Title of the system in water 5032 1LYS BB 1 12.684 20.847 24.704 -0.1973 0.0869 -0.2163 1LYS SC1 2 12.938 20.965 24.844 0.1081 0.1060 0.1668 1LYS SC2 3 13.267 20.981 24.926 -0.0670 -0.0024 0.2656 2LYS BB 4 12.481 20.741 24.970 -0.1067 0.2585 -0.0254 2LYS SC1 5 12.646 20.628 25.248 -0.0321 -0.1097 -0.0689 2LYS SC2 6 12.653 20.299 25.143 -0.1463 0.0339 0.1633 3CYS BB 7 12.279 20.917 25.120 0.1647 0.0011 0.3285 3CYS SC1 8 11.984 20.871 24.988 -0.0616 0.2022 0.0085 4LEU BB 9 12.158 21.254 25.075 0.1591 0.0092 0.0621 4LEU SC1 10 11.798 21.213 25.123 -0.3423 -0.5221 -0.2522 5PHE BB 11 12.327 21.482 25.077 -0.2942 -0.0667 -0.0978 5PHE SC1 12 12.279 21.604 25.365 0.1432 -0.1464 0.1167 5PHE SC2 13 11.950 21.521 25.376 0.0787 0.0783 -0.0504 5PHE SC3 14 12.125 21.349 25.530 -0.1290 0.0201 0.1264 6LYS BB 15 12.305 21.762 24.908 0.0020 -0.0366 0.1000 6LYS SC1 16 12.378 21.971 25.087 0.2252 -0.0804 0.0323 6LYS SC2 17 12.575 21.965 25.372 0.1172 0.1920 -0.0489 7LYS BB 18 12.394 21.800 24.557 -0.1651 -0.1200 0.1101 7LYS SC1 19 12.575 22.062 24.582 0.4054 -0.0700 -0.1464 7LYS SC2 20 12.626 22.378 24.406 -0.0403 0.2006 0.1128 8LYS BB 21 12.429 21.569 24.320 -0.2586 0.1414 0.1058 8LYS SC1 22 12.694 21.500 24.304 0.0236 0.1508 -0.1681 8LYS SC2 23 12.873 21.674 24.565 0.0659 -0.0301 0.2223 9ASN BB 24 12.259 21.271 24.270 -0.0029 0.3849 0.1348 9ASN SC1 25 12.511 21.053 24.337 0.1358 -0.1396 0.2415 10LYS BB 26 11.989 21.073 24.393 -0.3430 -0.1853 0.1254 10LYS SC1 27 11.900 20.964 24.153 -0.2069 0.1812 0.1653 10LYS SC2 28 11.735 20.866 23.886 0.0477 -0.2824 -0.2116 11LYS BB 29 11.874 21.115 24.693 0.0844 -0.0655 0.3213 11LYS SC1 30 11.757 20.832 24.720 0.0299 0.2512 -0.0305 11LYS SC2 31 11.840 20.566 24.800 -0.0904 0.1669 0.0808 12LYS BB 32 11.543 21.239 24.703 -0.0631 -0.1762 -0.3613 12LYS SC1 33 11.345 21.007 24.797 -0.3186 -0.0620 -0.2880 12LYS SC2 34 11.068 21.032 25.048 0.3636 -0.1819 0.1521 13GLY BB 35 11.395 21.366 24.389 0.1207 -0.3161 0.0635 14LYS BB 36 11.368 21.651 24.435 0.1731 -0.3115 -0.0223 14LYS SC1 37 11.468 21.708 24.750 -0.1222 -0.0219 0.1545 14LYS SC2 38 11.464 21.924 25.032 0.1397 0.2766 -0.0580 15GLU BB 39 11.192 21.925 24.359 0.3927 0.1647 -0.0443 15GLU SC1 40 10.863 21.690 24.382 -0.0784 -0.1299 0.3847 16LYS BB 41 11.258 22.053 24.104 0.1195 0.2426 0.0591 16LYS SC1 42 11.286 22.065 23.808 0.0123 0.1964 0.0767 16LYS SC2 43 11.475 22.186 23.552 0.1132 -0.1540 0.4487 17GLY BB 44 11.540 22.283 24.057 -0.0156 -0.1099 -0.0175 18GLY BB 45 11.815 22.242 23.886 0.0263 -0.2654 0.0020 19LYS BB 46 12.060 22.331 24.091 0.0302 -0.3050 0.0742 19LYS SC1 47 12.011 22.645 24.211 0.3916 0.1655 0.2310 19LYS SC2 48 11.951 23.019 24.250 -0.1755 -0.1715 0.1174 20ASN BB 49 12.228 22.085 24.071 -0.1038 -0.0063 -0.2167 20ASN SC1 50 12.071 21.918 24.254 0.0016 0.0459 -0.2586 21ALA BB 51 12.272 21.904 23.803 -0.0687 0.0922 -0.2003 21ALA SC1 52 12.104 21.909 23.591 -0.3929 -0.1487 0.0387 22ILE BB 53 12.473 21.573 23.816 -0.1185 -0.2266 0.0216 22ILE SC1 54 12.407 21.361 23.557 -0.4273 -0.0899 -0.0166 23ASN BB 55 12.779 21.535 23.699 -0.2494 -0.2239 -0.1472 23ASN SC1 56 12.935 21.372 23.964 -0.1992 0.0406 -0.1668 24MET BB 57 12.879 21.588 23.419 0.0296 0.0406 0.1040 24MET SC1 58 12.768 21.354 23.178 0.1585 0.2175 0.4242 25LYS BB 59 13.186 21.816 23.468 -0.1011 0.0615 0.0092 25LYS SC1 60 13.057 21.926 23.227 0.0711 -0.5700 0.2093 25LYS SC2 61 13.017 22.284 23.292 0.0433 0.0476 0.1173 26ASP BB 62 13.259 22.083 23.657 -0.0284 0.0637 0.0907 26ASP SC1 63 13.042 22.149 23.929 0.2387 -0.1776 -0.0878 27VAL BB 64 13.552 22.118 23.790 -0.3392 -0.1505 -0.3382 27VAL SC1 65 13.671 22.367 23.696 0.0538 -0.1599 0.0999 28LYS BB 66 13.748 21.987 24.020 0.2372 -0.3306 0.1257 28LYS SC1 67 13.653 21.691 24.157 -0.2594 0.1050 -0.0346 28LYS SC2 68 13.854 21.667 24.438 -0.3288 -0.2878 -0.0154 29ASP BB 69 14.067 21.828 24.021 0.0360 0.2737 -0.3040 29ASP SC1 70 14.326 22.014 24.035 -0.2456 0.3363 0.2393 30LEU BB 71 14.193 21.608 23.813 0.2493 -0.4556 -0.0085 30LEU SC1 72 14.333 21.283 23.863 -0.4270 -0.1773 -0.4479 31GLY BB 73 14.335 21.663 23.587 -0.2340 -0.0028 -0.2899 32LYS BB 74 14.354 21.749 23.275 -0.1410 0.2021 -0.1864 32LYS SC1 75 14.522 21.537 23.102 0.4224 0.2495 0.0862 32LYS SC2 76 14.442 21.373 22.800 0.4397 -0.1147 0.1509 33THR BB 77 14.111 21.706 23.072 -0.2416 -0.2117 -0.0385 33THR SC1 78 14.203 21.788 22.793 0.1902 -0.1609 0.1119 34MET BB 79 13.988 21.385 23.004 0.3040 0.0693 -0.2915 34MET SC1 80 13.967 21.336 22.626 -0.0898 0.3177 0.0833 35LYS BB 81 13.821 21.163 23.200 -0.2115 -0.0774 -0.0454 35LYS SC1 82 14.031 20.964 23.262 0.2622 0.3602 -0.1382 35LYS SC2 83 14.174 20.680 23.399 -0.0438 -0.0912 -0.0509 36ASP BB 84 13.562 21.254 23.362 -0.0957 -0.0070 0.3954 36ASP SC1 85 13.413 21.058 23.620 -0.0008 -0.1166 -0.0242 37GLN BB 86 13.274 21.362 23.249 -0.1129 0.0087 -0.3800 37GLN SC1 87 13.167 21.062 23.059 -0.2799 -0.1047 -0.4454 38ALA BB 88 13.229 21.613 22.996 -0.0204 0.1920 -0.0666 38ALA SC1 89 13.108 21.436 22.833 -0.0506 0.3281 -0.1931 39LEU BB 90 13.510 21.579 22.789 -0.3143 -0.1029 -0.4255 39LEU SC1 91 13.539 21.215 22.857 -0.1822 0.1019 -0.1532 40LYS BB 92 13.517 21.505 22.476 0.2090 -0.1617 -0.1542 40LYS SC1 93 13.365 21.291 22.494 0.1672 -0.2896 0.4642 40LYS SC2 94 13.292 21.077 22.255 -0.2776 0.3081 0.2051 41ASP BB 95 13.477 21.661 22.175 -0.3221 0.0589 -0.1420 41ASP SC1 96 13.470 21.403 22.007 -0.1927 0.0005 0.1882 42ASP BB 97 13.323 21.879 22.064 -0.0179 0.1814 -0.0201 42ASP SC1 98 12.967 21.916 22.143 -0.0804 -0.2644 0.1177 43ASP BB 99 13.427 22.067 21.788 -0.0346 -0.0169 0.0795 43ASP SC1 100 13.337 21.996 21.517 0.1948 -0.2548 -0.1187 44ALA BB 101 13.434 22.370 21.892 -0.0725 0.0733 -0.2064 44ALA SC1 102 13.267 22.480 22.073 -0.1962 -0.2576 -0.1112 45GLU BB 103 13.567 22.649 21.775 -0.0512 -0.3125 0.1019 45GLU SC1 104 13.481 22.786 21.413 -0.0037 0.1856 0.2768 46THR BB 105 13.649 22.931 21.979 0.0150 -0.1899 0.2404 46THR SC1 106 13.948 22.881 22.016 0.0797 0.0581 0.0733 47GLY BB 107 13.620 23.035 22.314 0.4093 0.4530 -0.2671 48LEU BB 108 13.907 22.903 22.459 0.0163 -0.2483 0.0580 48LEU SC1 109 14.092 23.029 22.735 0.1784 0.3601 0.1393 49THR BB 110 14.035 22.586 22.397 0.2503 -0.2525 -0.1192 49THR SC1 111 14.262 22.645 22.591 -0.0814 -0.1174 0.2445 50ASP BB 112 13.948 22.363 22.208 -0.1306 -0.0195 0.4312 50ASP SC1 113 13.670 22.194 22.214 -0.1357 0.2199 -0.0881 51GLY BB 114 13.899 22.421 21.930 -0.3314 0.0388 0.5089 52GLU BB 115 14.064 22.177 21.724 -0.2598 0.0877 0.0062 52GLU SC1 116 14.229 22.006 22.016 -0.3454 -0.1609 -0.0065 53GLU BB 117 14.268 22.199 21.480 -0.2201 -0.1358 -0.2521 53GLU SC1 118 14.116 22.368 21.262 -0.1831 0.1587 0.0181 54LYS BB 119 14.549 22.013 21.569 0.0982 0.2934 0.3248 54LYS SC1 120 14.611 22.173 21.826 0.1399 -0.2565 0.2175 54LYS SC2 121 14.703 22.133 22.114 0.0001 0.0789 -0.0418 55GLU BB 122 14.767 21.931 21.335 -0.3349 0.0163 0.0621 55GLU SC1 123 15.049 22.104 21.417 -0.1209 -0.2493 -0.1951 56GLU BB 124 14.802 21.622 21.410 -0.1522 0.2214 0.2235 56GLU SC1 125 14.477 21.501 21.207 -0.1627 -0.5300 0.0092 57PRO BB 126 14.965 21.577 21.692 -0.2544 -0.4885 0.0292 57PRO SC1 127 14.914 21.271 21.629 -0.0685 -0.0369 -0.1760 58LYS BB 128 15.274 21.430 21.760 0.0246 0.1188 0.2689 58LYS SC1 129 15.334 21.134 21.631 -0.1255 -0.2337 -0.0000 58LYS SC2 130 15.525 20.840 21.525 -0.1229 -0.2794 0.0530 59GLU BB 131 15.434 21.688 21.858 -0.0564 -0.2233 0.0277 59GLU SC1 132 15.670 21.708 21.566 -0.0057 0.1432 -0.1227 60GLU BB 133 15.446 21.756 22.192 0.3323 0.1681 -0.0367 60GLU SC1 134 15.362 21.423 22.371 0.1061 0.1012 0.4284 61GLU BB 135 15.451 21.996 22.418 0.1313 0.1841 0.1293 61GLU SC1 136 15.625 22.007 22.791 0.0946 0.2344 -0.0167 1LYS BB 137 21.321 16.234 17.068 -0.1076 -0.1186 -0.1417 1LYS SC1 138 21.498 16.313 16.764 -0.0515 0.3343 -0.1584 1LYS SC2 139 21.725 16.342 16.520 -0.0410 -0.3561 0.1560 2LYS BB 140 21.443 15.946 17.072 -0.2713 -0.0945 -0.0307 2LYS SC1 141 21.622 15.919 17.324 0.0094 0.1136 -0.1145 2LYS SC2 142 21.608 15.898 17.687 -0.0229 0.3284 -0.5273 3CYS BB 143 21.299 15.696 17.130 -0.3574 0.2586 0.2040 3CYS SC1 144 21.610 15.546 17.196 -0.2012 0.3785 -0.0559 4LEU BB 145 21.410 15.409 16.858 0.3306 -0.0360 -0.1847 4LEU SC1 146 21.717 15.518 16.775 0.1641 -0.0941 0.4007 5PHE BB 147 21.222 15.207 16.651 0.3490 -0.0869 0.2297 5PHE SC1 148 21.090 15.087 16.916 0.1027 0.0693 -0.1082 5PHE SC2 149 21.184 14.783 17.034 0.1686 0.1906 0.1605 5PHE SC3 150 21.337 15.007 17.134 -0.0245 0.3351 0.1411 6LYS BB 151 21.427 14.917 16.681 -0.3100 0.0025 -0.1338 6LYS SC1 152 21.703 14.972 16.827 0.0416 -0.0635 -0.4947 6LYS SC2 153 21.726 15.180 17.114 -0.2466 0.3472 0.1577 7LYS BB 154 21.222 14.671 16.607 -0.0063 -0.4020 -0.0088 7LYS SC1 155 20.938 14.852 16.567 0.5356 -0.5895 0.1339 7LYS SC2 156 20.812 15.077 16.320 0.0386 -0.3468 -0.2960 8LYS BB 157 21.420 14.473 16.367 0.0929 -0.0542 -0.0481 8LYS SC1 158 21.362 14.191 16.474 0.0258 -0.0659 0.0853 8LYS SC2 159 21.160 14.197 16.777 0.0015 -0.2401 0.5329 9ASN BB 160 21.752 14.521 16.408 0.3570 -0.3367 -0.2316 9ASN SC1 161 21.849 14.268 16.278 -0.0811 -0.3364 -0.1541 10LYS BB 162 21.981 14.467 16.669 -0.0766 -0.0746 0.2874 10LYS SC1 163 22.114 14.752 16.633 -0.4284 0.1941 -0.2718 10LYS SC2 164 22.336 14.868 16.412 -0.3071 0.5485 -0.1266 11LYS BB 165 21.969 14.223 16.841 0.3169 0.0582 -0.1296 11LYS SC1 166 21.903 14.289 17.162 0.0130 0.3395 0.1200 11LYS SC2 167 21.859 14.417 17.501 -0.1533 -0.0011 0.0300 12LYS BB 168 21.697 14.021 16.778 -0.1372 -0.3801 0.2260 12LYS SC1 169 21.698 13.971 16.480 -0.3110 0.0085 -0.1856 12LYS SC2 170 21.700 13.632 16.390 0.2492 0.0167 -0.2231 13GLY BB 171 21.442 13.858 16.950 0.4676 -0.1313 -0.0376 14LYS BB 172 21.491 13.632 17.168 0.0393 0.1042 0.0789 14LYS SC1 173 21.418 13.731 17.455 -0.1705 -0.1152 0.1830 14LYS SC2 174 21.208 13.974 17.618 -0.1329 0.1717 -0.1983 15GLU BB 175 21.616 13.264 17.044 -0.1743 -0.1731 -0.0782 15GLU SC1 176 21.446 13.341 16.716 -0.0121 0.0159 0.0090 16LYS BB 177 21.483 13.008 17.190 -0.0979 0.1586 0.2736 16LYS SC1 178 21.441 13.232 17.465 -0.1809 0.0138 -0.4163 16LYS SC2 179 21.549 13.124 17.752 -0.1560 -0.0726 -0.2713 17GLY BB 180 21.215 12.955 16.996 0.0363 -0.1431 0.0443 18GLY BB 181 20.886 12.952 16.996 -0.0447 -0.0585 -0.2278 19LYS BB 182 20.908 12.685 17.224 -0.0147 0.2119 0.0371 19LYS SC1 183 21.182 12.606 17.275 0.4134 -0.1899 0.3561 19LYS SC2 184 21.459 12.451 17.128 -0.0275 -0.0181 0.2139 20ASN BB 185 20.567 12.629 17.207 0.1844 -0.1042 0.2662 20ASN SC1 186 20.500 12.757 16.938 -0.3339 0.0014 -0.0589 21ALA BB 187 20.274 12.677 17.326 0.0677 -0.3497 -0.2324 21ALA SC1 188 20.344 12.937 17.316 0.0997 -0.3501 -0.0533 22ILE BB 189 20.165 12.613 17.639 0.1483 0.0693 -0.2200 22ILE SC1 190 20.140 12.933 17.753 -0.6177 -0.1003 0.1533 23ASN BB 191 20.194 12.267 17.575 0.0542 -0.0943 0.1879 23ASN SC1 192 20.512 12.302 17.517 -0.1052 0.0611 0.1672 24MET BB 193 20.031 12.007 17.502 0.1095 0.0245 0.1071 24MET SC1 194 19.768 11.973 17.813 0.4060 -0.1802 0.0661 25LYS BB 195 20.087 11.711 17.521 -0.0785 0.1441 0.0081 25LYS SC1 196 19.744 11.652 17.527 -0.0159 -0.0197 0.1264 25LYS SC2 197 19.483 11.455 17.452 0.5205 0.2151 -0.2590 26ASP BB 198 20.259 11.554 17.364 0.1475 0.2008 0.0244 26ASP SC1 199 20.546 11.568 17.553 0.0149 -0.0860 -0.0086 27VAL BB 200 20.203 11.209 17.352 -0.1364 -0.1729 -0.2200 27VAL SC1 201 20.149 11.162 17.069 -0.0122 0.2943 -0.3314 28LYS BB 202 20.567 11.078 17.473 -0.0014 -0.2213 -0.2659 28LYS SC1 203 20.686 11.159 17.744 0.1095 0.1370 0.0100 28LYS SC2 204 20.774 11.221 18.040 -0.2564 -0.0083 0.1608 29ASP BB 205 20.510 10.742 17.453 0.1440 0.1147 0.0046 29ASP SC1 206 20.625 10.662 17.139 0.1420 0.0727 -0.2342 30LEU BB 207 20.677 10.504 17.605 0.3029 0.2448 -0.3308 30LEU SC1 208 20.521 10.361 17.887 0.2783 -0.2231 0.1201 31GLY BB 209 21.028 10.509 17.514 -0.0139 -0.0190 0.0759 32LYS BB 210 21.257 10.358 17.772 -0.1055 -0.1527 -0.2310 32LYS SC1 211 21.345 10.629 17.733 -0.4050 -0.3482 -0.3003 32LYS SC2 212 21.368 10.832 18.014 -0.0389 0.3887 -0.0181 33THR BB 213 21.398 10.112 17.793 0.4009 0.0761 -0.1616 33THR SC1 214 21.550 10.062 18.053 -0.0367 -0.1191 0.0673 34MET BB 215 21.535 9.926 17.531 0.0907 0.2172 -0.1529 34MET SC1 216 21.875 10.027 17.726 0.0194 0.0091 0.2470 35LYS BB 217 21.387 9.670 17.511 -0.3414 -0.1163 0.2312 35LYS SC1 218 21.577 9.434 17.651 -0.1437 -0.2866 -0.0502 35LYS SC2 219 21.660 9.066 17.582 0.2440 -0.2202 0.1058 36ASP BB 220 21.075 9.479 17.553 0.2909 -0.0102 0.0311 36ASP SC1 221 21.224 9.262 17.391 0.1443 0.2928 0.1947 37GLN BB 222 20.802 9.651 17.526 -0.1849 0.0038 -0.1154 37GLN SC1 223 20.611 9.554 17.854 -0.0830 0.0625 0.2564 38ALA BB 224 20.472 9.616 17.385 0.3114 0.5086 -0.1362 38ALA SC1 225 20.413 9.375 17.278 0.0952 0.4448 0.1174 39LEU BB 226 20.556 9.831 17.134 0.0227 0.1734 -0.2731 39LEU SC1 227 20.233 9.911 17.036 -0.2201 -0.3356 0.1448 40LYS BB 228 20.835 9.868 17.005 -0.0379 0.1371 -0.0488 40LYS SC1 229 20.722 9.862 16.688 0.3288 0.0491 0.0313 40LYS SC2 230 20.809 9.828 16.372 -0.1503 -0.0904 -0.0884 41ASP BB 231 21.087 9.894 17.197 -0.2740 -0.1031 0.0949 41ASP SC1 232 20.990 10.085 17.443 0.1896 0.0456 0.0213 42ASP BB 233 21.311 9.998 17.010 -0.0899 -0.2202 -0.1356 42ASP SC1 234 21.178 10.003 16.690 0.1644 -0.0649 0.0588 43ASP BB 235 21.602 9.790 17.011 -0.2002 -0.1272 0.0229 43ASP SC1 236 21.861 9.913 16.762 -0.0097 0.4278 -0.3297 44ALA BB 237 21.579 9.550 16.812 0.0473 -0.1924 0.0493 44ALA SC1 238 21.813 9.445 16.898 0.1233 -0.0153 0.0639 45GLU BB 239 21.590 9.590 16.502 -0.1295 0.0812 0.1203 45GLU SC1 240 21.712 9.252 16.274 0.0361 0.2036 0.1262 46THR BB 241 21.352 9.634 16.213 -0.1493 -0.1448 -0.2910 46THR SC1 242 21.236 9.916 16.222 -0.1939 -0.1703 0.2415 47GLY BB 243 21.043 9.562 16.146 0.1952 -0.2942 0.4166 48LEU BB 244 20.859 9.575 15.866 0.1068 -0.4734 -0.1174 48LEU SC1 245 21.198 9.580 15.738 -0.2544 0.1799 0.2174 49THR BB 246 20.615 9.404 15.991 0.1492 -0.2705 0.1936 49THR SC1 247 20.352 9.478 16.128 -0.0090 -0.1659 -0.1535 50ASP BB 248 20.691 9.252 16.217 -0.0818 0.1753 -0.0322 50ASP SC1 249 20.656 9.481 16.467 0.0482 -0.2451 0.0998 51GLY BB 250 20.681 8.949 16.288 -0.2374 0.0464 -0.1422 52GLU BB 251 20.674 8.660 16.114 -0.1648 -0.1689 0.4202 52GLU SC1 252 20.785 8.336 16.358 -0.1837 0.1871 0.1438 53GLU BB 253 20.399 8.741 15.997 -0.0750 0.0122 -0.0643 53GLU SC1 254 20.198 8.575 16.314 -0.1180 0.0352 -0.0789 54LYS BB 255 20.285 9.023 15.994 0.0936 -0.0239 -0.0671 54LYS SC1 256 20.255 9.065 16.275 0.1643 0.4271 -0.1360 54LYS SC2 257 20.375 9.139 16.571 0.0428 0.2654 -0.2938 55GLU BB 258 20.084 9.193 15.898 0.0705 0.1460 0.2564 55GLU SC1 259 20.188 9.259 15.534 0.1819 0.0037 0.2162 56GLU BB 260 19.800 9.141 15.807 0.2386 0.1513 -0.2192 56GLU SC1 261 19.595 9.319 16.100 -0.4261 -0.0787 0.1872 57PRO BB 262 19.708 9.086 15.500 -0.1612 0.2698 0.0657 57PRO SC1 263 19.425 8.996 15.598 0.1638 -0.1853 -0.1947 58LYS BB 264 19.785 9.219 15.182 0.3347 0.0185 -0.0614 58LYS SC1 265 19.472 9.082 15.165 0.0083 0.1914 0.0025 58LYS SC2 266 19.240 8.968 14.917 0.2430 0.3477 0.0016 59GLU BB 267 19.922 9.462 15.003 0.0273 0.0510 -0.0550 59GLU SC1 268 20.085 9.251 14.732 -0.1506 -0.0488 -0.0370 60GLU BB 269 19.819 9.776 15.087 0.2280 0.0804 0.2125 60GLU SC1 270 20.076 10.118 15.091 -0.2607 -0.2278 -0.2239 61GLU BB 271 19.630 9.787 15.305 -0.0888 0.2607 0.1843 61GLU SC1 272 19.716 10.044 15.561 0.0104 -0.1782 0.2600 1LYS BB 273 24.256 11.464 16.826 0.0577 0.1066 -0.3404 1LYS SC1 274 24.483 11.429 16.594 -0.0702 0.1044 0.5499 1LYS SC2 275 24.858 11.334 16.598 -0.1018 0.2487 -0.5802 2LYS BB 276 24.014 11.421 16.639 0.0493 -0.0703 0.0739 2LYS SC1 277 23.699 11.616 16.657 -0.0714 0.0095 -0.0688 2LYS SC2 278 23.526 11.832 16.912 -0.1072 0.1350 0.0114 3CYS BB 279 24.001 11.172 16.386 -0.1777 0.2621 -0.3116 3CYS SC1 280 24.259 11.027 16.488 0.3314 0.3796 -0.1266 4LEU BB 281 24.012 11.264 16.079 -0.0319 -0.1111 -0.1516 4LEU SC1 282 24.252 11.129 15.937 -0.1906 0.1162 0.1556 5PHE BB 283 23.864 11.427 15.850 0.1498 0.1261 0.0918 5PHE SC1 284 23.716 11.651 16.023 0.0953 -0.1532 0.1015 5PHE SC2 285 23.917 11.617 16.295 0.0437 -0.0507 0.1527 5PHE SC3 286 23.892 11.888 16.193 0.1878 -0.1116 -0.0499 6LYS BB 287 23.600 11.246 15.764 0.1081 -0.1834 0.2393 6LYS SC1 288 23.749 11.094 15.544 0.1446 0.2551 -0.1088 6LYS SC2 289 23.770 10.759 15.430 0.2999 -0.0592 0.0034 7LYS BB 290 23.309 11.206 15.916 0.3275 -0.0449 0.1839 7LYS SC1 291 23.210 11.495 16.027 0.0604 0.1824 0.0947 7LYS SC2 292 23.285 11.817 16.053 0.1342 -0.3111 -0.1128 8LYS BB 293 23.213 10.929 15.824 0.0137 0.1902 0.3264 8LYS SC1 294 23.035 10.859 15.552 -0.2948 0.1565 0.0428 8LYS SC2 295 22.836 10.948 15.268 0.3358 -0.3060 0.1309 9ASN BB 296 23.486 10.747 15.774 -0.0713 -0.0189 -0.2543 9ASN SC1 297 23.403 10.570 15.567 0.0710 -0.0357 -0.1971 10LYS BB 298 23.472 10.465 15.990 -0.2122 -0.1879 0.2052 10LYS SC1 299 23.768 10.457 15.975 0.0556 0.0399 0.0734 10LYS SC2 300 24.136 10.418 15.973 0.0350 0.0968 0.2376 11LYS BB 301 23.376 10.361 16.229 0.0835 0.0342 -0.1212 11LYS SC1 302 23.582 10.375 16.465 -0.0336 -0.1333 -0.3176 11LYS SC2 303 23.813 10.475 16.709 -0.1166 -0.1668 0.1186 12LYS BB 304 23.312 10.057 16.399 0.0889 -0.0339 0.3548 12LYS SC1 305 23.504 9.804 16.345 0.2064 0.3762 -0.6243 12LYS SC2 306 23.641 9.550 16.572 0.0713 0.2253 -0.0196 13GLY BB 307 23.017 9.968 16.426 0.2288 -0.1092 0.0387 14LYS BB 308 22.833 9.860 16.727 0.2114 -0.2116 -0.1472 14LYS SC1 309 22.642 10.160 16.596 0.3835 -0.0603 -0.3414 14LYS SC2 310 22.503 10.468 16.660 -0.2664 0.1380 0.0880 15GLU BB 311 22.901 9.507 16.759 -0.2037 0.0349 0.2162 15GLU SC1 312 23.198 9.442 16.521 -0.4839 -0.1327 0.0462 16LYS BB 313 22.574 9.394 16.639 -0.2839 0.2464 0.1474 16LYS SC1 314 22.409 9.637 16.704 -0.0551 0.0348 0.1560 16LYS SC2 315 22.310 9.938 16.754 0.1832 -0.3196 0.0039 17GLY BB 316 22.442 9.286 16.334 0.1936 0.1692 -0.1131 18GLY BB 317 22.514 9.219 16.046 0.3235 0.3074 -0.0406 19LYS BB 318 22.795 9.169 15.843 0.1202 0.0356 -0.2658 19LYS SC1 319 22.936 9.369 16.010 -0.2384 -0.2026 -0.4125 19LYS SC2 320 22.857 9.515 16.268 0.1965 0.0025 -0.3497 20ASN BB 321 22.918 9.334 15.551 0.1729 -0.2471 -0.3370 20ASN SC1 322 23.151 9.576 15.694 0.0570 0.2373 0.0367 21ALA BB 323 22.831 9.074 15.343 -0.0573 -0.1014 0.1972 21ALA SC1 324 23.039 9.124 15.177 -0.0189 -0.0096 0.2719 22ILE BB 325 22.809 8.755 15.538 0.0117 -0.1675 0.0760 22ILE SC1 326 22.543 8.567 15.437 -0.0017 -0.1310 0.0435 23ASN BB 327 23.069 8.669 15.732 -0.1998 0.1354 -0.0417 23ASN SC1 328 22.998 8.319 15.736 -0.3772 -0.3376 0.2777 24MET BB 329 23.379 8.678 15.758 -0.0747 -0.1304 0.5546 24MET SC1 330 23.519 8.676 16.084 -0.2274 -0.0745 -0.1482 25LYS BB 331 23.568 8.695 15.444 0.0323 -0.1567 0.0120 25LYS SC1 332 23.778 8.908 15.635 -0.2578 -0.0669 0.1291 25LYS SC2 333 24.167 9.039 15.606 0.1662 0.2670 -0.0564 26ASP BB 334 23.845 8.488 15.475 -0.0340 -0.0004 0.0220 26ASP SC1 335 23.719 8.394 15.767 -0.0487 -0.1051 -0.1642 27VAL BB 336 23.979 8.240 15.388 0.2140 -0.5480 0.1281 27VAL SC1 337 24.257 8.330 15.391 0.0310 0.0546 0.2027 28LYS BB 338 23.790 8.053 15.233 -0.0334 0.2136 0.4172 28LYS SC1 339 23.587 8.129 15.016 -0.0661 -0.4615 0.0965 28LYS SC2 340 23.273 7.976 15.080 0.0157 -0.3857 -0.0428 29ASP BB 341 23.871 7.770 15.056 -0.0229 0.1736 0.0416 29ASP SC1 342 23.570 7.633 14.920 -0.1518 0.2680 -0.2428 30LEU BB 343 24.030 7.559 15.233 0.1330 0.1712 -0.1042 30LEU SC1 344 24.261 7.345 15.025 -0.0242 -0.2051 -0.1008 31GLY BB 345 24.294 7.546 15.445 -0.1569 0.1743 0.2299 32LYS BB 346 24.438 7.282 15.412 0.0613 -0.0575 0.1611 32LYS SC1 347 24.380 7.006 15.320 -0.1812 -0.2950 -0.0085 32LYS SC2 348 24.589 6.819 15.200 -0.0120 -0.0405 0.0862 33THR BB 349 24.778 7.242 15.377 0.1660 0.1422 0.1912 33THR SC1 350 24.849 7.166 15.090 0.1538 0.1836 0.1772 34MET BB 351 24.931 7.272 15.685 0.3000 0.0741 -0.1536 34MET SC1 352 25.105 7.133 15.996 -0.3078 0.0431 0.0735 35LYS BB 353 24.892 7.594 15.813 -0.1002 -0.1554 -0.1877 35LYS SC1 354 24.846 7.554 16.123 0.1917 -0.0210 -0.4684 35LYS SC2 355 24.610 7.594 16.452 -0.0929 -0.0504 0.1112 36ASP BB 356 24.950 7.795 15.583 0.1063 -0.2039 -0.2150 36ASP SC1 357 24.746 7.689 15.377 0.1149 0.0818 -0.0834 37GLN BB 358 25.177 7.933 15.396 -0.0090 -0.1146 -0.3172 37GLN SC1 359 25.159 7.832 15.012 -0.2053 0.3890 0.2461 38ALA BB 360 25.166 8.237 15.347 -0.0388 -0.1539 0.5483 38ALA SC1 361 25.419 8.293 15.272 -0.1246 -0.3749 0.0563 39LEU BB 362 25.090 8.349 15.038 0.0796 0.0035 0.1156 39LEU SC1 363 25.401 8.242 14.904 -0.4616 -0.2267 0.0493 40LYS BB 364 25.056 8.652 14.919 0.0895 0.3593 -0.2251 40LYS SC1 365 25.364 8.681 14.861 -0.0950 0.0203 0.2301 40LYS SC2 366 25.531 9.005 14.888 -0.3740 -0.3750 -0.2724 41ASP BB 367 24.832 8.785 14.755 0.0822 -0.1735 0.1372 41ASP SC1 368 24.675 8.517 14.552 -0.0180 -0.4991 -0.1046 42ASP BB 369 24.621 8.963 14.928 0.1393 0.0037 0.1056 42ASP SC1 370 24.758 8.906 15.202 0.1860 0.1497 0.0949 43ASP BB 371 24.689 9.265 14.815 -0.1299 0.1478 -0.0768 43ASP SC1 372 24.409 9.362 14.689 -0.0579 -0.0109 -0.3838 44ALA BB 373 24.884 9.334 14.556 0.0073 -0.2011 -0.2799 44ALA SC1 374 24.799 9.128 14.403 0.1690 -0.2334 -0.3276 45GLU BB 375 25.170 9.507 14.616 -0.3441 0.2768 -0.0861 45GLU SC1 376 25.028 9.648 14.989 -0.0697 -0.0387 0.0005 46THR BB 377 25.335 9.753 14.581 0.1824 -0.1477 -0.6231 46THR SC1 378 25.120 9.966 14.623 0.3206 -0.0870 -0.1729 47GLY BB 379 25.435 9.788 14.267 -0.0268 -0.3810 -0.1827 48LEU BB 380 25.431 9.587 14.010 0.0641 -0.1057 -0.1110 48LEU SC1 381 25.407 9.298 14.229 0.2096 0.2129 0.0768 49THR BB 382 25.215 9.584 13.802 -0.1127 0.0176 -0.1226 49THR SC1 383 25.381 9.517 13.555 0.0933 0.3707 -0.0871 50ASP BB 384 24.893 9.625 13.740 -0.0555 -0.0582 0.0994 50ASP SC1 385 24.656 9.380 13.742 -0.1616 -0.2103 0.3712 51GLY BB 386 24.884 9.813 13.538 0.0814 -0.0128 0.2847 52GLU BB 387 25.165 9.937 13.514 -0.1707 -0.3946 0.0417 52GLU SC1 388 25.011 10.239 13.740 -0.1148 0.2477 -0.2899 53GLU BB 389 25.295 9.805 13.272 -0.1140 0.1193 -0.1081 53GLU SC1 390 25.586 9.961 13.070 -0.2276 -0.0912 0.0611 54LYS BB 391 25.019 9.671 13.139 -0.0288 0.0661 -0.2228 54LYS SC1 392 25.095 9.564 12.834 0.0285 0.1687 -0.6257 54LYS SC2 393 25.298 9.649 12.654 -0.0409 -0.0379 0.1519 55GLU BB 394 24.769 9.877 13.121 -0.0173 0.1219 0.2724 55GLU SC1 395 24.964 10.237 13.090 0.2135 0.1993 -0.2421 56GLU BB 396 24.499 9.775 13.052 0.0048 0.0637 0.1753 56GLU SC1 397 24.242 9.934 13.220 -0.0349 0.1055 -0.0704 57PRO BB 398 24.384 9.527 12.864 0.0294 -0.0405 -0.0440 57PRO SC1 399 24.604 9.488 12.642 -0.2028 -0.2558 0.1985 58LYS BB 400 24.303 9.206 12.913 0.1474 -0.0972 -0.0094 58LYS SC1 401 24.498 8.921 12.967 -0.2588 -0.1216 0.2128 58LYS SC2 402 24.643 8.605 12.835 -0.0602 0.3253 0.0118 59GLU BB 403 24.026 9.095 12.849 -0.1430 -0.2265 -0.1664 59GLU SC1 404 23.778 9.246 13.153 -0.4064 0.0104 0.1040 60GLU BB 405 23.929 8.871 12.576 0.1658 -0.0361 0.1976 60GLU SC1 406 24.192 8.618 12.731 0.3144 0.1028 0.2216 61GLU BB 407 24.095 8.896 12.292 -0.2642 0.1070 -0.0529 61GLU SC1 408 23.961 8.803 11.899 -0.1879 -0.2254 0.1238 1LYS BB 409 1.549 23.304 11.588 0.1528 0.0210 0.2154 1LYS SC1 410 1.601 22.983 11.600 0.0138 -0.3283 -0.1394 1LYS SC2 411 1.566 22.617 11.549 0.1305 0.1009 -0.2635 2LYS BB 412 1.365 23.579 11.492 -0.1638 0.0713 -0.1115 2LYS SC1 413 1.333 23.683 11.193 -0.1707 0.3193 -0.2125 2LYS SC2 414 1.158 23.773 10.965 0.0541 0.0051 -0.3870 3CYS BB 415 1.075 23.655 11.700 -0.1090 0.0912 -0.2196 3CYS SC1 416 1.205 23.941 11.780 0.3903 -0.1489 0.0274 4LEU BB 417 0.771 23.465 11.673 -0.2164 -0.0696 -0.0808 4LEU SC1 418 0.709 23.721 11.450 0.0253 0.1203 -0.0815 5PHE BB 419 0.698 23.414 11.966 -0.0545 -0.1768 0.0787 5PHE SC1 420 0.383 23.349 11.992 0.1102 -0.1264 -0.2653 5PHE SC2 421 0.313 23.018 12.024 0.0769 -0.0914 0.0585 5PHE SC3 422 0.181 23.192 12.216 0.3028 0.0798 0.0633 6LYS BB 423 0.880 23.517 12.232 -0.0094 0.0927 -0.0786 6LYS SC1 424 1.088 23.704 12.129 0.0815 0.0144 0.1358 6LYS SC2 425 1.174 24.065 12.161 0.0342 0.2278 -0.3807 7LYS BB 426 0.797 23.528 12.556 0.1024 0.2718 -0.1111 7LYS SC1 427 0.685 23.779 12.720 0.0756 -0.0105 0.4088 7LYS SC2 428 0.408 23.966 12.629 -0.1971 -0.2699 -0.0744 8LYS BB 429 0.908 23.330 12.738 0.1841 0.3284 0.0036 8LYS SC1 430 0.971 23.065 12.602 -0.2718 -0.3267 0.0861 8LYS SC2 431 1.099 22.962 12.265 0.1823 0.1520 -0.0382 9ASN BB 432 1.268 23.360 12.820 0.2746 0.2265 -0.1389 9ASN SC1 433 1.252 23.029 12.892 -0.3171 -0.0484 0.1177 10LYS BB 434 1.423 23.532 13.095 0.0402 0.1630 -0.1040 10LYS SC1 435 1.543 23.750 12.929 0.4310 0.0762 0.2243 10LYS SC2 436 1.792 23.866 12.723 0.3154 0.1577 0.2897 11LYS BB 437 1.364 23.437 13.403 0.0566 -0.1450 0.1639 11LYS SC1 438 1.554 23.270 13.593 0.0742 0.1151 -0.0556 11LYS SC2 439 1.756 23.023 13.621 0.3578 0.0166 -0.1154 12LYS BB 440 1.168 23.545 13.688 0.1136 0.3388 -0.4003 12LYS SC1 441 1.070 23.260 13.733 0.1130 -0.0110 0.1130 12LYS SC2 442 0.907 23.033 13.986 0.2661 -0.1915 -0.1612 13GLY BB 443 0.911 23.646 13.536 0.0872 0.3191 0.2290 14LYS BB 444 0.588 23.530 13.507 0.3060 0.1086 0.3968 14LYS SC1 445 0.473 23.848 13.547 -0.0099 -0.2886 0.1728 14LYS SC2 446 0.461 24.106 13.798 0.1260 0.3333 -0.1706 15GLU BB 447 0.656 23.216 13.528 -0.0212 0.2585 0.0216 15GLU SC1 448 0.642 23.388 13.936 -0.0576 -0.2653 -0.1294 16LYS BB 449 0.438 23.033 13.353 0.0052 0.0737 0.2788 16LYS SC1 450 0.243 23.254 13.293 0.2719 0.1221 0.3276 16LYS SC2 451 0.064 23.416 13.048 -0.0303 -0.1567 0.0246 17GLY BB 452 0.510 22.726 13.251 0.1472 0.0903 -0.0821 18GLY BB 453 0.313 22.500 13.441 0.0750 -0.3378 -0.0720 19LYS BB 454 0.418 22.246 13.685 0.0712 0.1755 -0.0876 19LYS SC1 455 0.391 21.999 13.486 -0.3622 0.2642 0.1064 19LYS SC2 456 0.510 21.796 13.177 0.2442 -0.0257 -0.2523 20ASN BB 457 0.745 22.300 13.706 0.3212 0.0108 -0.1751 20ASN SC1 458 0.833 22.315 13.381 0.1479 0.0568 -0.0713 21ALA BB 459 0.826 22.078 13.954 0.1985 -0.2398 -0.3279 21ALA SC1 460 0.850 22.234 14.173 0.0733 -0.0634 -0.4381 22ILE BB 461 1.192 22.099 14.079 0.0603 0.1628 0.0708 22ILE SC1 462 1.199 21.850 14.312 -0.0691 -0.1828 -0.2819 23ASN BB 463 1.379 22.327 14.235 -0.2788 0.7312 0.0162 23ASN SC1 464 1.736 22.306 14.137 0.2338 -0.2300 0.1124 24MET BB 465 1.479 22.365 14.566 0.6022 -0.2431 -0.0995 24MET SC1 466 1.226 22.061 14.688 0.0492 -0.2352 -0.0960 25LYS BB 467 1.301 22.535 14.776 -0.6264 0.1312 0.0433 25LYS SC1 468 1.482 22.805 14.664 0.2130 -0.1048 -0.0829 25LYS SC2 469 1.756 23.010 14.638 0.2265 -0.0613 0.3477 26ASP BB 470 1.320 22.646 15.105 -0.0967 0.0795 0.0383 26ASP SC1 471 1.047 22.831 15.168 -0.1540 -0.1049 -0.1765 27VAL BB 472 1.627 22.758 15.213 -0.0428 -0.0379 -0.4923 27VAL SC1 473 1.770 22.652 14.982 0.0782 -0.4965 -0.2193 28LYS BB 474 1.683 22.584 15.508 0.1439 0.1272 -0.0269 28LYS SC1 475 1.445 22.348 15.518 -0.3033 -0.4884 0.3410 28LYS SC2 476 1.120 22.172 15.607 0.0272 0.0929 0.0756 29ASP BB 477 1.801 22.794 15.748 -0.0157 0.1518 -0.0440 29ASP SC1 478 2.094 22.752 15.915 0.1203 0.2502 -0.2821 30LEU BB 479 1.568 22.778 15.949 -0.0688 -0.2092 -0.0682 30LEU SC1 480 1.550 22.441 15.913 0.3402 -0.1406 -0.0144 31GLY BB 481 1.720 22.791 16.242 -0.0121 0.3240 0.3111 32LYS BB 482 1.990 22.920 16.355 0.1033 -0.1722 0.2005 32LYS SC1 483 2.272 22.809 16.360 -0.1837 -0.3493 0.0064 32LYS SC2 484 2.541 22.963 16.450 0.0280 -0.0883 0.3758 33THR BB 485 1.991 23.159 16.152 0.0709 -0.4936 0.0903 33THR SC1 486 2.152 23.343 16.333 -0.2872 0.0838 -0.1500 34MET BB 487 2.154 23.258 15.889 0.1582 -0.2361 0.1164 34MET SC1 488 2.470 23.052 15.972 -0.1939 -0.0584 -0.4368 35LYS BB 489 2.100 23.132 15.564 0.2114 -0.0012 0.3106 35LYS SC1 490 2.205 23.315 15.324 -0.1629 -0.1693 0.1880 35LYS SC2 491 2.044 23.493 15.100 0.3122 0.1056 0.1409 36ASP BB 492 1.809 23.130 15.339 0.2606 0.0326 -0.0094 36ASP SC1 493 1.912 23.099 15.009 0.2023 0.1499 -0.2118 37GLN BB 494 1.635 23.415 15.414 -0.0022 0.0076 0.1236 37GLN SC1 495 1.304 23.464 15.309 -0.0855 0.3551 -0.0690 38ALA BB 496 1.774 23.621 15.615 -0.0036 -0.3360 0.0892 38ALA SC1 497 1.589 23.817 15.598 0.3625 0.0301 0.1779 39LEU BB 498 1.766 23.674 15.927 -0.0961 -0.0678 -0.0683 39LEU SC1 499 2.117 23.716 15.946 0.0468 -0.0417 -0.0234 40LYS BB 500 1.764 24.013 16.024 -0.0698 -0.1465 -0.1791 40LYS SC1 501 2.023 24.106 16.171 0.1452 0.1968 0.0561 40LYS SC2 502 2.372 24.278 16.205 -0.4354 -0.1771 0.3520 41ASP BB 503 1.407 24.009 16.091 0.1250 -0.1015 0.1125 41ASP SC1 504 1.247 24.326 16.093 0.1032 0.3410 0.0898 42ASP BB 505 1.406 23.735 16.301 0.1262 0.2934 0.0460 42ASP SC1 506 1.739 23.616 16.359 -0.3850 0.3609 -0.0802 43ASP BB 507 1.219 23.495 16.418 0.2844 -0.2107 -0.0194 43ASP SC1 508 1.028 23.711 16.636 0.0550 -0.2095 0.3161 44ALA BB 509 1.371 23.439 16.713 -0.4437 -0.1551 0.1620 44ALA SC1 510 1.355 23.244 16.900 -0.1499 -0.1294 0.2189 45GLU BB 511 1.610 23.589 16.863 0.2644 -0.2689 0.2091 45GLU SC1 512 1.863 23.283 16.957 0.0102 0.2252 -0.1662 46THR BB 513 1.383 23.820 16.948 -0.1128 0.0454 0.1754 46THR SC1 514 1.381 23.964 16.679 0.2792 -0.1033 0.0866 47GLY BB 515 1.138 23.713 17.124 0.0602 0.2268 -0.0856 48LEU BB 516 0.914 23.715 17.348 0.0664 -0.1788 -0.2211 48LEU SC1 517 0.653 23.736 17.114 0.1618 0.4084 0.1784 49THR BB 518 1.117 23.516 17.565 0.1590 0.0753 0.3407 49THR SC1 519 1.068 23.215 17.559 0.3226 0.0506 -0.0276 50ASP BB 520 1.134 23.669 17.836 -0.0145 0.2634 -0.0189 50ASP SC1 521 1.036 23.426 18.067 0.0274 0.0495 -0.2324 51GLY BB 522 0.844 23.835 17.807 -0.3467 -0.0135 -0.0007 52GLU BB 523 0.531 23.787 17.655 -0.0897 -0.0126 -0.4410 52GLU SC1 524 0.375 23.530 17.827 -0.3134 -0.0893 -0.0232 53GLU BB 525 0.551 23.992 17.497 0.2478 -0.1194 -0.0205 53GLU SC1 526 0.137 24.082 17.411 -0.2235 -0.0734 -0.2001 54LYS BB 527 0.713 24.266 17.487 -0.0972 -0.1042 0.0264 54LYS SC1 528 0.980 24.199 17.372 0.1314 -0.1806 -0.2950 54LYS SC2 529 1.282 24.180 17.215 0.2096 -0.1030 -0.0636 55GLU BB 530 0.514 24.517 17.546 0.4562 -0.1825 0.1574 55GLU SC1 531 0.673 24.857 17.468 -0.1103 0.2639 -0.1156 56GLU BB 532 0.304 24.474 17.759 0.0612 0.0119 0.1296 56GLU SC1 533 0.353 24.582 18.134 0.3143 0.0211 0.1680 57PRO BB 534 -0.009 24.527 17.707 0.1775 -0.0702 0.0896 57PRO SC1 535 -0.130 24.316 17.899 -0.4074 0.1131 -0.0599 58LYS BB 536 -0.192 24.459 17.464 -0.1952 -0.3343 0.0503 58LYS SC1 537 -0.438 24.343 17.563 0.0041 -0.1431 0.2358 58LYS SC2 538 -0.744 24.232 17.627 -0.2448 0.4790 0.0909 59GLU BB 539 -0.352 24.638 17.229 -0.2948 0.2470 0.0816 59GLU SC1 540 -0.144 24.819 16.945 -0.0226 -0.0554 0.4295 60GLU BB 541 -0.670 24.649 17.262 -0.0658 0.2129 -0.4441 60GLU SC1 542 -0.776 24.327 17.094 0.0802 -0.1029 -0.0383 61GLU BB 543 -0.792 24.920 17.374 0.2992 -0.2934 0.1662 61GLU SC1 544 -0.477 25.112 17.408 0.0757 -0.1005 -0.1400 1LYS BB 545 19.018 18.047 24.941 0.2774 0.0071 0.0372 1LYS SC1 546 19.245 17.885 24.780 -0.2542 -0.1577 -0.1730 1LYS SC2 547 19.486 17.628 24.665 -0.1552 0.4338 -0.5738 2LYS BB 548 18.715 18.023 24.854 -0.1342 -0.0979 -0.0623 2LYS SC1 549 18.450 18.020 25.052 -0.2103 -0.0357 0.1357 2LYS SC2 550 18.122 18.092 25.128 -0.1211 -0.0742 0.0938 3CYS BB 551 18.588 18.143 24.612 0.0880 -0.1113 0.0148 3CYS SC1 552 18.264 18.136 24.731 -0.0069 0.0713 -0.0402 4LEU BB 553 18.472 17.938 24.412 -0.1614 0.0067 -0.0027 4LEU SC1 554 18.727 17.988 24.151 -0.5521 -0.0476 0.0167 5PHE BB 555 18.281 17.964 24.194 0.1960 0.1020 0.2622 5PHE SC1 556 18.420 17.930 23.868 0.1738 -0.1205 0.1176 5PHE SC2 557 18.397 17.999 23.536 -0.1243 0.0997 0.1797 5PHE SC3 558 18.313 17.732 23.613 0.4512 -0.1438 0.0161 6LYS BB 559 18.060 17.753 24.097 0.3340 0.1420 -0.1101 6LYS SC1 560 18.182 17.583 23.895 -0.1626 -0.0181 0.0715 6LYS SC2 561 18.097 17.262 23.717 0.1987 -0.3593 -0.0037 7LYS BB 562 17.942 17.708 24.400 0.1413 -0.0295 0.2927 7LYS SC1 563 18.223 17.566 24.420 0.1643 -0.0780 -0.1639 7LYS SC2 564 18.404 17.364 24.570 -0.0247 0.3623 -0.0186 8LYS BB 565 17.845 17.501 24.643 -0.3408 -0.2373 0.0098 8LYS SC1 566 17.550 17.503 24.443 0.0063 -0.1418 0.0989 8LYS SC2 567 17.384 17.668 24.201 -0.1861 -0.0478 0.2897 9ASN BB 568 17.963 17.249 24.718 0.1693 0.0406 -0.1485 9ASN SC1 569 18.184 17.242 24.986 -0.0109 -0.3772 -0.1887 10LYS BB 570 17.793 17.048 24.491 -0.0011 -0.3277 0.3191 10LYS SC1 571 17.566 17.070 24.616 0.1625 0.1730 0.0085 10LYS SC2 572 17.324 16.935 24.782 0.1161 -0.2075 -0.3759 11LYS BB 573 17.847 16.773 24.422 -0.0756 -0.2100 -0.3157 11LYS SC1 574 17.764 16.624 24.649 -0.4310 -0.3997 -0.1296 11LYS SC2 575 17.847 16.455 24.956 0.1662 0.1493 -0.0884 12LYS BB 576 18.063 16.738 24.188 -0.1612 0.0694 -0.0239 12LYS SC1 577 18.341 16.578 24.286 -0.1797 0.1502 -0.0799 12LYS SC2 578 18.480 16.392 24.555 0.2387 0.2036 0.1353 13GLY BB 579 17.995 16.726 23.892 0.2261 0.4540 0.2488 14LYS BB 580 17.795 16.520 23.669 0.2268 -0.1432 -0.1766 14LYS SC1 581 17.511 16.475 23.832 -0.0080 -0.1133 -0.0153 14LYS SC2 582 17.474 16.132 23.884 -0.2168 0.1338 -0.2264 15GLU BB 583 17.553 16.517 23.422 0.2857 -0.2871 0.2183 15GLU SC1 584 17.674 16.115 23.413 0.3758 -0.1405 -0.0497 16LYS BB 585 17.396 16.806 23.398 0.5454 -0.1300 -0.2512 16LYS SC1 586 17.309 16.902 23.676 0.4096 -0.4880 -0.2128 16LYS SC2 587 17.064 16.862 23.939 -0.0515 -0.0621 -0.0837 17GLY BB 588 17.387 17.077 23.194 0.1219 -0.0202 -0.4474 18GLY BB 589 17.098 17.125 23.035 -0.3703 -0.0352 -0.5066 19LYS BB 590 17.033 17.137 22.771 -0.1598 0.1696 -0.2145 19LYS SC1 591 17.070 17.450 22.774 -0.2574 -0.2656 -0.3568 19LYS SC2 592 17.196 17.640 23.030 -0.0504 0.3801 -0.1644 20ASN BB 593 16.889 16.968 22.579 -0.1889 0.2168 0.1178 20ASN SC1 594 16.807 16.674 22.711 0.1863 -0.0674 0.0455 21ALA BB 595 16.928 16.786 22.275 -0.1266 -0.0220 0.0129 21ALA SC1 596 17.192 16.776 22.218 -0.1428 -0.2407 -0.0327 22ILE BB 597 16.840 16.752 21.937 0.0058 0.0634 0.1909 22ILE SC1 598 16.612 16.504 21.880 0.2492 -0.0827 -0.1771 23ASN BB 599 16.965 16.779 21.628 -0.2622 -0.2653 -0.0004 23ASN SC1 600 16.712 16.816 21.445 -0.3351 -0.1122 -0.1805 24MET BB 601 17.314 16.802 21.572 -0.2234 -0.0252 -0.2415 24MET SC1 602 17.358 16.672 21.886 -0.0475 -0.0761 0.2617 25LYS BB 603 17.536 16.721 21.351 -0.4190 0.0237 0.2298 25LYS SC1 604 17.476 16.899 21.142 0.0757 -0.0978 -0.2675 25LYS SC2 605 17.410 17.212 20.991 0.1621 0.1714 0.0766 26ASP BB 606 17.559 16.371 21.256 0.0309 0.1293 -0.1522 26ASP SC1 607 17.378 16.343 21.567 -0.3182 0.0192 0.2815 27VAL BB 608 17.288 16.163 21.184 0.2426 -0.1962 -0.0610 27VAL SC1 609 17.431 15.916 21.249 0.2817 -0.1200 0.1520 28LYS BB 610 17.068 16.052 21.397 0.0147 -0.4902 0.0075 28LYS SC1 611 17.264 15.916 21.669 0.0254 0.0979 0.0254 28LYS SC2 612 17.620 15.840 21.645 -0.0863 0.0875 -0.0844 29ASP BB 613 16.774 16.164 21.370 -0.1945 0.0792 0.3578 29ASP SC1 614 16.774 16.461 21.182 0.0504 0.3568 -0.2756 30LEU BB 615 16.608 16.089 21.607 0.2385 0.0111 -0.0667 30LEU SC1 616 16.748 15.934 21.911 0.2534 -0.0835 0.3450 31GLY BB 617 16.255 16.064 21.548 0.2773 -0.1006 -0.0920 32LYS BB 618 16.112 15.776 21.528 -0.0395 -0.1794 0.0180 32LYS SC1 619 16.021 15.609 21.783 0.2381 -0.4141 0.0179 32LYS SC2 620 15.872 15.341 21.924 0.3400 0.1724 0.0579 33THR BB 621 15.935 15.829 21.266 -0.1172 0.1681 -0.0222 33THR SC1 622 15.965 15.602 21.065 -0.4193 0.1275 -0.0249 34MET BB 623 15.948 16.106 21.081 0.2803 0.0556 -0.2007 34MET SC1 624 16.043 16.168 20.726 -0.1550 -0.1045 -0.1029 35LYS BB 625 15.668 16.249 21.215 0.2445 0.2756 0.0037 35LYS SC1 626 15.451 16.018 21.235 -0.4615 0.1242 0.2114 35LYS SC2 627 15.455 15.699 21.085 0.0174 0.3463 0.0447 36ASP BB 628 15.542 16.582 21.224 0.2705 0.1084 0.2145 36ASP SC1 629 15.285 16.639 21.473 -0.3425 0.1993 -0.3399 37GLN BB 630 15.632 16.895 21.267 0.1853 0.1861 0.4718 37GLN SC1 631 15.865 17.287 21.201 -0.0435 -0.0170 0.0185 38ALA BB 632 15.406 17.084 21.383 0.3517 -0.1292 -0.2362 38ALA SC1 633 15.363 17.321 21.260 0.0410 0.0259 0.1476 39LEU BB 634 15.087 16.992 21.370 0.4514 -0.3096 0.0898 39LEU SC1 635 14.876 17.135 21.611 -0.0238 0.3459 0.0023 40LYS BB 636 15.014 16.864 21.093 0.1814 -0.0963 -0.0993 40LYS SC1 637 15.307 16.837 20.970 -0.0126 0.1779 0.3163 40LYS SC2 638 15.632 16.801 20.806 0.1676 -0.3241 -0.3650 41ASP BB 639 14.802 16.665 21.015 0.0582 -0.1516 -0.0064 41ASP SC1 640 14.772 16.739 20.679 -0.1952 0.2943 0.0592 42ASP BB 641 14.601 16.488 21.118 -0.1953 0.1259 0.4340 42ASP SC1 642 14.677 16.168 21.215 0.1316 0.0804 -0.2346 43ASP BB 643 14.269 16.472 21.191 0.1489 0.2076 0.1161 43ASP SC1 644 14.219 16.759 21.365 -0.0833 0.2323 -0.2034 44ALA BB 645 14.069 16.399 21.017 -0.1501 0.3619 0.2483 44ALA SC1 646 13.906 16.185 21.030 0.0471 0.1568 -0.3372 45GLU BB 647 14.061 16.565 20.700 -0.0382 -0.0318 -0.0068 45GLU SC1 648 13.688 16.448 20.721 0.4797 0.1883 0.0766 46THR BB 649 14.320 16.825 20.760 -0.1103 -0.1111 0.2385 46THR SC1 650 14.303 17.010 21.002 -0.3068 -0.1179 0.2312 47GLY BB 651 14.340 17.119 20.591 -0.0963 -0.0065 0.1285 48LEU BB 652 14.210 17.249 20.310 -0.0802 0.3830 -0.1684 48LEU SC1 653 14.422 17.511 20.389 -0.0205 -0.0548 0.1247 49THR BB 654 14.181 17.126 20.028 0.1197 0.0221 -0.3580 49THR SC1 655 14.469 17.150 19.930 0.2563 -0.1930 -0.0258 50ASP BB 656 13.938 17.246 19.838 0.1484 0.1346 -0.0736 50ASP SC1 657 13.661 17.116 19.706 0.2967 0.0855 0.2374 51GLY BB 658 14.040 17.303 19.548 0.0025 0.0975 0.1405 52GLU BB 659 14.341 17.245 19.501 0.0471 0.0686 -0.0915 52GLU SC1 660 14.414 16.870 19.544 0.0883 -0.0335 -0.0937 53GLU BB 661 14.417 17.459 19.301 -0.0535 0.4888 -0.0817 53GLU SC1 662 14.087 17.693 19.271 0.1099 0.1860 0.0140 54LYS BB 663 14.585 17.716 19.311 0.0440 -0.0387 0.1050 54LYS SC1 664 14.431 17.883 19.552 0.4493 0.0202 -0.0476 54LYS SC2 665 14.154 18.073 19.571 -0.0709 0.3415 -0.1047 55GLU BB 666 14.872 17.781 19.442 0.1656 0.4984 0.0705 55GLU SC1 667 15.137 17.624 19.168 -0.1318 -0.4666 0.0671 56GLU BB 668 14.818 18.018 19.692 0.1096 0.0724 0.1304 56GLU SC1 669 14.953 17.843 19.939 -0.0301 0.2700 -0.1164 57PRO BB 670 15.021 18.330 19.614 -0.1607 -0.3313 0.1527 57PRO SC1 671 14.862 18.524 19.423 -0.3200 -0.1733 -0.0633 58LYS BB 672 15.243 18.421 19.906 -0.0007 0.0358 -0.4361 58LYS SC1 673 15.244 18.167 20.073 -0.1254 -0.0638 -0.3848 58LYS SC2 674 15.505 18.098 20.333 -0.1168 0.4736 0.1410 59GLU BB 675 15.396 18.679 20.112 -0.1341 0.1253 0.3939 59GLU SC1 676 15.681 18.508 20.251 -0.0048 -0.5035 0.2014 60GLU BB 677 15.186 18.863 20.298 -0.2506 0.0906 0.3159 60GLU SC1 678 14.859 18.805 20.269 -0.1146 -0.3141 0.1023 61GLU BB 679 15.337 19.129 20.344 0.0731 -0.1771 -0.2006 61GLU SC1 680 15.085 19.417 20.158 -0.4206 0.1135 -0.0982 1LYS BB 681 12.434 22.808 17.981 -0.1361 -0.2124 0.2975 1LYS SC1 682 12.698 22.849 17.858 -0.4025 -0.0275 0.1923 1LYS SC2 683 12.906 22.938 17.577 0.1163 0.0533 -0.3503 2LYS BB 684 12.442 22.839 18.360 -0.1880 -0.1040 -0.0401 2LYS SC1 685 12.712 23.042 18.436 -0.0904 0.0226 0.1927 2LYS SC2 686 12.531 23.289 18.608 0.2950 -0.2346 0.0358 3CYS BB 687 12.228 22.821 18.568 0.0439 0.1021 -0.1003 3CYS SC1 688 12.196 22.475 18.587 -0.2386 0.1478 -0.0768 4LEU BB 689 12.085 22.998 18.795 -0.0280 0.0229 0.1369 4LEU SC1 690 12.310 22.993 19.116 -0.2356 -0.0098 0.1410 5PHE BB 691 11.795 23.032 18.974 -0.0732 -0.0490 -0.2275 5PHE SC1 692 11.881 23.115 19.243 -0.0321 -0.0136 -0.2852 5PHE SC2 693 11.886 23.455 19.256 -0.2299 -0.0110 -0.2498 5PHE SC3 694 12.143 23.330 19.208 -0.1433 0.1400 -0.1885 6LYS BB 695 11.518 22.936 18.810 0.1523 -0.1684 -0.1083 6LYS SC1 696 11.678 22.977 18.538 0.2696 -0.0194 -0.1318 6LYS SC2 697 11.548 22.864 18.230 0.1401 -0.0433 0.0577 7LYS BB 698 11.231 23.059 18.799 -0.0602 -0.0253 -0.1675 7LYS SC1 699 11.275 23.303 18.968 0.0336 -0.0881 0.2773 7LYS SC2 700 11.252 23.607 19.093 -0.2432 0.1548 0.1352 8LYS BB 701 11.099 23.037 18.514 -0.1269 0.0135 0.0295 8LYS SC1 702 10.837 23.195 18.599 0.3723 -0.1717 0.0817 8LYS SC2 703 10.685 23.465 18.786 -0.0526 0.2561 -0.1566 9ASN BB 704 11.045 22.784 18.370 -0.2347 0.1121 0.1584 9ASN SC1 705 11.263 22.558 18.488 0.1481 -0.0688 0.1650 10LYS BB 706 10.835 22.571 18.202 0.1383 -0.0852 0.2588 10LYS SC1 707 11.034 22.308 18.138 -0.0158 0.4116 0.0874 10LYS SC2 708 11.151 22.019 18.167 -0.2098 0.1301 0.1299 11LYS BB 709 10.517 22.443 18.310 0.1340 0.2491 0.1012 11LYS SC1 710 10.508 22.246 18.566 0.3301 -0.1878 -0.1386 11LYS SC2 711 10.537 21.947 18.739 -0.1292 0.0001 -0.0658 12LYS BB 712 10.269 22.550 18.111 -0.1213 -0.0738 0.2800 12LYS SC1 713 10.057 22.628 18.290 0.1339 -0.2203 -0.2073 12LYS SC2 714 10.089 22.965 18.409 0.0970 0.0279 -0.1357 13GLY BB 715 10.313 22.679 17.772 -0.1759 0.4306 -0.1715 14LYS BB 716 10.534 22.660 17.470 0.2357 0.1798 -0.1067 14LYS SC1 717 10.354 22.647 17.233 -0.2178 0.1438 -0.2070 14LYS SC2 718 10.058 22.591 17.124 0.1943 -0.1024 0.0546 15GLU BB 719 10.762 22.626 17.696 -0.1069 -0.2617 -0.1175 15GLU SC1 720 10.981 22.856 17.465 0.3728 -0.1595 -0.1029 16LYS BB 721 10.681 22.309 17.853 -0.3245 0.1016 -0.2285 16LYS SC1 722 10.527 22.098 17.709 -0.1159 0.0721 -0.3151 16LYS SC2 723 10.296 22.106 17.964 0.0266 -0.1282 -0.4611 17GLY BB 724 10.917 21.998 17.794 0.1006 -0.0428 0.2989 18GLY BB 725 11.073 21.991 17.474 0.0596 0.0066 -0.2626 19LYS BB 726 11.040 22.001 17.138 0.0118 0.1594 0.2154 19LYS SC1 727 11.317 22.085 17.139 0.0133 -0.1636 0.2157 19LYS SC2 728 11.600 21.936 17.057 -0.2179 -0.2691 0.0067 20ASN BB 729 11.113 21.731 16.968 0.1011 0.1101 0.0502 20ASN SC1 730 11.216 21.552 16.719 0.0436 -0.1266 0.1143 21ALA BB 731 11.021 21.458 17.095 -0.0541 0.1488 0.0991 21ALA SC1 732 11.156 21.339 17.296 -0.0156 -0.1522 -0.0989 22ILE BB 733 11.030 21.115 16.947 -0.1070 -0.0863 0.0944 22ILE SC1 734 11.354 21.077 17.045 0.0378 -0.0220 -0.3347 23ASN BB 735 10.871 20.867 17.015 0.2132 0.0522 -0.0531 23ASN SC1 736 11.048 20.648 16.819 -0.0777 0.1362 -0.3706 24MET BB 737 10.582 20.791 17.181 -0.0813 0.0523 0.1513 24MET SC1 738 10.832 20.712 17.472 -0.2314 0.3117 -0.1653 25LYS BB 739 10.305 20.870 17.187 -0.2253 -0.0880 -0.1302 25LYS SC1 740 10.244 21.064 17.004 0.0332 0.2260 -0.0700 25LYS SC2 741 9.990 21.073 16.718 0.2053 0.2788 0.1381 26ASP BB 742 10.087 20.864 17.382 -0.0037 0.2258 -0.2537 26ASP SC1 743 9.991 20.522 17.419 -0.0152 -0.1749 0.0083 27VAL BB 744 10.173 20.905 17.693 -0.0267 0.0380 0.2582 27VAL SC1 745 10.459 20.927 17.637 -0.1151 0.0379 -0.2408 28LYS BB 746 9.922 20.802 17.827 -0.1125 -0.1759 0.0557 28LYS SC1 747 9.993 20.968 18.082 -0.0875 -0.0690 0.0948 28LYS SC2 748 10.088 21.029 18.379 -0.1380 -0.1361 -0.1223 29ASP BB 749 9.688 20.547 17.767 0.0104 0.1215 0.0126 29ASP SC1 750 9.708 20.167 17.691 -0.2892 -0.1304 -0.3113 30LEU BB 751 9.528 20.429 18.035 0.3678 0.0603 0.1192 30LEU SC1 752 9.405 20.711 18.183 0.0348 0.2151 0.2351 31GLY BB 753 9.516 20.096 18.086 0.4909 0.3359 -0.3459 32LYS BB 754 9.314 19.946 17.989 -0.1065 -0.0188 0.0065 32LYS SC1 755 9.194 20.154 17.809 -0.2798 -0.0362 0.0263 32LYS SC2 756 8.867 20.237 17.728 0.2897 0.0299 0.0115 33THR BB 757 9.006 19.818 18.033 0.1965 0.2273 0.0711 33THR SC1 758 9.038 19.591 17.832 0.0568 0.2853 -0.0187 34MET BB 759 8.874 19.817 18.342 -0.0327 0.1200 0.0318 34MET SC1 760 8.501 19.774 18.318 -0.2700 0.0935 0.0853 35LYS BB 761 9.024 19.726 18.574 0.1516 0.1178 -0.2057 35LYS SC1 762 8.733 19.703 18.744 0.0630 0.3198 0.0240 35LYS SC2 763 8.579 20.037 18.787 0.0635 0.1946 -0.0689 36ASP BB 764 9.096 19.434 18.583 -0.0808 -0.1435 -0.1408 36ASP SC1 765 8.858 19.173 18.667 -0.3523 0.3698 0.2635 37GLN BB 766 9.382 19.267 18.612 -0.4018 0.0121 -0.3889 37GLN SC1 767 9.461 19.155 18.265 -0.1847 -0.0639 -0.0943 38ALA BB 768 9.693 19.363 18.646 0.0793 0.0429 -0.2206 38ALA SC1 769 9.822 19.376 18.410 0.3449 0.1261 -0.0752 39LEU BB 770 9.842 19.643 18.777 0.2054 0.0809 0.1680 39LEU SC1 771 10.020 19.733 18.481 0.3845 0.4939 -0.0513 40LYS BB 772 9.838 19.655 19.078 0.1108 0.0927 -0.0700 40LYS SC1 773 10.044 19.387 19.086 0.0610 0.2289 0.1502 40LYS SC2 774 10.217 19.087 19.107 -0.1128 -0.1752 -0.0901 41ASP BB 775 10.113 19.778 19.273 0.0120 0.3610 0.2404 41ASP SC1 776 10.389 20.008 19.217 0.1053 0.0280 0.2178 42ASP BB 777 10.047 19.811 19.545 -0.2375 -0.2352 0.3252 42ASP SC1 778 9.865 20.032 19.674 0.2349 -0.1740 -0.0813 43ASP BB 779 10.057 19.664 19.870 -0.1435 0.2786 -0.6004 43ASP SC1 780 9.764 19.457 19.861 -0.0205 -0.0591 0.2752 44ALA BB 781 9.943 19.838 20.058 -0.0216 0.0647 -0.1977 44ALA SC1 782 10.130 20.006 20.157 -0.0050 -0.1529 0.1580 45GLU BB 783 9.637 19.833 20.037 -0.1178 -0.0762 0.2509 45GLU SC1 784 9.473 19.845 20.388 -0.3349 0.0712 -0.1776 46THR BB 785 9.438 19.975 19.882 -0.2031 -0.2507 0.0006 46THR SC1 786 9.352 20.232 20.023 0.1450 -0.1673 0.0713 47GLY BB 787 9.408 20.075 19.597 0.1872 0.2882 0.2762 48LEU BB 788 9.233 20.309 19.377 0.0827 -0.1607 -0.3088 48LEU SC1 789 9.318 20.345 19.038 0.1369 0.4937 0.4114 49THR BB 790 9.354 20.576 19.423 0.0667 -0.1301 0.1589 49THR SC1 791 9.647 20.619 19.350 0.0412 -0.0474 0.1034 50ASP BB 792 9.309 20.668 19.727 -0.1192 -0.0362 -0.4168 50ASP SC1 793 9.020 20.805 19.882 -0.1829 -0.0316 0.1370 51GLY BB 794 9.484 20.634 20.016 0.0601 -0.1322 0.3813 52GLU BB 795 9.700 20.862 20.141 0.3048 -0.0082 -0.2356 52GLU SC1 796 9.923 20.614 19.895 -0.0203 -0.0611 -0.0021 53GLU BB 797 9.650 21.210 20.160 -0.2655 0.3464 -0.0407 53GLU SC1 798 9.930 21.450 20.071 -0.4636 0.1568 -0.1056 54LYS BB 799 9.411 21.359 20.292 0.3601 -0.1349 -0.0042 54LYS SC1 800 9.306 21.646 20.188 -0.0840 -0.0341 0.4413 54LYS SC2 801 9.398 21.915 19.978 0.1935 0.0476 -0.0745 55GLU BB 802 9.280 21.317 20.560 -0.2075 0.0311 -0.0901 55GLU SC1 803 9.299 21.707 20.674 -0.1347 -0.2050 0.2550 56GLU BB 804 9.292 21.111 20.832 0.2243 -0.2574 0.0052 56GLU SC1 805 9.290 20.772 20.820 0.2561 0.2083 -0.2291 57PRO BB 806 9.098 21.056 21.139 0.0696 0.0392 0.3179 57PRO SC1 807 9.243 21.295 21.296 -0.1809 0.2470 0.2833 58LYS BB 808 8.821 20.965 21.244 0.1331 -0.0930 0.1467 58LYS SC1 809 8.753 20.642 21.175 0.0366 -0.0976 0.0603 58LYS SC2 810 8.706 20.337 21.274 -0.1881 -0.1015 -0.0621 59GLU BB 811 8.536 21.178 21.230 0.0220 0.2948 -0.3038 59GLU SC1 812 8.389 21.145 20.834 -0.0280 -0.0735 -0.2218 60GLU BB 813 8.417 21.441 21.412 0.0493 -0.2848 0.1985 60GLU SC1 814 8.543 21.687 21.176 -0.1583 -0.0881 -0.0806 61GLU BB 815 8.146 21.403 21.544 -0.1975 0.2240 0.1208 61GLU SC1 816 8.141 21.364 21.910 -0.2024 -0.3196 -0.1265 1LYS BB 817 19.834 5.328 16.227 -0.2149 0.1711 -0.0944 1LYS SC1 818 19.642 5.494 16.335 -0.0484 0.0675 0.3075 1LYS SC2 819 19.351 5.584 16.499 0.2134 0.0083 0.0558 2LYS BB 820 19.897 5.003 16.342 -0.1473 0.0983 -0.1351 2LYS SC1 821 19.757 4.958 16.625 0.0867 -0.2485 -0.0510 2LYS SC2 822 19.605 5.042 16.934 -0.0136 0.3049 -0.1402 3CYS BB 823 20.085 4.739 16.166 -0.1751 0.0750 -0.0003 3CYS SC1 824 20.427 4.870 16.199 0.0678 -0.2109 0.3037 4LEU BB 825 20.129 4.517 16.408 0.1806 0.2470 0.1440 4LEU SC1 826 20.258 4.798 16.595 0.2663 0.0556 -0.0365 5PHE BB 827 20.304 4.175 16.396 0.1452 -0.3463 0.2901 5PHE SC1 828 20.039 3.999 16.501 -0.0590 -0.1372 -0.3014 5PHE SC2 829 20.029 3.775 16.757 0.1147 0.1194 -0.0635 5PHE SC3 830 19.928 3.678 16.503 0.1946 -0.2292 0.0323 6LYS BB 831 20.595 4.140 16.259 0.2138 0.1208 0.0347 6LYS SC1 832 20.795 4.239 16.514 0.3513 -0.0023 -0.1671 6LYS SC2 833 21.098 4.377 16.534 0.1541 0.1051 0.4522 7LYS BB 834 20.689 4.034 15.981 0.2339 -0.1680 0.0514 7LYS SC1 835 20.529 3.748 15.921 0.5146 0.0225 0.0530 7LYS SC2 836 20.606 3.403 16.022 0.4430 -0.3945 0.0143 8LYS BB 837 20.920 4.060 15.782 -0.1632 -0.4498 -0.0997 8LYS SC1 838 21.195 4.125 15.991 -0.3917 -0.2377 0.2274 8LYS SC2 839 21.410 3.940 15.861 -0.0117 0.1519 -0.1929 9ASN BB 840 20.997 4.315 15.596 0.2370 -0.1547 -0.3717 9ASN SC1 841 20.678 4.462 15.688 0.1718 0.0414 -0.1141 10LYS BB 842 21.257 4.379 15.372 -0.1846 -0.0769 0.0167 10LYS SC1 843 21.172 4.714 15.270 0.0176 0.2493 -0.0464 10LYS SC2 844 20.924 4.896 15.092 -0.0299 0.1992 -0.1769 11LYS BB 845 21.507 4.155 15.472 0.1687 0.2127 0.2228 11LYS SC1 846 21.471 3.948 15.229 -0.0464 -0.1637 -0.1311 11LYS SC2 847 21.230 3.971 15.002 0.0128 -0.0771 0.2655 12LYS BB 848 21.628 4.347 15.783 -0.1940 0.0193 0.1820 12LYS SC1 849 21.399 4.473 15.801 -0.1481 -0.3508 0.1292 12LYS SC2 850 21.286 4.803 15.728 -0.2020 -0.2565 -0.1523 13GLY BB 851 21.952 4.401 15.645 0.1026 0.0356 -0.0832 14LYS BB 852 22.001 4.340 15.364 0.0262 0.1322 0.2173 14LYS SC1 853 22.053 4.618 15.212 -0.1276 -0.0713 0.1115 14LYS SC2 854 22.381 4.692 15.274 -0.0137 -0.0403 0.0357 15GLU BB 855 22.302 4.219 15.312 -0.2763 0.0569 -0.1150 15GLU SC1 856 22.476 4.286 15.038 0.1477 -0.0983 0.0888 16LYS BB 857 22.445 3.981 15.484 -0.0872 0.2925 0.3223 16LYS SC1 858 22.657 3.847 15.297 0.2744 0.1499 -0.1646 16LYS SC2 859 22.914 3.765 15.063 0.0098 -0.1175 -0.0590 17GLY BB 860 22.626 3.889 15.781 0.0498 0.2102 0.3010 18GLY BB 861 22.866 4.069 15.900 -0.2623 0.1145 0.2378 19LYS BB 862 22.881 4.157 16.159 -0.0207 0.0932 0.0325 19LYS SC1 863 22.654 4.046 16.274 -0.0109 0.3763 -0.3392 19LYS SC2 864 22.363 3.872 16.241 0.1953 0.0242 0.0220 20ASN BB 865 22.830 4.442 16.184 -0.0492 0.2168 -0.1106 20ASN SC1 866 22.810 4.531 15.879 0.0178 0.2390 -0.0988 21ALA BB 867 22.619 4.558 16.358 0.2402 -0.1798 -0.5539 21ALA SC1 868 22.745 4.797 16.344 -0.0326 0.0267 0.1159 22ILE BB 869 22.357 4.331 16.403 -0.1532 -0.1507 0.0977 22ILE SC1 870 22.151 4.557 16.556 0.0930 0.2386 -0.1306 23ASN BB 871 22.433 4.162 16.621 -0.0341 -0.1930 0.0172 23ASN SC1 872 22.161 4.206 16.844 -0.3493 -0.1355 0.0480 24MET BB 873 22.473 3.821 16.672 0.1387 0.2174 -0.4230 24MET SC1 874 22.251 3.765 16.958 -0.1208 -0.0977 -0.2907 25LYS BB 875 22.643 3.594 16.511 -0.2317 -0.3314 0.1563 25LYS SC1 876 22.830 3.462 16.680 -0.1724 -0.4575 0.0861 25LYS SC2 877 23.068 3.256 16.593 -0.1383 -0.0764 0.3751 26ASP BB 878 22.776 3.585 16.241 0.1128 0.0566 0.3928 26ASP SC1 879 23.127 3.537 16.266 0.1406 -0.0292 -0.0693 27VAL BB 880 22.596 3.453 16.010 -0.1883 0.4077 -0.1574 27VAL SC1 881 22.378 3.430 16.203 0.1195 -0.1705 0.1469 28LYS BB 882 22.583 3.278 15.695 -0.0869 0.0595 0.2534 28LYS SC1 883 22.511 3.038 15.856 -0.1302 -0.0106 -0.0755 28LYS SC2 884 22.697 2.713 15.851 -0.2359 0.1895 0.1329 29ASP BB 885 22.623 3.355 15.409 -0.3437 0.1024 0.0020 29ASP SC1 886 22.351 3.525 15.384 0.0070 0.0977 0.0443 30LEU BB 887 22.649 3.063 15.186 -0.2339 0.0193 -0.2416 30LEU SC1 888 22.602 2.867 15.435 0.3625 0.0245 -0.1764 31GLY BB 889 22.648 3.008 14.869 -0.3514 0.4208 -0.1528 32LYS BB 890 22.688 2.717 14.748 0.2833 -0.1034 0.0888 32LYS SC1 891 22.510 2.622 15.033 -0.2153 0.0696 -0.0849 32LYS SC2 892 22.275 2.387 14.922 0.2070 0.4834 -0.0717 33THR BB 893 22.506 2.497 14.558 -0.1870 0.2116 0.1562 33THR SC1 894 22.370 2.402 14.303 -0.1236 -0.4460 0.3491 34MET BB 895 22.560 2.169 14.594 0.2824 -0.2009 0.1197 34MET SC1 896 22.830 2.287 14.889 0.3847 0.1362 -0.0603 35LYS BB 897 22.264 1.977 14.516 0.3181 -0.2050 -0.1313 35LYS SC1 898 22.145 2.084 14.228 -0.2834 -0.1449 -0.0380 35LYS SC2 899 21.952 2.380 14.183 -0.1892 0.3151 0.0415 36ASP BB 900 21.982 1.976 14.720 -0.2511 -0.3050 -0.1992 36ASP SC1 901 21.795 1.867 14.458 -0.4524 0.1135 0.1219 37GLN BB 902 21.796 1.767 14.900 -0.2547 -0.2212 -0.0994 37GLN SC1 903 22.050 1.731 15.198 0.1045 0.2479 0.2085 38ALA BB 904 21.441 1.728 14.967 0.0304 -0.2425 -0.1113 38ALA SC1 905 21.331 1.563 14.782 0.0403 -0.3710 -0.0043 39LEU BB 906 21.240 1.953 15.094 -0.1821 -0.1689 0.4061 39LEU SC1 907 20.965 1.793 15.168 0.4315 -0.2034 -0.2807 40LYS BB 908 21.153 2.183 14.944 -0.2673 0.1651 -0.1116 40LYS SC1 909 20.892 2.084 14.767 -0.2372 -0.0213 -0.4251 40LYS SC2 910 20.744 1.923 14.480 -0.0495 -0.2413 0.1378 41ASP BB 911 21.293 2.460 14.926 -0.0681 -0.0630 -0.2707 41ASP SC1 912 21.158 2.563 14.625 -0.4428 -0.0640 -0.0040 42ASP BB 913 21.312 2.658 15.158 0.1593 -0.0535 0.0786 42ASP SC1 914 21.366 2.388 15.360 -0.2880 -0.1332 -0.1651 43ASP BB 915 21.097 2.889 15.283 -0.2664 -0.2863 -0.1261 43ASP SC1 916 20.823 2.757 15.225 0.1964 -0.3477 0.4423 44ALA BB 917 21.151 3.237 15.276 0.0964 0.1703 0.0922 44ALA SC1 918 20.941 3.404 15.285 -0.0142 0.0206 0.6835 45GLU BB 919 21.392 3.404 15.346 -0.1320 -0.1240 -0.0412 45GLU SC1 920 21.219 3.693 15.526 -0.0696 0.1555 -0.0475 46THR BB 921 21.675 3.492 15.175 0.1829 -0.2321 -0.3608 46THR SC1 922 21.934 3.407 15.313 0.0693 -0.1657 -0.0991 47GLY BB 923 21.624 3.646 14.901 -0.1274 -0.1141 0.0529 48LEU BB 924 21.684 3.976 14.832 0.3541 0.3885 0.0513 48LEU SC1 925 22.032 3.837 14.754 -0.2575 0.2494 -0.1763 49THR BB 926 21.593 4.148 14.587 -0.1078 -0.0154 -0.0013 49THR SC1 927 21.822 4.141 14.386 -0.3914 0.1084 -0.3397 50ASP BB 928 21.337 4.125 14.495 -0.3811 -0.0396 0.1247 50ASP SC1 929 21.309 3.770 14.532 0.0702 0.2251 -0.1178 51GLY BB 930 21.171 4.213 14.211 -0.2125 0.1234 -0.1153 52GLU BB 931 21.208 4.502 14.081 -0.0742 0.1061 0.0816 52GLU SC1 932 21.347 4.316 13.730 -0.3689 -0.1241 -0.1726 53GLU BB 933 21.226 4.800 14.198 0.0581 -0.0336 0.0746 53GLU SC1 934 21.442 4.640 14.530 -0.4652 0.0882 -0.1621 54LYS BB 935 21.024 5.109 14.121 -0.0972 0.0532 0.0617 54LYS SC1 936 20.870 5.256 14.362 -0.0010 0.0382 0.0033 54LYS SC2 937 20.951 5.519 14.558 -0.1178 -0.2922 0.4986 55GLU BB 938 20.755 4.990 14.071 0.2773 -0.0721 0.0190 55GLU SC1 939 20.729 4.629 14.214 0.2434 -0.0030 0.0510 56GLU BB 940 20.570 5.208 13.932 -0.1926 0.0122 0.1521 56GLU SC1 941 20.406 5.300 14.263 0.1612 0.0136 -0.1463 57PRO BB 942 20.508 5.286 13.652 0.1967 0.0645 -0.2116 57PRO SC1 943 20.252 5.477 13.548 -0.1387 0.0177 0.1414 58LYS BB 944 20.549 5.182 13.349 0.3067 0.4205 -0.2064 58LYS SC1 945 20.677 5.354 13.102 -0.0383 0.3878 0.0621 58LYS SC2 946 20.848 5.612 12.933 -0.1272 -0.3130 0.0790 59GLU BB 947 20.786 4.938 13.253 -0.2910 0.1400 0.0863 59GLU SC1 948 21.177 5.052 13.221 0.1191 -0.2822 0.1945 60GLU BB 949 20.625 4.661 13.211 -0.2932 0.1205 0.3628 60GLU SC1 950 20.264 4.642 13.340 -0.4125 0.1249 -0.2415 61GLU BB 951 20.627 4.501 12.933 0.0497 0.0104 -0.0582 61GLU SC1 952 20.351 4.204 12.999 0.4255 -0.1060 -0.0134 1LYS BB 953 18.337 10.222 20.971 0.1622 -0.0156 -0.2613 1LYS SC1 954 18.276 10.108 20.628 -0.0150 -0.1572 0.1156 1LYS SC2 955 18.150 9.867 20.428 -0.1638 0.2312 0.0586 2LYS BB 956 18.382 10.577 20.844 -0.1106 0.0254 -0.3563 2LYS SC1 957 18.077 10.542 20.747 -0.2385 0.1620 -0.1187 2LYS SC2 958 17.764 10.719 20.743 -0.3103 -0.1646 -0.2283 3CYS BB 959 18.684 10.585 20.864 -0.2871 -0.2500 0.0333 3CYS SC1 960 18.701 10.663 20.539 -0.3134 0.1152 -0.2093 4LEU BB 961 18.844 10.726 21.114 -0.1598 0.2721 -0.1610 4LEU SC1 962 19.061 10.505 21.281 0.1721 -0.2971 -0.0976 5PHE BB 963 19.054 10.957 21.075 0.0449 -0.0681 -0.0811 5PHE SC1 964 19.165 10.993 21.361 -0.0020 0.1478 -0.0886 5PHE SC2 965 19.501 10.966 21.406 0.0429 0.2065 -0.3671 5PHE SC3 966 19.380 11.206 21.516 0.0250 0.0089 0.0675 6LYS BB 967 19.296 11.076 20.887 0.0826 0.1802 -0.5225 6LYS SC1 968 19.517 10.899 21.011 0.0876 -0.1610 0.2595 6LYS SC2 969 19.736 10.654 21.135 0.0223 -0.1954 -0.1438 7LYS BB 970 19.243 11.045 20.584 0.1366 -0.2841 0.2029 7LYS SC1 971 19.021 10.814 20.562 -0.2614 -0.1326 -0.2394 7LYS SC2 972 19.021 10.450 20.477 0.1349 0.2001 0.1716 8LYS BB 973 19.050 11.242 20.475 -0.0059 0.0247 0.1380 8LYS SC1 974 19.292 11.486 20.353 0.4318 -0.0803 -0.1742 8LYS SC2 975 19.532 11.689 20.374 -0.1159 -0.4194 0.0404 9ASN BB 976 18.738 11.112 20.471 -0.1784 -0.0198 -0.2532 9ASN SC1 977 18.639 11.022 20.724 0.1296 0.2493 -0.1133 10LYS BB 978 18.500 11.248 20.291 -0.4038 0.1369 0.2420 10LYS SC1 979 18.545 11.071 20.012 0.0649 0.0344 -0.0024 10LYS SC2 980 18.580 10.973 19.693 -0.0524 -0.3521 0.2504 11LYS BB 981 18.394 11.546 20.316 0.0212 -0.1655 -0.1666 11LYS SC1 982 18.153 11.553 20.111 -0.2829 -0.0683 0.2062 11LYS SC2 983 17.948 11.688 19.884 0.0838 0.2008 0.1741 12LYS BB 984 18.415 11.809 20.568 0.0366 -0.1480 -0.0863 12LYS SC1 985 18.588 12.004 20.371 0.4337 -0.0725 -0.5960 12LYS SC2 986 18.785 12.246 20.269 0.2201 -0.3242 0.0268 13GLY BB 987 18.337 11.836 20.875 -0.0082 -0.2482 -0.0089 14LYS BB 988 18.351 12.050 21.125 0.1675 -0.0353 -0.2333 14LYS SC1 989 18.067 12.203 21.100 0.1738 -0.0079 -0.0641 14LYS SC2 990 17.745 12.176 21.092 -0.3242 -0.4092 0.1969 15GLU BB 991 18.174 11.895 21.373 0.2832 0.0972 -0.0419 15GLU SC1 992 18.299 11.522 21.300 0.2363 -0.0788 0.0558 16LYS BB 993 17.969 11.992 21.587 -0.3269 0.3592 -0.3223 16LYS SC1 994 18.038 11.725 21.759 0.0215 0.1414 0.1645 16LYS SC2 995 17.908 11.461 21.935 -0.4521 0.2359 -0.0626 17GLY BB 996 17.771 12.270 21.647 -0.0377 0.2448 0.4116 18GLY BB 997 17.545 12.268 21.800 -0.3344 -0.1398 -0.1496 19LYS BB 998 17.554 12.297 22.141 -0.1087 0.1527 -0.1236 19LYS SC1 999 17.418 12.019 22.190 0.0273 -0.2231 -0.3425 19LYS SC2 1000 17.149 11.799 22.328 0.2996 -0.2356 0.0975 20ASN BB 1001 17.634 12.540 22.271 -0.0535 0.2684 -0.1443 20ASN SC1 1002 17.818 12.391 22.513 -0.0605 0.0384 -0.0231 21ALA BB 1003 17.386 12.843 22.176 -0.0405 -0.0848 0.5189 21ALA SC1 1004 17.396 12.991 22.402 -0.1292 0.4790 0.1744 22ILE BB 1005 17.414 13.094 21.927 -0.1284 0.1287 -0.2546 22ILE SC1 1006 17.577 13.359 22.067 0.0060 -0.1737 0.1800 23ASN BB 1007 17.260 13.362 21.732 0.0804 0.3222 -0.3387 23ASN SC1 1008 17.268 13.622 21.888 0.0169 -0.0195 -0.0056 24MET BB 1009 17.472 13.285 21.464 0.2189 -0.0995 0.2476 24MET SC1 1010 17.580 12.961 21.443 0.4115 0.1330 0.1099 25LYS BB 1011 17.495 13.523 21.224 -0.1462 -0.1637 -0.1476 25LYS SC1 1012 17.806 13.461 21.270 -0.2284 0.2834 0.1659 25LYS SC2 1013 18.014 13.240 21.369 0.0739 -0.1694 -0.0550 26ASP BB 1014 17.380 13.848 21.356 0.1567 -0.1027 -0.1735 26ASP SC1 1015 17.071 13.733 21.498 -0.1393 -0.0369 -0.1019 27VAL BB 1016 17.290 14.142 21.237 -0.0753 -0.1919 -0.1391 27VAL SC1 1017 17.008 14.213 21.267 0.0551 0.1385 0.4545 28LYS BB 1018 17.410 14.299 20.944 0.0731 -0.0573 0.0872 28LYS SC1 1019 17.136 14.242 20.846 0.1916 0.1572 0.0306 28LYS SC2 1020 16.911 14.146 20.573 0.2404 -0.0009 0.0601 29ASP BB 1021 17.639 14.277 20.702 0.0524 -0.2045 0.1051 29ASP SC1 1022 17.795 14.589 20.712 0.1005 0.1292 -0.0748 30LEU BB 1023 17.886 14.088 20.744 0.0567 0.0998 0.2443 30LEU SC1 1024 18.017 14.022 20.421 0.0493 0.2207 0.2400 31GLY BB 1025 17.691 13.812 20.592 -0.2382 -0.0774 -0.4616 32LYS BB 1026 17.809 13.657 20.299 -0.0671 0.0811 -0.0109 32LYS SC1 1027 17.490 13.688 20.217 0.0111 0.1691 0.1120 32LYS SC2 1028 17.272 13.827 20.061 0.1708 -0.0853 0.1102 33THR BB 1029 18.045 13.470 20.307 0.0856 0.2593 -0.1366 33THR SC1 1030 18.073 13.241 20.107 -0.1960 0.1405 -0.0444 34MET BB 1031 18.351 13.606 20.321 0.2251 -0.0264 0.2571 34MET SC1 1032 18.310 13.781 20.659 0.1745 -0.1494 -0.0907 35LYS BB 1033 18.528 13.846 20.174 -0.2837 0.0215 -0.0025 35LYS SC1 1034 18.453 14.126 20.146 0.2150 0.3859 0.1837 35LYS SC2 1035 18.455 14.420 19.970 -0.3189 0.0528 0.0858 36ASP BB 1036 18.686 13.751 19.900 -0.0875 -0.1414 0.0536 36ASP SC1 1037 18.882 14.007 19.809 0.3525 -0.3352 -0.2773 37GLN BB 1038 18.928 13.519 19.852 0.2741 -0.0821 -0.1131 37GLN SC1 1039 18.830 13.271 19.590 -0.0249 -0.1169 -0.3338 38ALA BB 1040 19.202 13.481 20.041 0.1743 0.1857 0.1712 38ALA SC1 1041 19.295 13.241 19.957 0.1433 0.2983 -0.2028 39LEU BB 1042 19.231 13.433 20.303 0.0552 0.2124 -0.3154 39LEU SC1 1043 19.434 13.730 20.318 -0.1584 0.2954 0.0239 40LYS BB 1044 19.101 13.228 20.461 0.2050 0.0218 0.1939 40LYS SC1 1045 19.078 13.356 20.773 -0.1924 -0.1950 -0.1135 40LYS SC2 1046 18.820 13.374 20.950 0.1167 -0.2322 -0.0094 41ASP BB 1047 18.816 13.083 20.465 -0.0221 0.1307 0.1413 41ASP SC1 1048 18.622 13.360 20.580 -0.2489 0.2087 0.1226 42ASP BB 1049 18.722 12.775 20.487 0.2400 -0.0618 -0.0494 42ASP SC1 1050 18.644 12.756 20.166 0.1411 0.1481 -0.0324 43ASP BB 1051 18.807 12.531 20.673 -0.0253 -0.1937 -0.2612 43ASP SC1 1052 18.559 12.313 20.696 -0.0126 -0.1477 -0.1307 44ALA BB 1053 19.059 12.381 20.784 -0.1373 -0.3140 -0.0455 44ALA SC1 1054 19.198 12.271 20.580 -0.2445 -0.0344 -0.2764 45GLU BB 1055 19.268 12.536 20.926 -0.0326 0.1399 -0.1465 45GLU SC1 1056 19.375 12.200 21.093 0.0753 0.0165 0.2874 46THR BB 1057 19.531 12.603 20.798 -0.0413 0.3484 -0.0963 46THR SC1 1058 19.811 12.646 20.911 0.0092 0.0641 -0.1066 47GLY BB 1059 19.559 12.634 20.472 -0.0159 0.0813 -0.2211 48LEU BB 1060 19.573 12.443 20.211 0.3173 0.3226 -0.3922 48LEU SC1 1061 19.368 12.587 19.955 0.0185 0.0185 -0.1803 49THR BB 1062 19.775 12.191 20.266 -0.0446 0.1306 0.1172 49THR SC1 1063 19.674 11.974 20.076 -0.0665 0.0694 0.1984 50ASP BB 1064 20.062 12.208 20.317 -0.3106 0.0307 0.0544 50ASP SC1 1065 20.226 12.181 20.593 0.1168 0.4599 -0.2413 51GLY BB 1066 20.163 12.157 20.037 -0.3765 -0.1312 0.5303 52GLU BB 1067 20.514 12.091 20.046 0.0139 0.2178 0.2541 52GLU SC1 1068 20.591 11.695 19.959 -0.2866 0.2421 -0.3709 53GLU BB 1069 20.726 12.187 19.876 0.1185 -0.0348 0.0320 53GLU SC1 1070 20.737 12.557 19.817 0.0325 -0.0616 0.3574 54LYS BB 1071 20.729 12.019 19.575 -0.1633 0.1053 0.0652 54LYS SC1 1072 20.563 12.021 19.295 -0.0801 0.1112 0.0119 54LYS SC2 1073 20.251 12.160 19.209 0.0517 0.5875 0.1697 55GLU BB 1074 20.993 12.149 19.393 0.0712 -0.0034 -0.4786 55GLU SC1 1075 21.101 12.537 19.388 -0.0905 0.1272 -0.2602 56GLU BB 1076 21.170 11.931 19.218 -0.0563 -0.2093 -0.3094 56GLU SC1 1077 21.116 11.649 19.514 -0.0282 0.2670 -0.0637 57PRO BB 1078 21.163 11.957 18.909 -0.1789 -0.0107 -0.0020 57PRO SC1 1079 21.240 11.667 18.852 0.0891 0.1666 0.0354 58LYS BB 1080 21.361 12.157 18.719 -0.2242 -0.0037 0.0634 58LYS SC1 1081 21.309 11.985 18.452 -0.0265 0.3386 -0.1370 58LYS SC2 1082 21.491 11.862 18.208 -0.1939 0.2498 -0.3357 59GLU BB 1083 21.617 12.312 18.734 0.4899 -0.0781 -0.0811 59GLU SC1 1084 21.942 12.205 18.890 -0.2087 -0.0061 -0.0758 60GLU BB 1085 21.771 12.596 18.586 0.1263 -0.0906 0.1532 60GLU SC1 1086 21.425 12.726 18.460 0.2529 0.1270 -0.1245 61GLU BB 1087 22.034 12.737 18.412 -0.2919 0.0090 0.1731 61GLU SC1 1088 22.150 13.097 18.465 -0.0582 0.0423 0.2011 1LYS BB 1089 5.290 3.462 0.804 -0.3223 -0.1172 0.1215 1LYS SC1 1090 5.244 3.629 1.096 -0.0946 0.1101 0.2660 1LYS SC2 1091 5.481 3.829 1.249 -0.0508 0.1376 0.0431 2LYS BB 1092 5.042 3.527 0.623 -0.0917 -0.1927 0.0424 2LYS SC1 1093 4.805 3.260 0.582 -0.3744 0.1131 0.1493 2LYS SC2 1094 4.788 2.942 0.456 -0.3313 0.0953 0.3859 3CYS BB 1095 4.962 3.793 0.503 -0.0809 0.1000 0.0190 3CYS SC1 1096 5.063 4.005 0.700 0.3564 -0.2930 0.4222 4LEU BB 1097 4.638 3.936 0.555 -0.2272 -0.1320 -0.1909 4LEU SC1 1098 4.576 3.603 0.526 -0.0723 -0.1300 0.1347 5PHE BB 1099 4.541 4.210 0.391 0.2622 -0.2033 0.1423 5PHE SC1 1100 4.388 4.411 0.609 -0.3116 -0.0100 0.0858 5PHE SC2 1101 4.492 4.560 0.897 -0.1101 -0.0837 0.0528 5PHE SC3 1102 4.531 4.717 0.655 0.4703 -0.3316 -0.0337 6LYS BB 1103 4.635 4.270 0.141 0.0792 0.2835 0.0416 6LYS SC1 1104 4.371 4.364 -0.015 0.0254 -0.0669 0.0536 6LYS SC2 1105 4.088 4.511 -0.050 -0.1403 -0.0479 0.1307 7LYS BB 1106 4.853 4.445 0.050 -0.1209 -0.0833 0.5529 7LYS SC1 1107 4.853 4.486 -0.259 -0.1255 0.3615 0.2832 7LYS SC2 1108 4.847 4.418 -0.586 0.0305 0.4740 0.0036 8LYS BB 1109 5.174 4.501 0.124 0.2674 -0.0169 -0.0399 8LYS SC1 1110 5.344 4.484 -0.182 -0.0944 0.1380 0.1563 8LYS SC2 1111 5.644 4.438 -0.366 -0.4143 0.5227 0.0900 9ASN BB 1112 5.329 4.809 0.237 -0.0688 0.3962 -0.0131 9ASN SC1 1113 5.443 4.643 0.541 -0.2724 -0.1318 0.1543 10LYS BB 1114 5.181 5.090 0.214 -0.3638 -0.1780 -0.0659 10LYS SC1 1115 5.272 5.180 -0.074 0.2214 -0.1641 -0.2138 10LYS SC2 1116 5.243 5.494 -0.105 -0.2077 0.2404 0.0669 11LYS BB 1117 5.203 5.366 0.395 0.0873 -0.2046 0.2021 11LYS SC1 1118 5.061 5.318 0.652 -0.0646 0.0406 0.0951 11LYS SC2 1119 5.190 4.983 0.710 0.2771 -0.1815 -0.2625 12LYS BB 1120 5.373 5.648 0.335 -0.0565 0.0807 -0.1025 12LYS SC1 1121 5.329 5.773 0.647 0.0100 0.0758 -0.0828 12LYS SC2 1122 5.288 6.057 0.842 -0.0528 -0.1544 -0.0517 13GLY BB 1123 5.685 5.677 0.467 -0.0139 -0.1491 -0.1143 14LYS BB 1124 5.878 5.393 0.466 -0.3227 -0.2022 0.0735 14LYS SC1 1125 5.935 5.457 0.772 0.1661 -0.3330 -0.0341 14LYS SC2 1126 6.107 5.594 1.043 0.0340 0.3199 0.4247 15GLU BB 1127 6.143 5.366 0.328 0.1434 -0.1675 0.1422 15GLU SC1 1128 6.379 5.278 0.574 0.0825 -0.2374 -0.0441 16LYS BB 1129 6.195 5.380 -0.026 -0.0761 0.1333 0.1280 16LYS SC1 1130 6.048 5.133 -0.041 -0.1303 -0.2476 -0.4572 16LYS SC2 1131 6.006 5.086 -0.397 0.0860 0.2111 0.2352 17GLY BB 1132 6.314 5.655 -0.078 -0.2519 -0.0373 -0.2580 18GLY BB 1133 6.399 5.709 0.224 -0.1015 0.1187 -0.0369 19LYS BB 1134 6.689 5.761 0.443 0.1021 0.0303 0.0209 19LYS SC1 1135 6.717 6.002 0.607 0.2138 -0.0990 -0.0053 19LYS SC2 1136 6.547 6.309 0.737 0.0432 0.3585 -0.1090 20ASN BB 1137 6.817 5.559 0.496 -0.2468 0.3430 -0.2999 20ASN SC1 1138 7.053 5.596 0.770 -0.1692 -0.0622 -0.4866 21ALA BB 1139 7.061 5.545 0.260 0.3160 0.2066 -0.0794 21ALA SC1 1140 7.295 5.631 0.363 0.1676 0.1811 0.3026 22ILE BB 1141 7.043 5.274 0.008 -0.1495 -0.2010 0.3200 22ILE SC1 1142 7.309 5.109 0.144 0.2078 0.2317 0.1705 23ASN BB 1143 6.877 5.094 0.213 -0.1617 0.1061 0.0079 23ASN SC1 1144 6.820 4.863 -0.050 0.0865 0.2033 -0.4930 24MET BB 1145 6.905 5.093 0.558 -0.0588 0.2204 0.0167 24MET SC1 1146 6.672 4.876 0.644 0.0943 -0.1262 -0.1087 25LYS BB 1147 7.232 5.017 0.599 -0.2454 -0.0062 0.1515 25LYS SC1 1148 7.317 5.300 0.599 -0.0798 0.0511 0.1216 25LYS SC2 1149 7.593 5.426 0.814 -0.0226 -0.0389 -0.2608 26ASP BB 1150 7.169 4.709 0.737 0.2712 0.0680 -0.2566 26ASP SC1 1151 6.890 4.497 0.720 0.0074 -0.2105 0.6440 27VAL BB 1152 7.385 4.364 0.720 0.3612 -0.2844 0.1031 27VAL SC1 1153 7.214 4.150 0.621 -0.1258 0.2378 -0.2510 28LYS BB 1154 7.593 4.409 0.967 0.2750 -0.0404 0.0612 28LYS SC1 1155 7.367 4.512 1.141 0.2486 -0.2162 0.2673 28LYS SC2 1156 7.208 4.788 1.324 0.1641 -0.1349 0.2785 29ASP BB 1157 7.841 4.434 0.842 0.0839 0.2949 -0.1749 29ASP SC1 1158 7.887 4.766 0.828 -0.1882 0.0631 -0.2648 30LEU BB 1159 7.971 4.422 0.495 0.2678 0.0108 0.1017 30LEU SC1 1160 8.321 4.437 0.518 0.4705 0.2798 -0.2476 31GLY BB 1161 7.957 4.766 0.398 -0.0494 0.2490 -0.2574 32LYS BB 1162 8.286 4.859 0.384 -0.1794 0.2016 0.1130 32LYS SC1 1163 8.486 4.836 0.161 -0.0022 -0.2185 -0.0798 32LYS SC2 1164 8.787 4.892 -0.025 -0.0394 -0.0913 -0.2838 33THR BB 1165 8.355 4.927 0.703 0.1123 0.0929 -0.0616 33THR SC1 1166 8.651 5.002 0.707 0.0909 0.1779 -0.0713 34MET BB 1167 8.226 5.014 0.998 0.1314 0.2593 -0.0665 34MET SC1 1168 8.563 5.174 1.137 -0.0595 0.0495 0.3382 35LYS BB 1169 7.918 5.200 1.015 -0.1202 0.0658 0.1852 35LYS SC1 1170 8.020 5.251 0.717 -0.0897 0.2505 -0.2031 35LYS SC2 1171 8.215 5.288 0.443 -0.1173 0.0269 0.1468 36ASP BB 1172 7.972 5.521 1.161 0.3082 0.4197 -0.3051 36ASP SC1 1173 8.242 5.509 1.401 0.2883 0.0546 -0.0158 37GLN BB 1174 7.660 5.603 1.275 0.0274 -0.1854 -0.2584 37GLN SC1 1175 7.593 5.848 0.977 0.1486 0.0630 -0.1708 38ALA BB 1176 7.471 5.594 1.575 0.0910 0.1819 0.0037 38ALA SC1 1177 7.331 5.363 1.582 0.3446 0.0230 -0.0394 39LEU BB 1178 7.447 5.531 1.922 0.3003 -0.0726 0.1166 39LEU SC1 1179 7.315 5.222 1.937 -0.2188 0.1121 -0.2719 40LYS BB 1180 7.338 5.650 2.175 0.1999 0.2607 0.0926 40LYS SC1 1181 7.198 5.376 2.319 -0.3010 -0.3855 0.1159 40LYS SC2 1182 7.139 5.092 2.498 -0.2835 0.3601 -0.1396 41ASP BB 1183 7.513 5.765 2.380 -0.1558 0.1410 -0.2608 41ASP SC1 1184 7.478 5.591 2.675 0.1345 0.0132 0.1523 42ASP BB 1185 7.766 5.850 2.305 0.1788 -0.2045 0.1727 42ASP SC1 1186 7.897 5.541 2.134 0.1725 -0.0277 -0.1600 43ASP BB 1187 7.879 6.129 2.268 0.1650 -0.2141 -0.2404 43ASP SC1 1188 8.154 6.156 2.444 0.0082 -0.2707 0.0973 44ALA BB 1189 7.609 6.254 2.411 0.3515 -0.0293 0.1737 44ALA SC1 1190 7.572 6.178 2.668 0.4269 0.5299 0.3647 45GLU BB 1191 7.375 6.205 2.165 0.0561 0.1538 -0.0773 45GLU SC1 1192 7.534 6.398 1.859 -0.0440 0.0938 0.3253 46THR BB 1193 7.071 6.369 2.068 -0.1007 -0.2092 0.0219 46THR SC1 1194 6.934 6.409 2.336 0.0981 0.3735 0.0514 47GLY BB 1195 6.920 6.290 1.836 0.3490 0.0409 0.0752 48LEU BB 1196 6.663 6.098 1.762 0.0437 0.2624 0.2532 48LEU SC1 1197 6.796 5.838 1.530 -0.0962 0.0220 -0.2299 49THR BB 1198 6.415 5.869 1.929 0.1516 -0.1036 -0.0325 49THR SC1 1199 6.433 5.602 1.783 -0.0289 -0.0783 -0.1036 50ASP BB 1200 6.472 5.746 2.227 0.2139 -0.0807 -0.1708 50ASP SC1 1201 6.722 5.507 2.317 -0.1208 0.1629 0.2380 51GLY BB 1202 6.170 5.571 2.286 0.0066 -0.1699 0.0717 52GLU BB 1203 5.910 5.567 2.450 0.0230 -0.0003 -0.4110 52GLU SC1 1204 6.001 5.829 2.738 -0.3522 0.0953 -0.0579 53GLU BB 1205 5.804 5.244 2.541 0.0013 -0.2188 -0.1430 53GLU SC1 1206 5.921 5.095 2.199 0.0932 -0.0147 -0.0736 54LYS BB 1207 5.460 5.078 2.540 0.0093 -0.2260 -0.1186 54LYS SC1 1208 5.409 5.158 2.801 -0.3730 -0.0224 -0.0992 54LYS SC2 1209 5.151 5.323 2.993 -0.0537 0.2930 0.3827 55GLU BB 1210 5.204 5.304 2.442 -0.0809 0.2606 0.1681 55GLU SC1 1211 5.108 5.730 2.353 -0.1201 0.0555 -0.2066 56GLU BB 1212 4.934 5.217 2.266 -0.2265 -0.0255 0.2757 56GLU SC1 1213 4.615 5.103 2.415 -0.1199 -0.0070 -0.3784 57PRO BB 1214 5.003 5.148 1.957 0.1426 0.0064 -0.1628 57PRO SC1 1215 5.159 5.420 1.940 0.0020 0.1669 0.0423 58LYS BB 1216 5.176 4.962 1.676 0.3246 0.1695 0.2087 58LYS SC1 1217 5.439 5.131 1.554 0.2694 -0.0864 -0.1790 58LYS SC2 1218 5.783 5.179 1.610 0.1008 0.0079 0.1403 59GLU BB 1219 5.088 4.707 1.470 0.2947 0.2402 0.0023 59GLU SC1 1220 4.712 4.790 1.498 0.1010 0.2124 0.0556 60GLU BB 1221 5.247 4.442 1.314 0.2727 0.0023 0.0420 60GLU SC1 1222 5.469 4.293 1.589 0.2510 -0.0848 -0.0488 61GLU BB 1223 5.151 4.214 1.114 -0.0297 0.1223 0.0712 61GLU SC1 1224 5.210 4.428 0.812 0.2224 0.0264 -0.0976 1LYS BB 1225 3.600 17.746 20.278 -0.0779 -0.2545 -0.0538 1LYS SC1 1226 3.811 17.509 20.373 0.1878 0.2078 0.1761 1LYS SC2 1227 4.109 17.336 20.366 -0.0063 -0.3908 0.2388 2LYS BB 1228 3.756 17.999 20.059 0.2868 0.1130 -0.2074 2LYS SC1 1229 3.868 18.286 20.242 0.1893 -0.0628 0.1034 2LYS SC2 1230 3.969 18.604 20.209 0.2898 0.1337 -0.3816 3CYS BB 1231 3.678 18.211 19.791 0.0049 0.3463 0.1152 3CYS SC1 1232 3.858 18.486 19.859 0.3232 -0.0933 0.0164 4LEU BB 1233 3.430 18.255 19.598 -0.0694 -0.1011 -0.2105 4LEU SC1 1234 3.493 18.613 19.616 -0.0199 0.1936 0.0565 5PHE BB 1235 3.087 18.178 19.503 -0.0647 -0.1385 0.0802 5PHE SC1 1236 3.039 18.245 19.207 -0.0933 0.3133 0.1950 5PHE SC2 1237 2.717 18.353 19.199 -0.2069 0.0029 0.3910 5PHE SC3 1238 2.891 18.467 18.997 -0.4597 0.1078 0.2274 6LYS BB 1239 2.984 17.792 19.427 -0.0473 -0.2515 -0.1826 6LYS SC1 1240 2.731 17.901 19.343 0.0391 -0.3635 -0.1940 6LYS SC2 1241 2.469 18.014 19.484 -0.1629 0.2183 0.0602 7LYS BB 1242 3.020 17.578 19.174 -0.1704 0.0554 -0.0905 7LYS SC1 1243 2.746 17.629 18.978 -0.5717 -0.1243 -0.0182 7LYS SC2 1244 2.730 17.686 18.609 -0.1169 0.1053 -0.0077 8LYS BB 1245 3.317 17.442 19.038 0.0523 0.1195 -0.1118 8LYS SC1 1246 3.215 17.159 18.904 -0.2290 0.1672 -0.0297 8LYS SC2 1247 2.993 16.959 18.687 -0.0355 0.2029 0.2079 9ASN BB 1248 3.617 17.512 19.114 0.6445 0.0786 0.2865 9ASN SC1 1249 3.588 17.785 18.946 0.2500 0.3157 -0.4067 10LYS BB 1250 3.887 17.309 19.063 0.1098 -0.4587 -0.0887 10LYS SC1 1251 3.829 17.100 18.838 0.1178 0.1865 -0.3865 10LYS SC2 1252 3.731 16.749 18.828 0.0550 0.0116 -0.2814 11LYS BB 1253 4.168 17.315 19.183 -0.3004 0.0035 0.2410 11LYS SC1 1254 4.329 17.164 18.984 0.0105 0.1935 -0.4369 11LYS SC2 1255 4.551 17.421 18.871 -0.3224 0.1384 0.3137 12LYS BB 1256 4.260 17.105 19.505 0.1214 -0.1945 -0.1831 12LYS SC1 1257 3.995 16.910 19.613 -0.1182 -0.1026 -0.0320 12LYS SC2 1258 3.606 16.878 19.638 0.3903 -0.1520 -0.2589 13GLY BB 1259 4.481 16.915 19.379 -0.0384 0.1050 -0.0012 14LYS BB 1260 4.758 16.931 19.508 0.2014 -0.0873 0.2606 14LYS SC1 1261 4.745 16.932 19.837 0.0211 0.0206 0.1277 14LYS SC2 1262 4.784 16.769 20.126 -0.0046 -0.2101 -0.0041 15GLU BB 1263 5.047 16.826 19.406 0.0632 -0.1934 0.0567 15GLU SC1 1264 5.099 16.571 19.104 -0.2374 -0.0143 0.0192 16LYS BB 1265 5.335 16.970 19.463 0.1069 0.1285 -0.1737 16LYS SC1 1266 5.467 17.067 19.756 0.2891 0.0220 0.1874 16LYS SC2 1267 5.428 17.433 19.863 0.1707 0.3745 0.2343 17GLY BB 1268 5.618 16.955 19.266 0.0697 0.4138 -0.3099 18GLY BB 1269 5.858 16.750 19.276 -0.2666 0.0790 -0.0348 19LYS BB 1270 6.168 16.915 19.332 -0.1725 0.1529 -0.0874 19LYS SC1 1271 6.397 16.749 19.223 -0.2683 0.2029 -0.0073 19LYS SC2 1272 6.548 16.496 19.036 -0.1370 0.2357 -0.0206 20ASN BB 1273 6.068 17.208 19.420 -0.1846 -0.1442 -0.1336 20ASN SC1 1274 5.791 17.255 19.561 0.3617 0.0726 0.0445 21ALA BB 1275 6.173 17.493 19.324 0.0900 -0.3152 0.2860 21ALA SC1 1276 6.157 17.618 19.563 -0.0946 0.5619 -0.1464 22ILE BB 1277 6.297 17.487 19.035 0.2296 0.0938 0.0511 22ILE SC1 1278 6.367 17.154 19.061 -0.1073 0.0220 0.0865 23ASN BB 1279 6.191 17.736 18.785 0.0815 0.2699 0.0685 23ASN SC1 1280 5.925 17.503 18.657 0.1997 -0.0045 0.1621 24MET BB 1281 6.388 17.812 18.539 -0.1652 -0.1262 -0.1150 24MET SC1 1282 6.487 18.203 18.656 -0.0628 0.1165 0.2093 25LYS BB 1283 6.660 17.766 18.458 0.2355 -0.0489 0.2975 25LYS SC1 1284 6.579 17.501 18.255 0.0121 -0.2192 -0.3946 25LYS SC2 1285 6.673 17.355 17.905 -0.1184 0.1857 -0.0547 26ASP BB 1286 6.866 17.729 18.727 -0.0817 0.0884 0.2111 26ASP SC1 1287 6.656 17.787 18.960 0.2599 -0.0407 0.0426 27VAL BB 1288 7.043 17.480 18.604 0.1282 -0.4305 -0.0416 27VAL SC1 1289 6.972 17.427 18.325 0.1778 -0.2685 -0.0859 28LYS BB 1290 7.336 17.362 18.704 0.0899 -0.0382 -0.2157 28LYS SC1 1291 7.355 17.485 19.020 0.0459 -0.4413 -0.0264 28LYS SC2 1292 7.679 17.435 19.144 0.0687 0.0969 0.0448 29ASP BB 1293 7.633 17.475 18.674 0.0261 0.3158 -0.0207 29ASP SC1 1294 7.933 17.444 18.661 -0.1443 0.0694 -0.0954 30LEU BB 1295 7.636 17.671 18.382 0.1060 -0.1955 0.1440 30LEU SC1 1296 7.405 17.486 18.171 -0.1257 -0.0156 -0.0152 31GLY BB 1297 7.777 18.011 18.407 0.0272 0.1060 -0.0515 32LYS BB 1298 7.715 18.300 18.271 -0.0369 0.1990 0.2377 32LYS SC1 1299 7.987 18.415 18.275 0.2285 0.4245 0.0501 32LYS SC2 1300 8.254 18.605 18.264 0.0029 0.3396 0.1939 33THR BB 1301 7.546 18.463 18.027 0.1046 0.2061 -0.2069 33THR SC1 1302 7.578 18.231 17.832 0.1298 -0.1580 0.2141 34MET BB 1303 7.418 18.740 18.160 0.0687 0.1000 0.0151 34MET SC1 1304 7.710 18.750 18.481 0.0769 0.1030 0.0406 35LYS BB 1305 7.120 18.816 18.121 0.0251 0.2700 0.1041 35LYS SC1 1306 7.138 19.091 18.278 0.0198 -0.1405 -0.2626 35LYS SC2 1307 7.173 19.234 18.636 0.1728 0.1401 0.1086 36ASP BB 1308 6.868 18.685 17.914 -0.0338 -0.0012 -0.2788 36ASP SC1 1309 7.122 18.617 17.709 0.1998 0.0629 0.1941 37GLN BB 1310 6.676 18.411 17.856 -0.1287 -0.1344 -0.2014 37GLN SC1 1311 6.682 18.184 18.135 0.1516 -0.0688 0.3113 38ALA BB 1312 6.696 18.341 17.535 0.1507 0.1862 -0.1674 38ALA SC1 1313 6.521 18.482 17.385 -0.1286 0.4740 0.3986 39LEU BB 1314 6.842 18.181 17.317 0.0164 -0.2165 -0.0051 39LEU SC1 1315 6.700 17.828 17.240 0.1499 -0.0435 -0.0844 40LYS BB 1316 6.869 18.408 17.034 -0.2183 -0.0366 -0.0480 40LYS SC1 1317 6.664 18.284 16.851 -0.0569 0.0737 -0.2581 40LYS SC2 1318 6.699 18.166 16.534 0.1198 -0.1775 -0.1750 41ASP BB 1319 7.073 18.635 16.989 0.0431 0.0611 0.0055 41ASP SC1 1320 6.869 18.878 16.960 -0.0980 0.2063 0.0810 42ASP BB 1321 7.353 18.555 17.030 -0.1229 -0.0395 -0.2320 42ASP SC1 1322 7.313 18.225 16.939 0.2283 0.3437 0.1407 43ASP BB 1323 7.616 18.676 17.020 -0.0729 -0.1278 -0.0242 43ASP SC1 1324 7.711 18.901 16.741 0.1423 -0.4636 -0.0610 44ALA BB 1325 7.603 18.933 17.221 -0.1422 0.2132 -0.0376 44ALA SC1 1326 7.794 18.882 17.405 0.0287 -0.0536 -0.2805 45GLU BB 1327 7.393 18.935 17.401 0.1836 0.1752 -0.1459 45GLU SC1 1328 7.367 19.309 17.374 0.0468 -0.1847 -0.2287 46THR BB 1329 7.530 18.978 17.699 0.0170 0.0231 0.0394 46THR SC1 1330 7.744 18.772 17.767 0.0066 0.0507 0.1585 47GLY BB 1331 7.297 19.173 17.860 -0.0150 -0.6176 0.0907 48LEU BB 1332 7.006 19.151 17.727 0.0201 -0.0368 -0.1224 48LEU SC1 1333 6.770 19.150 18.015 -0.0925 -0.2850 0.0650 49THR BB 1334 6.837 19.364 17.596 -0.0322 0.0113 0.1752 49THR SC1 1335 6.882 19.581 17.806 -0.0846 0.1931 0.0012 50ASP BB 1336 6.942 19.599 17.376 0.1285 -0.2215 0.2305 50ASP SC1 1337 6.666 19.650 17.218 0.1507 -0.2049 0.1965 51GLY BB 1338 7.209 19.764 17.383 0.1845 0.1294 0.2817 52GLU BB 1339 7.265 20.059 17.316 -0.0451 -0.3957 -0.0668 52GLU SC1 1340 7.438 20.090 17.009 -0.5090 -0.0132 0.4911 53GLU BB 1341 7.052 20.317 17.236 0.0116 0.1651 0.2793 53GLU SC1 1342 7.276 20.596 16.990 0.1258 -0.0719 -0.0478 54LYS BB 1343 6.844 20.451 17.469 0.1705 -0.0777 -0.1795 54LYS SC1 1344 6.953 20.479 17.751 -0.2098 -0.1662 -0.0066 54LYS SC2 1345 6.922 20.345 18.045 0.1607 -0.0510 0.4927 55GLU BB 1346 6.498 20.348 17.427 -0.1072 -0.1792 -0.0284 55GLU SC1 1347 6.493 20.292 17.785 0.0323 0.2521 -0.0550 56GLU BB 1348 6.231 20.534 17.317 -0.2371 -0.2727 0.1210 56GLU SC1 1349 6.148 20.392 17.030 -0.1845 -0.0858 -0.0284 57PRO BB 1350 6.122 20.622 17.594 -0.1004 -0.0176 -0.1222 57PRO SC1 1351 5.848 20.464 17.511 -0.2670 0.1669 -0.0554 58LYS BB 1352 6.155 20.639 17.940 0.2452 0.0075 -0.1563 58LYS SC1 1353 6.082 20.301 17.958 0.0975 0.0720 -0.0883 58LYS SC2 1354 5.788 20.247 17.854 0.0807 0.3613 0.1870 59GLU BB 1355 6.219 20.920 18.118 -0.1967 -0.0953 -0.1297 59GLU SC1 1356 6.089 20.739 18.453 -0.0015 -0.1911 0.1500 60GLU BB 1357 6.259 21.229 17.998 -0.0189 0.1396 0.0294 60GLU SC1 1358 6.652 21.286 17.921 -0.1254 0.1431 0.1983 61GLU BB 1359 5.964 21.326 17.858 0.0918 0.0239 -0.2375 61GLU SC1 1360 5.895 21.006 17.673 0.0322 -0.2578 0.1190 1LYS BB 1361 9.688 18.607 16.768 -0.0594 -0.1726 0.2540 1LYS SC1 1362 9.595 18.313 16.603 -0.0703 0.2222 -0.0468 1LYS SC2 1363 9.543 18.094 16.360 -0.2637 0.0871 0.1118 2LYS BB 1364 9.532 18.597 17.065 -0.1050 -0.3728 0.1153 2LYS SC1 1365 9.210 18.587 17.041 -0.0171 0.3681 0.0841 2LYS SC2 1366 8.949 18.565 17.292 -0.1785 -0.2151 0.1153 3CYS BB 1367 9.591 18.946 17.078 -0.0563 -0.0497 0.1583 3CYS SC1 1368 9.744 19.020 17.370 0.1014 0.2845 -0.4145 4LEU BB 1369 9.535 19.163 16.828 -0.1052 -0.0740 0.1069 4LEU SC1 1370 9.190 19.281 16.785 -0.1399 0.1662 -0.3052 5PHE BB 1371 9.732 19.381 16.616 0.0509 -0.1671 -0.2584 5PHE SC1 1372 9.652 19.643 16.785 0.3596 -0.2719 0.1281 5PHE SC2 1373 9.564 19.695 17.109 -0.1130 0.5265 -0.0986 5PHE SC3 1374 9.836 19.770 17.041 0.1355 -0.0532 0.1848 6LYS BB 1375 9.898 19.334 16.363 -0.0416 -0.1042 -0.0310 6LYS SC1 1376 9.757 19.403 16.134 0.1489 -0.0609 -0.1605 6LYS SC2 1377 9.453 19.402 15.978 -0.2222 -0.2739 -0.3414 7LYS BB 1378 10.163 19.469 16.388 0.2968 0.0360 -0.1233 7LYS SC1 1379 10.088 19.683 16.178 -0.1873 0.1476 -0.1974 7LYS SC2 1380 9.976 19.867 15.958 0.0049 -0.0036 -0.1202 8LYS BB 1381 10.448 19.274 16.507 0.1073 -0.1062 -0.1633 8LYS SC1 1382 10.547 19.383 16.223 -0.2388 -0.0513 0.2852 8LYS SC2 1383 10.851 19.562 16.126 -0.1585 0.1165 -0.3516 9ASN BB 1384 10.539 19.208 16.786 0.0099 -0.1781 0.2202 9ASN SC1 1385 10.540 18.897 16.667 0.1188 0.0794 -0.0338 10LYS BB 1386 10.458 19.367 17.066 0.1014 0.3056 0.0478 10LYS SC1 1387 10.185 19.121 17.208 -0.3144 -0.0866 0.0657 10LYS SC2 1388 10.146 18.954 17.513 -0.0316 0.1105 0.1621 11LYS BB 1389 10.681 19.302 17.278 0.1501 -0.0186 0.0532 11LYS SC1 1390 10.914 19.260 17.141 -0.1765 0.0266 -0.1323 11LYS SC2 1391 11.026 19.062 16.912 -0.0264 -0.1788 -0.2559 12LYS BB 1392 10.751 19.483 17.518 0.2870 -0.4453 -0.0225 12LYS SC1 1393 10.936 19.686 17.369 -0.1081 0.3653 -0.0101 12LYS SC2 1394 11.031 20.021 17.299 0.0110 0.4047 0.0103 13GLY BB 1395 10.705 19.726 17.764 0.3091 -0.0123 0.0953 14LYS BB 1396 10.452 19.750 17.949 0.0357 -0.0321 0.1474 14LYS SC1 1397 10.297 19.890 17.680 -0.1616 0.2297 -0.0671 14LYS SC2 1398 10.096 20.099 17.515 -0.2330 -0.1329 -0.2166 15GLU BB 1399 10.365 20.004 18.177 -0.1005 0.2627 0.0134 15GLU SC1 1400 10.602 20.259 18.026 -0.1368 -0.0112 -0.1854 16LYS BB 1401 10.376 19.973 18.500 -0.2948 0.3190 0.0687 16LYS SC1 1402 10.715 20.027 18.446 0.0052 -0.2422 -0.1608 16LYS SC2 1403 10.879 19.883 18.178 -0.0659 -0.2931 -0.0774 17GLY BB 1404 10.504 20.141 18.775 0.2170 0.2969 0.0258 18GLY BB 1405 10.777 20.292 18.836 -0.3367 0.0384 -0.1278 19LYS BB 1406 10.996 20.059 18.799 0.0208 -0.0635 0.1489 19LYS SC1 1407 11.159 20.035 18.509 -0.5147 -0.1319 0.1190 19LYS SC2 1408 11.521 20.149 18.541 0.1247 0.0174 -0.1333 20ASN BB 1409 11.282 19.995 18.966 -0.3533 -0.1693 0.0654 20ASN SC1 1410 11.105 19.815 19.232 -0.1348 0.3853 0.1241 21ALA BB 1411 11.498 20.174 19.188 0.2872 0.2885 -0.4605 21ALA SC1 1412 11.292 20.214 19.359 0.5103 -0.4607 0.0336 22ILE BB 1413 11.446 20.485 19.085 -0.1531 -0.0177 -0.0618 22ILE SC1 1414 11.115 20.410 19.112 -0.1615 0.1638 0.4501 23ASN BB 1415 11.547 20.757 19.286 -0.0287 0.1651 0.0480 23ASN SC1 1416 11.682 20.708 19.582 0.1311 0.1435 0.1963 24MET BB 1417 11.647 21.108 19.240 -0.1094 -0.0151 -0.2122 24MET SC1 1418 11.614 21.237 19.558 0.3485 -0.0402 -0.4299 25LYS BB 1419 11.817 21.185 19.028 -0.3957 0.0888 0.3047 25LYS SC1 1420 11.623 21.287 18.821 -0.2315 0.0084 0.0706 25LYS SC2 1421 11.373 21.381 18.565 0.0068 -0.0763 -0.0713 26ASP BB 1422 12.128 21.134 19.101 0.0294 0.0173 -0.1248 26ASP SC1 1423 12.234 20.939 18.837 -0.1658 0.1228 0.1323 27VAL BB 1424 12.182 21.503 18.973 0.1580 0.0718 -0.2221 27VAL SC1 1425 11.932 21.648 19.015 -0.1992 -0.5701 -0.0007 28LYS BB 1426 12.292 21.651 18.694 0.1396 -0.1186 -0.1660 28LYS SC1 1427 12.078 21.661 18.431 -0.1045 -0.1183 -0.2258 28LYS SC2 1428 12.056 21.761 18.063 0.0444 0.4768 -0.0028 29ASP BB 1429 12.497 21.587 18.467 0.0533 -0.0497 0.0715 29ASP SC1 1430 12.681 21.914 18.435 0.2988 -0.4412 0.3039 30LEU BB 1431 12.811 21.410 18.467 0.1146 0.0541 -0.1652 30LEU SC1 1432 13.045 21.469 18.746 0.1721 0.4903 -0.1622 31GLY BB 1433 12.969 21.660 18.211 0.1790 -0.0395 0.1759 32LYS BB 1434 13.230 21.484 18.090 0.1594 -0.3440 -0.2907 32LYS SC1 1435 13.320 21.241 18.118 -0.4195 0.0904 0.1494 32LYS SC2 1436 13.452 20.967 18.025 -0.0566 -0.1235 0.4592 33THR BB 1437 13.373 21.781 17.971 -0.4071 -0.1434 -0.1364 33THR SC1 1438 13.396 22.011 18.170 -0.0407 -0.1869 -0.1217 34MET BB 1439 13.470 21.686 17.645 0.0005 0.1905 -0.2676 34MET SC1 1440 13.865 21.704 17.661 -0.1023 0.3585 0.2409 35LYS BB 1441 13.369 21.707 17.349 0.0592 -0.0038 0.0813 35LYS SC1 1442 13.417 21.416 17.212 0.5666 0.0049 -0.3716 35LYS SC2 1443 13.254 21.124 17.284 0.1594 -0.0087 -0.3486 36ASP BB 1444 13.064 21.720 17.307 -0.4150 -0.1516 0.0567 36ASP SC1 1445 12.958 21.459 17.196 -0.5128 0.1935 0.1265 37GLN BB 1446 12.877 21.975 17.275 -0.1378 0.1024 0.0770 37GLN SC1 1447 12.688 22.003 17.613 0.2200 0.1669 0.0135 38ALA BB 1448 12.903 22.273 17.261 -0.1152 -0.2293 0.1089 38ALA SC1 1449 12.692 22.440 17.241 0.0548 -0.0292 -0.0545 39LEU BB 1450 13.063 22.453 16.946 0.1935 0.0615 -0.1209 39LEU SC1 1451 12.750 22.456 16.763 0.2127 0.3281 -0.2819 40LYS BB 1452 13.229 22.714 16.849 0.1795 -0.2713 -0.1193 40LYS SC1 1453 13.052 22.792 16.584 -0.0480 0.1407 -0.1711 40LYS SC2 1454 13.003 22.966 16.287 0.1285 -0.0167 0.0565 41ASP BB 1455 13.264 23.001 17.039 -0.0126 -0.0945 -0.0712 41ASP SC1 1456 13.539 23.119 16.927 -0.0454 -0.0553 0.3291 42ASP BB 1457 13.338 22.928 17.329 0.0827 -0.1685 0.0279 42ASP SC1 1458 13.181 22.663 17.379 0.1866 -0.1634 -0.2528 43ASP BB 1459 13.619 23.025 17.368 0.2468 0.0440 0.0497 43ASP SC1 1460 13.646 23.104 17.696 -0.3881 -0.0217 -0.2423 44ALA BB 1461 13.740 22.711 17.468 -0.0445 0.2745 -0.1585 44ALA SC1 1462 13.997 22.764 17.406 0.1771 -0.1417 0.3317 45GLU BB 1463 13.569 22.447 17.529 0.2711 0.0785 0.1596 45GLU SC1 1464 13.757 22.187 17.795 -0.0478 -0.0092 -0.2046 46THR BB 1465 13.642 22.185 17.301 -0.1751 -0.3326 -0.1938 46THR SC1 1466 13.361 22.207 17.181 -0.1174 0.0581 -0.2698 47GLY BB 1467 13.972 22.134 17.385 0.1224 -0.4982 0.2403 48LEU BB 1468 14.198 21.840 17.255 0.0025 -0.1235 0.1514 48LEU SC1 1469 13.910 21.709 17.183 0.1085 -0.0015 -0.1972 49THR BB 1470 14.438 21.654 17.381 -0.1167 0.0271 -0.1269 49THR SC1 1471 14.463 21.622 17.684 0.0671 0.1275 -0.1313 50ASP BB 1472 14.698 21.604 17.220 0.1047 0.3320 -0.1469 50ASP SC1 1473 14.667 21.469 16.951 -0.1029 -0.1073 0.2325 51GLY BB 1474 14.927 21.580 17.405 -0.2540 0.0784 0.0752 52GLU BB 1475 15.209 21.472 17.422 -0.1375 -0.3097 0.1163 52GLU SC1 1476 15.376 21.678 17.149 -0.2491 0.2360 -0.0386 53GLU BB 1477 15.359 21.203 17.334 -0.2900 0.0979 0.0791 53GLU SC1 1478 15.362 21.084 16.938 -0.1743 -0.1486 -0.1981 54LYS BB 1479 15.695 21.118 17.425 0.0193 0.1176 0.1948 54LYS SC1 1480 15.733 20.841 17.344 -0.0461 0.0801 0.1934 54LYS SC2 1481 15.976 20.564 17.299 0.0335 0.1433 -0.1225 55GLU BB 1482 15.797 21.233 17.757 -0.1914 0.1700 0.0962 55GLU SC1 1483 16.040 21.490 17.849 0.4135 -0.1391 0.0697 56GLU BB 1484 15.487 21.338 17.815 -0.0593 -0.2607 -0.4372 56GLU SC1 1485 15.406 21.558 18.138 -0.1939 0.0438 -0.0093 57PRO BB 1486 15.139 21.224 17.830 -0.2591 -0.1984 -0.1422 57PRO SC1 1487 15.056 20.934 17.824 -0.0300 0.2300 0.1326 58LYS BB 1488 15.012 21.255 18.134 0.0266 -0.1759 -0.0910 58LYS SC1 1489 14.691 21.167 18.058 -0.2917 0.2089 0.0698 58LYS SC2 1490 14.665 20.965 18.362 -0.2737 -0.1726 -0.4122 59GLU BB 1491 15.142 21.218 18.410 -0.1078 0.3269 -0.0501 59GLU SC1 1492 14.883 21.372 18.685 0.1555 0.0230 0.0505 60GLU BB 1493 15.233 20.972 18.631 -0.0529 0.2576 -0.2179 60GLU SC1 1494 14.913 20.868 18.822 0.0455 -0.1674 -0.0265 61GLU BB 1495 15.484 20.811 18.523 -0.1488 -0.0501 -0.1662 61GLU SC1 1496 15.778 20.666 18.748 0.2879 0.0836 0.0378 1LYS BB 1497 10.999 14.697 2.387 -0.2489 0.0510 0.1431 1LYS SC1 1498 11.277 14.627 2.571 0.0129 -0.3306 -0.0188 1LYS SC2 1499 11.580 14.725 2.687 -0.0703 -0.0609 -0.1567 2LYS BB 1500 10.811 14.745 2.627 0.3845 -0.0627 -0.1265 2LYS SC1 1501 10.854 14.474 2.800 0.1152 -0.2394 -0.1159 2LYS SC2 1502 10.765 14.192 3.043 0.2330 0.1024 0.5524 3CYS BB 1503 10.560 14.940 2.489 -0.1419 -0.1764 -0.3195 3CYS SC1 1504 10.315 14.754 2.623 0.3823 0.1818 -0.2640 4LEU BB 1505 10.386 15.152 2.676 -0.1996 0.0893 -0.1080 4LEU SC1 1506 10.209 15.241 2.369 -0.1768 0.0999 -0.0877 5PHE BB 1507 10.557 15.322 2.893 0.1711 -0.2751 0.4144 5PHE SC1 1508 10.645 15.501 2.707 -0.2037 -0.0398 0.1392 5PHE SC2 1509 10.370 15.597 2.533 -0.0658 -0.0515 -0.0894 5PHE SC3 1510 10.594 15.780 2.520 -0.0237 -0.0959 0.0032 6LYS BB 1511 10.501 15.453 3.166 -0.1074 0.0309 -0.3692 6LYS SC1 1512 10.738 15.647 3.255 0.3186 -0.1792 0.1877 6LYS SC2 1513 10.531 15.963 3.265 0.2802 -0.4532 -0.3565 7LYS BB 1514 10.251 15.489 3.381 0.0148 0.0679 -0.0587 7LYS SC1 1515 10.453 15.467 3.621 -0.2646 -0.1304 -0.2956 7LYS SC2 1516 10.815 15.408 3.626 0.1042 -0.0084 0.3965 8LYS BB 1517 9.965 15.272 3.395 0.1331 0.2687 0.1674 8LYS SC1 1518 9.696 15.487 3.352 0.0216 -0.0550 0.1557 8LYS SC2 1519 9.597 15.593 3.042 0.4064 -0.1490 0.1888 9ASN BB 1520 10.084 15.040 3.562 -0.0452 0.0108 0.0592 9ASN SC1 1521 10.263 14.766 3.419 -0.0103 -0.1171 -0.1043 10LYS BB 1522 9.912 14.870 3.789 -0.0185 -0.0014 -0.1776 10LYS SC1 1523 9.854 15.128 3.967 -0.1934 0.3111 -0.2053 10LYS SC2 1524 9.546 15.231 4.131 -0.0150 -0.0903 -0.2366 11LYS BB 1525 9.946 14.549 3.862 -0.0274 0.3293 0.0132 11LYS SC1 1526 10.188 14.389 3.706 0.1103 0.1305 0.0594 11LYS SC2 1527 10.235 14.060 3.626 -0.1299 -0.2071 -0.3345 12LYS BB 1528 9.735 14.311 3.908 0.1715 0.0181 0.5100 12LYS SC1 1529 9.703 14.219 3.608 0.1066 -0.2896 -0.0874 12LYS SC2 1530 9.479 14.241 3.355 0.0103 0.1707 -0.1622 13GLY BB 1531 9.586 14.080 4.122 -0.0485 0.0027 0.4573 14LYS BB 1532 9.373 13.968 4.265 -0.0603 -0.0199 -0.0450 14LYS SC1 1533 9.145 13.705 4.153 -0.1903 0.1996 -0.4100 14LYS SC2 1534 9.092 13.422 4.353 0.0874 0.1892 0.0858 15GLU BB 1535 9.125 14.138 4.422 0.2654 0.3247 -0.1790 15GLU SC1 1536 8.964 13.784 4.589 0.0074 -0.1569 0.0700 16LYS BB 1537 8.928 14.231 4.187 0.0627 -0.0021 0.1108 16LYS SC1 1538 8.902 14.012 3.958 -0.1863 -0.1325 0.4303 16LYS SC2 1539 8.895 13.950 3.656 -0.0721 0.1825 -0.0847 17GLY BB 1540 8.777 14.519 4.127 0.1070 -0.0778 -0.2193 18GLY BB 1541 8.457 14.488 4.289 -0.0227 -0.2300 0.1441 19LYS BB 1542 8.245 14.489 4.034 0.0443 -0.0364 -0.2258 19LYS SC1 1543 8.257 14.804 4.051 0.0310 0.2131 0.0885 19LYS SC2 1544 8.388 15.084 3.866 0.1901 -0.0413 -0.1597 20ASN BB 1545 8.059 14.250 3.864 0.3298 0.0419 -0.3267 20ASN SC1 1546 7.798 14.360 4.038 -0.0093 -0.0834 -0.1828 21ALA BB 1547 8.104 13.912 3.881 0.1488 0.1721 0.1722 21ALA SC1 1548 8.323 13.825 3.748 0.1636 -0.1764 0.4114 22ILE BB 1549 7.968 13.695 4.092 -0.0125 0.0400 0.1443 22ILE SC1 1550 7.772 13.505 3.888 -0.0931 0.1264 0.1407 23ASN BB 1551 8.204 13.720 4.337 0.2678 0.0179 0.0411 23ASN SC1 1552 8.126 13.906 4.609 0.3079 -0.1119 0.0345 24MET BB 1553 8.117 13.458 4.584 -0.2323 0.3242 0.3282 24MET SC1 1554 7.843 13.588 4.856 0.1424 0.2642 -0.1939 25LYS BB 1555 8.287 13.188 4.575 0.0484 0.0152 0.1151 25LYS SC1 1556 8.242 13.017 4.324 0.1124 0.0503 0.1806 25LYS SC2 1557 8.015 13.097 4.085 -0.0669 0.2619 -0.0113 26ASP BB 1558 8.571 13.090 4.730 0.3295 0.1684 0.0688 26ASP SC1 1559 8.610 13.184 5.091 -0.2730 -0.2054 -0.3301 27VAL BB 1560 8.409 12.745 4.606 -0.0084 -0.0777 0.1016 27VAL SC1 1561 8.673 12.628 4.565 0.1590 0.2840 0.1050 28LYS BB 1562 8.261 12.461 4.710 0.2819 0.3889 -0.0362 28LYS SC1 1563 8.518 12.319 4.809 0.4288 -0.0242 -0.1509 28LYS SC2 1564 8.769 12.400 5.032 0.0450 0.0013 0.1337 29ASP BB 1565 8.050 12.428 4.921 0.0016 0.0490 0.1257 29ASP SC1 1566 8.054 12.100 4.946 -0.3988 0.0363 0.0831 30LEU BB 1567 7.765 12.519 4.936 0.1912 -0.1921 0.1270 30LEU SC1 1568 7.528 12.481 4.670 -0.3570 0.1384 -0.4744 31GLY BB 1569 7.714 12.817 4.979 -0.2091 0.4334 0.2007 32LYS BB 1570 7.815 13.061 5.181 -0.1032 -0.0429 0.0725 32LYS SC1 1571 7.568 13.105 5.290 0.1960 0.1499 -0.3579 32LYS SC2 1572 7.451 13.036 5.622 0.0635 0.1906 -0.0406 33THR BB 1573 8.134 13.092 5.233 -0.1554 0.2914 -0.0621 33THR SC1 1574 8.176 13.279 4.997 0.3040 -0.0831 -0.2939 34MET BB 1575 8.271 12.979 5.477 0.0986 -0.1350 -0.3452 34MET SC1 1576 8.509 13.285 5.592 0.0759 0.1060 0.0836 35LYS BB 1577 8.372 12.687 5.648 -0.2120 -0.1273 -0.0842 35LYS SC1 1578 8.604 12.879 5.797 0.1065 0.2141 0.3485 35LYS SC2 1579 8.838 13.056 6.023 0.3033 0.1429 -0.1181 36ASP BB 1580 8.072 12.571 5.726 0.0769 0.0374 -0.0056 36ASP SC1 1581 7.814 12.773 5.536 -0.1604 0.2575 -0.1201 37GLN BB 1582 8.069 12.343 5.993 0.0352 -0.0466 0.0673 37GLN SC1 1583 8.104 12.002 5.804 0.1695 -0.1624 0.1594 38ALA BB 1584 7.845 12.492 6.207 0.3104 0.4753 -0.2288 38ALA SC1 1585 7.887 12.548 6.468 -0.3666 -0.3236 0.0993 39LEU BB 1586 7.508 12.353 6.333 0.2550 0.1856 0.0080 39LEU SC1 1587 7.253 12.503 6.135 0.0296 0.3469 0.3172 40LYS BB 1588 7.555 12.262 6.602 -0.5035 0.1598 -0.1073 40LYS SC1 1589 7.830 12.226 6.661 -0.2113 0.2487 -0.0503 40LYS SC2 1590 7.929 12.074 6.999 0.2417 -0.1147 -0.0690 41ASP BB 1591 7.412 12.099 6.816 -0.5678 -0.0172 0.1927 41ASP SC1 1592 7.626 11.807 6.775 0.2325 0.0383 0.0225 42ASP BB 1593 7.075 12.117 6.861 -0.2792 -0.1664 0.0181 42ASP SC1 1594 7.121 12.236 7.177 -0.1861 0.0378 0.2409 43ASP BB 1595 6.816 11.971 6.805 0.2402 0.0056 -0.0304 43ASP SC1 1596 6.850 11.903 6.453 0.2752 0.4055 -0.2079 44ALA BB 1597 6.763 11.757 7.038 -0.0047 -0.1006 0.2238 44ALA SC1 1598 6.654 11.551 6.902 -0.1028 0.2171 -0.2014 45GLU BB 1599 6.754 11.894 7.338 -0.0539 0.2759 -0.0218 45GLU SC1 1600 6.930 11.541 7.491 0.1487 0.1388 -0.1035 46THR BB 1601 6.747 12.211 7.379 0.1388 -0.0664 0.0127 46THR SC1 1602 6.802 12.198 7.679 0.0037 0.2419 0.0555 47GLY BB 1603 6.497 12.456 7.285 0.1882 0.1523 0.3231 48LEU BB 1604 6.474 12.806 7.290 -0.2099 -0.0012 0.2080 48LEU SC1 1605 6.177 12.959 7.484 -0.2838 0.1676 0.3501 49THR BB 1606 6.595 12.966 7.001 -0.0592 0.0347 0.1493 49THR SC1 1607 6.788 13.136 7.165 0.4383 -0.2150 -0.1533 50ASP BB 1608 6.501 12.878 6.680 0.1413 0.2912 -0.0254 50ASP SC1 1609 6.561 12.658 6.464 -0.0747 -0.0641 -0.2405 51GLY BB 1610 6.221 12.971 6.617 0.1505 0.3897 -0.0967 52GLU BB 1611 6.027 13.210 6.530 0.1076 -0.0962 -0.0316 52GLU SC1 1612 6.297 13.398 6.755 0.1997 0.1287 0.2812 53GLU BB 1613 6.040 13.224 6.214 -0.1714 -0.0940 0.1093 53GLU SC1 1614 6.172 13.611 6.208 -0.1821 -0.0626 -0.3247 54LYS BB 1615 5.916 13.055 5.939 0.1656 -0.1583 0.0516 54LYS SC1 1616 5.656 13.213 6.026 -0.2469 -0.1463 0.0689 54LYS SC2 1617 5.343 13.251 6.083 0.1668 -0.1981 0.0586 55GLU BB 1618 5.980 12.807 5.719 0.3186 0.0319 0.0789 55GLU SC1 1619 5.924 12.513 5.954 0.0374 0.2013 -0.0997 56GLU BB 1620 5.817 12.712 5.437 0.0485 -0.0186 -0.2351 56GLU SC1 1621 6.125 12.845 5.218 0.0842 0.0517 0.0634 57PRO BB 1622 5.609 12.451 5.382 -0.3740 0.4462 0.0434 57PRO SC1 1623 5.870 12.330 5.242 0.0248 0.5906 -0.2587 58LYS BB 1624 5.421 12.383 5.098 0.1566 0.1844 0.0979 58LYS SC1 1625 5.634 12.263 4.868 0.0331 0.0394 0.3773 58LYS SC2 1626 5.509 11.932 4.697 -0.1078 -0.1377 0.1777 59GLU BB 1627 5.238 12.141 5.061 -0.0031 0.1588 -0.3998 59GLU SC1 1628 5.239 12.017 5.434 0.1531 0.0527 0.2944 60GLU BB 1629 4.924 12.046 4.941 -0.0923 -0.0478 0.3259 60GLU SC1 1630 5.053 11.947 4.558 -0.3871 -0.0720 -0.0507 61GLU BB 1631 4.665 12.210 5.100 -0.0849 0.0899 0.0626 61GLU SC1 1632 4.357 12.400 4.899 0.0867 0.0069 -0.2673 1LYS BB 1633 11.573 26.139 13.738 -0.1348 -0.2988 -0.0113 1LYS SC1 1634 11.667 25.850 13.814 -0.5245 -0.1452 -0.1351 1LYS SC2 1635 11.819 25.712 14.113 -0.3255 -0.0226 0.1243 2LYS BB 1636 11.737 26.148 13.495 0.1230 -0.0195 -0.2962 2LYS SC1 1637 11.577 26.001 13.254 0.1801 -0.1045 -0.1264 2LYS SC2 1638 11.237 25.927 13.141 -0.0844 0.1595 0.0303 3CYS BB 1639 11.986 26.003 13.500 0.0676 0.0889 -0.0036 3CYS SC1 1640 12.035 25.787 13.751 -0.2364 -0.2016 -0.1873 4LEU BB 1641 12.233 25.990 13.225 -0.0864 -0.2001 0.1713 4LEU SC1 1642 12.005 26.267 13.098 -0.3330 0.0858 -0.1159 5PHE BB 1643 12.446 26.237 13.149 -0.1715 -0.0013 0.2765 5PHE SC1 1644 12.332 26.457 13.325 -0.0227 0.2904 0.0308 5PHE SC2 1645 12.010 26.451 13.436 0.0334 0.3929 0.2050 5PHE SC3 1646 12.197 26.292 13.590 -0.0232 -0.0982 -0.2048 6LYS BB 1647 12.340 26.323 12.803 0.1117 0.0831 0.3142 6LYS SC1 1648 12.088 26.439 12.727 0.1038 -0.1325 0.1959 6LYS SC2 1649 11.785 26.667 12.707 -0.2289 -0.0694 -0.0265 7LYS BB 1650 12.574 26.533 12.789 0.2261 0.1122 -0.1271 7LYS SC1 1651 12.847 26.395 12.610 0.2065 0.0632 -0.1525 7LYS SC2 1652 13.014 26.095 12.703 -0.1094 -0.0618 0.0881 8LYS BB 1653 12.450 26.844 12.686 0.0527 0.0800 0.1770 8LYS SC1 1654 12.175 26.817 12.540 -0.0147 0.4262 0.0706 8LYS SC2 1655 12.136 26.661 12.223 -0.3215 -0.0637 0.0863 9ASN BB 1656 12.540 27.172 12.554 0.1446 0.1393 -0.0898 9ASN SC1 1657 12.590 27.003 12.262 -0.3136 0.0076 0.0609 10LYS BB 1658 12.757 27.370 12.681 0.2108 -0.2960 -0.1520 10LYS SC1 1659 12.591 27.580 12.845 -0.2061 -0.1135 -0.1009 10LYS SC2 1660 12.654 27.915 12.882 0.1483 0.0422 -0.0954 11LYS BB 1661 13.050 27.319 12.646 0.1695 -0.1677 0.1091 11LYS SC1 1662 13.101 27.325 12.373 0.1884 -0.1890 0.2702 11LYS SC2 1663 13.182 27.595 12.120 0.2343 0.2906 -0.2003 12LYS BB 1664 13.238 27.118 12.762 -0.1557 -0.0192 -0.2610 12LYS SC1 1665 13.338 26.988 12.488 0.0392 0.0477 -0.2578 12LYS SC2 1666 13.268 26.710 12.211 -0.2324 -0.1737 -0.2296 13GLY BB 1667 13.390 27.194 13.094 0.0569 -0.1429 -0.0065 14LYS BB 1668 13.476 27.107 13.352 0.1474 0.0476 0.1711 14LYS SC1 1669 13.509 26.804 13.368 0.0875 0.0234 -0.1725 14LYS SC2 1670 13.379 26.514 13.452 -0.1669 -0.0357 0.0454 15GLU BB 1671 13.413 27.206 13.667 0.0652 -0.0454 0.1776 15GLU SC1 1672 13.438 26.891 13.816 -0.0574 0.3296 0.1398 16LYS BB 1673 13.663 27.310 13.885 -0.0327 0.1581 0.0747 16LYS SC1 1674 13.943 27.180 13.788 0.0221 0.0179 0.2467 16LYS SC2 1675 14.149 27.284 13.520 0.2476 -0.2692 -0.0094 17GLY BB 1676 13.708 27.526 14.172 -0.2063 0.0760 -0.0816 18GLY BB 1677 13.500 27.730 14.290 0.2113 -0.0962 0.4104 19LYS BB 1678 13.313 27.613 14.544 0.0999 -0.2938 0.0813 19LYS SC1 1679 13.594 27.627 14.693 0.1950 0.0690 -0.0112 19LYS SC2 1680 13.913 27.491 14.628 0.2578 0.0811 -0.1449 20ASN BB 1681 13.087 27.814 14.669 0.1928 -0.1002 0.2784 20ASN SC1 1682 13.094 28.086 14.477 -0.1717 0.0650 0.0020 21ALA BB 1683 13.139 27.853 14.979 -0.2588 -0.1693 -0.0281 21ALA SC1 1684 13.408 27.864 14.953 -0.2888 0.1467 -0.2624 22ILE BB 1685 13.210 27.489 15.022 0.2069 -0.2082 -0.0569 22ILE SC1 1686 13.365 27.631 15.291 0.0480 -0.0591 -0.0428 23ASN BB 1687 12.977 27.295 14.849 0.2279 0.1054 0.1062 23ASN SC1 1688 13.139 27.206 14.593 0.2542 -0.1144 -0.1607 24MET BB 1689 13.018 26.950 14.964 0.3870 0.2149 -0.0974 24MET SC1 1690 12.951 27.015 15.308 0.0903 -0.1150 0.0527 25LYS BB 1691 13.226 26.799 14.764 0.1038 0.2014 -0.2405 25LYS SC1 1692 13.139 26.519 14.805 0.3674 -0.2420 -0.2458 25LYS SC2 1693 13.250 26.212 14.685 0.1341 -0.0861 0.1518 26ASP BB 1694 13.538 26.801 14.813 -0.1297 -0.0355 0.0906 26ASP SC1 1695 13.510 26.682 15.157 0.1027 -0.3305 -0.2060 27VAL BB 1696 13.747 27.066 14.786 -0.0246 -0.1788 0.1163 27VAL SC1 1697 13.512 27.225 14.854 -0.0863 -0.2383 0.0440 28LYS BB 1698 14.077 27.067 14.727 0.1109 0.2425 -0.2938 28LYS SC1 1699 14.312 26.992 14.614 0.1403 -0.3549 0.2338 28LYS SC2 1700 14.591 27.146 14.484 -0.2196 0.1949 0.2694 29ASP BB 1701 14.125 27.210 15.034 -0.2175 -0.0770 0.1584 29ASP SC1 1702 14.275 27.434 14.835 -0.0356 -0.0010 0.2452 30LEU BB 1703 13.938 27.397 15.203 -0.0210 -0.1141 -0.2128 30LEU SC1 1704 13.778 27.668 15.125 -0.2630 -0.1122 -0.2327 31GLY BB 1705 13.983 27.613 15.473 0.0926 0.3731 0.0943 32LYS BB 1706 14.007 27.567 15.832 -0.3597 -0.0496 -0.1188 32LYS SC1 1707 13.913 27.825 15.889 -0.4711 -0.1571 0.1799 32LYS SC2 1708 13.691 28.082 15.884 -0.2398 -0.1338 0.0067 33THR BB 1709 14.071 27.319 15.953 0.1260 0.0307 -0.1512 33THR SC1 1710 13.969 27.032 15.944 -0.2362 0.1527 -0.1058 34MET BB 1711 14.278 27.265 16.160 0.0094 -0.0120 -0.3784 34MET SC1 1712 14.327 27.644 16.284 -0.1407 0.1732 0.0990 35LYS BB 1713 14.514 27.002 16.088 0.1509 0.3075 -0.1891 35LYS SC1 1714 14.837 27.046 16.037 0.3157 -0.3373 -0.0745 35LYS SC2 1715 15.094 27.252 15.919 -0.4337 -0.1332 -0.0951 36ASP BB 1716 14.358 26.707 16.098 0.0280 0.1721 -0.1986 36ASP SC1 1717 14.451 26.549 16.445 0.0565 0.1030 0.5117 37GLN BB 1718 14.075 26.655 16.241 -0.0384 0.1264 -0.1172 37GLN SC1 1719 13.816 26.868 16.333 0.1958 -0.0704 -0.0838 38ALA BB 1720 13.908 26.372 16.403 -0.1877 0.1250 0.2652 38ALA SC1 1721 13.899 26.236 16.637 0.4560 -0.3443 0.0471 39LEU BB 1722 14.039 26.153 16.221 -0.1034 -0.1687 0.1311 39LEU SC1 1723 14.108 26.229 15.934 0.0261 -0.1925 0.1465 40LYS BB 1724 14.077 25.778 16.180 0.0717 -0.0737 0.0405 40LYS SC1 1725 14.237 25.829 15.937 -0.1361 0.0084 -0.0779 40LYS SC2 1726 14.443 25.678 15.716 0.1597 -0.0095 -0.2231 41ASP BB 1727 13.811 25.560 16.110 -0.0179 -0.3067 0.1226 41ASP SC1 1728 14.033 25.421 15.865 0.3453 -0.1386 -0.0594 42ASP BB 1729 13.651 25.476 16.359 -0.0083 -0.1043 0.0339 42ASP SC1 1730 13.317 25.437 16.366 0.0738 -0.0522 0.2610 43ASP BB 1731 13.737 25.372 16.635 -0.0369 0.1525 -0.3123 43ASP SC1 1732 14.007 25.153 16.590 -0.0175 0.0196 -0.1203 44ALA BB 1733 13.436 25.292 16.770 -0.1819 -0.1374 0.1789 44ALA SC1 1734 13.501 25.434 16.990 -0.0762 0.0894 0.0048 45GLU BB 1735 13.394 25.003 16.671 0.1335 -0.2157 0.1186 45GLU SC1 1736 13.014 25.137 16.592 -0.0601 -0.0369 0.0825 46THR BB 1737 13.643 24.850 16.551 0.0930 0.0712 0.2290 46THR SC1 1738 13.708 24.687 16.302 -0.0200 0.2442 0.0837 47GLY BB 1739 13.868 24.722 16.730 -0.2413 -0.1594 -0.1573 48LEU BB 1740 13.890 24.547 17.013 0.0447 -0.0107 -0.1653 48LEU SC1 1741 14.116 24.810 17.123 0.1328 -0.0699 -0.2629 49THR BB 1742 14.125 24.278 17.152 0.2920 -0.1728 0.1343 49THR SC1 1743 13.965 24.227 17.406 0.2172 -0.0518 0.1121 50ASP BB 1744 14.325 24.119 17.016 0.3757 -0.2521 0.0602 50ASP SC1 1745 14.122 23.854 16.920 0.1343 0.0448 0.0155 51GLY BB 1746 14.497 24.239 16.809 -0.1167 -0.3184 0.0799 52GLU BB 1747 14.810 24.321 16.791 -0.2583 0.1386 -0.1754 52GLU SC1 1748 14.861 24.111 17.086 0.0096 0.2509 -0.2569 53GLU BB 1749 14.920 24.581 16.864 -0.0612 -0.2127 -0.3864 53GLU SC1 1750 14.865 24.752 16.513 0.3118 0.3301 0.0386 54LYS BB 1751 14.998 24.747 17.103 -0.3083 -0.0855 -0.0453 54LYS SC1 1752 15.174 24.671 17.351 -0.0723 0.0162 -0.0482 54LYS SC2 1753 15.094 24.856 17.644 -0.1131 -0.0119 0.1236 55GLU BB 1754 15.213 25.022 16.976 0.1508 -0.3096 -0.0119 55GLU SC1 1755 15.248 25.175 17.331 -0.0611 -0.3782 0.0432 56GLU BB 1756 15.296 25.011 16.646 0.0561 0.0246 0.1242 56GLU SC1 1757 15.584 24.776 16.503 -0.1215 0.0697 -0.0190 57PRO BB 1758 15.359 25.317 16.670 -0.1589 -0.0276 0.3727 57PRO SC1 1759 15.310 25.337 16.364 -0.3249 0.1042 -0.0584 58LYS BB 1760 15.619 25.489 16.618 0.2108 -0.0112 0.0323 58LYS SC1 1761 15.809 25.213 16.559 0.1729 0.3478 0.1756 58LYS SC2 1762 15.952 25.007 16.304 0.0715 0.1462 -0.3162 59GLU BB 1763 15.678 25.751 16.461 -0.1459 -0.0761 0.1303 59GLU SC1 1764 16.009 25.952 16.522 0.1134 0.3850 0.4729 60GLU BB 1765 15.508 25.985 16.364 0.1246 -0.0422 -0.0155 60GLU SC1 1766 15.333 26.113 16.649 0.0736 0.1147 -0.0763 61GLU BB 1767 15.493 25.953 16.036 -0.1116 0.0960 0.1076 61GLU SC1 1768 15.733 25.979 15.780 -0.0175 0.0381 0.0372 1LYS BB 1769 11.141 28.810 13.473 0.0513 -0.2287 -0.1339 1LYS SC1 1770 11.020 28.570 13.291 -0.3936 -0.1698 0.2618 1LYS SC2 1771 10.793 28.408 13.180 -0.0357 -0.0889 0.1930 2LYS BB 1772 11.423 28.840 13.339 -0.0205 0.0174 0.0719 2LYS SC1 1773 11.591 29.049 13.465 0.3294 -0.0723 -0.1569 2LYS SC2 1774 11.856 29.290 13.391 -0.2639 0.0499 0.1303 3CYS BB 1775 11.459 28.605 13.085 0.0970 0.0800 0.1086 3CYS SC1 1776 11.440 28.351 13.284 -0.3165 -0.5519 0.0045 4LEU BB 1777 11.754 28.580 12.920 0.0203 -0.0550 -0.1101 4LEU SC1 1778 11.922 28.868 12.800 -0.1181 0.3155 0.0633 5PHE BB 1779 11.720 28.263 12.798 -0.2001 0.0202 0.2155 5PHE SC1 1780 12.051 28.184 12.869 0.0836 0.4030 0.0395 5PHE SC2 1781 12.382 28.253 12.911 0.1592 -0.0942 0.3468 5PHE SC3 1782 12.318 28.094 12.678 0.0653 0.4153 0.0082 6LYS BB 1783 11.393 28.141 12.794 -0.0107 -0.0114 -0.3667 6LYS SC1 1784 11.401 27.949 12.532 0.0206 0.5107 -0.2099 6LYS SC2 1785 11.498 27.893 12.153 0.1318 0.0680 0.1147 7LYS BB 1786 11.163 28.139 13.044 -0.2791 -0.0725 -0.0915 7LYS SC1 1787 10.943 28.024 12.923 -0.4261 -0.0621 -0.1630 7LYS SC2 1788 10.818 27.694 12.939 0.2695 0.0575 0.0385 8LYS BB 1789 11.287 27.933 13.263 -0.1033 0.5194 -0.1317 8LYS SC1 1790 11.537 27.776 13.093 0.0014 0.0642 -0.0129 8LYS SC2 1791 11.701 27.512 12.993 0.2028 -0.0129 -0.2655 9ASN BB 1792 11.243 27.806 13.595 0.0432 -0.0698 0.1123 9ASN SC1 1793 10.991 27.930 13.751 -0.3208 0.0161 -0.0986 10LYS BB 1794 11.358 27.660 13.840 -0.1540 0.0537 -0.0427 10LYS SC1 1795 11.269 27.343 13.737 0.0875 -0.2176 0.2327 10LYS SC2 1796 10.975 27.427 13.581 0.0450 -0.1750 0.0057 11LYS BB 1797 11.624 27.780 13.955 0.0418 0.2310 0.3993 11LYS SC1 1798 11.902 27.756 13.868 0.2290 -0.2705 -0.1704 11LYS SC2 1799 12.229 27.740 13.666 0.1793 -0.0612 -0.0476 12LYS BB 1800 11.611 27.731 14.248 0.3228 -0.1271 0.1484 12LYS SC1 1801 11.936 27.676 14.334 -0.0589 0.1485 0.0757 12LYS SC2 1802 12.144 27.611 14.669 -0.1696 0.1677 -0.0706 13GLY BB 1803 11.567 27.426 14.375 -0.0782 -0.1630 0.1068 14LYS BB 1804 11.277 27.373 14.345 0.3160 -0.3137 -0.1614 14LYS SC1 1805 11.325 27.117 14.164 -0.3207 -0.1419 0.1206 14LYS SC2 1806 11.614 26.901 14.263 -0.0144 0.1820 0.4062 15GLU BB 1807 11.057 27.415 14.602 0.2349 -0.0309 -0.0014 15GLU SC1 1808 11.316 27.779 14.670 0.0180 -0.0252 -0.0447 16LYS BB 1809 10.880 27.162 14.719 0.1031 -0.0361 -0.3721 16LYS SC1 1810 10.998 26.897 14.601 -0.0449 0.0374 0.0560 16LYS SC2 1811 11.154 26.585 14.689 0.4669 -0.2306 -0.5099 17GLY BB 1812 10.669 27.134 14.949 0.0637 -0.0464 -0.1289 18GLY BB 1813 10.408 27.315 15.108 -0.4353 -0.0826 0.1879 19LYS BB 1814 10.600 27.345 15.410 -0.2250 -0.1237 0.0295 19LYS SC1 1815 10.903 27.517 15.366 0.0013 -0.0006 -0.3100 19LYS SC2 1816 11.171 27.674 15.501 0.1324 -0.1086 -0.1689 20ASN BB 1817 10.528 27.191 15.698 -0.1271 -0.2999 0.0781 20ASN SC1 1818 10.821 27.174 15.807 0.2586 -0.0253 -0.2140 21ALA BB 1819 10.295 27.364 15.912 -0.3846 0.0605 -0.2116 21ALA SC1 1820 10.317 27.137 16.057 0.5391 0.1698 -0.1223 22ILE BB 1821 10.044 27.520 15.841 0.0116 0.1046 0.1011 22ILE SC1 1822 9.845 27.327 15.643 0.2295 0.1193 -0.1380 23ASN BB 1823 9.786 27.542 16.059 -0.0603 -0.2890 -0.1218 23ASN SC1 1824 9.932 27.243 16.186 -0.1920 0.1749 -0.2135 24MET BB 1825 9.811 27.836 16.267 0.2035 -0.0690 -0.2248 24MET SC1 1826 10.111 27.961 16.033 -0.0020 -0.1355 0.1061 25LYS BB 1827 9.533 27.960 16.451 0.0144 -0.1810 0.1251 25LYS SC1 1828 9.457 28.194 16.694 -0.2092 0.0715 -0.1115 25LYS SC2 1829 9.344 28.188 17.035 0.0397 0.2917 0.3075 26ASP BB 1830 9.324 27.732 16.434 -0.1683 0.1482 0.0115 26ASP SC1 1831 9.614 27.496 16.507 0.5432 -0.0207 0.2013 27VAL BB 1832 9.344 27.496 16.169 0.1316 -0.0593 0.3141 27VAL SC1 1833 9.077 27.438 16.067 0.2170 -0.1709 0.1501 28LYS BB 1834 9.451 27.161 16.125 0.0675 -0.1661 0.1877 28LYS SC1 1835 9.328 27.071 16.409 0.3015 -0.0065 -0.4980 28LYS SC2 1836 9.128 26.853 16.643 0.1164 -0.1662 0.1690 29ASP BB 1837 9.652 27.043 15.880 -0.0824 0.0657 -0.0658 29ASP SC1 1838 9.841 26.843 16.099 -0.0728 0.2713 -0.1881 30LEU BB 1839 9.646 26.898 15.561 -0.2579 -0.2295 -0.0480 30LEU SC1 1840 9.387 27.024 15.371 0.1349 0.0167 0.0722 31GLY BB 1841 9.515 26.578 15.446 -0.2244 0.1052 0.2421 32LYS BB 1842 9.197 26.589 15.387 0.1338 -0.2925 -0.3245 32LYS SC1 1843 9.222 26.330 15.567 0.4627 -0.3300 -0.2604 32LYS SC2 1844 9.055 26.078 15.735 0.1893 -0.5852 0.4551 33THR BB 1845 9.035 26.760 15.174 0.0541 -0.0685 0.1247 33THR SC1 1846 8.789 26.836 15.338 -0.0701 -0.1558 -0.0193 34MET BB 1847 9.151 26.907 14.906 0.0428 0.1505 -0.1630 34MET SC1 1848 9.394 27.159 14.922 0.0346 0.1354 0.4458 35LYS BB 1849 9.258 26.692 14.644 -0.2091 0.0628 -0.1898 35LYS SC1 1850 9.333 26.869 14.387 0.2292 0.2781 -0.3168 35LYS SC2 1851 9.323 27.237 14.457 0.4263 0.0129 0.0229 36ASP BB 1852 9.478 26.439 14.552 0.1714 -0.1032 0.0944 36ASP SC1 1853 9.819 26.499 14.658 -0.0096 0.1201 -0.1700 37GLN BB 1854 9.473 26.293 14.271 -0.3443 -0.0637 0.2132 37GLN SC1 1855 9.327 26.551 14.006 0.1667 -0.0163 0.0031 38ALA BB 1856 9.308 26.049 14.262 -0.0147 0.2216 0.2234 38ALA SC1 1857 9.263 26.048 14.528 -0.1413 0.2245 0.2025 39LEU BB 1858 9.253 25.749 14.131 0.1316 0.0503 -0.0071 39LEU SC1 1859 9.157 25.712 14.440 0.0287 0.1528 -0.1551 40LYS BB 1860 9.415 25.644 13.875 -0.3647 -0.1950 0.1858 40LYS SC1 1861 9.564 25.404 14.035 0.1532 0.1818 0.3230 40LYS SC2 1862 9.936 25.404 14.140 0.2341 -0.1490 -0.1258 41ASP BB 1863 9.725 25.775 13.848 -0.1987 -0.2956 -0.1139 41ASP SC1 1864 9.743 26.086 13.987 -0.0861 -0.0878 0.0070 42ASP BB 1865 9.914 25.801 13.605 0.0460 0.0888 0.1075 42ASP SC1 1866 10.138 25.548 13.751 0.0858 -0.1261 -0.0815 43ASP BB 1867 10.078 26.062 13.589 0.1381 0.0758 -0.2842 43ASP SC1 1868 10.032 26.153 13.255 0.0510 -0.1830 -0.0473 44ALA BB 1869 10.369 25.970 13.581 0.2307 -0.2395 0.0623 44ALA SC1 1870 10.446 25.940 13.838 0.3646 0.3766 0.1080 45GLU BB 1871 10.574 26.156 13.379 0.2287 0.0631 0.0674 45GLU SC1 1872 10.907 26.023 13.512 -0.1619 0.2374 0.0207 46THR BB 1873 10.432 26.329 13.148 0.2410 0.1155 0.1637 46THR SC1 1874 10.583 26.593 13.172 0.1093 0.2033 0.0467 47GLY BB 1875 10.611 26.252 12.849 0.1342 0.2157 -0.1736 48LEU BB 1876 10.609 26.348 12.517 0.0174 0.1294 -0.0972 48LEU SC1 1877 10.502 26.663 12.673 0.1621 0.3849 0.5799 49THR BB 1878 10.477 26.224 12.245 -0.0867 -0.1242 0.1696 49THR SC1 1879 10.173 26.251 12.257 -0.0883 -0.0855 0.0571 50ASP BB 1880 10.620 26.171 11.971 -0.1081 -0.0079 -0.0016 50ASP SC1 1881 10.921 26.269 11.929 0.0058 -0.1075 0.3066 51GLY BB 1882 10.711 25.874 12.076 -0.0385 -0.4174 0.0672 52GLU BB 1883 11.001 25.675 12.112 -0.0572 0.0568 0.0799 52GLU SC1 1884 10.974 25.435 11.835 0.2585 -0.0065 -0.1185 53GLU BB 1885 11.115 25.702 12.416 -0.1360 0.1937 0.2477 53GLU SC1 1886 10.741 25.764 12.509 0.2448 -0.1781 -0.4409 54LYS BB 1887 11.393 25.510 12.471 0.0258 -0.0775 0.0805 54LYS SC1 1888 11.398 25.286 12.723 0.2046 -0.1587 0.1959 54LYS SC2 1889 11.367 25.065 13.010 0.4168 -0.4390 0.1063 55GLU BB 1890 11.713 25.417 12.336 0.2857 0.2030 0.1879 55GLU SC1 1891 11.940 25.738 12.398 0.2305 0.2609 0.1479 56GLU BB 1892 11.682 25.119 12.107 0.2218 -0.0772 -0.0722 56GLU SC1 1893 11.446 24.960 12.354 -0.0325 -0.1120 -0.3289 57PRO BB 1894 11.909 24.912 11.967 0.2235 0.1843 -0.0192 57PRO SC1 1895 11.775 24.958 11.686 0.0945 0.0247 0.1520 58LYS BB 1896 12.035 24.773 12.221 0.0429 0.0168 0.1705 58LYS SC1 1897 12.037 25.078 12.418 -0.0139 0.0738 -0.0735 58LYS SC2 1898 12.258 25.359 12.547 -0.1493 0.0238 -0.0814 59GLU BB 1899 12.363 24.719 12.274 -0.0664 0.0645 -0.0416 59GLU SC1 1900 12.559 24.385 12.278 -0.2342 -0.0735 -0.2092 60GLU BB 1901 12.528 25.046 12.200 0.2000 -0.0652 0.1055 60GLU SC1 1902 12.698 25.084 12.577 0.0245 -0.1090 -0.3521 61GLU BB 1903 12.719 25.173 12.008 -0.1435 0.1293 0.0527 61GLU SC1 1904 13.017 25.268 12.230 0.0354 0.2011 0.0947 1LYS BB 1905 -1.015 -3.022 5.714 -0.0239 -0.0388 -0.0137 1LYS SC1 1906 -0.750 -3.071 5.946 0.1963 0.2319 -0.3288 1LYS SC2 1907 -0.454 -3.076 6.209 0.2489 -0.2084 0.2188 2LYS BB 1908 -1.329 -3.204 5.716 0.1408 -0.0396 0.0440 2LYS SC1 1909 -1.635 -3.064 5.633 -0.0190 -0.0808 0.0510 2LYS SC2 1910 -1.609 -2.897 5.338 -0.0006 0.2712 0.2526 3CYS BB 1911 -1.441 -3.499 5.674 -0.1561 -0.0065 -0.0479 3CYS SC1 1912 -1.737 -3.480 5.572 0.0825 -0.1508 -0.1250 4LEU BB 1913 -1.251 -3.797 5.698 -0.0382 0.0789 -0.2738 4LEU SC1 1914 -1.272 -3.872 6.040 -0.0888 0.3422 0.3382 5PHE BB 1915 -0.937 -3.880 5.606 -0.3479 -0.2415 0.1562 5PHE SC1 1916 -0.770 -3.803 5.882 0.2275 0.1735 -0.0566 5PHE SC2 1917 -0.926 -3.909 6.165 0.0267 0.2593 -0.1328 5PHE SC3 1918 -0.636 -3.919 6.172 0.0176 -0.2065 -0.1044 6LYS BB 1919 -0.699 -3.721 5.387 -0.0901 -0.1357 0.0252 6LYS SC1 1920 -0.449 -3.717 5.603 0.1614 0.2275 -0.0213 6LYS SC2 1921 -0.333 -3.793 5.927 -0.1236 -0.0385 -0.2832 7LYS BB 1922 -0.488 -3.870 5.206 -0.0171 0.0835 -0.2143 7LYS SC1 1923 -0.294 -4.050 5.371 0.1686 -0.1276 -0.0345 7LYS SC2 1924 -0.136 -4.346 5.246 0.3775 0.1656 -0.0024 8LYS BB 1925 -0.599 -3.783 4.886 0.3951 -0.3152 -0.0863 8LYS SC1 1926 -0.861 -3.898 4.914 0.2628 0.0059 0.0255 8LYS SC2 1927 -1.121 -4.120 4.791 0.2058 0.2501 -0.3550 9ASN BB 1928 -0.579 -3.876 4.556 -0.0766 0.0472 -0.0553 9ASN SC1 1929 -0.710 -3.545 4.501 -0.2348 0.0605 -0.1980 10LYS BB 1930 -0.305 -3.740 4.327 0.1161 -0.1785 0.0498 10LYS SC1 1931 -0.506 -3.597 4.116 0.1454 -0.0628 0.1053 10LYS SC2 1932 -0.770 -3.801 4.020 -0.1410 0.2561 0.0606 11LYS BB 1933 0.045 -3.685 4.398 -0.0933 -0.1275 0.1970 11LYS SC1 1934 0.082 -3.404 4.263 0.1011 -0.0994 0.0799 11LYS SC2 1935 0.265 -3.084 4.216 0.2428 0.1723 0.2965 12LYS BB 1936 0.246 -3.945 4.478 -0.2243 -0.0246 0.5517 12LYS SC1 1937 0.182 -4.056 4.222 -0.1606 -0.4073 0.4037 12LYS SC2 1938 -0.063 -4.060 3.991 -0.0251 0.0906 -0.0918 13GLY BB 1939 0.460 -3.985 4.705 -0.0539 0.1089 -0.0787 14LYS BB 1940 0.622 -3.680 4.835 0.0386 -0.1174 -0.0988 14LYS SC1 1941 0.298 -3.585 4.796 -0.0559 0.0382 0.1718 14LYS SC2 1942 0.177 -3.423 5.054 -0.1157 -0.1348 -0.5363 15GLU BB 1943 0.614 -3.521 5.108 -0.0338 0.3103 -0.2570 15GLU SC1 1944 0.406 -3.768 5.374 -0.0111 0.0282 0.2647 16LYS BB 1945 0.652 -3.249 5.206 0.0189 0.2022 0.4134 16LYS SC1 1946 0.593 -3.347 5.574 -0.3950 0.1267 -0.3589 16LYS SC2 1947 0.728 -3.262 5.900 -0.3540 -0.2664 -0.2095 17GLY BB 1948 0.506 -3.087 4.950 0.4554 -0.0623 -0.0731 18GLY BB 1949 0.334 -2.829 5.018 -0.0042 0.1335 0.2480 19LYS BB 1950 0.438 -2.774 5.286 0.1975 0.1374 -0.0496 19LYS SC1 1951 0.130 -2.819 5.379 -0.2462 -0.1632 -0.1014 19LYS SC2 1952 -0.209 -2.687 5.418 -0.2175 0.0108 -0.2461 20ASN BB 1953 0.590 -2.551 5.353 0.1407 -0.1313 0.0512 20ASN SC1 1954 0.691 -2.501 5.645 0.1217 0.1283 0.0396 21ALA BB 1955 0.898 -2.450 5.234 -0.1458 0.1039 0.0418 21ALA SC1 1956 0.982 -2.194 5.229 0.1052 0.0230 -0.0941 22ILE BB 1957 1.036 -2.530 4.951 0.2119 -0.1347 0.0345 22ILE SC1 1958 1.376 -2.544 4.936 0.2102 0.0632 -0.2691 23ASN BB 1959 1.046 -2.344 4.711 -0.1244 0.0168 -0.0451 23ASN SC1 1960 1.031 -2.536 4.423 -0.1580 -0.2326 0.5576 24MET BB 1961 1.126 -2.078 4.850 -0.1563 0.0624 -0.1990 24MET SC1 1962 1.500 -2.059 4.889 0.4642 0.0763 0.0477 25LYS BB 1963 0.971 -1.808 4.923 -0.3162 0.0595 -0.3657 25LYS SC1 1964 0.924 -1.798 5.240 0.4458 -0.2405 0.4326 25LYS SC2 1965 0.952 -1.637 5.559 0.1512 0.1481 -0.0281 26ASP BB 1966 1.151 -1.553 4.820 -0.1341 0.1035 0.1266 26ASP SC1 1967 1.114 -1.314 5.087 -0.4525 0.1636 -0.2044 27VAL BB 1968 1.086 -1.318 4.610 -0.0016 0.0532 0.2292 27VAL SC1 1969 1.060 -1.425 4.340 0.0113 -0.2074 0.3285 28LYS BB 1970 1.169 -0.981 4.576 0.1912 0.1601 0.3691 28LYS SC1 1971 1.353 -0.972 4.288 -0.1023 0.4127 0.1962 28LYS SC2 1972 1.249 -1.015 3.972 0.0803 0.1283 -0.1246 29ASP BB 1973 0.970 -0.707 4.503 0.2366 -0.0933 -0.1386 29ASP SC1 1974 0.678 -0.755 4.695 -0.2271 0.1167 0.0953 30LEU BB 1975 0.867 -0.650 4.208 0.0084 0.0587 -0.0730 30LEU SC1 1976 0.791 -0.336 4.062 0.2634 -0.0854 -0.3437 31GLY BB 1977 0.507 -0.704 4.113 -0.2928 0.2307 -0.1133 32LYS BB 1978 0.297 -0.684 4.385 0.0029 0.3963 0.0112 32LYS SC1 1979 0.088 -0.616 4.172 -0.3331 -0.2877 -0.2097 32LYS SC2 1980 0.166 -0.466 3.916 0.1482 -0.0431 0.0739 33THR BB 1981 0.180 -1.011 4.362 0.1329 0.0117 0.1709 33THR SC1 1982 0.306 -1.135 4.611 0.2671 0.0542 0.1255 34MET BB 1983 0.014 -1.188 4.150 0.0050 0.0674 0.0819 34MET SC1 1984 -0.151 -0.857 3.934 -0.0428 0.3407 0.0849 35LYS BB 1985 0.182 -1.409 3.944 0.2113 0.1011 0.0983 35LYS SC1 1986 0.148 -1.309 3.656 0.1078 -0.1492 0.2039 35LYS SC2 1987 0.139 -1.058 3.356 -0.1921 0.4170 0.1324 36ASP BB 1988 0.466 -1.568 4.026 0.1097 0.1434 -0.1633 36ASP SC1 1989 0.383 -1.800 3.742 -0.1533 0.1848 -0.2160 37GLN BB 1990 0.454 -1.473 4.345 -0.0425 -0.0483 0.1400 37GLN SC1 1991 0.111 -1.584 4.495 -0.0138 0.0993 0.0176 38ALA BB 1992 0.741 -1.635 4.430 0.2547 0.0646 -0.2233 38ALA SC1 1993 0.845 -1.684 4.186 -0.2034 -0.4165 -0.3414 39LEU BB 1994 0.806 -1.961 4.482 0.0773 0.1472 0.0034 39LEU SC1 1995 1.098 -1.823 4.458 0.2217 0.1914 0.1045 40LYS BB 1996 0.591 -2.221 4.608 0.1523 0.2203 0.2811 40LYS SC1 1997 0.628 -2.401 4.337 -0.2161 0.0839 -0.3119 40LYS SC2 1998 0.406 -2.458 4.106 0.3206 -0.2625 0.3180 41ASP BB 1999 0.287 -2.174 4.719 -0.0382 -0.0071 0.1063 41ASP SC1 2000 0.158 -2.204 4.395 -0.3012 0.0484 0.0530 42ASP BB 2001 0.234 -1.940 4.892 0.0497 0.2114 -0.0663 42ASP SC1 2002 0.491 -1.750 4.777 0.0388 0.0754 0.0493 43ASP BB 2003 0.095 -1.926 5.158 -0.1823 0.0900 -0.2949 43ASP SC1 2004 0.241 -2.089 5.420 -0.1134 -0.0971 -0.1752 44ALA BB 2005 -0.179 -1.785 5.239 -0.3180 -0.4545 -0.0574 44ALA SC1 2006 -0.244 -1.563 5.377 0.2628 -0.2191 -0.1343 45GLU BB 2007 -0.481 -1.848 5.182 0.3014 -0.0876 0.1946 45GLU SC1 2008 -0.519 -1.456 4.991 0.2043 -0.0520 0.0161 46THR BB 2009 -0.411 -2.051 4.922 -0.1090 0.0181 0.3304 46THR SC1 2010 -0.673 -2.001 4.773 -0.0727 -0.2571 0.1674 47GLY BB 2011 -0.164 -2.234 4.872 -0.3743 -0.1190 0.1608 48LEU BB 2012 -0.192 -2.460 4.637 -0.1101 0.1692 -0.0695 48LEU SC1 2013 -0.057 -2.701 4.873 0.1154 0.1078 -0.3069 49THR BB 2014 -0.367 -2.445 4.312 0.0534 0.0689 -0.0906 49THR SC1 2015 -0.179 -2.354 4.090 -0.0435 -0.3336 -0.3500 50ASP BB 2016 -0.435 -2.788 4.269 0.2199 -0.0257 -0.1164 50ASP SC1 2017 -0.139 -2.857 4.317 0.0797 -0.1566 -0.2186 51GLY BB 2018 -0.589 -2.921 4.068 -0.0335 -0.1744 0.3808 52GLU BB 2019 -0.845 -2.900 3.818 -0.1610 -0.1358 0.0339 52GLU SC1 2020 -0.580 -3.001 3.506 0.1155 -0.2422 -0.2262 53GLU BB 2021 -1.102 -2.767 3.812 0.1127 0.0283 0.0537 53GLU SC1 2022 -1.274 -3.066 4.036 0.2841 -0.0045 -0.2725 54LYS BB 2023 -1.232 -2.584 3.600 0.0844 -0.3374 0.1891 54LYS SC1 2024 -0.977 -2.591 3.421 0.2474 0.2691 0.0424 54LYS SC2 2025 -0.675 -2.516 3.354 0.0270 0.0288 0.0872 55GLU BB 2026 -1.404 -2.324 3.736 -0.4668 0.0816 0.1636 55GLU SC1 2027 -1.230 -2.338 4.088 0.4158 0.0694 -0.2528 56GLU BB 2028 -1.720 -2.261 3.787 0.0337 0.1720 -0.0992 56GLU SC1 2029 -1.733 -2.367 4.170 -0.0615 0.0091 0.0970 57PRO BB 2030 -1.930 -2.406 3.520 -0.3964 -0.4357 0.2079 57PRO SC1 2031 -2.080 -2.581 3.683 -0.0300 0.1790 -0.1769 58LYS BB 2032 -1.791 -2.455 3.221 -0.0612 -0.3295 -0.1451 58LYS SC1 2033 -1.548 -2.366 3.343 0.1705 -0.2701 0.1183 58LYS SC2 2034 -1.559 -2.016 3.370 -0.1341 0.1747 -0.1488 59GLU BB 2035 -1.988 -2.291 2.905 0.2370 -0.3484 0.0260 59GLU SC1 2036 -1.937 -2.580 2.696 -0.0916 -0.0751 -0.2825 60GLU BB 2037 -2.280 -2.120 2.910 -0.4409 -0.0227 -0.0171 60GLU SC1 2038 -2.527 -2.309 3.176 -0.1571 0.0394 -0.0208 61GLU BB 2039 -2.425 -1.907 2.718 0.2026 -0.1147 -0.0079 61GLU SC1 2040 -2.757 -1.839 2.583 -0.2282 0.3607 0.0922 1LYS BB 2041 27.732 12.933 4.967 0.1300 0.1148 -0.0704 1LYS SC1 2042 27.666 12.624 4.850 -0.1874 0.0040 0.3981 1LYS SC2 2043 27.711 12.314 4.679 -0.1321 -0.0897 0.3348 2LYS BB 2044 27.767 13.126 4.706 -0.0265 0.0129 -0.2183 2LYS SC1 2045 28.035 13.212 4.554 0.1379 0.0675 0.1127 2LYS SC2 2046 28.294 13.054 4.391 0.2068 0.3489 -0.1002 3CYS BB 2047 27.604 13.375 4.603 -0.4070 0.2301 -0.1461 3CYS SC1 2048 27.807 13.421 4.346 0.4819 -0.1984 -0.0359 4LEU BB 2049 27.412 13.602 4.662 0.2270 -0.0380 0.2660 4LEU SC1 2050 27.521 13.922 4.514 -0.1253 0.0470 0.0097 5PHE BB 2051 27.081 13.701 4.603 0.0894 0.1974 0.0771 5PHE SC1 2052 27.193 14.000 4.748 -0.0077 -0.0129 -0.3677 5PHE SC2 2053 27.091 14.279 4.912 -0.3791 -0.3932 0.0789 5PHE SC3 2054 27.292 14.122 5.050 0.1132 -0.1651 -0.3447 6LYS BB 2055 27.111 13.794 4.263 -0.0721 0.1208 0.0642 6LYS SC1 2056 26.932 14.050 4.111 0.0085 -0.4066 -0.0929 6LYS SC2 2057 26.925 14.463 4.177 0.3373 0.0422 0.2504 7LYS BB 2058 27.325 13.538 4.178 -0.0817 -0.0071 -0.3744 7LYS SC1 2059 27.607 13.670 4.133 -0.1787 0.2221 0.1772 7LYS SC2 2060 27.777 14.004 4.106 -0.2096 -0.1576 0.1815 8LYS BB 2061 27.272 13.209 4.276 -0.4245 -0.0041 -0.2416 8LYS SC1 2062 27.299 13.120 3.962 -0.2484 -0.1553 -0.1940 8LYS SC2 2063 27.365 13.146 3.630 0.3069 0.1750 0.1474 9ASN BB 2064 26.967 13.134 4.300 0.3881 -0.1090 -0.4132 9ASN SC1 2065 27.005 12.802 4.380 0.0378 -0.0775 0.2071 10LYS BB 2066 26.797 13.038 4.058 0.3688 -0.2067 -0.2214 10LYS SC1 2067 26.932 12.934 3.802 0.2729 0.0868 0.1765 10LYS SC2 2068 27.006 12.663 3.607 -0.0334 0.1844 0.2091 11LYS BB 2069 26.499 13.232 4.067 0.0328 -0.0888 -0.0902 11LYS SC1 2070 26.242 13.224 3.806 -0.4849 -0.1369 -0.2438 11LYS SC2 2071 25.946 13.374 3.731 -0.7197 0.0965 -0.1305 12LYS BB 2072 26.259 13.276 4.255 -0.1110 0.1814 -0.0267 12LYS SC1 2073 26.012 13.474 4.182 -0.4208 0.2704 -0.2141 12LYS SC2 2074 26.013 13.760 4.353 -0.0953 0.0540 -0.0056 13GLY BB 2075 26.198 13.174 4.528 0.0108 0.1442 0.1421 14LYS BB 2076 26.222 12.846 4.727 0.3911 0.3502 0.1094 14LYS SC1 2077 26.403 12.700 4.994 -0.2018 0.0523 0.0830 14LYS SC2 2078 26.687 12.752 5.120 -0.0467 0.0613 -0.1535 15GLU BB 2079 26.007 12.598 4.584 0.1079 -0.0175 -0.2438 15GLU SC1 2080 26.257 12.349 4.706 -0.1850 0.2962 -0.1312 16LYS BB 2081 25.711 12.535 4.400 -0.2159 0.1550 -0.1524 16LYS SC1 2082 25.906 12.509 4.104 -0.3484 0.0415 0.1385 16LYS SC2 2083 26.202 12.357 4.188 -0.1904 0.2017 -0.2156 17GLY BB 2084 25.517 12.683 4.268 0.1204 -0.0153 0.1172 18GLY BB 2085 25.285 12.739 4.449 -0.1360 0.0236 -0.0084 19LYS BB 2086 25.035 12.573 4.459 0.0666 -0.1840 -0.1951 19LYS SC1 2087 24.820 12.747 4.393 0.0254 0.0856 -0.0361 19LYS SC2 2088 24.683 12.706 4.111 -0.2067 0.1497 -0.1636 20ASN BB 2089 25.014 12.248 4.515 0.0205 0.0849 0.1097 20ASN SC1 2090 25.379 12.215 4.427 0.3807 0.1253 -0.1294 21ALA BB 2091 24.792 12.146 4.716 0.2274 0.1132 -0.1019 21ALA SC1 2092 24.530 12.085 4.703 0.1843 0.3342 -0.3485 22ILE BB 2093 24.676 12.439 4.835 0.1180 0.2090 0.1365 22ILE SC1 2094 24.786 12.380 5.152 0.0351 -0.1143 0.1089 23ASN BB 2095 24.382 12.458 4.912 0.2014 -0.1597 -0.0896 23ASN SC1 2096 24.161 12.309 4.695 0.2518 -0.1890 0.0775 24MET BB 2097 24.237 12.427 5.228 0.0696 -0.0243 -0.0816 24MET SC1 2098 24.484 12.345 5.466 0.3294 -0.1005 0.2795 25LYS BB 2099 24.070 12.133 5.205 0.0184 -0.1383 -0.1299 25LYS SC1 2100 24.227 11.913 5.366 0.0969 -0.0248 0.0236 25LYS SC2 2101 24.294 11.619 5.464 0.1253 -0.0037 -0.1808 26ASP BB 2102 23.998 11.965 4.992 0.0884 0.0193 -0.1807 26ASP SC1 2103 24.194 11.696 4.936 -0.3126 0.0546 0.2093 27VAL BB 2104 23.739 12.153 4.830 0.1538 -0.4447 -0.0498 27VAL SC1 2105 23.801 12.071 4.557 -0.0787 -0.5395 -0.0764 28LYS BB 2106 23.502 12.259 5.051 0.1219 0.3458 -0.0172 28LYS SC1 2107 23.243 12.311 4.925 0.1104 -0.2161 -0.0118 28LYS SC2 2108 22.916 12.368 5.127 -0.3646 -0.0677 0.1237 29ASP BB 2109 23.510 12.501 5.319 -0.1698 -0.0438 0.1902 29ASP SC1 2110 23.220 12.408 5.478 0.0310 -0.1923 0.2481 30LEU BB 2111 23.790 12.642 5.422 -0.0477 -0.0460 0.0832 30LEU SC1 2112 23.599 12.947 5.374 0.1083 0.3401 0.0890 31GLY BB 2113 23.993 12.817 5.269 -0.1716 0.1785 0.1289 32LYS BB 2114 24.290 12.889 5.220 -0.0482 -0.0010 -0.1130 32LYS SC1 2115 24.399 13.042 5.514 0.1255 -0.0761 0.2507 32LYS SC2 2116 24.626 12.933 5.739 0.1539 0.0198 -0.1674 33THR BB 2117 24.619 12.774 5.221 -0.0157 -0.0863 0.2394 33THR SC1 2118 24.762 12.965 5.032 0.0113 -0.2357 0.1062 34MET BB 2119 24.867 12.675 5.425 -0.0078 -0.1345 -0.1902 34MET SC1 2120 25.054 12.949 5.350 0.0739 -0.0594 0.1886 35LYS BB 2121 24.929 12.578 5.707 0.1027 -0.0352 0.0994 35LYS SC1 2122 25.241 12.604 5.709 0.2853 0.2718 -0.0481 35LYS SC2 2123 25.485 12.833 5.847 -0.0259 0.0723 -0.1744 36ASP BB 2124 24.739 12.502 5.973 -0.0211 0.0597 0.3604 36ASP SC1 2125 24.732 12.787 6.150 0.2471 -0.0529 0.1436 37GLN BB 2126 24.827 12.192 6.054 -0.0070 -0.1570 -0.3308 37GLN SC1 2127 24.571 12.079 6.349 0.0260 0.1312 0.3040 38ALA BB 2128 25.099 12.279 6.168 0.2598 -0.0062 0.3916 38ALA SC1 2129 25.071 12.116 6.381 0.2332 -0.0677 0.3412 39LEU BB 2130 25.432 12.210 6.291 -0.0313 0.3562 0.0784 39LEU SC1 2131 25.547 11.933 6.449 0.3852 -0.1649 0.3386 40LYS BB 2132 25.548 12.381 6.527 0.0605 0.2911 -0.2037 40LYS SC1 2133 25.243 12.499 6.545 0.1127 0.1336 -0.0680 40LYS SC2 2134 24.922 12.514 6.463 0.6242 -0.3540 0.2013 41ASP BB 2135 25.686 12.644 6.419 0.0650 0.1756 0.1141 41ASP SC1 2136 25.706 12.536 6.087 0.0388 0.3271 -0.2105 42ASP BB 2137 25.887 12.767 6.605 -0.0284 0.0812 0.3309 42ASP SC1 2138 25.898 12.954 6.917 0.3687 0.0344 -0.1979 43ASP BB 2139 26.179 12.865 6.531 -0.3347 -0.0122 -0.1653 43ASP SC1 2140 26.376 12.788 6.252 -0.0158 -0.1428 -0.3695 44ALA BB 2141 26.255 13.160 6.687 -0.0956 0.2937 0.4357 44ALA SC1 2142 26.486 13.073 6.797 -0.0161 -0.1741 -0.0582 45GLU BB 2143 26.144 13.353 6.890 -0.1626 0.0415 0.0596 45GLU SC1 2144 26.134 13.579 6.538 -0.2392 0.0917 -0.1317 46THR BB 2145 26.263 13.586 7.145 -0.0667 -0.0473 -0.0022 46THR SC1 2146 26.563 13.625 7.186 -0.1547 0.2837 0.3947 47GLY BB 2147 25.954 13.620 7.278 0.0275 -0.3077 -0.0365 48LEU BB 2148 25.745 13.645 7.540 -0.0855 -0.3523 -0.0832 48LEU SC1 2149 25.864 13.422 7.794 -0.0314 0.0923 -0.1308 49THR BB 2150 25.745 13.993 7.481 -0.2240 -0.1221 0.2147 49THR SC1 2151 25.703 14.122 7.208 0.3846 -0.0852 0.1244 50ASP BB 2152 25.842 14.199 7.713 -0.1878 0.1561 -0.3690 50ASP SC1 2153 26.155 14.333 7.722 -0.0022 -0.1191 0.3514 51GLY BB 2154 25.672 14.401 7.930 -0.0457 0.1883 -0.2771 52GLU BB 2155 25.374 14.395 8.005 0.0454 -0.1048 -0.1427 52GLU SC1 2156 25.339 14.100 8.228 0.1710 0.2715 -0.3448 53GLU BB 2157 25.092 14.441 7.776 0.3590 -0.1599 0.0862 53GLU SC1 2158 25.257 14.760 7.595 -0.0048 -0.1191 0.2319 54LYS BB 2159 24.859 14.318 8.001 0.0498 0.0592 -0.0132 54LYS SC1 2160 24.983 14.016 7.933 -0.1597 -0.3141 -0.1604 54LYS SC2 2161 25.273 14.000 7.747 0.2132 0.1939 -0.2122 55GLU BB 2162 24.645 14.434 8.192 0.2975 -0.2705 0.0872 55GLU SC1 2163 24.503 14.682 7.950 0.1144 -0.0978 -0.0701 56GLU BB 2164 24.543 14.371 8.512 -0.0133 0.0381 0.3466 56GLU SC1 2165 24.790 14.533 8.725 0.1268 -0.1918 -0.0699 57PRO BB 2166 24.459 14.164 8.731 0.3730 0.0807 -0.1208 57PRO SC1 2167 24.360 13.968 8.473 -0.4406 -0.4675 -0.3012 58LYS BB 2168 24.528 14.267 9.057 -0.0846 -0.3426 0.0188 58LYS SC1 2169 24.261 14.323 9.114 0.1795 -0.0928 -0.4297 58LYS SC2 2170 24.034 14.260 9.373 0.1399 0.2438 0.0180 59GLU BB 2171 24.575 14.074 9.286 0.0279 0.1160 -0.2686 59GLU SC1 2172 24.917 13.823 9.320 0.0979 -0.1778 0.1198 60GLU BB 2173 24.342 13.967 9.485 0.0519 -0.1867 0.0163 60GLU SC1 2174 24.288 13.619 9.393 -0.0595 0.0922 -0.1599 61GLU BB 2175 24.247 14.074 9.799 -0.0912 0.0019 -0.0586 61GLU SC1 2176 24.265 14.478 9.721 0.0260 0.3247 -0.0147 1LYS BB 2177 12.613 23.871 17.022 0.1060 -0.2052 0.2902 1LYS SC1 2178 12.307 23.855 17.106 0.3846 0.3725 0.0744 1LYS SC2 2179 12.049 23.819 17.244 0.1955 -0.3401 0.0096 2LYS BB 2180 12.710 23.595 16.910 -0.1726 -0.2511 0.2855 2LYS SC1 2181 13.031 23.553 16.988 0.0668 -0.0360 -0.0879 2LYS SC2 2182 13.296 23.416 17.177 -0.2169 -0.0319 0.1640 3CYS BB 2183 12.463 23.371 16.892 -0.1064 0.1369 0.0495 3CYS SC1 2184 12.174 23.504 16.997 -0.0365 -0.0777 0.2163 4LEU BB 2185 12.372 23.142 17.103 0.0710 0.0511 0.1277 4LEU SC1 2186 12.259 23.388 17.361 0.2048 -0.0318 0.1771 5PHE BB 2187 12.296 22.882 16.959 -0.0265 -0.3205 0.0093 5PHE SC1 2188 11.962 22.877 16.968 -0.0729 0.1802 0.2519 5PHE SC2 2189 11.739 22.776 17.205 0.0832 0.0748 0.3555 5PHE SC3 2190 11.640 22.975 17.019 -0.1106 -0.0013 0.3749 6LYS BB 2191 12.323 22.545 16.919 0.1643 0.1367 0.0222 6LYS SC1 2192 12.090 22.523 17.154 0.0035 -0.1550 -0.2969 6LYS SC2 2193 11.894 22.457 17.442 0.1986 0.0018 -0.0176 7LYS BB 2194 12.260 22.285 16.707 0.1912 -0.0954 -0.3087 7LYS SC1 2195 12.276 22.410 16.423 0.0318 -0.4139 -0.1276 7LYS SC2 2196 12.128 22.360 16.102 0.2354 0.0764 0.1091 8LYS BB 2197 12.508 22.111 16.661 -0.1005 -0.0436 -0.0230 8LYS SC1 2198 12.505 22.019 16.971 0.0705 -0.2284 -0.1153 8LYS SC2 2199 12.441 21.796 17.290 0.0844 -0.0540 0.3360 9ASN BB 2200 12.644 22.095 16.393 0.0193 0.0894 0.2371 9ASN SC1 2201 12.722 22.427 16.319 -0.1811 -0.0460 -0.2192 10LYS BB 2202 12.671 21.801 16.249 -0.3002 -0.1227 -0.1382 10LYS SC1 2203 12.482 21.700 16.412 0.0710 -0.2382 0.0768 10LYS SC2 2204 12.422 21.413 16.588 0.2311 -0.1117 -0.2781 11LYS BB 2205 12.921 21.604 16.357 0.0188 0.1692 -0.3644 11LYS SC1 2206 13.156 21.796 16.340 0.2973 -0.1141 -0.2532 11LYS SC2 2207 13.497 21.933 16.524 0.0798 0.1154 0.0988 12LYS BB 2208 12.823 21.245 16.377 0.1749 -0.1998 -0.0181 12LYS SC1 2209 13.085 21.113 16.424 0.2275 0.0368 0.3218 12LYS SC2 2210 13.216 20.876 16.242 -0.3285 -0.1257 0.4957 13GLY BB 2211 12.545 21.112 16.307 0.0552 -0.0174 0.2461 14LYS BB 2212 12.326 21.202 16.118 0.0746 -0.0386 0.0489 14LYS SC1 2213 12.066 21.006 16.193 0.2544 -0.2727 -0.1641 14LYS SC2 2214 11.724 20.927 16.340 -0.2372 0.4203 0.0781 15GLU BB 2215 12.258 21.546 16.074 0.1347 0.0318 0.4778 15GLU SC1 2216 11.864 21.648 15.999 0.0016 -0.0490 0.1937 16LYS BB 2217 12.353 21.762 15.875 0.0810 0.0373 -0.0751 16LYS SC1 2218 12.177 22.003 15.809 0.1414 -0.1945 0.1871 16LYS SC2 2219 11.913 22.034 15.559 -0.2416 -0.0391 -0.1565 17GLY BB 2220 12.653 21.741 15.794 -0.0214 0.0308 -0.3885 18GLY BB 2221 12.889 21.513 15.651 -0.1022 -0.0928 0.0989 19LYS BB 2222 12.943 21.610 15.333 0.0769 -0.0650 -0.1444 19LYS SC1 2223 12.660 21.449 15.242 0.2334 0.1193 -0.2199 19LYS SC2 2224 12.390 21.257 15.186 0.0294 -0.0647 -0.0721 20ASN BB 2225 13.198 21.810 15.224 -0.0945 0.0294 -0.0063 20ASN SC1 2226 13.403 21.597 15.305 0.2249 0.1682 -0.1186 21ALA BB 2227 13.111 22.070 15.065 -0.0860 0.1034 -0.1625 21ALA SC1 2228 12.872 22.020 15.179 -0.1179 0.0568 -0.2492 22ILE BB 2229 13.064 22.394 15.162 -0.0700 -0.1979 -0.2074 22ILE SC1 2230 12.802 22.606 15.108 0.1656 0.1786 0.0725 23ASN BB 2231 13.279 22.639 15.133 0.1948 -0.2176 0.1063 23ASN SC1 2232 13.077 22.909 15.095 0.1325 -0.2357 -0.1570 24MET BB 2233 13.547 22.599 15.067 -0.0275 -0.0287 -0.0232 24MET SC1 2234 13.817 22.837 15.273 0.0558 0.0069 0.2767 25LYS BB 2235 13.722 22.363 14.926 -0.0436 -0.3203 0.2285 25LYS SC1 2236 13.472 22.345 14.714 0.3219 0.0584 0.1087 25LYS SC2 2237 13.181 22.508 14.672 -0.2160 -0.1778 -0.3016 26ASP BB 2238 14.014 22.309 14.957 0.1320 -0.0302 0.0693 26ASP SC1 2239 14.139 22.588 15.104 -0.0136 -0.2460 -0.1313 27VAL BB 2240 14.172 22.145 15.218 0.1572 0.0601 -0.0737 27VAL SC1 2241 14.299 22.293 15.435 -0.0583 -0.0221 0.1116 28LYS BB 2242 14.362 21.873 15.169 0.2081 0.0232 0.0130 28LYS SC1 2243 14.226 21.776 14.918 0.0683 0.0037 0.1343 28LYS SC2 2244 13.943 21.894 14.758 -0.1220 0.0073 -0.3453 29ASP BB 2245 14.674 21.815 15.071 0.0000 0.2815 0.1043 29ASP SC1 2246 14.665 21.541 14.842 -0.0704 0.1370 -0.4730 30LEU BB 2247 14.793 21.873 15.376 -0.2305 -0.0883 -0.0545 30LEU SC1 2248 14.501 21.912 15.592 -0.7246 0.1079 -0.0242 31GLY BB 2249 14.983 21.699 15.565 -0.2098 0.2909 0.1147 32LYS BB 2250 15.285 21.773 15.577 -0.1076 -0.0472 -0.4640 32LYS SC1 2251 15.382 21.755 15.294 0.1266 -0.0570 -0.0015 32LYS SC2 2252 15.512 21.900 15.024 0.0079 0.0857 -0.0004 33THR BB 2253 15.394 22.110 15.620 0.0513 0.0244 0.1000 33THR SC1 2254 15.552 22.177 15.367 0.0710 -0.0027 0.1050 34MET BB 2255 15.385 22.371 15.848 0.1892 0.0305 -0.0030 34MET SC1 2256 15.206 22.591 15.603 0.0320 -0.2663 0.2573 35LYS BB 2257 15.507 22.442 16.125 -0.0412 -0.0376 -0.0222 35LYS SC1 2258 15.542 22.163 16.334 -0.2348 -0.1111 -0.0445 35LYS SC2 2259 15.380 21.926 16.444 -0.0065 0.2804 0.2436 36ASP BB 2260 15.622 22.687 16.303 -0.0263 0.1604 0.0044 36ASP SC1 2261 15.493 22.697 16.624 0.2943 0.1054 0.1803 37GLN BB 2262 15.626 23.024 16.282 0.2928 -0.0612 -0.1606 37GLN SC1 2263 15.299 23.141 16.475 -0.3639 -0.3450 -0.1392 38ALA BB 2264 15.877 23.177 16.378 0.0866 0.0990 0.2167 38ALA SC1 2265 16.088 23.082 16.238 -0.2485 -0.1276 -0.1564 39LEU BB 2266 15.995 23.469 16.288 0.0344 -0.1133 0.0801 39LEU SC1 2267 16.282 23.385 16.164 -0.2223 -0.0903 0.2028 40LYS BB 2268 15.956 23.797 16.381 0.1311 -0.1680 0.2062 40LYS SC1 2269 16.250 23.842 16.412 0.2633 0.2635 0.1568 40LYS SC2 2270 16.250 24.198 16.385 0.0094 0.0359 0.1237 41ASP BB 2271 15.686 24.007 16.448 0.0174 -0.1658 -0.0835 41ASP SC1 2272 15.835 24.309 16.376 0.1702 0.0111 0.1739 42ASP BB 2273 15.406 23.817 16.384 0.0092 0.4128 -0.1529 42ASP SC1 2274 15.500 23.510 16.270 -0.2248 0.1040 -0.1201 43ASP BB 2275 15.136 23.869 16.351 0.0324 0.4413 -0.0262 43ASP SC1 2276 15.069 23.533 16.472 -0.1415 0.2310 -0.1720 44ALA BB 2277 14.917 23.765 16.148 -0.2715 -0.0102 0.1567 44ALA SC1 2278 14.914 23.852 15.893 -0.4043 -0.0310 0.1505 45GLU BB 2279 14.608 23.877 16.237 0.1352 0.3934 -0.3271 45GLU SC1 2280 14.472 24.157 16.018 0.0050 -0.2306 0.0605 46THR BB 2281 14.281 23.677 16.120 0.1581 -0.2247 0.2989 46THR SC1 2282 14.486 23.582 15.915 -0.0757 0.4369 -0.2804 47GLY BB 2283 13.974 23.609 16.273 -0.2534 -0.0774 0.0446 48LEU BB 2284 13.800 23.716 16.570 0.0843 0.1516 0.0280 48LEU SC1 2285 13.564 23.471 16.332 -0.0914 -0.2033 0.1005 49THR BB 2286 13.545 23.967 16.610 -0.0245 0.1067 -0.0865 49THR SC1 2287 13.365 23.922 16.368 -0.1149 -0.1733 0.0297 50ASP BB 2288 13.522 24.305 16.727 0.2990 -0.2452 0.0468 50ASP SC1 2289 13.474 24.355 17.057 0.2052 0.2775 -0.0339 51GLY BB 2290 13.237 24.336 16.605 -0.0227 0.5324 0.2238 52GLU BB 2291 13.028 24.218 16.274 0.0473 0.0591 -0.3788 52GLU SC1 2292 12.632 24.333 16.289 -0.0031 0.1702 0.1490 53GLU BB 2293 13.105 24.416 15.950 -0.3808 0.2910 -0.1495 53GLU SC1 2294 12.740 24.473 15.818 -0.2495 0.1993 0.0359 54LYS BB 2295 13.178 24.300 15.656 0.1434 0.3343 0.2250 54LYS SC1 2296 13.389 24.472 15.535 -0.0993 0.2732 -0.0742 54LYS SC2 2297 13.733 24.430 15.455 0.0560 -0.1191 -0.1604 55GLU BB 2298 13.178 24.025 15.611 -0.1389 -0.3173 0.0415 55GLU SC1 2299 13.196 23.817 15.947 -0.0555 -0.1532 0.1352 56GLU BB 2300 13.070 23.829 15.326 -0.0375 0.1456 -0.0612 56GLU SC1 2301 13.377 23.677 15.230 0.0463 0.2926 0.1046 57PRO BB 2302 12.907 23.890 15.016 -0.0251 -0.1483 -0.1281 57PRO SC1 2303 12.730 23.618 15.005 -0.0914 0.0542 0.1535 58LYS BB 2304 12.997 24.217 14.943 -0.0761 -0.2267 0.2044 58LYS SC1 2305 12.789 24.416 14.848 -0.2030 -0.1267 -0.0606 58LYS SC2 2306 12.785 24.570 14.553 0.0208 0.4779 -0.1973 59GLU BB 2307 13.257 24.418 14.780 0.1423 0.2503 0.2246 59GLU SC1 2308 13.559 24.568 15.004 -0.3009 -0.2347 -0.2514 60GLU BB 2309 13.243 24.399 14.475 -0.2313 0.3426 0.1382 60GLU SC1 2310 13.428 24.098 14.322 0.1774 0.0092 -0.3554 61GLU BB 2311 13.206 24.636 14.280 -0.3032 -0.0383 -0.0347 61GLU SC1 2312 13.331 24.568 13.966 -0.2371 -0.0156 0.2466 1LYS BB 2313 -0.587 4.667 9.993 0.2667 -0.2176 -0.0679 1LYS SC1 2314 -0.333 4.559 9.844 -0.0564 0.0410 -0.0974 1LYS SC2 2315 -0.042 4.742 9.733 -0.2153 0.3777 0.1236 2LYS BB 2316 -0.528 4.566 10.271 0.1004 0.3105 -0.2945 2LYS SC1 2317 -0.414 4.784 10.476 0.3880 0.1156 0.4990 2LYS SC2 2318 -0.347 5.130 10.492 0.1125 -0.0591 0.1937 3CYS BB 2319 -0.713 4.324 10.366 -0.0576 0.0614 0.2610 3CYS SC1 2320 -0.480 4.267 10.586 -0.4168 0.1592 -0.2781 4LEU BB 2321 -1.027 4.433 10.412 -0.0597 -0.2461 0.0482 4LEU SC1 2322 -0.914 4.568 10.718 0.1775 0.1531 -0.2930 5PHE BB 2323 -1.198 4.696 10.345 -0.2887 0.2358 0.1133 5PHE SC1 2324 -1.354 4.944 10.468 -0.1298 -0.2689 -0.3116 5PHE SC2 2325 -1.502 5.202 10.302 0.0286 -0.1819 -0.3195 5PHE SC3 2326 -1.684 5.019 10.434 -0.0874 -0.1014 -0.3666 6LYS BB 2327 -1.126 4.814 10.041 0.0114 0.1019 -0.0827 6LYS SC1 2328 -1.119 5.091 10.157 -0.0705 -0.3535 0.1736 6LYS SC2 2329 -0.993 5.438 10.279 -0.1140 -0.5015 -0.1243 7LYS BB 2330 -1.284 4.759 9.763 -0.1829 0.2523 -0.3495 7LYS SC1 2331 -1.317 5.047 9.609 -0.0711 0.4311 0.0690 7LYS SC2 2332 -1.149 5.191 9.314 -0.2718 0.0388 0.2730 8LYS BB 2333 -1.609 4.756 9.849 0.1222 0.1554 0.0069 8LYS SC1 2334 -1.615 5.020 10.003 0.0068 -0.3232 0.0810 8LYS SC2 2335 -1.763 5.344 9.966 0.4757 -0.5045 0.1191 9ASN BB 2336 -1.854 4.567 9.782 -0.2129 -0.0513 0.0834 9ASN SC1 2337 -2.006 4.596 10.065 0.2858 -0.1185 0.1566 10LYS BB 2338 -1.756 4.485 9.469 0.0607 -0.1849 0.2790 10LYS SC1 2339 -1.478 4.423 9.626 -0.1565 0.2176 -0.1887 10LYS SC2 2340 -1.346 4.362 9.964 -0.1597 0.0667 -0.0794 11LYS BB 2341 -1.905 4.321 9.146 0.1255 0.0838 -0.2932 11LYS SC1 2342 -1.684 4.566 9.004 0.0698 0.0130 -0.1389 11LYS SC2 2343 -1.700 4.892 8.816 0.2595 -0.3747 0.2099 12LYS BB 2344 -2.233 4.159 9.214 -0.0483 0.1153 0.0765 12LYS SC1 2345 -2.532 4.275 9.209 -0.0833 -0.1049 -0.1413 12LYS SC2 2346 -2.849 4.297 9.362 -0.0298 0.1470 0.0992 13GLY BB 2347 -2.263 3.873 9.059 0.1551 -0.4014 0.1051 14LYS BB 2348 -2.266 3.715 8.763 0.0923 -0.1018 -0.0586 14LYS SC1 2349 -2.111 3.466 8.837 0.0973 0.0107 0.1277 14LYS SC2 2350 -2.306 3.178 8.889 0.0888 0.0183 0.1671 15GLU BB 2351 -2.307 3.907 8.527 -0.0870 -0.1425 -0.0273 15GLU SC1 2352 -2.704 3.834 8.463 0.3507 0.0128 0.1452 16LYS BB 2353 -2.220 4.214 8.444 0.0171 -0.2218 -0.1614 16LYS SC1 2354 -2.448 4.322 8.308 0.3731 0.0688 0.1633 16LYS SC2 2355 -2.777 4.273 8.227 -0.0056 -0.4651 0.2307 17GLY BB 2356 -2.175 4.357 8.721 -0.1863 0.0970 -0.1053 18GLY BB 2357 -1.843 4.433 8.638 0.1756 0.1515 -0.1573 19LYS BB 2358 -1.747 4.446 8.322 -0.1647 -0.0777 0.0451 19LYS SC1 2359 -1.458 4.310 8.313 -0.1009 0.2772 0.0181 19LYS SC2 2360 -1.270 4.181 8.065 -0.1239 -0.1734 0.1816 20ASN BB 2361 -1.969 4.468 8.083 -0.0220 0.0218 -0.1411 20ASN SC1 2362 -2.128 4.149 7.953 0.1570 -0.6330 0.1376 21ALA BB 2363 -1.937 4.709 7.891 -0.3281 0.1719 0.4019 21ALA SC1 2364 -2.151 4.832 7.781 -0.2719 -0.0968 -0.0319 22ILE BB 2365 -1.926 4.581 7.565 0.1392 0.1555 0.4065 22ILE SC1 2366 -2.217 4.638 7.397 0.3993 0.4308 0.0334 23ASN BB 2367 -1.583 4.441 7.543 0.1866 0.1232 0.0304 23ASN SC1 2368 -1.665 4.280 7.811 -0.0938 0.1992 0.0878 24MET BB 2369 -1.414 4.741 7.481 -0.0702 -0.0967 0.0473 24MET SC1 2370 -1.688 5.004 7.449 -0.0847 -0.1742 0.0313 25LYS BB 2371 -1.171 4.840 7.254 -0.0201 -0.0436 -0.2263 25LYS SC1 2372 -1.341 4.991 7.036 -0.2337 0.0058 -0.1182 25LYS SC2 2373 -1.232 5.192 6.727 0.1343 -0.0004 0.2636 26ASP BB 2374 -0.880 4.679 7.317 0.1938 0.2615 0.2241 26ASP SC1 2375 -0.726 4.606 7.601 0.1630 0.1633 0.0775 27VAL BB 2376 -0.708 4.543 7.096 -0.1051 -0.0170 0.2131 27VAL SC1 2377 -0.896 4.437 6.899 -0.0957 0.0768 0.1528 28LYS BB 2378 -0.471 4.620 6.865 0.0010 0.0694 0.2184 28LYS SC1 2379 -0.532 4.317 6.729 -0.0274 0.1323 0.3036 28LYS SC2 2380 -0.764 4.038 6.858 -0.0883 0.0906 -0.0227 29ASP BB 2381 -0.533 4.791 6.622 0.0662 0.1591 0.2724 29ASP SC1 2382 -0.816 4.894 6.800 0.2522 -0.5035 0.1867 30LEU BB 2383 -0.523 4.741 6.312 -0.1851 -0.2138 -0.2623 30LEU SC1 2384 -0.481 4.375 6.260 0.1601 -0.1252 -0.2357 31GLY BB 2385 -0.272 4.825 6.106 0.1637 0.1878 0.0851 32LYS BB 2386 -0.083 5.063 6.043 -0.1454 -0.1332 -0.2642 32LYS SC1 2387 -0.235 5.291 5.977 0.0320 0.3356 0.2875 32LYS SC2 2388 -0.032 5.534 5.927 0.1954 -0.4696 0.0269 33THR BB 2389 0.184 5.118 5.848 0.2984 0.0394 0.2244 33THR SC1 2390 0.133 5.290 5.601 0.2782 0.0673 0.2478 34MET BB 2391 0.476 5.140 5.991 0.1093 -0.0042 0.0477 34MET SC1 2392 0.607 4.874 5.728 -0.0451 -0.1332 0.1976 35LYS BB 2393 0.552 5.193 6.309 -0.0990 0.0810 -0.1942 35LYS SC1 2394 0.839 5.330 6.328 -0.1022 0.0557 -0.0518 35LYS SC2 2395 1.085 5.603 6.262 -0.1122 0.1061 0.2394 36ASP BB 2396 0.401 5.009 6.509 -0.0346 0.1186 -0.1593 36ASP SC1 2397 0.176 4.822 6.368 0.0337 0.0732 0.3265 37GLN BB 2398 0.149 5.121 6.747 0.0689 0.1240 0.3209 37GLN SC1 2399 -0.004 4.819 6.859 0.0481 -0.1276 -0.0992 38ALA BB 2400 0.362 5.377 6.830 0.0178 0.8314 -0.2334 38ALA SC1 2401 0.612 5.390 6.728 0.1738 0.2887 0.0437 39LEU BB 2402 0.444 5.504 7.137 -0.0702 0.1673 -0.0769 39LEU SC1 2403 0.785 5.534 7.152 -0.4187 0.2466 -0.5261 40LYS BB 2404 0.291 5.450 7.437 -0.3751 -0.0079 -0.0963 40LYS SC1 2405 0.363 5.621 7.716 -0.2523 -0.1044 -0.1829 40LYS SC2 2406 0.598 5.819 7.758 -0.1913 0.2262 0.0028 41ASP BB 2407 0.287 5.139 7.501 -0.3222 0.1370 0.1170 41ASP SC1 2408 0.239 5.026 7.174 -0.1187 -0.0061 -0.4465 42ASP BB 2409 0.273 5.007 7.791 0.2382 -0.3643 0.2511 42ASP SC1 2410 0.516 5.194 7.927 -0.1754 -0.1187 0.0705 43ASP BB 2411 0.046 4.864 7.904 -0.0152 0.2390 -0.2220 43ASP SC1 2412 0.037 4.715 8.194 0.0991 -0.1028 0.0514 44ALA BB 2413 -0.292 4.949 7.828 0.0902 -0.0368 0.1508 44ALA SC1 2414 -0.308 4.803 7.601 -0.2438 0.4735 -0.1758 45GLU BB 2415 -0.542 4.797 7.983 0.0462 0.0523 0.0458 45GLU SC1 2416 -0.703 5.089 8.138 -0.2135 -0.0793 0.0553 46THR BB 2417 -0.400 4.643 8.258 0.2024 0.2179 -0.1599 46THR SC1 2418 -0.331 4.802 8.509 0.4208 -0.0367 -0.0537 47GLY BB 2419 -0.185 4.338 8.221 -0.0332 -0.0343 0.2537 48LEU BB 2420 0.008 4.206 8.430 0.0538 -0.1297 -0.1136 48LEU SC1 2421 -0.162 4.410 8.669 0.1168 0.1213 -0.2537 49THR BB 2422 0.266 4.339 8.235 -0.1810 0.0965 -0.1989 49THR SC1 2423 0.496 4.360 8.435 0.0849 -0.3968 -0.4332 50ASP BB 2424 0.244 4.369 7.955 0.2846 0.0932 -0.0255 50ASP SC1 2425 0.415 4.578 7.802 -0.0253 0.0340 -0.1500 51GLY BB 2426 0.438 4.134 7.855 0.1790 0.3325 -0.1062 52GLU BB 2427 0.539 3.932 8.094 0.0049 0.1355 -0.0565 52GLU SC1 2428 0.209 3.773 8.236 -0.1226 0.1549 0.1337 53GLU BB 2429 0.636 3.649 7.843 -0.1277 0.3280 -0.1827 53GLU SC1 2430 0.581 3.770 7.470 0.1466 -0.0978 0.3010 54LYS BB 2431 0.844 3.550 8.018 0.0478 0.5753 -0.0505 54LYS SC1 2432 0.770 3.617 8.292 0.2075 -0.1540 -0.2094 54LYS SC2 2433 0.590 3.476 8.601 -0.0132 -0.1316 0.3341 55GLU BB 2434 1.108 3.399 7.925 -0.0685 0.1101 0.3696 55GLU SC1 2435 1.308 3.645 7.855 -0.1136 0.0075 0.1286 56GLU BB 2436 1.193 3.163 7.698 0.3003 0.2557 0.0243 56GLU SC1 2437 1.191 3.073 7.321 0.1573 0.0997 -0.1101 57PRO BB 2438 1.267 2.844 7.757 -0.1579 0.0585 -0.0129 57PRO SC1 2439 1.538 2.806 7.619 -0.0380 0.4074 0.1157 58LYS BB 2440 1.385 2.754 8.021 -0.3112 0.0492 -0.3057 58LYS SC1 2441 1.473 3.088 8.081 0.2968 -0.2056 -0.1554 58LYS SC2 2442 1.636 3.346 8.037 0.2472 -0.1429 -0.0633 59GLU BB 2443 1.250 2.694 8.334 0.2337 0.0583 -0.0704 59GLU SC1 2444 1.576 2.585 8.503 -0.0213 -0.1435 0.0902 60GLU BB 2445 0.911 2.668 8.335 0.1478 -0.1193 -0.0491 60GLU SC1 2446 0.911 2.490 7.974 0.1624 0.1759 -0.0616 61GLU BB 2447 0.643 2.637 8.567 -0.1599 -0.2122 0.0871 61GLU SC1 2448 0.412 2.881 8.557 0.2527 0.0009 -0.2503 1LYS BB 2449 5.243 9.547 6.612 0.1450 -0.0870 0.2316 1LYS SC1 2450 5.245 9.823 6.661 0.2055 0.2988 -0.0437 1LYS SC2 2451 5.085 10.147 6.692 -0.2749 -0.4005 0.1027 2LYS BB 2452 5.146 9.481 6.968 -0.1871 -0.2834 0.0699 2LYS SC1 2453 4.828 9.421 6.955 -0.3643 -0.0759 -0.2136 2LYS SC2 2454 4.520 9.282 6.893 0.5752 -0.1189 0.0649 3CYS BB 2455 5.267 9.218 7.060 -0.2924 -0.2493 0.1034 3CYS SC1 2456 5.017 9.263 7.313 0.3865 0.3386 0.3923 4LEU BB 2457 5.231 8.924 7.086 -0.1915 0.0247 -0.1989 4LEU SC1 2458 5.087 8.839 7.390 0.0010 0.2068 -0.1204 5PHE BB 2459 5.477 8.692 6.977 0.0359 -0.2149 0.0277 5PHE SC1 2460 5.448 8.379 7.042 -0.0701 -0.0756 -0.4069 5PHE SC2 2461 5.627 8.097 6.981 0.0860 -0.0240 -0.1990 5PHE SC3 2462 5.704 8.243 7.220 0.0616 0.2390 -0.3480 6LYS BB 2463 5.741 8.869 6.970 -0.4067 -0.0956 0.0131 6LYS SC1 2464 5.809 8.946 6.663 0.1420 -0.6198 0.0841 6LYS SC2 2465 5.907 8.950 6.315 0.2734 -0.3415 0.1061 7LYS BB 2466 5.905 9.141 7.086 -0.0006 0.1562 -0.0598 7LYS SC1 2467 6.195 9.038 7.050 -0.0508 -0.1457 -0.1367 7LYS SC2 2468 6.495 9.151 7.011 -0.1678 0.0721 0.1843 8LYS BB 2469 5.688 9.249 7.312 -0.0070 0.3044 0.2677 8LYS SC1 2470 5.568 8.950 7.416 0.4502 0.1470 -0.0377 8LYS SC2 2471 5.682 8.620 7.479 0.0141 -0.0151 -0.0859 9ASN BB 2472 5.671 9.503 7.484 0.1240 0.4623 0.0522 9ASN SC1 2473 5.931 9.677 7.461 -0.0322 0.4940 0.2492 10LYS BB 2474 5.612 9.559 7.812 0.3094 -0.0797 0.0511 10LYS SC1 2475 5.288 9.529 7.926 0.6475 -0.0838 0.3862 10LYS SC2 2476 4.965 9.379 7.979 0.1127 -0.0987 0.0146 11LYS BB 2477 5.916 9.536 7.973 -0.2326 -0.2613 -0.2372 11LYS SC1 2478 5.783 9.738 8.206 -0.2367 -0.0508 -0.0866 11LYS SC2 2479 5.609 10.039 8.278 0.1889 -0.3374 -0.1110 12LYS BB 2480 6.229 9.623 7.802 0.3041 -0.3880 0.0163 12LYS SC1 2481 6.244 9.812 8.089 0.2366 0.0043 0.1435 12LYS SC2 2482 6.377 9.853 8.389 0.0879 -0.2260 -0.0980 13GLY BB 2483 6.388 9.389 7.911 -0.4915 -0.1504 0.4446 14LYS BB 2484 6.178 9.115 8.033 0.0234 0.2120 -0.1422 14LYS SC1 2485 5.993 9.204 8.248 0.3760 0.1409 0.1313 14LYS SC2 2486 5.998 9.209 8.592 0.0666 0.1656 0.0105 15GLU BB 2487 6.257 8.800 8.076 0.0408 -0.2303 -0.0107 15GLU SC1 2488 5.964 8.604 7.868 -0.3148 -0.0009 0.3674 16LYS BB 2489 6.487 8.652 8.070 0.3107 0.3572 -0.0778 16LYS SC1 2490 6.338 8.353 8.014 -0.1219 0.2027 0.1638 16LYS SC2 2491 6.007 8.172 8.056 -0.0878 -0.1167 0.0288 17GLY BB 2492 6.686 8.585 8.304 0.1174 -0.2410 -0.3330 18GLY BB 2493 6.848 8.343 8.119 0.0775 0.2429 0.0846 19LYS BB 2494 7.034 8.486 7.883 0.2883 0.1205 0.0223 19LYS SC1 2495 6.957 8.768 7.849 0.2483 -0.0086 0.2348 19LYS SC2 2496 6.682 8.971 7.817 -0.0322 -0.1307 0.1575 20ASN BB 2497 7.323 8.382 8.015 -0.4594 -0.0929 -0.0532 20ASN SC1 2498 7.436 8.681 8.047 -0.1219 0.1345 -0.4855 21ALA BB 2499 7.314 8.326 8.349 0.1316 -0.1983 0.0644 21ALA SC1 2500 7.077 8.436 8.417 -0.0180 0.0167 -0.7037 22ILE BB 2501 7.477 8.280 8.598 -0.0732 -0.1885 -0.1330 22ILE SC1 2502 7.219 8.319 8.817 -0.0721 -0.0219 -0.1594 23ASN BB 2503 7.525 8.025 8.679 -0.2538 0.0088 0.0618 23ASN SC1 2504 7.739 7.861 8.384 -0.1403 -0.1893 -0.0258 24MET BB 2505 7.384 7.723 8.683 0.0994 -0.3405 0.1729 24MET SC1 2506 7.144 7.816 8.884 -0.0519 -0.0821 -0.2136 25LYS BB 2507 7.213 7.555 8.452 -0.0117 0.0169 -0.1524 25LYS SC1 2508 6.928 7.539 8.599 0.1892 -0.2234 0.0767 25LYS SC2 2509 6.747 7.447 8.876 0.0497 -0.0852 -0.3706 26ASP BB 2510 7.190 7.222 8.357 0.3290 -0.2099 0.2206 26ASP SC1 2511 7.385 7.011 8.181 -0.0464 0.0613 -0.3005 27VAL BB 2512 6.930 7.145 8.318 -0.0357 0.0875 0.2326 27VAL SC1 2513 6.748 7.177 8.544 -0.3473 0.1624 -0.0220 28LYS BB 2514 6.817 7.160 7.994 -0.0184 0.1496 -0.1734 28LYS SC1 2515 7.074 7.282 7.921 0.0680 -0.1619 0.2780 28LYS SC2 2516 7.351 7.440 8.015 -0.1747 -0.0206 -0.4079 29ASP BB 2517 6.603 7.012 7.853 -0.1583 -0.1693 0.0159 29ASP SC1 2518 6.673 7.016 7.526 0.3067 -0.3901 -0.2238 30LEU BB 2519 6.335 7.113 7.822 0.0849 -0.1060 0.1233 30LEU SC1 2520 6.449 7.371 8.071 0.1974 0.1833 -0.1666 31GLY BB 2521 6.094 7.206 8.019 -0.1476 0.2122 -0.0420 32LYS BB 2522 6.203 7.124 8.298 0.0245 -0.0726 -0.0389 32LYS SC1 2523 6.108 7.457 8.318 -0.1607 -0.1828 0.2175 32LYS SC2 2524 5.827 7.542 8.104 -0.0111 -0.1464 -0.0899 33THR BB 2525 6.392 6.876 8.403 0.0427 -0.0406 -0.0948 33THR SC1 2526 6.657 6.797 8.274 0.1018 0.0506 -0.0301 34MET BB 2527 6.479 6.786 8.690 -0.2052 0.2729 0.3175 34MET SC1 2528 6.671 6.973 8.991 0.0537 0.0503 0.0211 35LYS BB 2529 6.547 6.530 8.830 -0.2516 0.0592 0.2571 35LYS SC1 2530 6.648 6.566 9.129 -0.1797 -0.0492 -0.0526 35LYS SC2 2531 6.436 6.463 9.403 0.1216 -0.1116 0.0558 36ASP BB 2532 6.789 6.251 8.840 0.2224 0.1513 0.1877 36ASP SC1 2533 6.582 6.015 9.002 0.2074 -0.0096 -0.2342 37GLN BB 2534 6.830 6.095 8.562 -0.0046 -0.0293 0.1477 37GLN SC1 2535 6.909 6.403 8.362 0.1197 0.2689 0.1723 38ALA BB 2536 6.620 5.983 8.406 -0.4294 0.0980 -0.1258 38ALA SC1 2537 6.462 5.797 8.520 -0.0157 -0.1104 0.1311 39LEU BB 2538 6.618 6.112 8.118 -0.1856 0.1176 0.0064 39LEU SC1 2539 6.525 5.829 7.921 0.4721 0.1130 -0.3129 40LYS BB 2540 6.330 6.222 7.981 0.2967 0.1457 0.1834 40LYS SC1 2541 6.349 6.148 7.739 0.3330 -0.2254 -0.0790 40LYS SC2 2542 6.311 6.174 7.398 0.1334 0.0198 -0.2833 41ASP BB 2543 6.105 6.362 8.143 -0.0998 0.1857 -0.2243 41ASP SC1 2544 5.811 6.168 8.152 0.1419 0.0669 0.0364 42ASP BB 2545 5.925 6.686 8.201 -0.2070 0.3523 -0.1421 42ASP SC1 2546 5.953 6.803 7.884 0.0819 -0.1220 0.1950 43ASP BB 2547 5.824 6.776 8.468 0.2667 0.3753 -0.0274 43ASP SC1 2548 6.003 6.872 8.718 -0.0390 -0.2991 0.3234 44ALA BB 2549 5.561 6.596 8.459 -0.0750 -0.0286 -0.3066 44ALA SC1 2550 5.467 6.752 8.259 -0.2986 0.4705 0.1605 45GLU BB 2551 5.304 6.740 8.621 0.1116 -0.0211 0.2157 45GLU SC1 2552 5.326 7.120 8.494 -0.0795 -0.0717 -0.3430 46THR BB 2553 5.355 6.627 8.860 0.2744 0.0425 0.1436 46THR SC1 2554 5.347 6.773 9.128 -0.2287 0.0817 0.1161 47GLY BB 2555 5.289 6.350 9.022 -0.3700 -0.0031 -0.0095 48LEU BB 2556 5.518 6.074 9.046 0.0736 -0.1297 -0.0526 48LEU SC1 2557 5.468 5.855 8.780 -0.1291 0.3690 -0.0913 49THR BB 2558 5.764 6.039 9.232 -0.2852 0.2032 -0.2863 49THR SC1 2559 6.000 5.919 9.081 -0.2031 0.2124 -0.1668 50ASP BB 2560 5.741 5.899 9.532 -0.0977 0.2636 -0.0584 50ASP SC1 2561 5.976 5.872 9.752 -0.4007 0.1958 0.1945 51GLY BB 2562 5.497 5.672 9.492 -0.2294 -0.4872 -0.1147 52GLU BB 2563 5.183 5.671 9.605 0.0004 0.2922 -0.0779 52GLU SC1 2564 5.109 5.923 9.871 0.0050 0.2100 0.4286 53GLU BB 2565 4.932 5.478 9.593 -0.1952 -0.2259 -0.1601 53GLU SC1 2566 4.693 5.554 9.270 -0.1324 -0.1078 0.1566 54LYS BB 2567 4.995 5.178 9.701 0.0528 0.1632 -0.1950 54LYS SC1 2568 4.685 5.089 9.755 -0.3508 -0.1235 -0.0553 54LYS SC2 2569 4.487 5.276 9.542 -0.0015 0.0245 -0.1123 55GLU BB 2570 5.104 4.913 9.604 -0.0031 0.0933 0.2513 55GLU SC1 2571 4.944 4.541 9.654 -0.0241 -0.1232 0.2437 56GLU BB 2572 5.276 4.872 9.357 0.0445 -0.0471 0.0933 56GLU SC1 2573 5.390 5.236 9.404 -0.2540 0.0386 0.4900 57PRO BB 2574 5.434 4.596 9.161 0.3819 0.1850 -0.0595 57PRO SC1 2575 5.313 4.673 8.831 -0.0281 -0.1845 0.1505 58LYS BB 2576 5.482 4.322 9.332 0.0259 -0.2250 -0.2593 58LYS SC1 2577 5.193 4.270 9.331 0.0861 -0.0133 0.0721 58LYS SC2 2578 4.887 4.141 9.208 -0.0584 0.1918 0.0704 59GLU BB 2579 5.666 4.241 9.567 -0.1296 0.1326 0.2696 59GLU SC1 2580 5.765 4.477 9.871 0.0237 -0.0585 -0.0602 60GLU BB 2581 5.645 3.905 9.677 -0.0422 0.0139 0.0527 60GLU SC1 2582 5.990 3.775 9.544 -0.1297 -0.0408 -0.2244 61GLU BB 2583 5.363 3.801 9.585 0.0958 -0.0375 0.0541 61GLU SC1 2584 5.257 3.814 9.227 -0.0964 -0.0045 0.1360 1LYS BB 2585 2.965 2.675 0.460 0.0644 0.2819 0.3316 1LYS SC1 2586 2.816 2.373 0.391 -0.0528 -0.4299 -0.3013 1LYS SC2 2587 2.854 2.061 0.555 -0.1052 0.0191 0.1489 2LYS BB 2588 3.049 2.903 0.169 0.1522 0.1228 -0.0870 2LYS SC1 2589 2.953 2.777 -0.133 0.0403 0.0797 0.3363 2LYS SC2 2590 2.692 2.795 -0.273 0.2667 -0.2708 -0.1521 3CYS BB 2591 3.261 3.137 0.148 -0.0359 0.0335 -0.1247 3CYS SC1 2592 3.254 3.431 0.064 -0.3080 -0.2222 -0.0233 4LEU BB 2593 3.555 3.189 0.318 0.1549 -0.0932 -0.0212 4LEU SC1 2594 3.642 3.516 0.165 -0.0150 -0.0705 0.0393 5PHE BB 2595 3.635 3.364 0.575 -0.1136 -0.1439 -0.3023 5PHE SC1 2596 3.943 3.381 0.452 0.0661 0.0815 0.1185 5PHE SC2 2597 3.937 3.272 0.130 0.1727 0.0181 0.1373 5PHE SC3 2598 4.065 3.093 0.318 0.0743 0.0363 0.2221 6LYS BB 2599 3.480 3.478 0.842 -0.1191 0.1857 0.1794 6LYS SC1 2600 3.654 3.446 1.069 0.1220 0.0482 0.2313 6LYS SC2 2601 3.613 3.230 1.297 0.1122 -0.2697 -0.0960 7LYS BB 2602 3.168 3.606 0.710 0.1363 0.0737 -0.0177 7LYS SC1 2603 3.194 3.509 0.397 0.0050 0.2507 -0.0042 7LYS SC2 2604 2.942 3.634 0.193 0.2476 0.1371 0.2033 8LYS BB 2605 3.000 3.739 1.002 -0.1855 -0.0156 0.0832 8LYS SC1 2606 2.850 4.021 0.887 -0.1530 0.2447 0.0816 8LYS SC2 2607 2.594 4.303 0.960 -0.1289 -0.2047 -0.2894 9ASN BB 2608 3.108 3.888 1.341 0.0620 -0.6550 0.0537 9ASN SC1 2609 3.383 3.700 1.268 0.2934 -0.3695 -0.2870 10LYS BB 2610 3.058 4.199 1.280 -0.0944 -0.1729 0.3805 10LYS SC1 2611 3.346 4.276 1.394 -0.0656 0.0449 -0.0416 10LYS SC2 2612 3.624 4.082 1.314 -0.2856 -0.1474 0.2409 11LYS BB 2613 2.928 4.304 1.575 -0.1921 0.0465 -0.0303 11LYS SC1 2614 3.159 4.307 1.789 0.2698 0.3225 -0.0513 11LYS SC2 2615 3.512 4.422 1.745 -0.0004 -0.0540 0.0247 12LYS BB 2616 2.733 4.556 1.762 0.2807 0.1551 0.0489 12LYS SC1 2617 2.906 4.789 1.824 -0.1515 0.1258 -0.4092 12LYS SC2 2618 3.137 5.071 1.790 -0.0809 0.1722 0.1425 13GLY BB 2619 2.729 4.523 2.113 -0.2117 0.1363 0.0468 14LYS BB 2620 2.893 4.262 2.164 0.2979 0.1423 0.3564 14LYS SC1 2621 2.749 4.013 2.258 -0.0743 0.3949 -0.3193 14LYS SC2 2622 2.833 3.756 2.467 0.3164 0.2059 -0.0204 15GLU BB 2623 2.970 4.322 2.510 -0.1335 0.1650 0.0562 15GLU SC1 2624 3.154 4.029 2.605 0.1206 0.2874 0.1833 16LYS BB 2625 3.164 4.572 2.558 0.1895 -0.2796 -0.1221 16LYS SC1 2626 2.945 4.753 2.425 0.0340 0.0191 -0.4171 16LYS SC2 2627 2.670 4.898 2.477 0.0438 -0.1898 -0.4216 17GLY BB 2628 3.139 4.721 2.801 0.2958 0.3763 -0.4528 18GLY BB 2629 2.872 4.905 2.869 0.1065 -0.0333 0.0865 19LYS BB 2630 2.742 5.067 3.090 0.0725 0.0144 -0.1035 19LYS SC1 2631 2.700 4.746 3.308 0.2728 0.3717 -0.1493 19LYS SC2 2632 2.822 4.476 3.510 -0.2242 0.3705 -0.2135 20ASN BB 2633 2.583 5.374 3.133 0.0054 -0.0472 0.4479 20ASN SC1 2634 2.581 5.330 3.493 0.0357 -0.4070 -0.2115 21ALA BB 2635 2.646 5.607 2.911 0.0171 0.1285 0.1355 21ALA SC1 2636 2.910 5.643 2.951 0.1333 -0.0385 -0.3955 22ILE BB 2637 2.608 5.702 2.602 -0.0895 0.0791 -0.3099 22ILE SC1 2638 2.694 6.010 2.482 0.0943 0.1044 -0.1168 23ASN BB 2639 2.312 5.836 2.553 -0.3716 -0.0454 -0.0736 23ASN SC1 2640 2.264 6.085 2.380 0.1032 0.1769 0.1537 24MET BB 2641 1.993 5.814 2.630 0.2383 0.0441 -0.0782 24MET SC1 2642 1.804 6.064 2.454 0.1592 -0.5233 0.0139 25LYS BB 2643 1.942 5.846 2.971 -0.0109 0.2019 -0.0736 25LYS SC1 2644 2.014 6.094 3.088 0.1200 0.3014 -0.1599 25LYS SC2 2645 2.226 6.388 3.167 0.1874 0.0741 0.2695 26ASP BB 2646 1.922 5.552 3.042 -0.3111 0.3782 0.1564 26ASP SC1 2647 2.132 5.475 3.275 -0.4613 0.2436 0.0553 27VAL BB 2648 1.829 5.401 2.734 0.0260 -0.0416 -0.2399 27VAL SC1 2649 1.631 5.548 2.577 -0.2382 -0.1694 -0.0339 28LYS BB 2650 2.045 5.279 2.467 -0.1233 0.0181 -0.1154 28LYS SC1 2651 1.758 5.152 2.366 0.3635 -0.0049 0.0206 28LYS SC2 2652 1.544 5.144 2.119 -0.3491 0.0620 -0.0072 29ASP BB 2653 2.377 5.307 2.435 0.0279 0.1540 0.0338 29ASP SC1 2654 2.498 5.224 2.717 -0.0501 0.2797 -0.2366 30LEU BB 2655 2.530 5.452 2.165 -0.2312 0.0495 -0.2947 30LEU SC1 2656 2.869 5.548 2.312 0.0415 -0.1080 0.2906 31GLY BB 2657 2.506 5.769 2.161 -0.2966 0.4457 0.3405 32LYS BB 2658 2.375 5.910 1.829 -0.1127 -0.0341 -0.2753 32LYS SC1 2659 2.525 5.734 1.599 -0.1148 -0.0581 -0.0566 32LYS SC2 2660 2.585 5.584 1.273 -0.1323 0.2447 0.4386 33THR BB 2661 2.092 6.013 1.766 0.0855 0.0750 -0.1449 33THR SC1 2662 1.991 6.001 2.054 -0.0169 0.0397 -0.1816 34MET BB 2663 2.153 6.302 1.584 0.0822 -0.2568 -0.1905 34MET SC1 2664 1.850 6.395 1.869 0.1337 -0.0622 0.0984 35LYS BB 2665 1.987 6.405 1.343 0.1045 -0.2885 0.1866 35LYS SC1 2666 2.069 6.712 1.314 0.0515 -0.2420 -0.0646 35LYS SC2 2667 2.284 6.928 1.099 -0.1922 -0.0045 -0.1959 36ASP BB 2668 1.749 6.288 1.193 -0.1919 -0.0788 -0.1169 36ASP SC1 2669 1.818 5.948 1.296 0.0072 0.0677 -0.2274 37GLN BB 2670 1.404 6.220 1.266 -0.2084 -0.1279 -0.1033 37GLN SC1 2671 1.334 5.888 1.360 -0.1749 -0.1516 0.1421 38ALA BB 2672 1.090 6.385 1.206 -0.4295 -0.0231 -0.5169 38ALA SC1 2673 0.981 6.157 1.300 -0.0165 -0.0111 0.0383 39LEU BB 2674 0.908 6.495 0.902 0.0811 -0.0075 -0.0247 39LEU SC1 2675 0.643 6.262 0.935 0.1370 -0.3172 -0.0379 40LYS BB 2676 1.001 6.578 0.610 -0.0851 0.0247 -0.1351 40LYS SC1 2677 0.760 6.630 0.366 -0.2186 0.1206 -0.0111 40LYS SC2 2678 0.581 6.469 0.133 -0.1909 -0.0375 0.0671 41ASP BB 2679 1.343 6.704 0.558 0.0384 0.1945 0.1787 41ASP SC1 2680 1.509 6.821 0.287 -0.0500 0.0315 0.0184 42ASP BB 2681 1.326 6.820 0.859 0.0117 0.0379 0.0100 42ASP SC1 2682 1.439 6.661 1.135 0.1767 0.0156 0.1392 43ASP BB 2683 1.095 6.970 0.995 0.0478 0.0330 0.2734 43ASP SC1 2684 0.905 6.998 0.713 0.2574 -0.1045 0.3239 44ALA BB 2685 1.009 7.243 1.114 -0.4058 0.0753 -0.3123 44ALA SC1 2686 1.128 7.438 0.970 -0.1044 0.0376 -0.1235 45GLU BB 2687 1.147 7.292 1.416 -0.0480 0.0256 0.1711 45GLU SC1 2688 0.872 7.209 1.657 0.1160 -0.0559 0.1686 46THR BB 2689 1.353 7.468 1.401 -0.2804 -0.0603 -0.0304 46THR SC1 2690 1.273 7.726 1.258 0.2269 -0.0008 -0.2279 47GLY BB 2691 1.592 7.581 1.640 -0.1155 -0.0048 -0.1237 48LEU BB 2692 1.632 7.800 1.947 -0.2117 0.0873 -0.0720 48LEU SC1 2693 1.966 7.867 2.092 -0.2969 -0.1616 0.0425 49THR BB 2694 1.345 8.043 2.088 0.1962 -0.0165 0.1492 49THR SC1 2695 1.340 8.257 1.870 -0.0897 -0.1110 0.0585 50ASP BB 2696 1.023 7.882 2.148 0.1721 0.3124 0.1667 50ASP SC1 2697 0.911 8.115 1.915 0.2845 0.1944 0.0098 51GLY BB 2698 0.903 7.826 2.411 0.1983 -0.2123 0.0711 52GLU BB 2699 0.632 7.712 2.513 0.0176 -0.1437 -0.1278 52GLU SC1 2700 0.885 7.591 2.795 0.1007 0.0103 0.0585 53GLU BB 2701 0.294 7.677 2.405 -0.4597 0.1528 -0.0765 53GLU SC1 2702 0.094 7.568 2.095 0.0070 -0.1723 0.0237 54LYS BB 2703 -0.033 7.770 2.547 0.2647 0.4434 0.0866 54LYS SC1 2704 -0.289 7.607 2.394 -0.3444 0.2546 0.1067 54LYS SC2 2705 -0.396 7.674 2.099 -0.0238 -0.1857 0.1373 55GLU BB 2706 -0.063 8.088 2.613 0.0341 -0.0617 0.2712 55GLU SC1 2707 0.205 8.228 2.363 -0.2729 -0.1707 -0.0315 56GLU BB 2708 -0.297 8.065 2.851 0.1804 -0.1262 -0.3131 56GLU SC1 2709 -0.551 8.007 2.516 0.1753 -0.1866 -0.2599 57PRO BB 2710 -0.178 7.888 3.121 -0.0744 0.0624 -0.1382 57PRO SC1 2711 -0.223 7.609 3.025 -0.0738 0.0591 0.3270 58LYS BB 2712 0.175 7.846 3.161 0.4940 0.0246 -0.1525 58LYS SC1 2713 0.235 7.599 2.961 -0.0668 -0.0170 0.1606 58LYS SC2 2714 0.455 7.377 2.778 0.0367 0.0290 0.0102 59GLU BB 2715 0.307 7.739 3.450 -0.1244 0.0132 -0.0841 59GLU SC1 2716 0.249 7.393 3.543 0.1960 -0.1365 0.0931 60GLU BB 2717 0.401 7.891 3.677 0.0718 0.0827 -0.2179 60GLU SC1 2718 0.321 8.228 3.635 0.3150 -0.0313 0.0513 61GLU BB 2719 0.591 7.882 3.955 0.0675 -0.1726 0.3800 61GLU SC1 2720 0.563 7.541 3.986 -0.4344 -0.1373 -0.1467 1LYS BB 2721 23.292 10.376 9.760 -0.3108 0.2233 0.0429 1LYS SC1 2722 23.449 10.594 9.901 0.7503 0.1478 -0.3405 1LYS SC2 2723 23.461 10.553 10.295 -0.0693 0.2019 0.1366 2LYS BB 2724 23.006 10.410 9.872 -0.2833 0.1236 -0.2334 2LYS SC1 2725 22.817 10.451 9.612 0.0580 -0.3819 -0.0510 2LYS SC2 2726 22.635 10.652 9.429 0.0780 -0.0488 0.0514 3CYS BB 2727 22.898 10.439 10.145 0.0297 -0.2499 0.0806 3CYS SC1 2728 23.110 10.419 10.359 0.0623 -0.1142 -0.1131 4LEU BB 2729 22.647 10.220 10.177 -0.2332 0.0669 -0.0019 4LEU SC1 2730 22.784 9.909 10.042 0.0619 -0.1362 -0.5795 5PHE BB 2731 22.315 10.310 10.243 0.3293 0.0404 0.3823 5PHE SC1 2732 22.249 10.025 10.008 0.1221 0.0510 -0.2132 5PHE SC2 2733 22.292 10.017 9.671 0.0490 0.0663 -0.2231 5PHE SC3 2734 22.428 9.807 9.818 -0.1531 -0.1148 -0.2886 6LYS BB 2735 22.267 10.448 10.547 -0.2723 -0.2228 0.1843 6LYS SC1 2736 22.119 10.288 10.776 -0.2963 0.1180 -0.5532 6LYS SC2 2737 21.938 10.116 10.583 0.0165 0.0241 -0.4368 7LYS BB 2738 22.349 10.700 10.681 0.1416 -0.2518 0.1123 7LYS SC1 2739 22.026 10.748 10.765 0.0993 -0.1035 -0.1029 7LYS SC2 2740 21.766 10.671 10.960 0.1196 -0.0757 -0.2878 8LYS BB 2741 22.491 10.905 10.501 0.1194 0.0850 0.1392 8LYS SC1 2742 22.467 11.108 10.737 0.2588 -0.1383 0.0201 8LYS SC2 2743 22.573 11.329 11.016 -0.0451 -0.1247 0.0802 9ASN BB 2744 22.768 10.914 10.351 0.3111 -0.0449 0.2351 9ASN SC1 2745 23.031 10.736 10.496 0.0370 -0.1669 0.1188 10LYS BB 2746 22.889 11.231 10.369 -0.3570 -0.0619 0.2078 10LYS SC1 2747 23.170 11.236 10.536 -0.0363 -0.0493 0.1398 10LYS SC2 2748 23.464 11.399 10.749 -0.2730 0.1437 0.2449 11LYS BB 2749 22.702 11.408 10.561 0.2234 -0.1813 0.1887 11LYS SC1 2750 22.492 11.341 10.307 0.0458 -0.4276 -0.3813 11LYS SC2 2751 22.393 11.078 10.095 0.2963 -0.0762 -0.1173 12LYS BB 2752 22.698 11.718 10.690 0.1539 -0.1101 0.2273 12LYS SC1 2753 22.398 11.835 10.580 0.0175 0.1811 0.0253 12LYS SC2 2754 22.098 11.804 10.518 -0.0201 -0.0905 -0.2509 13GLY BB 2755 22.537 11.882 10.986 -0.2238 0.0324 -0.0219 14LYS BB 2756 22.727 12.112 11.083 -0.0744 -0.0902 -0.2522 14LYS SC1 2757 22.761 12.121 11.411 -0.2604 -0.2419 0.1961 14LYS SC2 2758 22.927 11.902 11.665 -0.0738 0.1940 0.0530 15GLU BB 2759 22.776 12.433 11.065 0.0280 -0.2222 0.1433 15GLU SC1 2760 22.339 12.441 11.046 0.0229 0.2267 -0.2231 16LYS BB 2761 22.957 12.628 11.209 -0.0774 -0.0013 -0.4549 16LYS SC1 2762 23.215 12.491 11.010 -0.0725 -0.0905 -0.0154 16LYS SC2 2763 23.136 12.197 10.800 0.1614 -0.1976 -0.0088 17GLY BB 2764 22.888 12.802 11.450 -0.1737 0.2632 -0.1821 18GLY BB 2765 23.156 12.805 11.702 0.1175 -0.0109 0.2070 19LYS BB 2766 23.358 13.071 11.788 -0.1280 -0.0445 0.2067 19LYS SC1 2767 23.108 13.219 11.872 -0.0931 0.1211 0.0002 19LYS SC2 2768 23.000 13.527 11.796 0.3931 -0.0725 -0.2868 20ASN BB 2769 23.664 12.997 11.751 -0.4053 -0.1116 0.2875 20ASN SC1 2770 23.825 12.703 11.827 0.5227 -0.3077 0.1997 21ALA BB 2771 23.905 13.252 11.745 0.0191 0.2708 -0.7338 21ALA SC1 2772 23.762 13.477 11.789 0.0622 0.2158 -0.2581 22ILE BB 2773 24.051 13.192 12.017 0.2983 0.0525 0.1905 22ILE SC1 2774 24.197 12.884 12.000 0.1828 0.0207 -0.5162 23ASN BB 2775 23.844 13.365 12.239 -0.1387 0.2025 0.3713 23ASN SC1 2776 23.575 13.273 12.099 0.0965 0.1315 0.0069 24MET BB 2777 23.787 13.277 12.510 -0.2450 -0.2622 0.0824 24MET SC1 2778 24.095 13.071 12.578 -0.2194 -0.2873 0.2558 25LYS BB 2779 23.866 13.510 12.716 -0.1209 -0.1290 -0.1768 25LYS SC1 2780 24.202 13.433 12.834 -0.1466 -0.3401 0.2287 25LYS SC2 2781 24.464 13.409 12.605 -0.3056 -0.4856 0.3183 26ASP BB 2782 23.943 13.771 12.553 -0.0153 0.0128 -0.0869 26ASP SC1 2783 23.830 14.030 12.725 0.1576 -0.0496 0.0164 27VAL BB 2784 23.742 13.885 12.323 -0.1542 -0.0579 0.0481 27VAL SC1 2785 23.895 13.760 12.108 0.0818 -0.2056 0.2956 28LYS BB 2786 23.474 14.094 12.369 -0.0778 -0.2037 -0.0420 28LYS SC1 2787 23.771 14.300 12.352 -0.0162 -0.3018 -0.3313 28LYS SC2 2788 23.938 14.587 12.457 0.1296 0.2356 -0.1520 29ASP BB 2789 23.134 14.062 12.403 -0.1043 -0.0405 0.2006 29ASP SC1 2790 23.119 13.749 12.584 -0.2049 0.2458 0.3362 30LEU BB 2791 23.015 14.356 12.231 0.1122 -0.1765 -0.1252 30LEU SC1 2792 23.202 14.316 11.905 0.4994 -0.2859 -0.0393 31GLY BB 2793 22.735 14.477 12.079 -0.5639 -0.1452 -0.2711 32LYS BB 2794 22.634 14.619 12.395 -0.3092 0.2575 0.2171 32LYS SC1 2795 22.684 14.380 12.521 -0.1266 0.3681 0.2261 32LYS SC2 2796 22.447 14.222 12.703 0.0456 0.0820 0.3560 33THR BB 2797 22.365 14.752 12.547 -0.2342 0.0633 -0.2636 33THR SC1 2798 22.501 14.963 12.719 -0.0144 0.0873 -0.4618 34MET BB 2799 22.027 14.662 12.480 0.0964 0.2771 0.0012 34MET SC1 2800 21.968 14.705 12.112 0.0191 0.1468 0.0662 35LYS BB 2801 21.845 14.609 12.720 -0.0475 -0.0621 0.2553 35LYS SC1 2802 21.659 14.853 12.755 0.0512 0.4186 0.2007 35LYS SC2 2803 21.570 15.136 12.802 0.0217 0.0873 -0.1313 36ASP BB 2804 21.612 14.375 12.652 -0.1236 0.2143 -0.0085 36ASP SC1 2805 21.811 14.307 12.359 0.0229 0.0060 -0.1207 37GLN BB 2806 21.359 14.394 12.458 0.0197 -0.1912 -0.0489 37GLN SC1 2807 21.311 14.758 12.545 -0.0223 0.1488 0.1954 38ALA BB 2808 21.274 14.127 12.320 0.1134 0.0438 -0.2053 38ALA SC1 2809 21.060 14.216 12.179 0.3647 0.4879 -0.3227 39LEU BB 2810 21.451 14.062 12.047 0.3794 -0.2793 0.1310 39LEU SC1 2811 21.243 14.206 11.828 0.3526 -0.2562 -0.1646 40LYS BB 2812 21.604 13.816 11.916 0.1218 -0.0124 -0.1142 40LYS SC1 2813 21.392 13.628 12.067 -0.0276 -0.4421 -0.1813 40LYS SC2 2814 21.243 13.641 12.402 0.0764 0.1005 0.0197 41ASP BB 2815 21.822 13.749 11.654 0.1469 0.0214 -0.2491 41ASP SC1 2816 21.665 13.747 11.350 -0.1454 -0.2340 -0.2811 42ASP BB 2817 22.047 13.558 11.736 0.1139 -0.1563 -0.2532 42ASP SC1 2818 21.957 13.221 11.676 -0.2891 -0.1342 0.1025 43ASP BB 2819 22.347 13.612 11.735 -0.2778 0.1136 0.0287 43ASP SC1 2820 22.510 13.577 12.029 -0.2221 -0.0154 0.2173 44ALA BB 2821 22.558 13.675 11.511 0.1537 -0.1840 0.2091 44ALA SC1 2822 22.662 13.456 11.392 0.3468 0.1121 -0.1905 45GLU BB 2823 22.590 14.040 11.433 -0.1078 -0.1231 -0.4657 45GLU SC1 2824 22.430 14.050 11.140 0.0428 0.0716 0.0172 46THR BB 2825 22.814 14.270 11.543 0.2351 0.1912 0.0440 46THR SC1 2826 22.660 14.530 11.584 0.1398 0.2151 -0.4077 47GLY BB 2827 23.066 14.426 11.438 0.0301 -0.2168 0.0110 48LEU BB 2828 23.338 14.224 11.251 0.0143 -0.2568 -0.0385 48LEU SC1 2829 23.273 14.025 11.577 0.1145 0.4437 0.2724 49THR BB 2830 23.341 14.296 10.858 0.2388 0.0007 -0.0698 49THR SC1 2831 23.057 14.320 10.749 0.1347 0.0861 0.2109 50ASP BB 2832 23.479 14.536 10.755 0.1012 0.0132 0.0094 50ASP SC1 2833 23.212 14.740 10.655 0.0290 -0.1252 0.4048 51GLY BB 2834 23.687 14.650 10.608 0.0366 0.5951 -0.0775 52GLU BB 2835 23.980 14.485 10.594 0.2549 0.0260 0.2499 52GLU SC1 2836 23.990 14.393 10.236 0.0434 0.0706 -0.4411 53GLU BB 2837 24.264 14.448 10.737 0.0497 -0.0892 0.3395 53GLU SC1 2838 24.343 14.464 11.117 0.0298 -0.4395 -0.0693 54LYS BB 2839 24.538 14.485 10.630 0.2415 0.0325 0.1592 54LYS SC1 2840 24.590 14.189 10.537 -0.1402 -0.0801 -0.1336 54LYS SC2 2841 24.622 13.795 10.601 -0.0598 -0.0604 0.4487 55GLU BB 2842 24.732 14.669 10.814 -0.1602 0.1175 0.0873 55GLU SC1 2843 24.980 14.384 10.869 -0.4092 0.1088 -0.0056 56GLU BB 2844 24.718 14.937 10.646 0.0621 0.0781 -0.0680 56GLU SC1 2845 24.675 14.913 10.280 -0.2564 0.0018 -0.1402 57PRO BB 2846 25.019 15.080 10.758 -0.0977 -0.0188 -0.1461 57PRO SC1 2847 24.972 15.367 10.619 -0.3103 -0.0773 0.2523 58LYS BB 2848 25.350 15.097 10.720 -0.2281 -0.1956 0.0930 58LYS SC1 2849 25.559 15.325 10.781 0.3239 -0.3222 -0.0605 58LYS SC2 2850 25.703 15.567 10.975 0.0168 0.2084 -0.0944 59GLU BB 2851 25.548 14.792 10.751 0.0356 -0.1655 -0.0580 59GLU SC1 2852 25.636 14.755 10.360 0.0528 -0.1306 0.2261 60GLU BB 2853 25.464 14.653 10.977 -0.1849 0.0088 0.0562 60GLU SC1 2854 25.161 14.805 11.098 -0.1733 -0.1120 0.1313 61GLU BB 2855 25.711 14.597 11.236 0.0968 -0.1096 0.1957 61GLU SC1 2856 26.074 14.748 11.214 0.0927 0.3694 0.0357 1LYS BB 2857 13.420 16.361 4.458 -0.1382 0.0569 0.0349 1LYS SC1 2858 13.688 16.459 4.487 -0.0353 0.4503 -0.0980 1LYS SC2 2859 14.066 16.510 4.459 0.3536 0.0209 -0.1473 2LYS BB 2860 13.386 16.188 4.188 0.0049 -0.0024 0.3020 2LYS SC1 2861 13.448 15.887 4.214 0.3533 0.2884 -0.0331 2LYS SC2 2862 13.390 15.501 4.213 0.3207 0.0406 -0.0263 3CYS BB 2863 13.387 16.313 3.914 -0.0499 0.0554 0.2783 3CYS SC1 2864 13.104 16.449 3.781 -0.1489 0.4063 0.2288 4LEU BB 2865 13.466 16.241 3.618 -0.0645 -0.1845 -0.0086 4LEU SC1 2866 13.740 16.090 3.799 0.4170 -0.1492 -0.2981 5PHE BB 2867 13.705 16.364 3.439 -0.2347 -0.0126 -0.1321 5PHE SC1 2868 13.512 16.531 3.222 0.0544 -0.0360 -0.0913 5PHE SC2 2869 13.507 16.842 3.360 -0.0391 0.0384 -0.2605 5PHE SC3 2870 13.247 16.727 3.302 -0.0038 -0.0570 -0.2310 6LYS BB 2871 13.809 16.655 3.553 0.1876 -0.0293 0.1847 6LYS SC1 2872 13.518 16.667 3.701 0.1320 -0.0573 0.2533 6LYS SC2 2873 13.177 16.812 3.709 -0.2372 0.0494 -0.0305 7LYS BB 2874 14.090 16.845 3.591 0.1520 0.0223 0.0507 7LYS SC1 2875 13.981 17.008 3.845 0.0575 -0.2085 0.1057 7LYS SC2 2876 13.990 17.349 3.756 0.0472 0.3164 0.0255 8LYS BB 2877 14.382 16.745 3.479 -0.2039 0.2690 -0.2007 8LYS SC1 2878 14.508 16.668 3.755 -0.2916 -0.0533 0.1145 8LYS SC2 2879 14.539 16.385 3.933 -0.2257 0.2806 -0.0609 9ASN BB 2880 14.549 16.815 3.219 -0.1756 -0.1831 0.2325 9ASN SC1 2881 14.879 16.712 3.212 0.1741 -0.0241 -0.1029 10LYS BB 2882 14.441 17.048 2.996 0.0179 -0.2814 -0.1746 10LYS SC1 2883 14.538 16.931 2.772 -0.1775 -0.1684 0.0253 10LYS SC2 2884 14.333 16.894 2.456 0.0038 0.0857 -0.0062 11LYS BB 2885 14.446 17.394 3.002 0.0773 -0.1805 0.2198 11LYS SC1 2886 14.127 17.379 3.014 -0.3727 0.0048 0.2949 11LYS SC2 2887 13.840 17.418 2.884 0.0562 -0.2673 -0.1967 12LYS BB 2888 14.708 17.544 3.090 0.2014 -0.1859 -0.2931 12LYS SC1 2889 14.848 17.701 2.815 0.2709 -0.3873 0.0691 12LYS SC2 2890 15.146 17.734 2.619 -0.0468 -0.0529 0.1402 13GLY BB 2891 14.861 17.572 3.315 0.0205 0.0152 0.2231 14LYS BB 2892 14.855 17.481 3.630 -0.0455 -0.2660 -0.1018 14LYS SC1 2893 15.068 17.730 3.632 0.0130 -0.4271 -0.0481 14LYS SC2 2894 15.140 18.109 3.545 -0.1504 0.1789 -0.2550 15GLU BB 2895 14.517 17.579 3.620 0.0820 0.1611 0.3355 15GLU SC1 2896 14.303 17.678 3.904 0.3035 -0.0465 0.0471 16LYS BB 2897 14.255 17.515 3.404 0.0203 0.1244 -0.2306 16LYS SC1 2898 14.347 17.816 3.290 -0.4193 -0.0531 -0.0978 16LYS SC2 2899 14.245 18.152 3.253 0.0630 -0.0811 0.0493 17GLY BB 2900 14.215 17.192 3.379 -0.3362 0.2576 0.1894 18GLY BB 2901 13.918 17.170 3.333 0.2561 0.2621 0.2245 19LYS BB 2902 13.769 17.463 3.303 0.0627 0.1644 -0.2291 19LYS SC1 2903 13.637 17.577 3.622 0.0403 0.0666 -0.2504 19LYS SC2 2904 13.358 17.604 3.832 0.1630 -0.0585 -0.1334 20ASN BB 2905 13.470 17.385 3.194 0.1288 0.0709 -0.0604 20ASN SC1 2906 13.215 17.573 3.354 0.0002 0.4801 0.1637 21ALA BB 2907 13.316 17.106 3.119 0.0321 -0.1649 0.0965 21ALA SC1 2908 13.059 17.049 3.180 -0.2487 0.1348 -0.6767 22ILE BB 2909 13.314 16.817 2.912 0.1749 0.0466 -0.0291 22ILE SC1 2910 13.181 16.810 2.598 0.1365 -0.0187 -0.0118 23ASN BB 2911 13.007 16.598 2.959 -0.2321 -0.0629 -0.1589 23ASN SC1 2912 13.281 16.355 2.883 0.1964 0.2140 -0.1348 24MET BB 2913 12.691 16.607 3.079 0.2732 -0.1561 0.0047 24MET SC1 2914 12.806 16.796 3.350 0.0632 -0.1975 0.1760 25LYS BB 2915 12.578 16.352 3.037 -0.0865 0.0146 -0.1279 25LYS SC1 2916 12.309 16.329 3.151 -0.1123 -0.3009 0.1243 25LYS SC2 2917 11.979 16.234 3.330 -0.2160 -0.2274 0.1346 26ASP BB 2918 12.672 16.044 3.090 -0.0764 0.0994 0.0615 26ASP SC1 2919 12.963 16.044 3.006 -0.1211 0.1649 -0.4527 27VAL BB 2920 12.622 15.742 2.883 -0.2128 -0.2449 0.4729 27VAL SC1 2921 12.781 15.596 3.081 -0.0366 -0.1321 0.4175 28LYS BB 2922 12.847 15.743 2.655 -0.0956 0.0899 -0.0359 28LYS SC1 2923 12.892 15.433 2.679 0.0619 -0.2651 0.1588 28LYS SC2 2924 13.066 15.137 2.717 0.0447 -0.2348 -0.2240 29ASP BB 2925 12.790 15.933 2.412 0.0646 0.0488 -0.0147 29ASP SC1 2926 12.618 16.141 2.609 0.6440 0.2746 0.0144 30LEU BB 2927 12.963 16.116 2.241 -0.0217 -0.1400 0.1398 30LEU SC1 2928 12.983 15.915 1.970 0.3999 -0.3890 0.1435 31GLY BB 2929 12.730 16.264 2.068 -0.2845 0.0121 0.0761 32LYS BB 2930 12.699 16.627 1.981 0.0711 -0.0932 -0.0607 32LYS SC1 2931 12.899 16.647 1.721 0.2705 0.4291 0.0647 32LYS SC2 2932 12.966 16.289 1.696 0.2033 0.2448 0.2388 33THR BB 2933 12.745 16.913 2.130 -0.0333 0.1217 -0.0034 33THR SC1 2934 12.943 17.060 1.950 0.0436 -0.0797 -0.0871 34MET BB 2935 12.510 17.021 2.307 -0.0611 -0.1906 0.0925 34MET SC1 2936 12.320 16.860 2.565 0.0924 0.2133 0.1175 35LYS BB 2937 12.334 17.330 2.228 -0.0424 -0.3103 -0.0294 35LYS SC1 2938 12.049 17.279 2.311 -0.1590 0.0875 -0.1882 35LYS SC2 2939 11.959 17.185 2.655 0.0332 -0.1433 -0.0500 36ASP BB 2940 12.475 17.577 2.109 -0.1929 0.0918 -0.0487 36ASP SC1 2941 12.838 17.466 2.067 -0.0942 -0.1796 0.0479 37GLN BB 2942 12.549 17.789 2.327 -0.2600 -0.4085 0.1105 37GLN SC1 2943 12.875 17.952 2.154 0.2728 -0.2124 0.0901 38ALA BB 2944 12.414 17.967 2.558 0.0326 -0.1646 -0.0174 38ALA SC1 2945 12.166 18.001 2.456 -0.0731 -0.3809 0.1572 39LEU BB 2946 12.626 17.998 2.813 -0.0486 0.0350 0.0442 39LEU SC1 2947 12.698 17.728 3.028 0.2290 -0.1479 0.2394 40LYS BB 2948 12.782 18.297 2.960 -0.0516 -0.0420 0.0925 40LYS SC1 2949 12.778 18.190 3.262 0.0860 -0.0428 0.1226 40LYS SC2 2950 12.840 18.315 3.583 0.0875 -0.0354 -0.3258 41ASP BB 2951 12.886 18.602 2.822 -0.0222 -0.1148 0.0737 41ASP SC1 2952 12.611 18.767 2.850 0.1852 0.1339 -0.1983 42ASP BB 2953 13.031 18.616 2.531 0.1820 0.3167 -0.0843 42ASP SC1 2954 12.823 18.682 2.260 -0.1418 -0.0024 0.0596 43ASP BB 2955 13.295 18.768 2.453 -0.0931 -0.0402 -0.0180 43ASP SC1 2956 13.522 18.481 2.481 -0.2088 -0.0521 0.0093 44ALA BB 2957 13.363 18.933 2.676 -0.3204 -0.0042 0.0540 44ALA SC1 2958 13.330 19.186 2.591 0.3307 0.1619 0.2358 45GLU BB 2959 13.222 18.923 2.954 -0.0405 0.1768 0.0733 45GLU SC1 2960 13.403 19.201 3.165 -0.1568 0.0290 0.1387 46THR BB 2961 13.231 18.746 3.245 -0.0995 -0.1403 0.3498 46THR SC1 2962 13.522 18.818 3.304 -0.0925 0.0109 0.1417 47GLY BB 2963 12.952 18.607 3.306 -0.3224 -0.0053 0.2254 48LEU BB 2964 12.677 18.703 3.369 -0.1284 0.1921 0.2856 48LEU SC1 2965 12.717 18.786 3.709 0.2290 0.1977 -0.0902 49THR BB 2966 12.464 18.908 3.300 -0.1848 -0.1218 0.2758 49THR SC1 2967 12.175 18.813 3.319 -0.2640 0.1227 0.3426 50ASP BB 2968 12.504 19.121 3.513 0.0289 0.1829 0.0192 50ASP SC1 2969 12.656 19.417 3.361 -0.5590 0.1341 0.0198 51GLY BB 2970 12.395 19.045 3.849 -0.0503 0.2756 -0.2278 52GLU BB 2971 12.211 18.785 3.924 0.1990 -0.2233 -0.0534 52GLU SC1 2972 11.928 18.966 4.059 -0.0248 0.2027 0.0869 53GLU BB 2973 12.358 18.535 3.996 -0.1044 -0.1418 -0.0523 53GLU SC1 2974 12.342 18.422 3.627 -0.3297 0.2443 0.1897 54LYS BB 2975 12.681 18.415 4.012 -0.1246 -0.1462 0.2491 54LYS SC1 2976 12.887 18.655 4.072 -0.3215 0.0493 -0.1496 54LYS SC2 2977 13.076 18.874 4.278 -0.0667 0.3857 0.1923 55GLU BB 2978 12.788 18.120 4.128 -0.1032 -0.0488 -0.0619 55GLU SC1 2979 13.099 18.046 3.950 0.0370 -0.0905 0.1580 56GLU BB 2980 12.583 17.967 4.277 0.4454 -0.1625 0.1176 56GLU SC1 2981 12.467 18.300 4.469 -0.0621 0.0172 0.4025 57PRO BB 2982 12.463 17.651 4.407 0.2939 0.1189 0.2692 57PRO SC1 2983 12.378 17.555 4.114 0.1891 -0.0095 -0.2443 58LYS BB 2984 12.625 17.505 4.588 -0.2051 -0.0568 -0.1351 58LYS SC1 2985 12.910 17.350 4.513 0.1408 -0.2507 0.1463 58LYS SC2 2986 13.212 17.156 4.394 -0.0785 -0.2833 -0.1528 59GLU BB 2987 12.573 17.397 4.930 -0.2500 -0.2866 -0.0253 59GLU SC1 2988 12.532 17.757 5.210 0.3371 0.0142 -0.1245 60GLU BB 2989 12.375 17.119 4.857 0.2059 -0.1915 0.3063 60GLU SC1 2990 12.695 16.946 4.766 -0.0611 -0.0212 -0.0775 61GLU BB 2991 12.037 17.143 4.791 0.1395 -0.1218 -0.1720 61GLU SC1 2992 12.106 17.346 4.470 0.1366 -0.0983 -0.3274 1LYS BB 2993 20.931 14.223 8.242 -0.2148 0.2766 -0.0651 1LYS SC1 2994 20.769 14.015 8.436 -0.0581 -0.0616 0.2452 1LYS SC2 2995 20.741 13.699 8.632 -0.1083 -0.0102 0.0418 2LYS BB 2996 20.854 14.473 8.095 -0.2725 0.4178 0.1382 2LYS SC1 2997 20.538 14.512 8.156 -0.3028 -0.1617 0.2966 2LYS SC2 2998 20.309 14.608 8.382 0.1207 0.1111 -0.0590 3CYS BB 2999 21.038 14.489 7.820 -0.0571 -0.1902 -0.2700 3CYS SC1 3000 21.366 14.425 7.762 0.6074 0.4552 0.1046 4LEU BB 3001 20.855 14.510 7.602 0.2422 0.0832 0.2485 4LEU SC1 3002 20.538 14.413 7.748 0.0283 -0.3499 -0.0318 5PHE BB 3003 20.913 14.313 7.307 -0.2582 -0.0949 -0.2125 5PHE SC1 3004 20.625 14.194 7.286 0.1939 0.4397 0.0435 5PHE SC2 3005 20.302 14.244 7.382 0.1353 -0.0839 0.1512 5PHE SC3 3006 20.411 14.446 7.205 -0.2091 0.1640 0.2110 6LYS BB 3007 21.217 14.305 7.182 0.1117 -0.1047 -0.1157 6LYS SC1 3008 21.120 14.519 6.949 -0.1622 -0.3120 0.1533 6LYS SC2 3009 21.042 14.582 6.625 0.2569 -0.1717 -0.0972 7LYS BB 3010 21.513 14.307 7.405 0.2540 -0.2279 0.3496 7LYS SC1 3011 21.768 14.325 7.201 -0.1038 -0.2158 0.0243 7LYS SC2 3012 21.892 14.425 6.916 0.0093 0.0286 -0.0699 8LYS BB 3013 21.632 13.980 7.511 -0.2390 0.0110 -0.3881 8LYS SC1 3014 21.489 13.740 7.406 -0.3293 -0.2653 0.1509 8LYS SC2 3015 21.692 13.481 7.494 -0.3584 -0.1706 0.0868 9ASN BB 3016 21.554 13.906 7.810 0.0926 0.1357 0.2247 9ASN SC1 3017 21.567 13.589 7.886 0.2084 0.1361 -0.0353 10LYS BB 3018 21.654 14.171 7.982 0.0339 0.2494 -0.0023 10LYS SC1 3019 21.740 14.397 7.789 -0.1727 0.5275 -0.2584 10LYS SC2 3020 21.823 14.673 7.580 0.2783 0.1338 0.1601 11LYS BB 3021 21.424 14.261 8.183 0.0220 0.0469 -0.1198 11LYS SC1 3022 21.596 14.068 8.416 0.0625 0.2350 0.0055 11LYS SC2 3023 21.733 13.964 8.713 0.1233 -0.2431 -0.0713 12LYS BB 3024 21.352 14.564 8.199 0.0001 -0.1819 0.1322 12LYS SC1 3025 21.569 14.643 8.380 -0.3339 0.0548 0.4365 12LYS SC2 3026 21.536 14.830 8.701 0.4534 -0.0351 0.1448 13GLY BB 3027 21.147 14.708 8.448 0.1553 0.2231 -0.0572 14LYS BB 3028 21.125 15.073 8.540 -0.1666 0.1699 -0.0493 14LYS SC1 3029 21.052 15.169 8.232 -0.2280 0.1749 -0.1261 14LYS SC2 3030 21.001 14.923 8.020 0.1196 0.0482 0.2578 15GLU BB 3031 21.212 15.285 8.796 0.1009 0.2631 -0.0003 15GLU SC1 3032 21.429 15.105 9.065 -0.0211 0.1503 0.3010 16LYS BB 3033 21.069 15.546 8.714 0.1461 -0.2602 0.3233 16LYS SC1 3034 20.837 15.552 8.983 0.2033 0.0945 -0.3609 16LYS SC2 3035 20.497 15.466 9.060 -0.2188 0.3251 -0.4553 17GLY BB 3036 20.960 15.712 8.400 -0.1839 0.1015 0.1677 18GLY BB 3037 21.005 15.665 8.109 0.1091 -0.0169 0.3570 19LYS BB 3038 21.264 15.802 7.986 -0.0408 -0.3177 0.0980 19LYS SC1 3039 21.282 16.020 8.213 0.1753 -0.0367 0.1501 19LYS SC2 3040 21.244 15.954 8.587 -0.1564 -0.0657 -0.2001 20ASN BB 3041 21.331 15.734 7.617 0.0980 0.2542 -0.1378 20ASN SC1 3042 21.085 15.540 7.484 -0.3118 -0.2400 0.3582 21ALA BB 3043 21.352 16.038 7.518 -0.1286 -0.1091 0.0751 21ALA SC1 3044 21.580 16.081 7.379 -0.2793 0.2101 -0.0838 22ILE BB 3045 21.144 16.139 7.362 0.0168 0.3820 -0.0063 22ILE SC1 3046 21.295 16.288 7.095 0.1843 -0.2158 -0.2626 23ASN BB 3047 20.876 15.894 7.289 -0.1309 0.0514 -0.4964 23ASN SC1 3048 20.970 15.975 6.966 -0.0219 0.3819 -0.1494 24MET BB 3049 20.633 15.985 7.457 0.2062 0.2410 -0.2986 24MET SC1 3050 20.348 16.128 7.286 -0.0217 0.1853 -0.1327 25LYS BB 3051 20.493 15.853 7.742 -0.2049 0.2513 -0.2177 25LYS SC1 3052 20.342 15.654 7.556 0.0598 -0.2773 0.2644 25LYS SC2 3053 20.174 15.616 7.280 0.4094 0.1922 0.3729 26ASP BB 3054 20.602 16.038 7.983 0.1194 0.0365 0.1599 26ASP SC1 3055 20.924 16.116 7.839 -0.1891 -0.2958 0.2298 27VAL BB 3056 20.421 16.153 8.203 0.2786 0.2190 -0.1165 27VAL SC1 3057 20.524 16.143 8.476 0.1405 0.2806 -0.0609 28LYS BB 3058 20.208 16.407 8.163 -0.0614 -0.3887 0.0815 28LYS SC1 3059 20.025 16.346 8.414 -0.1740 0.0019 -0.1123 28LYS SC2 3060 19.913 16.229 8.710 -0.2911 -0.2235 0.1942 29ASP BB 3061 20.261 16.700 8.080 0.0387 -0.0047 0.1596 29ASP SC1 3062 20.612 16.825 8.018 0.1410 0.5257 -0.2244 30LEU BB 3063 20.011 16.958 8.040 0.2612 -0.1580 0.0559 30LEU SC1 3064 19.969 17.289 8.177 -0.0773 -0.1365 0.1042 31GLY BB 3065 19.908 16.932 7.730 -0.3076 0.1729 0.1822 32LYS BB 3066 19.587 16.878 7.578 -0.1180 -0.1146 0.3913 32LYS SC1 3067 19.656 16.799 7.277 0.2218 0.2616 0.1765 32LYS SC2 3068 19.872 16.649 7.092 -0.0112 -0.2345 -0.2314 33THR BB 3069 19.314 17.050 7.546 -0.0902 0.1527 0.0389 33THR SC1 3070 19.056 16.892 7.584 0.0286 -0.1847 -0.4551 34MET BB 3071 19.216 17.352 7.569 -0.0545 0.0643 0.1187 34MET SC1 3072 19.344 17.607 7.289 0.0117 -0.1045 0.2970 35LYS BB 3073 19.035 17.346 7.883 -0.1964 -0.1968 -0.1760 35LYS SC1 3074 18.717 17.352 7.963 0.0505 -0.0073 -0.1446 35LYS SC2 3075 18.372 17.326 7.889 -0.1722 -0.5235 -0.2852 36ASP BB 3076 19.099 17.167 8.105 0.1287 0.0769 -0.0669 36ASP SC1 3077 19.299 16.928 7.960 0.1490 0.0711 -0.2153 37GLN BB 3078 19.011 16.961 8.342 -0.0500 -0.0447 0.0539 37GLN SC1 3079 18.636 16.997 8.258 0.1840 0.0419 0.1703 38ALA BB 3080 19.236 16.969 8.626 0.1454 0.1481 -0.0709 38ALA SC1 3081 19.403 16.763 8.674 0.4935 0.3904 -0.1981 39LEU BB 3082 19.379 17.129 8.818 0.1324 0.2250 0.1173 39LEU SC1 3083 19.618 16.867 8.992 0.0485 -0.0238 0.0447 40LYS BB 3084 19.309 17.429 8.907 -0.1102 -0.1181 -0.0652 40LYS SC1 3085 19.639 17.489 9.038 -0.1039 0.2647 -0.0575 40LYS SC2 3086 19.986 17.561 9.004 -0.1870 -0.2187 -0.0437 41ASP BB 3087 19.073 17.716 8.858 0.2454 -0.0096 0.1214 41ASP SC1 3088 19.240 17.796 8.582 0.4342 0.0559 0.1250 42ASP BB 3089 18.990 17.885 9.094 0.1860 -0.3226 0.0933 42ASP SC1 3090 19.274 18.035 9.224 -0.3186 0.0036 -0.0146 43ASP BB 3091 18.802 17.896 9.351 0.1219 -0.0700 0.0128 43ASP SC1 3092 18.640 18.150 9.606 -0.1201 0.1357 0.5188 44ALA BB 3093 18.920 17.703 9.562 0.2835 0.0548 0.1452 44ALA SC1 3094 19.106 17.879 9.647 0.0608 0.3323 0.0733 45GLU BB 3095 18.911 17.368 9.567 0.2456 0.1089 0.0595 45GLU SC1 3096 18.946 17.376 9.240 0.3034 0.1962 0.0454 46THR BB 3097 18.653 17.229 9.679 0.1801 -0.0636 -0.1383 46THR SC1 3098 18.601 17.009 9.884 0.1449 0.0853 0.0157 47GLY BB 3099 18.310 17.281 9.584 -0.0747 0.0814 -0.0070 48LEU BB 3100 18.184 16.960 9.569 -0.0055 -0.2583 -0.0795 48LEU SC1 3101 17.962 16.851 9.856 -0.1209 -0.0773 -0.2448 49THR BB 3102 18.035 16.949 9.284 0.0889 0.0131 -0.0365 49THR SC1 3103 17.804 17.123 9.379 0.2943 0.0332 0.4599 50ASP BB 3104 18.073 17.077 8.979 0.2892 0.1809 0.2257 50ASP SC1 3105 18.122 17.366 9.174 -0.1901 0.0991 -0.2205 51GLY BB 3106 18.185 16.872 8.823 -0.3283 0.0971 -0.0129 52GLU BB 3107 18.184 16.940 8.478 0.0838 -0.1781 -0.2590 52GLU SC1 3108 18.094 16.619 8.429 0.1395 -0.0164 0.1711 53GLU BB 3109 18.168 17.171 8.267 -0.2903 -0.2518 -0.1376 53GLU SC1 3110 18.438 17.419 8.389 0.1632 -0.0345 -0.1034 54LYS BB 3111 17.872 17.302 8.344 0.2025 0.0835 -0.0612 54LYS SC1 3112 17.729 17.166 8.623 0.0627 0.4169 0.0672 54LYS SC2 3113 17.743 16.845 8.670 -0.0099 0.1611 -0.2959 55GLU BB 3114 17.588 17.387 8.180 0.2549 -0.1689 -0.4186 55GLU SC1 3115 17.620 17.452 7.761 -0.0298 0.1940 0.1260 56GLU BB 3116 17.340 17.309 8.355 0.2845 0.0567 0.3670 56GLU SC1 3117 17.161 17.625 8.336 0.2751 -0.0961 0.0068 57PRO BB 3118 17.288 17.028 8.568 -0.3065 -0.2953 0.3653 57PRO SC1 3119 17.354 17.225 8.789 0.2886 0.1210 0.4763 58LYS BB 3120 17.258 16.730 8.368 0.1853 0.2174 -0.0116 58LYS SC1 3121 17.574 16.751 8.268 -0.1536 -0.0722 -0.6113 58LYS SC2 3122 17.845 16.815 8.116 0.0004 -0.1253 -0.1856 59GLU BB 3123 17.017 16.703 8.195 0.0174 0.1287 0.2291 59GLU SC1 3124 17.233 16.566 7.867 -0.0291 0.0297 0.3014 60GLU BB 3125 16.767 16.514 8.335 -0.2157 0.0223 -0.0041 60GLU SC1 3126 16.767 16.806 8.615 -0.2321 -0.1803 0.0565 61GLU BB 3127 16.615 16.235 8.300 -0.3355 -0.0752 0.2745 61GLU SC1 3128 16.382 16.355 8.029 -0.0785 0.2831 -0.2228 1LYS BB 3129 24.599 11.176 21.682 -0.2659 -0.0987 -0.1792 1LYS SC1 3130 24.413 11.239 21.429 -0.0194 0.0262 -0.2856 1LYS SC2 3131 24.125 11.489 21.437 0.0812 -0.2972 -0.0179 2LYS BB 3132 24.571 10.831 21.615 0.0382 0.2240 -0.0628 2LYS SC1 3133 24.676 10.833 21.311 -0.1293 0.3211 0.1533 2LYS SC2 3134 24.614 10.501 21.193 -0.1009 -0.4438 -0.3071 3CYS BB 3135 24.787 10.673 21.803 0.1183 0.0323 -0.0484 3CYS SC1 3136 24.982 10.747 21.538 0.0757 -0.1367 0.0187 4LEU BB 3137 24.920 10.747 22.085 -0.2062 0.2323 0.1437 4LEU SC1 3138 25.277 10.773 22.100 0.3355 0.1633 0.0563 5PHE BB 3139 24.767 11.032 22.119 -0.0087 0.1769 -0.0265 5PHE SC1 3140 25.051 11.098 22.294 0.0363 0.3291 -0.0302 5PHE SC2 3141 25.090 11.436 22.294 0.0391 0.3293 -0.1474 5PHE SC3 3142 25.291 11.288 22.146 -0.1525 0.3000 -0.3848 6LYS BB 3143 24.446 10.960 22.170 -0.2047 -0.1219 -0.3432 6LYS SC1 3144 24.413 10.661 22.080 -0.1414 0.0285 -0.0376 6LYS SC2 3145 24.597 10.335 22.140 -0.0319 -0.1425 0.2234 7LYS BB 3146 24.299 11.167 22.369 -0.2329 -0.2882 0.5226 7LYS SC1 3147 23.944 11.144 22.316 0.1019 0.2688 0.0306 7LYS SC2 3148 23.625 11.058 22.126 0.0474 -0.0080 -0.1855 8LYS BB 3149 24.479 11.274 22.586 0.0900 0.0910 -0.2000 8LYS SC1 3150 24.247 11.498 22.624 0.3677 -0.1248 -0.0832 8LYS SC2 3151 24.270 11.857 22.589 -0.2675 0.3409 0.0732 9ASN BB 3152 24.730 11.060 22.645 -0.0455 0.0397 0.0492 9ASN SC1 3153 24.903 11.314 22.712 -0.0168 -0.4729 0.2979 10LYS BB 3154 24.770 10.837 22.938 0.2840 -0.0098 -0.0200 10LYS SC1 3155 25.052 10.697 22.921 0.1792 -0.1199 -0.1265 10LYS SC2 3156 25.240 10.426 23.151 -0.0700 -0.4818 0.1742 11LYS BB 3157 24.522 10.609 23.109 0.1104 -0.3017 0.3622 11LYS SC1 3158 24.678 10.440 23.322 -0.0102 0.1046 0.1411 11LYS SC2 3159 24.911 10.213 23.437 -0.0920 -0.1038 -0.1793 12LYS BB 3160 24.210 10.660 23.177 -0.0292 0.1210 -0.0747 12LYS SC1 3161 24.161 10.496 23.450 0.3199 0.0371 0.2373 12LYS SC2 3162 24.136 10.473 23.808 -0.4381 0.0734 0.2060 13GLY BB 3163 23.999 10.861 23.217 0.0156 -0.1202 0.2947 14LYS BB 3164 24.117 11.139 23.268 0.2703 -0.1550 -0.6808 14LYS SC1 3165 24.026 11.231 23.558 0.0361 0.2256 -0.2739 14LYS SC2 3166 24.250 11.166 23.786 0.0983 0.0579 0.0354 15GLU BB 3167 24.094 11.401 23.068 -0.3046 0.0546 -0.1497 15GLU SC1 3168 23.975 11.140 22.771 0.0834 -0.0817 0.0938 16LYS BB 3169 24.205 11.669 23.026 -0.2505 -0.1157 -0.1472 16LYS SC1 3170 24.433 11.748 23.229 -0.4388 0.1725 -0.3483 16LYS SC2 3171 24.753 11.691 23.344 -0.0313 -0.0431 -0.2985 17GLY BB 3172 23.969 11.924 22.901 0.1996 -0.0418 0.1107 18GLY BB 3173 23.893 12.245 23.004 0.0730 0.0502 -0.0598 19LYS BB 3174 23.613 12.447 23.108 0.1437 -0.2027 0.0434 19LYS SC1 3175 23.413 12.189 23.109 -0.0267 -0.0373 -0.0662 19LYS SC2 3176 23.160 11.965 23.278 0.0003 0.0649 0.1772 20ASN BB 3177 23.418 12.607 22.863 -0.0310 0.1455 -0.1202 20ASN SC1 3178 23.209 12.815 23.127 0.0475 0.0287 -0.3254 21ALA BB 3179 23.549 12.746 22.589 0.1515 -0.0474 0.0038 21ALA SC1 3180 23.546 12.506 22.465 -0.0454 -0.1235 0.1496 22ILE BB 3181 23.921 12.794 22.555 -0.3266 0.2367 0.1798 22ILE SC1 3182 23.907 12.612 22.843 0.0891 -0.0646 0.0209 23ASN BB 3183 24.092 12.992 22.394 0.1083 -0.1786 0.4749 23ASN SC1 3184 24.078 12.878 22.062 -0.1140 -0.1033 -0.3469 24MET BB 3185 24.191 13.368 22.320 0.2961 -0.0285 -0.1513 24MET SC1 3186 24.225 13.240 21.944 -0.1255 -0.0912 -0.0389 25LYS BB 3187 24.018 13.619 22.472 0.0565 0.1198 0.1903 25LYS SC1 3188 24.049 13.488 22.750 0.0905 0.1105 0.1625 25LYS SC2 3189 24.186 13.635 23.021 0.1591 -0.0826 0.1684 26ASP BB 3190 23.788 13.639 22.318 0.1732 -0.2228 0.0106 26ASP SC1 3191 23.793 13.941 22.187 -0.0263 0.1067 -0.0940 27VAL BB 3192 23.798 13.469 22.047 -0.0332 0.1172 0.0868 27VAL SC1 3193 23.794 13.225 22.207 -0.1673 0.0745 0.0190 28LYS BB 3194 23.605 13.350 21.835 -0.1455 0.0438 -0.2009 28LYS SC1 3195 23.748 13.044 21.796 -0.3392 -0.3978 0.2759 28LYS SC2 3196 23.809 12.702 21.764 0.2254 0.1874 -0.2352 29ASP BB 3197 23.292 13.332 21.781 0.2044 -0.1447 -0.1027 29ASP SC1 3198 23.297 13.623 21.667 -0.0860 0.1258 -0.2718 30LEU BB 3199 22.993 13.212 21.817 -0.2961 0.1183 0.0648 30LEU SC1 3200 22.727 13.215 21.566 -0.0643 -0.0345 -0.0072 31GLY BB 3201 22.898 12.910 21.838 -0.0170 -0.1142 -0.5005 32LYS BB 3202 23.113 12.689 21.936 -0.2381 -0.2541 0.1270 32LYS SC1 3203 22.864 12.540 22.002 -0.0996 0.4373 -0.2137 32LYS SC2 3204 22.875 12.207 22.088 0.1764 0.3165 0.0760 33THR BB 3205 23.199 12.577 22.274 -0.1186 0.2486 0.0037 33THR SC1 3206 23.305 12.305 22.184 -0.0040 0.2459 0.1425 34MET BB 3207 22.941 12.635 22.445 -0.1234 0.0025 -0.0614 34MET SC1 3208 22.724 12.358 22.548 -0.1380 -0.1114 0.0302 35LYS BB 3209 22.972 12.824 22.708 -0.3819 0.1646 -0.2111 35LYS SC1 3210 22.743 12.793 22.950 0.2247 -0.2104 -0.1051 35LYS SC2 3211 22.513 12.956 23.104 -0.2051 0.0698 0.1158 36ASP BB 3212 22.908 13.126 22.666 -0.0073 0.0995 -0.2417 36ASP SC1 3213 22.649 13.274 22.768 0.1744 0.2090 0.2838 37GLN BB 3214 23.136 13.384 22.695 -0.1002 0.1569 -0.3014 37GLN SC1 3215 22.984 13.762 22.649 0.1383 -0.1356 -0.0560 38ALA BB 3216 23.322 13.494 22.895 0.0337 0.2258 0.2613 38ALA SC1 3217 23.512 13.553 22.713 -0.0674 0.2506 0.1626 39LEU BB 3218 23.431 13.403 23.121 0.1106 -0.0559 0.0852 39LEU SC1 3219 23.790 13.364 23.106 0.0535 0.2224 0.1176 40LYS BB 3220 23.475 13.181 23.390 0.2540 -0.3007 -0.0783 40LYS SC1 3221 23.637 13.356 23.544 -0.4394 0.0149 0.0142 40LYS SC2 3222 23.821 13.442 23.809 0.0392 -0.2098 -0.2454 41ASP BB 3223 23.217 13.018 23.554 0.0575 -0.1542 -0.1316 41ASP SC1 3224 23.450 12.784 23.728 0.4937 -0.2474 -0.0300 42ASP BB 3225 22.913 12.886 23.509 0.0561 -0.4499 0.0953 42ASP SC1 3226 22.654 13.116 23.534 -0.1233 0.2190 -0.0425 43ASP BB 3227 22.744 12.660 23.402 -0.1944 -0.3964 -0.2011 43ASP SC1 3228 22.785 12.340 23.363 0.0936 -0.0627 -0.2367 44ALA BB 3229 22.375 12.530 23.399 -0.0436 -0.1161 0.1570 44ALA SC1 3230 22.222 12.660 23.218 -0.0216 -0.3032 0.0009 45GLU BB 3231 22.360 12.288 23.627 -0.1470 0.1261 -0.0863 45GLU SC1 3232 22.205 11.904 23.567 -0.0054 -0.0398 0.1239 46THR BB 3233 22.241 12.286 23.975 0.0844 0.0216 0.2610 46THR SC1 3234 22.005 12.475 24.013 0.0069 -0.0892 0.3345 47GLY BB 3235 22.216 12.004 24.175 0.2516 0.0429 -0.1701 48LEU BB 3236 22.442 11.829 24.028 -0.1363 0.0823 0.3886 48LEU SC1 3237 22.645 12.064 24.038 0.0192 -0.3330 0.4413 49THR BB 3238 22.431 11.526 24.016 0.0619 -0.0844 -0.1782 49THR SC1 3239 22.714 11.413 24.029 0.1508 0.1472 -0.0373 50ASP BB 3240 22.319 11.316 24.273 -0.2452 -0.2381 -0.0034 50ASP SC1 3241 21.986 11.384 24.252 0.0595 -0.1629 -0.3571 51GLY BB 3242 22.435 11.238 24.541 -0.1421 -0.3426 -0.1619 52GLU BB 3243 22.671 11.030 24.444 0.0767 0.1758 -0.0150 52GLU SC1 3244 22.450 10.772 24.658 -0.1147 0.1820 0.1672 53GLU BB 3245 22.895 11.104 24.278 0.1913 0.0754 0.0197 53GLU SC1 3246 22.909 11.495 24.409 -0.0051 -0.0919 -0.0984 54LYS BB 3247 23.046 10.864 24.096 0.0826 -0.2770 0.1452 54LYS SC1 3248 22.892 10.715 23.947 -0.2809 0.0621 -0.0995 54LYS SC2 3249 22.603 10.541 23.787 0.0665 -0.1699 0.2063 55GLU BB 3250 23.332 10.744 24.190 0.0189 0.0866 0.0644 55GLU SC1 3251 23.251 10.411 24.005 0.5923 -0.0945 0.0233 56GLU BB 3252 23.540 10.708 24.482 -0.1039 -0.0007 0.0481 56GLU SC1 3253 23.336 10.721 24.831 -0.2185 0.2102 -0.0497 57PRO BB 3254 23.806 10.581 24.641 0.0136 0.0399 -0.0470 57PRO SC1 3255 23.635 10.307 24.617 0.1087 -0.4353 -0.0103 58LYS BB 3256 23.846 10.440 24.947 -0.0324 0.0169 -0.1836 58LYS SC1 3257 23.978 10.716 25.031 -0.0797 0.0497 0.1219 58LYS SC2 3258 23.975 11.005 25.238 -0.2047 0.0678 -0.1781 59GLU BB 3259 24.066 10.218 24.962 -0.1007 -0.1487 0.0342 59GLU SC1 3260 23.796 9.964 25.128 -0.0938 -0.0497 0.3040 60GLU BB 3261 24.351 10.332 25.014 -0.3662 -0.0128 -0.2555 60GLU SC1 3262 24.424 10.344 25.415 -0.2545 -0.1245 -0.0104 61GLU BB 3263 24.597 10.490 24.860 -0.0067 -0.1050 0.2419 61GLU SC1 3264 24.722 10.802 24.823 -0.0027 0.0734 0.0238 1LYS BB 3265 3.529 13.928 12.630 -0.2080 0.1013 -0.0402 1LYS SC1 3266 3.821 13.761 12.609 0.0191 -0.1522 -0.3279 1LYS SC2 3267 4.179 13.750 12.429 0.1853 0.0005 0.1429 2LYS BB 3268 3.560 14.184 12.822 0.0162 0.0166 -0.3816 2LYS SC1 3269 3.594 14.063 13.150 0.0624 0.0649 -0.2720 2LYS SC2 3270 3.849 13.952 13.408 0.0392 -0.2161 0.0683 3CYS BB 3271 3.372 14.466 12.783 -0.0182 -0.3306 0.2213 3CYS SC1 3272 3.223 14.462 12.495 0.0632 0.1986 0.1378 4LEU BB 3273 3.632 14.659 12.723 0.1326 -0.2009 0.0869 4LEU SC1 3274 3.788 14.596 13.057 -0.0143 0.3584 -0.1021 5PHE BB 3275 3.903 14.733 12.601 -0.4979 0.1704 -0.1420 5PHE SC1 3276 3.896 14.652 12.321 -0.3293 -0.0871 0.1776 5PHE SC2 3277 3.918 14.362 12.145 -0.1960 -0.1513 0.2982 5PHE SC3 3278 4.158 14.438 12.288 -0.1121 0.2011 -0.0138 6LYS BB 3279 4.201 14.591 12.700 -0.1094 0.1063 0.0216 6LYS SC1 3280 4.261 14.649 13.015 0.1017 0.2489 -0.4487 6LYS SC2 3281 4.427 14.905 12.993 0.1167 -0.2081 -0.0822 7LYS BB 3282 4.470 14.698 12.517 0.0392 0.0074 -0.0712 7LYS SC1 3283 4.272 14.859 12.352 -0.1323 0.2398 -0.0957 7LYS SC2 3284 3.982 15.096 12.325 -0.2778 -0.1000 0.1811 8LYS BB 3285 4.729 14.529 12.553 0.1873 0.2382 -0.0056 8LYS SC1 3286 4.768 14.285 12.369 0.2162 -0.1044 -0.0200 8LYS SC2 3287 4.868 14.098 12.189 0.0890 -0.1930 0.0372 9ASN BB 3288 4.701 14.432 12.883 -0.1108 -0.0966 0.2784 9ASN SC1 3289 5.055 14.471 12.909 0.2553 -0.2529 -0.5260 10LYS BB 3290 4.585 14.146 13.063 0.0361 0.0940 -0.1662 10LYS SC1 3291 4.696 13.933 12.932 -0.3636 -0.0352 0.1666 10LYS SC2 3292 4.968 13.703 12.777 -0.2301 0.2933 -0.0064 11LYS BB 3293 4.707 14.126 13.440 -0.1913 -0.3181 0.1192 11LYS SC1 3294 4.660 13.854 13.425 -0.1559 -0.0299 0.3898 11LYS SC2 3295 4.770 13.525 13.581 0.0795 -0.3979 0.2562 12LYS BB 3296 4.662 14.345 13.699 -0.1240 0.1066 -0.0383 12LYS SC1 3297 4.428 14.276 13.875 0.0447 -0.3019 -0.0031 12LYS SC2 3298 4.075 14.374 13.897 -0.0275 -0.1133 0.3299 13GLY BB 3299 4.820 14.632 13.787 -0.2168 -0.1334 0.1748 14LYS BB 3300 5.076 14.753 13.996 -0.1146 0.1759 -0.1110 14LYS SC1 3301 5.258 14.819 13.775 -0.2223 0.1424 -0.1642 14LYS SC2 3302 5.415 14.766 13.466 -0.3058 -0.3160 0.1552 15GLU BB 3303 5.102 14.858 14.272 0.0100 0.0840 -0.1553 15GLU SC1 3304 5.424 14.865 14.469 -0.0346 0.0362 -0.0716 16LYS BB 3305 4.938 14.978 14.530 0.0256 -0.0215 0.0541 16LYS SC1 3306 5.111 15.243 14.569 -0.1089 -0.0528 0.1615 16LYS SC2 3307 5.094 15.418 14.860 0.1410 0.2504 -0.0149 17GLY BB 3308 4.949 14.846 14.798 -0.0814 -0.3041 0.1774 18GLY BB 3309 4.919 15.086 15.033 -0.2094 0.3070 -0.2229 19LYS BB 3310 4.813 15.028 15.329 0.3934 -0.1329 0.1009 19LYS SC1 3311 4.612 14.855 15.214 -0.0537 -0.0507 -0.0263 19LYS SC2 3312 4.392 15.008 15.043 -0.0191 -0.1644 0.1921 20ASN BB 3313 4.951 14.811 15.525 0.2478 -0.0934 -0.2828 20ASN SC1 3314 4.761 14.921 15.769 -0.0091 -0.2467 0.0226 21ALA BB 3315 5.265 14.794 15.557 0.1161 -0.1801 -0.0423 21ALA SC1 3316 5.291 14.569 15.704 0.1438 -0.1519 -0.0036 22ILE BB 3317 5.509 14.805 15.344 0.0842 0.1739 0.1562 22ILE SC1 3318 5.751 14.570 15.388 0.2956 0.3589 0.0048 23ASN BB 3319 5.725 15.069 15.272 -0.2023 0.0251 0.0006 23ASN SC1 3320 5.724 15.217 15.608 0.3317 0.2193 0.1506 24MET BB 3321 5.671 15.324 15.127 -0.2302 -0.1173 -0.1861 24MET SC1 3322 5.927 15.557 14.924 -0.1248 -0.3641 0.1519 25LYS BB 3323 5.477 15.531 15.182 0.0554 0.0516 0.2848 25LYS SC1 3324 5.549 15.847 15.157 -0.2217 0.2303 0.1551 25LYS SC2 3325 5.660 16.117 15.342 -0.1777 0.1036 0.0368 26ASP BB 3326 5.374 15.513 15.488 0.0083 0.0115 -0.0513 26ASP SC1 3327 5.247 15.206 15.388 0.0710 0.2122 0.3186 27VAL BB 3328 5.104 15.625 15.720 -0.1893 -0.3907 0.0151 27VAL SC1 3329 4.905 15.802 15.600 -0.0967 -0.3119 -0.0239 28LYS BB 3330 5.081 15.640 16.076 0.0079 0.0387 -0.0743 28LYS SC1 3331 4.780 15.727 16.106 0.1203 0.1313 0.1001 28LYS SC2 3332 4.497 15.915 16.230 0.1192 -0.1676 0.0534 29ASP BB 3333 5.229 15.430 16.266 -0.1501 -0.4149 0.0644 29ASP SC1 3334 5.480 15.680 16.254 -0.0662 -0.3141 0.0686 30LEU BB 3335 5.210 15.491 16.573 0.3157 -0.1627 0.0342 30LEU SC1 3336 5.411 15.288 16.722 0.2611 0.5729 0.0508 31GLY BB 3337 5.105 15.808 16.702 -0.4020 0.2663 0.0181 32LYS BB 3338 4.865 15.850 16.884 0.0032 0.1573 -0.3586 32LYS SC1 3339 4.942 16.025 17.124 0.1759 0.0305 -0.2561 32LYS SC2 3340 4.953 16.246 17.408 0.1304 0.3423 0.3734 33THR BB 3341 4.720 16.088 16.670 -0.3224 0.2216 0.1120 33THR SC1 3342 4.459 16.247 16.669 -0.3426 0.1886 0.1130 34MET BB 3343 5.022 16.215 16.555 -0.2010 0.2167 0.0458 34MET SC1 3344 5.089 16.075 16.270 0.2181 -0.1004 -0.1362 35LYS BB 3345 5.140 16.534 16.591 -0.2097 0.1985 0.0719 35LYS SC1 3346 5.108 16.768 16.365 0.0666 0.0661 -0.1183 35LYS SC2 3347 5.214 17.092 16.349 0.0843 0.1769 0.0588 36ASP BB 3348 5.453 16.607 16.682 -0.3373 -0.1812 -0.3295 36ASP SC1 3349 5.682 16.449 16.538 0.0110 0.3476 -0.1926 37GLN BB 3350 5.669 16.524 16.992 0.3091 -0.3297 0.1202 37GLN SC1 3351 5.851 16.229 16.967 -0.1196 -0.1571 -0.1142 38ALA BB 3352 5.670 16.728 17.279 -0.1600 -0.2539 0.2370 38ALA SC1 3353 5.578 16.943 17.144 -0.0663 -0.0348 0.5123 39LEU BB 3354 5.553 16.859 17.541 -0.1838 -0.1554 0.1637 39LEU SC1 3355 5.577 16.607 17.781 -0.2196 -0.3752 -0.2304 40LYS BB 3356 5.317 17.024 17.466 0.2756 0.1586 0.2188 40LYS SC1 3357 5.362 17.228 17.288 0.1489 0.1380 -0.1488 40LYS SC2 3358 5.252 17.558 17.316 -0.1391 -0.0542 -0.1147 41ASP BB 3359 5.202 17.162 17.749 -0.0459 0.0330 -0.0219 41ASP SC1 3360 5.428 17.428 17.732 0.4762 0.1712 -0.3775 42ASP BB 3361 5.184 16.918 17.900 -0.0805 0.1333 0.2824 42ASP SC1 3362 5.126 17.025 18.218 -0.5461 0.0084 -0.1630 43ASP BB 3363 5.159 16.594 17.779 -0.0854 -0.3182 0.3014 43ASP SC1 3364 5.029 16.674 17.458 0.0678 0.2056 0.1950 44ALA BB 3365 5.300 16.253 17.848 -0.0632 -0.1710 0.1854 44ALA SC1 3366 5.554 16.192 17.781 -0.1298 -0.1417 -0.1055 45GLU BB 3367 5.136 16.050 17.895 -0.0542 -0.2230 -0.5123 45GLU SC1 3368 5.261 15.918 17.550 -0.2326 0.0298 0.1668 46THR BB 3369 5.185 15.692 17.987 -0.0705 -0.5585 -0.2111 46THR SC1 3370 5.483 15.741 17.938 -0.1399 -0.0140 -0.1579 47GLY BB 3371 5.088 15.356 18.071 0.0952 -0.0018 -0.0838 48LEU BB 3372 5.135 15.341 18.377 0.3211 0.0883 0.2363 48LEU SC1 3373 5.465 15.327 18.262 -0.2367 0.3529 0.0629 49THR BB 3374 5.014 15.508 18.638 -0.0294 -0.0121 0.0564 49THR SC1 3375 5.036 15.352 18.899 -0.0030 -0.0128 0.0539 50ASP BB 3376 5.033 15.856 18.649 -0.0255 -0.0543 0.4231 50ASP SC1 3377 5.065 15.951 18.354 0.2200 0.1191 0.0878 51GLY BB 3378 4.692 16.005 18.585 -0.2079 0.0078 0.1509 52GLU BB 3379 4.455 15.748 18.616 0.0282 0.1010 0.1047 52GLU SC1 3380 4.524 15.755 18.949 0.1654 0.3199 -0.1517 53GLU BB 3381 4.196 15.757 18.407 -0.2763 -0.3631 0.1872 53GLU SC1 3382 3.896 15.514 18.471 0.1142 -0.3036 -0.3762 54LYS BB 3383 4.192 16.010 18.215 -0.3537 -0.2090 -0.1086 54LYS SC1 3384 4.398 16.186 18.370 -0.1514 -0.1907 -0.0112 54LYS SC2 3385 4.401 16.560 18.415 -0.2073 0.6671 -0.4432 55GLU BB 3386 4.229 16.077 17.880 0.3156 0.3106 0.6691 55GLU SC1 3387 4.221 16.474 17.963 -0.1280 -0.2428 0.2925 56GLU BB 3388 4.010 15.969 17.665 0.1265 0.0213 0.1406 56GLU SC1 3389 4.251 15.766 17.503 -0.1750 0.1431 -0.1832 57PRO BB 3390 3.877 16.201 17.473 0.1098 0.0247 -0.0443 57PRO SC1 3391 4.176 16.297 17.447 0.1189 -0.0313 0.1388 58LYS BB 3392 3.690 16.429 17.591 -0.1535 -0.3328 -0.3862 58LYS SC1 3393 3.829 16.727 17.742 0.1128 0.1246 -0.0742 58LYS SC2 3394 3.922 17.077 17.789 0.0448 -0.1626 -0.2869 59GLU BB 3395 3.464 16.506 17.816 0.0576 0.2146 0.1520 59GLU SC1 3396 3.280 16.758 17.594 -0.2138 0.0119 0.0561 60GLU BB 3397 3.321 16.324 18.046 0.1255 -0.1358 -0.0046 60GLU SC1 3398 3.048 16.160 17.837 -0.0292 0.1567 -0.2511 61GLU BB 3399 3.476 16.360 18.396 -0.2341 -0.1862 0.0449 61GLU SC1 3400 3.361 16.664 18.583 -0.2362 -0.2932 -0.3350 1LYS BB 3401 -1.704 6.068 8.490 -0.1266 -0.3207 0.0293 1LYS SC1 3402 -1.459 5.889 8.580 -0.0546 -0.1967 -0.0919 1LYS SC2 3403 -1.264 5.651 8.695 -0.0598 0.1665 -0.0256 2LYS BB 3404 -1.935 5.807 8.506 0.2139 -0.2308 -0.0999 2LYS SC1 3405 -2.138 5.861 8.334 -0.2821 -0.0180 0.2154 2LYS SC2 3406 -2.267 5.893 8.030 0.1957 -0.0877 -0.2216 3CYS BB 3407 -1.960 5.623 8.761 -0.0646 0.0360 0.0800 3CYS SC1 3408 -2.139 5.786 9.009 0.2463 0.0157 -0.2121 4LEU BB 3409 -1.719 5.691 8.940 -0.1218 0.0098 -0.1662 4LEU SC1 3410 -1.595 5.350 8.985 0.1071 0.0808 0.3561 5PHE BB 3411 -1.782 5.870 9.245 -0.0441 0.0904 0.3205 5PHE SC1 3412 -1.985 5.659 9.324 -0.2613 -0.0749 0.0283 5PHE SC2 3413 -2.172 5.407 9.455 -0.0564 -0.0916 0.2972 5PHE SC3 3414 -2.235 5.672 9.553 -0.1110 -0.0657 0.1935 6LYS BB 3415 -1.973 6.173 9.300 -0.0661 -0.1090 -0.1753 6LYS SC1 3416 -1.850 6.284 9.604 -0.1459 -0.1977 -0.0659 6LYS SC2 3417 -1.754 6.561 9.795 -0.0488 -0.1659 0.1430 7LYS BB 3418 -2.274 6.186 9.157 0.1030 -0.0241 0.1942 7LYS SC1 3419 -2.359 5.955 9.339 -0.0142 0.0195 -0.1935 7LYS SC2 3420 -2.691 5.887 9.495 -0.0550 -0.3448 0.2252 8LYS BB 3421 -2.313 6.110 8.824 -0.0024 -0.1950 0.1180 8LYS SC1 3422 -2.404 5.800 8.748 -0.3138 -0.1301 0.1163 8LYS SC2 3423 -2.354 5.497 8.535 -0.0941 -0.0341 0.3631 9ASN BB 3424 -2.314 6.382 8.604 -0.2013 0.0776 -0.2363 9ASN SC1 3425 -2.253 6.240 8.310 0.0365 0.0547 -0.1072 10LYS BB 3426 -2.557 6.608 8.583 -0.1441 -0.1740 0.1544 10LYS SC1 3427 -2.394 6.717 8.345 -0.4335 -0.6407 -0.2609 10LYS SC2 3428 -2.226 6.601 8.086 -0.0927 -0.2180 -0.1970 11LYS BB 3429 -2.720 6.802 8.874 0.0570 -0.2761 0.6326 11LYS SC1 3430 -3.009 6.828 8.738 0.1357 0.0186 -0.1760 11LYS SC2 3431 -3.351 6.723 8.699 -0.4408 0.2057 -0.2007 12LYS BB 3432 -2.663 6.886 9.159 0.0234 -0.0522 -0.0438 12LYS SC1 3433 -2.954 7.059 9.195 -0.1431 -0.0734 0.2288 12LYS SC2 3434 -3.049 7.374 9.277 -0.2189 -0.0918 0.3978 13GLY BB 3435 -2.328 6.975 9.170 0.2059 -0.1175 -0.1458 14LYS BB 3436 -2.189 7.291 9.124 0.2595 0.1898 -0.0060 14LYS SC1 3437 -2.234 7.307 9.426 -0.1902 -0.0028 0.2724 14LYS SC2 3438 -2.359 7.551 9.565 0.0673 -0.0558 0.2332 15GLU BB 3439 -1.923 7.289 8.991 0.0280 0.3679 -0.0884 15GLU SC1 3440 -1.697 7.322 9.299 -0.3890 -0.1993 -0.0096 16LYS BB 3441 -1.817 7.218 8.651 0.0675 0.2037 -0.0698 16LYS SC1 3442 -2.082 7.387 8.576 -0.1834 -0.2405 0.0905 16LYS SC2 3443 -2.184 7.664 8.418 0.2398 0.1129 0.1100 17GLY BB 3444 -1.759 6.881 8.680 -0.4833 0.0772 -0.0436 18GLY BB 3445 -1.515 6.684 8.848 0.0431 0.3496 -0.3964 19LYS BB 3446 -1.229 6.732 9.022 -0.0841 -0.2125 0.1750 19LYS SC1 3447 -1.233 6.521 9.315 0.3015 0.0243 0.4987 19LYS SC2 3448 -1.387 6.285 9.444 -0.2597 -0.1076 -0.2448 20ASN BB 3449 -0.996 6.964 8.879 -0.0134 0.2591 0.0424 20ASN SC1 3450 -0.921 6.756 8.629 0.1788 0.0727 0.4303 21ALA BB 3451 -0.839 7.211 9.046 -0.1210 0.0339 -0.2152 21ALA SC1 3452 -0.629 7.292 8.897 0.0720 0.3422 0.2050 22ILE BB 3453 -0.887 7.465 9.279 -0.0098 0.1687 -0.0063 22ILE SC1 3454 -1.149 7.603 9.111 0.0346 0.1455 -0.0953 23ASN BB 3455 -0.794 7.402 9.564 0.0846 -0.0787 -0.4755 23ASN SC1 3456 -1.079 7.295 9.761 -0.0478 -0.2139 -0.0972 24MET BB 3457 -0.493 7.206 9.628 0.2281 0.0780 0.0167 24MET SC1 3458 -0.373 7.159 9.237 0.2802 -0.0338 -0.1630 25LYS BB 3459 -0.320 7.054 9.854 0.0169 0.2450 -0.2713 25LYS SC1 3460 -0.485 7.031 10.128 -0.1519 -0.1472 0.2289 25LYS SC2 3461 -0.589 6.793 10.330 -0.1684 -0.0308 0.0875 26ASP BB 3462 -0.162 6.790 9.890 0.1753 0.0063 0.0956 26ASP SC1 3463 -0.148 6.729 10.238 -0.4306 0.0995 -0.0891 27VAL BB 3464 0.059 6.618 9.747 -0.0261 0.1941 0.2932 27VAL SC1 3465 0.192 6.378 9.848 0.3541 0.1376 -0.2952 28LYS BB 3466 0.215 6.654 9.469 -0.1197 0.4339 0.2908 28LYS SC1 3467 0.359 6.433 9.323 -0.1239 0.1124 -0.0878 28LYS SC2 3468 0.577 6.274 9.048 -0.2172 0.0658 0.4406 29ASP BB 3469 0.357 6.947 9.475 -0.0744 -0.1551 0.1900 29ASP SC1 3470 0.036 7.057 9.543 -0.1710 0.1355 -0.0235 30LEU BB 3471 0.550 7.086 9.682 -0.1626 0.0452 -0.1759 30LEU SC1 3472 0.867 6.937 9.733 -0.2084 0.1414 -0.0546 31GLY BB 3473 0.666 7.357 9.814 0.0101 0.3281 0.2940 32LYS BB 3474 0.394 7.531 9.923 0.1071 0.0550 0.0636 32LYS SC1 3475 0.485 7.811 10.008 0.2761 -0.1581 0.0704 32LYS SC2 3476 0.387 7.773 10.370 -0.1504 -0.1910 -0.4150 33THR BB 3477 0.139 7.284 9.959 -0.0076 0.2026 0.3437 33THR SC1 3478 -0.046 7.189 10.182 -0.0062 -0.0592 0.2375 34MET BB 3479 -0.099 7.470 9.827 -0.0501 0.0896 0.2199 34MET SC1 3480 -0.031 7.727 10.124 -0.0248 -0.0966 -0.0573 35LYS BB 3481 -0.141 7.518 9.464 -0.1585 0.0730 0.0115 35LYS SC1 3482 -0.436 7.602 9.452 -0.6610 0.0310 -0.2276 35LYS SC2 3483 -0.605 7.861 9.358 0.0551 0.0285 -0.0295 36ASP BB 3484 0.002 7.640 9.281 -0.2259 0.1380 -0.0610 36ASP SC1 3485 -0.164 7.930 9.273 0.2957 -0.0069 -0.0716 37GLN BB 3486 0.338 7.739 9.202 -0.1215 0.0293 -0.1620 37GLN SC1 3487 0.512 8.092 9.207 0.1263 -0.2735 0.0139 38ALA BB 3488 0.517 7.734 8.879 0.0836 0.1603 0.0176 38ALA SC1 3489 0.674 7.953 8.866 0.0717 0.1807 0.1917 39LEU BB 3490 0.362 7.613 8.667 -0.0075 -0.1122 -0.1604 39LEU SC1 3491 0.050 7.505 8.792 0.2516 0.1446 -0.2106 40LYS BB 3492 0.410 7.289 8.506 0.2370 0.1685 -0.0713 40LYS SC1 3493 0.652 7.270 8.748 -0.0585 -0.1525 -0.0092 40LYS SC2 3494 0.974 7.163 8.764 0.1815 -0.0998 0.0233 41ASP BB 3495 0.664 7.441 8.273 0.2029 0.0586 0.1087 41ASP SC1 3496 0.573 7.778 8.205 -0.2305 0.3191 -0.0596 42ASP BB 3497 0.890 7.204 8.198 -0.1363 -0.2786 -0.0592 42ASP SC1 3498 0.764 7.073 7.912 -0.0337 0.0178 -0.5616 43ASP BB 3499 1.145 7.122 8.339 -0.1326 0.0500 0.1758 43ASP SC1 3500 1.302 7.382 8.538 0.5185 -0.2327 -0.0168 44ALA BB 3501 1.458 7.090 8.201 -0.2369 -0.1765 -0.2687 44ALA SC1 3502 1.424 6.830 8.265 -0.3164 -0.1101 -0.0308 45GLU BB 3503 1.704 7.182 8.420 -0.0264 0.1066 0.2115 45GLU SC1 3504 1.879 6.851 8.396 -0.1600 -0.0780 -0.1453 46THR BB 3505 1.888 7.402 8.281 -0.2449 0.2406 0.2072 46THR SC1 3506 2.129 7.266 8.409 -0.1925 0.0720 -0.0631 47GLY BB 3507 2.011 7.746 8.316 -0.1122 0.2148 0.2127 48LEU BB 3508 2.307 7.863 8.423 -0.0437 -0.1425 -0.1498 48LEU SC1 3509 2.321 8.194 8.401 0.2250 0.0007 0.2258 49THR BB 3510 2.392 7.744 8.711 -0.2856 -0.0079 0.1681 49THR SC1 3511 2.148 7.562 8.724 -0.1757 -0.1682 0.0231 50ASP BB 3512 2.579 7.466 8.797 0.1362 -0.1477 0.2232 50ASP SC1 3513 2.833 7.606 8.741 -0.0298 -0.0997 0.0436 51GLY BB 3514 2.489 7.320 9.057 0.1001 0.1141 -0.0129 52GLU BB 3515 2.234 7.343 9.276 0.4580 -0.0038 -0.0515 52GLU SC1 3516 2.326 7.186 9.625 0.1946 0.2757 -0.1856 53GLU BB 3517 1.992 7.458 9.168 0.0427 -0.0518 -0.0064 53GLU SC1 3518 2.018 7.866 9.204 0.0966 -0.2188 0.1190 54LYS BB 3519 1.679 7.442 9.317 0.0392 -0.1349 -0.2828 54LYS SC1 3520 1.551 7.681 9.406 0.1317 0.3321 -0.1417 54LYS SC2 3521 1.253 7.797 9.539 0.1408 -0.0284 0.0466 55GLU BB 3522 1.410 7.259 9.435 -0.0868 0.0541 -0.2621 55GLU SC1 3523 1.027 7.411 9.541 -0.1365 0.0035 0.2863 56GLU BB 3524 1.358 7.028 9.622 -0.2667 0.1667 0.3042 56GLU SC1 3525 1.535 7.012 9.896 0.0083 -0.0141 0.1139 57PRO BB 3526 1.265 6.716 9.607 0.2996 -0.1196 -0.0213 57PRO SC1 3527 1.087 6.465 9.585 0.2684 0.1144 -0.3603 58LYS BB 3528 1.421 6.613 9.309 0.0385 0.1608 0.0427 58LYS SC1 3529 1.478 6.905 9.183 -0.0248 -0.0643 -0.0935 58LYS SC2 3530 1.643 7.105 9.001 -0.0731 0.2427 -0.1849 59GLU BB 3531 1.340 6.258 9.240 0.1829 0.0176 0.2521 59GLU SC1 3532 1.024 6.175 9.129 0.0169 -0.0202 0.2038 60GLU BB 3533 1.682 6.198 9.254 -0.3065 -0.3822 -0.2097 60GLU SC1 3534 1.676 5.874 9.058 0.1639 0.3525 0.4337 61GLU BB 3535 1.933 6.456 9.413 0.1541 -0.1977 -0.0113 61GLU SC1 3536 1.951 6.336 9.796 0.0744 0.1094 0.1313 1LYS BB 3537 1.757 25.194 17.787 0.0563 -0.0289 -0.2931 1LYS SC1 3538 1.716 25.480 17.886 0.2998 -0.2396 -0.3940 1LYS SC2 3539 1.591 25.785 17.977 -0.3316 0.0824 -0.0857 2LYS BB 3540 2.032 25.145 17.589 0.0641 0.1919 -0.3598 2LYS SC1 3541 2.037 24.878 17.460 -0.4652 -0.2318 0.3615 2LYS SC2 3542 2.118 24.511 17.584 -0.0008 -0.0424 -0.0773 3CYS BB 3543 2.160 25.240 17.254 -0.0623 0.2639 0.1518 3CYS SC1 3544 2.274 24.932 17.113 -0.3632 0.0582 -0.2634 4LEU BB 3545 2.406 25.461 17.321 0.0043 -0.0137 0.0464 4LEU SC1 3546 2.768 25.461 17.348 0.1149 -0.0038 0.1122 5PHE BB 3547 2.401 25.822 17.286 -0.2001 -0.0996 0.0154 5PHE SC1 3548 2.646 25.930 17.380 -0.1981 0.0375 -0.0929 5PHE SC2 3549 2.979 25.916 17.448 -0.1238 -0.0128 -0.4505 5PHE SC3 3550 2.809 25.770 17.632 -0.0343 0.6697 0.2237 6LYS BB 3551 2.150 26.006 17.399 -0.2050 0.2362 0.0965 6LYS SC1 3552 2.097 26.166 17.122 -0.1192 -0.0559 0.1482 6LYS SC2 3553 1.945 26.072 16.868 0.0652 -0.1730 -0.1373 7LYS BB 3554 2.275 26.198 17.587 -0.0739 0.0386 -0.0795 7LYS SC1 3555 2.442 25.975 17.757 0.3803 -0.5134 0.0285 7LYS SC2 3556 2.496 25.621 17.769 0.4849 -0.1727 0.0885 8LYS BB 3557 2.206 26.504 17.620 0.2149 -0.1111 -0.0074 8LYS SC1 3558 2.145 26.541 17.302 0.2018 -0.0664 0.2254 8LYS SC2 3559 1.892 26.638 17.054 0.0855 -0.1313 -0.4385 9ASN BB 3560 2.501 26.696 17.696 -0.0805 -0.1568 0.1657 9ASN SC1 3561 2.691 26.713 17.414 0.2970 0.0073 -0.0948 10LYS BB 3562 2.668 26.831 17.929 0.0900 -0.1405 0.0713 10LYS SC1 3563 2.688 27.167 17.928 0.2781 -0.0185 0.3138 10LYS SC2 3564 2.484 27.445 17.996 0.2283 -0.2394 0.2462 11LYS BB 3565 2.841 26.679 18.080 -0.0759 -0.0569 0.2590 11LYS SC1 3566 3.083 26.867 18.026 -0.0595 0.0473 -0.1213 11LYS SC2 3567 3.435 26.901 17.932 0.1841 -0.4659 -0.0158 12LYS BB 3568 2.814 26.524 18.368 0.1051 -0.0646 -0.0097 12LYS SC1 3569 2.867 26.729 18.576 0.1422 -0.2974 -0.3684 12LYS SC2 3570 3.093 26.931 18.681 0.0225 0.0753 0.0992 13GLY BB 3571 2.507 26.469 18.537 0.0175 0.4971 0.2839 14LYS BB 3572 2.375 26.184 18.688 -0.2000 0.1893 -0.2748 14LYS SC1 3573 2.132 26.283 18.750 0.2206 0.1294 0.0085 14LYS SC2 3574 1.916 26.103 18.601 -0.0138 -0.1005 0.1033 15GLU BB 3575 2.502 25.869 18.711 0.1202 -0.0508 -0.0084 15GLU SC1 3576 2.510 25.670 19.036 0.0219 -0.0742 0.1297 16LYS BB 3577 2.770 25.823 18.522 0.4444 -0.0420 0.2532 16LYS SC1 3578 2.996 25.746 18.712 -0.0099 0.3301 -0.0279 16LYS SC2 3579 3.289 25.613 18.644 0.1025 -0.5025 0.2888 17GLY BB 3580 2.828 25.642 18.266 0.2607 -0.0590 -0.2105 18GLY BB 3581 2.597 25.368 18.225 -0.0947 0.1643 -0.1063 19LYS BB 3582 2.593 24.998 18.318 0.3914 0.0707 -0.2883 19LYS SC1 3583 2.312 24.984 18.545 0.0466 0.1839 0.2342 19LYS SC2 3584 2.015 25.079 18.744 -0.1286 -0.3265 -0.0073 20ASN BB 3585 2.862 24.904 18.424 -0.1913 0.1659 -0.2212 20ASN SC1 3586 2.935 24.918 18.772 -0.2684 -0.3761 0.0460 21ALA BB 3587 2.925 24.670 18.270 0.2729 0.2796 -0.3183 21ALA SC1 3588 2.722 24.682 18.093 -0.0504 0.3707 0.0451 22ILE BB 3589 3.229 24.451 18.208 -0.1031 0.0960 0.3055 22ILE SC1 3590 3.190 24.113 18.229 0.0654 0.0384 -0.1803 23ASN BB 3591 3.366 24.497 17.916 -0.3326 -0.0879 0.0709 23ASN SC1 3592 3.419 24.167 17.791 -0.3272 -0.2836 0.1077 24MET BB 3593 3.356 24.757 17.739 0.3420 -0.1953 0.1806 24MET SC1 3594 3.133 24.932 18.003 0.2490 -0.0593 -0.4302 25LYS BB 3595 3.597 24.793 17.560 -0.1511 -0.0113 0.1543 25LYS SC1 3596 3.689 24.452 17.508 0.7759 -0.3850 -0.1215 25LYS SC2 3597 3.675 24.122 17.402 -0.1093 -0.2618 0.2877 26ASP BB 3598 3.768 25.038 17.508 0.0191 0.0646 -0.2968 26ASP SC1 3599 3.522 25.229 17.462 -0.0180 -0.2796 -0.1979 27VAL BB 3600 3.864 25.083 17.199 0.1265 0.1609 0.1599 27VAL SC1 3601 3.962 24.813 17.147 -0.2381 0.0119 0.2135 28LYS BB 3602 3.729 25.262 17.022 -0.1244 0.0243 -0.2316 28LYS SC1 3603 3.679 25.075 16.809 -0.2348 0.1397 0.2964 28LYS SC2 3604 3.727 24.940 16.442 0.3313 -0.1474 -0.2344 29ASP BB 3605 3.548 25.560 17.032 0.0735 0.0622 0.0183 29ASP SC1 3606 3.785 25.782 17.013 -0.1299 -0.2205 0.2662 30LEU BB 3607 3.273 25.642 16.836 -0.1595 -0.0677 0.0295 30LEU SC1 3608 3.073 25.831 17.074 0.0773 -0.0312 -0.0270 31GLY BB 3609 3.276 25.742 16.511 -0.1297 -0.0036 0.1057 32LYS BB 3610 3.014 25.579 16.368 0.0899 -0.0709 0.0081 32LYS SC1 3611 2.980 25.865 16.221 0.2406 -0.1370 -0.0804 32LYS SC2 3612 3.021 26.203 16.196 0.0114 -0.2200 0.1787 33THR BB 3613 2.970 25.319 16.170 0.0736 -0.0901 -0.0627 33THR SC1 3614 3.219 25.163 16.253 -0.0564 -0.3562 -0.1613 34MET BB 3615 2.738 25.182 15.957 0.0554 -0.2640 0.0201 34MET SC1 3616 2.484 25.334 16.244 0.0201 -0.0264 0.1035 35LYS BB 3617 2.577 25.298 15.681 -0.0252 -0.1227 -0.2940 35LYS SC1 3618 2.794 25.346 15.468 0.0477 0.4914 -0.0281 35LYS SC2 3619 2.980 25.497 15.169 -0.0788 -0.0929 0.3319 36ASP BB 3620 2.400 25.540 15.803 0.0051 0.4255 0.0898 36ASP SC1 3621 2.668 25.690 15.946 -0.4268 0.0153 0.1194 37GLN BB 3622 2.075 25.407 15.761 0.1005 0.1454 -0.4090 37GLN SC1 3623 1.936 25.774 15.657 0.0185 0.1000 0.3112 38ALA BB 3624 1.946 25.096 15.908 0.2560 -0.2027 0.1157 38ALA SC1 3625 1.814 24.991 15.697 -0.1779 -0.1808 0.3636 39LEU BB 3626 1.970 24.838 16.099 0.2106 -0.0645 -0.0056 39LEU SC1 3627 1.795 24.864 16.420 0.0643 0.2265 -0.2419 40LYS BB 3628 2.123 24.596 15.958 -0.1510 -0.0877 0.3752 40LYS SC1 3629 1.920 24.567 15.700 -0.0959 -0.3224 -0.1422 40LYS SC2 3630 1.963 24.479 15.322 0.2153 -0.2312 -0.2578 41ASP BB 3631 2.389 24.615 15.866 -0.0602 -0.2827 -0.1643 41ASP SC1 3632 2.370 24.533 15.527 0.1678 0.2122 0.2427 42ASP BB 3633 2.597 24.719 16.041 0.1259 -0.2879 0.1251 42ASP SC1 3634 2.389 24.893 16.269 -0.2539 0.0518 0.4564 43ASP BB 3635 2.744 24.491 16.215 -0.1630 -0.0445 -0.1642 43ASP SC1 3636 2.620 24.494 16.524 0.2803 -0.1538 -0.3252 44ALA BB 3637 3.013 24.455 16.314 -0.0497 0.4628 0.1696 44ALA SC1 3638 3.096 24.452 16.570 0.1680 -0.4166 0.1224 45GLU BB 3639 3.321 24.400 16.218 -0.0951 0.2772 -0.1346 45GLU SC1 3640 3.441 24.735 16.108 0.0678 -0.1041 -0.1469 46THR BB 3641 3.433 24.102 16.247 -0.0014 -0.4266 -0.0547 46THR SC1 3642 3.191 24.018 16.411 -0.1601 -0.4204 -0.2808 47GLY BB 3643 3.391 24.004 15.976 -0.2110 -0.1755 0.2312 48LEU BB 3644 3.498 23.751 15.813 0.0634 -0.0263 0.2089 48LEU SC1 3645 3.397 23.810 15.455 0.2353 0.1137 0.0040 49THR BB 3646 3.677 23.448 15.880 -0.1257 -0.0155 0.1065 49THR SC1 3647 3.465 23.320 15.702 -0.2690 -0.1684 0.3792 50ASP BB 3648 3.743 23.262 16.068 -0.1338 -0.3638 0.0230 50ASP SC1 3649 3.889 22.931 16.122 -0.0350 0.2525 0.1999 51GLY BB 3650 3.682 23.352 16.376 0.1939 -0.1812 0.0515 52GLU BB 3651 3.365 23.416 16.538 -0.4358 0.0684 -0.2519 52GLU SC1 3652 3.532 23.775 16.624 0.2800 0.1858 0.0985 53GLU BB 3653 3.237 23.206 16.753 0.0941 0.3595 0.1780 53GLU SC1 3654 2.855 23.296 16.711 0.2994 -0.3066 -0.1015 54LYS BB 3655 3.172 22.901 16.806 -0.2550 0.2563 -0.0001 54LYS SC1 3656 3.161 22.757 17.062 0.1099 0.0770 -0.0414 54LYS SC2 3657 2.938 22.628 17.275 0.0991 0.0888 0.0534 55GLU BB 3658 2.902 22.791 16.672 -0.5671 -0.2789 0.3296 55GLU SC1 3659 2.895 22.397 16.806 -0.0992 -0.0229 0.0299 56GLU BB 3660 2.639 22.809 16.895 0.0056 0.0232 0.2281 56GLU SC1 3661 2.816 23.024 17.182 0.0429 0.0449 0.1842 57PRO BB 3662 2.441 22.588 16.954 0.4010 0.0700 -0.3422 57PRO SC1 3663 2.441 22.479 16.632 0.2111 -0.1893 0.1847 58LYS BB 3664 2.570 22.368 17.185 0.1664 -0.1303 0.2249 58LYS SC1 3665 2.526 22.139 16.904 -0.3307 0.1455 0.0741 58LYS SC2 3666 2.262 21.892 16.837 -0.4790 -0.2810 0.2057 59GLU BB 3667 2.491 22.202 17.405 -0.2410 0.4602 0.1859 59GLU SC1 3668 2.457 21.840 17.275 -0.0080 -0.0025 0.0224 60GLU BB 3669 2.262 22.310 17.647 -0.0473 0.0465 0.2354 60GLU SC1 3670 2.486 22.480 17.939 0.1629 0.2491 -0.2953 61GLU BB 3671 2.003 22.530 17.629 -0.1087 -0.2584 0.2486 61GLU SC1 3672 2.095 22.700 17.282 -0.1294 0.2573 -0.0074 1LYS BB 3673 0.512 1.397 8.855 0.2498 0.0415 -0.1116 1LYS SC1 3674 0.645 1.107 9.020 0.3922 -0.1015 -0.2517 1LYS SC2 3675 0.923 1.063 9.243 0.0254 0.0743 -0.0214 2LYS BB 3676 0.658 1.614 8.667 0.3012 0.0855 -0.0948 2LYS SC1 3677 0.818 1.869 8.764 -0.2491 0.1674 -0.1702 2LYS SC2 3678 0.893 2.134 8.969 -0.2623 -0.2392 -0.0540 3CYS BB 3679 0.710 1.570 8.333 -0.0279 -0.1520 -0.1084 3CYS SC1 3680 0.514 1.298 8.355 -0.1247 0.0610 0.5052 4LEU BB 3681 1.029 1.552 8.174 -0.2372 0.1035 -0.1009 4LEU SC1 3682 1.137 1.393 8.443 -0.1688 0.2143 0.1490 5PHE BB 3683 1.144 1.293 7.973 0.0046 -0.1169 -0.1446 5PHE SC1 3684 0.827 1.174 8.053 -0.0213 -0.2432 -0.1632 5PHE SC2 3685 0.623 1.165 7.781 0.3668 0.2922 -0.4925 5PHE SC3 3686 0.556 1.366 7.978 0.1036 -0.0758 -0.1923 6LYS BB 3687 1.350 1.334 7.728 0.0046 0.1741 0.1830 6LYS SC1 3688 1.316 1.037 7.688 0.1440 0.1497 -0.0026 6LYS SC2 3689 1.251 0.839 7.434 0.3898 0.0305 -0.4676 7LYS BB 3690 1.674 1.293 7.707 0.0146 0.2712 -0.0168 7LYS SC1 3691 1.744 1.021 7.763 0.3365 -0.0309 -0.1549 7LYS SC2 3692 1.935 0.710 7.826 -0.2612 0.3616 -0.1769 8LYS BB 3693 1.859 1.633 7.731 -0.0905 -0.2629 -0.2451 8LYS SC1 3694 1.959 1.714 8.020 0.0462 0.0187 -0.0618 8LYS SC2 3695 2.109 1.950 8.239 -0.0948 -0.3028 -0.1351 9ASN BB 3696 1.959 1.872 7.474 0.0058 0.1073 0.2906 9ASN SC1 3697 1.998 1.684 7.205 0.0451 -0.4924 -0.1177 10LYS BB 3698 2.215 2.095 7.404 0.2304 -0.3376 -0.4022 10LYS SC1 3699 2.468 1.922 7.451 0.4248 -0.2037 -0.0774 10LYS SC2 3700 2.769 1.782 7.517 -0.1364 -0.3042 0.1511 11LYS BB 3701 2.197 2.297 7.150 -0.0181 0.3229 0.0206 11LYS SC1 3702 2.346 2.170 6.910 0.1482 -0.2869 0.1368 11LYS SC2 3703 2.371 1.992 6.601 0.0415 0.1891 -0.2794 12LYS BB 3704 2.312 2.636 7.073 0.2220 0.1822 0.1143 12LYS SC1 3705 2.365 2.774 6.808 0.2993 0.1581 -0.1140 12LYS SC2 3706 2.353 3.125 6.795 -0.0192 0.0212 0.0901 13GLY BB 3707 2.636 2.683 7.137 0.1544 0.0803 0.0208 14LYS BB 3708 2.834 2.919 6.931 0.1020 0.3723 -0.0365 14LYS SC1 3709 2.956 3.011 7.180 0.1323 0.0666 -0.3376 14LYS SC2 3710 3.211 3.230 7.024 0.4037 -0.2586 -0.0839 15GLU BB 3711 2.761 2.915 6.606 -0.0363 0.0138 0.0074 15GLU SC1 3712 2.991 2.690 6.342 -0.3682 -0.3165 0.0900 16LYS BB 3713 2.743 3.210 6.489 -0.0033 -0.0833 0.0990 16LYS SC1 3714 3.005 3.149 6.266 0.1919 -0.1318 0.1971 16LYS SC2 3715 3.337 3.033 6.275 -0.2875 0.0959 0.4053 17GLY BB 3716 2.989 3.336 6.609 0.1235 0.1134 0.1766 18GLY BB 3717 3.047 3.657 6.467 0.0848 -0.2580 0.1561 19LYS BB 3718 3.265 3.947 6.608 -0.0824 0.1580 -0.2088 19LYS SC1 3719 3.386 3.913 6.318 0.0274 0.0767 0.3321 19LYS SC2 3720 3.403 3.837 5.963 -0.1899 0.1063 -0.0349 20ASN BB 3721 3.203 4.237 6.662 -0.0546 -0.3296 0.1162 20ASN SC1 3722 3.486 4.489 6.704 -0.3668 0.3395 0.0993 21ALA BB 3723 3.149 4.332 6.969 -0.0297 0.3375 -0.1749 21ALA SC1 3724 2.954 4.145 6.957 -0.1863 0.4670 0.2061 22ILE BB 3725 3.241 4.654 7.050 0.0081 0.0641 -0.0292 22ILE SC1 3726 3.504 4.566 7.249 -0.0510 0.0338 0.0360 23ASN BB 3727 3.321 4.927 6.844 0.0230 -0.0231 0.0920 23ASN SC1 3728 3.294 5.140 7.080 0.1387 0.0021 -0.0597 24MET BB 3729 3.553 4.923 6.623 -0.0263 -0.2263 -0.0148 24MET SC1 3730 3.836 5.183 6.739 -0.0817 -0.0373 -0.0280 25LYS BB 3731 3.401 5.126 6.413 0.0033 0.0893 -0.1305 25LYS SC1 3732 3.441 4.976 6.139 0.0231 -0.1050 0.1733 25LYS SC2 3733 3.297 4.762 5.996 0.3413 -0.0889 -0.0636 26ASP BB 3734 3.085 4.971 6.376 -0.0291 0.0575 0.0584 26ASP SC1 3735 3.193 4.662 6.427 -0.2802 0.2888 0.0144 27VAL BB 3736 2.808 5.080 6.207 0.0611 0.2876 0.1272 27VAL SC1 3737 2.923 5.168 5.953 0.1840 0.2417 0.1664 28LYS BB 3738 2.549 4.965 6.299 -0.2085 -0.2304 -0.0861 28LYS SC1 3739 2.613 4.875 6.569 0.0907 0.3399 -0.4719 28LYS SC2 3740 2.910 4.689 6.727 0.2500 0.1330 -0.0832 29ASP BB 3741 2.383 4.707 6.214 -0.0892 -0.1816 0.2024 29ASP SC1 3742 2.297 4.525 6.452 0.1130 0.0089 -0.3424 30LEU BB 3743 2.230 4.625 5.943 -0.2237 -0.0877 0.2363 30LEU SC1 3744 2.466 4.473 5.716 -0.2435 -0.3148 -0.0962 31GLY BB 3745 2.021 4.454 5.854 0.2411 0.1946 -0.3801 32LYS BB 3746 1.732 4.513 5.792 0.1965 -0.0499 -0.0642 32LYS SC1 3747 1.814 4.822 5.891 -0.2016 0.1483 0.2328 32LYS SC2 3748 2.054 5.019 6.086 0.0498 -0.3876 0.5018 33THR BB 3749 1.557 4.328 5.580 0.1056 -0.1530 0.0936 33THR SC1 3750 1.691 4.365 5.308 0.4593 -0.2355 0.2516 34MET BB 3751 1.529 4.028 5.741 0.0794 0.1429 0.2217 34MET SC1 3752 1.913 3.950 5.817 -0.2057 0.1679 0.4224 35LYS BB 3753 1.415 4.072 6.074 -0.0600 0.0743 0.1682 35LYS SC1 3754 1.354 4.398 5.984 -0.2124 0.0721 -0.0248 35LYS SC2 3755 1.005 4.596 5.890 -0.2683 -0.0779 0.2149 36ASP BB 3756 1.148 3.949 6.220 0.0953 -0.4190 -0.0708 36ASP SC1 3757 0.862 3.940 6.083 0.0261 0.1026 -0.0025 37GLN BB 3758 1.243 3.694 6.369 -0.0231 0.0310 -0.4289 37GLN SC1 3759 1.537 3.657 6.592 0.3980 -0.0890 -0.1639 38ALA BB 3760 1.208 3.484 6.135 0.0293 -0.2874 0.0725 38ALA SC1 3761 1.104 3.283 6.281 0.1289 -0.4245 -0.0427 39LEU BB 3762 1.335 3.202 5.971 -0.0679 -0.1609 0.0766 39LEU SC1 3763 1.019 3.041 5.986 -0.1206 -0.0342 -0.0698 40LYS BB 3764 1.659 3.140 6.030 -0.2316 0.0469 0.1156 40LYS SC1 3765 1.764 2.852 6.124 0.2503 -0.3189 0.2440 40LYS SC2 3766 1.886 2.580 6.304 0.0268 -0.1081 -0.3223 41ASP BB 3767 1.928 3.346 5.938 0.1427 0.4263 0.1500 41ASP SC1 3768 1.962 3.458 5.616 -0.2178 -0.0986 0.0786 42ASP BB 3769 2.242 3.195 5.967 -0.0978 0.1607 0.0560 42ASP SC1 3770 2.319 3.326 6.262 -0.1289 -0.1311 0.3128 43ASP BB 3771 2.424 3.123 5.668 0.2041 -0.0563 -0.3947 43ASP SC1 3772 2.520 2.774 5.701 0.0596 -0.0088 -0.4875 44ALA BB 3773 2.620 3.236 5.472 -0.0078 0.2502 -0.1323 44ALA SC1 3774 2.645 3.475 5.595 0.1510 0.0517 0.2415 45GLU BB 3775 2.986 3.255 5.603 -0.1622 -0.0087 -0.1458 45GLU SC1 3776 3.098 3.635 5.613 0.0050 -0.2758 0.3276 46THR BB 3777 3.249 3.080 5.519 0.1598 -0.1549 -0.1507 46THR SC1 3778 3.341 2.985 5.794 -0.1750 0.1566 0.0800 47GLY BB 3779 3.303 2.821 5.294 -0.0873 0.1507 -0.2965 48LEU BB 3780 3.138 2.577 5.132 -0.2240 0.0298 -0.2056 48LEU SC1 3781 3.395 2.420 4.897 -0.1019 0.1371 0.2195 49THR BB 3782 2.854 2.456 5.259 0.2500 0.0343 -0.3656 49THR SC1 3783 2.659 2.520 5.034 -0.1909 0.0048 -0.0058 50ASP BB 3784 2.804 2.445 5.569 0.1065 0.3017 -0.1656 50ASP SC1 3785 3.141 2.485 5.632 0.0811 -0.1742 -0.0748 51GLY BB 3786 2.708 2.215 5.773 -0.2142 -0.1892 -0.0774 52GLU BB 3787 2.322 2.216 5.749 -0.2070 -0.2034 -0.3112 52GLU SC1 3788 2.349 2.299 5.314 0.0158 0.3716 -0.1658 53GLU BB 3789 2.233 1.911 5.816 -0.1100 -0.1647 -0.1634 53GLU SC1 3790 2.013 1.781 6.131 -0.1635 -0.1459 0.1932 54LYS BB 3791 2.575 1.760 5.781 -0.3533 -0.1202 0.2709 54LYS SC1 3792 2.619 1.903 5.503 0.1000 0.0835 -0.0451 54LYS SC2 3793 2.659 1.980 5.168 0.2137 0.1868 -0.1213 55GLU BB 3794 2.790 1.569 5.919 0.1662 -0.0945 -0.1876 55GLU SC1 3795 3.111 1.743 5.904 -0.1298 0.0662 -0.3701 56GLU BB 3796 2.643 1.266 5.883 -0.3591 0.0498 -0.0491 56GLU SC1 3797 2.639 1.139 6.219 -0.0610 0.0791 0.0492 57PRO BB 3798 2.437 1.219 5.648 -0.3596 0.1584 0.0409 57PRO SC1 3799 2.540 1.451 5.420 0.0258 0.0638 -0.0278 58LYS BB 3800 2.174 1.381 5.766 -0.0496 -0.0510 0.0324 58LYS SC1 3801 2.041 1.513 5.542 -0.0727 0.0343 -0.0074 58LYS SC2 3802 1.808 1.313 5.367 -0.3752 0.3642 0.1589 59GLU BB 3803 1.846 1.250 5.835 0.0842 0.1447 0.0926 59GLU SC1 3804 1.489 1.383 5.813 -0.1198 0.2613 0.1455 60GLU BB 3805 1.930 0.949 5.797 0.2326 0.0201 0.0206 60GLU SC1 3806 2.102 0.959 5.476 -0.0074 -0.0935 0.2091 61GLU BB 3807 1.897 0.649 5.983 0.0359 0.2267 0.0812 61GLU SC1 3808 1.799 0.259 5.950 0.3157 0.0785 0.1665 1LYS BB 3809 14.837 20.215 8.303 0.2745 0.0034 0.0969 1LYS SC1 3810 15.128 20.204 8.203 -0.1720 -0.1498 0.1201 1LYS SC2 3811 15.507 20.374 8.201 0.3496 0.3106 -0.0228 2LYS BB 3812 14.740 20.346 7.980 -0.0609 -0.3245 0.2788 2LYS SC1 3813 14.709 20.659 7.973 -0.2274 -0.1833 0.1516 2LYS SC2 3814 14.672 21.021 7.993 0.0676 -0.0344 -0.1886 3CYS BB 3815 14.656 20.188 7.731 -0.3011 0.1649 -0.3400 3CYS SC1 3816 14.455 20.455 7.645 -0.5937 -0.3021 -0.1255 4LEU BB 3817 14.642 20.154 7.420 0.1845 -0.0582 0.1711 4LEU SC1 3818 14.413 20.352 7.273 -0.2207 0.1921 0.2401 5PHE BB 3819 14.858 20.188 7.182 0.1050 -0.0531 -0.2604 5PHE SC1 3820 14.918 19.919 7.147 0.0666 0.0266 -0.2906 5PHE SC2 3821 14.804 19.718 6.897 -0.2051 -0.2115 0.0165 5PHE SC3 3822 14.654 19.704 7.145 -0.2444 0.3915 0.0399 6LYS BB 3823 14.906 20.495 7.029 -0.2365 -0.0675 -0.1400 6LYS SC1 3824 14.640 20.664 7.009 -0.0351 -0.2104 0.1470 6LYS SC2 3825 14.311 20.657 6.881 0.4761 0.0474 -0.0781 7LYS BB 3826 15.077 20.607 6.815 0.0337 -0.1583 -0.1982 7LYS SC1 3827 14.883 20.625 6.575 0.2949 -0.0987 -0.1704 7LYS SC2 3828 14.758 20.574 6.244 -0.1209 -0.2346 0.1048 8LYS BB 3829 15.271 20.479 6.614 0.1939 -0.0351 0.1779 8LYS SC1 3830 15.427 20.744 6.522 0.1593 0.1225 0.3765 8LYS SC2 3831 15.515 21.020 6.286 0.1152 -0.2871 -0.1185 9ASN BB 3832 15.358 20.176 6.497 0.0264 -0.0103 -0.0378 9ASN SC1 3833 15.399 20.150 6.198 -0.1517 0.3302 0.2297 10LYS BB 3834 15.469 19.930 6.676 0.0173 -0.3823 -0.0701 10LYS SC1 3835 15.351 19.716 6.462 0.0551 -0.3195 -0.0305 10LYS SC2 3836 15.362 19.438 6.237 0.1699 0.3517 -0.2114 11LYS BB 3837 15.698 19.819 6.904 0.2354 0.0423 -0.0705 11LYS SC1 3838 16.000 19.976 6.886 0.5286 -0.1826 0.1307 11LYS SC2 3839 16.199 20.249 6.734 -0.0860 0.3576 -0.1626 12LYS BB 3840 15.692 19.650 7.210 -0.3037 -0.1721 0.0391 12LYS SC1 3841 15.896 19.754 7.469 0.2148 -0.2623 0.4007 12LYS SC2 3842 15.706 19.798 7.771 -0.4048 0.1068 0.3190 13GLY BB 3843 15.715 19.364 7.072 -0.3976 -0.2164 0.1248 14LYS BB 3844 15.481 19.188 7.122 -0.0018 -0.0564 0.1516 14LYS SC1 3845 15.620 18.907 7.003 0.4120 -0.0558 -0.4297 14LYS SC2 3846 15.844 18.645 7.013 0.2272 0.2179 0.0618 15GLU BB 3847 15.410 19.039 7.420 0.1394 -0.1210 -0.2415 15GLU SC1 3848 15.483 19.073 7.845 -0.1480 -0.2464 0.0201 16LYS BB 3849 15.682 18.832 7.465 -0.1387 0.0156 0.3441 16LYS SC1 3850 15.580 18.629 7.649 -0.0428 -0.0111 -0.0148 16LYS SC2 3851 15.578 18.644 7.995 0.0485 0.0169 -0.1549 17GLY BB 3852 15.976 18.885 7.596 0.4139 -0.3257 0.0242 18GLY BB 3853 16.097 18.618 7.504 -0.0575 0.0880 -0.3003 19LYS BB 3854 16.274 18.519 7.263 0.1941 -0.1354 0.0139 19LYS SC1 3855 16.495 18.276 7.343 -0.0411 -0.2316 0.1690 19LYS SC2 3856 16.611 17.962 7.248 0.0026 -0.2232 0.2181 20ASN BB 3857 16.441 18.700 7.169 -0.2843 0.0716 0.2324 20ASN SC1 3858 16.247 18.654 6.834 -0.2079 0.0820 -0.1910 21ALA BB 3859 16.743 18.704 7.308 0.4004 0.1097 -0.4299 21ALA SC1 3860 16.892 18.518 7.180 0.3480 -0.0848 -0.2147 22ILE BB 3861 16.851 18.709 7.620 -0.0390 0.1812 0.1783 22ILE SC1 3862 17.038 18.983 7.541 0.0107 0.0995 0.0077 23ASN BB 3863 16.722 18.859 7.887 0.0107 -0.0557 -0.0041 23ASN SC1 3864 16.571 18.643 8.044 0.0695 0.1206 -0.1087 24MET BB 3865 16.743 19.192 7.983 -0.0254 -0.1640 0.1265 24MET SC1 3866 17.064 19.224 7.903 0.0084 -0.0556 -0.2348 25LYS BB 3867 16.675 19.514 7.846 -0.2577 0.1325 -0.2152 25LYS SC1 3868 16.861 19.516 7.593 0.0766 0.5859 -0.0742 25LYS SC2 3869 16.953 19.777 7.426 -0.2611 -0.2462 0.2758 26ASP BB 3870 16.868 19.703 8.018 0.1521 -0.2427 -0.0211 26ASP SC1 3871 16.959 20.016 7.824 -0.2257 0.0496 -0.1604 27VAL BB 3872 16.768 19.886 8.303 0.0704 0.1157 -0.0125 27VAL SC1 3873 17.025 19.902 8.440 0.1006 -0.0959 -0.0400 28LYS BB 3874 16.545 19.932 8.516 0.2542 -0.0390 -0.4843 28LYS SC1 3875 16.584 20.307 8.500 -0.2440 0.2488 -0.3027 28LYS SC2 3876 16.692 20.594 8.641 0.2777 0.4306 0.5509 29ASP BB 3877 16.583 19.738 8.728 -0.2140 -0.0311 -0.2625 29ASP SC1 3878 16.248 19.577 8.673 -0.1405 0.1171 0.1841 30LEU BB 3879 16.792 19.437 8.759 -0.2475 0.0650 -0.0333 30LEU SC1 3880 16.875 19.421 8.398 0.2415 -0.3055 0.0680 31GLY BB 3881 16.760 19.272 9.029 0.3442 0.3146 0.0740 32LYS BB 3882 16.969 19.269 9.256 -0.1735 -0.0370 0.1698 32LYS SC1 3883 16.852 19.068 9.460 -0.2644 -0.1566 -0.0707 32LYS SC2 3884 16.783 18.737 9.439 -0.0249 -0.1116 -0.1286 33THR BB 3885 17.198 19.493 9.359 0.1423 0.0825 -0.0617 33THR SC1 3886 17.392 19.513 9.125 0.1073 -0.0690 -0.1054 34MET BB 3887 17.189 19.794 9.465 -0.1152 0.5204 -0.1235 34MET SC1 3888 17.526 19.903 9.564 -0.1394 0.0507 0.0260 35LYS BB 3889 16.973 20.015 9.517 -0.0261 -0.0480 -0.0920 35LYS SC1 3890 17.071 20.330 9.599 -0.0935 -0.2142 -0.0417 35LYS SC2 3891 17.177 20.671 9.523 -0.1296 0.0345 0.2170 36ASP BB 3892 16.840 19.925 9.829 -0.1907 0.2817 0.0084 36ASP SC1 3893 17.191 19.975 9.903 -0.0206 0.1275 0.0200 37GLN BB 3894 16.869 19.644 10.011 -0.2751 -0.0392 -0.0688 37GLN SC1 3895 17.209 19.477 9.886 0.1422 -0.0466 -0.4971 38ALA BB 3896 16.651 19.412 10.060 -0.5023 -0.1200 -0.0489 38ALA SC1 3897 16.642 19.342 10.321 0.0233 0.2419 0.0831 39LEU BB 3898 16.460 19.293 9.811 0.0823 -0.0673 0.4238 39LEU SC1 3899 16.531 18.968 9.810 -0.1178 -0.0017 0.3453 40LYS BB 3900 16.297 19.480 9.550 -0.0063 0.2860 -0.0582 40LYS SC1 3901 16.066 19.185 9.571 -0.1938 -0.2755 -0.0777 40LYS SC2 3902 15.854 18.938 9.663 -0.2580 -0.2716 -0.1035 41ASP BB 3903 16.517 19.668 9.508 -0.3001 -0.0007 -0.1372 41ASP SC1 3904 16.788 19.539 9.569 -0.1164 0.0405 0.0773 42ASP BB 3905 16.418 19.976 9.612 -0.1767 0.0229 -0.0051 42ASP SC1 3906 16.566 20.129 9.360 -0.4255 0.2198 0.5720 43ASP BB 3907 16.126 19.991 9.740 0.0328 -0.0466 -0.1154 43ASP SC1 3908 16.053 19.709 9.859 -0.2543 -0.0365 -0.3284 44ALA BB 3909 16.178 20.110 10.030 -0.1356 0.2386 -0.2302 44ALA SC1 3910 15.949 20.054 10.163 -0.0559 0.0383 -0.1740 45GLU BB 3911 16.448 20.128 10.144 -0.1188 0.1622 0.0144 45GLU SC1 3912 16.493 19.841 10.362 0.1838 0.0997 -0.1883 46THR BB 3913 16.569 20.397 10.054 0.2265 0.0020 0.1013 46THR SC1 3914 16.637 20.321 9.766 -0.2941 0.2382 -0.0976 47GLY BB 3915 16.444 20.705 9.970 -0.2334 0.1297 0.5935 48LEU BB 3916 16.264 20.962 10.106 -0.0326 0.0272 -0.0031 48LEU SC1 3917 16.281 21.279 9.918 -0.0686 0.1561 -0.2465 49THR BB 3918 16.168 20.875 10.426 -0.2427 0.1060 0.1102 49THR SC1 3919 15.900 21.020 10.443 -0.3476 -0.0731 0.0166 50ASP BB 3920 16.361 20.811 10.734 -0.1478 -0.1486 -0.0525 50ASP SC1 3921 16.261 20.497 10.807 0.0084 -0.1400 -0.0408 51GLY BB 3922 16.625 20.916 10.550 -0.2413 0.1329 0.2026 52GLU BB 3923 16.939 20.840 10.665 -0.0223 0.0395 0.1900 52GLU SC1 3924 17.128 21.072 10.890 0.1026 0.0249 0.2047 53GLU BB 3925 16.965 20.578 10.898 -0.1581 -0.1374 -0.0543 53GLU SC1 3926 17.052 20.267 10.774 0.2697 0.1749 -0.0322 54LYS BB 3927 16.691 20.474 11.062 -0.1599 0.2967 -0.1842 54LYS SC1 3928 16.771 20.232 11.236 -0.2605 -0.3124 -0.0167 54LYS SC2 3929 16.847 19.931 11.061 0.0227 -0.0409 0.0031 55GLU BB 3930 16.532 20.633 11.276 -0.3103 -0.0487 -0.1302 55GLU SC1 3931 16.498 20.462 11.628 -0.0342 0.0761 -0.1957 56GLU BB 3932 16.229 20.711 11.199 -0.2770 0.1960 -0.1820 56GLU SC1 3933 16.328 21.098 11.168 -0.1383 0.3030 -0.2961 57PRO BB 3934 15.990 20.497 11.323 0.1532 -0.0771 -0.1065 57PRO SC1 3935 16.067 20.188 11.396 -0.2096 0.3090 0.0731 58LYS BB 3936 15.880 20.356 11.022 -0.0221 -0.1002 0.2254 58LYS SC1 3937 16.029 20.086 10.962 -0.2209 -0.2905 0.2359 58LYS SC2 3938 15.906 19.826 11.166 0.0646 -0.2349 0.0602 59GLU BB 3939 15.594 20.251 10.937 0.0045 0.1544 -0.3419 59GLU SC1 3940 15.649 19.884 10.761 -0.1870 0.0846 -0.1478 60GLU BB 3941 15.352 20.464 10.953 0.2533 -0.1886 -0.0031 60GLU SC1 3942 15.372 20.774 10.733 0.0061 0.0219 -0.1159 61GLU BB 3943 15.229 20.642 11.217 -0.0939 0.1053 -0.0004 61GLU SC1 3944 15.177 20.340 11.369 0.0432 0.2117 0.0540 1LYS BB 3945 4.340 24.258 14.169 0.0009 -0.0160 0.0406 1LYS SC1 3946 4.134 24.135 14.409 0.1493 -0.0639 -0.2413 1LYS SC2 3947 3.993 24.060 14.725 -0.1718 0.2355 -0.1585 2LYS BB 3948 4.093 24.294 13.886 -0.0853 0.0665 0.0245 2LYS SC1 3949 4.186 24.041 13.779 -0.0476 0.2095 -0.0078 2LYS SC2 3950 4.304 23.713 13.702 0.2777 -0.0080 -0.0378 3CYS BB 3951 4.243 24.480 13.615 0.0943 0.0432 -0.0411 3CYS SC1 3952 3.959 24.614 13.583 -0.2758 -0.3404 -0.1406 4LEU BB 3953 4.389 24.785 13.669 0.1474 0.0695 0.0627 4LEU SC1 3954 4.090 25.008 13.730 0.2443 0.0391 -0.0416 5PHE BB 3955 4.563 25.028 13.457 -0.0643 -0.0581 -0.1918 5PHE SC1 3956 4.406 25.303 13.536 0.1288 0.2861 -0.1826 5PHE SC2 3957 4.429 25.441 13.226 -0.1832 0.6531 -0.0498 5PHE SC3 3958 4.173 25.321 13.289 0.1176 -0.1286 -0.2090 6LYS BB 3959 4.395 25.018 13.098 0.0533 0.2206 -0.3808 6LYS SC1 3960 4.256 24.749 13.186 -0.0043 0.0021 0.0375 6LYS SC2 3961 4.178 24.463 12.994 0.3005 -0.0443 -0.3734 7LYS BB 3962 4.188 25.173 12.867 -0.0295 0.3243 0.2385 7LYS SC1 3963 3.969 25.009 12.664 0.0839 0.0883 0.1431 7LYS SC2 3964 3.946 24.809 12.352 0.1378 -0.0790 -0.0027 8LYS BB 3965 4.265 25.425 12.628 -0.1574 0.0022 0.1379 8LYS SC1 3966 4.158 25.672 12.459 0.1938 0.1699 0.0982 8LYS SC2 3967 4.145 25.922 12.185 0.1008 -0.0893 -0.2660 9ASN BB 3968 4.285 25.206 12.379 -0.0335 -0.1736 0.4019 9ASN SC1 3969 3.979 25.336 12.187 -0.1216 -0.3507 0.0422 10LYS BB 3970 4.448 24.983 12.276 0.1738 -0.1976 0.0017 10LYS SC1 3971 4.735 25.048 12.135 -0.0836 -0.3316 0.3595 10LYS SC2 3972 5.104 25.156 12.224 0.0280 0.3060 0.3085 11LYS BB 3973 4.647 24.662 12.362 -0.1686 -0.0472 0.2493 11LYS SC1 3974 4.741 24.490 12.111 -0.1959 0.3324 0.1431 11LYS SC2 3975 4.798 24.470 11.748 -0.1258 -0.2890 -0.1766 12LYS BB 3976 4.951 24.802 12.465 -0.1479 0.3793 0.1794 12LYS SC1 3977 5.010 24.460 12.446 -0.3612 0.1620 0.2615 12LYS SC2 3978 5.006 24.099 12.467 -0.2234 -0.2966 0.3999 13GLY BB 3979 5.010 25.060 12.648 -0.2696 0.2520 -0.0001 14LYS BB 3980 5.179 25.343 12.630 -0.2001 -0.0515 -0.0746 14LYS SC1 3981 4.994 25.457 12.848 -0.3624 0.0433 -0.2187 14LYS SC2 3982 4.678 25.304 12.933 0.2067 -0.2658 -0.1958 15GLU BB 3983 5.482 25.285 12.609 0.3820 0.0055 -0.1665 15GLU SC1 3984 5.493 25.525 12.281 0.1635 0.0647 0.1388 16LYS BB 3985 5.720 25.063 12.682 0.1269 0.0262 -0.0506 16LYS SC1 3986 5.940 25.038 12.467 -0.1190 0.0938 -0.1967 16LYS SC2 3987 6.280 25.039 12.295 -0.0756 -0.0421 0.2939 17GLY BB 3988 5.721 24.711 12.654 -0.2935 0.0760 0.0329 18GLY BB 3989 6.074 24.654 12.636 -0.3667 -0.2245 0.4193 19LYS BB 3990 6.282 24.443 12.745 -0.0954 -0.1425 -0.1539 19LYS SC1 3991 6.293 24.235 12.474 -0.2457 0.0874 -0.0664 19LYS SC2 3992 6.192 24.272 12.166 -0.0170 0.2623 0.0772 20ASN BB 3993 6.429 24.389 13.013 0.1475 -0.1511 0.2486 20ASN SC1 3994 6.724 24.456 12.838 -0.1339 0.0548 0.2560 21ALA BB 3995 6.249 24.556 13.272 -0.1035 -0.3181 0.2404 21ALA SC1 3996 6.436 24.733 13.353 -0.3436 -0.1937 0.5393 22ILE BB 3997 5.956 24.684 13.126 -0.2304 -0.0331 0.0979 22ILE SC1 3998 5.862 24.438 12.909 -0.1655 0.0243 0.0038 23ASN BB 3999 5.727 24.813 13.205 -0.0035 -0.0214 -0.2358 23ASN SC1 4000 5.791 25.102 13.149 -0.0282 -0.0894 0.1084 24MET BB 4001 5.392 24.857 13.373 -0.1862 -0.2949 0.2213 24MET SC1 4002 5.129 24.633 13.297 0.1421 0.1523 -0.1499 25LYS BB 4003 5.474 24.699 13.639 0.1182 -0.5488 0.3961 25LYS SC1 4004 5.338 24.743 13.893 0.1200 -0.2705 -0.1170 25LYS SC2 4005 5.150 24.507 14.088 -0.0601 0.0097 -0.0656 26ASP BB 4006 5.593 24.362 13.689 0.4653 0.4209 -0.4698 26ASP SC1 4007 5.900 24.452 13.569 -0.0737 -0.1568 0.3956 27VAL BB 4008 5.509 24.262 13.974 -0.1786 0.1299 -0.0857 27VAL SC1 4009 5.584 24.005 14.089 -0.4181 0.1436 0.1098 28LYS BB 4010 5.622 24.464 14.282 0.0262 -0.0990 0.2333 28LYS SC1 4011 5.833 24.246 14.405 -0.0829 -0.0873 -0.3960 28LYS SC2 4012 5.732 23.953 14.545 0.0149 0.1352 -0.0978 29ASP BB 4013 5.472 24.758 14.353 0.0426 0.0126 0.1153 29ASP SC1 4014 5.169 24.663 14.521 -0.3794 -0.0530 -0.0159 30LEU BB 4015 5.514 25.050 14.487 0.0029 -0.2438 -0.1858 30LEU SC1 4016 5.803 25.165 14.309 -0.0188 -0.2524 0.1426 31GLY BB 4017 5.483 25.394 14.419 -0.2072 -0.1417 -0.1572 32LYS BB 4018 5.334 25.536 14.633 0.4126 -0.1196 -0.1587 32LYS SC1 4019 5.449 25.324 14.868 -0.0705 -0.0742 0.0125 32LYS SC2 4020 5.305 25.203 15.132 0.2549 0.4097 0.2013 33THR BB 4021 5.550 25.761 14.721 0.3587 -0.0596 0.3626 33THR SC1 4022 5.830 25.646 14.756 0.2822 -0.2810 0.2610 34MET BB 4023 5.460 26.007 14.980 -0.0674 -0.3826 -0.0828 34MET SC1 4024 5.367 26.211 14.654 0.0522 0.3871 0.1314 35LYS BB 4025 5.228 25.955 15.243 -0.0103 -0.0114 0.0147 35LYS SC1 4026 4.986 26.013 15.106 0.4596 -0.0673 -0.1623 35LYS SC2 4027 4.728 26.277 15.138 0.1509 0.0728 -0.1961 36ASP BB 4028 5.296 25.902 15.560 -0.4478 0.4238 -0.0273 36ASP SC1 4029 5.407 26.194 15.613 -0.0460 0.1989 0.3350 37GLN BB 4030 5.493 25.653 15.651 0.0353 0.0089 -0.3643 37GLN SC1 4031 5.596 25.874 15.949 -0.1217 -0.1542 -0.0068 38ALA BB 4032 5.522 25.310 15.590 0.0610 0.3224 -0.2218 38ALA SC1 4033 5.789 25.310 15.632 0.0097 0.0539 0.1541 39LEU BB 4034 5.345 25.089 15.610 0.1583 -0.1686 -0.0699 39LEU SC1 4035 5.473 25.035 15.948 -0.0499 -0.0036 -0.0268 40LYS BB 4036 5.308 24.788 15.396 0.1685 -0.0598 -0.0202 40LYS SC1 4037 5.112 24.832 15.215 0.3144 0.1751 0.4056 40LYS SC2 4038 4.800 24.727 15.354 -0.2019 0.1252 -0.1213 41ASP BB 4039 5.313 24.491 15.344 -0.0541 0.0158 -0.0971 41ASP SC1 4040 5.131 24.484 15.656 -0.1098 -0.1881 -0.0681 42ASP BB 4041 5.401 24.269 15.179 0.0848 0.1028 0.3692 42ASP SC1 4042 5.707 24.248 15.309 0.1252 0.0421 -0.2750 43ASP BB 4043 5.292 24.027 15.034 0.0921 0.1234 -0.1080 43ASP SC1 4044 4.984 24.021 14.865 0.1850 -0.1277 0.3257 44ALA BB 4045 5.325 23.668 15.060 0.1037 -0.1494 -0.1805 44ALA SC1 4046 5.311 23.522 15.287 0.0676 -0.0765 -0.1353 45GLU BB 4047 5.012 23.551 14.984 0.4679 0.1283 -0.2463 45GLU SC1 4048 5.202 23.217 14.975 0.1923 -0.1451 -0.3112 46THR BB 4049 4.762 23.636 14.791 0.0190 -0.0632 0.0135 46THR SC1 4050 4.838 23.752 14.519 -0.1269 -0.0738 -0.0326 47GLY BB 4051 4.561 23.733 15.035 0.1858 0.2211 0.2958 48LEU BB 4052 4.521 23.793 15.313 -0.0044 0.1438 0.0145 48LEU SC1 4053 4.547 23.599 15.643 0.0534 0.5251 -0.0312 49THR BB 4054 4.341 24.002 15.495 -0.0584 -0.1901 0.2403 49THR SC1 4055 4.544 24.019 15.722 0.3196 -0.2313 -0.0841 50ASP BB 4056 4.238 24.299 15.386 -0.0403 -0.1732 -0.2998 50ASP SC1 4057 4.096 24.272 15.061 0.0103 0.0941 0.1868 51GLY BB 4058 4.391 24.602 15.392 0.1437 0.1109 0.3422 52GLU BB 4059 4.388 24.920 15.440 -0.0198 -0.2210 0.1255 52GLU SC1 4060 4.400 24.907 15.802 0.0764 0.2301 -0.0989 53GLU BB 4061 4.343 25.095 15.231 0.2387 -0.1316 0.3107 53GLU SC1 4062 4.663 25.164 14.966 0.2008 0.2530 -0.0588 54LYS BB 4063 4.176 25.360 15.192 -0.1334 0.0163 0.0217 54LYS SC1 4064 4.073 25.325 14.897 0.1691 -0.2057 -0.2370 54LYS SC2 4065 3.973 25.463 14.599 0.0463 -0.0341 -0.2237 55GLU BB 4066 4.227 25.672 15.303 -0.3276 -0.0050 -0.0809 55GLU SC1 4067 4.113 25.679 15.656 0.2188 -0.1125 0.5432 56GLU BB 4068 3.980 25.862 15.182 0.1991 -0.1429 0.1131 56GLU SC1 4069 4.124 25.878 14.839 0.0626 -0.0548 0.1830 57PRO BB 4070 3.848 25.992 15.401 0.4190 0.2587 0.3445 57PRO SC1 4071 3.972 26.301 15.452 0.0514 0.2289 -0.0505 58LYS BB 4072 3.536 25.950 15.494 0.1013 0.3246 -0.0635 58LYS SC1 4073 3.687 26.058 15.779 0.1809 0.5226 -0.2158 58LYS SC2 4074 4.027 26.100 15.884 0.3724 -0.1205 0.0782 59GLU BB 4075 3.329 25.740 15.332 0.0568 -0.1126 0.3613 59GLU SC1 4076 3.094 26.095 15.229 -0.0974 -0.1749 -0.0151 60GLU BB 4077 3.400 25.453 15.338 -0.0258 0.3085 -0.0647 60GLU SC1 4078 3.561 25.425 15.703 0.0432 -0.4850 -0.0232 61GLU BB 4079 3.280 25.169 15.288 -0.2861 0.1643 0.0900 61GLU SC1 4080 3.277 25.228 14.899 0.2825 -0.1639 0.3750 1LYS BB 4081 11.551 17.457 7.486 0.2147 0.2726 -0.1510 1LYS SC1 4082 11.321 17.609 7.327 -0.1939 0.2584 0.0921 1LYS SC2 4083 10.968 17.652 7.225 -0.0836 0.1582 -0.0187 2LYS BB 4084 11.525 17.477 7.792 -0.4098 0.2124 -0.2063 2LYS SC1 4085 11.475 17.758 7.907 0.0023 0.1157 0.0574 2LYS SC2 4086 11.395 18.081 7.892 0.0684 0.0747 -0.0575 3CYS BB 4087 11.572 17.275 8.062 -0.3252 -0.1111 -0.0836 3CYS SC1 4088 11.771 17.330 8.347 0.3651 -0.1050 0.1628 4LEU BB 4089 11.661 16.981 8.065 -0.2416 -0.1354 0.5147 4LEU SC1 4090 12.053 17.073 8.090 0.1812 -0.2496 0.5156 5PHE BB 4091 11.478 16.696 8.034 -0.1550 -0.0738 0.2989 5PHE SC1 4092 11.705 16.499 8.004 -0.1228 -0.2420 0.1877 5PHE SC2 4093 11.976 16.398 8.182 -0.0440 -0.1611 0.1147 5PHE SC3 4094 11.870 16.658 8.255 -0.0426 -0.1501 0.0779 6LYS BB 4095 11.460 16.572 8.375 -0.3335 0.0643 0.1695 6LYS SC1 4096 11.618 16.848 8.457 0.2155 0.0864 -0.3644 6LYS SC2 4097 11.633 17.088 8.662 -0.2592 0.0171 -0.2515 7LYS BB 4098 11.660 16.329 8.447 0.1662 -0.2801 -0.0325 7LYS SC1 4099 11.480 16.207 8.661 0.3718 -0.0650 0.2591 7LYS SC2 4100 11.264 16.286 8.904 -0.2393 -0.1449 -0.0769 8LYS BB 4101 11.950 16.238 8.547 0.1699 -0.0014 -0.1368 8LYS SC1 4102 11.932 16.252 8.848 0.1535 0.3090 0.1484 8LYS SC2 4103 11.873 16.340 9.183 -0.1848 0.0506 -0.1792 9ASN BB 4104 12.080 15.951 8.490 -0.1076 0.0240 -0.1041 9ASN SC1 4105 12.183 15.823 8.796 0.1290 -0.1187 -0.2284 10LYS BB 4106 12.100 15.782 8.263 0.1459 0.2218 0.1052 10LYS SC1 4107 11.955 15.542 8.367 -0.0965 0.0605 0.1765 10LYS SC2 4108 11.880 15.522 8.729 0.0262 -0.3717 0.2417 11LYS BB 4109 12.104 15.845 7.939 -0.0399 0.0827 0.1201 11LYS SC1 4110 11.900 15.662 7.839 0.0253 0.2286 0.3510 11LYS SC2 4111 12.032 15.362 7.919 -0.2598 -0.0467 0.0029 12LYS BB 4112 11.921 16.122 7.861 0.1830 0.1843 -0.0610 12LYS SC1 4113 11.674 15.983 8.095 0.0286 -0.3332 -0.0001 12LYS SC2 4114 11.371 16.199 8.073 0.2519 0.0586 0.3193 13GLY BB 4115 12.040 16.386 7.623 0.5041 -0.2007 -0.2042 14LYS BB 4116 11.941 16.342 7.282 0.1737 -0.2070 -0.0661 14LYS SC1 4117 11.786 16.603 7.344 -0.3276 0.0810 0.1142 14LYS SC2 4118 11.735 16.735 7.644 0.0769 0.1598 -0.2058 15GLU BB 4119 12.020 16.080 7.048 -0.1193 -0.2227 -0.0451 15GLU SC1 4120 11.650 15.903 6.960 0.0298 -0.0038 -0.3791 16LYS BB 4121 12.310 15.834 7.129 0.0073 -0.1536 -0.1167 16LYS SC1 4122 12.459 16.088 6.994 -0.0373 0.1431 -0.0206 16LYS SC2 4123 12.635 16.372 6.961 -0.0230 -0.1954 0.0649 17GLY BB 4124 12.435 15.614 6.908 0.1111 0.0716 0.0323 18GLY BB 4125 12.769 15.546 6.901 -0.0217 -0.0346 0.9105 19LYS BB 4126 12.932 15.608 7.200 0.0432 -0.2450 -0.2634 19LYS SC1 4127 12.677 15.598 7.349 0.0319 0.1088 0.0480 19LYS SC2 4128 12.591 15.885 7.590 0.0570 -0.1583 0.0726 20ASN BB 4129 13.005 15.938 7.227 -0.2787 0.2594 0.1683 20ASN SC1 4130 13.064 16.113 6.919 0.1042 -0.1932 -0.2616 21ALA BB 4131 13.306 15.827 7.372 0.1446 -0.2114 0.1739 21ALA SC1 4132 13.354 16.088 7.419 -0.0044 -0.1888 0.2086 22ILE BB 4133 13.525 15.663 7.179 -0.0097 -0.1238 -0.4501 22ILE SC1 4134 13.321 15.420 7.053 0.1777 -0.3398 -0.3424 23ASN BB 4135 13.845 15.721 7.132 0.2907 0.2859 0.2138 23ASN SC1 4136 13.993 15.663 7.430 -0.1257 -0.3386 -0.1193 24MET BB 4137 14.045 15.523 6.969 0.2276 -0.1795 -0.1166 24MET SC1 4138 13.861 15.188 6.859 -0.1068 0.0919 -0.1653 25LYS BB 4139 14.182 15.559 6.682 -0.0421 -0.0371 0.0759 25LYS SC1 4140 14.278 15.266 6.710 -0.0907 0.1858 -0.2780 25LYS SC2 4141 14.243 14.900 6.576 0.0316 -0.2206 0.1333 26ASP BB 4142 13.908 15.590 6.470 -0.0291 0.0833 -0.0671 26ASP SC1 4143 13.944 15.697 6.162 0.1392 0.0265 -0.2199 27VAL BB 4144 13.615 15.792 6.462 0.3132 0.5325 -0.0881 27VAL SC1 4145 13.667 15.878 6.736 -0.1178 -0.0437 0.1962 28LYS BB 4146 13.389 15.733 6.248 -0.1562 0.1062 -0.1038 28LYS SC1 4147 13.320 16.007 6.041 0.0427 0.1325 0.1920 28LYS SC2 4148 13.327 16.267 5.819 -0.1166 0.4792 -0.1398 29ASP BB 4149 13.233 15.475 6.167 -0.0327 -0.1799 -0.1080 29ASP SC1 4150 12.958 15.497 6.340 -0.3577 -0.1723 -0.1618 30LEU BB 4151 13.118 15.476 5.853 -0.2589 0.1257 -0.0589 30LEU SC1 4152 13.067 15.162 5.787 -0.1784 0.2367 0.0908 31GLY BB 4153 13.081 15.845 5.766 0.3005 -0.2180 0.2961 32LYS BB 4154 12.826 15.885 5.595 0.0243 -0.4073 -0.0530 32LYS SC1 4155 12.873 15.859 5.309 -0.2393 -0.4061 0.3769 32LYS SC2 4156 13.052 15.870 5.037 -0.0686 -0.0796 -0.1039 33THR BB 4157 12.528 15.925 5.649 -0.0569 -0.0603 -0.0981 33THR SC1 4158 12.336 15.832 5.430 -0.0300 0.0924 -0.1888 34MET BB 4159 12.402 16.121 5.862 0.2202 0.0070 -0.2882 34MET SC1 4160 12.459 15.974 6.179 -0.0094 0.1644 0.0489 35LYS BB 4161 12.077 16.050 5.898 0.4161 0.0562 0.0219 35LYS SC1 4162 11.979 15.937 6.137 0.0441 -0.1266 -0.0041 35LYS SC2 4163 11.743 15.655 6.051 0.1797 -0.1101 -0.0827 36ASP BB 4164 11.910 15.904 5.649 -0.0073 -0.1659 -0.1868 36ASP SC1 4165 11.755 16.134 5.448 -0.0089 -0.1119 0.2863 37GLN BB 4166 11.683 15.674 5.589 -0.0969 -0.3434 0.2350 37GLN SC1 4167 11.782 15.321 5.700 0.0872 -0.0878 0.0062 38ALA BB 4168 11.389 15.816 5.510 0.1990 -0.3022 -0.1956 38ALA SC1 4169 11.229 15.808 5.727 0.1270 0.0952 -0.2271 39LEU BB 4170 11.157 15.712 5.300 0.0665 -0.0336 -0.4697 39LEU SC1 4171 10.941 15.655 5.591 -0.2378 -0.0704 -0.2532 40LYS BB 4172 11.151 15.389 5.198 -0.2367 0.6259 -0.2169 40LYS SC1 4173 10.819 15.404 5.256 -0.1082 0.0875 0.2937 40LYS SC2 4174 10.581 15.147 5.212 0.2679 -0.1330 -0.3088 41ASP BB 4175 11.397 15.396 4.988 -0.0348 -0.1434 0.0221 41ASP SC1 4176 11.622 15.326 5.227 -0.1327 0.3376 -0.2207 42ASP BB 4177 11.440 15.581 4.721 0.0982 0.1784 -0.1882 42ASP SC1 4178 11.316 15.300 4.573 0.0273 -0.0646 0.6170 43ASP BB 4179 11.690 15.820 4.600 0.1057 -0.0008 -0.3042 43ASP SC1 4180 11.920 15.621 4.554 0.2341 0.1006 0.0577 44ALA BB 4181 11.795 16.111 4.717 -0.0797 0.2921 0.1917 44ALA SC1 4182 12.027 16.065 4.587 -0.2543 -0.1889 0.0258 45GLU BB 4183 11.767 16.235 4.983 0.0768 0.0273 0.1289 45GLU SC1 4184 12.125 16.378 4.943 0.2816 -0.1433 -0.1821 46THR BB 4185 11.568 16.446 5.114 0.0947 0.4378 -0.5727 46THR SC1 4186 11.783 16.559 5.299 -0.2885 0.2165 0.0368 47GLY BB 4187 11.313 16.218 5.207 0.1805 -0.4451 -0.0621 48LEU BB 4188 11.002 16.312 5.166 0.3069 -0.0802 0.0421 48LEU SC1 4189 10.896 15.987 5.120 -0.1318 -0.1218 0.0367 49THR BB 4190 10.720 16.446 5.301 -0.0249 0.0032 -0.2504 49THR SC1 4191 10.591 16.678 5.451 -0.1725 -0.0673 -0.2657 50ASP BB 4192 10.556 16.582 5.020 0.2557 -0.3287 0.0876 50ASP SC1 4193 10.802 16.699 4.846 0.0525 0.1493 -0.2037 51GLY BB 4194 10.322 16.552 4.806 0.3595 -0.2654 0.2343 52GLU BB 4195 10.186 16.267 4.752 0.5095 -0.0001 0.1219 52GLU SC1 4196 9.854 16.279 4.548 0.0843 0.1532 0.4114 53GLU BB 4197 10.143 16.029 4.946 -0.0317 0.2730 -0.0243 53GLU SC1 4198 10.142 16.317 5.222 -0.1897 -0.0342 -0.0111 54LYS BB 4199 9.943 15.815 4.832 -0.1583 -0.0348 -0.0314 54LYS SC1 4200 9.778 15.614 5.036 -0.0719 -0.3009 -0.0729 54LYS SC2 4201 9.479 15.470 4.929 -0.0103 0.2727 0.2885 55GLU BB 4202 9.871 15.741 4.524 0.0481 0.1903 -0.1437 55GLU SC1 4203 9.721 15.403 4.551 -0.0765 0.4438 -0.3116 56GLU BB 4204 9.928 15.857 4.188 -0.0675 -0.1551 -0.1173 56GLU SC1 4205 9.665 15.657 4.095 -0.1407 -0.1273 0.1361 57PRO BB 4206 10.212 16.096 4.144 0.1056 -0.0390 0.2690 57PRO SC1 4207 10.427 16.178 4.360 -0.0348 -0.2361 0.1233 58LYS BB 4208 10.114 16.336 3.897 0.0794 -0.1655 -0.0875 58LYS SC1 4209 10.269 16.617 3.971 0.2944 -0.2858 0.3224 58LYS SC2 4210 10.122 16.912 3.979 0.0162 -0.2310 -0.1918 59GLU BB 4211 10.018 16.412 3.582 -0.2868 -0.3932 -0.3299 59GLU SC1 4212 9.701 16.265 3.543 0.1040 -0.0125 0.0842 60GLU BB 4213 10.209 16.680 3.505 0.0411 -0.0985 -0.1133 60GLU SC1 4214 10.491 16.383 3.465 -0.0635 -0.2088 0.0636 61GLU BB 4215 10.252 16.949 3.560 -0.1388 -0.2475 0.2972 61GLU SC1 4216 10.428 17.226 3.752 0.0007 -0.0224 -0.2383 1LYS BB 4217 2.449 25.369 21.725 -0.2145 -0.2800 0.0493 1LYS SC1 4218 2.242 25.150 21.584 -0.0334 0.1520 -0.0179 1LYS SC2 4219 2.164 24.847 21.448 -0.1327 0.0345 -0.0182 2LYS BB 4220 2.246 25.586 21.671 0.0658 0.3964 -0.0771 2LYS SC1 4221 2.205 25.906 21.564 0.1530 0.0731 0.0937 2LYS SC2 4222 2.246 26.200 21.377 -0.0842 -0.0447 -0.0412 3CYS BB 4223 2.025 25.650 21.943 -0.0330 -0.1620 0.0636 3CYS SC1 4224 1.777 25.428 21.913 0.5433 -0.2943 0.3365 4LEU BB 4225 1.757 25.862 21.807 -0.1610 0.1877 -0.0523 4LEU SC1 4226 1.652 25.589 21.580 -0.2759 0.4293 -0.4092 5PHE BB 4227 1.570 26.046 22.001 -0.2179 0.1173 0.1551 5PHE SC1 4228 1.400 26.252 21.857 -0.0499 -0.0575 0.2799 5PHE SC2 4229 1.521 26.560 21.777 -0.3076 0.0488 0.2867 5PHE SC3 4230 1.446 26.394 21.551 0.2605 -0.1950 0.2596 6LYS BB 4231 1.707 26.354 22.152 -0.0502 -0.2644 -0.0049 6LYS SC1 4232 1.538 26.432 22.418 0.1177 0.3127 0.2281 6LYS SC2 4233 1.475 26.567 22.746 -0.0895 -0.4757 -0.2422 7LYS BB 4234 1.911 26.579 22.106 0.2264 -0.0717 0.0591 7LYS SC1 4235 1.751 26.818 21.981 -0.0003 0.0417 -0.1772 7LYS SC2 4236 1.445 27.057 21.927 0.3701 -0.2388 0.1537 8LYS BB 4237 2.288 26.639 22.075 0.2029 0.0296 0.3553 8LYS SC1 4238 2.241 26.924 21.891 0.1553 -0.0220 -0.3819 8LYS SC2 4239 2.368 27.063 21.568 0.1212 0.1591 0.0920 9ASN BB 4240 2.535 26.455 22.121 -0.1766 -0.0076 -0.0378 9ASN SC1 4241 2.552 26.179 22.360 -0.4430 -0.1041 -0.2489 10LYS BB 4242 2.787 26.330 21.947 0.0917 -0.0337 -0.0648 10LYS SC1 4243 3.006 26.458 21.741 0.3042 -0.1334 -0.0932 10LYS SC2 4244 2.955 26.684 21.425 0.2247 0.5349 -0.1337 11LYS BB 4245 3.053 26.249 22.170 -0.1138 -0.1161 -0.0158 11LYS SC1 4246 2.931 25.939 22.151 0.0185 -0.2051 -0.3423 11LYS SC2 4247 2.742 25.744 22.370 -0.2688 0.5764 0.0609 12LYS BB 4248 3.388 26.177 22.114 -0.1858 0.1738 -0.1210 12LYS SC1 4249 3.482 26.447 22.225 0.0594 -0.0012 -0.0022 12LYS SC2 4250 3.338 26.662 22.478 0.1272 -0.0713 -0.0836 13GLY BB 4251 3.399 25.848 22.188 -0.2139 0.0196 -0.0645 14LYS BB 4252 3.225 25.706 22.384 -0.0996 -0.2056 -0.0145 14LYS SC1 4253 3.180 25.379 22.301 -0.0649 -0.3792 -0.0049 14LYS SC2 4254 3.096 25.156 22.041 -0.2199 0.2848 0.3024 15GLU BB 4255 3.290 25.866 22.689 -0.1866 0.0548 0.1680 15GLU SC1 4256 3.297 26.237 22.642 0.0427 -0.0072 0.0915 16LYS BB 4257 3.308 25.754 22.977 -0.0128 -0.4682 -0.1103 16LYS SC1 4258 3.569 25.538 22.978 0.2125 0.2487 -0.1292 16LYS SC2 4259 3.929 25.537 22.912 0.0743 -0.1618 -0.1767 17GLY BB 4260 3.443 26.038 23.079 -0.3710 0.0071 0.0459 18GLY BB 4261 3.634 26.132 23.355 -0.2578 0.0035 -0.1255 19LYS BB 4262 3.799 26.049 23.692 -0.1704 0.2560 -0.0616 19LYS SC1 4263 3.921 25.747 23.771 -0.0255 -0.0405 -0.0192 19LYS SC2 4264 4.038 25.423 23.693 -0.0980 -0.0611 -0.1099 20ASN BB 4265 3.770 26.102 24.047 -0.3005 0.1394 0.0501 20ASN SC1 4266 3.782 26.420 24.168 0.4039 0.1605 -0.0534 21ALA BB 4267 3.652 25.831 24.131 -0.0913 -0.0106 -0.0425 21ALA SC1 4268 3.821 25.648 24.235 -0.4600 -0.3228 0.0297 22ILE BB 4269 3.426 25.742 23.892 -0.0492 -0.2535 -0.2861 22ILE SC1 4270 3.379 25.426 24.013 -0.1130 -0.1463 -0.0233 23ASN BB 4271 3.113 25.838 23.913 -0.0033 -0.1754 0.2285 23ASN SC1 4272 2.975 26.126 23.714 -0.1620 0.1932 -0.0689 24MET BB 4273 2.933 25.571 23.899 -0.0899 -0.1454 0.0228 24MET SC1 4274 3.234 25.434 23.541 -0.0274 0.1460 -0.0809 25LYS BB 4275 2.799 25.508 24.176 0.0124 0.0499 -0.0893 25LYS SC1 4276 2.943 25.247 24.234 0.0556 0.0926 -0.2851 25LYS SC2 4277 3.010 24.916 24.275 0.0068 0.0480 -0.1482 26ASP BB 4278 2.496 25.477 24.186 0.1556 -0.1089 0.0162 26ASP SC1 4279 2.410 25.771 24.257 -0.1239 0.1123 -0.3643 27VAL BB 4280 2.275 25.397 23.986 -0.2483 -0.0624 -0.1119 27VAL SC1 4281 2.187 25.205 24.187 0.0884 0.0174 0.1190 28LYS BB 4282 2.171 25.673 23.851 -0.2586 -0.0158 0.3181 28LYS SC1 4283 1.946 25.806 23.959 -0.1524 -0.0551 -0.1055 28LYS SC2 4284 1.686 26.014 24.028 0.0511 0.0974 0.1411 29ASP BB 4285 2.202 25.803 23.563 0.1413 -0.0174 0.3198 29ASP SC1 4286 1.920 26.014 23.461 -0.1240 0.0003 -0.5348 30LEU BB 4287 2.425 25.704 23.359 -0.0451 0.0883 0.3341 30LEU SC1 4288 2.443 25.917 23.071 0.2449 -0.2929 0.2078 31GLY BB 4289 2.397 25.376 23.276 0.0725 -0.0802 -0.1193 32LYS BB 4290 2.239 25.254 23.555 0.0202 0.3081 0.1100 32LYS SC1 4291 2.034 25.395 23.493 0.2663 -0.0353 0.1537 32LYS SC2 4292 1.791 25.435 23.245 0.2120 0.1086 -0.0635 33THR BB 4293 2.413 25.052 23.679 0.0656 -0.0922 -0.1266 33THR SC1 4294 2.642 25.169 23.844 -0.1646 0.1287 0.0435 34MET BB 4295 2.426 24.772 23.548 0.3365 0.0367 -0.1693 34MET SC1 4296 2.612 24.851 23.247 0.0633 0.1987 -0.5185 35LYS BB 4297 2.186 24.550 23.463 0.0612 0.1123 0.1148 35LYS SC1 4298 2.338 24.315 23.403 -0.1705 0.3027 -0.2525 35LYS SC2 4299 2.591 24.070 23.444 -0.0350 0.1205 -0.0977 36ASP BB 4300 1.902 24.583 23.227 0.2561 0.2725 -0.0066 36ASP SC1 4301 1.943 24.820 22.987 -0.5684 -0.2073 0.0856 37GLN BB 4302 1.719 24.325 23.130 0.0484 -0.0025 -0.0356 37GLN SC1 4303 1.992 24.099 23.228 -0.0521 0.1977 0.1647 38ALA BB 4304 1.466 24.557 23.068 0.1695 -0.1306 0.0618 38ALA SC1 4305 1.521 24.686 23.299 0.0643 0.3717 -0.1804 39LEU BB 4306 1.149 24.436 23.161 0.2090 0.0236 0.0070 39LEU SC1 4307 1.302 24.432 23.464 0.1611 0.0855 0.1334 40LYS BB 4308 0.940 24.218 23.173 -0.2450 0.1336 -0.1813 40LYS SC1 4309 1.044 24.024 23.398 0.2756 0.0119 -0.1886 40LYS SC2 4310 0.793 23.824 23.516 0.0744 0.2704 0.2534 41ASP BB 4311 0.623 24.217 23.288 0.2946 0.1395 0.0501 41ASP SC1 4312 0.554 24.245 22.931 -0.1043 0.0036 -0.0976 42ASP BB 4313 0.447 24.445 23.359 -0.0573 -0.1218 0.2253 42ASP SC1 4314 0.313 24.377 23.643 -0.3917 0.2039 -0.2562 43ASP BB 4315 0.371 24.679 23.110 -0.0833 0.0738 0.4630 43ASP SC1 4316 0.564 24.920 22.993 0.1950 -0.0150 0.0596 44ALA BB 4317 0.041 24.580 23.010 -0.2185 0.1945 0.1282 44ALA SC1 4318 0.075 24.729 22.788 0.3377 0.1138 0.1452 45GLU BB 4319 -0.029 24.321 22.841 0.1614 0.0713 0.1367 45GLU SC1 4320 -0.412 24.227 22.904 0.4321 0.0687 -0.2128 46THR BB 4321 0.236 24.171 22.606 0.0879 -0.0426 0.1511 46THR SC1 4322 0.010 24.005 22.484 0.0483 0.2070 -0.1264 47GLY BB 4323 0.402 24.236 22.318 -0.1273 -0.2168 -0.0357 48LEU BB 4324 0.553 23.987 22.185 0.3727 0.1236 -0.1020 48LEU SC1 4325 0.886 24.144 22.227 0.0097 -0.0911 -0.0438 49THR BB 4326 0.317 23.766 22.295 0.1409 -0.3074 -0.1465 49THR SC1 4327 0.201 23.706 22.019 -0.2984 -0.0402 -0.0312 50ASP BB 4328 0.312 23.436 22.430 -0.3130 -0.2537 -0.0740 50ASP SC1 4329 0.555 23.459 22.681 -0.2606 0.0780 0.0920 51GLY BB 4330 0.024 23.348 22.632 0.3073 -0.2219 -0.0824 52GLU BB 4331 -0.095 23.090 22.460 -0.0727 -0.0809 -0.1454 52GLU SC1 4332 -0.425 23.262 22.561 -0.0767 0.1456 -0.1921 53GLU BB 4333 0.112 22.930 22.231 -0.0153 -0.1969 0.2357 53GLU SC1 4334 0.121 23.266 22.018 -0.1147 0.1087 -0.1824 54LYS BB 4335 0.017 22.604 22.156 0.2022 -0.3337 -0.1444 54LYS SC1 4336 -0.192 22.644 21.922 0.1946 -0.1148 0.0605 54LYS SC2 4337 -0.490 22.800 21.898 -0.4056 0.0546 0.4689 55GLU BB 4338 -0.189 22.391 22.332 -0.0029 -0.0891 -0.2096 55GLU SC1 4339 -0.519 22.345 22.122 0.1045 0.4917 0.0181 56GLU BB 4340 -0.144 22.248 22.618 0.0952 -0.0510 -0.5075 56GLU SC1 4341 -0.300 22.401 22.909 -0.3251 -0.1927 -0.2007 57PRO BB 4342 0.128 22.117 22.546 -0.0968 -0.4174 0.1038 57PRO SC1 4343 0.095 21.814 22.549 -0.0039 -0.2414 0.1872 58LYS BB 4344 0.249 22.142 22.209 -0.1006 0.0054 -0.2537 58LYS SC1 4345 0.429 21.882 22.131 -0.0754 0.0166 0.0865 58LYS SC2 4346 0.752 21.882 22.036 -0.2700 -0.1400 0.0883 59GLU BB 4347 0.516 22.308 22.031 0.1352 0.1502 0.1997 59GLU SC1 4348 0.540 22.647 22.264 0.1365 0.3003 0.0815 60GLU BB 4349 0.692 22.236 21.772 -0.2854 -0.0255 0.2694 60GLU SC1 4350 0.360 22.072 21.613 0.0152 0.2039 -0.1684 61GLU BB 4351 0.738 22.582 21.618 -0.1346 0.0274 0.0091 61GLU SC1 4352 1.044 22.427 21.355 0.0901 -0.1338 -0.0047 1LYS BB 4353 9.641 11.428 3.045 0.2585 -0.0814 -0.0987 1LYS SC1 4354 9.813 11.141 3.081 0.0833 -0.3227 0.0822 1LYS SC2 4355 10.162 11.035 3.052 0.4031 -0.5111 -0.6121 2LYS BB 4356 9.328 11.343 3.192 0.0304 -0.1050 -0.0251 2LYS SC1 4357 9.209 11.667 3.137 -0.1540 0.2154 -0.2772 2LYS SC2 4358 9.051 11.914 3.290 -0.0553 -0.4014 -0.0948 3CYS BB 4359 9.133 11.154 3.106 0.3182 -0.2231 0.6419 3CYS SC1 4360 8.901 11.285 2.879 -0.0823 -0.1945 -0.2882 4LEU BB 4361 8.975 10.892 3.121 -0.0029 -0.2467 0.0700 4LEU SC1 4362 9.154 10.719 2.916 0.1524 0.0940 0.3089 5PHE BB 4363 9.007 10.668 3.350 -0.1347 -0.1194 0.2212 5PHE SC1 4364 8.956 10.425 3.168 -0.0826 -0.1364 0.1604 5PHE SC2 4365 9.118 10.291 2.901 -0.0022 0.1744 0.0490 5PHE SC3 4366 9.173 10.163 3.156 0.3376 0.2067 -0.0026 6LYS BB 4367 8.975 10.653 3.703 -0.2361 0.2760 -0.4003 6LYS SC1 4368 9.105 10.452 3.915 0.1400 0.4122 0.0150 6LYS SC2 4369 9.430 10.238 3.869 0.1238 -0.2489 -0.1179 7LYS BB 4370 8.693 10.512 3.756 0.1269 -0.0301 -0.2078 7LYS SC1 4371 8.605 10.481 3.427 -0.0362 0.0410 -0.4029 7LYS SC2 4372 8.444 10.635 3.165 -0.0716 -0.0079 -0.4760 8LYS BB 4373 8.424 10.645 3.899 -0.2249 0.0467 0.0401 8LYS SC1 4374 8.699 10.743 4.152 0.0617 0.1887 0.2069 8LYS SC2 4375 8.766 11.037 4.286 0.1912 -0.1629 -0.2653 9ASN BB 4376 8.113 10.620 3.914 -0.1019 -0.0828 -0.1048 9ASN SC1 4377 8.065 10.968 3.952 -0.3457 0.2067 -0.1244 10LYS BB 4378 7.936 10.414 4.003 -0.0466 -0.0493 0.2510 10LYS SC1 4379 7.964 10.210 3.796 0.2052 -0.0387 0.0138 10LYS SC2 4380 7.767 10.244 3.533 -0.0103 -0.2345 -0.2700 11LYS BB 4381 7.870 10.296 4.293 -0.0182 -0.0423 0.2687 11LYS SC1 4382 7.893 10.010 4.166 0.3057 -0.1047 0.0736 11LYS SC2 4383 7.596 9.831 4.161 -0.3379 0.4201 0.1009 12LYS BB 4384 8.016 10.442 4.531 0.0850 -0.1282 -0.0126 12LYS SC1 4385 8.073 10.188 4.722 -0.0537 0.1733 0.1632 12LYS SC2 4386 8.237 10.136 5.048 -0.3510 0.0718 -0.5280 13GLY BB 4387 7.908 10.734 4.696 0.0653 -0.3758 -0.3039 14LYS BB 4388 8.141 10.930 4.870 0.1073 0.1339 0.0654 14LYS SC1 4389 8.146 11.228 4.770 -0.0218 -0.1087 0.0523 14LYS SC2 4390 7.831 11.304 4.680 -0.0832 -0.4402 0.1656 15GLU BB 4391 8.229 10.779 5.170 -0.2984 0.1794 0.0794 15GLU SC1 4392 8.572 10.855 5.046 0.0247 -0.3214 0.0269 16LYS BB 4393 8.086 10.870 5.411 -0.0164 0.0751 -0.2779 16LYS SC1 4394 8.202 10.727 5.679 -0.1217 -0.0258 -0.2440 16LYS SC2 4395 8.140 10.466 5.922 -0.1420 -0.2535 -0.5192 17GLY BB 4396 7.796 11.002 5.440 -0.0838 -0.0298 0.2699 18GLY BB 4397 7.520 10.904 5.484 0.2324 0.0814 0.4500 19LYS BB 4398 7.267 11.076 5.722 -0.1325 0.3617 0.2773 19LYS SC1 4399 6.942 11.014 5.692 -0.0676 -0.0106 0.0508 19LYS SC2 4400 6.658 11.048 5.594 -0.1630 0.2468 0.1821 20ASN BB 4401 7.237 11.100 6.069 0.0836 0.2545 0.1375 20ASN SC1 4402 7.346 11.481 6.003 -0.1496 -0.3034 -0.5275 21ALA BB 4403 7.557 11.069 6.200 -0.0492 0.0870 0.3832 21ALA SC1 4404 7.664 11.251 6.031 -0.1829 -0.0297 0.1673 22ILE BB 4405 7.730 10.842 6.359 0.1499 0.3533 -0.1850 22ILE SC1 4406 7.403 10.748 6.331 0.3143 -0.2793 -0.1334 23ASN BB 4407 7.658 10.991 6.641 0.2708 0.0809 0.2732 23ASN SC1 4408 7.738 10.765 6.821 0.1111 0.1344 -0.2909 24MET BB 4409 7.771 11.250 6.789 0.1124 -0.0310 -0.3183 24MET SC1 4410 7.468 11.394 6.919 0.0581 -0.2684 0.2221 25LYS BB 4411 7.914 11.195 7.042 0.0097 -0.0088 -0.2490 25LYS SC1 4412 7.681 11.076 7.231 0.1284 -0.0897 0.2113 25LYS SC2 4413 7.364 10.948 7.091 0.1257 -0.0266 -0.1999 26ASP BB 4414 8.091 10.922 7.105 0.0515 -0.1805 -0.5478 26ASP SC1 4415 8.098 10.903 7.457 0.2119 0.0078 0.2909 27VAL BB 4416 8.327 10.763 6.931 -0.2017 0.0585 -0.1153 27VAL SC1 4417 8.580 10.757 7.076 -0.1846 -0.2308 -0.1520 28LYS BB 4418 8.346 10.518 6.731 -0.0640 -0.0862 -0.1860 28LYS SC1 4419 8.418 10.231 6.813 0.2574 0.0439 -0.0453 28LYS SC2 4420 8.465 9.913 7.024 0.0614 0.1559 0.0198 29ASP BB 4421 8.091 10.476 6.582 0.1161 0.1107 0.1765 29ASP SC1 4422 8.152 10.720 6.315 -0.3456 0.1337 0.1627 30LEU BB 4423 7.825 10.214 6.702 0.0624 0.1880 0.1514 30LEU SC1 4424 7.627 10.413 6.489 -0.2553 -0.1094 0.1877 31GLY BB 4425 7.630 10.283 6.953 0.0221 -0.1464 -0.0742 32LYS BB 4426 7.580 10.119 7.223 0.3420 0.1000 -0.2660 32LYS SC1 4427 7.806 10.227 7.464 0.4435 -0.0920 0.0791 32LYS SC2 4428 8.032 10.222 7.728 0.1579 0.1563 -0.0095 33THR BB 4429 7.580 9.835 7.066 -0.1686 0.1467 -0.0945 33THR SC1 4430 7.734 9.776 6.810 -0.3571 -0.1732 -0.1399 34MET BB 4431 7.341 9.582 7.075 0.1144 -0.3207 -0.1747 34MET SC1 4432 7.012 9.717 6.965 0.1379 -0.0863 0.0221 35LYS BB 4433 7.458 9.300 6.905 -0.0255 -0.1376 -0.0104 35LYS SC1 4434 7.755 9.357 7.053 -0.0645 -0.0224 -0.0618 35LYS SC2 4435 8.015 9.610 7.110 -0.0738 0.3707 0.0432 36ASP BB 4436 7.285 9.157 6.669 0.2301 0.0385 -0.0939 36ASP SC1 4437 7.083 9.362 6.562 0.3286 -0.1495 0.0192 37GLN BB 4438 7.432 9.063 6.424 -0.3125 0.0417 -0.1004 37GLN SC1 4439 7.504 9.353 6.197 -0.2150 -0.2095 -0.2941 38ALA BB 4440 7.708 8.914 6.402 -0.1290 0.0888 -0.2299 38ALA SC1 4441 7.885 9.103 6.324 -0.0710 0.0402 -0.2171 39LEU BB 4442 7.815 8.622 6.455 -0.0344 0.0439 0.0372 39LEU SC1 4443 8.114 8.754 6.322 -0.1117 -0.1041 -0.3678 40LYS BB 4444 7.664 8.352 6.481 0.1751 -0.2475 -0.0585 40LYS SC1 4445 7.732 8.170 6.728 0.1232 0.0061 -0.0701 40LYS SC2 4446 8.048 8.135 6.823 0.2219 0.0959 0.1155 41ASP BB 4447 7.503 8.160 6.286 0.2461 0.0589 0.1229 41ASP SC1 4448 7.787 8.156 6.092 0.2941 0.3228 0.1269 42ASP BB 4449 7.254 8.157 6.131 0.1548 0.1831 0.2234 42ASP SC1 4450 7.058 7.948 6.288 0.0940 0.2163 0.1182 43ASP BB 4451 7.160 8.402 6.007 0.0059 -0.2465 -0.1253 43ASP SC1 4452 7.236 8.436 5.676 0.0093 -0.3559 -0.3275 44ALA BB 4453 6.851 8.419 6.030 -0.0362 -0.1351 -0.0483 44ALA SC1 4454 6.785 8.665 6.121 0.0623 -0.2531 0.3657 45GLU BB 4455 6.725 8.234 6.316 -0.0354 -0.2724 -0.3686 45GLU SC1 4456 6.459 8.130 6.053 -0.0474 0.0959 0.2157 46THR BB 4457 6.628 8.334 6.627 0.0006 0.0511 -0.1685 46THR SC1 4458 6.741 8.617 6.631 0.0587 0.0282 0.2500 47GLY BB 4459 6.342 8.433 6.711 0.1356 0.0817 -0.0533 48LEU BB 4460 6.051 8.509 6.546 0.0165 -0.0121 0.2282 48LEU SC1 4461 5.833 8.461 6.807 0.1546 0.3180 -0.1528 49THR BB 4462 6.123 8.535 6.221 0.0943 -0.1809 -0.1469 49THR SC1 4463 6.414 8.590 6.295 -0.0967 -0.0654 0.6087 50ASP BB 4464 5.916 8.574 6.049 -0.1535 0.4281 -0.0746 50ASP SC1 4465 5.602 8.402 6.084 -0.2829 0.0059 0.0399 51GLY BB 4466 5.995 8.728 5.800 0.0716 0.3157 -0.4993 52GLU BB 4467 5.819 8.754 5.533 0.0198 -0.1171 -0.1927 52GLU SC1 4468 6.062 8.868 5.184 0.0292 0.0533 -0.3523 53GLU BB 4469 5.526 8.765 5.530 0.1405 -0.3037 -0.1328 53GLU SC1 4470 5.507 8.983 5.224 0.1460 0.0147 -0.2618 54LYS BB 4471 5.339 8.567 5.744 -0.1508 -0.1269 0.0470 54LYS SC1 4472 5.101 8.696 5.851 -0.0450 0.3981 0.3474 54LYS SC2 4473 5.049 9.045 5.814 -0.1727 -0.0616 0.1336 55GLU BB 4474 5.239 8.263 5.661 0.1917 0.2437 0.0679 55GLU SC1 4475 4.833 8.254 5.703 0.2348 -0.2430 0.0883 56GLU BB 4476 5.276 8.070 5.447 0.0392 -0.2316 -0.1874 56GLU SC1 4477 5.547 7.812 5.473 -0.1993 0.0572 0.3834 57PRO BB 4478 5.132 7.790 5.700 -0.0434 -0.4527 0.0614 57PRO SC1 4479 4.865 7.807 5.485 0.4038 -0.3391 -0.0818 58LYS BB 4480 5.286 7.528 5.881 0.3420 -0.2545 0.2294 58LYS SC1 4481 5.376 7.324 5.655 0.7766 -0.0055 0.4901 58LYS SC2 4482 5.266 7.081 5.412 -0.2271 -0.0050 -0.1054 59GLU BB 4483 5.471 7.338 6.108 0.2469 0.0494 0.0432 59GLU SC1 4484 5.735 7.551 6.276 0.2218 0.0084 0.1116 60GLU BB 4485 5.392 7.062 6.186 0.0624 -0.1112 -0.3312 60GLU SC1 4486 5.080 7.021 5.962 0.0001 -0.0666 -0.0283 61GLU BB 4487 5.317 6.896 6.428 0.2025 -0.0374 0.0455 61GLU SC1 4488 5.641 6.645 6.482 0.2772 -0.0633 0.0843 1LYS BB 4489 21.224 11.047 20.433 0.1338 0.3362 -0.0879 1LYS SC1 4490 21.299 10.870 20.201 -0.1706 0.1258 0.0787 1LYS SC2 4491 21.337 10.726 19.906 -0.0094 -0.4051 -0.2021 2LYS BB 4492 20.958 10.919 20.611 0.2092 -0.0124 -0.0278 2LYS SC1 4493 20.734 11.077 20.521 0.2850 -0.0746 -0.1299 2LYS SC2 4494 20.588 11.340 20.324 -0.1734 0.2088 -0.0720 3CYS BB 4495 20.889 10.613 20.712 -0.0236 -0.1174 -0.2682 3CYS SC1 4496 20.751 10.515 20.402 0.0307 -0.0534 -0.0586 4LEU BB 4497 20.858 10.442 20.990 0.1463 0.0272 -0.0553 4LEU SC1 4498 20.529 10.391 20.975 0.0273 -0.4660 -0.0248 5PHE BB 4499 20.993 10.182 21.139 0.4053 0.3973 -0.0423 5PHE SC1 4500 20.865 9.930 20.973 -0.0286 -0.3046 -0.0099 5PHE SC2 4501 20.581 9.942 20.786 0.0339 0.1758 -0.0868 5PHE SC3 4502 20.542 9.889 21.069 -0.1092 0.0132 -0.1354 6LYS BB 4503 21.253 10.117 21.263 -0.0255 -0.0899 0.2678 6LYS SC1 4504 21.448 10.255 21.031 0.1062 -0.1606 -0.0433 6LYS SC2 4505 21.356 10.384 20.725 0.0883 0.3417 0.3808 7LYS BB 4506 21.439 9.811 21.222 0.0960 -0.2051 -0.1941 7LYS SC1 4507 21.245 9.625 21.020 -0.0418 -0.1551 0.0004 7LYS SC2 4508 21.198 9.300 20.913 0.0394 0.2776 0.0640 8LYS BB 4509 21.723 9.785 21.363 -0.1177 -0.2065 -0.1142 8LYS SC1 4510 21.660 9.496 21.471 0.3850 0.0996 0.3327 8LYS SC2 4511 21.627 9.323 21.761 -0.0737 -0.0850 0.3325 9ASN BB 4512 21.903 10.007 21.233 -0.1977 0.1505 0.1623 9ASN SC1 4513 21.844 10.393 21.262 -0.1474 0.1774 -0.2224 10LYS BB 4514 22.147 9.999 21.034 -0.2837 -0.0568 -0.1141 10LYS SC1 4515 22.464 10.059 21.019 -0.2715 -0.0452 0.0386 10LYS SC2 4516 22.710 9.875 20.890 0.2732 0.1088 -0.1787 11LYS BB 4517 22.174 9.871 20.718 0.0026 -0.0257 0.0634 11LYS SC1 4518 22.287 10.174 20.621 0.3794 0.1219 -0.4572 11LYS SC2 4519 22.479 10.450 20.664 0.0926 -0.0554 -0.0423 12LYS BB 4520 21.991 9.882 20.477 0.1622 0.1395 0.1349 12LYS SC1 4521 22.225 9.976 20.247 0.1834 0.1727 -0.0829 12LYS SC2 4522 22.328 9.810 19.928 0.1232 -0.2573 0.1700 13GLY BB 4523 21.679 9.752 20.440 -0.0097 -0.1565 -0.1558 14LYS BB 4524 21.489 9.447 20.542 -0.1301 0.1510 -0.1215 14LYS SC1 4525 21.213 9.534 20.392 0.1971 0.2192 0.0639 14LYS SC2 4526 20.935 9.590 20.210 0.2372 0.0177 0.3435 15GLU BB 4527 21.527 9.090 20.577 0.1138 -0.1898 0.1273 15GLU SC1 4528 21.655 8.933 20.870 -0.0613 0.3671 0.1240 16LYS BB 4529 21.552 8.811 20.307 -0.3846 0.1576 -0.2286 16LYS SC1 4530 21.609 8.583 20.477 0.1630 -0.0230 -0.0208 16LYS SC2 4531 21.757 8.429 20.786 0.3153 -0.0332 0.1065 17GLY BB 4532 21.536 8.879 19.971 -0.0254 -0.4512 -0.0382 18GLY BB 4533 21.259 8.759 19.777 0.0430 -0.1953 0.2884 19LYS BB 4534 21.333 8.614 19.492 0.4443 -0.2368 0.1685 19LYS SC1 4535 21.090 8.569 19.302 -0.0227 -0.1925 0.0790 19LYS SC2 4536 21.250 8.364 19.026 0.3773 0.0070 0.3461 20ASN BB 4537 21.581 8.605 19.267 -0.3308 -0.0235 0.0514 20ASN SC1 4538 21.645 8.295 19.234 -0.0511 0.0993 -0.3020 21ALA BB 4539 21.760 8.838 19.280 0.3462 -0.0776 0.0758 21ALA SC1 4540 21.741 9.032 19.466 -0.2758 -0.0092 -0.0372 22ILE BB 4541 22.085 8.840 19.385 0.4276 -0.2347 -0.0358 22ILE SC1 4542 22.147 9.175 19.407 -0.2606 -0.1142 0.3230 23ASN BB 4543 22.295 8.705 19.225 -0.1128 -0.3154 0.0548 23ASN SC1 4544 22.302 8.405 19.059 -0.3896 0.0637 -0.0005 24MET BB 4545 22.643 8.672 19.279 -0.1449 0.1780 0.3145 24MET SC1 4546 22.752 8.303 19.194 -0.2644 0.1140 -0.2001 25LYS BB 4547 22.860 8.717 19.560 0.2345 0.3465 -0.1213 25LYS SC1 4548 22.862 8.449 19.700 0.0050 -0.2172 0.0942 25LYS SC2 4549 22.911 8.237 19.967 0.2756 0.2654 0.2303 26ASP BB 4550 23.151 8.797 19.502 0.1713 -0.0383 0.1036 26ASP SC1 4551 23.172 8.653 19.218 0.0997 0.1773 0.2580 27VAL BB 4552 23.319 8.782 19.784 -0.2304 -0.2279 -0.0586 27VAL SC1 4553 23.240 8.512 19.862 0.1879 -0.3844 -0.1465 28LYS BB 4554 23.419 8.998 20.046 0.1116 -0.0032 0.0703 28LYS SC1 4555 23.440 9.291 19.871 0.1576 -0.0815 -0.1396 28LYS SC2 4556 23.535 9.635 19.944 -0.0028 0.1083 -0.0647 29ASP BB 4557 23.424 8.882 20.332 -0.1739 0.1795 -0.0511 29ASP SC1 4558 23.767 8.855 20.483 -0.0465 -0.0942 -0.0112 30LEU BB 4559 23.126 8.909 20.526 0.1123 0.1136 0.1206 30LEU SC1 4560 22.940 9.089 20.285 0.0463 0.2326 0.0017 31GLY BB 4561 22.801 8.833 20.617 -0.5320 0.3581 0.3604 32LYS BB 4562 22.545 8.639 20.521 -0.1967 0.1220 0.2869 32LYS SC1 4563 22.323 8.799 20.475 0.0068 -0.6744 0.3846 32LYS SC2 4564 22.024 8.969 20.507 0.1357 0.2369 0.0432 33THR BB 4565 22.496 8.371 20.258 -0.1959 -0.0497 0.2513 33THR SC1 4566 22.463 8.605 20.065 -0.3704 -0.2629 0.0152 34MET BB 4567 22.294 8.094 20.333 0.1201 0.1934 0.1899 34MET SC1 4568 22.318 8.242 20.711 -0.0354 0.2285 -0.3056 35LYS BB 4569 22.406 7.778 20.304 -0.1329 -0.1225 0.0784 35LYS SC1 4570 22.272 7.683 20.061 -0.0599 0.2993 -0.2544 35LYS SC2 4571 22.198 7.361 20.102 -0.1655 -0.0046 0.1340 36ASP BB 4572 22.474 7.580 20.466 0.1412 0.0183 -0.0519 36ASP SC1 4573 22.307 7.712 20.763 0.0435 0.3302 0.0291 37GLN BB 4574 22.360 7.299 20.528 -0.2766 -0.2248 0.0071 37GLN SC1 4575 22.047 7.262 20.761 -0.3429 0.0357 0.1088 38ALA BB 4576 22.327 6.979 20.436 -0.0563 -0.0062 -0.0699 38ALA SC1 4577 22.218 6.909 20.673 0.1378 0.1452 0.0667 39LEU BB 4578 22.132 6.815 20.304 0.1943 -0.1212 -0.2312 39LEU SC1 4579 22.354 6.702 20.084 0.0260 -0.1708 0.0773 40LYS BB 4580 22.044 6.537 20.419 0.2255 -0.0639 -0.3423 40LYS SC1 4581 22.268 6.339 20.396 -0.1821 -0.0613 0.0803 40LYS SC2 4582 22.417 6.007 20.367 -0.1375 -0.1464 -0.0156 41ASP BB 4583 21.941 6.585 20.724 0.0207 0.0623 -0.0230 41ASP SC1 4584 21.939 6.255 20.761 0.2883 -0.1185 0.2766 42ASP BB 4585 21.705 6.825 20.732 0.2967 0.0003 -0.2720 42ASP SC1 4586 21.482 6.628 20.639 -0.0581 0.1607 -0.2502 43ASP BB 4587 21.662 7.052 20.563 -0.0011 -0.0204 -0.1592 43ASP SC1 4588 21.867 7.174 20.330 -0.2046 -0.0082 0.0654 44ALA BB 4589 21.452 7.300 20.603 -0.1394 0.2963 0.0756 44ALA SC1 4590 21.631 7.380 20.788 -0.0419 0.4198 -0.0694 45GLU BB 4591 21.144 7.189 20.703 -0.0799 -0.2991 0.1429 45GLU SC1 4592 21.209 7.347 21.033 0.0800 -0.2922 -0.0424 46THR BB 4593 21.106 6.868 20.799 0.1175 -0.2117 -0.2260 46THR SC1 4594 21.341 6.871 20.992 0.0319 0.1410 -0.1198 47GLY BB 4595 21.066 6.572 20.582 -0.0144 -0.2012 -0.0041 48LEU BB 4596 21.212 6.470 20.293 -0.1109 0.0564 -0.1887 48LEU SC1 4597 21.108 6.185 20.157 0.4778 0.0203 -0.0610 49THR BB 4598 21.193 6.677 20.038 0.0418 -0.1840 -0.0365 49THR SC1 4599 21.361 6.713 19.785 -0.2895 0.0594 -0.2302 50ASP BB 4600 20.958 6.877 20.048 -0.0428 0.1175 0.0354 50ASP SC1 4601 20.868 6.879 20.400 -0.1764 -0.1133 -0.1113 51GLY BB 4602 20.907 7.098 19.870 0.0927 -0.5010 0.0502 52GLU BB 4603 20.719 7.114 19.614 -0.1647 0.1899 0.1582 52GLU SC1 4604 20.977 6.773 19.548 -0.0192 0.0559 -0.1404 53GLU BB 4605 20.684 7.388 19.503 -0.6032 -0.0281 -0.1353 53GLU SC1 4606 20.615 7.574 19.841 0.0619 -0.0874 -0.0472 54LYS BB 4607 20.859 7.579 19.304 0.0144 0.0552 0.2640 54LYS SC1 4608 20.806 7.805 19.474 -0.2913 0.4059 0.0656 54LYS SC2 4609 21.021 7.886 19.703 0.1248 -0.1195 -0.1720 55GLU BB 4610 20.761 7.583 18.967 -0.1948 -0.2668 -0.2711 55GLU SC1 4611 20.484 7.790 19.037 0.0992 0.1488 -0.3522 56GLU BB 4612 20.731 7.363 18.761 0.1220 -0.0763 -0.0700 56GLU SC1 4613 21.064 7.168 18.839 0.0521 -0.0315 0.1897 57PRO BB 4614 20.465 7.503 18.547 -0.0952 -0.0382 0.4861 57PRO SC1 4615 20.271 7.410 18.789 -0.0881 -0.1437 -0.1647 58LYS BB 4616 20.682 7.454 18.287 0.3284 -0.3576 -0.0753 58LYS SC1 4617 20.837 7.171 18.353 0.0282 -0.2105 0.3749 58LYS SC2 4618 21.153 7.030 18.413 -0.1411 0.1741 -0.0857 59GLU BB 4619 20.458 7.470 17.997 0.0310 -0.1920 -0.2075 59GLU SC1 4620 20.740 7.545 17.783 -0.0573 0.2825 -0.1066 60GLU BB 4621 20.085 7.486 17.937 0.0383 0.1924 -0.0431 60GLU SC1 4622 19.868 7.738 18.084 -0.0737 0.0166 -0.0639 61GLU BB 4623 19.927 7.179 17.963 0.2337 0.1209 0.0408 61GLU SC1 4624 19.615 7.162 18.142 -0.2333 0.0964 -0.1233 1LYS BB 4625 8.711 14.871 16.291 0.1439 0.1467 0.2226 1LYS SC1 4626 8.428 14.845 16.091 0.1735 0.2058 0.0847 1LYS SC2 4627 8.189 14.618 15.962 -0.1901 0.1002 0.1215 2LYS BB 4628 8.844 14.978 15.985 -0.5008 0.2497 0.1047 2LYS SC1 4629 9.067 15.241 16.101 -0.0376 -0.3315 0.2712 2LYS SC2 4630 9.263 15.527 16.246 0.1793 -0.3919 -0.0651 3CYS BB 4631 8.834 14.862 15.695 -0.3244 -0.1213 0.2473 3CYS SC1 4632 8.618 14.681 15.822 -0.1203 -0.0126 -0.1917 4LEU BB 4633 8.968 14.605 15.492 0.0048 0.0103 -0.2415 4LEU SC1 4634 8.953 14.421 15.756 -0.0936 0.0332 0.0318 5PHE BB 4635 9.209 14.621 15.319 -0.0206 -0.2085 -0.0017 5PHE SC1 4636 9.140 14.887 15.165 0.1135 -0.0522 -0.0812 5PHE SC2 4637 8.874 14.940 14.959 0.3209 0.1092 -0.3129 5PHE SC3 4638 8.890 15.117 15.189 0.1454 -0.0033 -0.2118 6LYS BB 4639 9.508 14.406 15.358 0.2508 -0.0463 0.0532 6LYS SC1 4640 9.647 14.691 15.521 -0.0233 0.0379 -0.0214 6LYS SC2 4641 9.660 15.036 15.549 0.0305 0.0675 -0.2186 7LYS BB 4642 9.599 14.062 15.396 0.1034 -0.0660 0.0831 7LYS SC1 4643 9.824 14.005 15.675 -0.2973 0.1381 -0.1162 7LYS SC2 4644 10.091 13.826 15.484 0.1707 -0.2954 0.0280 8LYS BB 4645 9.794 13.988 15.151 0.2112 0.0062 0.1950 8LYS SC1 4646 9.816 14.302 15.058 -0.0853 -0.1972 0.3554 8LYS SC2 4647 10.124 14.492 15.008 -0.1496 0.2992 -0.0915 9ASN BB 4648 9.806 13.737 14.917 0.0157 -0.3013 -0.4786 9ASN SC1 4649 10.076 13.605 15.085 0.2221 0.1890 -0.2722 10LYS BB 4650 9.505 13.721 14.820 -0.1879 0.0716 -0.0422 10LYS SC1 4651 9.391 13.957 15.031 0.1890 -0.1460 0.0277 10LYS SC2 4652 9.282 14.276 14.964 0.0718 -0.2539 -0.4413 11LYS BB 4653 9.290 13.400 14.771 0.0446 0.0371 0.0157 11LYS SC1 4654 9.397 13.233 14.569 0.0556 -0.0505 0.4283 11LYS SC2 4655 9.521 12.930 14.550 0.3099 0.0461 -0.0212 12LYS BB 4656 8.948 13.490 14.738 0.1084 0.1135 0.1792 12LYS SC1 4657 8.928 13.456 14.429 0.2616 -0.1647 0.3098 12LYS SC2 4658 8.882 13.605 14.062 -0.1610 0.2453 -0.1156 13GLY BB 4659 8.667 13.284 14.766 0.1077 0.1889 0.1089 14LYS BB 4660 8.517 13.061 14.919 -0.0045 0.0995 -0.2871 14LYS SC1 4661 8.459 13.156 15.211 -0.2371 -0.0415 0.0612 14LYS SC2 4662 8.366 13.268 15.543 0.1289 0.1479 0.3869 15GLU BB 4663 8.211 13.038 14.790 -0.1102 0.2722 0.0705 15GLU SC1 4664 8.103 13.207 14.429 -0.3392 -0.0002 -0.0138 16LYS BB 4665 7.930 12.832 14.815 -0.0839 -0.1161 -0.1449 16LYS SC1 4666 7.719 12.831 15.073 -0.0789 -0.1019 0.3912 16LYS SC2 4667 7.524 13.078 15.182 0.3684 -0.0029 0.2990 17GLY BB 4668 7.871 12.562 14.665 -0.1661 -0.1062 0.2355 18GLY BB 4669 7.999 12.340 14.727 0.0440 0.1572 0.7989 19LYS BB 4670 8.228 12.262 14.876 -0.0547 -0.4814 -0.0070 19LYS SC1 4671 8.313 12.016 15.060 0.1623 0.1448 -0.2054 19LYS SC2 4672 8.462 11.813 15.311 0.1559 0.1875 0.2116 20ASN BB 4673 8.350 12.564 14.923 -0.0577 -0.2675 0.0086 20ASN SC1 4674 8.634 12.670 14.723 -0.3243 -0.6223 -0.5304 21ALA BB 4675 8.288 12.747 15.213 0.1259 0.4029 -0.3068 21ALA SC1 4676 8.501 12.794 15.371 0.0601 0.4653 -0.2361 22ILE BB 4677 7.993 12.610 15.369 0.1132 -0.0578 -0.1280 22ILE SC1 4678 7.930 12.329 15.186 -0.1858 0.1432 -0.3443 23ASN BB 4679 7.916 12.509 15.681 0.1072 0.2370 -0.1357 23ASN SC1 4680 7.831 12.808 15.767 -0.5482 -0.2819 0.1856 24MET BB 4681 7.938 12.153 15.663 -0.3699 0.5205 -0.0180 24MET SC1 4682 7.978 11.965 15.370 -0.2167 0.4807 0.0281 25LYS BB 4683 7.663 11.953 15.781 0.2156 -0.2078 0.2187 25LYS SC1 4684 7.718 11.625 15.899 -0.4915 -0.0448 -0.4783 25LYS SC2 4685 7.878 11.490 16.150 0.2101 0.2818 0.2264 26ASP BB 4686 7.468 12.103 15.958 0.0017 0.2496 0.3253 26ASP SC1 4687 7.517 12.385 15.813 0.0593 0.0560 0.0883 27VAL BB 4688 7.209 12.061 16.182 -0.2896 -0.1898 0.1843 27VAL SC1 4689 7.275 12.206 16.427 0.0121 -0.0713 0.0374 28LYS BB 4690 6.923 12.020 16.006 -0.0040 -0.0003 0.1633 28LYS SC1 4691 6.812 11.775 16.218 -0.0732 0.0951 0.2117 28LYS SC2 4692 6.528 11.683 16.396 -0.2044 -0.2652 0.0059 29ASP BB 4693 6.812 12.298 16.129 0.1085 0.0346 -0.0866 29ASP SC1 4694 7.051 12.533 16.209 -0.1732 -0.1896 -0.2198 30LEU BB 4695 6.567 12.495 16.148 0.4533 -0.1491 -0.2123 30LEU SC1 4696 6.314 12.408 15.846 -0.0433 -0.1657 -0.2521 31GLY BB 4697 6.502 12.823 16.108 0.0371 -0.0487 0.0053 32LYS BB 4698 6.700 13.080 16.210 -0.2095 -0.0712 0.0149 32LYS SC1 4699 6.782 13.098 16.507 -0.0384 0.1438 -0.0073 32LYS SC2 4700 6.594 13.061 16.797 -0.0393 0.0121 0.0689 33THR BB 4701 6.926 13.170 15.988 -0.2505 -0.1563 0.1800 33THR SC1 4702 6.787 13.398 15.840 -0.2100 -0.2106 0.0567 34MET BB 4703 7.204 13.337 15.980 0.2108 -0.0182 -0.0948 34MET SC1 4704 7.111 13.514 16.264 0.1733 -0.0978 -0.1188 35LYS BB 4705 7.215 13.533 15.682 0.2921 0.1248 -0.0911 35LYS SC1 4706 7.398 13.786 15.614 -0.1109 0.0593 0.4317 35LYS SC2 4707 7.211 14.081 15.608 -0.0715 0.0515 0.1211 36ASP BB 4708 7.189 13.364 15.391 -0.0130 -0.0181 0.2199 36ASP SC1 4709 7.121 13.062 15.564 0.0739 -0.3043 -0.1058 37GLN BB 4710 6.871 13.336 15.269 0.1773 -0.0731 0.0260 37GLN SC1 4711 6.671 13.073 15.440 -0.2875 0.1464 0.0128 38ALA BB 4712 6.772 13.276 14.982 0.0766 0.0671 -0.2450 38ALA SC1 4713 6.654 13.495 14.877 0.0233 0.3141 0.2969 39LEU BB 4714 6.615 13.008 14.854 -0.1176 -0.4383 0.0660 39LEU SC1 4715 6.349 13.206 14.697 0.1574 0.1575 0.1560 40LYS BB 4716 6.580 12.773 15.015 0.2304 -0.1314 0.1641 40LYS SC1 4717 6.284 12.773 15.002 0.1565 -0.2204 0.0121 40LYS SC2 4718 5.976 12.938 15.170 0.1128 0.2932 0.0285 41ASP BB 4719 6.830 12.547 14.989 -0.2515 0.0435 -0.0591 41ASP SC1 4720 6.903 12.637 14.695 -0.3403 -0.0091 0.2941 42ASP BB 4721 6.727 12.294 15.166 0.1283 0.0652 0.2317 42ASP SC1 4722 6.425 12.395 15.298 0.2631 -0.1327 -0.0433 43ASP BB 4723 6.890 12.040 15.131 -0.1214 0.1555 -0.2344 43ASP SC1 4724 7.159 12.181 15.109 0.1076 -0.2295 -0.1217 44ALA BB 4725 6.763 11.818 14.955 0.2080 -0.2979 -0.1014 44ALA SC1 4726 6.686 11.567 15.018 0.3040 -0.2478 0.2380 45GLU BB 4727 6.503 11.890 14.807 0.0005 0.0006 -0.0643 45GLU SC1 4728 6.513 11.568 14.589 0.0799 0.2332 -0.0412 46THR BB 4729 6.335 12.148 14.843 0.0359 -0.2152 -0.1362 46THR SC1 4730 6.139 12.021 15.040 -0.1679 -0.1915 -0.3199 47GLY BB 4731 6.369 12.445 14.804 0.2339 -0.3408 0.0740 48LEU BB 4732 6.454 12.543 14.537 -0.1852 0.0323 -0.2638 48LEU SC1 4733 6.302 12.803 14.466 -0.4553 -0.3884 0.1177 49THR BB 4734 6.536 12.313 14.307 0.0514 -0.2798 0.0895 49THR SC1 4735 6.834 12.376 14.328 -0.0046 0.0664 -0.0769 50ASP BB 4736 6.400 12.027 14.341 0.1642 -0.2075 -0.0939 50ASP SC1 4737 6.067 12.119 14.473 0.4314 -0.5293 0.1686 51GLY BB 4738 6.292 11.998 14.035 -0.2483 -0.0195 0.2586 52GLU BB 4739 6.109 12.145 13.837 -0.0125 -0.0513 -0.0669 52GLU SC1 4740 5.818 12.077 14.028 -0.1031 -0.2424 0.2055 53GLU BB 4741 5.932 12.112 13.530 0.0778 0.1972 -0.2676 53GLU SC1 4742 5.872 11.754 13.591 0.2114 -0.2654 -0.1095 54LYS BB 4743 5.699 12.313 13.482 0.0690 0.0606 -0.3271 54LYS SC1 4744 5.643 12.658 13.497 0.0308 0.3521 0.2283 54LYS SC2 4745 5.392 12.905 13.602 -0.2103 -0.0403 0.0222 55GLU BB 4746 5.559 12.328 13.230 -0.1790 -0.2027 0.1306 55GLU SC1 4747 5.188 12.215 13.264 0.2102 -0.0888 0.0227 56GLU BB 4748 5.755 12.541 13.054 0.1742 -0.2761 -0.0016 56GLU SC1 4749 6.069 12.672 13.259 -0.0431 0.2446 0.0539 57PRO BB 4750 5.550 12.721 12.855 -0.1020 -0.0833 0.1942 57PRO SC1 4751 5.545 12.578 12.573 0.0043 -0.0788 -0.1869 58LYS BB 4752 5.732 12.982 12.703 -0.0603 0.1291 -0.3295 58LYS SC1 4753 5.701 12.967 12.385 -0.2868 0.1280 -0.4872 58LYS SC2 4754 5.720 13.158 12.116 0.4516 -0.1238 -0.1025 59GLU BB 4755 5.760 13.286 12.807 0.1855 0.1131 0.0220 59GLU SC1 4756 5.814 13.494 12.486 0.0966 -0.0171 -0.1206 60GLU BB 4757 5.618 13.442 13.019 0.3219 -0.3336 0.1646 60GLU SC1 4758 5.959 13.592 13.178 0.1130 0.1464 0.0933 61GLU BB 4759 5.297 13.476 13.081 -0.0774 0.0172 0.1963 61GLU SC1 4760 5.203 13.211 13.293 -0.1163 0.0776 0.0758 1LYS BB 4761 1.053 19.146 12.841 -0.1056 0.1700 -0.0595 1LYS SC1 4762 1.337 19.163 13.051 0.0708 -0.1094 0.2693 1LYS SC2 4763 1.510 19.447 13.130 -0.2100 -0.1875 0.1174 2LYS BB 4764 0.940 19.293 12.580 -0.3279 0.3072 -0.1086 2LYS SC1 4765 0.780 19.554 12.593 -0.1602 -0.0515 0.2550 2LYS SC2 4766 0.473 19.794 12.541 0.1080 -0.2003 -0.5452 3CYS BB 4767 0.900 19.258 12.240 0.2186 0.1896 -0.1420 3CYS SC1 4768 0.835 18.918 12.216 0.0896 0.0573 0.1862 4LEU BB 4769 0.966 19.456 11.977 -0.0210 0.0797 -0.2536 4LEU SC1 4770 1.201 19.278 11.765 0.1237 0.0597 -0.1889 5PHE BB 4771 0.686 19.392 11.777 -0.2160 -0.0847 0.0932 5PHE SC1 4772 0.809 19.085 11.741 0.1910 0.0599 0.3591 5PHE SC2 4773 0.756 18.770 11.856 0.0250 -0.1500 -0.2499 5PHE SC3 4774 0.572 18.858 11.650 0.4272 0.1235 -0.5047 6LYS BB 4775 0.415 19.240 11.853 -0.1442 0.0572 0.0525 6LYS SC1 4776 0.451 19.018 12.065 -0.1714 -0.1240 -0.2939 6LYS SC2 4777 0.410 18.801 12.331 -0.2694 0.1855 0.0757 7LYS BB 4778 0.280 19.145 11.527 0.0156 -0.1122 0.0918 7LYS SC1 4779 0.280 19.448 11.427 0.2928 0.3342 -0.2834 7LYS SC2 4780 0.280 19.742 11.603 0.1369 -0.0537 -0.2525 8LYS BB 4781 0.142 18.913 11.377 -0.2407 0.3260 0.1704 8LYS SC1 4782 0.406 18.870 11.202 0.0569 0.3349 0.2592 8LYS SC2 4783 0.493 19.039 10.870 -0.2369 0.0827 0.0978 9ASN BB 4784 -0.102 18.790 11.569 -0.2648 0.0782 -0.1318 9ASN SC1 4785 -0.057 18.976 11.844 -0.1985 0.0733 -0.1152 10LYS BB 4786 -0.278 18.534 11.485 -0.1655 0.3397 -0.2387 10LYS SC1 4787 -0.137 18.279 11.647 0.1749 0.2591 0.0339 10LYS SC2 4788 0.072 18.130 11.862 -0.4332 -0.1497 -0.1553 11LYS BB 4789 -0.320 18.466 11.192 -0.0240 0.3377 0.0331 11LYS SC1 4790 -0.057 18.301 11.057 -0.0919 -0.2988 0.3291 11LYS SC2 4791 0.242 18.258 10.918 -0.3081 0.2236 0.3767 12LYS BB 4792 -0.390 18.611 10.885 0.2138 0.1273 0.0654 12LYS SC1 4793 -0.328 18.360 10.712 -0.0362 0.1086 0.0515 12LYS SC2 4794 -0.430 18.027 10.578 -0.2752 -0.1202 -0.1237 13GLY BB 4795 -0.371 18.914 10.817 -0.2924 -0.3650 -0.0437 14LYS BB 4796 -0.394 19.217 10.599 0.0035 0.0474 -0.0423 14LYS SC1 4797 -0.738 19.253 10.618 0.1258 -0.2450 -0.1011 14LYS SC2 4798 -1.047 19.049 10.475 0.3824 0.1096 -0.2179 15GLU BB 4799 -0.275 19.247 10.337 -0.3931 0.0197 0.1243 15GLU SC1 4800 -0.362 18.943 10.127 -0.1592 0.4041 0.3652 16LYS BB 4801 -0.071 19.439 10.190 -0.0386 0.1675 -0.1908 16LYS SC1 4802 0.177 19.261 10.116 0.0123 0.0557 -0.0954 16LYS SC2 4803 0.156 18.911 10.101 -0.0109 -0.2976 -0.1194 17GLY BB 4804 -0.117 19.695 9.987 -0.1650 0.2818 0.0030 18GLY BB 4805 -0.415 19.825 10.086 -0.2475 0.1255 -0.0085 19LYS BB 4806 -0.687 20.022 9.993 0.0282 -0.3209 -0.0698 19LYS SC1 4807 -0.891 19.766 9.925 0.1315 0.2120 -0.0225 19LYS SC2 4808 -0.957 19.463 9.782 -0.3794 -0.1619 0.0217 20ASN BB 4809 -0.716 20.282 9.820 0.0889 -0.3047 -0.2433 20ASN SC1 4810 -0.590 20.173 9.545 -0.0391 0.0268 0.3003 21ALA BB 4811 -0.631 20.607 9.926 -0.0063 -0.0482 -0.0110 21ALA SC1 4812 -0.854 20.732 10.014 -0.1516 -0.1084 -0.2826 22ILE BB 4813 -0.507 20.762 10.244 -0.5366 -0.0839 0.0020 22ILE SC1 4814 -0.563 21.061 10.091 -0.0333 0.0637 0.0874 23ASN BB 4815 -0.450 20.640 10.505 0.1039 0.1347 -0.0869 23ASN SC1 4816 -0.318 20.315 10.540 0.1221 0.0600 0.0073 24MET BB 4817 -0.602 20.806 10.705 0.1867 0.0477 0.0022 24MET SC1 4818 -0.333 20.989 10.902 0.3238 0.2870 0.3078 25LYS BB 4819 -0.773 20.687 11.021 -0.0554 -0.1191 0.1311 25LYS SC1 4820 -0.886 20.913 11.150 -0.2512 -0.1787 0.0039 25LYS SC2 4821 -0.694 21.160 11.326 -0.2407 0.2730 0.2570 26ASP BB 4822 -1.073 20.487 11.072 -0.2863 0.1505 -0.1962 26ASP SC1 4823 -1.016 20.303 11.380 -0.0980 0.2159 -0.1556 27VAL BB 4824 -1.276 20.708 11.244 0.0672 0.2786 -0.0779 27VAL SC1 4825 -1.469 20.921 11.188 -0.2318 -0.0382 -0.2941 28LYS BB 4826 -1.321 20.812 11.593 -0.0156 0.1122 0.2927 28LYS SC1 4827 -1.368 21.029 11.761 0.1998 -0.2053 -0.0600 28LYS SC2 4828 -1.392 21.222 12.023 -0.0919 -0.2209 0.0399 29ASP BB 4829 -1.289 20.510 11.760 -0.1090 0.0671 0.0738 29ASP SC1 4830 -1.447 20.299 11.499 0.3556 0.0234 -0.0448 30LEU BB 4831 -0.989 20.369 11.860 -0.3054 -0.0204 -0.1420 30LEU SC1 4832 -0.820 20.677 11.911 0.3643 -0.0203 -0.0754 31GLY BB 4833 -0.934 20.044 11.997 0.1401 -0.0539 -0.0300 32LYS BB 4834 -0.725 19.955 12.172 0.1620 -0.3060 0.1330 32LYS SC1 4835 -0.528 19.894 11.932 -0.0962 -0.1918 0.0282 32LYS SC2 4836 -0.447 19.659 11.716 -0.3153 -0.4274 0.0833 33THR BB 4837 -0.659 19.930 12.476 -0.1070 -0.0659 0.0236 33THR SC1 4838 -0.723 19.649 12.574 -0.3016 -0.0802 -0.1394 34MET BB 4839 -0.344 19.920 12.709 0.3748 -0.0476 -0.1076 34MET SC1 4840 -0.348 19.669 12.929 0.1492 -0.1671 0.0055 35LYS BB 4841 -0.421 20.204 12.953 -0.1604 0.0748 0.0388 35LYS SC1 4842 -0.348 20.063 13.244 -0.2226 -0.0271 0.3149 35LYS SC2 4843 -0.487 20.054 13.556 -0.2639 0.0564 -0.1388 36ASP BB 4844 -0.660 20.393 13.049 0.0836 -0.1089 0.0814 36ASP SC1 4845 -0.824 20.365 12.717 0.1011 -0.2195 -0.7934 37GLN BB 4846 -0.656 20.756 13.083 -0.1743 0.0971 0.0160 37GLN SC1 4847 -1.003 20.839 13.204 -0.3368 0.1214 -0.1610 38ALA BB 4848 -0.534 20.909 13.323 -0.1978 0.1639 -0.4389 38ALA SC1 4849 -0.709 21.109 13.371 0.1456 0.3202 0.3175 39LEU BB 4850 -0.206 20.883 13.242 -0.2542 0.0302 0.0153 39LEU SC1 4851 -0.247 21.046 12.938 0.0462 0.6834 0.2182 40LYS BB 4852 -0.153 20.593 13.174 -0.1195 0.0546 -0.1358 40LYS SC1 4853 -0.240 20.569 12.871 0.1314 -0.1637 -0.2232 40LYS SC2 4854 -0.216 20.458 12.553 -0.0995 0.2672 -0.1138 41ASP BB 4855 -0.208 20.410 13.428 0.2314 -0.0670 -0.0451 41ASP SC1 4856 -0.542 20.487 13.468 0.1506 0.2810 0.3290 42ASP BB 4857 0.016 20.306 13.539 -0.0320 0.0336 -0.0877 42ASP SC1 4858 0.134 20.621 13.599 -0.1312 -0.4754 -0.4623 43ASP BB 4859 0.130 20.044 13.354 0.0514 -0.3838 -0.1928 43ASP SC1 4860 0.422 20.171 13.259 -0.0336 0.2106 -0.2986 44ALA BB 4861 0.015 20.215 13.081 -0.0791 0.0253 -0.0731 44ALA SC1 4862 -0.040 19.972 12.977 0.0650 -0.1165 0.1730 45GLU BB 4863 0.219 20.350 12.837 0.0013 0.1005 0.0235 45GLU SC1 4864 0.172 20.134 12.521 -0.0318 -0.2458 -0.2238 46THR BB 4865 0.515 20.479 12.861 0.1521 0.5253 0.4630 46THR SC1 4866 0.471 20.660 12.620 -0.1172 -0.0649 0.0448 47GLY BB 4867 0.831 20.356 12.948 0.0950 -0.2040 0.0732 48LEU BB 4868 1.133 20.331 12.799 0.2577 -0.1637 -0.2900 48LEU SC1 4869 1.109 20.039 13.013 -0.1696 -0.2755 -0.1976 49THR BB 4870 1.184 20.328 12.501 -0.0175 -0.1016 -0.3402 49THR SC1 4871 1.446 20.173 12.471 0.1480 0.0386 0.2562 50ASP BB 4872 1.161 20.632 12.301 -0.1930 0.1021 -0.0617 50ASP SC1 4873 0.804 20.617 12.257 -0.3345 0.1863 0.0716 51GLY BB 4874 1.302 20.931 12.265 0.0308 0.1533 -0.1760 52GLU BB 4875 1.348 21.134 12.495 0.0573 0.1241 0.0339 52GLU SC1 4876 1.151 21.459 12.449 -0.2443 0.1926 0.1994 53GLU BB 4877 1.508 21.255 12.727 0.0502 0.1756 0.1065 53GLU SC1 4878 1.797 20.934 12.746 0.0232 -0.2898 0.0227 54LYS BB 4879 1.386 21.485 12.894 0.1484 -0.0441 -0.0026 54LYS SC1 4880 1.426 21.720 12.707 -0.0255 0.5197 0.0294 54LYS SC2 4881 1.694 22.005 12.635 -0.3698 0.0448 0.0830 55GLU BB 4882 1.141 21.458 13.153 -0.2241 -0.0899 -0.1254 55GLU SC1 4883 1.200 21.095 13.228 0.2117 0.0313 -0.4021 56GLU BB 4884 1.040 21.686 13.320 0.1270 0.1839 0.0338 56GLU SC1 4885 0.785 21.744 13.609 0.2620 0.1567 -0.0032 57PRO BB 4886 1.196 21.917 13.230 -0.1069 -0.2810 -0.4289 57PRO SC1 4887 0.963 22.063 13.074 0.0352 -0.0819 -0.0336 58LYS BB 4888 1.521 21.822 13.284 0.0966 0.0434 0.1771 58LYS SC1 4889 1.540 21.500 13.306 -0.0719 0.0600 0.0266 58LYS SC2 4890 1.681 21.233 13.131 -0.2443 -0.0435 0.3134 59GLU BB 4891 1.719 22.028 13.112 -0.1407 0.2397 -0.0981 59GLU SC1 4892 2.018 21.876 13.292 0.1953 0.1052 -0.0112 60GLU BB 4893 1.709 22.342 13.033 -0.1821 -0.1507 -0.0921 60GLU SC1 4894 1.790 22.639 13.253 0.0670 -0.1298 0.0192 61GLU BB 4895 1.812 22.432 12.724 0.2102 -0.0609 -0.0904 61GLU SC1 4896 1.552 22.386 12.385 -0.0337 -0.3089 -0.1068 1LYS BB 4897 18.748 11.688 5.990 0.2345 -0.4808 0.0612 1LYS SC1 4898 18.750 11.917 5.754 -0.0172 0.0991 0.0367 1LYS SC2 4899 18.747 12.102 5.486 -0.0488 0.3036 -0.1273 2LYS BB 4900 18.455 11.595 6.145 -0.4346 0.0353 -0.0924 2LYS SC1 4901 18.451 11.719 6.444 0.2967 0.3566 -0.0429 2LYS SC2 4902 18.306 11.751 6.786 0.0468 -0.2811 0.0758 3CYS BB 4903 18.224 11.739 5.970 0.2616 -0.0384 0.1359 3CYS SC1 4904 18.378 11.997 6.158 0.2088 -0.1894 -0.0421 4LEU BB 4905 18.042 12.003 5.925 0.0708 0.0856 0.2819 4LEU SC1 4906 17.806 11.729 5.995 -0.1877 -0.0525 0.0795 5PHE BB 4907 17.972 12.351 6.027 -0.0244 0.3297 -0.1227 5PHE SC1 4908 18.255 12.349 6.196 -0.1122 0.0463 0.1467 5PHE SC2 4909 18.476 12.514 6.395 0.2251 0.0872 -0.2481 5PHE SC3 4910 18.501 12.567 6.111 -0.1440 -0.0891 -0.3205 6LYS BB 4911 17.969 12.568 5.811 -0.0558 -0.0277 0.0488 6LYS SC1 4912 17.875 12.836 5.966 0.1168 -0.0323 -0.1638 6LYS SC2 4913 17.722 12.719 6.275 -0.5812 0.0523 -0.1867 7LYS BB 4914 17.949 12.665 5.520 0.2102 -0.2365 0.1256 7LYS SC1 4915 17.931 12.999 5.524 0.2867 0.1735 0.0549 7LYS SC2 4916 18.146 13.115 5.724 -0.1414 0.0927 0.1166 8LYS BB 4917 17.729 12.493 5.333 -0.1332 0.1407 -0.1800 8LYS SC1 4918 17.517 12.674 5.492 0.4158 0.1923 -0.1868 8LYS SC2 4919 17.220 12.752 5.601 0.1655 0.1311 0.3671 9ASN BB 4920 17.663 12.233 5.106 -0.0951 0.3720 -0.1639 9ASN SC1 4921 17.439 12.162 5.350 0.1627 -0.1713 0.1362 10LYS BB 4922 17.767 12.330 4.840 0.0246 -0.2574 0.0504 10LYS SC1 4923 17.500 12.441 4.732 -0.2048 -0.0197 -0.3009 10LYS SC2 4924 17.184 12.588 4.702 0.1817 -0.2246 -0.2485 11LYS BB 4925 17.991 12.520 4.697 0.4120 0.1106 0.0723 11LYS SC1 4926 18.118 12.276 4.556 -0.2700 0.2537 -0.4851 11LYS SC2 4927 18.140 11.958 4.426 0.1015 0.2825 0.4307 12LYS BB 4928 18.177 12.748 4.720 0.0314 -0.0352 -0.1203 12LYS SC1 4929 18.443 12.667 4.546 0.2500 -0.0984 -0.1247 12LYS SC2 4930 18.781 12.516 4.538 0.0930 -0.0377 0.1913 13GLY BB 4931 18.040 12.967 4.546 -0.2738 0.0875 0.1666 14LYS BB 4932 17.849 13.215 4.592 0.1400 -0.1758 -0.1488 14LYS SC1 4933 17.647 13.251 4.334 0.1712 0.4016 -0.4113 14LYS SC2 4934 17.302 13.118 4.388 -0.1980 -0.1737 0.1255 15GLU BB 4935 17.929 13.532 4.627 0.3500 0.0010 -0.1406 15GLU SC1 4936 18.193 13.612 4.827 0.0899 -0.0674 0.0446 16LYS BB 4937 17.952 13.672 4.410 0.0178 0.1982 -0.0299 16LYS SC1 4938 18.118 13.929 4.430 0.0141 0.2524 -0.1105 16LYS SC2 4939 18.192 14.241 4.342 -0.0796 -0.1373 -0.0359 17GLY BB 4940 17.883 13.633 4.104 0.0572 0.2629 0.3099 18GLY BB 4941 17.753 13.887 3.894 -0.2328 -0.0925 -0.2341 19LYS BB 4942 17.807 14.184 4.074 0.2038 -0.2170 -0.2483 19LYS SC1 4943 17.910 14.421 3.841 -0.3919 0.2835 0.2327 19LYS SC2 4944 18.060 14.730 3.788 -0.0465 -0.1130 -0.0035 20ASN BB 4945 17.700 14.152 4.414 -0.3164 -0.0588 -0.1719 20ASN SC1 4946 17.618 13.873 4.589 -0.1849 -0.0732 -0.1450 21ALA BB 4947 17.517 14.405 4.398 0.2305 -0.4083 0.0450 21ALA SC1 4948 17.292 14.297 4.296 -0.0903 0.0879 0.1909 22ILE BB 4949 17.459 14.677 4.221 0.0039 0.1951 -0.1381 22ILE SC1 4950 17.448 14.458 3.960 0.0517 -0.2803 0.2437 23ASN BB 4951 17.608 14.915 4.341 -0.3398 0.2996 -0.0872 23ASN SC1 4952 17.774 15.173 4.164 -0.1354 0.3744 -0.1582 24MET BB 4953 17.477 15.101 4.562 -0.2191 0.0479 -0.1408 24MET SC1 4954 17.274 15.360 4.543 -0.0511 -0.0790 -0.0606 25LYS BB 4955 17.785 15.144 4.737 0.0841 0.0351 -0.0359 25LYS SC1 4956 17.826 15.448 4.827 -0.0518 0.1783 -0.2057 25LYS SC2 4957 17.924 15.666 5.081 0.5412 0.0068 0.1566 26ASP BB 4958 17.944 14.871 4.693 0.2834 0.1141 -0.1749 26ASP SC1 4959 17.863 14.548 4.621 0.2273 -0.3703 -0.2853 27VAL BB 4960 18.149 14.985 4.479 -0.1813 -0.0194 0.0264 27VAL SC1 4961 18.066 15.264 4.464 -0.0684 -0.0007 -0.3490 28LYS BB 4962 18.453 14.938 4.370 0.2583 -0.0668 0.1962 28LYS SC1 4963 18.525 15.228 4.349 -0.4045 0.1217 0.0327 28LYS SC2 4964 18.476 15.557 4.321 -0.1970 -0.0263 -0.1371 29ASP BB 4965 18.477 14.847 4.036 0.2262 0.2312 0.1969 29ASP SC1 4966 18.279 15.088 3.958 -0.0609 -0.0457 0.1648 30LEU BB 4967 18.799 14.722 4.046 -0.0670 0.0771 -0.3843 30LEU SC1 4968 18.944 14.974 4.263 0.1124 -0.4900 -0.1641 31GLY BB 4969 18.845 14.629 3.687 0.2286 0.0118 -0.2202 32LYS BB 4970 18.542 14.637 3.495 0.2367 0.0036 -0.0191 32LYS SC1 4971 18.411 14.375 3.403 0.2061 -0.1388 0.2946 32LYS SC2 4972 18.154 14.301 3.128 -0.1226 -0.2762 -0.4515 33THR BB 4973 18.380 14.912 3.505 -0.1000 0.0356 0.0109 33THR SC1 4974 18.616 15.050 3.640 0.0760 -0.2590 0.0121 34MET BB 4975 18.132 14.866 3.255 -0.1860 0.3184 -0.2453 34MET SC1 4976 17.863 14.588 3.402 -0.0553 0.0568 0.1971 35LYS BB 4977 17.831 15.052 3.141 0.1969 -0.2597 -0.0083 35LYS SC1 4978 17.535 14.908 3.269 0.0876 -0.0081 -0.3779 35LYS SC2 4979 17.362 14.642 3.334 -0.1193 -0.1794 -0.1041 36ASP BB 4980 17.703 15.030 2.861 0.0312 0.1147 0.0898 36ASP SC1 4981 17.480 15.282 2.868 -0.4201 -0.2468 0.2988 37GLN BB 4982 17.819 15.043 2.546 -0.2094 0.2795 -0.0093 37GLN SC1 4983 17.660 15.357 2.442 -0.1036 -0.2095 -0.0078 38ALA BB 4984 18.038 14.941 2.394 0.0544 0.0106 -0.0062 38ALA SC1 4985 18.184 15.136 2.279 -0.1357 0.3488 0.3056 39LEU BB 4986 18.206 14.710 2.418 -0.2002 0.0437 0.0099 39LEU SC1 4987 18.403 14.639 2.137 -0.1280 0.0011 -0.0433 40LYS BB 4988 18.495 14.605 2.626 0.0312 -0.1491 -0.1170 40LYS SC1 4989 18.729 14.640 2.457 0.0967 -0.1529 -0.1456 40LYS SC2 4990 18.993 14.858 2.342 0.2423 -0.0171 -0.3520 41ASP BB 4991 18.495 14.576 2.979 -0.5778 -0.3163 -0.1590 41ASP SC1 4992 18.535 14.882 3.102 -0.2253 0.0072 0.0120 42ASP BB 4993 18.552 14.261 2.960 -0.1100 -0.0185 -0.1814 42ASP SC1 4994 18.597 14.121 2.645 -0.1450 -0.0557 -0.1765 43ASP BB 4995 18.526 14.017 3.142 0.1345 -0.0747 0.0447 43ASP SC1 4996 18.865 13.991 3.246 0.3241 -0.0483 0.2535 44ALA BB 4997 18.358 13.736 3.055 0.3643 -0.2714 0.2240 44ALA SC1 4998 18.105 13.830 3.042 0.3524 -0.3249 0.0398 45GLU BB 4999 18.363 13.437 3.231 -0.0692 -0.1601 -0.0565 45GLU SC1 5000 18.556 13.282 2.959 -0.1711 0.0791 -0.0785 46THR BB 5001 18.199 13.304 3.512 -0.3085 0.2436 0.1463 46THR SC1 5002 18.365 13.169 3.730 -0.0615 0.0610 -0.1478 47GLY BB 5003 17.979 13.088 3.440 0.3312 0.1259 -0.2128 48LEU BB 5004 17.719 12.961 3.607 0.1302 0.4187 0.2402 48LEU SC1 5005 17.500 12.809 3.395 -0.0268 -0.0238 0.2002 49THR BB 5006 17.740 12.714 3.812 -0.2436 0.0241 -0.0948 49THR SC1 5007 17.863 12.444 3.739 -0.4220 -0.0328 -0.1889 50ASP BB 5008 17.745 12.749 4.119 -0.1690 0.0459 -0.1973 50ASP SC1 5009 18.067 12.661 4.226 0.1341 0.5583 0.0888 51GLY BB 5010 17.646 12.491 4.344 -0.1438 0.1697 0.1084 52GLU BB 5011 17.365 12.329 4.359 0.4699 0.2330 -0.0101 52GLU SC1 5012 17.262 12.680 4.224 0.2863 0.0394 -0.1391 53GLU BB 5013 17.254 12.008 4.241 0.0953 0.0936 0.0668 53GLU SC1 5014 17.519 11.949 3.977 -0.1971 -0.2081 -0.1515 54LYS BB 5015 17.132 11.804 4.430 -0.2137 -0.0586 0.0494 54LYS SC1 5016 16.931 11.925 4.564 0.1597 -0.0842 -0.4889 54LYS SC2 5017 16.802 11.906 4.863 -0.2785 -0.0088 -0.2222 55GLU BB 5018 17.288 11.652 4.706 0.1850 -0.0813 0.1564 55GLU SC1 5019 17.605 11.766 4.896 0.2155 -0.4060 -0.0187 56GLU BB 5020 17.177 11.555 4.983 0.3895 -0.0442 -0.0513 56GLU SC1 5021 17.146 11.195 4.920 0.2215 0.1250 -0.0805 57PRO BB 5022 16.833 11.507 5.079 0.1916 -0.0009 0.0337 57PRO SC1 5023 16.729 11.219 5.229 0.4259 0.0267 0.2808 58LYS BB 5024 16.660 11.665 5.294 0.2439 0.1814 -0.0442 58LYS SC1 5025 16.394 11.488 5.303 -0.0639 -0.2180 -0.2207 58LYS SC2 5026 16.052 11.567 5.192 -0.2077 0.0776 0.0557 59GLU BB 5027 16.529 11.961 5.280 0.0446 -0.1969 -0.2192 59GLU SC1 5028 16.188 11.983 5.295 -0.1377 -0.1836 0.1029 60GLU BB 5029 16.688 12.249 5.336 0.4456 -0.0387 0.3307 60GLU SC1 5030 16.521 12.275 5.709 -0.0302 -0.0010 -0.0300 61GLU BB 5031 16.897 12.379 5.110 -0.2585 0.0079 -0.2263 61GLU SC1 5032 16.684 12.753 4.975 -0.0680 -0.1585 0.1018 24.94361 24.94361 24.94361