Title of the system in water 5032 1LYS BB 1 22.832 16.947 9.558 -0.1165 -0.3455 -0.1720 1LYS SC1 2 22.690 16.671 9.480 -0.3065 0.1562 0.0518 1LYS SC2 3 22.500 16.460 9.233 0.0067 0.0172 0.1631 2LYS BB 4 22.567 17.166 9.703 -0.2623 -0.1027 -0.2694 2LYS SC1 5 22.342 17.000 9.841 -0.1696 -0.0286 0.2936 2LYS SC2 6 22.155 16.888 10.057 0.0471 -0.2255 0.3738 3CYS BB 7 22.685 17.383 10.005 -0.0672 0.0171 0.0805 3CYS SC1 8 22.841 17.566 9.776 -0.4933 -0.1146 0.3614 4LEU BB 9 22.554 17.634 10.101 0.2192 -0.2629 -0.1451 4LEU SC1 10 22.676 17.885 9.897 -0.0165 -0.1443 -0.1104 5PHE BB 11 22.400 17.697 10.405 -0.0487 -0.0776 0.1092 5PHE SC1 12 22.287 18.008 10.441 -0.2004 -0.4480 0.2678 5PHE SC2 13 22.076 18.160 10.661 -0.1866 -0.2424 0.1408 5PHE SC3 14 22.355 18.156 10.739 -0.1295 0.1282 -0.0211 6LYS BB 15 22.506 17.615 10.721 -0.3513 0.0310 -0.0695 6LYS SC1 16 22.272 17.417 10.829 -0.4561 0.1075 0.3759 6LYS SC2 17 22.232 17.106 10.817 0.0166 -0.1963 0.0803 7LYS BB 18 22.705 17.859 10.858 0.0579 0.1588 -0.3323 7LYS SC1 19 22.835 17.601 10.987 0.1541 -0.0839 -0.1050 7LYS SC2 20 23.184 17.551 11.137 -0.0196 0.3452 0.1331 8LYS BB 21 22.985 18.006 10.817 0.4520 -0.0677 0.3445 8LYS SC1 22 22.918 18.289 10.641 0.0440 -0.3366 0.1095 8LYS SC2 23 22.974 18.451 10.341 -0.1505 0.4252 0.2336 9ASN BB 24 23.238 17.989 11.000 0.3034 0.1183 0.0236 9ASN SC1 25 23.444 17.854 10.812 -0.1281 -0.1313 -0.2213 10LYS BB 26 23.289 18.180 11.228 -0.0084 0.1933 -0.1783 10LYS SC1 27 23.269 18.046 11.535 -0.0122 -0.3082 0.0216 10LYS SC2 28 23.492 17.845 11.676 -0.0537 0.1090 0.2262 11LYS BB 29 23.030 18.334 11.309 -0.0217 0.2025 -0.2407 11LYS SC1 30 23.055 18.529 11.068 0.2144 -0.1650 0.1002 11LYS SC2 31 23.250 18.818 10.995 0.1318 -0.2019 0.0935 12LYS BB 32 22.877 18.334 11.612 -0.1907 -0.3493 0.2338 12LYS SC1 33 22.594 18.292 11.512 0.2261 0.1938 -0.3376 12LYS SC2 34 22.352 18.052 11.342 0.0258 -0.0966 0.0966 13GLY BB 35 22.843 18.169 11.889 -0.1075 0.1741 -0.1293 14LYS BB 36 22.594 17.981 11.839 -0.0254 0.0929 -0.0024 14LYS SC1 37 22.607 17.749 11.647 -0.0854 -0.1530 0.1647 14LYS SC2 38 22.468 17.443 11.733 -0.1169 0.1309 -0.2171 15GLU BB 39 22.348 18.081 11.921 -0.1072 0.0406 -0.1449 15GLU SC1 40 22.182 17.758 12.033 0.1348 0.0545 -0.2381 16LYS BB 41 22.147 18.240 11.739 -0.0873 -0.1507 0.2107 16LYS SC1 42 21.863 18.177 11.801 0.3922 0.1539 -0.0425 16LYS SC2 43 21.621 17.944 11.694 0.0128 -0.0156 -0.0882 17GLY BB 44 22.180 18.434 11.456 0.2688 -0.0732 0.1420 18GLY BB 45 22.383 18.574 11.293 0.0622 -0.0924 0.1122 19LYS BB 46 22.711 18.717 11.314 -0.2854 -0.0491 0.2069 19LYS SC1 47 22.566 18.961 11.492 0.3254 -0.1893 0.0939 19LYS SC2 48 22.226 18.915 11.517 0.1283 0.1628 0.1681 20ASN BB 49 22.854 18.959 11.151 0.0302 -0.1116 -0.1475 20ASN SC1 50 22.561 19.113 10.982 -0.2368 0.3108 -0.0855 21ALA BB 51 23.015 19.247 11.206 -0.3174 0.0145 -0.0896 21ALA SC1 52 22.813 19.409 11.282 -0.1671 0.2140 -0.1098 22ILE BB 53 23.324 19.155 11.278 0.0297 -0.0845 -0.0345 22ILE SC1 54 23.425 19.276 11.580 0.2460 -0.1816 -0.0657 23ASN BB 55 23.566 19.311 11.125 -0.4203 0.0139 0.1953 23ASN SC1 56 23.804 19.042 11.068 -0.2195 -0.3900 0.2306 24MET BB 57 23.659 19.608 11.194 0.0010 0.0224 0.2854 24MET SC1 58 23.586 19.722 11.532 -0.2343 0.1482 -0.0479 25LYS BB 59 23.706 19.794 10.969 0.1861 0.1070 -0.3322 25LYS SC1 60 24.021 19.743 10.965 0.3623 0.1401 -0.0064 25LYS SC2 61 24.119 19.435 10.899 -0.2796 -0.1227 0.0137 26ASP BB 62 23.672 19.626 10.687 -0.1476 -0.1769 -0.1880 26ASP SC1 63 23.788 19.331 10.645 0.2070 -0.0202 -0.1503 27VAL BB 64 23.530 19.602 10.375 0.0032 0.0258 -0.1718 27VAL SC1 65 23.354 19.370 10.360 -0.0145 0.0112 0.1765 28LYS BB 66 23.756 19.728 10.219 0.1109 0.0172 -0.0250 28LYS SC1 67 24.006 19.531 10.144 0.2120 -0.0821 -0.1035 28LYS SC2 68 24.085 19.480 9.823 -0.3933 -0.1160 -0.0548 29ASP BB 69 23.709 20.023 10.379 -0.1680 -0.0652 -0.0231 29ASP SC1 70 23.403 20.088 10.369 -0.1802 0.0009 0.1002 30LEU BB 71 23.778 20.183 10.643 -0.0076 0.3169 0.3997 30LEU SC1 72 23.973 20.440 10.722 -0.0402 0.0304 -0.1267 31GLY BB 73 23.613 20.286 10.890 0.1030 0.4066 -0.1681 32LYS BB 74 23.353 20.422 10.704 0.4367 -0.0074 -0.1555 32LYS SC1 75 23.549 20.696 10.691 0.1471 0.0412 -0.1235 32LYS SC2 76 23.568 21.004 10.744 0.0049 0.1653 0.0842 33THR BB 77 23.225 20.532 10.454 0.0033 0.1001 -0.1609 33THR SC1 78 22.920 20.542 10.460 -0.0262 -0.4773 -0.1175 34MET BB 79 23.332 20.627 10.187 0.0327 -0.0124 0.1469 34MET SC1 80 23.700 20.571 10.284 0.0380 -0.1683 0.1114 35LYS BB 81 23.305 20.436 9.909 -0.0785 -0.1368 -0.3092 35LYS SC1 82 23.192 20.679 9.753 -0.2186 -0.0132 -0.2450 35LYS SC2 83 22.899 20.785 9.644 -0.2619 -0.0401 -0.0341 36ASP BB 84 23.375 20.117 9.852 0.1301 -0.0652 -0.0848 36ASP SC1 85 23.393 20.216 9.516 0.5904 0.0883 -0.7812 37GLN BB 86 23.234 19.880 9.998 0.3221 -0.1614 -0.1208 37GLN SC1 87 22.962 20.157 10.166 0.0171 0.0862 -0.1846 38ALA BB 88 23.283 19.560 9.995 -0.0017 0.3286 -0.0907 38ALA SC1 89 23.051 19.464 10.093 0.3157 -0.2506 0.1474 39LEU BB 90 23.572 19.360 9.927 0.2850 0.3844 0.2606 39LEU SC1 91 23.393 19.078 10.032 -0.0574 -0.1307 -0.0627 40LYS BB 92 23.668 19.282 9.561 -0.0891 -0.0061 -0.0643 40LYS SC1 93 23.470 19.441 9.447 -0.1890 0.1233 0.0404 40LYS SC2 94 23.402 19.412 9.083 -0.0842 0.0183 0.0521 41ASP BB 95 23.977 19.055 9.567 -0.1668 0.0006 0.0836 41ASP SC1 96 23.815 18.838 9.387 0.1426 -0.2387 0.1707 42ASP BB 97 24.296 19.085 9.606 -0.1003 0.0595 0.0417 42ASP SC1 98 24.418 19.389 9.594 -0.3233 -0.3336 -0.0324 43ASP BB 99 24.358 18.766 9.750 -0.1147 -0.0117 0.2192 43ASP SC1 100 24.444 18.452 9.622 -0.1873 -0.3110 -0.1053 44ALA BB 101 24.120 18.629 9.907 0.2724 0.2953 -0.0873 44ALA SC1 102 24.012 18.852 10.013 0.2527 -0.0041 0.5682 45GLU BB 103 23.935 18.502 9.634 0.0289 0.1858 -0.0476 45GLU SC1 104 23.591 18.363 9.659 -0.1290 0.0845 -0.0210 46THR BB 105 24.078 18.173 9.695 -0.2157 0.0504 -0.2351 46THR SC1 106 24.168 18.212 9.406 0.0253 -0.0449 -0.1758 47GLY BB 107 23.984 17.973 9.951 -0.1386 -0.0398 -0.0063 48LEU BB 108 24.205 18.024 10.218 0.1668 -0.1036 0.1315 48LEU SC1 109 24.078 17.701 10.362 -0.0123 0.1967 0.1093 49THR BB 110 24.214 18.346 10.254 -0.0854 0.0570 -0.1908 49THR SC1 111 24.458 18.417 10.085 -0.0091 0.1936 -0.0264 50ASP BB 112 24.124 18.333 10.609 -0.1657 0.0925 -0.0431 50ASP SC1 113 24.416 18.149 10.656 -0.2966 0.0441 -0.1554 51GLY BB 114 23.917 18.461 10.792 0.0018 -0.1046 -0.0442 52GLU BB 115 23.693 18.247 10.893 0.1479 0.2516 -0.2257 52GLU SC1 116 23.403 18.417 10.702 0.0287 -0.0763 0.1287 53GLU BB 117 23.756 18.062 11.205 0.0870 -0.0829 -0.1200 53GLU SC1 118 23.634 17.715 11.200 -0.2868 0.0984 0.0985 54LYS BB 119 23.737 18.226 11.517 -0.0084 0.0327 0.0648 54LYS SC1 120 23.468 18.434 11.617 0.2387 0.0292 0.1015 54LYS SC2 121 23.434 18.648 11.913 0.0851 0.2607 -0.5522 55GLU BB 122 23.797 18.186 11.828 0.0665 0.0681 -0.2330 55GLU SC1 123 23.809 17.817 11.972 -0.1544 0.1888 -0.0524 56GLU BB 124 23.847 18.477 11.962 -0.1928 -0.0682 -0.1472 56GLU SC1 125 23.600 18.440 12.306 -0.0351 -0.0390 -0.0332 57PRO BB 126 24.101 18.530 11.671 0.1112 0.0403 -0.1607 57PRO SC1 127 24.197 18.242 11.623 0.3272 0.2839 -0.0995 58LYS BB 128 24.165 18.857 11.580 0.0091 0.3454 -0.0864 58LYS SC1 129 24.071 19.015 11.799 0.3119 -0.4084 0.1275 58LYS SC2 130 24.261 19.324 11.818 -0.0563 -0.0480 -0.0788 59GLU BB 131 24.484 18.911 11.526 0.1025 -0.1987 -0.2403 59GLU SC1 132 24.460 19.048 11.131 0.0276 -0.1384 -0.0583 60GLU BB 133 24.672 19.016 11.739 -0.0024 0.0387 0.6065 60GLU SC1 134 24.981 18.808 11.652 0.0256 0.0399 -0.0587 61GLU BB 135 24.683 19.234 12.014 0.0229 0.1899 0.2715 61GLU SC1 136 24.654 19.635 11.957 0.4082 -0.1451 -0.1557 1LYS BB 137 20.160 14.913 23.645 0.2168 -0.2880 -0.0439 1LYS SC1 138 20.423 15.009 23.776 0.0613 -0.3700 0.3257 1LYS SC2 139 20.789 15.078 23.797 0.2188 -0.3402 -0.3573 2LYS BB 140 19.909 15.070 23.597 0.5354 0.4132 0.0038 2LYS SC1 141 19.940 15.186 23.273 -0.0173 0.1082 -0.1057 2LYS SC2 142 19.836 15.110 22.972 -0.0176 -0.3262 0.2894 3CYS BB 143 19.847 15.292 23.832 0.0295 -0.2506 0.1178 3CYS SC1 144 20.133 15.199 23.952 -0.7184 0.0805 -0.6644 4LEU BB 145 19.862 15.607 23.665 0.1913 -0.1722 -0.0751 4LEU SC1 146 19.841 15.852 23.876 0.0215 0.2656 0.0736 5PHE BB 147 20.141 15.699 23.613 -0.0432 0.0171 -0.0145 5PHE SC1 148 20.315 15.477 23.837 0.0100 -0.0866 0.2762 5PHE SC2 149 20.399 15.584 24.149 0.3331 0.0525 0.1465 5PHE SC3 150 20.546 15.709 23.932 -0.2470 0.3421 -0.1023 6LYS BB 151 20.234 15.977 23.735 -0.4525 0.2874 0.1017 6LYS SC1 152 20.267 15.904 24.024 0.3764 -0.0571 -0.2528 6LYS SC2 153 20.391 16.113 24.205 -0.2963 -0.1914 -0.1640 7LYS BB 154 20.018 16.167 23.541 0.3147 0.1209 -0.1886 7LYS SC1 155 20.119 16.018 23.293 0.3744 0.0541 0.5404 7LYS SC2 156 20.322 15.725 23.170 0.0162 -0.3940 -0.1474 8LYS BB 157 19.970 16.526 23.483 0.1530 0.2393 0.1699 8LYS SC1 158 19.991 16.683 23.734 0.1946 -0.1589 0.0671 8LYS SC2 159 20.025 17.005 23.880 0.1003 0.2812 0.2294 9ASN BB 160 20.100 16.641 23.241 -0.0958 -0.0913 0.4581 9ASN SC1 161 19.876 16.879 23.064 0.1316 0.1618 0.1347 10LYS BB 162 20.068 16.443 23.001 0.1122 -0.2839 -0.0583 10LYS SC1 163 20.334 16.291 23.023 0.1938 0.2202 0.0136 10LYS SC2 164 20.582 16.524 23.000 -0.0131 -0.2333 -0.2783 11LYS BB 165 19.773 16.418 22.824 -0.0791 0.0375 -0.1988 11LYS SC1 166 19.743 16.635 22.646 -0.0947 -0.2086 -0.0743 11LYS SC2 167 19.699 16.770 22.346 0.2504 -0.0833 0.3468 12LYS BB 168 19.507 16.245 22.892 -0.0024 -0.0858 -0.1360 12LYS SC1 169 19.576 15.907 22.820 -0.2118 -0.0725 0.0797 12LYS SC2 170 19.739 15.743 22.546 0.4956 -0.1533 0.2536 13GLY BB 171 19.674 16.186 23.195 0.0396 -0.2058 0.2538 14LYS BB 172 19.579 15.900 23.355 0.0853 -0.0947 0.1602 14LYS SC1 173 19.432 15.736 23.182 0.0763 -0.2647 0.2599 14LYS SC2 174 19.148 15.562 23.106 -0.3527 -0.3459 0.1941 15GLU BB 175 19.480 16.055 23.606 0.0268 -0.1138 -0.2487 15GLU SC1 176 19.597 16.367 23.749 -0.0703 0.0323 0.2605 16LYS BB 177 19.332 15.964 23.898 0.0746 0.1046 0.2651 16LYS SC1 178 19.521 15.964 24.179 -0.2966 0.5040 0.2589 16LYS SC2 179 19.609 16.048 24.504 0.1167 0.1399 -0.1333 17GLY BB 180 18.971 15.867 23.930 0.1664 0.2325 -0.0075 18GLY BB 181 19.009 15.621 24.105 0.0861 0.0639 0.3399 19LYS BB 182 18.895 15.453 24.341 -0.0313 0.4016 -0.2584 19LYS SC1 183 18.914 15.671 24.612 0.0571 0.2813 -0.0557 19LYS SC2 184 18.638 15.629 24.766 -0.0338 -0.2979 0.3669 20ASN BB 185 19.160 15.273 24.390 -0.1207 -0.3819 -0.0043 20ASN SC1 186 19.354 15.575 24.335 -0.1721 -0.0307 -0.0495 21ALA BB 187 19.256 15.242 24.719 0.0135 0.1310 0.1262 21ALA SC1 188 19.243 15.511 24.697 0.1419 0.1110 -0.2774 22ILE BB 189 19.203 15.000 24.947 -0.1475 -0.0983 -0.1269 22ILE SC1 190 19.015 15.065 25.224 0.3172 0.1092 0.1526 23ASN BB 191 19.363 14.669 24.949 0.2097 -0.2389 0.2031 23ASN SC1 192 19.602 14.794 25.121 -0.1078 -0.1499 0.2065 24MET BB 193 19.329 14.452 24.734 -0.1222 -0.1053 0.0444 24MET SC1 194 19.396 14.447 24.405 0.0968 -0.0468 0.2290 25LYS BB 195 19.106 14.220 24.705 -0.2582 0.1478 0.1487 25LYS SC1 196 19.195 14.075 24.437 -0.1038 -0.0317 0.2151 25LYS SC2 197 19.105 13.776 24.435 0.0385 0.0870 0.0954 26ASP BB 198 18.742 14.227 24.729 -0.0229 0.1150 0.2211 26ASP SC1 199 18.768 13.882 24.688 0.0260 -0.1766 -0.1141 27VAL BB 200 18.559 14.403 24.922 -0.1699 -0.1209 0.3746 27VAL SC1 201 18.281 14.317 24.902 -0.1572 -0.1501 0.3229 28LYS BB 202 18.732 14.680 25.042 0.1675 -0.1427 0.1164 28LYS SC1 203 18.875 14.725 24.803 0.3501 0.0952 0.2918 28LYS SC2 204 19.031 14.828 24.538 0.0061 0.3728 0.0275 29ASP BB 205 18.822 14.531 25.327 -0.3309 -0.0453 -0.0635 29ASP SC1 206 19.041 14.327 25.138 -0.3912 -0.1471 0.2351 30LEU BB 207 18.837 14.578 25.620 -0.0416 -0.2428 0.4245 30LEU SC1 208 18.908 14.946 25.630 -0.3551 -0.1160 0.1481 31GLY BB 209 18.606 14.472 25.752 -0.2240 -0.0122 0.1232 32LYS BB 210 18.587 14.153 25.714 -0.1201 -0.2316 0.1778 32LYS SC1 211 18.362 14.012 25.885 0.2478 0.0809 -0.0731 32LYS SC2 212 18.047 13.946 26.024 0.1885 0.1674 0.4077 33THR BB 213 18.791 13.990 25.444 0.1573 -0.0737 0.2076 33THR SC1 214 18.676 14.073 25.173 0.3187 0.0079 0.1627 34MET BB 215 18.951 13.705 25.481 -0.1956 0.0439 0.5477 34MET SC1 216 18.652 13.466 25.563 0.0190 0.0781 0.0512 35LYS BB 217 19.263 13.674 25.557 -0.0215 -0.1413 0.0449 35LYS SC1 218 19.205 13.781 25.858 0.0730 -0.1345 0.2534 35LYS SC2 219 19.184 13.652 26.201 0.0429 -0.2731 -0.1042 36ASP BB 220 19.496 13.739 25.336 0.0697 -0.1909 -0.3194 36ASP SC1 221 19.385 13.548 25.098 0.0878 -0.3732 0.0515 37GLN BB 222 19.773 13.644 25.376 0.0386 0.1720 0.1715 37GLN SC1 223 19.884 13.834 25.014 -0.0477 0.0098 -0.0523 38ALA BB 224 19.928 13.401 25.220 0.1240 0.4162 -0.1315 38ALA SC1 225 20.115 13.472 25.039 0.5778 -0.2016 0.0631 39LEU BB 226 20.121 13.258 25.399 -0.3154 0.2256 -0.2515 39LEU SC1 227 19.936 13.342 25.664 -0.0091 -0.1286 -0.1722 40LYS BB 228 20.064 12.951 25.532 0.0885 0.0396 -0.0838 40LYS SC1 229 19.764 12.978 25.484 0.2365 -0.2775 0.3239 40LYS SC2 230 19.535 13.237 25.385 -0.1577 -0.3108 -0.0356 41ASP BB 231 20.330 12.739 25.511 -0.1253 -0.2357 -0.2014 41ASP SC1 232 20.502 12.925 25.749 -0.1026 0.1078 0.0673 42ASP BB 233 20.433 12.733 25.172 0.0361 0.0545 -0.1094 42ASP SC1 234 20.124 12.666 25.076 0.2357 0.1724 0.4046 43ASP BB 235 20.677 12.550 25.056 0.6614 -0.2333 -0.2961 43ASP SC1 236 20.928 12.719 25.168 0.1282 -0.4481 -0.3118 44ALA BB 237 20.697 12.486 24.763 0.1962 0.0518 0.0207 44ALA SC1 238 20.934 12.596 24.697 0.4294 -0.2332 0.3505 45GLU BB 239 20.767 12.224 24.605 0.0963 0.0695 0.0721 45GLU SC1 240 20.933 11.897 24.719 0.0558 0.1358 0.0690 46THR BB 241 20.863 12.261 24.289 -0.0205 -0.2159 0.1771 46THR SC1 242 21.115 12.416 24.361 -0.0243 0.0184 -0.2752 47GLY BB 243 20.806 12.115 24.035 0.1512 0.0969 0.2838 48LEU BB 244 20.778 11.805 23.929 0.0659 -0.0810 -0.2471 48LEU SC1 245 20.633 11.524 24.088 0.2938 0.1985 0.0182 49THR BB 246 21.054 11.581 23.900 -0.0853 -0.0579 0.3391 49THR SC1 247 20.968 11.330 23.750 -0.1201 0.2290 -0.1427 50ASP BB 248 21.328 11.627 23.765 0.2888 -0.0443 0.1299 50ASP SC1 249 21.469 11.368 23.599 0.0906 -0.1019 -0.0144 51GLY BB 250 21.526 11.868 23.962 0.0652 -0.0936 0.0910 52GLU BB 251 21.609 12.162 23.838 0.3525 -0.3012 0.0862 52GLU SC1 252 21.444 12.392 24.092 -0.0697 0.2702 -0.2394 53GLU BB 253 21.451 12.250 23.551 -0.1346 -0.3306 0.4576 53GLU SC1 254 21.079 12.413 23.733 -0.2139 -0.0299 -0.1408 54LYS BB 255 21.661 12.183 23.250 -0.2369 0.1815 -0.2480 54LYS SC1 256 21.400 12.096 23.088 0.2443 0.1122 0.0517 54LYS SC2 257 21.194 12.229 22.836 -0.4937 -0.1166 0.1944 55GLU BB 258 21.661 12.483 23.025 0.0303 0.0363 -0.3491 55GLU SC1 259 21.599 12.324 22.714 0.1353 -0.2701 0.0193 56GLU BB 260 21.864 12.685 23.115 -0.1546 -0.0775 -0.0417 56GLU SC1 261 21.910 12.676 23.488 0.1081 -0.3858 -0.2637 57PRO BB 262 22.138 12.790 22.921 -0.2826 0.2036 -0.0737 57PRO SC1 263 22.380 12.546 22.899 -0.1698 0.2759 -0.2517 58LYS BB 264 21.963 12.977 22.713 -0.0347 0.1384 0.0312 58LYS SC1 265 22.260 13.022 22.583 0.0932 -0.4316 0.3889 58LYS SC2 266 22.587 13.091 22.441 0.3745 0.2794 0.4116 59GLU BB 267 21.908 13.288 22.708 -0.1519 0.1048 -0.2160 59GLU SC1 268 21.926 13.291 22.287 0.3585 0.1598 -0.1369 60GLU BB 269 21.727 13.573 22.784 0.0531 0.1897 0.1365 60GLU SC1 270 21.986 13.834 22.722 0.1042 -0.1512 0.3485 61GLU BB 271 21.490 13.424 22.911 0.1319 -0.2207 0.0440 61GLU SC1 272 21.537 13.064 22.968 0.0663 -0.0611 0.1508 1LYS BB 273 4.675 10.965 14.126 0.0235 -0.2537 0.0532 1LYS SC1 274 4.354 11.049 14.172 -0.4964 0.0846 -0.2836 1LYS SC2 275 3.989 11.014 14.295 -0.2389 0.6222 0.0545 2LYS BB 276 4.752 10.676 13.946 -0.0325 -0.0459 -0.0239 2LYS SC1 277 4.486 10.537 13.881 0.1429 -0.1299 0.0592 2LYS SC2 278 4.263 10.308 13.960 0.1493 -0.0192 -0.1123 3CYS BB 279 5.008 10.536 13.700 -0.0125 -0.3329 0.1977 3CYS SC1 280 5.336 10.579 13.837 0.3249 0.0481 -0.2825 4LEU BB 281 5.041 10.784 13.507 0.1953 0.2122 0.3628 4LEU SC1 282 4.993 10.574 13.223 0.0267 -0.1602 0.2189 5PHE BB 283 5.333 10.924 13.633 -0.2830 0.1463 -0.0708 5PHE SC1 284 5.491 10.754 13.458 -0.1399 0.1287 0.0641 5PHE SC2 285 5.576 10.431 13.524 0.5008 0.3131 0.2019 5PHE SC3 286 5.345 10.466 13.352 0.1535 -0.2082 0.5394 6LYS BB 287 5.255 11.236 13.687 -0.1553 -0.0130 0.0636 6LYS SC1 288 5.342 11.378 13.942 -0.2567 0.0250 -0.0492 6LYS SC2 289 5.520 11.546 14.206 -0.2555 -0.0945 -0.2797 7LYS BB 290 5.425 11.456 13.481 0.3305 -0.1245 0.1016 7LYS SC1 291 5.163 11.644 13.517 0.2914 0.0668 0.2041 7LYS SC2 292 4.883 11.547 13.744 -0.0335 0.1579 0.0415 8LYS BB 293 5.656 11.394 13.292 -0.2734 -0.2733 -0.1141 8LYS SC1 294 5.760 11.610 13.116 0.1759 -0.3563 -0.0228 8LYS SC2 295 5.812 11.904 12.945 -0.2529 0.0583 -0.0502 9ASN BB 296 5.963 11.349 13.380 -0.1799 0.1346 0.1918 9ASN SC1 297 5.995 11.044 13.376 0.0737 -0.1976 -0.2060 10LYS BB 298 6.107 11.366 13.056 0.1321 -0.1361 0.2834 10LYS SC1 299 6.297 11.599 13.181 -0.4466 -0.3453 0.4383 10LYS SC2 300 6.581 11.668 13.405 -0.0957 -0.0567 0.1432 11LYS BB 301 5.882 11.113 12.911 0.2450 -0.1575 0.1217 11LYS SC1 302 5.616 11.068 13.049 -0.0821 -0.2394 0.0934 11LYS SC2 303 5.305 11.072 13.222 -0.3666 0.0076 -0.0153 12LYS BB 304 5.788 10.951 12.646 -0.3850 -0.1872 0.0852 12LYS SC1 305 5.498 11.060 12.589 -0.3199 0.1366 -0.4288 12LYS SC2 306 5.217 11.136 12.425 0.0464 0.0079 0.0172 13GLY BB 307 6.005 10.728 12.538 0.2126 -0.0310 -0.0130 14LYS BB 308 6.280 10.724 12.727 -0.0517 -0.0017 0.0954 14LYS SC1 309 6.425 10.457 12.631 -0.2402 -0.1951 -0.2394 14LYS SC2 310 6.694 10.210 12.640 -0.3650 0.3046 -0.4341 15GLU BB 311 6.273 10.852 13.058 0.0586 0.0592 0.1466 15GLU SC1 312 6.652 11.007 12.973 0.1126 -0.0845 -0.4411 16LYS BB 313 6.267 10.606 13.273 -0.1674 -0.1914 -0.1472 16LYS SC1 314 5.974 10.589 13.376 -0.0364 -0.0622 0.0601 16LYS SC2 315 5.927 10.270 13.239 -0.1502 0.3834 -0.2103 17GLY BB 316 6.506 10.397 13.306 -0.0515 0.0611 0.0205 18GLY BB 317 6.734 10.323 13.568 0.0696 -0.0180 0.1496 19LYS BB 318 7.052 10.351 13.447 -0.0762 0.0777 -0.2783 19LYS SC1 319 7.163 10.597 13.666 -0.3004 -0.1560 -0.2281 19LYS SC2 320 7.175 10.927 13.661 0.4071 -0.1909 -0.1721 20ASN BB 321 7.208 10.091 13.335 0.1319 0.1105 -0.1299 20ASN SC1 322 7.085 9.780 13.456 0.1044 -0.1633 -0.3800 21ALA BB 323 7.237 9.988 13.045 0.2041 0.2578 -0.2216 21ALA SC1 324 7.093 9.761 13.044 0.2474 0.2225 0.1469 22ILE BB 325 7.239 10.176 12.771 0.2271 0.2477 -0.0912 22ILE SC1 326 7.297 10.436 12.985 -0.2047 0.0864 0.2361 23ASN BB 327 7.552 10.164 12.625 -0.0556 -0.0954 0.0179 23ASN SC1 328 7.526 10.526 12.651 -0.1712 0.1086 0.3214 24MET BB 329 7.676 10.001 12.353 0.2758 0.1162 0.1331 24MET SC1 330 7.830 10.197 12.029 0.2562 -0.0057 -0.1124 25LYS BB 331 7.535 9.771 12.177 -0.0156 0.2741 -0.1495 25LYS SC1 332 7.467 9.667 11.893 0.2700 0.0084 0.0341 25LYS SC2 333 7.211 9.647 11.708 0.1255 -0.0772 0.1380 26ASP BB 334 7.757 9.462 12.232 -0.2443 -0.1519 0.1236 26ASP SC1 335 8.023 9.624 12.349 0.0225 -0.1419 -0.0844 27VAL BB 336 7.739 9.202 12.040 0.0918 -0.2420 -0.0403 27VAL SC1 337 7.798 9.322 11.781 0.0130 -0.1724 -0.0263 28LYS BB 338 7.849 8.887 12.124 -0.2808 0.1344 -0.0101 28LYS SC1 339 7.633 8.779 11.949 -0.0175 -0.1507 0.1756 28LYS SC2 340 7.318 8.904 11.770 0.0238 -0.0312 -0.2578 29ASP BB 341 7.714 8.782 12.429 0.1306 -0.0475 -0.1686 29ASP SC1 342 7.775 9.115 12.527 -0.2289 -0.1810 0.1907 30LEU BB 343 7.751 8.692 12.732 -0.3388 -0.0997 0.0259 30LEU SC1 344 7.932 8.404 12.668 0.0156 -0.3066 -0.0896 31GLY BB 345 7.938 8.922 12.910 0.2893 0.3355 -0.0677 32LYS BB 346 8.242 8.834 12.808 -0.0710 -0.0666 -0.2162 32LYS SC1 347 8.299 8.527 12.949 0.1339 -0.3941 0.1049 32LYS SC2 348 8.195 8.220 12.990 0.3990 0.1188 -0.8262 33THR BB 349 8.490 9.067 12.818 -0.0829 -0.4179 0.1934 33THR SC1 350 8.538 9.152 13.106 0.3335 0.0520 0.0001 34MET BB 351 8.742 9.039 12.578 0.1135 -0.1914 -0.0199 34MET SC1 352 8.718 8.661 12.600 -0.1734 0.2663 0.0252 35LYS BB 353 8.892 9.263 12.335 -0.1473 0.0621 -0.2322 35LYS SC1 354 8.611 9.386 12.324 -0.0348 -0.2233 0.0850 35LYS SC2 355 8.444 9.615 12.528 -0.0094 -0.4964 -0.1688 36ASP BB 356 9.040 9.525 12.420 -0.1952 0.0387 0.1325 36ASP SC1 357 8.860 9.639 12.639 0.3137 0.0125 0.0662 37GLN BB 358 9.354 9.522 12.447 0.3978 0.0394 0.2741 37GLN SC1 359 9.740 9.424 12.317 0.2826 0.1767 0.2337 38ALA BB 360 9.380 9.498 12.768 -0.1018 -0.0828 0.0847 38ALA SC1 361 9.489 9.261 12.835 0.1442 -0.0877 -0.3014 39LEU BB 362 9.688 9.670 12.857 -0.2050 -0.1905 0.2514 39LEU SC1 363 9.610 10.047 12.892 -0.2176 0.0939 -0.0963 40LYS BB 364 9.722 9.872 12.543 0.1076 -0.0049 0.4450 40LYS SC1 365 10.019 9.796 12.488 0.0197 -0.0266 0.2676 40LYS SC2 366 10.278 9.939 12.479 -0.2359 -0.2070 0.1217 41ASP BB 367 9.671 10.206 12.484 0.0849 0.3635 -0.0248 41ASP SC1 368 10.000 10.263 12.493 0.3894 -0.1023 0.1361 42ASP BB 369 9.577 10.311 12.222 -0.2176 0.0011 0.0925 42ASP SC1 370 9.372 10.594 12.299 0.0284 -0.1842 -0.0357 43ASP BB 371 9.398 10.250 11.954 0.0887 0.0723 -0.0983 43ASP SC1 372 9.086 10.093 11.975 0.1789 -0.0021 -0.0792 44ALA BB 373 9.447 10.365 11.652 -0.2489 0.1549 0.3411 44ALA SC1 374 9.397 10.620 11.724 -0.4759 0.3596 -0.4401 45GLU BB 375 9.336 10.171 11.390 0.1270 -0.0536 0.2964 45GLU SC1 376 9.619 9.983 11.186 0.1093 -0.1246 0.0030 46THR BB 377 9.226 9.921 11.560 -0.0476 -0.1178 -0.0928 46THR SC1 378 9.475 9.757 11.622 -0.0475 -0.0673 0.0429 47GLY BB 379 8.895 9.915 11.552 -0.1434 0.2586 -0.2580 48LEU BB 380 8.653 10.025 11.782 -0.2087 0.1105 0.0180 48LEU SC1 381 8.364 9.827 11.843 0.2261 -0.1407 0.1596 49THR BB 382 8.620 10.291 11.933 0.2907 -0.3386 0.0705 49THR SC1 383 8.588 10.395 12.218 0.4317 0.3688 -0.1512 50ASP BB 384 8.649 10.552 11.681 0.1832 0.2260 -0.0955 50ASP SC1 385 8.522 10.327 11.470 -0.0976 -0.1782 -0.4700 51GLY BB 386 8.341 10.737 11.767 -0.3494 0.0626 0.4521 52GLU BB 387 8.241 11.002 11.720 0.0017 0.0146 0.0088 52GLU SC1 388 8.396 11.106 11.383 -0.0045 -0.0553 -0.0720 53GLU BB 389 8.238 11.214 12.008 0.2606 0.0463 0.1287 53GLU SC1 390 7.896 11.167 12.214 -0.3394 -0.0050 0.0318 54LYS BB 391 8.518 11.284 12.113 0.1859 0.1243 0.0396 54LYS SC1 392 8.808 11.218 12.000 -0.0770 0.0818 -0.0936 54LYS SC2 393 9.049 11.422 11.839 -0.1404 0.2716 0.0088 55GLU BB 394 8.669 11.319 12.406 -0.0470 -0.0843 -0.0016 55GLU SC1 395 8.537 11.040 12.559 -0.0724 -0.0915 -0.2342 56GLU BB 396 8.729 11.554 12.604 -0.1620 -0.2779 -0.1058 56GLU SC1 397 8.619 11.796 12.360 0.0256 -0.0386 0.3183 57PRO BB 398 9.104 11.620 12.725 -0.4042 -0.1684 0.0719 57PRO SC1 399 9.218 11.319 12.619 0.3543 0.2304 0.0588 58LYS BB 400 8.963 11.666 13.048 0.1315 0.3746 -0.1421 58LYS SC1 401 9.169 11.526 13.258 -0.1488 -0.0682 0.3341 58LYS SC2 402 9.191 11.202 13.228 -0.1774 -0.0827 -0.0615 59GLU BB 403 8.773 11.859 13.162 -0.2731 0.1546 -0.1696 59GLU SC1 404 8.415 11.770 13.178 0.3277 0.1002 -0.0383 60GLU BB 405 8.914 12.148 13.368 0.1215 -0.0134 -0.2518 60GLU SC1 406 9.261 12.067 13.440 0.1391 -0.1007 0.0300 61GLU BB 407 8.780 12.354 13.158 -0.0869 0.1488 -0.1677 61GLU SC1 408 8.565 12.628 13.388 -0.0865 0.2079 -0.1587 1LYS BB 409 14.487 10.784 14.151 0.1341 0.0784 -0.1186 1LYS SC1 410 14.517 10.471 14.043 -0.0945 -0.0749 -0.0879 1LYS SC2 411 14.607 10.220 13.837 0.2684 0.0092 -0.0712 2LYS BB 412 14.542 10.765 14.500 -0.1273 0.0154 0.1005 2LYS SC1 413 14.693 11.059 14.479 -0.1018 -0.3346 -0.0457 2LYS SC2 414 14.736 11.369 14.655 0.2656 0.2045 0.2740 3CYS BB 415 14.559 10.550 14.762 0.3684 -0.0882 0.1311 3CYS SC1 416 14.414 10.699 14.980 0.2309 0.0751 0.1866 4LEU BB 417 14.232 10.436 14.749 -0.2715 0.1245 0.0163 4LEU SC1 418 14.279 10.270 14.412 0.2514 0.1348 0.3210 5PHE BB 419 14.065 10.217 14.896 0.1492 -0.2004 -0.0370 5PHE SC1 420 14.325 10.016 14.876 0.0508 0.1829 -0.4598 5PHE SC2 421 14.643 9.919 14.807 0.1922 0.4419 -0.1961 5PHE SC3 422 14.551 10.150 14.659 0.0281 0.2094 -0.4671 6LYS BB 423 14.208 10.268 15.241 -0.0967 -0.0378 -0.2236 6LYS SC1 424 14.558 10.328 15.129 0.1116 0.1872 -0.1191 6LYS SC2 425 14.945 10.374 15.178 0.4613 -0.0076 -0.0564 7LYS BB 426 14.187 10.433 15.524 0.2104 -0.2643 -0.0823 7LYS SC1 427 14.296 10.745 15.418 -0.0789 0.1259 -0.3652 7LYS SC2 428 14.252 11.076 15.405 -0.2332 0.3882 -0.0459 8LYS BB 429 13.926 10.358 15.673 -0.0942 0.3483 -0.1096 8LYS SC1 430 13.889 10.071 15.561 -0.0312 -0.0827 0.2712 8LYS SC2 431 13.687 9.794 15.421 0.0031 0.3437 0.0503 9ASN BB 432 13.584 10.447 15.556 -0.1109 0.1920 -0.4316 9ASN SC1 433 13.406 10.154 15.554 0.2802 -0.3895 0.1241 10LYS BB 434 13.468 10.721 15.736 0.0856 -0.0303 0.1895 10LYS SC1 435 13.362 10.912 15.523 0.0894 0.1211 -0.1658 10LYS SC2 436 13.108 10.915 15.277 -0.0285 -0.1071 0.0266 11LYS BB 437 13.655 10.777 16.004 0.3747 -0.0096 -0.2907 11LYS SC1 438 13.999 10.662 15.987 0.2505 -0.2274 -0.1044 11LYS SC2 439 14.247 10.770 16.177 0.5415 -0.0908 0.3819 12LYS BB 440 13.660 10.613 16.256 -0.2077 0.1767 -0.1265 12LYS SC1 441 13.602 10.790 16.527 0.2296 0.0376 -0.1878 12LYS SC2 442 13.305 10.887 16.620 0.1293 0.0885 -0.1387 13GLY BB 443 13.480 10.362 16.299 0.0729 0.2557 -0.0040 14LYS BB 444 13.213 10.405 16.510 -0.1215 0.0055 -0.1635 14LYS SC1 445 13.184 10.102 16.610 -0.1278 -0.0685 0.3248 14LYS SC2 446 13.281 9.748 16.554 -0.0315 -0.2164 0.1125 15GLU BB 447 12.904 10.512 16.501 0.1134 0.0809 -0.0791 15GLU SC1 448 12.921 10.706 16.830 0.0650 0.1518 0.0433 16LYS BB 449 12.806 10.523 16.209 0.1897 -0.4415 0.1668 16LYS SC1 450 12.583 10.776 16.334 0.0834 -0.2694 0.2616 16LYS SC2 451 12.427 10.973 16.520 0.1357 -0.0345 -0.1279 17GLY BB 452 12.635 10.381 15.980 0.3538 -0.1077 0.1065 18GLY BB 453 12.283 10.334 16.008 -0.0072 -0.1355 -0.2070 19LYS BB 454 12.153 10.414 15.772 0.1088 0.4005 -0.0411 19LYS SC1 455 12.338 10.200 15.582 0.0895 0.1302 0.2437 19LYS SC2 456 12.195 10.067 15.227 0.0937 -0.5408 0.0341 20ASN BB 457 11.907 10.585 15.869 0.2867 -0.3514 0.0633 20ASN SC1 458 11.705 10.636 15.574 -0.5867 -0.2225 0.0979 21ALA BB 459 11.884 10.867 15.969 -0.2106 0.0481 0.2086 21ALA SC1 460 12.005 11.013 15.779 -0.0208 -0.3587 0.0016 22ILE BB 461 11.599 11.026 15.969 -0.1419 -0.1396 0.0460 22ILE SC1 462 11.333 10.815 15.939 -0.0798 -0.2439 0.2183 23ASN BB 463 11.591 11.276 16.128 0.1645 0.0162 -0.0713 23ASN SC1 464 11.662 11.278 16.457 -0.1845 0.2172 -0.3058 24MET BB 465 11.291 11.411 16.207 -0.0994 -0.2884 0.1207 24MET SC1 466 11.013 11.240 16.003 0.1144 0.1622 -0.3187 25LYS BB 467 11.267 11.454 16.535 0.1522 0.1875 -0.0783 25LYS SC1 468 11.079 11.648 16.668 -0.0816 -0.2530 -0.2818 25LYS SC2 469 11.133 11.970 16.770 0.3155 0.4833 -0.0772 26ASP BB 470 11.242 11.246 16.805 -0.2648 0.2764 0.0994 26ASP SC1 471 11.291 11.483 17.026 0.0526 0.1114 -0.0164 27VAL BB 472 11.429 11.009 16.919 -0.0513 0.0064 -0.0218 27VAL SC1 473 11.269 10.787 16.818 -0.1160 0.0657 -0.0513 28LYS BB 474 11.586 10.929 17.164 -0.2689 0.0734 -0.1697 28LYS SC1 475 11.575 11.228 17.314 -0.2899 0.0243 0.3197 28LYS SC2 476 11.729 11.425 17.563 -0.1507 -0.3060 0.4837 29ASP BB 477 11.585 10.638 17.266 0.2160 0.0661 -0.2736 29ASP SC1 478 11.432 10.695 17.565 0.0617 0.0424 -0.3441 30LEU BB 479 11.752 10.412 17.125 -0.1882 0.1278 -0.1340 30LEU SC1 480 12.002 10.648 17.100 -0.3054 -0.3681 0.3751 31GLY BB 481 11.520 10.283 16.994 0.3011 0.4518 -0.0093 32LYS BB 482 11.462 10.150 16.683 -0.0865 -0.1277 0.2634 32LYS SC1 483 11.672 10.259 16.436 -0.2031 -0.0512 -0.0307 32LYS SC2 484 11.602 10.563 16.231 0.0266 0.1783 0.1403 33THR BB 485 11.209 10.346 16.716 0.0589 -0.3526 -0.3605 33THR SC1 486 11.081 10.200 16.951 0.1752 -0.0712 -0.1166 34MET BB 487 10.992 10.519 16.579 -0.0533 -0.1709 0.4647 34MET SC1 488 11.158 10.429 16.228 0.0350 0.2320 0.0505 35LYS BB 489 10.785 10.683 16.733 0.1330 -0.0304 0.1048 35LYS SC1 490 10.656 10.716 16.457 -0.1085 -0.0301 -0.0803 35LYS SC2 491 10.390 10.647 16.229 -0.1083 0.1456 -0.0337 36ASP BB 492 10.832 11.000 16.856 0.1394 -0.0913 -0.0515 36ASP SC1 493 10.869 11.162 16.505 -0.0939 -0.0870 0.0375 37GLN BB 494 10.793 11.074 17.131 -0.2441 0.1957 0.0619 37GLN SC1 495 11.107 11.131 17.269 0.1575 0.1195 0.1022 38ALA BB 496 10.636 11.191 17.411 0.2045 0.0741 -0.0144 38ALA SC1 497 10.780 11.390 17.522 0.2439 0.0982 -0.1081 39LEU BB 498 10.335 11.019 17.385 0.1566 -0.2135 -0.2773 39LEU SC1 499 10.334 10.836 17.667 -0.1037 -0.2759 -0.0871 40LYS BB 500 9.989 11.105 17.317 0.2824 -0.1960 -0.1491 40LYS SC1 501 9.978 10.820 17.174 -0.4568 0.2262 -0.0708 40LYS SC2 502 10.202 10.586 17.156 0.2871 0.0349 -0.0076 41ASP BB 503 9.953 11.385 17.227 0.2480 0.0146 -0.0560 41ASP SC1 504 10.303 11.446 17.174 -0.0516 0.0814 -0.1677 42ASP BB 505 9.742 11.562 17.090 0.4026 0.0565 -0.2051 42ASP SC1 506 9.697 11.690 17.412 -0.2604 -0.1785 -0.1067 43ASP BB 507 9.617 11.347 16.855 0.0109 0.1053 0.2818 43ASP SC1 508 9.869 11.128 16.845 0.3449 0.1028 0.2240 44ALA BB 509 9.304 11.343 16.808 0.0860 0.2456 0.1154 44ALA SC1 510 9.368 11.593 16.727 -0.3763 0.3360 -0.0022 45GLU BB 511 9.097 11.071 17.010 0.0018 0.0265 -0.1854 45GLU SC1 512 9.046 11.245 17.361 -0.0660 0.0386 0.0576 46THR BB 513 8.845 11.101 16.814 0.0179 -0.3191 -0.0846 46THR SC1 514 9.016 11.120 16.562 0.0947 -0.1364 -0.0210 47GLY BB 515 8.742 11.352 17.042 -0.0140 -0.1427 -0.0083 48LEU BB 516 8.664 11.619 16.887 -0.0431 0.0546 0.0634 48LEU SC1 517 8.943 11.566 16.708 -0.0294 0.2670 0.0144 49THR BB 518 8.429 11.707 16.720 0.3666 -0.0944 -0.2391 49THR SC1 519 8.361 12.003 16.699 0.1911 -0.1289 -0.1756 50ASP BB 520 8.316 11.488 16.466 -0.0997 0.0425 0.2536 50ASP SC1 521 8.310 11.753 16.233 0.0070 0.0568 -0.0447 51GLY BB 522 8.608 11.295 16.466 0.3144 0.1319 0.0017 52GLU BB 523 8.551 10.949 16.440 -0.0591 0.4635 0.3010 52GLU SC1 524 8.157 10.933 16.454 0.0880 0.3551 -0.0276 53GLU BB 525 8.771 10.695 16.553 0.0253 0.1687 -0.0565 53GLU SC1 526 8.801 10.592 16.951 -0.1666 0.0967 -0.1942 54LYS BB 527 9.081 10.617 16.417 0.0683 0.0122 -0.0783 54LYS SC1 528 9.120 10.360 16.592 0.0546 -0.1018 0.0271 54LYS SC2 529 8.818 10.225 16.617 -0.0223 -0.1178 -0.1323 55GLU BB 530 9.264 10.735 16.146 -0.1997 -0.1842 -0.2061 55GLU SC1 531 9.479 10.356 16.139 0.0464 0.0535 -0.1843 56GLU BB 532 9.093 10.686 15.863 -0.3083 0.0678 0.1563 56GLU SC1 533 8.724 10.671 15.985 -0.1993 -0.0436 -0.0917 57PRO BB 534 9.148 10.919 15.645 -0.2493 -0.3298 0.0575 57PRO SC1 535 8.874 10.972 15.533 0.0358 0.0405 0.0144 58LYS BB 536 9.346 11.174 15.757 0.0714 0.4856 -0.0581 58LYS SC1 537 9.181 11.216 16.019 0.1682 0.3160 -0.3254 58LYS SC2 538 8.918 11.025 16.130 0.0303 0.2831 -0.0400 59GLU BB 539 9.432 11.480 15.705 0.0773 0.2059 -0.2366 59GLU SC1 540 9.123 11.664 15.795 0.1128 -0.0185 0.2310 60GLU BB 541 9.633 11.618 15.446 -0.0685 0.2071 -0.3447 60GLU SC1 542 9.540 11.576 15.116 -0.0641 0.2175 0.2964 61GLU BB 543 9.882 11.843 15.410 0.3652 0.2149 -0.1781 61GLU SC1 544 9.719 12.132 15.232 -0.1173 -0.0625 -0.0667 1LYS BB 545 22.698 17.217 23.601 -0.0020 0.1564 -0.2779 1LYS SC1 546 22.872 17.029 23.718 -0.2807 0.0293 -0.0761 1LYS SC2 547 23.046 17.022 24.051 0.0350 0.4076 0.3415 2LYS BB 548 22.607 17.050 23.304 -0.2473 0.1095 0.0831 2LYS SC1 549 22.691 16.752 23.194 0.0327 0.0303 0.5291 2LYS SC2 550 22.720 16.626 22.828 0.0139 0.2574 -0.0360 3CYS BB 551 22.286 16.910 23.337 -0.2801 -0.1649 -0.1651 3CYS SC1 552 22.095 17.031 23.091 -0.2940 0.3276 0.0379 4LEU BB 553 22.085 16.987 23.517 0.2757 -0.2046 -0.1630 4LEU SC1 554 21.831 17.140 23.356 -0.1281 0.1297 0.5674 5PHE BB 555 22.170 16.979 23.869 0.2630 -0.2348 0.0256 5PHE SC1 556 22.234 17.249 24.045 -0.0413 -0.0985 -0.0903 5PHE SC2 557 22.103 17.479 24.258 -0.2838 -0.0877 -0.2466 5PHE SC3 558 22.270 17.277 24.382 -0.3700 -0.0443 -0.0564 6LYS BB 559 21.898 16.839 24.035 0.2676 0.1075 0.4332 6LYS SC1 560 21.747 16.607 23.906 -0.1684 0.3799 0.0848 6LYS SC2 561 21.575 16.392 23.673 -0.1758 -0.0494 0.0308 7LYS BB 562 21.965 16.750 24.319 -0.0472 -0.0370 -0.0641 7LYS SC1 563 21.710 16.772 24.486 -0.1207 0.0646 -0.0723 7LYS SC2 564 21.403 16.625 24.557 -0.1674 0.4242 -0.0564 8LYS BB 565 22.308 16.623 24.369 -0.0824 -0.2357 0.0739 8LYS SC1 566 22.366 16.870 24.500 -0.1419 0.2273 -0.1860 8LYS SC2 567 22.405 17.070 24.818 -0.2654 -0.2175 0.1321 9ASN BB 568 22.375 16.319 24.387 -0.0354 0.0856 -0.1389 9ASN SC1 569 22.278 16.196 24.711 0.1982 -0.1394 -0.0123 10LYS BB 570 22.622 16.250 24.138 -0.2239 0.0638 -0.1076 10LYS SC1 571 22.944 16.205 24.193 0.2066 -0.3514 0.0511 10LYS SC2 572 23.320 16.235 24.348 0.3253 0.3578 0.4749 11LYS BB 573 22.684 16.194 23.830 0.0304 0.3554 0.0550 11LYS SC1 574 22.894 16.209 23.601 0.4460 -0.1458 0.1464 11LYS SC2 575 23.187 16.229 23.407 0.6907 0.2785 -0.1023 12LYS BB 576 22.385 16.124 23.708 -0.0421 -0.2804 -0.0002 12LYS SC1 577 22.229 16.058 23.997 0.0220 -0.0299 -0.1554 12LYS SC2 578 22.029 16.322 24.078 0.1599 0.0679 -0.0876 13GLY BB 579 22.259 15.829 23.581 0.1518 -0.0991 0.1354 14LYS BB 580 22.361 15.637 23.330 0.1459 -0.1589 -0.0278 14LYS SC1 581 22.306 15.372 23.475 -0.3287 -0.0166 -0.1867 14LYS SC2 582 22.088 15.261 23.696 -0.3341 -0.0164 0.0371 15GLU BB 583 22.312 15.752 23.050 -0.5030 0.2114 0.1032 15GLU SC1 584 21.944 15.731 23.014 -0.1111 -0.2426 0.1198 16LYS BB 585 22.445 15.698 22.726 0.1350 -0.0268 -0.2069 16LYS SC1 586 22.676 15.721 22.820 -0.2764 0.0745 0.2138 16LYS SC2 587 23.037 15.828 22.834 0.0249 -0.0168 0.1457 17GLY BB 588 22.362 15.630 22.396 0.2095 0.2871 -0.1647 18GLY BB 589 22.520 15.480 22.154 -0.2996 -0.2957 0.1290 19LYS BB 590 22.463 15.142 22.161 -0.2736 -0.1110 -0.2665 19LYS SC1 591 22.279 15.138 22.457 -0.0518 -0.1732 0.0222 19LYS SC2 592 22.122 15.390 22.687 0.2899 -0.0694 -0.3395 20ASN BB 593 22.409 15.056 21.812 -0.0369 0.2102 0.0724 20ASN SC1 594 22.200 15.330 21.780 0.0642 -0.0866 -0.1873 21ALA BB 595 22.711 14.878 21.751 0.1787 0.5914 0.0738 21ALA SC1 596 22.802 14.959 21.510 0.3726 -0.3545 -0.2152 22ILE BB 597 22.650 14.580 21.599 -0.0493 -0.0251 0.1222 22ILE SC1 598 22.854 14.578 21.326 -0.1149 0.1716 0.0695 23ASN BB 599 22.631 14.356 21.812 -0.2682 0.4222 0.1207 23ASN SC1 600 22.391 14.107 21.731 -0.4668 0.0416 0.0341 24MET BB 601 22.790 14.319 22.114 -0.1365 0.2808 -0.0223 24MET SC1 602 22.767 13.924 22.054 0.0548 0.0501 0.0866 25LYS BB 603 22.935 14.573 22.242 0.0589 0.1449 -0.3300 25LYS SC1 604 22.888 14.427 22.547 -0.0121 -0.0985 -0.3952 25LYS SC2 605 22.813 14.164 22.636 0.2890 -0.0381 0.0580 26ASP BB 606 22.946 14.897 22.156 -0.3569 -0.2504 0.1325 26ASP SC1 607 23.057 15.018 22.450 0.1598 0.0670 -0.1401 27VAL BB 608 23.180 15.138 22.061 -0.1115 -0.0326 0.4126 27VAL SC1 609 23.388 14.949 21.980 -0.2324 -0.0376 0.0978 28LYS BB 610 23.241 15.487 22.158 0.1646 -0.2083 -0.2950 28LYS SC1 611 23.462 15.658 22.032 0.0332 0.1209 -0.1012 28LYS SC2 612 23.775 15.707 21.840 -0.2553 -0.1456 0.2554 29ASP BB 613 23.053 15.609 21.937 -0.2654 0.1077 -0.0864 29ASP SC1 614 22.842 15.347 21.859 -0.2535 0.1327 -0.0770 30LEU BB 615 23.111 15.918 21.874 -0.1244 -0.1801 0.1314 30LEU SC1 616 22.900 16.069 22.078 -0.0606 -0.1759 0.1270 31GLY BB 617 22.972 15.951 21.609 -0.2657 -0.0069 0.0430 32LYS BB 618 23.157 16.061 21.409 -0.4357 -0.1937 -0.0122 32LYS SC1 619 23.257 15.872 21.148 0.0798 -0.2529 -0.0519 32LYS SC2 620 22.996 15.970 20.956 0.2795 -0.1776 0.0425 33THR BB 621 23.505 16.119 21.502 -0.0410 -0.2235 -0.1455 33THR SC1 622 23.519 16.368 21.328 0.0073 -0.0239 0.1361 34MET BB 623 23.582 16.258 21.752 -0.1230 0.1899 -0.1522 34MET SC1 624 23.923 16.427 21.822 0.0151 -0.1597 0.1787 35LYS BB 625 23.533 16.129 22.055 0.0754 -0.1775 0.0990 35LYS SC1 626 23.273 16.305 22.170 0.0719 0.2038 0.1573 35LYS SC2 627 23.094 16.570 22.279 0.2214 -0.1366 -0.2903 36ASP BB 628 23.617 15.955 22.315 -0.2284 -0.0958 0.1570 36ASP SC1 629 23.273 15.907 22.408 -0.0819 0.2942 -0.1141 37GLN BB 630 23.883 16.077 22.448 0.1976 0.0246 -0.1062 37GLN SC1 631 23.996 15.772 22.647 0.0074 -0.0041 0.0286 38ALA BB 632 23.954 16.260 22.694 0.0799 0.1969 0.1127 38ALA SC1 633 24.194 16.264 22.818 0.0410 -0.1831 0.2150 39LEU BB 634 23.712 16.354 22.923 -0.0488 -0.0352 0.2108 39LEU SC1 635 23.453 16.171 23.089 0.1858 -0.2244 0.3595 40LYS BB 636 23.595 16.631 23.047 0.2985 0.2249 -0.0759 40LYS SC1 637 23.820 16.845 22.954 -0.2935 -0.3174 -0.0667 40LYS SC2 638 23.915 17.141 22.740 -0.2812 0.0880 0.2758 41ASP BB 639 23.346 16.720 23.272 0.2894 -0.0423 0.1092 41ASP SC1 640 23.358 16.579 23.577 -0.0261 0.1394 -0.1129 42ASP BB 641 23.108 16.951 23.183 -0.1379 0.2572 0.0590 42ASP SC1 642 23.130 17.204 23.391 0.1921 0.1239 -0.1782 43ASP BB 643 23.008 16.991 22.847 0.0365 -0.0354 -0.0915 43ASP SC1 644 23.191 16.722 22.709 -0.0288 0.0946 -0.1674 44ALA BB 645 22.934 17.260 22.636 -0.0196 0.0447 0.0140 44ALA SC1 646 23.129 17.404 22.755 0.4849 -0.0552 -0.6343 45GLU BB 647 23.010 17.255 22.335 -0.0358 0.5195 0.0169 45GLU SC1 648 23.286 17.542 22.241 0.1392 0.1183 -0.1266 46THR BB 649 23.226 17.008 22.239 -0.3549 -0.1091 -0.1144 46THR SC1 650 23.512 16.990 22.343 -0.4136 -0.1263 0.0481 47GLY BB 651 23.226 16.884 21.945 0.0767 0.5123 0.0283 48LEU BB 652 23.241 16.914 21.655 0.1169 -0.1959 -0.5328 48LEU SC1 653 23.524 16.678 21.659 0.2057 0.2597 0.1684 49THR BB 654 22.961 17.084 21.492 -0.1048 -0.1818 0.0996 49THR SC1 655 22.784 16.837 21.508 0.0603 -0.3154 -0.0884 50ASP BB 656 22.853 17.336 21.316 0.0069 -0.2225 -0.1748 50ASP SC1 657 22.745 17.603 21.495 -0.0174 -0.2278 -0.0027 51GLY BB 658 22.756 17.201 21.048 0.2503 -0.2956 -0.0524 52GLU BB 659 22.818 17.104 20.775 -0.0142 0.0213 -0.1239 52GLU SC1 660 22.621 16.790 20.715 -0.1240 -0.0211 -0.1214 53GLU BB 661 23.088 16.967 20.621 -0.1559 0.0108 -0.0042 53GLU SC1 662 23.194 17.289 20.461 -0.0439 0.0391 0.1496 54LYS BB 663 23.167 16.679 20.802 0.0482 -0.1004 0.6574 54LYS SC1 664 23.480 16.655 20.746 -0.2630 -0.0564 0.0858 54LYS SC2 665 23.811 16.639 20.867 -0.0975 -0.0953 0.2235 55GLU BB 666 22.908 16.437 20.829 -0.0657 0.3783 -0.1191 55GLU SC1 667 23.057 16.191 20.574 -0.0969 0.0768 -0.1745 56GLU BB 668 22.777 16.365 21.121 0.0122 0.2522 -0.3126 56GLU SC1 669 23.063 16.542 21.298 -0.2485 0.1531 -0.1526 57PRO BB 670 22.585 16.486 21.306 -0.3338 0.2103 0.0840 57PRO SC1 671 22.710 16.306 21.562 -0.0768 -0.2932 -0.6310 58LYS BB 672 22.318 16.354 21.241 0.1735 0.1954 -0.2880 58LYS SC1 673 22.352 16.475 20.944 0.0274 0.0606 -0.1688 58LYS SC2 674 22.143 16.728 20.828 -0.1268 -0.0820 -0.0993 59GLU BB 675 22.080 16.548 21.385 0.4822 -0.2738 -0.1732 59GLU SC1 676 22.354 16.678 21.650 0.0395 -0.1033 0.0448 60GLU BB 677 21.805 16.438 21.444 -0.2263 0.1837 0.0661 60GLU SC1 678 21.833 16.110 21.283 0.0749 0.2378 -0.2268 61GLU BB 679 21.626 16.710 21.480 0.2396 0.1463 0.1399 61GLU SC1 680 21.455 16.893 21.792 -0.0039 -0.0645 0.0954 1LYS BB 681 15.216 14.590 12.781 0.1285 -0.0993 -0.2468 1LYS SC1 682 15.224 14.780 12.517 0.2525 0.1962 -0.0645 1LYS SC2 683 15.234 14.979 12.248 0.2709 0.0663 -0.1424 2LYS BB 684 15.221 14.281 12.608 -0.0582 0.0292 0.0243 2LYS SC1 685 14.934 14.141 12.664 0.1014 0.3240 0.0498 2LYS SC2 686 14.889 13.798 12.821 0.0781 -0.2783 0.3706 3CYS BB 687 15.536 14.233 12.575 0.0035 -0.1105 -0.0101 3CYS SC1 688 15.587 14.031 12.299 0.4538 -0.0960 0.1274 4LEU BB 689 15.556 14.525 12.357 0.4310 0.1636 0.3236 4LEU SC1 690 15.387 14.323 12.129 0.1009 -0.0067 -0.1805 5PHE BB 691 15.885 14.672 12.308 -0.1960 0.3517 0.0211 5PHE SC1 692 15.762 14.766 12.008 0.1962 0.0872 0.0779 5PHE SC2 693 15.578 14.964 11.802 0.0939 -0.0923 -0.0057 5PHE SC3 694 15.579 15.042 12.081 -0.0148 -0.0231 -0.0242 6LYS BB 695 16.194 14.611 12.475 0.4281 0.2257 -0.0910 6LYS SC1 696 16.262 14.934 12.421 -0.2471 0.2355 -0.0274 6LYS SC2 697 16.534 15.185 12.395 0.1418 0.0118 -0.0792 7LYS BB 698 16.409 14.360 12.518 -0.0458 0.5378 -0.2135 7LYS SC1 699 16.469 14.222 12.209 0.0486 0.2807 -0.6032 7LYS SC2 700 16.658 14.456 12.061 -0.1751 0.2121 -0.1349 8LYS BB 701 16.272 14.229 12.835 -0.0147 -0.1974 -0.1205 8LYS SC1 702 16.207 14.470 12.969 -0.3418 0.2032 0.4586 8LYS SC2 703 16.082 14.703 13.185 0.0976 -0.2496 0.1290 9ASN BB 704 16.527 14.046 12.943 -0.3094 0.1711 -0.2553 9ASN SC1 705 16.643 14.267 13.200 -0.0290 -0.0474 0.0888 10LYS BB 706 16.661 13.972 12.692 0.0455 0.1349 0.1364 10LYS SC1 707 16.974 13.829 12.596 0.5023 0.2412 0.3257 10LYS SC2 708 17.230 14.052 12.722 0.0760 0.3024 -0.2520 11LYS BB 709 16.553 13.686 12.492 0.0397 0.2516 0.2738 11LYS SC1 710 16.411 13.516 12.690 0.0026 -0.0382 -0.1103 11LYS SC2 711 16.122 13.724 12.793 -0.2483 -0.0488 -0.2158 12LYS BB 712 16.518 13.544 12.191 -0.1748 0.0006 0.0259 12LYS SC1 713 16.764 13.296 12.175 0.0627 -0.4693 0.1166 12LYS SC2 714 17.044 13.070 12.146 0.3149 -0.2508 -0.1127 13GLY BB 715 16.280 13.385 11.992 0.1341 -0.1027 0.3233 14LYS BB 716 16.459 13.163 11.822 -0.0714 0.1492 0.2948 14LYS SC1 717 16.358 13.151 11.514 0.0489 0.0122 -0.0453 14LYS SC2 718 16.575 12.886 11.355 0.3072 -0.0951 -0.1054 15GLU BB 719 16.640 12.902 11.966 0.0127 0.1130 0.0837 15GLU SC1 720 16.889 12.803 11.675 -0.1545 -0.0004 -0.0806 16LYS BB 721 16.376 12.776 12.118 0.1243 -0.2099 0.1062 16LYS SC1 722 16.465 12.751 12.415 0.0928 0.0519 0.1083 16LYS SC2 723 16.219 12.792 12.691 0.0152 0.0087 -0.0042 17GLY BB 724 16.061 12.872 12.210 0.1492 0.0994 -0.3799 18GLY BB 725 15.863 12.934 11.952 0.1781 -0.3075 -0.1342 19LYS BB 726 15.960 13.159 11.736 -0.1581 -0.3305 -0.1439 19LYS SC1 727 15.660 13.274 11.811 -0.2305 -0.3562 -0.0681 19LYS SC2 728 15.317 13.389 11.807 0.3547 0.0326 -0.0426 20ASN BB 729 15.861 13.203 11.450 -0.2208 0.1416 0.1688 20ASN SC1 730 16.024 13.480 11.373 0.1527 -0.0547 -0.1651 21ALA BB 731 15.633 13.280 11.280 -0.0753 0.0189 -0.1370 21ALA SC1 732 15.465 13.211 11.480 -0.1629 0.6910 0.0442 22ILE BB 733 15.583 13.494 11.048 -0.2444 0.2173 -0.2124 22ILE SC1 734 15.906 13.554 10.957 -0.1051 -0.1346 0.0291 23ASN BB 735 15.532 13.454 10.744 0.0185 -0.2660 0.0549 23ASN SC1 736 15.339 13.254 10.627 0.3579 -0.3759 -0.1155 24MET BB 737 15.735 13.396 10.490 -0.1692 0.0582 0.0481 24MET SC1 738 15.985 13.645 10.551 0.0662 0.1375 0.5019 25LYS BB 739 15.729 13.231 10.177 -0.2497 -0.2614 0.2783 25LYS SC1 740 16.070 13.361 10.134 0.2101 0.2877 0.0228 25LYS SC2 741 16.167 13.429 9.827 0.2825 -0.2529 0.0850 26ASP BB 742 15.639 12.953 10.041 0.0889 -0.0790 0.0747 26ASP SC1 743 15.846 12.696 10.139 0.0834 -0.6039 -0.1346 27VAL BB 744 15.262 12.884 10.047 0.0180 0.1609 0.1704 27VAL SC1 745 15.241 12.606 9.959 0.0645 0.1400 0.2243 28LYS BB 746 15.176 12.950 10.337 0.1338 -0.2020 -0.2486 28LYS SC1 747 15.430 12.802 10.423 -0.3557 0.1416 -0.2226 28LYS SC2 748 15.629 12.949 10.619 -0.0125 0.1767 0.0131 29ASP BB 749 14.886 12.995 10.509 -0.0899 -0.3072 -0.0306 29ASP SC1 750 14.792 12.727 10.621 0.2395 -0.2465 0.0289 30LEU BB 751 14.947 13.121 10.850 0.0176 0.3047 -0.1252 30LEU SC1 752 14.687 13.348 10.771 -0.1777 0.0816 0.1879 31GLY BB 753 15.167 13.337 11.011 -0.0962 0.2021 0.1084 32LYS BB 754 15.171 13.453 11.354 0.1376 0.2821 -0.1796 32LYS SC1 755 14.915 13.622 11.348 -0.4684 -0.0738 0.1836 32LYS SC2 756 14.573 13.730 11.407 0.0842 -0.0755 0.4101 33THR BB 757 15.378 13.712 11.498 -0.0067 0.1018 -0.0728 33THR SC1 758 15.657 13.619 11.579 -0.0102 0.2274 0.0906 34MET BB 759 15.250 13.850 11.726 -0.1112 -0.0067 0.3009 34MET SC1 760 15.375 14.187 11.547 0.1238 0.2661 0.2664 35LYS BB 761 14.953 13.954 11.808 0.0778 -0.2254 -0.2981 35LYS SC1 762 14.973 14.283 11.850 -0.0818 -0.0075 -0.0813 35LYS SC2 763 15.011 14.434 11.547 0.2286 0.3660 0.1902 36ASP BB 764 14.829 13.664 11.868 -0.1014 0.2039 -0.2389 36ASP SC1 765 15.043 13.529 12.069 -0.4770 0.1486 0.1567 37GLN BB 766 14.743 13.424 11.731 -0.1315 0.2695 0.0001 37GLN SC1 767 14.321 13.430 11.600 -0.1244 -0.1033 -0.2343 38ALA BB 768 14.877 13.178 11.587 0.0214 0.0429 -0.1528 38ALA SC1 769 15.099 13.028 11.614 0.0925 0.1830 0.0721 39LEU BB 770 14.738 12.895 11.517 0.0914 0.1367 -0.2112 39LEU SC1 771 14.940 12.707 11.763 0.1057 0.0522 0.3535 40LYS BB 772 14.402 12.888 11.518 -0.4304 -0.1965 -0.0948 40LYS SC1 773 14.420 12.871 11.217 0.0531 -0.0910 -0.0674 40LYS SC2 774 14.501 12.965 10.859 -0.1552 -0.1141 -0.4248 41ASP BB 775 14.148 12.824 11.694 -0.0753 -0.0212 -0.4669 41ASP SC1 776 13.906 12.565 11.640 0.5855 0.4510 0.0554 42ASP BB 777 14.162 12.947 11.942 0.1207 -0.0537 -0.1023 42ASP SC1 778 14.474 13.069 11.969 -0.2578 0.0914 0.1277 43ASP BB 779 14.211 12.845 12.279 0.1097 -0.2714 -0.1840 43ASP SC1 780 14.112 12.525 12.228 -0.0306 0.3132 -0.2864 44ALA BB 781 14.252 13.053 12.546 -0.1584 -0.3171 0.1736 44ALA SC1 782 14.234 13.293 12.423 0.0231 -0.1755 0.4166 45GLU BB 783 14.500 13.008 12.709 -0.1203 -0.0025 0.1479 45GLU SC1 784 14.321 13.012 13.046 0.2807 -0.0576 0.1180 46THR BB 785 14.763 12.919 12.572 0.0672 -0.0231 0.1341 46THR SC1 786 14.648 12.849 12.298 0.0301 -0.1171 0.1731 47GLY BB 787 15.090 13.070 12.517 0.2272 0.0075 0.1881 48LEU BB 788 15.302 12.822 12.431 0.1315 -0.0463 -0.1840 48LEU SC1 789 15.509 12.611 12.187 -0.1011 0.1723 0.1677 49THR BB 790 15.275 12.532 12.597 -0.2670 0.1139 0.1747 49THR SC1 791 15.503 12.541 12.799 0.1299 -0.1145 -0.2437 50ASP BB 792 15.032 12.512 12.771 -0.1925 0.2679 0.1647 50ASP SC1 793 14.813 12.483 12.520 0.4860 0.3638 -0.2239 51GLY BB 794 14.873 12.188 12.877 0.2105 0.0920 0.0429 52GLU BB 795 14.871 12.153 13.193 -0.1691 0.0994 -0.1464 52GLU SC1 796 14.515 12.118 13.223 -0.4240 -0.0493 -0.0105 53GLU BB 797 14.990 11.891 13.324 0.0395 0.0116 -0.1065 53GLU SC1 798 15.206 12.103 13.561 0.0620 0.4555 0.0685 54LYS BB 799 14.819 11.645 13.456 0.0574 0.0883 0.0116 54LYS SC1 800 14.996 11.421 13.372 0.4257 0.2459 0.0310 54LYS SC2 801 14.862 11.281 13.031 0.1855 0.0542 0.0248 55GLU BB 802 14.486 11.647 13.541 0.0846 0.2636 0.1404 55GLU SC1 803 14.366 11.415 13.269 0.1361 0.0699 0.0315 56GLU BB 804 14.419 11.700 13.814 0.0294 0.0317 0.0701 56GLU SC1 805 14.410 11.318 13.894 -0.0205 -0.0643 -0.1697 57PRO BB 806 14.431 11.977 13.946 0.1096 0.0608 0.1118 57PRO SC1 807 14.714 12.033 14.096 -0.1051 -0.1194 -0.1446 58LYS BB 808 14.346 12.286 13.997 -0.1555 -0.1838 0.2008 58LYS SC1 809 14.487 12.450 13.758 -0.0296 -0.4672 0.1576 58LYS SC2 810 14.367 12.718 13.507 -0.1750 0.5524 -0.1171 59GLU BB 811 14.068 12.370 14.092 -0.0453 0.0140 -0.0352 59GLU SC1 812 14.009 12.692 13.862 -0.2588 -0.1151 0.1429 60GLU BB 813 13.952 12.111 14.202 -0.0308 -0.2557 -0.2949 60GLU SC1 814 13.923 11.911 13.848 -0.0785 0.2191 -0.2901 61GLU BB 815 13.923 12.224 14.508 -0.0854 0.0366 0.0752 61GLU SC1 816 13.862 11.869 14.661 -0.0143 0.3030 0.1133 1LYS BB 817 15.931 11.855 9.723 -0.1359 0.0994 0.3438 1LYS SC1 818 15.941 12.073 9.910 -0.1376 0.0800 -0.0015 1LYS SC2 819 15.944 12.190 10.202 0.0606 -0.2571 -0.1925 2LYS BB 820 15.626 11.841 9.621 -0.1012 0.0043 -0.0846 2LYS SC1 821 15.389 11.850 9.833 -0.0452 -0.0277 -0.1553 2LYS SC2 822 15.200 11.679 10.089 -0.1661 -0.2328 0.2413 3CYS BB 823 15.581 12.096 9.428 -0.0724 -0.1822 -0.1752 3CYS SC1 824 15.853 12.197 9.568 0.2697 -0.2692 0.0778 4LEU BB 825 15.513 12.134 9.146 0.1292 0.1368 0.0020 4LEU SC1 826 15.622 11.785 9.055 0.3650 0.1189 -0.0712 5PHE BB 827 15.457 12.328 8.902 -0.0558 -0.0310 -0.0751 5PHE SC1 828 15.236 12.543 9.042 -0.0823 0.1822 -0.0184 5PHE SC2 829 14.932 12.474 8.907 -0.0520 0.0550 -0.0226 5PHE SC3 830 15.068 12.703 8.793 -0.0095 -0.0739 -0.2370 6LYS BB 831 15.465 12.337 8.549 0.0823 -0.0297 0.3770 6LYS SC1 832 15.125 12.397 8.597 -0.4615 -0.0357 0.0875 6LYS SC2 833 14.879 12.163 8.622 0.0235 0.0042 0.0791 7LYS BB 834 15.635 12.544 8.368 -0.2048 -0.0254 0.1568 7LYS SC1 835 15.416 12.779 8.413 0.0364 -0.0027 0.3790 7LYS SC2 836 15.512 13.119 8.357 0.0973 -0.4107 -0.3205 8LYS BB 837 15.874 12.776 8.447 -0.0134 -0.1584 0.0561 8LYS SC1 838 15.919 12.853 8.165 0.0425 -0.0082 0.2443 8LYS SC2 839 15.984 12.747 7.839 0.0321 0.0927 -0.1889 9ASN BB 840 16.030 12.897 8.679 0.2163 0.2004 -0.1611 9ASN SC1 841 16.302 12.670 8.654 0.2599 -0.1566 0.0468 10LYS BB 842 15.976 12.953 9.037 -0.2768 0.1395 0.0074 10LYS SC1 843 16.229 12.853 9.190 -0.2228 -0.1251 0.0130 10LYS SC2 844 16.233 12.783 9.506 -0.2825 0.0354 0.0609 11LYS BB 845 15.812 13.194 9.112 -0.2106 -0.2462 0.2738 11LYS SC1 846 15.550 13.063 9.228 -0.1109 0.0076 -0.2611 11LYS SC2 847 15.277 12.902 9.261 -0.1653 0.1667 0.1577 12LYS BB 848 15.843 13.498 8.963 -0.0745 -0.1367 0.1870 12LYS SC1 849 15.578 13.604 8.931 0.0943 -0.5094 0.1193 12LYS SC2 850 15.574 13.852 9.185 0.4527 0.1340 -0.3264 13GLY BB 851 15.941 13.551 8.619 -0.1129 -0.0450 0.1372 14LYS BB 852 16.197 13.678 8.510 0.0681 -0.1332 -0.0985 14LYS SC1 853 16.331 13.454 8.327 0.0013 0.1721 -0.0605 14LYS SC2 854 16.598 13.342 8.116 0.0631 -0.2152 -0.1315 15GLU BB 855 16.309 13.968 8.402 0.0213 0.0088 0.2549 15GLU SC1 856 16.593 13.854 8.179 0.3358 -0.3190 -0.0631 16LYS BB 857 16.344 14.263 8.551 -0.0303 -0.2241 -0.0549 16LYS SC1 858 16.463 14.342 8.823 -0.2663 -0.1414 -0.2310 16LYS SC2 859 16.365 14.266 9.175 -0.0716 0.1946 0.3192 17GLY BB 860 16.023 14.404 8.593 -0.0867 -0.2219 -0.0066 18GLY BB 861 15.738 14.377 8.742 0.1688 -0.1148 0.3562 19LYS BB 862 15.422 14.501 8.714 -0.3348 0.2987 -0.0654 19LYS SC1 863 15.439 14.758 8.549 0.2954 0.4585 0.3498 19LYS SC2 864 15.472 15.104 8.422 0.2202 0.1445 0.1245 20ASN BB 865 15.236 14.459 8.927 -0.0632 -0.0558 -0.1601 20ASN SC1 866 15.064 14.145 8.870 -0.2397 0.0114 0.0552 21ALA BB 867 14.985 14.583 8.707 -0.0643 0.0835 -0.0657 21ALA SC1 868 15.061 14.815 8.591 0.5460 0.0058 0.1410 22ILE BB 869 14.931 14.399 8.490 0.2335 -0.1070 -0.0131 22ILE SC1 870 14.891 14.446 8.154 0.5139 -0.0290 -0.0381 23ASN BB 871 14.677 14.170 8.478 -0.1506 -0.1998 0.0034 23ASN SC1 872 14.694 13.876 8.684 0.3891 -0.1317 -0.0257 24MET BB 873 14.591 14.004 8.259 0.0845 -0.0255 -0.1253 24MET SC1 874 14.858 14.012 7.971 0.1191 -0.0856 0.1483 25LYS BB 875 14.364 14.159 8.044 -0.0220 0.3092 -0.0317 25LYS SC1 876 14.170 14.015 7.830 0.0300 0.0484 0.3270 25LYS SC2 877 13.810 14.011 7.953 0.2994 0.2868 -0.1460 26ASP BB 878 14.172 14.365 8.228 0.0700 -0.1015 0.0709 26ASP SC1 879 14.148 14.261 8.560 0.1607 -0.3430 0.2965 27VAL BB 880 13.817 14.357 8.215 -0.2186 0.1318 0.2271 27VAL SC1 881 13.763 14.482 7.957 0.1910 -0.0622 0.0388 28LYS BB 882 13.692 14.147 8.426 0.0677 -0.2443 -0.0825 28LYS SC1 883 13.447 14.281 8.558 -0.3530 -0.0702 0.5414 28LYS SC2 884 13.369 14.527 8.750 0.2316 -0.2131 0.1008 29ASP BB 885 13.804 13.838 8.373 -0.0062 0.1118 -0.2623 29ASP SC1 886 13.547 13.745 8.155 0.2614 0.0381 0.1711 30LEU BB 887 14.084 13.870 8.304 0.1292 0.3149 -0.0417 30LEU SC1 888 14.204 13.567 8.242 -0.1579 -0.1570 -0.0191 31GLY BB 889 14.272 13.857 8.513 -0.4783 -0.2256 -0.4127 32LYS BB 890 14.294 13.584 8.688 -0.0053 0.0113 0.2915 32LYS SC1 891 14.449 13.618 8.929 0.2947 -0.3302 -0.2312 32LYS SC2 892 14.523 13.439 9.250 0.0434 -0.3602 -0.2204 33THR BB 893 13.999 13.437 8.642 -0.1853 -0.0616 -0.2081 33THR SC1 894 14.112 13.199 8.488 0.4578 -0.1003 0.2784 34MET BB 895 13.721 13.502 8.835 -0.4320 -0.0467 0.2590 34MET SC1 896 13.568 13.156 8.745 0.2967 -0.0033 0.0850 35LYS BB 897 13.505 13.730 8.754 0.2837 0.1264 0.1487 35LYS SC1 898 13.248 13.503 8.595 0.0125 0.2462 0.1348 35LYS SC2 899 13.240 13.415 8.246 -0.1547 0.1734 -0.1863 36ASP BB 900 13.279 13.863 8.918 0.2319 -0.1444 -0.1772 36ASP SC1 901 13.138 14.186 8.817 0.1761 0.1499 0.2449 37GLN BB 902 13.198 13.838 9.246 0.1149 0.3760 0.0670 37GLN SC1 903 13.472 14.028 9.373 -0.2305 -0.0133 -0.1396 38ALA BB 904 13.200 13.497 9.293 -0.1869 -0.0702 0.0561 38ALA SC1 905 13.381 13.418 9.109 0.0150 -0.0189 0.2280 39LEU BB 906 12.972 13.279 9.276 0.2149 -0.1493 0.1757 39LEU SC1 907 13.126 13.163 8.974 0.2920 0.1304 0.1401 40LYS BB 908 13.035 13.015 9.379 -0.0680 0.0433 0.1559 40LYS SC1 909 13.119 12.705 9.353 0.1524 0.1155 -0.0536 40LYS SC2 910 13.148 12.369 9.270 0.1120 0.1932 -0.2694 41ASP BB 911 12.972 12.947 9.712 0.0261 0.1584 -0.0354 41ASP SC1 912 12.665 13.051 9.671 0.1986 -0.0715 0.1418 42ASP BB 913 13.259 13.040 9.890 0.0653 0.2685 0.1110 42ASP SC1 914 13.364 13.239 9.638 -0.0731 -0.3403 -0.2658 43ASP BB 915 13.243 13.173 10.183 -0.0594 -0.1613 0.4120 43ASP SC1 916 13.101 13.049 10.464 -0.0384 -0.0244 -0.0880 44ALA BB 917 13.109 13.449 10.153 -0.0802 -0.2296 0.1113 44ALA SC1 918 13.300 13.578 10.295 0.0961 -0.4046 0.0376 45GLU BB 919 12.897 13.607 10.368 -0.1009 -0.2859 -0.1224 45GLU SC1 920 12.609 13.550 10.145 0.1413 0.1070 -0.1442 46THR BB 921 12.908 13.647 10.657 -0.1011 0.2120 0.0233 46THR SC1 922 12.637 13.553 10.761 0.0665 -0.3692 -0.0343 47GLY BB 923 12.964 13.927 10.753 0.2063 0.1469 -0.2537 48LEU BB 924 12.918 14.268 10.773 0.1006 0.0236 -0.1106 48LEU SC1 925 12.573 14.402 10.796 -0.0769 0.2482 -0.2110 49THR BB 926 13.012 14.476 10.516 -0.1074 0.0301 -0.2393 49THR SC1 927 12.732 14.433 10.404 -0.2547 0.2412 0.0361 50ASP BB 928 13.299 14.575 10.323 -0.0602 -0.0520 0.2447 50ASP SC1 929 13.513 14.317 10.382 0.0472 -0.1992 0.1210 51GLY BB 930 13.275 14.826 10.079 0.1131 0.0627 -0.1277 52GLU BB 931 13.058 15.079 10.026 -0.2343 0.3026 -0.2919 52GLU SC1 932 12.810 14.996 9.671 0.2623 0.3874 -0.2953 53GLU BB 933 12.992 15.249 10.297 -0.3039 -0.0446 0.0624 53GLU SC1 934 13.191 15.484 10.482 0.2723 0.1955 -0.2821 54LYS BB 935 12.743 15.202 10.433 0.0669 -0.1361 -0.1966 54LYS SC1 936 12.831 15.220 10.743 0.1632 -0.2169 -0.0771 54LYS SC2 937 12.779 15.597 10.753 0.1755 0.0930 -0.1542 55GLU BB 938 12.424 15.080 10.390 0.2167 -0.1121 -0.0144 55GLU SC1 939 12.576 14.919 10.097 0.1842 -0.0071 0.0534 56GLU BB 940 12.196 15.281 10.393 0.1589 0.0879 0.0921 56GLU SC1 941 12.322 15.585 10.547 0.0240 0.1435 0.2633 57PRO BB 942 12.023 15.387 10.107 0.1352 -0.3191 0.0476 57PRO SC1 943 11.779 15.418 10.331 0.2736 0.3734 0.0810 58LYS BB 944 12.230 15.703 10.036 0.2234 -0.1926 0.1275 58LYS SC1 945 12.255 15.960 10.182 0.1289 0.0130 0.2702 58LYS SC2 946 12.203 16.187 10.427 -0.1076 0.2786 -0.1156 59GLU BB 947 12.495 15.813 9.861 -0.0865 -0.2253 -0.0502 59GLU SC1 948 12.392 15.713 9.508 0.1187 -0.1898 0.0134 60GLU BB 949 12.634 16.106 9.999 -0.2315 0.0585 0.0505 60GLU SC1 950 12.970 15.978 9.844 -0.0493 -0.0940 -0.2011 61GLU BB 951 12.697 16.230 10.308 0.0434 0.2954 0.0458 61GLU SC1 952 12.606 16.025 10.639 -0.0071 0.3306 -0.2139 1LYS BB 953 4.742 4.152 2.659 0.1646 0.0077 0.1687 1LYS SC1 954 5.020 3.983 2.521 -0.0811 0.0334 -0.1865 1LYS SC2 955 5.269 3.849 2.400 -0.1060 -0.0623 0.1851 2LYS BB 956 4.634 4.360 2.823 -0.1207 -0.1429 0.2369 2LYS SC1 957 4.359 4.424 3.006 -0.3082 -0.3638 -0.1655 2LYS SC2 958 4.033 4.443 3.112 -0.0830 0.1061 -0.0295 3CYS BB 959 4.685 4.682 2.789 -0.1529 -0.0317 0.0616 3CYS SC1 960 4.721 4.998 2.929 0.8400 0.4538 0.5096 4LEU BB 961 4.951 4.839 2.632 0.1320 -0.1040 -0.1885 4LEU SC1 962 4.927 4.842 2.282 0.5307 0.0872 -0.2554 5PHE BB 963 5.121 5.120 2.619 -0.1182 0.0043 -0.0393 5PHE SC1 964 4.926 5.269 2.427 -0.0789 0.4225 0.3342 5PHE SC2 965 4.937 5.467 2.151 0.1302 0.1410 0.1355 5PHE SC3 966 5.078 5.214 2.128 -0.2916 -0.1212 0.3145 6LYS BB 967 5.477 5.145 2.657 -0.2036 -0.0548 -0.1569 6LYS SC1 968 5.628 5.210 2.375 -0.1561 0.1150 -0.0273 6LYS SC2 969 5.925 5.279 2.268 0.0491 0.0407 -0.0442 7LYS BB 970 5.579 5.431 2.804 0.3352 -0.0364 -0.0483 7LYS SC1 971 5.437 5.681 2.689 -0.1004 -0.0184 0.2673 7LYS SC2 972 5.416 5.984 2.470 0.0017 0.3331 0.2044 8LYS BB 973 5.708 5.342 3.077 0.0089 -0.0129 -0.1105 8LYS SC1 974 5.641 5.690 3.163 0.0475 -0.1302 0.0765 8LYS SC2 975 5.801 5.960 3.313 -0.1142 -0.0374 0.2073 9ASN BB 976 5.717 5.027 3.212 0.3109 0.1045 0.0341 9ASN SC1 977 5.986 5.138 3.442 0.4152 -0.0056 0.0167 10LYS BB 978 5.540 4.853 3.427 -0.0828 0.2878 0.2025 10LYS SC1 979 5.786 4.644 3.485 0.0370 0.2425 -0.0060 10LYS SC2 980 5.993 4.386 3.535 -0.0475 -0.1904 -0.0858 11LYS BB 981 5.659 4.877 3.796 0.1724 0.1212 0.1794 11LYS SC1 982 5.530 5.193 3.831 0.3084 0.4624 0.2396 11LYS SC2 983 5.487 5.511 4.015 0.3273 0.0646 0.0242 12LYS BB 984 5.574 4.571 3.938 0.2097 -0.2576 0.0846 12LYS SC1 985 5.283 4.707 3.906 -0.0729 -0.2022 -0.1996 12LYS SC2 986 4.942 4.610 3.935 0.1016 -0.2741 -0.0704 13GLY BB 987 5.805 4.374 3.965 -0.0883 0.0577 -0.1888 14LYS BB 988 6.089 4.484 4.028 -0.0174 -0.0209 0.0303 14LYS SC1 989 5.982 4.791 4.108 0.0635 -0.3051 -0.0799 14LYS SC2 990 6.029 4.957 4.446 -0.2712 -0.3386 0.0834 15GLU BB 991 6.375 4.557 3.857 0.1210 0.2500 -0.3759 15GLU SC1 992 6.251 4.860 3.660 -0.0357 0.1841 0.1334 16LYS BB 993 6.682 4.512 4.057 0.1124 0.0041 -0.0509 16LYS SC1 994 6.755 4.755 3.945 0.1839 0.1014 0.1811 16LYS SC2 995 6.718 4.975 3.731 -0.2389 0.0318 0.2228 17GLY BB 996 7.006 4.339 4.072 -0.2388 0.0479 -0.0908 18GLY BB 997 7.288 4.447 3.908 0.0063 0.1254 -0.1748 19LYS BB 998 7.442 4.411 3.604 0.1992 0.1142 -0.1222 19LYS SC1 999 7.273 4.620 3.432 -0.3670 -0.2092 0.1103 19LYS SC2 1000 7.057 4.696 3.181 -0.4991 -0.0304 0.1672 20ASN BB 1001 7.616 4.068 3.534 -0.0034 -0.2620 0.1714 20ASN SC1 1002 7.817 3.938 3.799 -0.2323 -0.2662 -0.1869 21ALA BB 1003 7.326 3.888 3.559 -0.2438 -0.0263 -0.3975 21ALA SC1 1004 7.152 4.089 3.609 0.0839 0.1567 0.0789 22ILE BB 1005 7.362 3.578 3.545 -0.1745 0.1880 -0.2441 22ILE SC1 1006 7.674 3.485 3.648 -0.3404 0.2665 0.3674 23ASN BB 1007 7.329 3.301 3.352 0.2798 0.0828 -0.0388 23ASN SC1 1008 7.627 3.308 3.141 -0.1096 0.0216 -0.3589 24MET BB 1009 7.010 3.223 3.364 0.1057 0.2042 0.2318 24MET SC1 1010 7.013 3.189 3.718 -0.0380 -0.0706 0.2625 25LYS BB 1011 6.764 3.414 3.343 0.1138 -0.2758 0.0232 25LYS SC1 1012 6.916 3.686 3.238 -0.0772 0.0390 0.0069 25LYS SC2 1013 6.867 4.033 3.321 0.2987 -0.1730 -0.1780 26ASP BB 1014 6.555 3.421 3.568 0.1279 0.2178 -0.1780 26ASP SC1 1015 6.249 3.372 3.461 -0.2486 -0.0457 -0.2087 27VAL BB 1016 6.732 3.551 3.799 -0.1011 -0.0181 -0.0205 27VAL SC1 1017 6.867 3.782 3.680 -0.0184 -0.0235 0.0607 28LYS BB 1018 6.534 3.652 3.986 -0.1574 -0.1961 0.1062 28LYS SC1 1019 6.677 3.679 4.288 0.1306 0.0099 -0.1220 28LYS SC2 1020 6.975 3.563 4.446 0.1860 -0.0694 -0.2532 29ASP BB 1021 6.232 3.769 3.816 0.2849 -0.0667 -0.1344 29ASP SC1 1022 6.175 4.099 3.793 0.4668 0.0031 -0.3813 30LEU BB 1023 6.003 3.636 3.743 0.1388 -0.1605 0.2840 30LEU SC1 1024 5.854 3.511 4.057 -0.2792 0.0748 0.1488 31GLY BB 1025 5.972 3.759 3.489 0.1789 0.1830 0.2655 32LYS BB 1026 5.965 3.633 3.192 0.2405 0.1089 -0.1749 32LYS SC1 1027 5.994 3.761 2.954 -0.0791 0.0394 -0.1337 32LYS SC2 1028 6.194 3.929 2.753 0.0109 -0.1389 -0.0150 33THR BB 1029 5.854 3.342 3.167 -0.0543 0.1836 0.0246 33THR SC1 1030 5.732 3.353 3.447 0.0314 0.1397 0.0640 34MET BB 1031 5.987 3.067 3.115 0.1109 -0.3534 -0.2126 34MET SC1 1032 6.003 2.998 3.498 -0.2960 0.1571 -0.0078 35LYS BB 1033 6.266 2.984 3.095 -0.1623 0.1793 -0.2097 35LYS SC1 1034 6.194 2.716 3.240 -0.2323 0.1976 -0.0627 35LYS SC2 1035 6.238 2.595 3.555 0.3568 -0.0171 0.0545 36ASP BB 1036 6.362 3.020 2.772 0.1286 0.0391 0.2045 36ASP SC1 1037 6.677 3.138 2.718 0.0517 -0.0768 -0.3551 37GLN BB 1038 6.301 2.834 2.564 0.1363 -0.4155 0.1276 37GLN SC1 1039 6.319 2.520 2.834 -0.2504 0.0961 0.0941 38ALA BB 1040 6.225 3.013 2.310 -0.0557 -0.0157 -0.1188 38ALA SC1 1041 6.050 2.856 2.180 -0.0927 0.0493 -0.1477 39LEU BB 1042 6.343 3.318 2.354 -0.0733 -0.2226 0.2182 39LEU SC1 1043 6.290 3.349 1.995 -0.1274 -0.1679 0.0442 40LYS BB 1044 6.309 3.509 2.593 0.0703 0.0902 -0.1247 40LYS SC1 1045 6.607 3.585 2.572 0.1670 0.0529 0.0735 40LYS SC2 1046 6.944 3.742 2.589 -0.2057 0.1459 0.1084 41ASP BB 1047 5.981 3.523 2.597 0.0998 0.1004 -0.1870 41ASP SC1 1048 5.947 3.203 2.682 0.0045 0.0789 0.0775 42ASP BB 1049 5.784 3.689 2.380 0.1181 0.0130 -0.2361 42ASP SC1 1050 5.531 3.582 2.194 -0.5156 0.0400 0.1415 43ASP BB 1051 5.975 3.938 2.324 -0.1634 -0.1343 0.0658 43ASP SC1 1052 5.838 4.103 2.626 0.1673 -0.0500 0.4003 44ALA BB 1053 6.288 3.908 2.333 -0.1235 0.2583 -0.1553 44ALA SC1 1054 6.345 3.681 2.197 0.2307 0.2453 -0.0011 45GLU BB 1055 6.569 4.026 2.473 -0.1064 -0.1266 0.0613 45GLU SC1 1056 6.860 4.113 2.218 -0.3585 -0.0522 0.1662 46THR BB 1057 6.509 4.252 2.683 -0.0316 -0.3962 -0.0780 46THR SC1 1058 6.420 4.308 2.970 0.1422 0.0996 -0.1104 47GLY BB 1059 6.506 4.540 2.508 -0.0622 0.1327 0.0868 48LEU BB 1060 6.376 4.821 2.647 0.1520 -0.2162 0.1033 48LEU SC1 1061 6.260 4.924 2.348 -0.3122 0.3963 0.1208 49THR BB 1062 6.428 5.127 2.832 0.1478 0.0884 -0.0358 49THR SC1 1063 6.682 5.152 2.999 -0.0796 0.2202 0.3012 50ASP BB 1064 6.178 5.238 3.006 -0.3478 0.0476 -0.0233 50ASP SC1 1065 6.020 5.380 2.728 -0.2956 -0.0529 -0.0032 51GLY BB 1066 6.142 5.551 3.148 -0.0634 -0.0744 0.0493 52GLU BB 1067 6.083 5.630 3.459 -0.1700 -0.1529 -0.2311 52GLU SC1 1068 5.911 5.796 3.754 -0.2015 0.1277 -0.2217 53GLU BB 1069 6.430 5.711 3.497 0.1906 0.0039 0.0960 53GLU SC1 1070 6.384 5.964 3.215 -0.3783 0.0154 -0.1858 54LYS BB 1071 6.725 5.602 3.500 0.0706 0.1227 0.1229 54LYS SC1 1072 6.819 5.935 3.436 0.0351 0.0221 -0.0225 54LYS SC2 1073 6.718 6.217 3.594 0.5082 0.2591 -0.3097 55GLU BB 1074 6.951 5.513 3.259 -0.1127 0.0832 0.0837 55GLU SC1 1075 6.996 5.124 3.352 -0.1610 -0.0032 -0.1201 56GLU BB 1076 6.987 5.631 2.952 -0.1713 0.3028 0.0697 56GLU SC1 1077 6.795 5.457 2.670 0.4839 -0.0427 0.0014 57PRO BB 1078 6.769 5.907 2.963 -0.4256 -0.2192 -0.0831 57PRO SC1 1079 6.722 5.915 2.659 -0.1648 0.0416 0.0804 58LYS BB 1080 6.798 6.202 3.063 -0.2986 -0.1921 0.0576 58LYS SC1 1081 6.770 6.320 2.775 0.2047 -0.1297 -0.1356 58LYS SC2 1082 6.764 6.321 2.448 -0.2779 -0.3453 0.1549 59GLU BB 1083 7.116 6.325 3.152 0.0703 0.2901 0.2849 59GLU SC1 1084 7.274 5.968 3.178 -0.1519 0.0889 -0.1852 60GLU BB 1085 7.293 6.568 3.258 -0.0413 0.0534 -0.0322 60GLU SC1 1086 7.027 6.666 3.553 0.1603 0.0753 -0.1878 61GLU BB 1087 7.586 6.681 3.070 0.0515 -0.1957 0.3137 61GLU SC1 1088 7.385 6.999 2.930 -0.0936 -0.0078 -0.1630 1LYS BB 1089 9.045 12.172 13.920 0.0177 -0.1508 0.1215 1LYS SC1 1090 9.321 11.967 13.952 0.0687 -0.1395 -0.0474 1LYS SC2 1091 9.453 11.649 13.997 0.0306 0.4210 0.0322 2LYS BB 1092 8.913 12.220 14.216 0.0773 0.0590 -0.0925 2LYS SC1 1093 9.084 12.479 14.310 -0.0629 -0.3824 -0.3708 2LYS SC2 1094 9.357 12.687 14.470 -0.0448 0.0139 -0.0619 3CYS BB 1095 8.611 12.200 14.301 0.2138 0.1640 -0.0293 3CYS SC1 1096 8.584 12.514 14.213 -0.0906 -0.1188 -0.0571 4LEU BB 1097 8.451 12.170 14.546 -0.2506 -0.1014 0.3106 4LEU SC1 1098 8.115 12.171 14.531 0.1841 -0.0947 -0.0329 5PHE BB 1099 8.538 11.899 14.673 0.1658 0.4166 -0.0936 5PHE SC1 1100 8.599 11.707 14.397 -0.2065 -0.1903 -0.0767 5PHE SC2 1101 8.397 11.544 14.178 -0.1916 -0.1091 -0.1515 5PHE SC3 1102 8.543 11.769 14.068 0.0557 -0.2577 -0.1363 6LYS BB 1103 8.761 11.838 14.916 0.5560 -0.1215 0.1711 6LYS SC1 1104 8.941 11.578 14.971 -0.2496 0.2536 -0.0869 6LYS SC2 1105 9.165 11.312 14.910 -0.1294 0.0737 0.1867 7LYS BB 1106 8.610 11.757 15.240 -0.0973 -0.1523 -0.0372 7LYS SC1 1107 8.898 11.822 15.362 0.1440 0.1556 0.4589 7LYS SC2 1108 9.234 11.877 15.380 0.1830 -0.0737 0.0694 8LYS BB 1109 8.538 11.524 15.388 -0.0581 -0.1330 -0.0454 8LYS SC1 1110 8.708 11.279 15.233 0.1450 0.2016 -0.2367 8LYS SC2 1111 8.459 11.035 15.113 -0.0225 0.2839 0.1018 9ASN BB 1112 8.211 11.388 15.395 -0.1882 -0.2326 0.2058 9ASN SC1 1113 8.101 11.341 15.086 0.3591 0.1763 0.0390 10LYS BB 1114 8.109 11.687 15.350 -0.2052 -0.1127 0.0260 10LYS SC1 1115 7.836 11.733 15.237 0.1786 -0.2236 0.5080 10LYS SC2 1116 7.517 11.784 15.207 -0.2557 -0.1304 0.1516 11LYS BB 1117 8.132 11.967 15.458 -0.0461 0.0466 0.2158 11LYS SC1 1118 7.816 12.063 15.538 -0.1777 -0.0874 0.0105 11LYS SC2 1119 7.667 12.227 15.850 0.2059 0.0425 0.0444 12LYS BB 1120 8.391 12.183 15.480 -0.1201 0.1579 0.2889 12LYS SC1 1121 8.555 11.967 15.636 -0.1603 -0.2629 -0.3871 12LYS SC2 1122 8.716 11.843 15.938 -0.1023 0.1507 -0.0684 13GLY BB 1123 8.339 12.448 15.356 0.2878 -0.2302 -0.0299 14LYS BB 1124 8.046 12.529 15.218 0.2599 -0.0809 0.1389 14LYS SC1 1125 8.041 12.305 15.024 0.0595 -0.0687 0.0477 14LYS SC2 1126 8.343 12.081 15.029 0.0239 0.0900 0.0052 15GLU BB 1127 7.888 12.709 15.449 0.1215 0.0379 0.2704 15GLU SC1 1128 8.084 12.477 15.734 0.1914 0.2504 0.0862 16LYS BB 1129 8.019 13.036 15.543 0.0141 0.4062 -0.0081 16LYS SC1 1130 7.905 13.193 15.751 0.4091 0.2375 -0.3282 16LYS SC2 1131 7.714 13.457 15.780 0.0295 -0.3122 0.0523 17GLY BB 1132 8.355 12.837 15.535 0.2599 -0.1276 -0.1414 18GLY BB 1133 8.639 12.851 15.290 -0.2587 0.1147 -0.0224 19LYS BB 1134 8.864 13.029 15.359 0.1773 0.0050 0.0303 19LYS SC1 1135 8.841 13.020 15.685 0.0800 0.3850 0.0871 19LYS SC2 1136 8.868 12.834 16.005 0.0588 -0.0436 -0.1137 20ASN BB 1137 8.753 13.359 15.392 0.2130 0.2825 -0.3442 20ASN SC1 1138 8.845 13.439 15.082 -0.1847 -0.1562 -0.1036 21ALA BB 1139 8.462 13.353 15.336 0.0219 0.1254 -0.3587 21ALA SC1 1140 8.286 13.444 15.519 -0.0089 -0.0353 -0.3062 22ILE BB 1141 8.356 13.526 15.044 -0.1886 -0.1917 -0.2718 22ILE SC1 1142 8.061 13.379 15.130 -0.2125 0.0386 0.0596 23ASN BB 1143 8.350 13.334 14.756 0.1788 0.0204 -0.1416 23ASN SC1 1144 8.660 13.421 14.634 -0.0960 -0.0320 -0.1785 24MET BB 1145 8.067 13.364 14.608 -0.1913 -0.0275 -0.1843 24MET SC1 1146 7.931 13.031 14.690 -0.0075 -0.5647 -0.1840 25LYS BB 1147 7.887 13.584 14.723 0.2616 0.1286 -0.1396 25LYS SC1 1148 7.645 13.665 14.547 -0.0333 0.0008 0.2707 25LYS SC2 1149 7.316 13.765 14.256 -0.1991 -0.0577 0.4110 26ASP BB 1150 8.010 13.924 14.648 0.2568 0.0621 -0.0862 26ASP SC1 1151 8.316 13.813 14.622 -0.2228 -0.1053 0.1172 27VAL BB 1152 7.911 14.238 14.724 0.0615 0.2486 -0.0230 27VAL SC1 1153 7.908 14.409 14.961 0.1409 -0.1473 0.2750 28LYS BB 1154 8.001 14.441 14.451 -0.0832 -0.0331 -0.1641 28LYS SC1 1155 8.287 14.308 14.519 -0.2303 -0.1674 -0.1741 28LYS SC2 1156 8.612 14.182 14.671 0.0505 0.0093 0.0704 29ASP BB 1157 7.909 14.512 14.141 0.0402 0.3573 0.0267 29ASP SC1 1158 7.828 14.819 14.266 0.0296 -0.2902 0.0821 30LEU BB 1159 7.864 14.341 13.884 -0.2060 -0.2830 0.0225 30LEU SC1 1160 7.571 14.089 13.854 0.4882 -0.3945 -0.1442 31GLY BB 1161 8.066 14.305 13.597 0.4666 0.3095 -0.2121 32LYS BB 1162 8.355 14.243 13.570 -0.0382 -0.0546 0.2954 32LYS SC1 1163 8.371 14.332 13.921 -0.3156 0.1696 -0.0617 32LYS SC2 1164 8.400 14.606 14.149 -0.1751 -0.3612 0.4485 33THR BB 1165 8.509 14.158 13.301 -0.2548 0.0972 -0.0856 33THR SC1 1166 8.421 13.905 13.154 0.3360 -0.0572 -0.2032 34MET BB 1167 8.617 14.347 13.026 -0.3940 -0.1531 -0.2614 34MET SC1 1168 8.923 14.419 13.354 -0.1964 -0.1872 0.2679 35LYS BB 1169 8.474 14.262 12.784 -0.0964 -0.3698 0.1116 35LYS SC1 1170 8.229 14.235 12.956 -0.2525 0.3622 0.0929 35LYS SC2 1171 7.996 14.008 13.143 0.1207 -0.1845 0.0570 36ASP BB 1172 8.504 14.401 12.489 0.0459 0.1669 0.1314 36ASP SC1 1173 8.692 14.679 12.541 0.0174 0.1430 0.5054 37GLN BB 1174 8.410 14.190 12.295 -0.0639 0.1644 -0.2494 37GLN SC1 1175 8.646 13.913 12.433 -0.0159 0.4205 -0.0946 38ALA BB 1176 8.099 14.131 12.241 -0.0539 0.6247 0.4734 38ALA SC1 1177 7.969 14.054 12.465 -0.4907 -0.1792 -0.0101 39LEU BB 1178 8.007 13.935 12.016 0.0675 0.2167 0.1583 39LEU SC1 1179 7.641 14.040 12.068 -0.4467 0.3176 0.0067 40LYS BB 1180 8.149 13.806 11.713 0.2850 -0.0122 0.2178 40LYS SC1 1181 7.896 13.815 11.567 0.1235 -0.1645 -0.1604 40LYS SC2 1182 7.743 13.811 11.252 -0.0689 0.2001 -0.3564 41ASP BB 1183 8.380 13.875 11.501 -0.2395 -0.3468 -0.2337 41ASP SC1 1184 8.213 13.804 11.229 -0.0297 0.0595 -0.2159 42ASP BB 1185 8.629 14.024 11.606 -0.1333 -0.0304 0.2395 42ASP SC1 1186 8.625 14.327 11.602 0.0028 -0.3965 0.0233 43ASP BB 1187 8.678 13.986 11.924 -0.0763 0.0198 0.0104 43ASP SC1 1188 8.953 13.805 11.870 -0.2056 -0.2222 -0.1714 44ALA BB 1189 8.533 13.634 11.916 -0.1641 -0.1587 -0.0218 44ALA SC1 1190 8.363 13.729 12.103 -0.0100 0.2813 -0.0933 45GLU BB 1191 8.655 13.451 11.654 0.0476 0.1088 -0.0050 45GLU SC1 1192 8.310 13.377 11.557 -0.1510 -0.0526 0.0538 46THR BB 1193 8.925 13.538 11.516 0.2802 0.0915 0.1462 46THR SC1 1194 9.034 13.460 11.242 0.1229 0.1498 0.0663 47GLY BB 1195 9.172 13.408 11.714 -0.2874 -0.1572 -0.1596 48LEU BB 1196 9.433 13.334 11.556 -0.0290 -0.0683 -0.3080 48LEU SC1 1197 9.426 13.199 11.218 -0.1237 -0.1592 0.1166 49THR BB 1198 9.698 13.426 11.697 -0.0165 0.0774 0.1870 49THR SC1 1199 9.909 13.255 11.558 -0.1742 -0.0630 0.1167 50ASP BB 1200 9.782 13.433 11.971 -0.0937 0.1242 0.1805 50ASP SC1 1201 10.162 13.444 11.945 0.3913 -0.2887 -0.3058 51GLY BB 1202 9.677 13.190 12.180 -0.1214 -0.0420 0.1668 52GLU BB 1203 9.518 13.014 11.990 0.3623 -0.1489 0.0105 52GLU SC1 1204 9.111 13.072 11.955 0.0140 -0.1661 0.1276 53GLU BB 1205 9.570 12.719 12.092 -0.0943 -0.0354 0.1802 53GLU SC1 1206 9.782 12.509 11.885 -0.1910 -0.2395 -0.1691 54LYS BB 1207 9.372 12.693 12.378 0.1540 0.0454 -0.4046 54LYS SC1 1208 9.107 12.723 12.274 -0.2208 -0.0790 -0.0930 54LYS SC2 1209 8.811 12.762 12.091 -0.1905 -0.0017 0.3781 55GLU BB 1210 9.527 12.828 12.643 0.0497 -0.2296 0.1380 55GLU SC1 1211 9.202 12.892 12.857 0.0275 0.1160 0.0712 56GLU BB 1212 9.762 13.090 12.722 -0.2542 0.1496 -0.1285 56GLU SC1 1213 10.111 12.989 12.868 0.2780 -0.2305 -0.3233 57PRO BB 1214 9.819 13.360 12.894 0.1503 0.0379 -0.4083 57PRO SC1 1215 9.889 13.601 12.681 -0.2948 0.1802 0.3799 58LYS BB 1216 10.055 13.445 13.102 -0.2490 -0.3218 0.3064 58LYS SC1 1217 10.283 13.483 12.937 0.3828 -0.0448 0.2627 58LYS SC2 1218 10.496 13.232 12.766 -0.0170 0.0496 0.0277 59GLU BB 1219 10.084 13.456 13.431 -0.0478 0.1176 0.0521 59GLU SC1 1220 9.899 13.813 13.481 -0.1925 0.0010 0.0108 60GLU BB 1221 10.284 13.219 13.556 -0.0165 0.1130 -0.3553 60GLU SC1 1222 10.519 13.182 13.238 -0.0574 -0.1044 -0.2078 61GLU BB 1223 10.471 13.231 13.803 -0.3042 -0.1258 -0.0592 61GLU SC1 1224 10.267 13.187 14.105 0.0008 0.0045 -0.1747 1LYS BB 1225 14.103 16.654 8.599 0.3315 -0.1702 0.2864 1LYS SC1 1226 13.870 16.877 8.485 0.0702 0.0954 -0.1987 1LYS SC2 1227 13.775 17.206 8.292 0.4381 0.3378 0.1201 2LYS BB 1228 14.083 16.770 8.902 0.0239 0.2509 0.1474 2LYS SC1 1229 13.822 16.638 9.058 0.1576 0.0697 -0.2162 2LYS SC2 1230 13.501 16.795 9.148 0.1481 0.4394 -0.0952 3CYS BB 1231 14.307 16.803 9.133 -0.1038 -0.3997 0.1439 3CYS SC1 1232 14.265 17.046 9.327 -0.0208 -0.6323 -0.1718 4LEU BB 1233 14.495 16.588 9.251 -0.0592 -0.0252 -0.1081 4LEU SC1 1234 14.432 16.501 9.582 0.1100 -0.0823 0.0600 5PHE BB 1235 14.838 16.553 9.257 -0.0032 0.0880 0.1312 5PHE SC1 1236 14.987 16.258 9.309 -0.0575 -0.1572 -0.0058 5PHE SC2 1237 14.852 15.953 9.374 0.0479 -0.2082 -0.0233 5PHE SC3 1238 14.911 16.114 9.608 -0.4210 -0.0161 -0.0253 6LYS BB 1239 15.115 16.711 9.349 0.2827 0.1379 -0.1079 6LYS SC1 1240 15.018 16.502 9.647 0.0160 0.0650 0.0901 6LYS SC2 1241 15.025 16.311 9.928 0.0905 -0.3580 0.1467 7LYS BB 1242 15.208 16.970 9.198 -0.0756 -0.0082 0.2438 7LYS SC1 1243 15.444 16.788 9.066 -0.2585 0.0561 -0.0700 7LYS SC2 1244 15.478 16.588 8.803 0.1602 0.1608 0.0701 8LYS BB 1245 14.996 17.278 9.200 -0.0371 0.0476 0.1138 8LYS SC1 1246 14.804 17.434 9.341 0.3296 0.0256 -0.2585 8LYS SC2 1247 14.547 17.648 9.412 0.0655 -0.0529 0.0765 9ASN BB 1248 15.229 17.513 9.234 0.0619 -0.0604 -0.2116 9ASN SC1 1249 15.067 17.802 9.355 0.3288 -0.0724 0.2052 10LYS BB 1250 15.474 17.416 9.132 -0.1822 -0.0262 0.2109 10LYS SC1 1251 15.659 17.669 9.147 0.0229 -0.0681 0.1221 10LYS SC2 1252 15.859 17.654 9.412 0.0342 0.1527 0.4986 11LYS BB 1253 15.678 17.183 9.307 -0.4204 -0.1009 0.0515 11LYS SC1 1254 15.552 17.163 9.575 0.0860 0.0350 0.0564 11LYS SC2 1255 15.230 17.184 9.626 0.0862 0.2091 0.0790 12LYS BB 1256 15.980 17.241 9.419 -0.1221 -0.1036 0.0285 12LYS SC1 1257 15.932 16.953 9.588 -0.1305 0.0385 0.1036 12LYS SC2 1258 15.982 16.705 9.807 -0.3507 0.2951 0.0718 13GLY BB 1259 16.215 17.453 9.569 0.1200 0.1120 -0.0431 14LYS BB 1260 16.145 17.643 9.857 0.2301 -0.1942 0.1276 14LYS SC1 1261 16.383 17.613 10.083 -0.0625 0.3844 -0.0425 14LYS SC2 1262 16.681 17.638 10.208 0.2941 -0.1840 -0.2071 15GLU BB 1263 15.884 17.856 9.841 0.3145 -0.2532 -0.0190 15GLU SC1 1264 16.013 18.045 9.560 0.0159 0.1006 0.0143 16LYS BB 1265 15.907 18.002 10.112 0.2820 0.0290 0.0092 16LYS SC1 1266 16.019 18.283 10.006 -0.1285 0.4681 -0.3115 16LYS SC2 1267 16.288 18.502 9.903 -0.0697 0.1335 0.2096 17GLY BB 1268 15.835 17.732 10.310 0.0247 0.0940 0.1782 18GLY BB 1269 16.025 17.513 10.383 0.2695 0.1151 0.1214 19LYS BB 1270 15.998 17.488 10.671 0.0405 -0.1315 -0.1166 19LYS SC1 1271 16.178 17.239 10.696 0.2450 0.1822 0.0572 19LYS SC2 1272 16.268 17.080 10.439 -0.0521 -0.0880 -0.0475 20ASN BB 1273 15.759 17.383 10.874 0.0334 -0.0728 0.1978 20ASN SC1 1274 15.661 17.273 11.171 0.1705 0.2939 -0.1984 21ALA BB 1275 15.485 17.223 10.783 -0.2782 -0.2303 0.0764 21ALA SC1 1276 15.594 16.985 10.717 0.2335 0.0610 -0.1879 22ILE BB 1277 15.297 17.181 10.518 -0.1399 -0.0831 -0.0094 22ILE SC1 1278 15.413 16.900 10.363 -0.0092 0.0629 -0.1812 23ASN BB 1279 15.141 17.404 10.343 0.1562 -0.0401 0.0023 23ASN SC1 1280 15.385 17.355 10.113 0.4596 -0.4431 0.1560 24MET BB 1281 14.797 17.438 10.410 -0.0028 0.3388 0.1488 24MET SC1 1282 14.767 17.148 10.679 -0.1602 0.0260 0.1674 25LYS BB 1283 14.759 17.651 10.627 -0.1702 0.1178 -0.0226 25LYS SC1 1284 14.564 17.820 10.517 -0.1631 -0.2003 -0.0573 25LYS SC2 1285 14.202 17.649 10.610 0.0684 0.3434 0.0878 26ASP BB 1286 14.984 17.741 10.827 0.0856 0.1822 -0.2142 26ASP SC1 1287 15.111 17.417 10.845 -0.1821 -0.1031 -0.0906 27VAL BB 1288 15.241 17.769 10.576 -0.0425 -0.1533 0.0175 27VAL SC1 1289 15.073 17.868 10.358 0.0514 -0.1622 -0.0597 28LYS BB 1290 15.499 17.923 10.598 0.2233 0.1852 -0.1717 28LYS SC1 1291 15.361 18.175 10.480 -0.0847 0.5474 0.5757 28LYS SC2 1292 15.271 18.272 10.175 -0.1371 0.0409 0.1385 29ASP BB 1293 15.749 17.853 10.744 -0.0087 -0.2090 0.0461 29ASP SC1 1294 15.923 18.203 10.737 0.0229 0.1117 0.0391 30LEU BB 1295 15.746 17.851 11.066 -0.1977 0.2107 0.1838 30LEU SC1 1296 16.093 17.742 11.008 -0.0023 -0.0400 0.1435 31GLY BB 1297 15.535 17.695 11.278 -0.0844 0.2457 -0.1020 32LYS BB 1298 15.210 17.649 11.294 -0.1980 0.1010 0.0027 32LYS SC1 1299 15.092 17.823 11.493 0.1636 0.1714 -0.1955 32LYS SC2 1300 15.249 17.962 11.739 -0.1449 0.3399 0.0775 33THR BB 1301 15.130 17.369 11.288 0.2077 0.0144 0.0168 33THR SC1 1302 15.031 17.370 11.577 -0.1182 0.0001 -0.0904 34MET BB 1303 15.197 17.088 11.232 -0.0855 -0.2157 -0.0435 34MET SC1 1304 15.175 16.887 10.902 -0.0128 -0.0405 -0.1689 35LYS BB 1305 15.353 16.985 11.499 -0.0583 0.0441 -0.0012 35LYS SC1 1306 15.155 16.715 11.555 -0.1377 -0.1977 -0.2266 35LYS SC2 1307 15.068 16.511 11.809 0.1292 -0.3672 -0.0419 36ASP BB 1308 15.520 17.218 11.613 -0.0535 0.0315 -0.1801 36ASP SC1 1309 15.752 17.123 11.867 0.0446 0.1215 -0.3531 37GLN BB 1310 15.476 17.518 11.698 0.1314 0.1339 0.0120 37GLN SC1 1311 15.771 17.562 11.928 -0.0390 0.0897 -0.0112 38ALA BB 1312 15.351 17.407 11.991 -0.1101 0.1785 0.0869 38ALA SC1 1313 15.472 17.532 12.197 -0.1469 0.4034 -0.0247 39LEU BB 1314 15.329 17.127 12.142 -0.1387 -0.1502 0.2318 39LEU SC1 1315 15.295 17.207 12.490 0.3123 -0.3343 -0.2013 40LYS BB 1316 15.214 16.937 11.961 0.0677 0.0625 0.0744 40LYS SC1 1317 15.452 16.714 11.876 -0.3270 0.0024 -0.0789 40LYS SC2 1318 15.756 16.709 11.742 -0.1357 -0.0639 -0.0019 41ASP BB 1319 14.948 17.015 11.869 -0.0816 0.1661 0.1293 41ASP SC1 1320 14.901 17.310 12.026 0.2133 0.1941 -0.0286 42ASP BB 1321 14.803 16.963 11.598 -0.3201 0.1352 -0.2327 42ASP SC1 1322 14.638 17.261 11.593 0.0399 -0.1185 -0.2452 43ASP BB 1323 14.712 16.684 11.584 0.0860 0.1749 0.1285 43ASP SC1 1324 14.706 16.617 11.898 -0.2419 0.2653 -0.3673 44ALA BB 1325 14.489 16.605 11.421 0.5485 -0.0593 -0.1353 44ALA SC1 1326 14.354 16.407 11.546 0.0974 0.0776 -0.3817 45GLU BB 1327 14.433 16.821 11.217 0.0958 -0.1999 0.1863 45GLU SC1 1328 14.086 16.881 11.041 0.1797 0.0043 -0.0703 46THR BB 1329 14.703 16.892 11.085 -0.1505 -0.0426 0.0136 46THR SC1 1330 14.787 17.176 11.157 0.1000 -0.1322 0.0820 47GLY BB 1331 14.802 16.700 10.800 0.1888 -0.0036 -0.2500 48LEU BB 1332 14.780 16.650 10.447 -0.0367 -0.0035 0.1490 48LEU SC1 1333 14.984 16.893 10.408 0.0413 -0.2897 -0.2382 49THR BB 1334 14.548 16.748 10.255 0.0347 -0.1537 0.1379 49THR SC1 1335 14.662 16.651 9.989 0.0310 -0.1927 0.1505 50ASP BB 1336 14.401 16.999 10.236 0.1223 -0.0490 -0.0293 50ASP SC1 1337 14.354 17.240 10.489 -0.0511 -0.0964 -0.0691 51GLY BB 1338 14.098 17.078 10.162 -0.0600 -0.1124 -0.0335 52GLU BB 1339 13.848 17.302 10.277 -0.0909 -0.3874 -0.0079 52GLU SC1 1340 13.573 17.079 10.476 -0.0744 0.0104 0.0258 53GLU BB 1341 13.665 17.521 10.154 -0.1624 -0.2224 0.0781 53GLU SC1 1342 13.849 17.888 10.117 -0.1075 0.1263 0.0173 54LYS BB 1343 13.479 17.569 9.901 0.0685 0.1753 -0.1679 54LYS SC1 1344 13.208 17.581 10.064 -0.0996 -0.1385 -0.3032 54LYS SC2 1345 13.244 17.554 10.424 0.0415 0.0761 0.2111 55GLU BB 1346 13.564 17.446 9.555 0.2200 0.3524 0.0377 55GLU SC1 1347 13.376 17.086 9.489 0.0917 0.0914 -0.2977 56GLU BB 1348 13.251 17.564 9.422 -0.1965 0.0989 0.1729 56GLU SC1 1349 13.372 17.928 9.318 -0.0533 0.5794 0.2498 57PRO BB 1350 13.194 17.481 9.107 0.0913 -0.1606 0.0543 57PRO SC1 1351 13.380 17.251 9.062 0.2207 0.0162 -0.2767 58LYS BB 1352 12.989 17.367 8.857 -0.0242 0.0144 -0.0569 58LYS SC1 1353 12.957 17.410 8.552 -0.5222 -0.1423 -0.0325 58LYS SC2 1354 12.665 17.441 8.320 -0.0946 -0.2870 0.0999 59GLU BB 1355 12.977 17.082 8.876 -0.3591 0.2467 0.3799 59GLU SC1 1356 12.577 17.043 8.879 0.1254 -0.0168 -0.0595 60GLU BB 1357 13.212 16.896 8.803 0.2054 -0.1884 -0.3019 60GLU SC1 1358 13.384 16.998 8.500 0.2540 -0.0234 0.1199 61GLU BB 1359 13.118 16.591 8.968 0.0445 -0.2389 -0.1648 61GLU SC1 1360 13.115 16.686 9.355 0.2665 -0.1523 0.1062 1LYS BB 1361 12.608 15.331 14.099 -0.0694 0.1012 0.0574 1LYS SC1 1362 12.746 15.395 13.786 -0.0230 0.1010 -0.0531 1LYS SC2 1363 12.973 15.370 13.501 -0.2987 -0.2307 -0.2169 2LYS BB 1364 12.350 15.628 14.025 0.3646 0.1495 0.3221 2LYS SC1 1365 12.250 15.454 13.739 0.1321 -0.0383 0.4220 2LYS SC2 1366 12.032 15.240 13.586 0.2001 -0.1007 -0.0481 3CYS BB 1367 12.401 15.912 14.166 -0.0489 -0.2356 0.2000 3CYS SC1 1368 12.290 15.879 14.472 0.0006 0.0747 -0.2224 4LEU BB 1369 12.630 16.104 14.273 0.0508 -0.0278 -0.1612 4LEU SC1 1370 12.601 16.144 14.616 -0.0920 0.0804 0.0928 5PHE BB 1371 12.821 16.293 14.110 0.5152 0.0703 0.5210 5PHE SC1 1372 13.102 16.344 14.260 -0.1380 0.2488 -0.1756 5PHE SC2 1373 13.389 16.435 14.103 0.0834 -0.0660 0.0336 5PHE SC3 1374 13.408 16.196 14.266 -0.2763 -0.0392 0.1233 6LYS BB 1375 12.834 16.619 14.034 0.0572 -0.0952 0.0570 6LYS SC1 1376 12.532 16.668 14.015 -0.1660 -0.0897 0.4496 6LYS SC2 1377 12.308 16.845 14.163 -0.1169 0.3768 -0.0676 7LYS BB 1378 13.040 16.773 13.841 -0.2383 0.3167 0.0388 7LYS SC1 1379 13.121 17.072 13.927 0.3253 0.1065 -0.0208 7LYS SC2 1380 13.408 17.249 14.053 0.1726 0.3522 -0.0766 8LYS BB 1381 13.241 16.572 13.668 0.0371 -0.0922 0.1007 8LYS SC1 1382 13.032 16.401 13.503 -0.0908 0.3871 0.1977 8LYS SC2 1383 12.777 16.196 13.633 -0.1349 -0.2426 0.0058 9ASN BB 1384 13.587 16.567 13.606 -0.2351 0.1780 -0.3554 9ASN SC1 1385 13.642 16.785 13.889 0.0793 0.0440 -0.1058 10LYS BB 1386 13.491 16.236 13.460 -0.1489 0.3932 0.0902 10LYS SC1 1387 13.756 16.348 13.240 0.1165 -0.2947 -0.0759 10LYS SC2 1388 13.811 16.566 12.980 0.2227 0.1478 0.2369 11LYS BB 1389 13.566 15.914 13.594 -0.0758 0.0801 -0.0370 11LYS SC1 1390 13.888 15.994 13.521 -0.1281 0.2300 -0.0791 11LYS SC2 1391 14.162 16.005 13.684 -0.0012 0.0443 0.0655 12LYS BB 1392 13.550 15.564 13.406 0.2446 -0.0238 -0.3143 12LYS SC1 1393 13.826 15.390 13.448 0.0525 -0.0388 -0.0198 12LYS SC2 1394 13.893 15.102 13.591 0.0355 0.2738 -0.0280 13GLY BB 1395 13.527 15.517 13.102 0.3960 -0.0208 0.0178 14LYS BB 1396 13.706 15.426 12.822 -0.0415 0.1668 0.2173 14LYS SC1 1397 13.607 15.194 12.803 0.1810 0.2669 -0.3155 14LYS SC2 1398 13.473 14.892 12.785 0.2166 0.3085 -0.1963 15GLU BB 1399 13.691 15.570 12.521 0.0131 -0.2722 -0.3036 15GLU SC1 1400 13.295 15.496 12.523 0.1392 -0.0782 0.0257 16LYS BB 1401 13.699 15.883 12.416 0.1442 0.0187 -0.0856 16LYS SC1 1402 13.379 15.991 12.508 -0.1782 -0.0533 0.1589 16LYS SC2 1403 13.424 15.842 12.812 0.3102 0.0268 -0.1976 17GLY BB 1404 13.798 15.931 12.108 -0.0595 -0.2548 0.1060 18GLY BB 1405 13.642 15.943 11.843 -0.1322 0.2764 0.0189 19LYS BB 1406 13.618 15.850 11.548 0.4151 -0.0236 0.3331 19LYS SC1 1407 13.904 15.871 11.383 0.0215 0.0169 -0.1657 19LYS SC2 1408 14.237 15.955 11.381 -0.1464 -0.2412 -0.1897 20ASN BB 1409 13.554 15.520 11.585 0.0476 0.2441 -0.1623 20ASN SC1 1410 13.759 15.285 11.621 -0.0916 0.1267 -0.1817 21ALA BB 1411 13.550 15.427 11.254 -0.2807 -0.0969 0.0130 21ALA SC1 1412 13.676 15.610 11.101 -0.5661 0.0900 -0.0059 22ILE BB 1413 13.720 15.161 11.144 -0.2049 0.2230 0.0497 22ILE SC1 1414 13.699 14.985 10.852 0.0286 0.0972 0.1059 23ASN BB 1415 14.018 15.191 11.075 0.1118 -0.1774 -0.0404 23ASN SC1 1416 14.120 14.920 11.272 -0.1262 0.0764 0.0008 24MET BB 1417 14.118 15.495 11.166 -0.0090 0.2887 -0.0495 24MET SC1 1418 14.288 15.477 11.445 -0.0737 0.0859 0.2003 25LYS BB 1419 14.063 15.732 10.959 0.0690 0.0079 -0.0473 25LYS SC1 1420 13.984 15.594 10.726 -0.0907 0.0249 0.1657 25LYS SC2 1421 14.249 15.640 10.482 -0.1861 -0.2867 0.0999 26ASP BB 1422 14.178 16.000 10.887 0.3616 0.3023 -0.2001 26ASP SC1 1423 14.427 16.144 11.018 -0.1555 -0.0656 -0.0125 27VAL BB 1424 14.282 16.119 10.601 -0.2853 -0.0016 0.0140 27VAL SC1 1425 14.483 16.285 10.470 -0.1496 -0.0683 0.1345 28LYS BB 1426 14.050 16.050 10.326 -0.3679 -0.0018 0.0200 28LYS SC1 1427 13.832 15.929 10.534 -0.0018 0.4843 0.1589 28LYS SC2 1428 13.507 15.817 10.541 0.0539 -0.3034 0.0582 29ASP BB 1429 14.162 15.858 10.058 0.2491 0.1975 0.1024 29ASP SC1 1430 14.483 15.806 10.169 -0.2447 -0.1192 0.2520 30LEU BB 1431 14.031 15.783 9.748 -0.1990 -0.0715 -0.0822 30LEU SC1 1432 14.204 15.662 9.456 -0.2385 0.0286 -0.1243 31GLY BB 1433 13.729 15.651 9.786 0.1491 -0.2236 -0.0082 32LYS BB 1434 13.778 15.328 9.835 0.1145 -0.0151 0.2769 32LYS SC1 1435 13.554 15.227 9.639 0.0102 0.0684 0.0652 32LYS SC2 1436 13.245 15.255 9.677 0.0337 0.0419 0.2782 33THR BB 1437 14.058 15.135 9.856 -0.1792 -0.0596 0.1333 33THR SC1 1438 14.168 15.270 10.106 -0.0308 -0.0988 0.0906 34MET BB 1439 14.303 15.225 9.619 0.1774 0.1712 -0.1545 34MET SC1 1440 14.457 15.533 9.828 0.0390 0.2035 0.0007 35LYS BB 1441 14.519 15.055 9.584 0.2091 -0.0693 0.0574 35LYS SC1 1442 14.808 15.168 9.497 0.0719 0.2030 0.0972 35LYS SC2 1443 15.160 15.088 9.521 0.1025 -0.0022 0.2666 36ASP BB 1444 14.618 14.823 9.742 0.1374 -0.1296 -0.0441 36ASP SC1 1445 14.521 15.006 10.018 0.0497 0.1377 -0.2500 37GLN BB 1446 14.943 14.801 9.818 0.1865 -0.1788 -0.3840 37GLN SC1 1447 14.861 14.727 10.190 -0.0319 0.0869 0.0351 38ALA BB 1448 15.147 14.529 9.764 0.2784 -0.1498 -0.0479 38ALA SC1 1449 15.395 14.619 9.823 0.0536 0.1145 0.5886 39LEU BB 1450 15.070 14.173 9.848 0.2696 0.2169 -0.0640 39LEU SC1 1451 14.913 13.900 9.669 0.0898 -0.1426 0.0446 40LYS BB 1452 14.855 14.144 10.082 0.0597 0.1717 0.0148 40LYS SC1 1453 14.686 14.375 9.931 0.2135 -0.1393 -0.3553 40LYS SC2 1454 14.339 14.467 9.855 0.0259 0.1001 -0.2618 41ASP BB 1455 14.972 14.004 10.385 -0.2951 0.0676 -0.0608 41ASP SC1 1456 14.706 13.877 10.572 0.0245 0.1856 -0.1762 42ASP BB 1457 15.266 14.030 10.521 -0.0584 -0.2736 -0.4046 42ASP SC1 1458 15.437 13.743 10.399 0.2069 0.0327 0.0884 43ASP BB 1459 15.355 14.303 10.733 0.0412 0.1125 -0.0585 43ASP SC1 1460 15.376 14.187 11.038 0.0468 0.2158 0.3144 44ALA BB 1461 15.316 14.667 10.719 -0.1178 -0.1071 0.0026 44ALA SC1 1462 15.163 14.609 10.504 -0.4321 -0.3233 0.2735 45GLU BB 1463 15.519 14.914 10.883 0.1195 -0.2096 -0.1650 45GLU SC1 1464 15.165 15.067 10.998 0.0585 -0.1997 -0.1705 46THR BB 1465 15.858 14.919 10.964 -0.0545 -0.0025 0.0142 46THR SC1 1466 16.017 14.888 10.705 -0.5320 -0.2469 -0.2623 47GLY BB 1467 16.079 14.874 11.235 0.1351 0.0600 -0.2552 48LEU BB 1468 16.375 14.854 11.214 -0.1282 -0.1138 -0.1094 48LEU SC1 1469 16.380 15.148 11.003 0.1183 -0.2539 0.0802 49THR BB 1470 16.594 14.856 11.476 -0.0666 -0.1867 -0.2723 49THR SC1 1471 16.650 15.130 11.598 -0.3295 -0.3142 0.1582 50ASP BB 1472 16.702 14.614 11.600 -0.2258 -0.0056 0.3266 50ASP SC1 1473 16.905 14.783 11.814 -0.0708 -0.3807 -0.2500 51GLY BB 1474 16.568 14.312 11.685 -0.2432 -0.1537 0.0332 52GLU BB 1475 16.637 14.095 11.412 0.0560 -0.0848 0.1220 52GLU SC1 1476 16.875 13.819 11.575 -0.2224 -0.0503 0.0626 53GLU BB 1477 16.690 14.134 11.108 -0.1322 0.1318 -0.0631 53GLU SC1 1478 16.793 14.474 11.047 0.2162 0.2321 -0.2267 54LYS BB 1479 16.893 13.958 10.980 -0.0629 -0.2276 0.0159 54LYS SC1 1480 17.152 14.104 10.872 0.1485 -0.1977 -0.0618 54LYS SC2 1481 17.071 14.443 10.691 0.0399 0.2541 0.0671 55GLU BB 1482 16.735 13.754 10.799 -0.1505 0.3438 0.0060 55GLU SC1 1483 16.836 13.374 10.864 -0.0050 0.2481 0.3223 56GLU BB 1484 16.428 13.678 10.710 0.0407 -0.1252 -0.2326 56GLU SC1 1485 16.469 13.356 10.516 0.1211 0.1404 0.2401 57PRO BB 1486 16.367 13.850 10.481 0.4493 -0.1577 -0.0485 57PRO SC1 1487 16.131 14.045 10.668 0.0525 -0.1844 -0.2577 58LYS BB 1488 16.324 13.699 10.191 -0.2431 0.1918 0.3052 58LYS SC1 1489 16.116 13.923 10.155 -0.0545 0.0314 0.1404 58LYS SC2 1490 16.086 14.196 9.948 0.1090 0.0266 0.2642 59GLU BB 1491 16.438 13.817 9.905 0.1005 -0.0328 -0.3448 59GLU SC1 1492 16.514 14.168 10.074 -0.1707 0.0417 -0.4796 60GLU BB 1493 16.253 13.898 9.639 0.0677 0.2498 0.3167 60GLU SC1 1494 16.466 13.872 9.359 -0.1305 -0.0227 0.1700 61GLU BB 1495 15.980 13.899 9.445 -0.4597 -0.1683 0.0443 61GLU SC1 1496 15.847 13.531 9.472 0.0343 -0.1040 0.2670 1LYS BB 1497 10.110 6.480 9.468 0.1267 0.1889 -0.1091 1LYS SC1 1498 10.201 6.439 9.747 -0.0573 0.3045 -0.1151 1LYS SC2 1499 10.365 6.586 10.032 -0.0058 0.0099 -0.1115 2LYS BB 1500 10.020 6.814 9.527 -0.0754 0.3929 0.0894 2LYS SC1 1501 9.685 6.783 9.620 -0.0840 0.2393 -0.0516 2LYS SC2 1502 9.421 6.523 9.620 -0.1069 -0.1005 0.0027 3CYS BB 1503 10.171 6.935 9.756 0.2035 0.1617 -0.0867 3CYS SC1 1504 9.898 6.905 9.935 0.3789 -0.1030 0.3728 4LEU BB 1505 10.225 7.247 9.875 0.1755 0.2294 -0.0014 4LEU SC1 1506 10.316 7.103 10.157 0.4378 0.2707 0.1006 5PHE BB 1507 10.088 7.546 9.847 -0.0601 -0.2852 0.1404 5PHE SC1 1508 10.293 7.770 9.873 0.1013 0.0176 -0.2327 5PHE SC2 1509 10.258 8.108 9.902 -0.6620 -0.0280 -0.3993 5PHE SC3 1510 10.304 8.011 9.632 0.1217 -0.0371 -0.2868 6LYS BB 1511 9.920 7.714 9.563 -0.0958 0.1093 -0.1439 6LYS SC1 1512 9.765 7.940 9.742 0.2898 -0.1367 -0.0958 6LYS SC2 1513 9.728 7.981 10.074 -0.2216 0.1975 0.0370 7LYS BB 1514 9.897 7.624 9.227 0.0225 0.1702 0.0063 7LYS SC1 1515 9.609 7.578 9.199 -0.3433 0.0558 -0.3700 7LYS SC2 1516 9.451 7.401 8.946 0.0124 0.1928 -0.3509 8LYS BB 1517 10.059 7.523 9.005 -0.2686 -0.2785 -0.1225 8LYS SC1 1518 9.969 7.727 8.736 0.0999 0.1299 -0.0159 8LYS SC2 1519 10.135 7.549 8.491 -0.1302 -0.0072 0.2190 9ASN BB 1520 10.376 7.584 8.883 0.0243 0.0760 -0.0470 9ASN SC1 1521 10.460 7.859 9.049 -0.4918 0.0315 -0.1922 10LYS BB 1522 10.621 7.373 8.892 0.2351 -0.0005 -0.0883 10LYS SC1 1523 10.580 7.328 9.225 -0.0883 -0.4366 -0.0538 10LYS SC2 1524 10.491 7.189 9.506 0.1821 0.0002 -0.1993 11LYS BB 1525 10.959 7.421 8.775 0.2088 -0.0921 -0.4526 11LYS SC1 1526 10.993 7.765 8.829 -0.1770 0.2772 0.0910 11LYS SC2 1527 10.907 8.041 8.977 -0.0884 0.3114 0.0411 12LYS BB 1528 11.273 7.283 8.856 0.3178 -0.2363 -0.2369 12LYS SC1 1529 11.337 7.459 9.133 -0.4156 0.2757 -0.3220 12LYS SC2 1530 11.392 7.575 9.497 -0.2382 -0.2006 -0.4062 13GLY BB 1531 11.174 7.050 9.070 -0.2275 0.2841 -0.1751 14LYS BB 1532 10.882 7.025 9.136 -0.0251 -0.1583 -0.1685 14LYS SC1 1533 10.686 6.954 8.923 -0.3610 0.1046 0.0039 14LYS SC2 1534 10.458 6.853 8.696 0.0434 0.1130 -0.1293 15GLU BB 1535 10.865 6.668 9.179 -0.1690 0.2037 0.0039 15GLU SC1 1536 10.546 6.744 9.413 -0.0023 0.1899 -0.3398 16LYS BB 1537 11.034 6.388 9.026 -0.2205 0.0599 -0.2149 16LYS SC1 1538 11.120 6.565 8.770 -0.0397 0.0248 0.2152 16LYS SC2 1539 11.291 6.634 8.465 -0.3460 0.2326 -0.0246 17GLY BB 1540 10.980 6.063 9.087 -0.1077 0.0646 0.0944 18GLY BB 1541 11.041 5.873 9.369 0.3745 -0.1397 0.0937 19LYS BB 1542 11.119 6.214 9.552 0.4845 -0.1133 -0.0677 19LYS SC1 1543 11.377 6.325 9.467 0.0331 -0.3292 -0.0205 19LYS SC2 1544 11.535 6.384 9.191 0.1406 -0.4125 0.1940 20ASN BB 1545 10.990 6.495 9.704 0.0403 0.0538 -0.1458 20ASN SC1 1546 11.343 6.655 9.801 0.0102 0.0256 0.0049 21ALA BB 1547 10.950 6.488 10.020 -0.1330 0.0995 -0.1954 21ALA SC1 1548 10.734 6.443 10.174 0.1262 -0.0550 0.1367 22ILE BB 1549 11.103 6.273 10.187 0.0873 -0.1336 0.4494 22ILE SC1 1550 11.317 6.534 10.235 0.0394 0.0146 -0.0776 23ASN BB 1551 11.018 6.023 10.417 -0.0234 -0.2147 0.2202 23ASN SC1 1552 10.682 6.051 10.408 -0.1409 0.1088 -0.2632 24MET BB 1553 11.098 5.695 10.283 0.0161 -0.0814 -0.1631 24MET SC1 1554 10.761 5.608 10.190 0.0375 -0.2712 0.0372 25LYS BB 1555 11.284 5.439 10.399 0.0986 -0.2901 -0.0154 25LYS SC1 1556 11.474 5.360 10.161 0.1034 -0.0299 0.3707 25LYS SC2 1557 11.421 5.600 9.942 0.2296 0.2502 0.0271 26ASP BB 1558 11.261 5.282 10.644 0.0680 0.1246 -0.1589 26ASP SC1 1559 10.956 5.161 10.749 -0.3225 0.3740 0.0778 27VAL BB 1560 11.324 5.443 10.916 -0.1038 -0.0133 -0.2582 27VAL SC1 1561 11.553 5.266 10.948 -0.1524 -0.0622 -0.1788 28LYS BB 1562 11.077 5.585 11.085 0.0367 -0.1325 -0.0095 28LYS SC1 1563 10.998 5.460 11.355 0.0937 0.1473 0.2718 28LYS SC2 1564 10.976 5.108 11.333 -0.0833 -0.1139 0.0627 29ASP BB 1565 11.304 5.737 11.291 0.1352 -0.1353 -0.0250 29ASP SC1 1566 11.442 5.908 11.027 0.3755 -0.0607 0.0991 30LEU BB 1567 11.484 5.620 11.534 -0.0999 -0.0313 -0.2373 30LEU SC1 1568 11.379 5.627 11.925 -0.0321 0.0475 -0.2180 31GLY BB 1569 11.472 5.342 11.405 0.1315 -0.0846 0.1012 32LYS BB 1570 11.639 5.127 11.618 0.2266 -0.0753 0.3124 32LYS SC1 1571 11.889 5.275 11.496 0.0574 -0.2913 0.3332 32LYS SC2 1572 12.197 5.325 11.310 -0.2764 -0.0843 0.2358 33THR BB 1573 11.693 4.811 11.668 0.0835 -0.2261 0.0776 33THR SC1 1574 11.558 4.679 11.428 0.0325 0.3527 -0.2284 34MET BB 1575 11.575 4.585 11.889 0.0043 -0.1714 0.0373 34MET SC1 1576 11.813 4.269 11.723 0.2080 -0.0437 -0.1958 35LYS BB 1577 11.616 4.571 12.216 0.2511 -0.0809 0.1320 35LYS SC1 1578 11.893 4.429 12.250 -0.1116 -0.0435 -0.2781 35LYS SC2 1579 12.067 4.283 12.485 -0.1740 0.0879 -0.2132 36ASP BB 1580 11.391 4.770 12.326 -0.0514 0.0180 -0.0516 36ASP SC1 1581 11.558 4.995 12.486 -0.2024 0.1688 -0.0383 37GLN BB 1582 11.123 4.928 12.173 -0.2669 -0.3294 -0.1117 37GLN SC1 1583 10.753 4.748 12.167 -0.7108 0.1164 0.1423 38ALA BB 1584 10.934 5.148 12.243 0.0990 -0.0731 -0.0364 38ALA SC1 1585 10.841 5.096 12.491 0.2005 0.0197 0.0216 39LEU BB 1586 10.866 5.488 12.145 0.2090 0.0159 0.0865 39LEU SC1 1587 11.078 5.759 12.172 0.2451 -0.1241 0.0421 40LYS BB 1588 10.734 5.556 11.805 -0.0589 -0.0364 -0.0932 40LYS SC1 1589 10.895 5.735 11.666 -0.0305 -0.2950 -0.1841 40LYS SC2 1590 10.895 6.012 11.425 0.1758 0.0942 -0.2334 41ASP BB 1591 10.617 5.320 11.597 -0.1030 0.0283 -0.2690 41ASP SC1 1592 10.805 5.071 11.760 -0.0319 0.0665 -0.1498 42ASP BB 1593 10.297 5.259 11.640 0.1374 -0.2547 -0.0437 42ASP SC1 1594 10.144 5.460 11.851 -0.0682 -0.4556 -0.3943 43ASP BB 1595 10.194 5.287 11.312 0.2141 0.0756 -0.0306 43ASP SC1 1596 10.112 4.950 11.292 0.2477 -0.3571 -0.2664 44ALA BB 1597 9.950 5.438 11.149 -0.1339 0.0084 0.0705 44ALA SC1 1598 9.819 5.359 10.927 -0.1652 -0.0082 0.0950 45GLU BB 1599 9.823 5.728 11.111 -0.0226 -0.1772 0.2155 45GLU SC1 1600 9.501 5.718 10.907 -0.0958 0.0469 -0.1268 46THR BB 1601 10.051 5.964 11.178 0.0178 0.1546 0.1870 46THR SC1 1602 9.968 6.144 11.410 -0.5896 0.3135 -0.1324 47GLY BB 1603 10.105 6.189 10.974 0.1908 0.1602 -0.0449 48LEU BB 1604 10.351 6.495 11.024 -0.0671 0.1978 -0.1138 48LEU SC1 1605 10.420 6.662 10.684 -0.1137 0.2512 -0.1144 49THR BB 1606 10.188 6.716 11.208 0.0535 0.0002 0.1918 49THR SC1 1607 9.907 6.596 11.198 0.1191 -0.1401 -0.1047 50ASP BB 1608 10.289 7.049 11.155 -0.2051 -0.0842 -0.0321 50ASP SC1 1609 10.135 7.093 11.428 -0.1536 -0.0517 0.0751 51GLY BB 1610 10.552 7.213 11.252 -0.1191 -0.0436 -0.5178 52GLU BB 1611 10.603 7.475 11.425 -0.1645 0.2650 -0.1219 52GLU SC1 1612 10.276 7.624 11.380 -0.2069 -0.2189 -0.3671 53GLU BB 1613 10.912 7.557 11.383 0.1366 0.1404 -0.0699 53GLU SC1 1614 10.917 7.457 11.001 -0.0717 0.0348 0.1427 54LYS BB 1615 11.165 7.502 11.573 0.0406 -0.2426 0.0539 54LYS SC1 1616 11.388 7.679 11.455 0.2364 0.2380 -0.0156 54LYS SC2 1617 11.667 7.761 11.280 0.0762 -0.0512 -0.2045 55GLU BB 1618 11.005 7.301 11.805 -0.1326 0.0693 -0.3432 55GLU SC1 1619 11.288 7.012 11.797 -0.1938 0.1768 -0.0969 56GLU BB 1620 10.785 7.418 12.013 0.1914 0.0786 0.1821 56GLU SC1 1621 10.575 7.123 12.219 0.1433 -0.2438 -0.1364 57PRO BB 1622 10.853 7.727 11.815 -0.2720 0.2047 0.2773 57PRO SC1 1623 11.145 7.799 11.994 -0.0003 -0.3011 0.3926 58LYS BB 1624 10.592 7.873 11.681 -0.2464 0.2856 0.2178 58LYS SC1 1625 10.467 7.870 11.985 0.2060 0.0796 -0.1928 58LYS SC2 1626 10.195 7.915 12.198 0.0053 0.0054 0.2037 59GLU BB 1627 10.685 8.165 11.508 0.0642 0.0192 -0.0992 59GLU SC1 1628 11.042 8.002 11.530 0.1083 -0.2455 -0.1494 60GLU BB 1629 10.464 8.379 11.647 0.1134 0.1318 0.1911 60GLU SC1 1630 10.640 8.615 11.914 -0.3217 -0.2349 -0.0432 61GLU BB 1631 10.229 8.492 11.409 -0.1349 -0.2136 -0.1408 61GLU SC1 1632 10.498 8.401 11.112 -0.0055 0.1009 0.1400 1LYS BB 1633 5.941 14.602 20.383 0.0060 0.3949 0.1476 1LYS SC1 1634 5.732 14.484 20.127 0.3492 -0.2667 0.5004 1LYS SC2 1635 5.471 14.696 20.047 0.0025 0.0217 0.1466 2LYS BB 1636 5.804 14.524 20.686 -0.0390 -0.0635 -0.2380 2LYS SC1 1637 5.649 14.753 20.847 0.4248 0.3714 0.0673 2LYS SC2 1638 5.534 15.113 20.896 -0.1551 -0.2351 -0.1088 3CYS BB 1639 6.073 14.302 20.798 0.3469 -0.0067 -0.1403 3CYS SC1 1640 6.048 14.129 20.524 0.1895 -0.1026 -0.0039 4LEU BB 1641 6.422 14.418 20.700 0.1691 0.0134 -0.0307 4LEU SC1 1642 6.468 14.676 20.905 0.4232 0.2537 0.2527 5PHE BB 1643 6.593 14.120 20.682 0.4480 -0.1051 -0.0665 5PHE SC1 1644 6.760 14.091 20.419 0.0041 0.1872 -0.1480 5PHE SC2 1645 6.954 13.889 20.226 0.2341 0.2769 -0.0158 5PHE SC3 1646 7.097 14.046 20.423 0.0452 0.4827 -0.0392 6LYS BB 1647 6.515 13.901 20.878 0.2192 -0.0325 -0.1829 6LYS SC1 1648 6.236 13.853 20.685 0.0293 -0.2692 -0.0499 6LYS SC2 1649 5.961 13.732 20.442 -0.2952 -0.0688 0.0125 7LYS BB 1650 6.734 13.835 21.080 -0.0363 0.0037 -0.0374 7LYS SC1 1651 6.602 13.734 21.396 -0.1152 -0.1180 0.3169 7LYS SC2 1652 6.682 13.663 21.729 0.1256 0.0830 0.1564 8LYS BB 1653 7.015 13.987 20.977 0.1303 0.1673 -0.0817 8LYS SC1 1654 7.325 13.897 20.797 0.2810 0.0218 -0.0014 8LYS SC2 1655 7.593 13.674 20.776 -0.0941 -0.3084 0.0078 9ASN BB 1656 7.132 14.231 21.119 0.1963 0.3935 0.0806 9ASN SC1 1657 7.448 14.348 20.986 0.1188 0.2803 0.0632 10LYS BB 1658 7.099 14.328 21.389 -0.2225 0.4083 -0.2095 10LYS SC1 1659 7.373 14.218 21.483 0.1465 -0.2751 -0.1504 10LYS SC2 1660 7.696 14.287 21.555 -0.0245 -0.2583 -0.0745 11LYS BB 1661 7.041 14.563 21.535 0.0125 -0.1285 -0.2137 11LYS SC1 1662 6.725 14.551 21.547 0.1941 -0.0457 0.3218 11LYS SC2 1663 6.423 14.503 21.523 0.3494 0.2096 0.1114 12LYS BB 1664 6.989 14.897 21.454 -0.0379 0.3447 0.0834 12LYS SC1 1665 6.943 15.100 21.689 0.6427 -0.0482 -0.1841 12LYS SC2 1666 6.817 15.406 21.776 0.2436 -0.3117 0.2683 13GLY BB 1667 7.172 14.973 21.240 -0.2372 -0.2239 -0.1381 14LYS BB 1668 7.300 15.227 21.058 0.3092 0.3127 -0.0027 14LYS SC1 1669 7.252 15.228 20.712 -0.2692 0.0031 0.1733 14LYS SC2 1670 7.486 15.095 20.499 0.2433 -0.0562 0.0280 15GLU BB 1671 7.554 15.344 21.078 -0.0182 0.4097 -0.0563 15GLU SC1 1672 7.784 15.103 20.836 0.0729 0.1254 -0.1527 16LYS BB 1673 7.723 15.227 21.387 -0.1164 -0.1289 -0.2188 16LYS SC1 1674 7.892 15.440 21.546 0.0857 -0.2230 -0.0328 16LYS SC2 1675 7.664 15.720 21.540 -0.1439 0.2430 -0.0353 17GLY BB 1676 7.817 14.967 21.285 0.2182 0.0024 0.1407 18GLY BB 1677 8.069 14.864 21.096 -0.3576 -0.0426 -0.0086 19LYS BB 1678 8.336 14.796 21.300 -0.1284 0.1050 0.1261 19LYS SC1 1679 8.379 14.485 21.274 -0.0352 0.4787 -0.1794 19LYS SC2 1680 8.612 14.244 21.317 -0.0269 -0.2083 -0.0669 20ASN BB 1681 8.335 15.017 21.580 -0.3545 0.0798 -0.0426 20ASN SC1 1682 8.729 15.046 21.527 -0.1018 0.1949 0.0419 21ALA BB 1683 8.330 14.854 21.896 0.2121 0.2347 0.1180 21ALA SC1 1684 8.473 15.078 21.943 0.2602 0.2577 -0.1240 22ILE BB 1685 8.098 14.973 22.009 0.2027 0.0864 -0.0841 22ILE SC1 1686 7.927 15.073 21.731 -0.2369 0.2143 0.2214 23ASN BB 1687 7.972 15.174 22.257 0.0688 -0.0489 -0.0544 23ASN SC1 1688 8.014 15.518 22.282 0.0545 0.1681 -0.1097 24MET BB 1689 7.971 15.172 22.559 0.0694 0.2537 -0.0616 24MET SC1 1690 7.911 14.799 22.600 0.0801 0.1053 -0.1729 25LYS BB 1691 7.942 15.466 22.744 0.1043 -0.2642 0.1055 25LYS SC1 1692 8.268 15.514 22.724 -0.0162 0.0090 0.3214 25LYS SC2 1693 8.313 15.524 23.056 -0.1795 0.0096 0.2127 26ASP BB 1694 7.842 15.755 22.644 0.3425 -0.2806 0.5368 26ASP SC1 1695 7.982 15.986 22.393 -0.0311 0.3949 -0.3391 27VAL BB 1696 7.996 15.921 22.929 0.0358 0.2336 0.1617 27VAL SC1 1697 7.824 16.134 23.031 -0.0426 0.0878 0.3402 28LYS BB 1698 8.294 15.992 22.869 -0.5566 -0.1172 -0.1454 28LYS SC1 1699 8.399 15.868 22.538 -0.1880 0.0061 0.1254 28LYS SC2 1700 8.342 15.841 22.193 -0.1603 0.2572 -0.0150 29ASP BB 1701 8.608 15.939 23.043 -0.1780 0.1458 -0.0542 29ASP SC1 1702 8.455 15.811 23.327 0.0812 -0.0373 0.2206 30LEU BB 1703 8.801 15.688 23.034 -0.1175 0.3451 -0.0913 30LEU SC1 1704 8.846 15.634 22.660 0.1859 -0.0034 -0.0226 31GLY BB 1705 8.722 15.366 23.212 -0.2279 -0.0067 -0.2794 32LYS BB 1706 8.936 15.111 23.221 -0.1060 0.4631 0.4882 32LYS SC1 1707 8.831 14.862 23.018 0.0902 0.1833 -0.2320 32LYS SC2 1708 8.527 14.783 22.893 -0.1062 -0.2721 0.4256 33THR BB 1709 9.100 15.102 23.418 -0.1456 0.2921 0.1880 33THR SC1 1710 9.017 14.853 23.572 0.3168 -0.1456 -0.2313 34MET BB 1711 9.167 15.309 23.657 -0.3797 0.0572 -0.3903 34MET SC1 1712 9.111 15.122 24.029 0.0632 -0.1521 0.2955 35LYS BB 1713 9.444 15.466 23.605 -0.3254 -0.2789 -0.0987 35LYS SC1 1714 9.507 15.585 23.913 -0.3239 0.0794 0.0613 35LYS SC2 1715 9.483 15.896 23.972 -0.2187 -0.3440 -0.1325 36ASP BB 1716 9.369 15.766 23.546 -0.0507 -0.0243 -0.2345 36ASP SC1 1717 9.115 15.803 23.785 0.2700 0.1944 0.1543 37GLN BB 1718 9.253 15.935 23.307 -0.1064 0.1277 -0.0685 37GLN SC1 1719 8.904 16.072 23.433 -0.2104 0.1189 0.1532 38ALA BB 1720 9.300 15.897 22.960 -0.3371 0.0232 0.0179 38ALA SC1 1721 9.067 15.869 22.828 -0.2135 -0.1672 -0.1658 39LEU BB 1722 9.469 15.785 22.745 0.0010 0.3540 -0.1266 39LEU SC1 1723 9.233 15.760 22.463 -0.2303 0.2239 -0.1804 40LYS BB 1724 9.790 15.711 22.830 0.1500 -0.2043 -0.1084 40LYS SC1 1725 9.823 15.383 22.853 -0.1194 0.1348 0.2256 40LYS SC2 1726 9.962 15.134 22.989 0.0299 -0.1376 0.2553 41ASP BB 1727 9.990 15.983 22.917 -0.1216 0.0002 -0.1342 41ASP SC1 1728 9.854 16.121 22.665 0.3260 -0.0664 0.1222 42ASP BB 1729 10.253 15.815 23.105 -0.0126 -0.1600 -0.2576 42ASP SC1 1730 10.244 15.518 22.937 0.0936 0.2270 0.0607 43ASP BB 1731 10.495 16.051 23.174 0.1266 -0.2271 0.3500 43ASP SC1 1732 10.625 15.839 23.407 -0.1533 -0.0454 -0.0114 44ALA BB 1733 10.433 16.305 22.994 -0.0132 -0.0891 0.3387 44ALA SC1 1734 10.679 16.416 23.003 0.0301 -0.1508 0.0092 45GLU BB 1735 10.229 16.438 22.806 0.3287 0.0966 0.1835 45GLU SC1 1736 10.203 16.323 22.424 -0.0163 -0.1008 0.0322 46THR BB 1737 9.951 16.520 22.883 -0.3207 -0.1126 0.1364 46THR SC1 1738 9.829 16.792 22.945 -0.2859 -0.1311 0.2900 47GLY BB 1739 9.816 16.573 22.546 -0.0225 -0.1397 0.0429 48LEU BB 1740 9.925 16.887 22.428 -0.1178 0.0068 0.0270 48LEU SC1 1741 9.727 16.774 22.125 -0.1085 -0.5264 -0.1447 49THR BB 1742 10.274 16.865 22.500 0.3762 0.1625 0.0825 49THR SC1 1743 10.396 16.869 22.779 0.1783 0.0030 0.1741 50ASP BB 1744 10.448 16.974 22.237 -0.0591 -0.2301 -0.1435 50ASP SC1 1745 10.293 17.275 22.354 0.1837 0.0036 0.1256 51GLY BB 1746 10.441 16.964 21.897 0.0917 -0.1255 -0.2282 52GLU BB 1747 10.557 16.767 21.750 0.3548 0.2593 -0.0433 52GLU SC1 1748 10.225 16.724 21.578 0.1686 0.0485 0.0572 53GLU BB 1749 10.871 16.727 21.637 0.0579 -0.2246 0.0347 53GLU SC1 1750 10.902 16.357 21.573 0.2654 0.1560 0.0921 54LYS BB 1751 11.184 16.867 21.657 0.0730 -0.1068 0.1363 54LYS SC1 1752 11.102 17.073 21.826 -0.0660 -0.1615 0.4391 54LYS SC2 1753 10.784 17.214 21.806 0.2506 0.0354 -0.0042 55GLU BB 1754 11.266 17.069 21.426 -0.1735 0.1715 -0.2580 55GLU SC1 1755 11.520 16.804 21.230 0.0195 0.1886 0.0604 56GLU BB 1756 11.549 17.274 21.411 0.0684 0.0556 -0.1957 56GLU SC1 1757 11.538 17.377 21.057 -0.1031 0.1216 -0.0838 57PRO BB 1758 11.710 17.312 21.718 0.0339 -0.1496 0.1426 57PRO SC1 1759 11.934 17.426 21.511 -0.0259 0.2202 0.1740 58LYS BB 1760 11.591 17.538 21.893 0.1125 -0.0047 0.0064 58LYS SC1 1761 11.816 17.624 22.129 0.3293 -0.1844 0.1494 58LYS SC2 1762 11.894 17.607 22.478 0.2423 0.4246 0.0534 59GLU BB 1763 11.351 17.495 22.109 0.1299 -0.2522 0.3131 59GLU SC1 1764 11.466 17.429 22.482 -0.1769 0.1021 0.4432 60GLU BB 1765 11.212 17.776 22.105 -0.2258 0.1791 0.1692 60GLU SC1 1766 10.904 17.755 21.906 -0.2322 0.1711 0.0982 61GLU BB 1767 11.300 18.069 21.998 -0.0677 -0.0321 0.0066 61GLU SC1 1768 11.661 18.090 21.886 0.1606 0.2766 -0.0515 1LYS BB 1769 9.737 15.158 19.377 -0.1486 -0.2815 0.1590 1LYS SC1 1770 9.493 15.359 19.330 0.3215 0.0139 -0.1970 1LYS SC2 1771 9.355 15.694 19.258 -0.1246 0.4446 -0.0574 2LYS BB 1772 9.865 15.315 19.705 0.3350 0.3149 -0.0120 2LYS SC1 1773 9.713 15.237 19.973 -0.1995 -0.3841 -0.5488 2LYS SC2 1774 9.430 15.347 20.140 -0.3585 0.3435 0.0493 3CYS BB 1775 10.109 15.534 19.685 -0.2250 0.2443 0.1551 3CYS SC1 1776 10.156 15.464 20.020 0.2225 -0.2001 -0.1423 4LEU BB 1777 10.444 15.404 19.741 -0.2423 -0.0031 -0.1232 4LEU SC1 1778 10.323 15.146 19.525 -0.0874 0.1130 0.3075 5PHE BB 1779 10.755 15.342 19.577 -0.0331 -0.2623 -0.1845 5PHE SC1 1780 10.957 15.629 19.492 0.1289 -0.2621 0.1029 5PHE SC2 1781 11.025 15.691 19.819 0.0326 -0.1636 0.1052 5PHE SC3 1782 10.832 15.869 19.698 0.2111 -0.0779 -0.0585 6LYS BB 1783 10.987 15.138 19.603 0.2556 -0.0981 -0.0173 6LYS SC1 1784 11.193 15.285 19.778 -0.2255 0.2382 0.4972 6LYS SC2 1785 11.276 15.511 20.060 0.1662 0.2332 0.2049 7LYS BB 1786 11.127 15.110 19.270 -0.1826 -0.0050 0.0250 7LYS SC1 1787 10.893 15.261 19.066 -0.0022 0.3029 0.1423 7LYS SC2 1788 10.809 15.485 18.807 -0.0585 -0.0498 -0.2062 8LYS BB 1789 11.223 14.858 19.015 0.0493 0.0989 0.0871 8LYS SC1 1790 10.946 14.731 18.995 -0.2022 0.1112 -0.0244 8LYS SC2 1791 10.698 14.494 19.069 0.0219 0.0405 -0.1289 9ASN BB 1792 11.364 14.573 19.135 -0.2944 -0.0049 0.0254 9ASN SC1 1793 11.176 14.390 18.920 -0.2748 0.1296 0.0631 10LYS BB 1794 11.272 14.357 19.377 -0.4224 -0.1060 0.3077 10LYS SC1 1795 11.406 14.105 19.179 0.4725 -0.1000 -0.0593 10LYS SC2 1796 11.695 13.976 19.283 0.2299 0.0685 0.0642 11LYS BB 1797 11.359 14.121 19.600 -0.2019 -0.0366 -0.3247 11LYS SC1 1798 11.287 13.821 19.595 0.2774 -0.3233 -0.0456 11LYS SC2 1799 11.122 13.561 19.721 -0.2767 -0.1713 0.0438 12LYS BB 1800 11.667 14.052 19.745 0.0003 0.2491 -0.0657 12LYS SC1 1801 11.901 14.238 19.790 -0.2775 -0.2418 0.0439 12LYS SC2 1802 12.187 14.153 19.972 0.4894 -0.2191 0.2935 13GLY BB 1803 11.746 14.015 20.071 0.1966 0.2939 0.1013 14LYS BB 1804 11.943 13.764 20.186 0.1468 -0.0101 0.1104 14LYS SC1 1805 11.867 13.861 20.501 0.1020 -0.2333 0.3434 14LYS SC2 1806 11.962 14.062 20.802 0.1874 0.2427 0.1371 15GLU BB 1807 12.164 13.586 20.061 -0.3508 -0.0052 -0.0903 15GLU SC1 1808 12.067 13.721 19.696 0.1396 -0.0641 -0.1683 16LYS BB 1809 12.333 13.344 20.093 -0.0016 0.1961 -0.0023 16LYS SC1 1810 12.109 13.178 20.289 -0.2655 -0.6253 -0.0661 16LYS SC2 1811 11.957 13.042 20.570 -0.3725 0.0517 0.2016 17GLY BB 1812 12.654 13.213 20.155 0.2564 0.0733 -0.4134 18GLY BB 1813 12.893 13.425 20.053 -0.0730 0.2237 0.3519 19LYS BB 1814 13.121 13.208 19.963 -0.0168 0.1092 0.0474 19LYS SC1 1815 12.989 13.174 19.687 0.4853 0.2714 0.3548 19LYS SC2 1816 12.848 13.272 19.337 -0.0332 0.2114 -0.2962 20ASN BB 1817 13.378 13.399 19.843 -0.0269 -0.2036 -0.2036 20ASN SC1 1818 13.145 13.534 19.601 -0.1684 0.0443 0.0691 21ALA BB 1819 13.552 13.691 19.920 0.1548 0.1508 0.3613 21ALA SC1 1820 13.539 13.616 20.179 0.3596 -0.2027 0.2773 22ILE BB 1821 13.830 13.742 19.839 0.1177 0.0065 -0.2031 22ILE SC1 1822 13.896 13.578 20.131 -0.2802 0.2136 0.0105 23ASN BB 1823 14.038 13.725 19.573 0.0077 0.1808 0.0379 23ASN SC1 1824 14.238 13.451 19.707 -0.1514 -0.1551 0.3201 24MET BB 1825 14.307 13.909 19.442 0.0996 0.2083 0.3573 24MET SC1 1826 14.229 13.923 19.161 -0.2449 -0.2775 0.0269 25LYS BB 1827 14.618 13.785 19.440 -0.0857 0.0829 0.0829 25LYS SC1 1828 14.623 13.948 19.740 0.1440 0.1987 -0.1354 25LYS SC2 1829 14.766 13.896 20.064 -0.0129 0.2469 0.1933 26ASP BB 1830 14.984 13.901 19.491 -0.1002 -0.1800 0.0188 26ASP SC1 1831 15.086 14.025 19.778 0.2151 -0.2655 -0.0921 27VAL BB 1832 15.072 14.182 19.311 0.3283 0.0516 0.1496 27VAL SC1 1833 14.886 14.076 19.112 0.2166 0.2642 0.1374 28LYS BB 1834 15.233 14.390 19.365 -0.0371 0.1086 0.1115 28LYS SC1 1835 15.049 14.504 19.582 -0.0056 -0.2223 -0.0868 28LYS SC2 1836 15.241 14.759 19.830 0.0192 -0.0847 -0.1195 29ASP BB 1837 15.267 14.600 19.111 -0.3561 0.3166 0.1159 29ASP SC1 1838 15.516 14.645 18.918 0.2048 0.0438 -0.1684 30LEU BB 1839 15.041 14.791 18.973 -0.2966 -0.1403 0.0288 30LEU SC1 1840 14.826 14.564 19.169 -0.2780 -0.0184 0.2023 31GLY BB 1841 14.964 15.074 19.108 0.0316 -0.2058 -0.4022 32LYS BB 1842 14.797 15.206 18.886 -0.2010 -0.0245 0.1148 32LYS SC1 1843 14.503 15.174 18.993 -0.0661 0.0720 0.0531 32LYS SC2 1844 14.201 15.126 19.106 0.2427 -0.2512 -0.4006 33THR BB 1845 14.856 15.226 18.511 -0.3657 -0.0684 -0.1995 33THR SC1 1846 14.596 15.203 18.353 -0.3508 0.1264 -0.2556 34MET BB 1847 15.200 15.225 18.443 -0.3331 0.1071 0.0393 34MET SC1 1848 15.221 14.853 18.476 -0.2195 0.1916 -0.0841 35LYS BB 1849 15.405 15.450 18.363 -0.0071 0.0761 -0.0513 35LYS SC1 1850 15.650 15.338 18.560 -0.3262 -0.2068 -0.1317 35LYS SC2 1851 15.860 15.282 18.833 0.0458 -0.1788 -0.1401 36ASP BB 1852 15.244 15.585 18.101 0.1468 0.0011 0.0487 36ASP SC1 1853 14.958 15.422 18.081 0.3106 0.0850 -0.3473 37GLN BB 1854 15.198 15.852 18.044 -0.4670 0.0520 -0.0903 37GLN SC1 1855 14.832 15.890 17.915 0.1654 0.1867 0.0110 38ALA BB 1856 15.366 16.083 18.299 -0.2102 0.3823 0.1863 38ALA SC1 1857 15.472 16.321 18.228 0.3005 0.1083 -0.0252 39LEU BB 1858 15.131 16.192 18.529 -0.1497 -0.0423 0.0953 39LEU SC1 1859 15.251 16.510 18.526 -0.0346 0.1901 -0.3490 40LYS BB 1860 15.124 16.162 18.840 0.2474 0.0148 -0.3666 40LYS SC1 1861 15.339 16.361 18.969 0.3411 0.2320 -0.0298 40LYS SC2 1862 15.588 16.235 19.192 0.1697 0.0643 0.2416 41ASP BB 1863 15.141 15.905 19.064 0.1695 0.0869 0.1631 41ASP SC1 1864 15.224 16.112 19.368 -0.0871 -0.1497 -0.1366 42ASP BB 1865 15.337 15.671 19.093 0.0504 0.2327 -0.0617 42ASP SC1 1866 15.160 15.443 19.227 0.3602 -0.2924 0.1254 43ASP BB 1867 15.562 15.651 18.847 0.0462 -0.0780 0.0413 43ASP SC1 1868 15.368 15.794 18.612 0.5056 -0.0947 -0.2106 44ALA BB 1869 15.768 15.874 19.024 0.0148 -0.1991 -0.2200 44ALA SC1 1870 15.685 15.799 19.270 0.2719 -0.3289 -0.1694 45GLU BB 1871 16.052 15.892 18.941 -0.0314 -0.2763 -0.3204 45GLU SC1 1872 16.134 15.533 19.109 0.1930 -0.1258 0.0629 46THR BB 1873 16.091 16.202 18.932 0.2137 -0.1509 -0.1772 46THR SC1 1874 16.286 16.352 19.112 -0.0178 -0.1633 0.0912 47GLY BB 1875 16.153 16.415 18.681 -0.5266 -0.1136 0.1837 48LEU BB 1876 16.309 16.693 18.763 -0.0800 -0.2415 -0.2780 48LEU SC1 1877 16.621 16.726 18.697 0.0975 0.3731 0.3705 49THR BB 1878 16.189 16.830 18.979 -0.0417 -0.3331 0.0521 49THR SC1 1879 16.333 16.784 19.244 0.0868 -0.3200 -0.0145 50ASP BB 1880 15.877 16.876 18.942 0.1077 0.2122 0.3218 50ASP SC1 1881 15.767 16.559 18.922 0.0288 0.1105 0.1176 51GLY BB 1882 15.685 16.935 19.235 0.0722 0.6008 -0.3511 52GLU BB 1883 15.632 17.146 19.437 0.1153 -0.0739 -0.2223 52GLU SC1 1884 15.345 17.049 19.615 -0.1381 -0.1220 0.3137 53GLU BB 1885 15.523 17.470 19.415 -0.2678 0.1533 -0.2860 53GLU SC1 1886 15.715 17.824 19.337 0.0134 0.0565 -0.3071 54LYS BB 1887 15.204 17.566 19.261 0.0326 -0.0167 -0.0853 54LYS SC1 1888 14.972 17.572 19.452 0.3353 -0.1578 -0.0194 54LYS SC2 1889 14.756 17.603 19.726 -0.0094 0.2148 0.0975 55GLU BB 1890 15.077 17.493 18.947 0.4283 -0.0329 0.0370 55GLU SC1 1891 15.095 17.208 18.737 0.0217 -0.0427 0.3572 56GLU BB 1892 14.841 17.657 18.862 -0.2021 0.0119 -0.0557 56GLU SC1 1893 14.861 17.647 18.490 0.1149 0.0044 0.2211 57PRO BB 1894 14.857 18.006 18.819 -0.0133 -0.2652 -0.4287 57PRO SC1 1895 14.541 18.030 18.879 0.2589 0.1797 0.3131 58LYS BB 1896 15.045 18.276 18.660 -0.0771 0.2399 -0.1398 58LYS SC1 1897 15.323 18.394 18.814 -0.2962 -0.0250 0.1608 58LYS SC2 1898 15.624 18.559 18.789 0.1376 0.2917 0.1255 59GLU BB 1899 15.101 18.449 18.377 -0.1265 0.3348 -0.0271 59GLU SC1 1900 14.795 18.555 18.276 -0.1287 -0.1323 0.1384 60GLU BB 1901 15.390 18.405 18.201 -0.5523 0.0963 -0.0921 60GLU SC1 1902 15.260 18.294 17.872 -0.2887 -0.2569 -0.0712 61GLU BB 1903 15.712 18.471 18.342 0.1143 0.0900 -0.1267 61GLU SC1 1904 15.859 18.854 18.480 -0.3640 0.1502 0.0618 1LYS BB 1905 9.456 11.012 18.514 -0.1203 -0.0322 -0.2351 1LYS SC1 1906 9.174 11.164 18.509 -0.0475 0.1359 -0.2041 1LYS SC2 1907 8.869 11.321 18.505 0.0787 0.1519 0.1385 2LYS BB 1908 9.619 11.095 18.787 -0.0365 -0.2278 -0.1038 2LYS SC1 1909 9.644 11.397 18.772 0.0944 0.2344 0.0766 2LYS SC2 1910 9.778 11.754 18.782 0.2753 0.1862 0.1883 3CYS BB 1911 9.885 10.980 18.854 -0.1879 0.0399 0.1755 3CYS SC1 1912 9.700 10.860 19.139 -0.0507 -0.0645 0.0220 4LEU BB 1913 10.189 10.970 18.750 0.3291 0.2129 -0.0341 4LEU SC1 1914 10.138 10.589 18.837 -0.5661 -0.3079 -0.0051 5PHE BB 1915 10.311 11.040 18.488 0.0704 0.0121 0.2550 5PHE SC1 1916 10.333 10.755 18.402 -0.0175 -0.0392 0.1164 5PHE SC2 1917 10.382 10.645 18.083 0.0387 0.4421 -0.0490 5PHE SC3 1918 10.105 10.692 18.157 0.0003 0.0416 0.0782 6LYS BB 1919 10.352 11.404 18.332 0.4082 -0.3861 -0.2526 6LYS SC1 1920 10.140 11.496 18.118 0.2321 -0.0978 0.2721 6LYS SC2 1921 9.933 11.729 17.935 0.2555 0.0825 -0.2283 7LYS BB 1922 10.655 11.388 18.337 -0.2588 0.1576 -0.1568 7LYS SC1 1923 10.691 11.107 18.263 0.2011 0.4612 -0.1307 7LYS SC2 1924 10.730 10.834 18.083 0.0770 0.2428 0.2964 8LYS BB 1925 10.862 11.518 18.609 -0.1425 -0.2162 0.0385 8LYS SC1 1926 11.170 11.374 18.763 0.3587 0.2294 0.0584 8LYS SC2 1927 11.460 11.388 18.914 -0.0533 -0.1952 0.1376 9ASN BB 1928 10.771 11.833 18.653 0.3201 -0.1221 -0.0654 9ASN SC1 1929 10.556 11.838 18.422 -0.1591 0.1279 -0.1007 10LYS BB 1930 10.860 12.106 18.857 -0.3824 -0.0926 -0.0513 10LYS SC1 1931 10.589 12.061 19.051 -0.2658 -0.1993 0.1941 10LYS SC2 1932 10.309 12.043 19.330 -0.1137 0.3731 0.4294 11LYS BB 1933 10.927 12.393 18.698 -0.2087 0.1012 -0.1202 11LYS SC1 1934 10.671 12.559 18.828 -0.0064 0.1944 -0.3364 11LYS SC2 1935 10.554 12.856 18.971 -0.0319 0.1848 0.0315 12LYS BB 1936 11.083 12.392 18.413 -0.3245 -0.1130 -0.1629 12LYS SC1 1937 10.937 12.497 18.106 -0.2197 -0.2576 -0.2018 12LYS SC2 1938 10.631 12.604 17.939 -0.4366 0.1679 -0.1864 13GLY BB 1939 11.179 12.182 18.285 0.1984 -0.3764 0.2187 14LYS BB 1940 11.498 12.149 18.192 0.0847 0.1299 0.0010 14LYS SC1 1941 11.545 12.454 18.326 0.0656 -0.1370 -0.0695 14LYS SC2 1942 11.405 12.789 18.298 -0.2596 -0.0438 -0.0656 15GLU BB 1943 11.657 11.860 18.274 0.0829 -0.2762 0.1379 15GLU SC1 1944 11.753 11.779 17.895 0.2380 0.3809 -0.1198 16LYS BB 1945 11.966 11.891 18.369 0.0102 0.1389 -0.0875 16LYS SC1 1946 12.006 11.593 18.325 0.3007 -0.0640 0.2322 16LYS SC2 1947 12.225 11.434 18.114 0.0596 0.0280 -0.0703 17GLY BB 1948 12.093 11.906 18.670 -0.1389 -0.1264 -0.3101 18GLY BB 1949 12.235 11.626 18.863 0.1811 -0.1190 0.3886 19LYS BB 1950 12.452 11.403 18.872 0.0408 0.1056 0.0413 19LYS SC1 1951 12.243 11.173 19.033 -0.1693 0.1430 0.1372 19LYS SC2 1952 12.038 11.197 19.300 0.2730 0.0774 -0.0321 20ASN BB 1953 12.778 11.505 18.927 -0.0140 -0.0739 0.1436 20ASN SC1 1954 13.002 11.348 18.723 0.4043 -0.1162 0.0322 21ALA BB 1955 13.010 11.444 19.128 0.0720 -0.2532 -0.1818 21ALA SC1 1956 12.929 11.188 19.148 0.1871 -0.2896 -0.1787 22ILE BB 1957 13.318 11.348 19.114 -0.1822 0.0316 0.0038 22ILE SC1 1958 13.320 11.026 19.226 0.1677 0.0140 -0.0430 23ASN BB 1959 13.459 11.626 19.048 -0.2097 0.1495 -0.0697 23ASN SC1 1960 13.159 11.780 18.915 -0.0633 0.0866 0.1914 24MET BB 1961 13.691 11.667 19.279 -0.3203 0.1197 0.0310 24MET SC1 1962 14.083 11.697 19.226 0.5393 0.0084 0.0787 25LYS BB 1963 13.753 11.806 19.592 0.0449 -0.0279 -0.0967 25LYS SC1 1964 14.045 11.818 19.747 -0.3128 -0.0924 -0.2982 25LYS SC2 1965 14.265 11.955 19.955 -0.2904 0.0046 0.0795 26ASP BB 1966 13.462 11.794 19.715 -0.0184 0.0333 -0.2586 26ASP SC1 1967 13.244 11.681 19.467 -0.1514 0.0490 -0.1991 27VAL BB 1968 13.440 11.933 20.027 0.0717 0.0410 0.3947 27VAL SC1 1969 13.543 11.693 20.157 -0.1651 -0.2426 0.0762 28LYS BB 1970 13.362 12.225 20.027 0.3477 0.5363 0.1381 28LYS SC1 1971 13.187 12.291 20.274 0.0320 0.1627 0.1646 28LYS SC2 1972 12.881 12.284 20.435 -0.1611 -0.0457 0.1297 29ASP BB 1973 13.418 12.482 19.843 0.1165 -0.0130 0.0778 29ASP SC1 1974 13.538 12.281 19.587 -0.0258 -0.1987 0.3613 30LEU BB 1975 13.240 12.677 19.707 -0.1121 -0.2957 0.2700 30LEU SC1 1976 13.461 12.922 19.807 0.0847 -0.2391 0.2933 31GLY BB 1977 12.922 12.757 19.616 -0.0804 0.0780 -0.0335 32LYS BB 1978 12.815 12.444 19.508 0.0327 -0.0824 0.1089 32LYS SC1 1979 13.112 12.342 19.409 -0.3455 0.5040 -0.5833 32LYS SC2 1980 13.309 12.053 19.255 -0.3712 0.5117 0.1423 33THR BB 1981 12.564 12.391 19.225 -0.0163 0.1142 0.0923 33THR SC1 1982 12.661 12.614 19.041 0.3029 -0.3185 -0.2900 34MET BB 1983 12.278 12.396 19.425 -0.0425 -0.0328 0.2250 34MET SC1 1984 11.975 12.509 19.433 -0.0750 0.0992 -0.1050 35LYS BB 1985 12.347 12.416 19.770 0.1088 -0.2329 -0.2887 35LYS SC1 1986 12.572 12.643 19.830 -0.0330 -0.0231 -0.2090 35LYS SC2 1987 12.801 12.839 20.001 -0.1507 -0.1613 -0.1982 36ASP BB 1988 12.455 12.091 19.805 0.1945 -0.0662 0.2353 36ASP SC1 1989 12.474 11.955 19.503 -0.3525 -0.3625 0.1351 37GLN BB 1990 12.385 11.798 19.937 -0.0823 -0.3002 0.0770 37GLN SC1 1991 12.729 11.658 20.011 0.2808 0.1032 0.1806 38ALA BB 1992 12.336 11.770 20.218 -0.0957 -0.1466 -0.3229 38ALA SC1 1993 12.408 11.563 20.376 -0.3152 0.1653 0.2137 39LEU BB 1994 12.142 11.922 20.423 0.1988 -0.0183 0.3683 39LEU SC1 1995 12.042 11.609 20.597 0.1983 -0.2531 0.2542 40LYS BB 1996 12.076 12.207 20.535 -0.0202 -0.1898 0.1160 40LYS SC1 1997 11.866 12.137 20.744 0.1464 -0.0229 -0.2224 40LYS SC2 1998 11.596 12.009 20.951 -0.4237 -0.1633 0.2266 41ASP BB 1999 11.873 12.341 20.383 0.1799 0.1769 -0.2402 41ASP SC1 2000 11.726 12.136 20.196 0.3475 -0.1128 -0.0404 42ASP BB 2001 11.974 12.641 20.329 -0.0714 0.1780 0.0803 42ASP SC1 2002 12.258 12.650 20.546 0.1341 0.2632 0.0305 43ASP BB 2003 11.820 12.833 20.124 -0.0654 -0.1536 -0.0944 43ASP SC1 2004 11.540 12.942 20.327 -0.3904 0.2681 0.2108 44ALA BB 2005 11.558 12.845 19.884 -0.2226 -0.1653 -0.0317 44ALA SC1 2006 11.704 12.853 19.657 0.1089 0.0546 0.1797 45GLU BB 2007 11.313 12.650 19.967 -0.0330 0.0639 0.0227 45GLU SC1 2008 10.985 12.821 19.751 -0.0608 0.1774 -0.0345 46THR BB 2009 11.370 12.319 19.937 0.0598 -0.1390 0.0994 46THR SC1 2010 11.269 12.202 20.200 -0.1703 0.1015 0.1231 47GLY BB 2011 11.545 12.121 19.779 -0.0537 0.0422 0.1425 48LEU BB 2012 11.534 12.043 19.429 -0.1979 -0.0472 -0.1521 48LEU SC1 2013 11.209 11.950 19.473 -0.1168 0.1599 -0.0762 49THR BB 2014 11.615 11.742 19.254 -0.1262 -0.1452 -0.0684 49THR SC1 2015 11.868 11.635 19.387 -0.0324 -0.0788 -0.1908 50ASP BB 2016 11.749 11.768 18.905 0.2404 0.1589 -0.0136 50ASP SC1 2017 11.874 11.455 18.964 0.2483 -0.2443 -0.0873 51GLY BB 2018 11.653 11.996 18.715 0.1597 0.1651 -0.1532 52GLU BB 2019 11.353 12.112 18.751 -0.0940 0.0518 0.1784 52GLU SC1 2020 11.295 11.806 18.580 0.0699 0.0689 0.2676 53GLU BB 2021 11.462 12.425 18.772 0.0234 0.3110 -0.0953 53GLU SC1 2022 11.750 12.325 19.051 0.1499 0.1617 0.1255 54LYS BB 2023 11.308 12.719 18.739 -0.1585 0.0360 0.3211 54LYS SC1 2024 11.090 12.719 18.970 0.2758 0.0258 -0.2179 54LYS SC2 2025 11.096 12.817 19.309 -0.2829 -0.0851 0.0128 55GLU BB 2026 11.424 13.020 18.700 -0.0103 0.1826 0.1597 55GLU SC1 2027 11.194 13.230 18.449 0.0674 -0.1213 0.2425 56GLU BB 2028 11.207 13.181 18.966 0.0975 0.1207 0.1094 56GLU SC1 2029 11.559 13.367 19.062 0.0863 0.0723 -0.0033 57PRO BB 2030 10.904 13.080 18.858 -0.2243 -0.1265 0.2343 57PRO SC1 2031 10.921 12.873 18.613 0.2063 0.0112 0.2052 58LYS BB 2032 10.761 13.342 18.887 0.2342 0.0754 -0.2317 58LYS SC1 2033 10.967 13.589 18.882 -0.0525 -0.0441 -0.1598 58LYS SC2 2034 11.241 13.561 18.738 0.1230 0.2832 0.3227 59GLU BB 2035 10.537 13.306 19.128 0.0492 -0.1112 0.1867 59GLU SC1 2036 10.240 13.283 18.869 -0.0832 0.0618 -0.3235 60GLU BB 2037 10.467 13.446 19.435 -0.2666 -0.2963 0.0418 60GLU SC1 2038 10.704 13.773 19.429 0.1208 -0.0299 0.0930 61GLU BB 2039 10.162 13.353 19.614 -0.0491 0.0524 -0.2564 61GLU SC1 2040 10.236 13.276 19.995 -0.0332 0.3937 0.2223 1LYS BB 2041 18.108 15.503 15.887 -0.0249 -0.2320 0.1609 1LYS SC1 2042 18.373 15.521 15.662 0.1840 0.0455 -0.1473 1LYS SC2 2043 18.387 15.375 15.337 -0.2328 -0.2018 0.2457 2LYS BB 2044 18.223 15.698 16.183 -0.1950 0.1205 0.0795 2LYS SC1 2045 18.532 15.770 16.269 0.0786 0.0357 0.2679 2LYS SC2 2046 18.835 15.629 16.282 -0.0230 -0.3324 -0.0428 3CYS BB 2047 18.054 15.589 16.413 0.1523 0.0796 -0.0131 3CYS SC1 2048 18.232 15.328 16.413 0.3872 0.0626 0.2605 4LEU BB 2049 17.822 15.687 16.592 0.2438 -0.0597 -0.0948 4LEU SC1 2050 17.524 15.467 16.523 0.0405 -0.1163 0.0752 5PHE BB 2051 17.948 15.684 16.889 -0.1833 0.1869 0.1281 5PHE SC1 2052 18.271 15.760 16.940 0.0602 0.1626 0.0559 5PHE SC2 2053 18.532 15.759 17.158 0.0701 -0.0428 0.0457 5PHE SC3 2054 18.553 15.949 16.940 0.2806 -0.1571 -0.0366 6LYS BB 2055 17.928 15.462 17.115 0.3674 -0.0182 -0.0888 6LYS SC1 2056 18.216 15.445 17.223 -0.2127 0.0461 -0.1521 6LYS SC2 2057 18.512 15.317 17.091 0.2659 -0.1093 -0.2988 7LYS BB 2058 17.759 15.414 17.369 -0.1833 0.1176 0.0752 7LYS SC1 2059 17.569 15.145 17.351 -0.5340 0.1503 0.2298 7LYS SC2 2060 17.351 14.911 17.475 0.5180 0.0939 -0.0090 8LYS BB 2061 17.774 15.768 17.460 -0.2062 0.2562 -0.1464 8LYS SC1 2062 17.671 15.744 17.739 -0.3271 -0.1165 -0.3043 8LYS SC2 2063 17.797 15.628 18.018 0.2401 -0.1227 -0.2154 9ASN BB 2064 17.644 16.027 17.384 -0.0306 -0.1736 -0.3177 9ASN SC1 2065 17.693 16.371 17.522 -0.2810 0.0570 -0.0498 10LYS BB 2066 17.348 16.185 17.328 -0.1191 0.2859 -0.1616 10LYS SC1 2067 17.258 16.352 17.578 -0.1294 0.0848 0.2636 10LYS SC2 2068 17.245 16.469 17.908 0.2584 0.3404 0.0613 11LYS BB 2069 17.180 16.049 17.113 0.0344 0.0911 0.0857 11LYS SC1 2070 16.936 16.101 17.318 0.1045 -0.6521 -0.1115 11LYS SC2 2071 16.616 16.315 17.248 -0.1976 -0.3835 0.1398 12LYS BB 2072 17.021 16.256 16.877 0.3441 -0.2840 -0.0064 12LYS SC1 2073 17.331 16.276 16.737 0.2800 -0.2613 -0.0795 12LYS SC2 2074 17.221 16.490 16.476 0.0772 -0.0108 -0.1435 13GLY BB 2075 16.763 16.176 16.673 0.2459 0.3284 0.0201 14LYS BB 2076 16.604 15.929 16.921 -0.0946 0.2885 0.0496 14LYS SC1 2077 16.854 15.806 16.896 0.1980 0.0661 0.0316 14LYS SC2 2078 17.039 15.564 16.993 -0.0067 0.0757 0.0474 15GLU BB 2079 16.455 15.598 16.965 -0.0514 0.0035 0.0230 15GLU SC1 2080 16.642 15.271 17.061 -0.0578 0.1193 0.1817 16LYS BB 2081 16.213 15.710 17.159 0.0852 0.4381 -0.1591 16LYS SC1 2082 16.342 15.506 17.370 0.4841 0.0149 -0.0903 16LYS SC2 2083 16.201 15.368 17.648 -0.0526 0.4147 -0.2320 17GLY BB 2084 16.241 16.049 17.156 -0.0376 0.2006 0.0866 18GLY BB 2085 15.893 15.995 17.218 -0.1600 0.1294 0.1645 19LYS BB 2086 15.704 15.829 16.992 0.0835 -0.0623 -0.3222 19LYS SC1 2087 15.500 15.747 17.251 0.2278 0.0895 0.0849 19LYS SC2 2088 15.412 15.729 17.595 -0.4580 0.3936 -0.0748 20ASN BB 2089 15.625 15.957 16.663 -0.1929 0.1532 0.2235 20ASN SC1 2090 15.846 15.848 16.387 -0.0364 -0.0228 0.1071 21ALA BB 2091 15.550 16.233 16.603 0.0196 -0.0328 -0.0223 21ALA SC1 2092 15.409 16.310 16.821 0.2081 0.0871 0.0596 22ILE BB 2093 15.789 16.310 16.363 0.1079 -0.3200 0.1263 22ILE SC1 2094 16.093 16.410 16.481 -0.0164 -0.2272 0.3751 23ASN BB 2095 15.826 16.561 16.136 -0.2261 -0.1974 0.0413 23ASN SC1 2096 15.839 16.287 15.910 -0.1268 0.0266 0.0655 24MET BB 2097 16.062 16.667 15.910 0.0644 0.0419 0.0238 24MET SC1 2098 16.370 16.443 16.031 -0.1265 0.1027 0.0983 25LYS BB 2099 16.054 16.609 15.577 0.2083 0.1618 -0.1806 25LYS SC1 2100 16.357 16.596 15.597 0.1646 0.0576 -0.3977 25LYS SC2 2101 16.654 16.474 15.472 -0.2434 -0.0966 -0.2806 26ASP BB 2102 15.738 16.498 15.499 0.2780 -0.3234 -0.1030 26ASP SC1 2103 15.558 16.673 15.730 -0.2780 -0.1675 -0.2597 27VAL BB 2104 15.516 16.575 15.251 -0.0360 0.3570 -0.1286 27VAL SC1 2105 15.274 16.482 15.386 0.0661 0.0264 -0.1637 28LYS BB 2106 15.780 16.746 15.064 -0.2278 -0.0192 -0.1655 28LYS SC1 2107 15.576 16.977 15.199 0.0771 0.2708 0.0009 28LYS SC2 2108 15.693 17.018 15.523 -0.1758 -0.0146 -0.4001 29ASP BB 2109 15.976 16.672 14.809 0.3047 0.0149 -0.1904 29ASP SC1 2110 15.817 16.381 14.745 0.1539 0.1891 -0.4234 30LEU BB 2111 16.284 16.640 14.736 -0.2286 -0.3136 -0.1518 30LEU SC1 2112 16.379 16.491 15.045 -0.4879 0.1393 0.1687 31GLY BB 2113 16.275 16.903 14.491 -0.0044 0.2917 0.0024 32LYS BB 2114 16.451 17.124 14.431 0.1851 -0.1365 0.2403 32LYS SC1 2115 16.567 17.115 14.183 0.2020 0.3915 0.1015 32LYS SC2 2116 16.439 17.272 13.876 0.1140 -0.3131 -0.0284 33THR BB 2117 16.383 17.400 14.602 -0.1667 -0.0004 -0.1622 33THR SC1 2118 16.388 17.674 14.469 0.2688 0.1450 0.1339 34MET BB 2119 16.384 17.454 14.913 -0.0456 0.0981 0.2081 34MET SC1 2120 16.372 17.784 14.965 -0.2226 -0.0231 -0.1007 35LYS BB 2121 16.603 17.329 15.128 -0.2385 0.1417 -0.3704 35LYS SC1 2122 16.768 17.604 15.063 0.2850 0.0263 -0.3193 35LYS SC2 2123 16.725 17.661 14.742 0.2508 0.4584 -0.0221 36ASP BB 2124 16.859 17.123 14.979 0.1904 0.1418 0.2607 36ASP SC1 2125 16.855 17.233 14.669 -0.1757 -0.0780 -0.2864 37GLN BB 2126 17.127 17.137 15.100 0.3481 0.0597 0.0877 37GLN SC1 2127 17.046 17.387 15.375 -0.0960 0.1446 -0.1829 38ALA BB 2128 17.354 16.955 15.267 0.0094 -0.1017 0.2876 38ALA SC1 2129 17.359 16.928 15.535 0.2822 -0.2508 0.2713 39LEU BB 2130 17.633 16.878 15.232 -0.1464 -0.2174 0.2363 39LEU SC1 2131 17.594 16.853 14.860 -0.2230 -0.0144 -0.0123 40LYS BB 2132 17.797 16.608 15.458 -0.2135 -0.4257 0.1763 40LYS SC1 2133 18.071 16.693 15.433 0.1029 -0.2102 -0.0813 40LYS SC2 2134 18.442 16.619 15.346 0.2389 0.0119 -0.1343 41ASP BB 2135 17.837 16.569 15.796 0.1596 -0.2572 0.0566 41ASP SC1 2136 18.102 16.694 15.923 0.5631 -0.5326 -0.6188 42ASP BB 2137 17.736 16.373 15.986 -0.1582 -0.0315 -0.4233 42ASP SC1 2138 17.543 16.532 16.209 0.0647 0.1056 0.0170 43ASP BB 2139 17.688 16.094 15.899 0.0978 -0.0420 0.3127 43ASP SC1 2140 17.992 15.949 15.882 0.2459 0.4239 -0.3172 44ALA BB 2141 17.340 15.998 15.907 -0.0333 -0.0351 0.3038 44ALA SC1 2142 17.282 15.765 15.784 0.2128 -0.1412 0.3840 45GLU BB 2143 17.228 16.236 16.035 0.0209 -0.0350 0.0344 45GLU SC1 2144 17.076 16.039 16.357 0.1362 0.1445 0.2574 46THR BB 2145 17.113 16.489 15.971 0.2216 0.1591 -0.0170 46THR SC1 2146 16.840 16.388 15.879 0.1458 0.3182 0.0308 47GLY BB 2147 17.067 16.729 15.740 -0.1827 0.0586 -0.0694 48LEU BB 2148 16.945 16.822 15.429 0.0087 0.1399 0.1602 48LEU SC1 2149 16.724 17.096 15.499 -0.2411 -0.1026 -0.0215 49THR BB 2150 17.052 16.636 15.239 0.0382 0.0992 0.2450 49THR SC1 2151 16.820 16.575 15.052 0.0356 0.0269 0.2715 50ASP BB 2152 17.349 16.479 15.283 -0.0002 0.0670 0.2409 50ASP SC1 2153 17.404 16.428 15.612 -0.2249 0.3226 -0.1351 51GLY BB 2154 17.501 16.451 15.041 -0.1452 0.6248 0.2176 52GLU BB 2155 17.481 16.141 14.915 0.0750 0.1290 -0.1826 52GLU SC1 2156 17.146 16.116 14.986 0.3213 -0.1507 -0.2098 53GLU BB 2157 17.789 15.958 14.990 -0.2607 -0.1584 0.1982 53GLU SC1 2158 17.612 15.708 15.166 -0.1301 0.1086 0.0649 54LYS BB 2159 17.879 16.213 15.144 -0.0860 0.0754 0.2659 54LYS SC1 2160 17.816 16.183 15.455 -0.6623 0.0576 -0.0893 54LYS SC2 2161 17.479 16.043 15.406 -0.0844 -0.1602 -0.1772 55GLU BB 2162 18.205 16.314 15.142 0.2516 0.0979 0.2186 55GLU SC1 2163 18.125 16.616 14.990 -0.2566 -0.1642 0.0048 56GLU BB 2164 18.479 16.151 15.193 -0.1837 0.2297 0.0962 56GLU SC1 2165 18.798 16.224 15.374 0.0383 0.2707 -0.1401 57PRO BB 2166 18.495 15.818 15.234 -0.1676 0.0609 -0.0926 57PRO SC1 2167 18.722 15.704 15.434 -0.1813 -0.2561 -0.0577 58LYS BB 2168 18.617 15.645 14.953 0.1280 -0.2902 0.1856 58LYS SC1 2169 18.911 15.820 15.038 0.3735 -0.0972 0.1512 58LYS SC2 2170 19.113 16.085 15.006 0.2527 -0.0938 0.0200 59GLU BB 2171 18.465 15.557 14.687 -0.0039 0.1038 0.1217 59GLU SC1 2172 18.254 15.811 14.518 0.0441 0.1083 0.0423 60GLU BB 2173 18.326 15.280 14.691 -0.3011 -0.0278 -0.1709 60GLU SC1 2174 18.183 15.226 14.365 -0.0652 0.0413 0.1764 61GLU BB 2175 18.395 15.125 14.947 0.3798 -0.0583 -0.0052 61GLU SC1 2176 18.807 15.099 14.871 0.0662 -0.0333 -0.0675 1LYS BB 2177 12.450 12.762 18.533 -0.2092 0.3139 -0.4600 1LYS SC1 2178 12.249 12.797 18.738 -0.0228 -0.0261 0.1388 1LYS SC2 2179 11.896 12.730 18.919 -0.4039 0.0032 -0.0132 2LYS BB 2180 12.300 12.823 18.256 -0.0900 0.1362 -0.2772 2LYS SC1 2181 12.108 12.550 18.201 0.0633 -0.0650 0.0455 2LYS SC2 2182 11.934 12.249 18.092 -0.1287 -0.3163 0.1595 3CYS BB 2183 12.426 12.826 18.012 0.1708 0.1343 0.0708 3CYS SC1 2184 12.122 12.913 17.898 -0.0766 -0.0921 0.2710 4LEU BB 2185 12.457 13.181 17.939 0.1559 0.0669 -0.1177 4LEU SC1 2186 12.162 13.336 17.808 -0.0804 -0.0666 -0.0170 5PHE BB 2187 12.692 13.398 17.865 -0.3904 -0.0318 0.1281 5PHE SC1 2188 12.492 13.570 17.711 0.0680 0.1905 -0.0912 5PHE SC2 2189 12.273 13.573 17.452 -0.1733 -0.3591 0.0929 5PHE SC3 2190 12.394 13.315 17.509 0.2107 -0.1506 0.2571 6LYS BB 2191 12.999 13.377 17.902 -0.0124 0.5798 -0.1697 6LYS SC1 2192 13.108 13.090 17.885 -0.0135 -0.3394 0.1621 6LYS SC2 2193 13.161 12.817 17.689 -0.0086 0.0995 0.4032 7LYS BB 2194 13.123 13.607 18.101 -0.2832 0.1094 -0.4592 7LYS SC1 2195 13.352 13.418 18.148 -0.0616 0.0717 0.2074 7LYS SC2 2196 13.607 13.455 18.376 -0.1158 -0.1495 0.1504 8LYS BB 2197 12.874 13.847 18.180 0.1995 0.1491 -0.3245 8LYS SC1 2198 13.014 14.028 18.363 0.0903 -0.2935 -0.1624 8LYS SC2 2199 12.824 14.236 18.549 -0.0804 0.0774 0.0037 9ASN BB 2200 12.645 13.947 18.002 -0.2855 -0.5664 -0.3128 9ASN SC1 2201 12.765 14.160 17.689 0.5030 0.6570 0.1220 10LYS BB 2202 12.356 13.835 18.112 -0.1989 -0.0313 -0.1214 10LYS SC1 2203 12.440 13.569 18.202 -0.1010 0.2284 0.0285 10LYS SC2 2204 12.765 13.437 18.331 -0.0460 0.2682 -0.3605 11LYS BB 2205 12.096 13.933 17.951 -0.0763 -0.0797 0.0614 11LYS SC1 2206 11.916 13.665 17.997 -0.1439 -0.0076 -0.0948 11LYS SC2 2207 11.642 13.445 18.006 0.3448 0.2207 -0.0930 12LYS BB 2208 12.144 14.044 17.638 -0.1559 -0.1159 -0.2321 12LYS SC1 2209 11.864 14.164 17.534 0.0773 -0.1816 0.0439 12LYS SC2 2210 11.643 13.919 17.375 0.2689 -0.2634 0.1480 13GLY BB 2211 12.392 14.184 17.485 -0.2611 -0.2935 -0.2212 14LYS BB 2212 12.238 14.096 17.182 -0.2740 -0.1427 -0.0403 14LYS SC1 2213 12.248 13.754 17.172 0.2789 0.0890 0.0576 14LYS SC2 2214 12.299 13.531 16.900 0.0928 -0.0114 -0.1692 15GLU BB 2215 12.269 14.431 17.105 0.0761 -0.1430 0.4694 15GLU SC1 2216 12.504 14.676 16.893 0.1606 0.2347 -0.1025 16LYS BB 2217 11.985 14.584 16.966 -0.0359 0.3650 -0.2223 16LYS SC1 2218 11.864 14.755 17.213 -0.0335 0.3088 0.0402 16LYS SC2 2219 11.607 14.786 17.457 -0.1620 -0.1449 -0.0765 17GLY BB 2220 12.054 14.664 16.635 -0.2283 0.2239 -0.0030 18GLY BB 2221 12.311 14.804 16.485 0.1908 -0.1515 -0.1442 19LYS BB 2222 12.355 15.085 16.320 0.1145 -0.0361 0.0742 19LYS SC1 2223 12.159 15.070 16.077 -0.1386 -0.0599 0.0195 19LYS SC2 2224 11.999 15.308 15.918 0.0207 -0.1620 0.5168 20ASN BB 2225 12.592 15.263 16.239 -0.2375 0.1966 -0.1030 20ASN SC1 2226 12.509 15.205 15.907 -0.3276 0.1665 0.0926 21ALA BB 2227 12.726 15.515 16.392 -0.2637 -0.0481 -0.0162 21ALA SC1 2228 12.614 15.761 16.401 0.1602 0.1485 0.2606 22ILE BB 2229 12.936 15.588 16.646 0.2071 -0.1449 -0.0458 22ILE SC1 2230 12.714 15.531 16.899 -0.0343 0.0161 -0.2168 23ASN BB 2231 13.084 15.837 16.584 -0.0620 0.0742 0.0177 23ASN SC1 2232 13.308 15.824 16.835 -0.0846 0.0882 -0.0180 24MET BB 2233 12.980 16.015 16.315 0.0508 0.2746 -0.0521 24MET SC1 2234 12.690 16.225 16.466 -0.2384 -0.1750 -0.0755 25LYS BB 2235 12.841 15.847 16.069 0.1161 0.1850 -0.2080 25LYS SC1 2236 12.547 15.972 16.018 -0.0810 -0.3362 -0.3244 25LYS SC2 2237 12.406 16.319 16.105 0.0967 -0.1055 -0.0683 26ASP BB 2238 12.995 15.951 15.783 -0.0375 -0.1664 0.0125 26ASP SC1 2239 12.745 15.920 15.584 -0.0725 -0.0880 0.1179 27VAL BB 2240 12.943 16.293 15.753 0.0657 0.0410 -0.0313 27VAL SC1 2241 12.839 16.315 16.025 -0.1149 0.0022 -0.0958 28LYS BB 2242 13.117 16.603 15.724 0.2297 0.0712 -0.0337 28LYS SC1 2243 12.927 16.658 15.473 0.0840 -0.1458 0.0279 28LYS SC2 2244 12.955 16.872 15.219 0.0475 0.1918 0.3551 29ASP BB 2245 13.299 16.830 15.929 -0.0178 0.1495 -0.0668 29ASP SC1 2246 13.556 16.598 15.968 0.3273 -0.2960 0.1497 30LEU BB 2247 13.055 16.927 16.162 -0.1101 -0.0071 -0.0044 30LEU SC1 2248 12.917 16.642 16.312 -0.0155 -0.0284 -0.1748 31GLY BB 2249 12.743 17.091 16.170 0.0362 0.1301 0.0070 32LYS BB 2250 12.751 17.331 16.080 0.0560 0.0614 -0.0752 32LYS SC1 2251 13.073 17.347 15.988 0.4447 0.0545 -0.2815 32LYS SC2 2252 13.334 17.330 15.803 0.0293 0.0622 -0.1953 33THR BB 2253 12.590 17.597 16.224 0.0478 0.1110 0.1101 33THR SC1 2254 12.763 17.686 16.459 0.1456 -0.0193 0.0889 34MET BB 2255 12.239 17.447 16.127 -0.2517 -0.0282 -0.1438 34MET SC1 2256 12.070 17.203 16.309 0.1393 -0.0324 0.1378 35LYS BB 2257 12.115 17.513 15.816 -0.1939 0.1634 0.2568 35LYS SC1 2258 11.901 17.743 15.746 0.1317 -0.1477 -0.0386 35LYS SC2 2259 11.550 17.774 15.722 -0.0346 0.1415 0.2957 36ASP BB 2260 11.989 17.322 15.547 0.0092 0.1592 0.1008 36ASP SC1 2261 11.644 17.352 15.591 0.0541 -0.3064 -0.0173 37GLN BB 2262 12.153 17.269 15.289 -0.2058 0.2864 0.0417 37GLN SC1 2263 12.131 16.967 15.102 0.2686 0.4206 0.0722 38ALA BB 2264 12.377 17.537 15.224 -0.1237 -0.1035 0.0385 38ALA SC1 2265 12.270 17.648 15.446 -0.2382 0.1233 -0.1256 39LEU BB 2266 12.289 17.746 14.975 -0.0737 -0.1042 -0.1195 39LEU SC1 2267 11.937 17.793 14.874 -0.1663 -0.0276 0.1104 40LYS BB 2268 12.452 17.653 14.687 0.1415 0.3458 -0.0132 40LYS SC1 2269 12.313 17.663 14.409 -0.2150 0.2716 -0.3852 40LYS SC2 2270 12.295 17.812 14.101 -0.2057 -0.0392 0.0354 41ASP BB 2271 12.661 17.433 14.642 0.0707 -0.0700 -0.1632 41ASP SC1 2272 12.497 17.170 14.568 -0.0184 0.5621 0.1684 42ASP BB 2273 12.862 17.326 14.870 0.2629 -0.0154 -0.1525 42ASP SC1 2274 13.154 17.535 14.869 0.4514 -0.4425 0.1322 43ASP BB 2275 12.865 17.350 15.186 0.1563 -0.0561 -0.1474 43ASP SC1 2276 12.609 17.152 15.274 -0.2555 -0.0833 -0.0806 44ALA BB 2277 13.099 17.322 15.345 -0.1224 -0.3553 -0.1159 44ALA SC1 2278 12.974 17.462 15.539 -0.0991 0.0449 -0.3785 45GLU BB 2279 13.293 17.574 15.301 0.0405 -0.1395 0.3025 45GLU SC1 2280 13.616 17.329 15.395 -0.0665 -0.2297 0.0486 46THR BB 2281 13.313 17.856 15.161 0.0850 0.0624 -0.1910 46THR SC1 2282 13.024 17.952 15.160 0.0940 0.0935 -0.0284 47GLY BB 2283 13.578 18.032 15.117 -0.1743 -0.0782 0.4436 48LEU BB 2284 13.699 18.174 15.373 0.1300 -0.1684 -0.0596 48LEU SC1 2285 13.704 18.500 15.275 -0.0130 0.1264 -0.1411 49THR BB 2286 13.896 18.036 15.575 0.2741 0.0418 0.0325 49THR SC1 2287 14.062 18.234 15.736 0.2058 0.2161 -0.1074 50ASP BB 2288 14.165 17.898 15.397 -0.3295 0.0286 -0.3106 50ASP SC1 2289 14.075 18.034 15.062 0.1957 0.3564 -0.0302 51GLY BB 2290 14.375 17.754 15.528 0.0751 -0.2136 0.0577 52GLU BB 2291 14.667 17.737 15.395 -0.0342 -0.0393 0.0711 52GLU SC1 2292 14.514 17.809 15.062 0.3985 0.1219 0.0603 53GLU BB 2293 14.884 17.926 15.522 -0.1519 0.0621 0.1391 53GLU SC1 2294 14.879 18.303 15.628 0.0102 -0.2405 0.1174 54LYS BB 2295 15.175 17.803 15.676 0.1248 -0.0377 -0.0720 54LYS SC1 2296 15.322 18.013 15.794 -0.2947 -0.1416 0.1324 54LYS SC2 2297 15.553 18.007 16.062 0.3859 -0.2226 -0.0414 55GLU BB 2298 15.414 17.694 15.454 -0.0475 0.1880 0.3565 55GLU SC1 2299 15.200 17.784 15.135 0.1490 -0.0975 -0.2976 56GLU BB 2300 15.637 17.430 15.366 0.0211 -0.3089 0.2394 56GLU SC1 2301 15.929 17.415 15.639 -0.3334 -0.0476 -0.1991 57PRO BB 2302 15.635 17.485 15.017 -0.0799 0.2827 -0.1623 57PRO SC1 2303 15.960 17.510 15.031 -0.1228 0.0298 0.0920 58LYS BB 2304 15.717 17.260 14.800 -0.0042 0.3155 0.0818 58LYS SC1 2305 15.431 17.172 14.776 0.2478 0.1679 0.0495 58LYS SC2 2306 15.165 17.062 14.542 0.0590 0.1853 -0.1471 59GLU BB 2307 15.911 17.379 14.563 0.2632 -0.2687 -0.2694 59GLU SC1 2308 15.968 17.760 14.631 0.2141 -0.0978 -0.2453 60GLU BB 2309 16.017 17.311 14.312 -0.1735 -0.1047 -0.2043 60GLU SC1 2310 16.042 17.027 14.093 0.1740 0.0330 0.0507 61GLU BB 2311 16.099 17.510 14.100 0.1593 -0.1011 0.0864 61GLU SC1 2312 15.832 17.642 13.894 0.0945 0.1776 -0.2343 1LYS BB 2313 24.597 19.371 9.162 0.0381 -0.2404 0.0324 1LYS SC1 2314 24.663 19.094 9.345 -0.0686 -0.2855 -0.2318 1LYS SC2 2315 24.748 18.962 9.659 0.1502 0.1924 -0.0369 2LYS BB 2316 24.310 19.298 9.121 -0.0778 0.1268 -0.0759 2LYS SC1 2317 24.300 18.996 9.105 0.3356 -0.2784 -0.3432 2LYS SC2 2318 24.217 18.702 9.273 -0.0655 -0.0011 0.2898 3CYS BB 2319 24.254 19.396 8.824 -0.0178 -0.0936 0.0350 3CYS SC1 2320 24.466 19.134 8.740 0.3440 0.0677 0.2155 4LEU BB 2321 24.364 19.726 8.831 -0.0673 0.2641 -0.1789 4LEU SC1 2322 24.353 19.869 9.146 0.1149 0.2081 0.1518 5PHE BB 2323 24.510 19.842 8.600 -0.2548 -0.1268 -0.0880 5PHE SC1 2324 24.352 20.080 8.503 -0.1305 -0.0068 0.1043 5PHE SC2 2325 24.268 20.409 8.481 0.0020 0.0031 -0.3485 5PHE SC3 2326 24.044 20.226 8.492 -0.0732 0.1063 -0.0242 6LYS BB 2327 24.698 19.768 8.354 -0.0796 -0.0843 -0.1274 6LYS SC1 2328 24.882 19.997 8.450 -0.5099 0.1291 -0.2299 6LYS SC2 2329 25.195 19.998 8.590 -0.0356 -0.1676 -0.2566 7LYS BB 2330 24.600 19.570 8.046 0.1818 0.0447 -0.3095 7LYS SC1 2331 24.803 19.361 8.030 0.1465 -0.3766 -0.1505 7LYS SC2 2332 24.822 19.203 7.714 -0.3173 0.0543 0.0659 8LYS BB 2333 24.661 19.712 7.733 0.2929 -0.1739 -0.0784 8LYS SC1 2334 24.583 19.940 7.817 0.0206 -0.0459 -0.2233 8LYS SC2 2335 24.560 20.115 8.089 0.0286 0.0933 0.3311 9ASN BB 2336 24.795 19.612 7.480 0.1533 -0.0748 -0.1794 9ASN SC1 2337 25.090 19.651 7.604 -0.0791 -0.0069 -0.1762 10LYS BB 2338 24.644 19.362 7.297 0.2575 -0.0813 0.1364 10LYS SC1 2339 24.855 19.134 7.251 -0.2947 -0.1168 -0.3557 10LYS SC2 2340 25.056 18.900 7.133 -0.2383 0.1201 -0.0659 11LYS BB 2341 24.307 19.455 7.264 -0.3027 -0.1486 0.0469 11LYS SC1 2342 24.270 19.156 7.139 0.0978 0.3029 -0.1099 11LYS SC2 2343 24.214 18.892 6.917 -0.1612 0.1892 0.0828 12LYS BB 2344 24.220 19.722 7.429 0.0976 -0.3892 -0.1211 12LYS SC1 2345 24.459 19.902 7.374 -0.2918 -0.0659 0.0414 12LYS SC2 2346 24.660 19.809 7.116 0.1658 -0.1236 0.2239 13GLY BB 2347 24.008 19.874 7.262 -0.4825 -0.0841 0.2320 14LYS BB 2348 23.709 19.891 7.080 -0.0841 -0.0356 -0.1753 14LYS SC1 2349 23.512 19.657 7.155 0.1358 0.1747 -0.3181 14LYS SC2 2350 23.272 19.569 7.428 -0.1320 0.2911 -0.3946 15GLU BB 2351 23.754 19.820 6.735 0.2279 0.0929 0.1559 15GLU SC1 2352 23.690 19.496 6.672 -0.2244 0.3872 -0.0579 16LYS BB 2353 23.663 19.926 6.451 -0.1133 0.0308 0.1902 16LYS SC1 2354 23.371 19.981 6.529 0.0796 -0.1199 -0.1481 16LYS SC2 2355 23.228 20.289 6.481 0.2875 -0.1017 -0.0159 17GLY BB 2356 23.899 20.053 6.228 0.6427 0.0998 -0.1122 18GLY BB 2357 24.117 20.141 6.507 0.2158 -0.0695 -0.1351 19LYS BB 2358 24.439 20.120 6.566 -0.1935 0.0991 -0.3734 19LYS SC1 2359 24.580 20.281 6.762 -0.1031 -0.2072 -0.0078 19LYS SC2 2360 24.518 20.639 6.703 -0.2117 0.0304 0.4291 20ASN BB 2361 24.604 19.808 6.557 -0.0849 -0.1671 0.0412 20ASN SC1 2362 24.456 19.622 6.488 0.1159 0.2340 -0.1190 21ALA BB 2363 24.910 19.623 6.509 0.0577 0.0057 -0.2440 21ALA SC1 2364 24.882 19.358 6.556 0.2035 -0.0423 -0.4158 22ILE BB 2365 25.197 19.608 6.353 -0.2092 0.0193 0.1016 22ILE SC1 2366 25.277 19.824 6.605 0.1355 0.0375 -0.0169 23ASN BB 2367 25.178 19.668 5.967 0.2683 0.2212 0.0686 23ASN SC1 2368 25.502 19.741 5.941 -0.1275 -0.2091 -0.2331 24MET BB 2369 24.913 19.761 5.776 0.3673 0.3104 -0.2487 24MET SC1 2370 25.049 19.828 5.398 0.0475 -0.0085 0.0371 25LYS BB 2371 24.697 19.714 6.035 -0.1534 -0.2546 0.0089 25LYS SC1 2372 24.481 19.541 5.880 -0.2106 0.1695 0.0839 25LYS SC2 2373 24.450 19.228 5.834 -0.0129 -0.1130 -0.3232 26ASP BB 2374 24.565 20.039 6.030 -0.1734 0.1545 0.0455 26ASP SC1 2375 24.270 19.895 6.098 -0.1363 0.2316 0.1684 27VAL BB 2376 24.805 20.211 5.867 -0.2415 0.0748 -0.0815 27VAL SC1 2377 24.799 20.161 5.579 -0.0244 -0.2870 -0.0285 28LYS BB 2378 24.849 20.462 6.073 0.0717 -0.0914 -0.1034 28LYS SC1 2379 24.997 20.705 5.934 0.1610 -0.2555 -0.0594 28LYS SC2 2380 25.169 20.985 5.801 -0.0615 -0.3699 0.0002 29ASP BB 2381 24.611 20.510 6.271 0.1113 0.1914 0.0877 29ASP SC1 2382 24.583 20.845 6.311 0.1682 -0.0453 0.2221 30LEU BB 2383 24.281 20.415 6.196 -0.2031 -0.0582 -0.2034 30LEU SC1 2384 24.373 20.386 5.828 0.1163 0.1286 -0.0943 31GLY BB 2385 24.111 20.626 6.361 0.3703 0.0738 0.1079 32LYS BB 2386 23.904 20.885 6.348 -0.2068 0.1612 0.0272 32LYS SC1 2387 23.828 20.789 6.089 0.1020 -0.0159 0.0717 32LYS SC2 2388 23.753 20.459 6.059 0.0586 -0.3698 -0.0623 33THR BB 2389 23.712 20.867 6.607 0.3912 0.2497 -0.0993 33THR SC1 2390 23.689 20.749 6.887 -0.0635 0.1329 -0.1781 34MET BB 2391 23.413 21.085 6.638 -0.2600 0.0342 -0.0063 34MET SC1 2392 23.489 21.179 6.240 -0.0337 -0.0877 -0.2151 35LYS BB 2393 23.171 20.975 6.817 0.0248 -0.0559 0.1340 35LYS SC1 2394 22.988 21.252 6.693 -0.1861 -0.0728 0.0209 35LYS SC2 2395 22.799 21.526 6.667 0.0789 -0.1273 0.1770 36ASP BB 2396 23.028 20.942 7.140 -0.0286 -0.0967 0.3625 36ASP SC1 2397 22.770 20.732 7.155 -0.1928 0.0395 -0.1345 37GLN BB 2398 23.105 21.069 7.473 0.0731 0.2228 -0.1320 37GLN SC1 2399 22.686 21.092 7.515 0.1878 -0.0059 0.3108 38ALA BB 2400 23.154 20.827 7.755 -0.0508 -0.0556 0.1471 38ALA SC1 2401 23.247 21.035 7.899 0.5285 -0.1177 -0.1079 39LEU BB 2402 23.328 20.531 7.764 0.0810 0.1170 0.2848 39LEU SC1 2403 23.411 20.666 8.121 -0.3083 -0.0127 0.0590 40LYS BB 2404 23.441 20.308 7.493 -0.2205 -0.0399 -0.3993 40LYS SC1 2405 23.466 20.358 7.202 0.2211 0.2021 0.0234 40LYS SC2 2406 23.585 20.272 6.906 -0.2889 0.0039 0.0833 41ASP BB 2407 23.604 20.036 7.556 -0.0049 0.1741 0.2150 41ASP SC1 2408 23.897 20.139 7.710 -0.1264 -0.0042 -0.1609 42ASP BB 2409 23.418 19.842 7.720 -0.0737 0.0477 0.0026 42ASP SC1 2410 23.140 20.015 7.847 -0.0860 -0.1279 0.0382 43ASP BB 2411 23.465 19.600 7.955 0.0908 -0.4079 -0.2148 43ASP SC1 2412 23.322 19.331 7.783 -0.4884 0.0525 0.2660 44ALA BB 2413 23.625 19.707 8.226 -0.1047 -0.0056 -0.2479 44ALA SC1 2414 23.828 19.531 8.198 -0.1295 -0.1251 0.2290 45GLU BB 2415 23.497 19.590 8.506 0.0836 -0.2943 -0.0750 45GLU SC1 2416 23.404 19.824 8.788 -0.0919 0.0525 0.2339 46THR BB 2417 23.713 19.435 8.687 0.1302 -0.0526 0.1464 46THR SC1 2418 23.814 19.595 8.926 0.2454 0.1068 -0.0070 47GLY BB 2419 23.810 19.081 8.634 -0.1259 0.0542 0.2248 48LEU BB 2420 24.066 19.067 8.448 -0.0178 -0.1983 -0.1718 48LEU SC1 2421 24.032 18.907 8.138 0.0171 0.0549 -0.0801 49THR BB 2422 24.360 19.176 8.365 0.0260 -0.0830 -0.0802 49THR SC1 2423 24.298 19.475 8.349 -0.4836 -0.1740 0.0157 50ASP BB 2424 24.669 19.156 8.394 -0.3111 0.0118 0.1271 50ASP SC1 2425 24.732 19.383 8.630 0.2040 0.0351 -0.1373 51GLY BB 2426 24.855 18.967 8.566 0.0346 -0.1557 -0.2079 52GLU BB 2427 24.903 18.866 8.847 -0.0222 -0.2126 0.1536 52GLU SC1 2428 24.872 18.470 8.822 -0.1667 0.2397 0.2754 53GLU BB 2429 25.010 19.065 9.004 -0.1787 -0.0800 0.1529 53GLU SC1 2430 25.108 18.928 9.387 -0.0490 0.0300 -0.0916 54LYS BB 2431 25.148 19.297 8.816 -0.5165 -0.1936 0.0367 54LYS SC1 2432 25.284 19.036 8.661 0.1364 0.0560 -0.0129 54LYS SC2 2433 25.228 18.703 8.529 -0.2986 0.0841 0.1097 55GLU BB 2434 25.521 19.374 8.803 0.1451 -0.0901 -0.0285 55GLU SC1 2435 25.592 19.695 8.679 0.1144 0.2284 -0.0253 56GLU BB 2436 25.719 19.128 8.823 -0.0013 -0.1818 -0.0005 56GLU SC1 2437 25.929 19.187 9.132 0.2052 0.0739 0.1527 57PRO BB 2438 25.709 18.896 8.566 0.1903 -0.2355 0.1103 57PRO SC1 2439 25.835 18.609 8.721 -0.0228 0.0789 0.2606 58LYS BB 2440 25.569 18.972 8.329 0.3274 0.0050 0.3728 58LYS SC1 2441 25.473 19.271 8.389 -0.0553 -0.2951 0.0495 58LYS SC2 2442 25.603 19.475 8.189 -0.1344 0.0788 0.1314 59GLU BB 2443 25.576 18.952 7.988 0.2024 0.0444 -0.0423 59GLU SC1 2444 25.392 18.555 8.022 -0.0175 -0.0583 -0.0646 60GLU BB 2445 25.673 19.153 7.770 0.1211 -0.2733 -0.0211 60GLU SC1 2446 25.977 19.275 7.945 -0.1552 0.2109 0.2295 61GLU BB 2447 25.735 19.104 7.420 -0.2361 0.1682 0.0855 61GLU SC1 2448 25.522 18.849 7.153 -0.3260 -0.0838 0.0313 1LYS BB 2449 26.770 17.674 11.077 0.0765 -0.0826 0.0697 1LYS SC1 2450 26.478 17.763 10.912 -0.1163 -0.2420 -0.2655 1LYS SC2 2451 26.194 17.722 10.720 -0.0481 -0.2661 0.1369 2LYS BB 2452 27.002 17.921 11.158 0.0559 0.1943 0.0888 2LYS SC1 2453 27.235 17.735 11.081 -0.0338 -0.1726 0.1701 2LYS SC2 2454 27.495 17.813 10.903 0.0188 -0.3515 -0.0161 3CYS BB 2455 27.222 18.011 11.429 -0.3305 -0.0467 0.0172 3CYS SC1 2456 27.464 18.106 11.206 -0.1078 0.1286 -0.0023 4LEU BB 2457 27.276 17.873 11.732 -0.0388 -0.3482 -0.0614 4LEU SC1 2458 27.041 17.983 11.971 0.0910 0.0055 0.3299 5PHE BB 2459 27.542 17.782 11.911 0.0131 -0.1384 -0.0567 5PHE SC1 2460 27.467 17.906 12.195 0.0246 0.0635 0.1720 5PHE SC2 2461 27.577 17.815 12.504 -0.0719 0.1982 0.2469 5PHE SC3 2462 27.745 18.006 12.364 0.0318 0.0504 0.1676 6LYS BB 2463 27.797 17.626 11.757 0.3128 0.0520 -0.2217 6LYS SC1 2464 28.092 17.745 11.621 0.1116 0.4772 -0.0905 6LYS SC2 2465 28.263 17.994 11.521 -0.1334 -0.3013 -0.0253 7LYS BB 2466 27.884 17.416 12.013 0.1325 0.0710 -0.0767 7LYS SC1 2467 27.926 17.606 12.258 -0.1408 -0.2584 0.0250 7LYS SC2 2468 28.089 17.856 12.463 0.2469 0.2829 0.0136 8LYS BB 2469 27.836 17.095 11.909 0.5249 -0.3185 -0.0394 8LYS SC1 2470 27.593 17.179 11.705 -0.1829 0.3196 -0.2145 8LYS SC2 2471 27.367 17.393 11.816 0.3326 0.1306 0.0488 9ASN BB 2472 27.875 16.895 12.146 -0.0811 -0.0420 -0.0681 9ASN SC1 2473 27.811 17.121 12.374 -0.0466 -0.1551 0.3718 10LYS BB 2474 27.911 16.567 12.077 0.2809 0.3224 0.1026 10LYS SC1 2475 27.988 16.448 12.332 0.2626 -0.4092 0.1154 10LYS SC2 2476 28.109 16.331 12.624 0.3531 0.0435 0.2145 11LYS BB 2477 27.738 16.300 11.950 -0.1812 -0.3000 0.1260 11LYS SC1 2478 27.539 16.286 11.678 0.1179 -0.0577 -0.1083 11LYS SC2 2479 27.532 16.304 11.332 0.5300 0.1981 -0.4078 12LYS BB 2480 27.878 15.990 11.846 0.0972 -0.1017 0.0870 12LYS SC1 2481 27.833 16.011 11.508 -0.0411 -0.1126 -0.0923 12LYS SC2 2482 27.832 15.746 11.258 0.1205 0.0024 -0.1312 13GLY BB 2483 27.863 15.713 12.023 0.2641 -0.0131 -0.1366 14LYS BB 2484 27.679 15.629 12.344 -0.1902 0.1026 0.1917 14LYS SC1 2485 28.020 15.556 12.388 0.0771 0.1657 -0.1790 14LYS SC2 2486 28.359 15.623 12.470 -0.0355 -0.0056 -0.3750 15GLU BB 2487 27.401 15.495 12.308 0.0275 -0.1555 -0.3864 15GLU SC1 2488 27.135 15.571 12.128 -0.3691 -0.2263 0.0738 16LYS BB 2489 27.269 15.387 12.620 0.3224 0.1018 -0.1834 16LYS SC1 2490 27.272 15.586 12.892 0.0070 0.1856 0.3612 16LYS SC2 2491 27.495 15.853 12.745 0.3416 0.1685 0.1734 17GLY BB 2492 27.022 15.326 12.469 -0.0321 -0.3089 0.1476 18GLY BB 2493 26.799 15.564 12.531 0.1147 -0.0622 0.1312 19LYS BB 2494 26.508 15.421 12.631 0.2016 0.1897 -0.0105 19LYS SC1 2495 26.540 15.218 12.372 -0.0520 0.1053 -0.0258 19LYS SC2 2496 26.740 15.252 12.155 0.0351 0.4000 0.0697 20ASN BB 2497 26.465 15.314 12.902 -0.2326 -0.0417 0.3351 20ASN SC1 2498 26.481 15.635 13.031 -0.1410 0.1599 0.1075 21ALA BB 2499 26.192 15.188 13.021 -0.1801 -0.1059 -0.1398 21ALA SC1 2500 26.050 15.414 13.061 0.0897 0.0463 -0.0163 22ILE BB 2501 25.930 14.956 12.939 0.2103 -0.0630 0.0023 22ILE SC1 2502 26.085 14.696 13.097 0.0889 -0.1609 -0.0385 23ASN BB 2503 25.803 14.846 12.683 -0.0638 -0.1418 0.2023 23ASN SC1 2504 25.949 14.774 12.407 0.1629 0.2013 0.2178 24MET BB 2505 25.543 15.027 12.608 0.0175 0.0468 0.1776 24MET SC1 2506 25.263 14.801 12.699 -0.1547 -0.0074 -0.0810 25LYS BB 2507 25.591 15.189 12.328 0.1105 -0.0653 -0.2856 25LYS SC1 2508 25.638 14.926 12.125 -0.2634 -0.4882 -0.1804 25LYS SC2 2509 25.490 14.791 11.819 -0.2283 0.2420 -0.1513 26ASP BB 2510 25.829 15.390 12.300 -0.0258 0.0866 0.0647 26ASP SC1 2511 26.032 15.245 12.551 -0.2897 0.1426 -0.0622 27VAL BB 2512 25.582 15.623 12.524 0.0500 -0.1512 0.1952 27VAL SC1 2513 25.348 15.462 12.594 0.0546 -0.4009 -0.3178 28LYS BB 2514 25.595 15.940 12.595 0.1966 -0.2761 -0.0385 28LYS SC1 2515 25.719 15.838 12.887 -0.0305 -0.1063 -0.1359 28LYS SC2 2516 25.917 15.933 13.136 0.0895 0.1416 -0.2741 29ASP BB 2517 25.307 16.002 12.437 0.2780 0.2590 0.0152 29ASP SC1 2518 25.284 16.093 12.128 -0.3109 0.2008 -0.0050 30LEU BB 2519 25.078 16.193 12.518 0.0491 -0.3218 -0.0312 30LEU SC1 2520 25.130 16.168 12.899 0.3410 0.3271 0.1494 31GLY BB 2521 24.886 16.284 12.307 0.2431 -0.0549 0.0950 32LYS BB 2522 24.853 16.233 11.956 -0.0068 0.2109 0.0291 32LYS SC1 2523 24.929 16.462 11.809 -0.1899 0.1378 -0.2627 32LYS SC2 2524 25.114 16.664 11.524 0.1361 -0.0037 0.1677 33THR BB 2525 24.948 15.984 11.846 -0.2562 -0.1054 0.0887 33THR SC1 2526 24.794 15.961 11.584 -0.1153 0.1456 -0.0203 34MET BB 2527 25.207 15.775 11.770 0.0883 0.1926 0.0569 34MET SC1 2528 25.029 15.542 11.658 -0.3225 0.1227 -0.1403 35LYS BB 2529 25.472 15.802 11.756 -0.1809 -0.4028 0.0490 35LYS SC1 2530 25.558 15.946 11.509 -0.1409 0.1702 -0.2403 35LYS SC2 2531 25.688 16.217 11.356 -0.1292 -0.3857 -0.0490 36ASP BB 2532 25.759 16.013 11.854 -0.2157 0.1068 -0.0774 36ASP SC1 2533 25.882 15.678 11.901 -0.2125 0.0425 0.0920 37GLN BB 2534 25.783 16.142 12.134 -0.1125 -0.0793 0.0663 37GLN SC1 2535 26.028 15.899 12.285 -0.1272 0.2269 0.1052 38ALA BB 2536 25.991 16.393 12.139 0.1056 -0.4613 -0.2470 38ALA SC1 2537 26.075 16.258 12.357 -0.0852 -0.0659 0.0842 39LEU BB 2538 26.282 16.450 12.001 -0.1344 0.1682 -0.0019 39LEU SC1 2539 26.425 16.200 12.244 0.2436 -0.0196 -0.0661 40LYS BB 2540 26.491 16.656 11.892 -0.0065 0.1693 -0.1198 40LYS SC1 2541 26.595 16.777 12.148 0.1961 -0.1538 -0.0453 40LYS SC2 2542 26.960 16.744 12.251 0.1456 0.0263 -0.0016 41ASP BB 2543 26.349 16.927 11.824 0.0277 0.1404 -0.0844 41ASP SC1 2544 26.002 16.836 11.852 -0.2958 -0.3958 -0.2428 42ASP BB 2545 26.307 17.114 11.532 -0.0829 0.0829 0.3071 42ASP SC1 2546 26.554 17.313 11.571 -0.0082 0.0446 0.3600 43ASP BB 2547 26.126 17.057 11.273 -0.1301 0.2148 0.0819 43ASP SC1 2548 26.337 16.852 11.128 0.1422 -0.0266 -0.2679 44ALA BB 2549 25.926 16.837 11.383 -0.0050 0.2240 0.0422 44ALA SC1 2550 25.746 17.029 11.443 0.0068 0.3804 -0.3908 45GLU BB 2551 25.929 16.581 11.211 -0.0278 -0.1665 0.1139 45GLU SC1 2552 25.516 16.634 11.330 0.1721 -0.0494 -0.1672 46THR BB 2553 26.132 16.328 11.241 0.4610 0.0113 -0.0412 46THR SC1 2554 26.057 16.101 11.052 -0.2025 0.0891 0.1032 47GLY BB 2555 26.260 16.239 11.515 -0.0917 -0.6283 0.0338 48LEU BB 2556 26.606 16.284 11.522 0.1539 -0.1605 -0.0844 48LEU SC1 2557 26.851 16.201 11.775 -0.0162 0.2028 0.0628 49THR BB 2558 26.707 16.074 11.334 -0.0273 0.1042 0.0632 49THR SC1 2559 26.445 15.952 11.237 -0.0846 0.1007 0.2198 50ASP BB 2560 27.030 16.139 11.267 0.0345 0.1683 0.0522 50ASP SC1 2561 27.131 15.857 11.170 0.1615 0.5510 0.3286 51GLY BB 2562 27.118 16.509 11.380 0.1381 0.0896 -0.2401 52GLU BB 2563 27.265 16.749 11.267 -0.2874 -0.0027 0.1757 52GLU SC1 2564 27.119 17.014 11.521 -0.1422 -0.1177 0.0119 53GLU BB 2565 27.307 16.709 10.914 -0.1468 0.2436 0.2233 53GLU SC1 2566 27.014 16.481 10.759 -0.0730 0.0499 0.1039 54LYS BB 2567 27.525 16.846 10.742 0.3042 -0.0226 0.2586 54LYS SC1 2568 27.599 16.879 10.441 -0.3031 0.0568 -0.1959 54LYS SC2 2569 27.429 16.999 10.204 0.1853 -0.0291 -0.2215 55GLU BB 2570 27.784 17.070 10.791 -0.4216 0.0210 -0.0067 55GLU SC1 2571 27.555 17.333 10.631 -0.0145 0.0351 -0.0592 56GLU BB 2572 27.980 17.020 11.024 -0.0371 -0.0754 -0.2656 56GLU SC1 2573 27.775 16.690 11.162 -0.4153 -0.0210 0.5368 57PRO BB 2574 28.286 17.112 11.089 -0.3760 0.0101 -0.1622 57PRO SC1 2575 28.556 17.131 10.883 0.3834 0.0080 0.2576 58LYS BB 2576 28.439 16.997 11.341 0.2199 -0.1043 0.1780 58LYS SC1 2577 28.191 16.834 11.418 -0.0163 -0.1207 0.1248 58LYS SC2 2578 28.165 16.833 11.772 -0.1156 0.1283 0.3108 59GLU BB 2579 28.507 17.102 11.634 0.0095 0.1468 0.0306 59GLU SC1 2580 28.662 17.454 11.668 0.1325 -0.0153 0.0256 60GLU BB 2581 28.609 16.951 11.839 -0.0577 0.1028 -0.0429 60GLU SC1 2582 28.306 17.114 12.110 -0.1408 0.3180 -0.0463 61GLU BB 2583 28.592 16.616 11.774 -0.1910 0.2204 -0.3058 61GLU SC1 2584 28.507 16.487 11.395 0.0213 0.1313 -0.4212 1LYS BB 2585 5.627 13.233 19.116 -0.1155 0.3178 0.0079 1LYS SC1 2586 5.729 13.165 19.406 -0.2107 -0.1424 0.2432 1LYS SC2 2587 5.510 13.199 19.653 -0.4662 0.0307 -0.0177 2LYS BB 2588 5.461 12.939 19.022 -0.1222 -0.0534 0.0761 2LYS SC1 2589 5.179 13.139 18.981 -0.3453 0.0623 -0.0858 2LYS SC2 2590 4.911 13.325 19.116 -0.0006 -0.1340 0.1463 3CYS BB 2591 5.362 12.798 19.316 -0.2316 0.0346 -0.1286 3CYS SC1 2592 5.140 13.049 19.345 -0.6648 -0.4826 0.1432 4LEU BB 2593 5.208 12.567 19.222 -0.1125 0.1189 0.1134 4LEU SC1 2594 5.198 12.575 18.861 0.0524 0.0013 0.0751 5PHE BB 2595 4.934 12.457 19.248 -0.3084 0.0175 -0.0540 5PHE SC1 2596 4.772 12.405 19.498 -0.1641 0.2355 -0.5123 5PHE SC2 2597 4.489 12.220 19.539 -0.0540 0.1293 -0.2042 5PHE SC3 2598 4.456 12.507 19.570 -0.1145 0.1108 -0.0921 6LYS BB 2599 4.836 12.091 19.164 -0.1329 -0.0129 0.1753 6LYS SC1 2600 5.117 11.912 19.142 0.1616 -0.5029 -0.4400 6LYS SC2 2601 5.321 11.659 19.235 0.0343 0.2393 -0.1185 7LYS BB 2602 4.788 11.912 19.469 0.0776 -0.3244 -0.0723 7LYS SC1 2603 4.529 11.825 19.517 -0.1000 0.1997 0.6118 7LYS SC2 2604 4.412 11.500 19.378 -0.6912 0.4147 -0.1399 8LYS BB 2605 5.009 12.030 19.704 0.2109 -0.1038 0.1213 8LYS SC1 2606 5.168 12.213 19.504 -0.1641 0.1291 0.2816 8LYS SC2 2607 5.487 12.395 19.589 0.0362 0.1726 0.0041 9ASN BB 2608 5.009 11.811 19.984 0.2410 0.0837 -0.1986 9ASN SC1 2609 5.272 11.607 19.993 -0.0571 -0.2090 0.2449 10LYS BB 2610 5.050 11.865 20.304 0.0398 -0.0178 0.0780 10LYS SC1 2611 4.835 11.974 20.403 0.0256 0.4679 -0.1432 10LYS SC2 2612 4.552 12.213 20.411 -0.1283 0.0942 -0.1092 11LYS BB 2613 5.232 11.613 20.491 0.2240 -0.0731 -0.0320 11LYS SC1 2614 4.979 11.543 20.659 0.2123 0.2769 0.2978 11LYS SC2 2615 4.722 11.475 20.830 0.1282 -0.2118 0.6211 12LYS BB 2616 5.524 11.687 20.334 0.2011 0.0575 -0.1116 12LYS SC1 2617 5.632 11.410 20.401 -0.0946 -0.2009 0.2654 12LYS SC2 2618 5.693 11.059 20.475 0.2020 0.2935 -0.2425 13GLY BB 2619 5.732 11.921 20.480 0.0352 -0.1843 0.1556 14LYS BB 2620 5.823 11.910 20.782 0.1932 -0.1000 0.0517 14LYS SC1 2621 6.086 11.984 20.661 0.1261 0.5517 0.0078 14LYS SC2 2622 6.423 11.886 20.564 0.0905 0.1693 -0.0376 15GLU BB 2623 5.819 12.189 20.959 0.2002 0.1293 0.0300 15GLU SC1 2624 6.140 12.185 21.100 0.0335 -0.0546 0.0664 16LYS BB 2625 5.609 12.401 20.909 -0.3190 -0.0479 -0.1385 16LYS SC1 2626 5.655 12.699 20.929 -0.2189 0.0787 -0.1827 16LYS SC2 2627 5.774 13.015 21.019 -0.1193 -0.2972 -0.0909 17GLY BB 2628 5.374 12.409 21.081 0.3201 -0.1068 -0.1182 18GLY BB 2629 5.309 12.322 21.410 -0.1952 -0.3126 -0.1616 19LYS BB 2630 5.586 12.300 21.573 -0.1390 -0.0923 0.1992 19LYS SC1 2631 5.913 12.283 21.614 -0.0160 -0.0849 -0.1283 19LYS SC2 2632 6.262 12.339 21.602 -0.0757 0.2068 0.3100 20ASN BB 2633 5.626 11.975 21.455 0.0551 0.2881 -0.0178 20ASN SC1 2634 5.439 11.986 21.194 -0.3552 -0.0247 -0.1447 21ALA BB 2635 5.686 11.723 21.693 -0.3647 -0.0435 -0.2943 21ALA SC1 2636 5.541 11.699 21.920 0.2255 -0.1464 0.0920 22ILE BB 2637 5.846 11.472 21.719 -0.1758 0.0233 0.1148 22ILE SC1 2638 6.100 11.616 21.896 -0.3274 0.0590 0.3068 23ASN BB 2639 5.649 11.193 21.604 -0.0055 0.2189 -0.1729 23ASN SC1 2640 5.637 11.196 21.291 0.0387 0.0512 0.1296 24MET BB 2641 5.746 10.887 21.666 -0.0984 -0.0179 0.0702 24MET SC1 2642 5.765 10.748 21.305 -0.1029 0.1038 -0.3032 25LYS BB 2643 5.530 10.630 21.757 -0.0498 0.0110 0.0480 25LYS SC1 2644 5.725 10.502 21.979 0.2531 -0.2473 -0.1397 25LYS SC2 2645 5.861 10.203 22.105 0.0069 -0.1336 0.0720 26ASP BB 2646 5.291 10.782 21.891 -0.4474 -0.0961 -0.0233 26ASP SC1 2647 5.107 10.563 22.018 0.2092 0.0410 -0.2288 27VAL BB 2648 5.231 11.081 21.846 -0.1987 0.1626 -0.2742 27VAL SC1 2649 5.326 11.314 21.994 -0.1190 -0.0236 -0.0256 28LYS BB 2650 5.036 11.189 21.677 -0.1505 -0.1394 -0.1336 28LYS SC1 2651 5.238 11.437 21.584 -0.1009 -0.1436 0.0118 28LYS SC2 2652 5.408 11.577 21.300 0.2976 0.0679 0.0963 29ASP BB 2653 4.742 11.415 21.740 0.3003 0.1075 0.2484 29ASP SC1 2654 4.399 11.437 21.581 -0.0301 -0.0236 -0.1518 30LEU BB 2655 4.645 11.476 22.017 -0.1198 0.0185 0.0852 30LEU SC1 2656 4.936 11.282 22.160 0.2167 -0.3942 0.1199 31GLY BB 2657 4.770 11.694 22.233 -0.3057 -0.0789 0.1268 32LYS BB 2658 4.947 11.993 22.226 -0.1925 -0.0111 0.2014 32LYS SC1 2659 5.015 11.930 22.552 -0.3491 -0.0918 -0.0385 32LYS SC2 2660 5.239 11.726 22.764 0.0398 0.0654 -0.1851 33THR BB 2661 5.010 12.157 21.952 -0.2693 -0.2840 0.2934 33THR SC1 2662 5.294 12.117 21.847 -0.2930 0.1410 0.0428 34MET BB 2663 4.840 12.262 21.743 -0.0297 -0.0110 0.0750 34MET SC1 2664 4.666 12.542 21.943 0.0226 0.2621 -0.0620 35LYS BB 2665 4.700 12.189 21.486 0.1336 0.0275 -0.1173 35LYS SC1 2666 4.402 12.279 21.572 -0.1956 -0.2873 -0.0779 35LYS SC2 2667 4.040 12.273 21.565 0.3198 -0.2990 -0.0382 36ASP BB 2668 4.741 12.283 21.201 -0.1866 0.2554 0.2037 36ASP SC1 2669 5.012 12.108 21.105 -0.4231 0.0358 -0.2557 37GLN BB 2670 4.954 12.545 21.221 -0.1097 0.0182 0.4222 37GLN SC1 2671 4.744 12.778 21.049 0.0038 0.1857 0.0716 38ALA BB 2672 4.818 12.650 21.485 -0.3127 0.0920 -0.3697 38ALA SC1 2673 4.555 12.649 21.546 -0.2178 0.3502 0.0994 39LEU BB 2674 4.774 12.994 21.534 -0.0252 -0.1249 0.0988 39LEU SC1 2675 4.583 13.293 21.425 0.5479 0.0529 -0.0246 40LYS BB 2676 5.023 13.225 21.611 -0.0046 0.0147 -0.2200 40LYS SC1 2677 4.908 13.437 21.857 0.0743 0.2300 0.0609 40LYS SC2 2678 4.864 13.772 21.840 0.0377 -0.0504 -0.3240 41ASP BB 2679 5.235 13.385 21.462 0.1219 0.3224 0.4731 41ASP SC1 2680 5.409 13.151 21.323 -0.1277 -0.1333 0.1567 42ASP BB 2681 5.256 13.685 21.516 0.2311 0.0787 -0.1013 42ASP SC1 2682 5.333 13.614 21.839 -0.2359 -0.0919 -0.3694 43ASP BB 2683 5.356 13.936 21.289 0.0263 -0.1712 -0.2071 43ASP SC1 2684 5.444 13.835 20.952 0.3319 -0.0092 0.0552 44ALA BB 2685 5.099 14.032 21.117 -0.1507 -0.0687 -0.1672 44ALA SC1 2686 5.003 14.186 21.316 -0.0860 0.2298 -0.3615 45GLU BB 2687 4.943 13.934 20.877 -0.1112 -0.3190 0.1798 45GLU SC1 2688 4.878 14.302 20.794 -0.2143 -0.1468 0.0739 46THR BB 2689 5.081 13.727 20.672 0.1604 -0.0239 -0.1588 46THR SC1 2690 5.266 13.945 20.565 0.0895 -0.0631 -0.3661 47GLY BB 2691 5.038 13.413 20.703 -0.3702 -0.1815 -0.0950 48LEU BB 2692 5.139 13.285 20.469 0.0437 -0.2637 -0.0756 48LEU SC1 2693 5.090 12.970 20.587 -0.1313 0.0852 -0.1576 49THR BB 2694 5.192 13.402 20.194 0.1337 -0.0606 0.1251 49THR SC1 2695 5.444 13.295 20.060 0.0545 -0.0283 -0.0544 50ASP BB 2696 5.273 13.728 20.099 -0.1096 -0.0851 0.1330 50ASP SC1 2697 5.611 13.703 20.082 -0.1302 -0.2726 -0.1187 51GLY BB 2698 5.244 13.629 19.804 0.3084 -0.1928 -0.1307 52GLU BB 2699 5.475 13.699 19.579 0.1917 -0.1795 0.0443 52GLU SC1 2700 5.260 13.430 19.380 -0.0632 -0.2363 0.0540 53GLU BB 2701 5.648 13.983 19.677 -0.1021 -0.1430 0.1099 53GLU SC1 2702 5.732 14.202 19.290 -0.0291 0.2608 0.0829 54LYS BB 2703 5.470 14.187 19.854 0.1550 0.2713 0.0479 54LYS SC1 2704 5.595 14.396 19.669 -0.3442 0.0961 0.1043 54LYS SC2 2705 5.764 14.638 19.455 -0.0124 -0.2506 0.0548 55GLU BB 2706 5.179 14.348 19.881 -0.0885 0.3371 0.3489 55GLU SC1 2707 4.867 14.276 19.623 0.2962 0.1304 0.0511 56GLU BB 2708 5.036 14.690 19.891 -0.2862 0.3734 0.1702 56GLU SC1 2709 5.317 14.876 19.622 -0.0187 0.1578 0.0498 57PRO BB 2710 4.807 14.662 20.139 -0.0396 -0.0195 -0.2316 57PRO SC1 2711 4.714 14.992 20.184 0.0760 0.1992 -0.1216 58LYS BB 2712 4.579 14.461 20.375 0.0398 -0.0344 0.2168 58LYS SC1 2713 4.701 14.743 20.547 0.2677 0.0091 -0.3235 58LYS SC2 2714 4.708 14.781 20.861 -0.1856 0.2193 0.0739 59GLU BB 2715 4.246 14.303 20.351 -0.2137 -0.0567 -0.2242 59GLU SC1 2716 4.003 14.146 20.564 0.0171 0.0337 0.1289 60GLU BB 2717 3.989 14.398 20.138 0.0838 -0.1544 -0.0332 60GLU SC1 2718 3.922 14.118 19.884 0.0981 -0.0595 -0.2161 61GLU BB 2719 3.823 14.666 20.106 0.1167 -0.0575 0.1785 61GLU SC1 2720 3.444 14.732 20.070 0.0376 -0.0404 -0.1473 1LYS BB 2721 16.406 14.038 15.162 0.0584 -0.2834 0.2628 1LYS SC1 2722 16.598 13.862 15.022 -0.1175 -0.0822 0.0068 1LYS SC2 2723 16.925 13.907 14.908 0.2002 0.1904 0.2363 2LYS BB 2724 16.155 13.818 15.223 0.3066 0.0231 0.0625 2LYS SC1 2725 15.995 13.958 15.450 0.1109 -0.1250 0.3775 2LYS SC2 2726 15.733 14.089 15.578 0.0025 -0.0873 0.2047 3CYS BB 2727 16.232 13.535 15.351 -0.0596 -0.1129 0.2791 3CYS SC1 2728 16.531 13.451 15.317 -0.6277 0.0444 -0.1423 4LEU BB 2729 16.272 13.408 15.674 0.3420 -0.0780 -0.0612 4LEU SC1 2730 16.602 13.448 15.739 0.0347 -0.2806 0.1529 5PHE BB 2731 16.280 13.082 15.798 0.2545 0.0773 0.0922 5PHE SC1 2732 16.545 12.944 15.693 0.2221 -0.0266 -0.0989 5PHE SC2 2733 16.725 12.794 15.939 -0.1475 0.1715 0.3067 5PHE SC3 2734 16.842 13.036 15.830 0.1330 -0.0455 0.1105 6LYS BB 2735 16.128 13.089 16.117 -0.2433 0.0772 0.2514 6LYS SC1 2736 16.454 13.101 16.278 -0.1445 0.1148 0.0185 6LYS SC2 2737 16.778 12.956 16.376 -0.0660 0.4045 0.2256 7LYS BB 2738 15.844 13.213 16.193 0.0245 -0.1864 0.0910 7LYS SC1 2739 15.943 13.511 16.217 0.0615 0.3980 -0.0163 7LYS SC2 2740 15.981 13.817 16.334 0.3465 0.1800 -0.2230 8LYS BB 2741 15.524 13.045 16.083 -0.2710 -0.1792 -0.1528 8LYS SC1 2742 15.301 13.222 16.182 0.2233 -0.3295 -0.2902 8LYS SC2 2743 15.244 13.374 16.476 -0.0838 -0.2379 -0.3056 9ASN BB 2744 15.430 12.865 15.802 0.0329 0.0673 -0.0067 9ASN SC1 2745 15.248 12.586 15.823 0.1283 0.1510 -0.3577 10LYS BB 2746 15.543 12.819 15.473 -0.3653 0.1270 0.0879 10LYS SC1 2747 15.517 13.111 15.353 -0.2529 -0.0957 0.0491 10LYS SC2 2748 15.434 13.345 15.080 -0.3162 0.1308 0.0281 11LYS BB 2749 15.841 12.740 15.453 0.0904 0.3108 0.0071 11LYS SC1 2750 16.127 12.857 15.354 0.1531 -0.1382 0.0667 11LYS SC2 2751 16.317 13.113 15.122 0.0362 -0.0309 -0.2679 12LYS BB 2752 15.908 12.444 15.406 0.3044 0.0396 0.1508 12LYS SC1 2753 16.158 12.441 15.181 -0.2491 0.0827 0.1115 12LYS SC2 2754 16.343 12.170 15.209 -0.0120 0.2521 0.0473 13GLY BB 2755 16.101 12.241 15.602 -0.1507 -0.0995 -0.4118 14LYS BB 2756 16.000 12.081 15.862 -0.1289 0.1001 0.1359 14LYS SC1 2757 15.707 12.045 15.809 0.0302 -0.1285 0.0862 14LYS SC2 2758 15.526 11.788 15.723 -0.1968 0.0208 0.2691 15GLU BB 2759 16.107 11.950 16.120 -0.0315 0.1311 -0.1377 15GLU SC1 2760 15.785 11.746 16.119 -0.0425 -0.0400 -0.1233 16LYS BB 2761 16.395 11.836 16.068 -0.1681 -0.1285 -0.0277 16LYS SC1 2762 16.297 11.534 16.133 0.1149 -0.1793 0.0964 16LYS SC2 2763 16.175 11.257 16.295 -0.1228 -0.1540 0.1844 17GLY BB 2764 16.659 11.985 16.169 0.1789 0.1247 0.0650 18GLY BB 2765 16.960 11.922 16.209 -0.4369 0.2003 -0.0424 19LYS BB 2766 17.227 12.164 16.129 0.0289 0.0713 0.0314 19LYS SC1 2767 17.283 12.223 16.455 -0.1465 -0.1259 0.2462 19LYS SC2 2768 17.210 12.349 16.767 0.1429 0.0211 -0.4224 20ASN BB 2769 17.299 12.450 16.036 0.0330 0.0133 0.1723 20ASN SC1 2770 17.185 12.450 15.767 -0.0065 0.2517 0.0823 21ALA BB 2771 17.629 12.495 15.988 -0.3204 0.1590 -0.1148 21ALA SC1 2772 17.659 12.355 16.216 -0.1130 -0.1881 -0.3464 22ILE BB 2773 17.781 12.462 15.733 0.1582 -0.2048 0.0211 22ILE SC1 2774 18.055 12.644 15.644 0.0703 -0.0468 0.0711 23ASN BB 2775 17.661 12.493 15.447 -0.0360 0.2805 -0.2561 23ASN SC1 2776 17.327 12.542 15.395 0.0493 -0.0617 0.2926 24MET BB 2777 17.701 12.756 15.244 -0.1021 0.0231 -0.1470 24MET SC1 2778 18.085 12.834 15.245 0.0646 0.0351 -0.1085 25LYS BB 2779 17.549 13.023 15.304 0.3453 0.1852 0.3229 25LYS SC1 2780 17.283 12.905 15.232 0.2999 0.0907 -0.4011 25LYS SC2 2781 16.936 12.823 15.119 -0.1660 -0.2751 -0.1371 26ASP BB 2782 17.689 13.044 15.633 -0.0148 -0.2298 0.5884 26ASP SC1 2783 17.477 12.795 15.713 0.0779 0.4471 -0.0273 27VAL BB 2784 17.858 13.269 15.833 -0.0744 -0.1639 -0.3196 27VAL SC1 2785 18.119 13.143 15.796 -0.1621 -0.3217 -0.4157 28LYS BB 2786 17.922 13.254 16.161 0.0368 0.1813 -0.1876 28LYS SC1 2787 18.102 13.520 16.207 -0.0123 0.0525 0.2344 28LYS SC2 2788 18.131 13.732 16.432 0.3922 0.0225 -0.2250 29ASP BB 2789 17.709 13.160 16.368 0.0059 0.1756 -0.0775 29ASP SC1 2790 17.567 13.432 16.432 -0.2882 0.0928 -0.0902 30LEU BB 2791 17.820 12.948 16.626 0.2059 -0.2621 -0.3245 30LEU SC1 2792 17.857 12.645 16.468 -0.1062 0.0849 0.3178 31GLY BB 2793 18.028 12.935 16.919 -0.0886 -0.0802 -0.3625 32LYS BB 2794 18.372 12.937 16.961 0.0968 0.0869 -0.3480 32LYS SC1 2795 18.490 12.676 17.082 0.3281 0.0535 -0.2377 32LYS SC2 2796 18.678 12.691 17.406 -0.1284 0.4064 0.2420 33THR BB 2797 18.405 13.289 17.014 -0.0266 -0.2525 0.1383 33THR SC1 2798 18.688 13.212 16.928 -0.0166 -0.0229 -0.0444 34MET BB 2799 18.200 13.429 17.220 0.0059 -0.2398 -0.0040 34MET SC1 2800 17.823 13.311 17.233 0.0748 0.2506 -0.2352 35LYS BB 2801 18.276 13.747 17.340 0.0084 -0.2969 -0.0937 35LYS SC1 2802 18.485 13.633 17.486 -0.3822 -0.1385 -0.3170 35LYS SC2 2803 18.757 13.491 17.362 0.0109 0.1405 -0.2492 36ASP BB 2804 18.319 13.944 17.122 0.1729 -0.1707 -0.0778 36ASP SC1 2805 18.236 13.756 16.861 0.1552 -0.2128 0.1032 37GLN BB 2806 18.298 14.267 17.100 0.0899 -0.2843 -0.0722 37GLN SC1 2807 18.664 14.431 17.132 0.1575 -0.0573 0.0521 38ALA BB 2808 18.327 14.419 17.394 -0.0063 -0.1934 0.0680 38ALA SC1 2809 18.545 14.472 17.545 0.0026 -0.1027 0.0237 39LEU BB 2810 18.142 14.444 17.688 -0.1330 0.2045 0.1014 39LEU SC1 2811 18.306 14.772 17.736 0.1319 -0.0649 -0.4384 40LYS BB 2812 17.817 14.534 17.631 -0.0039 -0.2331 0.0418 40LYS SC1 2813 17.941 14.673 17.374 0.1091 0.4059 -0.1482 40LYS SC2 2814 17.994 15.031 17.295 -0.0335 -0.0696 -0.0533 41ASP BB 2815 17.499 14.478 17.748 -0.2492 0.3211 0.1437 41ASP SC1 2816 17.474 14.768 17.859 0.2308 -0.1922 -0.2276 42ASP BB 2817 17.206 14.463 17.607 0.0708 0.3612 -0.1035 42ASP SC1 2818 17.369 14.475 17.298 0.0769 -0.0068 -0.1271 43ASP BB 2819 16.864 14.395 17.639 0.2402 -0.0078 -0.0688 43ASP SC1 2820 16.646 14.636 17.734 -0.1363 -0.1208 0.2661 44ALA BB 2821 16.852 14.129 17.876 0.1195 0.1439 0.0012 44ALA SC1 2822 16.616 13.998 17.867 0.2846 -0.1675 0.0459 45GLU BB 2823 17.018 13.960 18.162 -0.0777 0.0078 0.0576 45GLU SC1 2824 17.347 14.043 17.950 0.0108 0.0803 -0.0592 46THR BB 2825 17.086 14.159 18.365 -0.0432 0.2407 0.1533 46THR SC1 2826 17.346 14.049 18.479 -0.2769 -0.3643 0.1361 47GLY BB 2827 17.125 14.468 18.511 0.1875 0.6773 -0.0249 48LEU BB 2828 17.396 14.607 18.652 -0.1228 -0.1239 0.0877 48LEU SC1 2829 17.220 14.886 18.744 0.0956 0.1255 -0.3759 49THR BB 2830 17.550 14.438 18.853 -0.2533 -0.0668 0.0868 49THR SC1 2831 17.352 14.389 19.079 -0.2420 -0.1959 0.0696 50ASP BB 2832 17.833 14.258 18.758 0.1346 0.0270 0.0866 50ASP SC1 2833 17.889 14.427 18.492 -0.0347 -0.0927 0.4746 51GLY BB 2834 17.801 13.991 18.693 -0.0608 0.1278 -0.5682 52GLU BB 2835 17.537 13.819 18.899 0.1680 0.1922 -0.3650 52GLU SC1 2836 17.614 14.039 19.207 -0.0740 -0.2077 -0.0129 53GLU BB 2837 17.278 13.702 18.917 0.0166 -0.2304 -0.1023 53GLU SC1 2838 17.405 13.363 18.710 -0.1366 0.1660 -0.1693 54LYS BB 2839 17.022 13.798 18.717 0.0884 -0.0606 -0.6834 54LYS SC1 2840 16.997 13.600 18.504 -0.0965 0.0104 0.0032 54LYS SC2 2841 16.816 13.561 18.212 -0.3214 0.5449 -0.2319 55GLU BB 2842 16.801 13.970 18.895 0.2911 0.0088 0.0219 55GLU SC1 2843 16.700 14.285 18.671 0.0375 0.1458 0.0409 56GLU BB 2844 16.554 13.717 18.922 -0.1062 0.0218 -0.1551 56GLU SC1 2845 16.516 13.606 18.558 0.0046 0.1038 0.0429 57PRO BB 2846 16.393 13.603 19.167 -0.1189 0.3488 -0.0827 57PRO SC1 2847 16.153 13.371 19.215 0.5989 -0.1132 -0.1372 58LYS BB 2848 16.646 13.359 19.272 0.0122 0.3584 -0.2934 58LYS SC1 2849 16.438 13.324 19.530 -0.2759 0.0244 -0.3708 58LYS SC2 2850 16.590 13.146 19.810 0.1662 -0.0287 -0.2262 59GLU BB 2851 16.897 13.393 19.469 -0.1461 -0.0656 0.1167 59GLU SC1 2852 16.948 13.030 19.466 -0.4474 -0.2131 0.1434 60GLU BB 2853 16.946 13.464 19.795 0.1745 -0.0171 -0.1799 60GLU SC1 2854 17.015 13.821 19.821 0.0984 0.0269 0.1113 61GLU BB 2855 17.060 13.169 19.919 0.2134 -0.1169 0.0351 61GLU SC1 2856 16.801 13.205 20.213 -0.0211 -0.1850 -0.1451 1LYS BB 2857 19.481 20.314 12.100 0.0169 -0.1897 -0.5260 1LYS SC1 2858 19.489 20.556 12.276 -0.0261 -0.1259 -0.1525 1LYS SC2 2859 19.223 20.671 12.418 0.0538 -0.0655 0.0250 2LYS BB 2860 19.812 20.415 11.972 0.4716 -0.1352 0.2503 2LYS SC1 2861 20.021 20.242 12.112 0.2889 0.0363 -0.0589 2LYS SC2 2862 20.221 20.067 12.340 -0.0178 0.1852 -0.4467 3CYS BB 2863 19.901 20.712 12.042 -0.1218 0.2291 -0.1161 3CYS SC1 2864 19.639 20.921 12.171 -0.0200 0.2272 -0.0095 4LEU BB 2865 20.130 20.692 12.287 0.0004 0.0143 -0.3235 4LEU SC1 2866 19.907 20.781 12.580 -0.0085 0.0028 -0.1993 5PHE BB 2867 20.309 20.978 12.465 -0.0287 0.0694 -0.0208 5PHE SC1 2868 20.136 21.188 12.621 -0.3513 -0.1712 -0.1764 5PHE SC2 2869 19.976 21.104 12.909 -0.0560 0.3137 0.1431 5PHE SC3 2870 19.812 21.237 12.711 -0.2696 -0.0559 0.0632 6LYS BB 2871 20.573 21.027 12.394 -0.1760 0.3330 -0.0003 6LYS SC1 2872 20.587 20.834 12.140 0.0552 -0.4106 0.1046 6LYS SC2 2873 20.303 20.912 11.877 0.0665 0.0142 0.2323 7LYS BB 2874 20.622 21.337 12.523 -0.1264 -0.3151 -0.1363 7LYS SC1 2875 20.495 21.294 12.824 -0.0673 -0.2990 -0.2802 7LYS SC2 2876 20.436 21.017 13.032 -0.0180 0.0281 0.3147 8LYS BB 2877 20.815 21.577 12.494 0.2338 -0.2406 -0.4463 8LYS SC1 2878 20.659 21.828 12.432 -0.0275 -0.4801 -0.0684 8LYS SC2 2879 20.434 22.051 12.492 0.3041 -0.1317 0.1403 9ASN BB 2880 21.136 21.511 12.508 -0.2305 0.2466 0.0604 9ASN SC1 2881 21.308 21.333 12.280 0.0178 -0.0495 0.0448 10LYS BB 2882 21.368 21.370 12.758 0.2946 -0.0763 0.2442 10LYS SC1 2883 21.520 21.474 12.978 -0.0560 -0.1384 0.5556 10LYS SC2 2884 21.796 21.602 13.162 0.1087 0.0888 0.1009 11LYS BB 2885 21.466 21.053 12.693 -0.1915 -0.1838 -0.3491 11LYS SC1 2886 21.702 20.983 12.474 0.1572 -0.1696 -0.1475 11LYS SC2 2887 22.040 20.940 12.415 -0.0872 -0.2064 -0.3153 12LYS BB 2888 21.299 20.759 12.754 0.1673 -0.0704 0.3669 12LYS SC1 2889 21.475 20.630 12.945 0.1416 -0.0249 -0.3883 12LYS SC2 2890 21.730 20.392 13.118 -0.1346 0.0886 0.4257 13GLY BB 2891 21.371 20.506 12.559 0.0717 0.1577 -0.0193 14LYS BB 2892 21.187 20.225 12.464 0.0117 0.3362 -0.3182 14LYS SC1 2893 21.136 20.464 12.256 -0.1201 -0.2695 0.2328 14LYS SC2 2894 20.957 20.703 12.299 0.3054 0.1511 -0.1816 15GLU BB 2895 21.352 19.947 12.358 0.0898 0.0739 -0.0010 15GLU SC1 2896 21.472 19.767 12.699 0.1943 -0.0981 0.2411 16LYS BB 2897 21.310 19.926 12.051 -0.0057 0.2613 -0.2525 16LYS SC1 2898 21.598 20.080 12.025 -0.2534 0.2187 -0.0067 16LYS SC2 2899 21.900 20.125 12.247 -0.4278 0.0248 -0.0468 17GLY BB 2900 21.027 19.709 11.942 0.1458 0.0072 -0.3007 18GLY BB 2901 20.881 19.432 12.069 0.1539 0.2945 0.2021 19LYS BB 2902 20.615 19.408 11.889 -0.2529 -0.0050 -0.1498 19LYS SC1 2903 20.549 19.100 11.878 0.0533 0.1482 0.1275 19LYS SC2 2904 20.222 18.982 11.913 0.0500 0.4575 -0.0162 20ASN BB 2905 20.590 19.572 11.619 0.0436 -0.2676 -0.1743 20ASN SC1 2906 20.692 19.428 11.376 0.1838 0.1628 -0.0916 21ALA BB 2907 20.306 19.737 11.502 -0.0687 0.1538 -0.1776 21ALA SC1 2908 20.107 19.772 11.681 -0.0815 -0.1122 -0.1356 22ILE BB 2909 20.267 20.087 11.394 0.0400 -0.2900 0.1867 22ILE SC1 2910 19.951 19.960 11.403 0.0241 -0.2386 0.4066 23ASN BB 2911 20.495 20.287 11.337 -0.1037 0.0800 0.1017 23ASN SC1 2912 20.522 20.358 11.039 -0.0206 -0.1532 -0.1446 24MET BB 2913 20.476 20.617 11.497 -0.0612 -0.2634 -0.3363 24MET SC1 2914 20.264 20.477 11.767 0.3120 -0.0029 0.0820 25LYS BB 2915 20.554 20.928 11.450 -0.0154 0.0087 -0.1423 25LYS SC1 2916 20.803 20.858 11.300 0.0957 0.2914 -0.0259 25LYS SC2 2917 20.889 20.661 11.007 -0.0782 -0.2364 0.1138 26ASP BB 2918 20.662 21.194 11.653 0.2257 0.2587 -0.1119 26ASP SC1 2919 20.604 21.518 11.665 0.0795 -0.1565 -0.5072 27VAL BB 2920 20.974 21.246 11.566 0.2568 -0.0781 -0.1202 27VAL SC1 2921 21.069 21.506 11.658 0.2747 -0.2591 0.4033 28LYS BB 2922 21.111 21.286 11.220 0.2168 0.1703 0.4982 28LYS SC1 2923 21.368 21.495 11.154 -0.3414 0.2180 -0.1858 28LYS SC2 2924 21.726 21.520 11.170 0.2728 -0.1027 -0.0962 29ASP BB 2925 21.117 21.080 10.997 0.1863 -0.2844 -0.1863 29ASP SC1 2926 20.789 21.202 10.928 0.2330 -0.1968 0.1814 30LEU BB 2927 21.353 20.897 10.871 -0.1288 0.0139 0.1422 30LEU SC1 2928 21.343 20.969 10.564 -0.1909 0.3422 0.5777 31GLY BB 2929 21.696 20.978 10.817 -0.3184 -0.0956 -0.0588 32LYS BB 2930 22.013 20.875 11.034 -0.0821 -0.1834 -0.0302 32LYS SC1 2931 22.055 20.998 11.328 0.2098 -0.0577 -0.4378 32LYS SC2 2932 22.199 20.973 11.632 0.1657 0.0264 0.2549 33THR BB 2933 22.111 20.616 11.136 -0.2411 -0.0873 0.3087 33THR SC1 2934 22.407 20.543 11.158 -0.1571 0.1269 -0.0361 34MET BB 2935 21.878 20.370 11.254 -0.1391 0.0174 0.1763 34MET SC1 2936 21.812 20.647 11.540 0.1484 -0.0297 -0.0919 35LYS BB 2937 21.913 20.106 11.034 0.0881 -0.1049 -0.2105 35LYS SC1 2938 21.653 19.902 11.076 -0.0713 -0.0746 0.1592 35LYS SC2 2939 21.508 19.617 11.250 -0.5605 0.3982 -0.0137 36ASP BB 2940 22.195 20.162 10.820 0.2598 0.2765 -0.0784 36ASP SC1 2941 22.547 20.239 10.865 -0.4092 -0.1051 -0.3233 37GLN BB 2942 22.313 19.850 10.779 0.1445 -0.1667 -0.2358 37GLN SC1 2943 22.627 19.879 10.539 0.4534 -0.0153 0.1364 38ALA BB 2944 22.282 19.710 11.051 0.0516 0.1361 0.0485 38ALA SC1 2945 22.490 19.726 11.222 -0.2706 0.0706 0.4628 39LEU BB 2946 22.026 19.667 11.313 0.2679 -0.1569 -0.3476 39LEU SC1 2947 22.001 19.983 11.450 0.0334 0.1774 0.0862 40LYS BB 2948 21.909 19.334 11.338 0.1673 0.2217 -0.0267 40LYS SC1 2949 21.995 19.267 11.083 0.0106 0.1390 -0.1734 40LYS SC2 2950 22.242 19.306 10.797 0.4734 -0.0205 -0.1424 41ASP BB 2951 21.704 19.218 11.567 0.2588 -0.2276 -0.1887 41ASP SC1 2952 21.375 19.295 11.526 0.2916 -0.2343 -0.4419 42ASP BB 2953 21.932 19.173 11.827 -0.0029 -0.0954 0.2465 42ASP SC1 2954 22.101 19.464 11.804 0.5102 -0.2368 0.0778 43ASP BB 2955 21.886 18.908 12.002 0.2294 -0.0634 0.2867 43ASP SC1 2956 21.989 18.679 11.781 0.3377 0.0863 -0.1801 44ALA BB 2957 21.754 18.940 12.315 0.1304 -0.0299 0.1652 44ALA SC1 2958 21.509 19.041 12.259 0.2589 0.1332 -0.1261 45GLU BB 2959 21.911 18.920 12.585 -0.1188 0.1038 0.0817 45GLU SC1 2960 21.895 18.547 12.613 0.1600 0.0479 -0.3127 46THR BB 2961 22.148 19.072 12.696 -0.1991 -0.2790 -0.0065 46THR SC1 2962 22.000 19.328 12.768 0.1405 -0.0086 -0.2330 47GLY BB 2963 22.417 19.058 12.860 -0.2150 0.2836 -0.1799 48LEU BB 2964 22.597 19.326 12.974 -0.1520 -0.0717 0.0170 48LEU SC1 2965 22.524 19.199 13.272 0.0001 0.0247 -0.2532 49THR BB 2966 22.893 19.455 12.868 -0.0574 0.0382 -0.0961 49THR SC1 2967 22.900 19.262 12.632 -0.1873 -0.0494 -0.0297 50ASP BB 2968 23.009 19.792 12.814 -0.0556 0.0437 -0.3514 50ASP SC1 2969 22.745 19.905 13.028 0.2151 -0.0297 -0.2005 51GLY BB 2970 23.292 19.950 12.982 -0.0249 -0.1131 0.0300 52GLU BB 2971 23.340 19.749 13.224 -0.0432 -0.1556 0.0501 52GLU SC1 2972 23.292 19.744 13.611 0.0617 -0.1283 0.1815 53GLU BB 2973 23.659 19.624 13.175 0.0038 -0.1110 0.2636 53GLU SC1 2974 23.734 19.337 12.961 0.4103 -0.0804 -0.1279 54LYS BB 2975 23.788 19.920 13.079 0.3962 0.1024 0.2247 54LYS SC1 2976 23.863 20.186 13.301 0.1130 0.5403 0.1597 54LYS SC2 2977 24.045 20.443 13.324 -0.0960 -0.1727 0.1732 55GLU BB 2978 23.727 20.160 12.861 -0.4042 -0.2286 -0.0630 55GLU SC1 2979 24.109 20.178 12.764 -0.1315 -0.2184 -0.2150 56GLU BB 2980 23.487 20.146 12.655 -0.0076 -0.0647 0.0316 56GLU SC1 2981 23.594 19.745 12.632 -0.0484 -0.1454 0.0349 57PRO BB 2982 23.144 20.249 12.659 0.1924 -0.0435 -0.1027 57PRO SC1 2983 23.014 20.267 12.967 -0.2728 -0.1042 0.2055 58LYS BB 2984 22.889 20.320 12.416 0.1702 0.2691 -0.1720 58LYS SC1 2985 22.812 20.019 12.490 -0.1569 0.4140 -0.0361 58LYS SC2 2986 22.534 19.772 12.659 0.3504 -0.0660 0.1449 59GLU BB 2987 22.662 20.534 12.371 -0.1364 -0.0892 -0.0043 59GLU SC1 2988 22.965 20.775 12.345 0.0004 -0.1767 -0.1319 60GLU BB 2989 22.378 20.620 12.445 -0.1977 -0.1978 0.3775 60GLU SC1 2990 22.197 20.533 12.073 -0.0452 -0.1799 -0.1344 61GLU BB 2991 22.150 20.409 12.574 0.2014 -0.1271 -0.0287 61GLU SC1 2992 21.935 20.610 12.760 -0.0870 -0.0597 0.0690 1LYS BB 2993 10.371 15.138 15.323 -0.1446 0.1084 -0.0520 1LYS SC1 2994 10.457 15.070 15.630 0.0593 0.1607 -0.0068 1LYS SC2 2995 10.743 14.997 15.774 -0.2251 0.2810 -0.0522 2LYS BB 2996 10.042 15.182 15.319 0.1176 0.1517 -0.0805 2LYS SC1 2997 9.976 15.485 15.336 0.6567 0.4975 0.3625 2LYS SC2 2998 10.032 15.854 15.434 -0.0108 -0.0738 0.3156 3CYS BB 2999 9.912 14.980 15.543 0.0699 -0.1466 -0.2637 3CYS SC1 3000 9.644 15.202 15.625 -0.1281 0.1613 -0.2464 4LEU BB 3001 10.066 14.906 15.797 0.2081 0.2148 -0.1929 4LEU SC1 3002 9.852 14.860 16.098 0.3681 0.1790 -0.1608 5PHE BB 3003 10.304 14.718 15.869 -0.2010 -0.1903 -0.3541 5PHE SC1 3004 10.471 14.863 16.071 -0.2965 -0.2322 0.0540 5PHE SC2 3005 10.431 14.979 16.388 0.3950 0.0685 0.0491 5PHE SC3 3006 10.476 14.693 16.366 -0.2029 -0.0475 0.1607 6LYS BB 3007 10.289 14.402 15.887 0.2619 -0.0907 -0.0196 6LYS SC1 3008 10.425 14.349 16.246 -0.3306 -0.0100 -0.3314 6LYS SC2 3009 10.447 14.222 16.554 0.3478 0.2041 -0.0286 7LYS BB 3010 10.248 14.156 15.706 -0.4824 -0.1316 0.0257 7LYS SC1 3011 9.973 14.081 15.729 0.1855 0.1166 -0.4089 7LYS SC2 3012 9.688 13.909 15.901 0.1024 -0.1379 -0.1657 8LYS BB 3013 10.336 14.097 15.379 0.2490 -0.0895 0.1688 8LYS SC1 3014 10.151 13.833 15.404 0.2875 -0.4274 0.0310 8LYS SC2 3015 10.325 13.609 15.443 -0.1559 0.3745 -0.1107 9ASN BB 3016 10.612 13.965 15.287 0.0940 -0.2182 -0.3155 9ASN SC1 3017 10.831 14.266 15.231 0.0458 -0.1911 -0.2293 10LYS BB 3018 10.663 13.896 14.953 -0.2626 -0.0464 0.0374 10LYS SC1 3019 10.579 14.187 14.887 0.2327 0.0340 0.1814 10LYS SC2 3020 10.398 14.418 14.966 -0.3443 -0.1614 0.1597 11LYS BB 3021 10.871 13.679 14.851 -0.0323 0.1348 -0.0100 11LYS SC1 3022 10.764 13.478 14.629 0.0735 -0.2209 0.1838 11LYS SC2 3023 10.603 13.407 14.329 -0.4436 -0.2584 0.2201 12LYS BB 3024 11.213 13.653 14.810 0.1212 0.1040 -0.2990 12LYS SC1 3025 11.477 13.546 14.635 0.0895 0.1886 -0.2377 12LYS SC2 3026 11.799 13.394 14.598 -0.0900 0.1922 0.2123 13GLY BB 3027 11.289 13.896 14.511 0.0569 -0.1233 0.0083 14LYS BB 3028 11.439 13.776 14.292 -0.0971 -0.0604 0.3580 14LYS SC1 3029 11.373 13.854 14.004 0.1676 0.1659 -0.0997 14LYS SC2 3030 11.102 13.671 13.887 -0.1685 0.2111 -0.3416 15GLU BB 3031 11.380 13.435 14.232 -0.1743 -0.2235 -0.2257 15GLU SC1 3032 11.734 13.268 14.165 -0.0908 0.0317 0.1400 16LYS BB 3033 11.113 13.408 14.375 -0.2113 -0.0466 -0.1939 16LYS SC1 3034 11.017 13.103 14.364 0.1115 -0.0984 -0.1551 16LYS SC2 3035 10.961 12.819 14.576 -0.2707 -0.1221 -0.1296 17GLY BB 3036 10.970 13.698 14.306 0.2004 -0.3564 -0.0643 18GLY BB 3037 10.719 13.921 14.455 -0.1455 -0.1311 -0.1913 19LYS BB 3038 10.385 13.850 14.447 0.0973 -0.2330 0.2519 19LYS SC1 3039 10.253 13.744 14.153 -0.1605 0.0870 -0.2566 19LYS SC2 3040 10.138 13.558 13.875 -0.1268 -0.4406 0.2988 20ASN BB 3041 10.281 13.602 14.622 -0.0478 0.3463 0.2524 20ASN SC1 3042 9.972 13.699 14.637 -0.2190 0.3025 -0.0269 21ALA BB 3043 10.378 13.539 15.016 0.0140 0.0531 0.3254 21ALA SC1 3044 10.127 13.454 15.069 -0.0455 -0.0738 -0.1214 22ILE BB 3045 10.468 13.230 15.136 0.0464 -0.2116 0.0509 22ILE SC1 3046 10.216 13.000 15.149 -0.2001 0.0662 0.3517 23ASN BB 3047 10.576 13.130 15.410 -0.1387 0.4489 0.0335 23ASN SC1 3048 10.599 13.340 15.688 0.0433 0.0849 0.1321 24MET BB 3049 10.539 12.796 15.540 0.1342 -0.2084 -0.3716 24MET SC1 3050 10.835 12.751 15.661 -0.0592 -0.2039 -0.0584 25LYS BB 3051 10.440 12.555 15.377 -0.1860 -0.1131 0.3414 25LYS SC1 3052 10.358 12.375 15.622 0.2661 -0.1484 0.0732 25LYS SC2 3053 10.052 12.255 15.593 0.0665 -0.1449 -0.1437 26ASP BB 3054 10.651 12.348 15.282 -0.0602 -0.0896 0.1335 26ASP SC1 3055 10.640 12.334 14.951 -0.2317 -0.1009 -0.1804 27VAL BB 3056 10.960 12.404 15.409 0.1552 0.1541 0.0273 27VAL SC1 3057 11.072 12.648 15.294 0.1239 0.2089 0.1126 28LYS BB 3058 11.216 12.204 15.471 -0.1716 -0.2176 -0.0222 28LYS SC1 3059 11.233 12.071 15.204 -0.1972 0.2056 0.0950 28LYS SC2 3060 11.042 12.006 14.926 -0.1166 0.0853 0.2591 29ASP BB 3061 11.235 11.955 15.728 -0.2205 -0.1285 -0.0658 29ASP SC1 3062 11.096 11.988 16.058 -0.2298 0.0798 -0.1281 30LEU BB 3063 11.460 11.832 15.795 0.0087 0.0787 -0.0341 30LEU SC1 3064 11.373 11.471 15.755 0.0845 0.1529 0.1503 31GLY BB 3065 11.638 12.016 15.988 0.0114 -0.2286 -0.1421 32LYS BB 3066 11.767 12.343 16.056 0.0823 -0.0595 -0.0912 32LYS SC1 3067 11.576 12.405 16.307 -0.0293 -0.0469 0.1245 32LYS SC2 3068 11.332 12.632 16.359 0.0631 -0.1469 0.2587 33THR BB 3069 12.006 12.431 15.892 0.3002 -0.0253 -0.1569 33THR SC1 3070 12.163 12.503 16.144 -0.1442 -0.0436 0.1353 34MET BB 3071 11.995 12.701 15.739 -0.0878 -0.0334 0.3981 34MET SC1 3072 11.717 12.811 16.018 -0.0702 -0.0221 0.1822 35LYS BB 3073 12.139 12.994 15.620 0.2985 -0.2135 0.3077 35LYS SC1 3074 12.095 13.219 15.784 0.3770 0.1931 -0.1827 35LYS SC2 3075 12.153 13.489 15.980 0.5822 0.1684 0.2346 36ASP BB 3076 12.360 13.028 15.339 -0.1619 0.1995 0.1163 36ASP SC1 3077 12.053 13.198 15.219 -0.1961 -0.3465 0.2713 37GLN BB 3078 12.533 13.265 15.197 0.1074 0.0142 -0.3385 37GLN SC1 3079 12.871 13.194 15.123 0.1501 -0.0528 -0.1229 38ALA BB 3080 12.388 13.158 14.902 0.1416 0.2670 0.1932 38ALA SC1 3081 12.426 13.348 14.713 -0.2444 -0.1333 -0.3168 39LEU BB 3082 12.596 12.992 14.712 -0.2426 0.0336 -0.2636 39LEU SC1 3083 12.437 12.924 14.415 -0.2519 0.1990 0.2863 40LYS BB 3084 12.752 12.747 14.829 -0.1391 -0.0296 0.0134 40LYS SC1 3085 13.040 12.665 14.875 -0.2245 -0.0220 -0.2279 40LYS SC2 3086 13.269 12.458 15.026 -0.1723 0.2890 -0.3645 41ASP BB 3087 12.642 12.667 15.081 -0.0039 0.0482 -0.2055 41ASP SC1 3088 12.290 12.732 15.000 -0.1925 -0.0669 0.0820 42ASP BB 3089 12.694 12.456 15.306 -0.0561 -0.0154 -0.2012 42ASP SC1 3090 12.846 12.223 15.087 -0.1644 0.0303 -0.3392 43ASP BB 3091 13.000 12.516 15.411 -0.1341 -0.1592 -0.1343 43ASP SC1 3092 13.065 12.840 15.374 0.2309 0.1392 0.1165 44ALA BB 3093 13.226 12.363 15.628 0.1149 -0.1343 -0.0283 44ALA SC1 3094 13.490 12.355 15.682 0.2075 0.3210 -0.3612 45GLU BB 3095 13.158 12.042 15.660 -0.0634 -0.2695 -0.0150 45GLU SC1 3096 13.078 12.129 15.999 0.0821 0.2129 0.0668 46THR BB 3097 12.912 11.951 15.510 -0.1244 0.0596 0.0339 46THR SC1 3098 13.013 11.677 15.423 -0.0363 0.0256 0.2361 47GLY BB 3099 12.624 12.007 15.503 -0.0289 0.0015 -0.0467 48LEU BB 3100 12.540 11.864 15.179 -0.0337 -0.2453 -0.3030 48LEU SC1 3101 12.185 11.797 15.172 -0.0543 0.0902 -0.2615 49THR BB 3102 12.725 11.701 15.029 -0.0026 0.1850 0.0930 49THR SC1 3103 12.965 11.856 14.922 -0.0483 0.2121 0.0287 50ASP BB 3104 12.720 11.345 14.923 0.0488 0.2228 0.0300 50ASP SC1 3105 12.818 11.257 15.222 0.0375 0.0443 0.1317 51GLY BB 3106 12.568 11.271 14.620 0.3758 -0.1070 -0.2126 52GLU BB 3107 12.805 11.304 14.425 -0.3317 0.1544 -0.1039 52GLU SC1 3108 13.031 11.587 14.570 0.0953 -0.0184 0.1659 53GLU BB 3109 12.648 11.275 14.091 0.1788 0.3151 -0.1260 53GLU SC1 3110 12.774 10.893 14.174 0.4067 0.0225 -0.1345 54LYS BB 3111 12.566 11.525 13.913 0.1196 0.2089 -0.0055 54LYS SC1 3112 12.240 11.412 13.952 0.0757 0.0824 -0.1715 54LYS SC2 3113 12.079 11.598 14.219 -0.4160 0.4788 0.2836 55GLU BB 3114 12.702 11.798 13.808 -0.0420 -0.0307 -0.1503 55GLU SC1 3115 13.002 11.682 13.625 -0.0596 0.3224 -0.1348 56GLU BB 3116 12.593 12.118 13.716 -0.2398 0.0600 0.1142 56GLU SC1 3117 12.791 12.369 13.877 -0.4346 0.1603 0.2909 57PRO BB 3118 12.278 12.226 13.820 -0.3819 -0.0811 0.2195 57PRO SC1 3119 12.168 12.447 13.635 0.0169 0.0468 -0.1365 58LYS BB 3120 11.948 12.109 13.841 -0.2369 0.0799 0.0148 58LYS SC1 3121 11.709 12.248 13.702 0.1539 -0.1461 -0.2600 58LYS SC2 3122 11.557 12.592 13.665 0.1584 0.2446 0.3591 59GLU BB 3123 11.768 11.946 14.069 -0.0004 -0.1724 -0.0837 59GLU SC1 3124 11.619 11.729 13.822 -0.1135 -0.2519 0.1143 60GLU BB 3125 11.725 12.113 14.400 -0.2230 -0.2227 0.1285 60GLU SC1 3126 12.126 12.047 14.492 0.0713 -0.1829 0.1608 61GLU BB 3127 11.458 12.171 14.594 0.3144 -0.1217 -0.0734 61GLU SC1 3128 11.404 12.565 14.581 0.0748 -0.0741 -0.0861 1LYS BB 3129 21.476 24.074 9.668 0.1590 0.2609 -0.2055 1LYS SC1 3130 21.210 24.177 9.849 -0.0977 -0.0778 -0.2561 1LYS SC2 3131 20.987 24.028 10.114 0.2717 -0.3107 -0.0288 2LYS BB 3132 21.726 24.356 9.656 0.1157 0.1437 -0.0756 2LYS SC1 3133 21.728 24.701 9.647 -0.3104 0.3690 -0.3188 2LYS SC2 3134 21.903 24.924 9.575 0.4952 -0.1115 -0.0298 3CYS BB 3135 21.787 24.450 10.003 0.1144 -0.1768 0.0158 3CYS SC1 3136 21.469 24.423 10.083 -0.2916 0.0354 0.3102 4LEU BB 3137 22.041 24.385 10.181 0.0501 0.0187 0.0351 4LEU SC1 3138 21.920 24.640 10.454 -0.1545 -0.0201 0.2106 5PHE BB 3139 22.213 24.119 10.346 -0.1921 0.4894 0.5108 5PHE SC1 3140 21.961 24.027 10.455 0.1552 0.0237 0.0271 5PHE SC2 3141 21.624 24.069 10.442 0.1264 -0.2106 -0.0225 5PHE SC3 3142 21.752 24.171 10.681 -0.0038 -0.2764 0.0763 6LYS BB 3143 22.553 24.188 10.346 0.0593 0.1070 0.1657 6LYS SC1 3144 22.548 23.955 10.643 -0.0467 0.0648 -0.1978 6LYS SC2 3145 22.599 23.933 11.010 0.0264 -0.0597 -0.1008 7LYS BB 3146 22.719 24.000 10.147 -0.2166 -0.0410 -0.1501 7LYS SC1 3147 22.684 23.715 10.266 0.1771 0.3527 0.1618 7LYS SC2 3148 22.644 23.365 10.355 0.1833 -0.2752 -0.1506 8LYS BB 3149 22.771 24.126 9.847 0.3813 -0.2090 0.1180 8LYS SC1 3150 22.609 23.888 9.700 0.2984 -0.0016 -0.1122 8LYS SC2 3151 22.365 23.754 9.492 -0.1698 -0.0651 0.0433 9ASN BB 3152 22.980 24.327 9.648 -0.1459 0.3709 -0.2818 9ASN SC1 3153 22.934 24.647 9.759 0.1372 0.0008 -0.0161 10LYS BB 3154 23.098 24.293 9.359 0.2469 0.0464 0.1796 10LYS SC1 3155 22.977 24.531 9.277 0.5338 -0.1488 0.2606 10LYS SC2 3156 23.119 24.727 8.972 -0.2065 -0.2299 0.0356 11LYS BB 3157 23.155 24.059 9.152 -0.1736 0.2324 0.0340 11LYS SC1 3158 23.375 23.840 9.225 -0.3362 -0.2092 0.0751 11LYS SC2 3159 23.427 23.523 9.099 -0.3405 -0.3717 -0.0256 12LYS BB 3160 22.932 23.825 9.248 0.2651 0.0534 0.1707 12LYS SC1 3161 22.983 23.886 9.520 0.0969 -0.2236 0.0977 12LYS SC2 3162 23.164 23.878 9.829 0.1210 0.0439 0.2467 13GLY BB 3163 22.983 23.521 9.074 -0.2784 -0.4564 -0.2312 14LYS BB 3164 22.810 23.396 8.848 -0.1306 -0.0095 -0.2725 14LYS SC1 3165 22.970 23.170 8.737 -0.3369 -0.1736 -0.1932 14LYS SC2 3166 23.029 23.034 8.424 0.0534 0.2546 -0.3466 15GLU BB 3167 22.556 23.396 9.093 0.4822 0.1380 0.1356 15GLU SC1 3168 22.700 23.356 9.459 -0.2569 -0.0203 0.1688 16LYS BB 3169 22.297 23.135 9.082 0.2698 -0.0097 -0.1975 16LYS SC1 3170 22.241 22.824 9.096 -0.3653 -0.3961 -0.1453 16LYS SC2 3171 22.405 22.522 9.158 0.0072 -0.2424 0.0691 17GLY BB 3172 21.972 23.301 9.018 -0.1606 -0.0378 0.1079 18GLY BB 3173 22.150 23.504 8.854 0.1653 0.0750 0.2556 19LYS BB 3174 21.994 23.829 8.927 0.1921 0.2440 -0.0475 19LYS SC1 3175 22.153 24.014 8.759 -0.0080 -0.2539 -0.1062 19LYS SC2 3176 22.115 24.278 8.495 -0.1702 -0.1192 -0.1474 20ASN BB 3177 21.728 23.698 9.021 0.1189 -0.3097 -0.1086 20ASN SC1 3178 21.686 23.671 9.338 0.1418 -0.3112 -0.2267 21ALA BB 3179 21.481 23.784 8.861 0.1388 0.0741 0.2025 21ALA SC1 3180 21.309 23.601 8.961 -0.3574 0.2816 -0.2212 22ILE BB 3181 21.484 23.885 8.573 0.2254 0.1281 -0.0249 22ILE SC1 3182 21.341 24.188 8.635 -0.1394 0.0407 -0.3876 23ASN BB 3183 21.439 23.807 8.283 -0.2085 0.0029 0.0760 23ASN SC1 3184 21.113 23.850 8.238 0.2965 -0.3684 0.2946 24MET BB 3185 21.492 23.911 7.993 -0.0967 -0.0862 0.0952 24MET SC1 3186 21.282 24.259 7.972 -0.1241 -0.3376 -0.3705 25LYS BB 3187 21.833 23.982 7.896 0.2648 -0.0894 -0.0936 25LYS SC1 3188 21.932 23.748 7.748 0.1423 -0.0911 -0.1617 25LYS SC2 3189 22.030 23.421 7.606 0.3444 -0.2065 0.1280 26ASP BB 3190 22.096 24.126 8.011 0.1977 0.2418 -0.0550 26ASP SC1 3191 22.306 23.996 8.244 0.0662 -0.0248 0.0855 27VAL BB 3192 22.212 24.327 7.789 -0.1656 0.1464 -0.0554 27VAL SC1 3193 22.035 24.231 7.577 -0.0793 -0.0629 -0.0352 28LYS BB 3194 22.541 24.297 7.682 0.1784 0.0646 -0.0622 28LYS SC1 3195 22.540 24.012 7.821 0.0967 -0.1379 0.0866 28LYS SC2 3196 22.684 23.715 7.905 -0.0260 -0.2576 -0.0716 29ASP BB 3197 22.717 24.476 7.521 0.0652 0.0254 0.0887 29ASP SC1 3198 22.951 24.300 7.389 0.2808 -0.3389 0.3113 30LEU BB 3199 22.690 24.667 7.276 -0.1996 -0.0997 -0.1392 30LEU SC1 3200 22.933 24.924 7.344 -0.2729 0.1785 0.0050 31GLY BB 3201 22.716 24.457 7.031 -0.2290 -0.1081 -0.2083 32LYS BB 3202 22.759 24.185 6.981 0.0190 0.1467 0.2504 32LYS SC1 3203 22.596 24.081 7.247 0.1060 -0.1210 0.0492 32LYS SC2 3204 22.335 24.307 7.272 -0.0671 0.0509 -0.1439 33THR BB 3205 23.044 24.012 6.891 -0.0345 -0.1208 -0.1887 33THR SC1 3206 23.104 23.816 7.117 0.1843 0.0203 -0.1215 34MET BB 3207 23.089 23.821 6.684 0.1452 -0.1039 0.2439 34MET SC1 3208 22.780 23.555 6.597 0.0554 0.1665 0.1674 35LYS BB 3209 23.016 24.045 6.377 0.2526 0.0336 -0.0197 35LYS SC1 3210 22.828 23.812 6.213 0.0758 0.0202 -0.2075 35LYS SC2 3211 22.548 23.883 6.053 0.0379 -0.1157 0.1726 36ASP BB 3212 22.834 24.294 6.280 -0.1160 -0.0457 0.1624 36ASP SC1 3213 22.853 24.492 6.555 -0.3606 0.0364 -0.1241 37GLN BB 3214 22.793 24.408 6.003 0.0004 0.1293 -0.1303 37GLN SC1 3215 22.987 24.575 5.725 -0.0137 0.0152 0.0800 38ALA BB 3216 22.991 24.141 5.882 0.3194 -0.0630 -0.1449 38ALA SC1 3217 22.853 24.209 5.661 -0.1354 -0.3440 0.0387 39LEU BB 3218 23.313 24.110 5.996 -0.3064 -0.2881 -0.0159 39LEU SC1 3219 23.373 24.446 5.934 -0.2431 0.2006 0.2693 40LYS BB 3220 23.343 23.773 5.999 -0.1050 -0.2690 0.1420 40LYS SC1 3221 23.503 23.785 6.288 0.1032 -0.1160 0.0975 40LYS SC2 3222 23.824 23.791 6.439 0.0277 -0.1360 -0.1851 41ASP BB 3223 23.379 23.704 5.658 -0.3328 -0.1117 0.0063 41ASP SC1 3224 23.571 23.886 5.442 0.1694 0.3071 0.2803 42ASP BB 3225 23.387 23.370 5.613 -0.3524 0.0529 0.1250 42ASP SC1 3226 23.527 23.363 5.934 0.0927 0.2902 0.1476 43ASP BB 3227 23.542 23.164 5.378 -0.2166 -0.3161 -0.0182 43ASP SC1 3228 23.247 23.115 5.258 0.1852 0.2403 -0.2004 44ALA BB 3229 23.870 23.223 5.224 -0.2795 -0.3735 0.0700 44ALA SC1 3230 24.017 23.105 5.418 -0.0739 -0.1246 0.0712 45GLU BB 3231 23.780 23.207 4.925 -0.5159 -0.1951 0.1056 45GLU SC1 3232 23.933 22.862 4.892 -0.2913 0.3212 -0.2274 46THR BB 3233 23.463 23.210 4.861 -0.0429 0.1881 -0.0918 46THR SC1 3234 23.414 23.006 4.640 0.0653 -0.1131 0.1550 47GLY BB 3235 23.255 23.459 4.907 0.0903 -0.1273 0.0364 48LEU BB 3236 22.924 23.455 5.026 -0.0174 -0.0879 -0.1053 48LEU SC1 3237 22.792 23.762 4.983 -0.0710 0.2178 -0.0760 49THR BB 3238 22.985 23.502 5.329 0.0347 0.1648 -0.1872 49THR SC1 3239 23.050 23.786 5.420 -0.0282 0.1036 0.0569 50ASP BB 3240 22.877 23.267 5.545 -0.1201 -0.1018 -0.2199 50ASP SC1 3241 22.557 23.334 5.685 -0.0873 0.2733 0.4262 51GLY BB 3242 23.085 23.015 5.630 0.0971 0.0730 -0.3298 52GLU BB 3243 23.324 22.955 5.882 0.0301 0.0360 0.1155 52GLU SC1 3244 23.225 22.628 5.895 -0.1127 0.1796 -0.1484 53GLU BB 3245 23.359 23.028 6.228 0.0850 -0.0693 -0.1344 53GLU SC1 3246 23.679 23.193 6.380 0.1786 0.1334 -0.1504 54LYS BB 3247 23.045 22.972 6.334 -0.1856 0.2868 -0.0088 54LYS SC1 3248 23.181 22.669 6.458 -0.0685 -0.1787 -0.3900 54LYS SC2 3249 23.378 22.382 6.530 0.2058 0.0320 0.0100 55GLU BB 3250 22.903 22.933 6.628 0.1699 0.0748 0.0534 55GLU SC1 3251 22.539 23.004 6.488 0.0547 -0.0841 -0.0906 56GLU BB 3252 23.054 22.931 6.959 -0.1896 -0.0346 -0.3108 56GLU SC1 3253 23.411 23.056 7.096 0.3026 0.0498 0.0935 57PRO BB 3254 22.860 22.836 7.207 0.2490 0.0991 0.0969 57PRO SC1 3255 23.013 22.618 7.310 -0.0266 0.1155 -0.1336 58LYS BB 3256 22.799 22.974 7.532 -0.0327 -0.2694 -0.0775 58LYS SC1 3257 23.143 22.945 7.566 0.2386 -0.2808 0.3557 58LYS SC2 3258 23.467 23.107 7.612 -0.2294 -0.1427 -0.1606 59GLU BB 3259 22.843 23.268 7.748 0.0660 0.0670 -0.1495 59GLU SC1 3260 22.560 23.434 7.589 0.0204 -0.2388 -0.1112 60GLU BB 3261 23.153 23.302 7.964 0.1243 -0.0138 -0.2234 60GLU SC1 3262 23.148 23.719 7.988 0.1921 0.0875 0.1075 61GLU BB 3263 23.364 23.164 8.129 -0.2329 0.0969 0.0667 61GLU SC1 3264 23.332 22.836 7.962 -0.1424 0.0424 -0.2427 1LYS BB 3265 8.406 14.298 10.237 0.2822 -0.1013 -0.1972 1LYS SC1 3266 8.204 14.317 9.986 0.1382 -0.0025 0.0263 1LYS SC2 3267 8.052 14.554 9.770 -0.3066 0.1688 0.4921 2LYS BB 3268 8.394 14.069 10.460 0.0569 -0.1024 -0.0757 2LYS SC1 3269 8.161 13.873 10.381 0.1360 -0.3886 -0.1158 2LYS SC2 3270 7.881 13.677 10.354 0.0710 0.0122 0.1866 3CYS BB 3271 8.617 13.910 10.680 0.1700 -0.0821 0.1460 3CYS SC1 3272 8.417 13.750 10.888 0.3051 -0.2226 0.1286 4LEU BB 3273 8.865 13.783 10.520 0.0818 0.0839 -0.0892 4LEU SC1 3274 8.787 13.507 10.329 -0.1103 0.2075 -0.3739 5PHE BB 3275 8.962 13.933 10.237 0.0387 0.0511 0.2429 5PHE SC1 3276 8.717 13.977 10.121 0.2323 -0.0487 -0.4922 5PHE SC2 3277 8.569 13.904 9.824 -0.1842 -0.0511 -0.2908 5PHE SC3 3278 8.389 13.924 10.050 0.1292 -0.0644 -0.0332 6LYS BB 3279 9.166 14.157 10.252 0.1075 0.1772 -0.1026 6LYS SC1 3280 9.302 14.035 9.985 -0.0667 -0.1375 -0.0895 6LYS SC2 3281 9.410 13.959 9.644 -0.0378 -0.0375 0.1424 7LYS BB 3282 9.405 14.108 10.453 -0.0721 -0.0958 -0.1634 7LYS SC1 3283 9.445 13.813 10.535 -0.1338 0.3370 -0.2108 7LYS SC2 3284 9.663 13.583 10.514 0.5176 -0.1576 0.1229 8LYS BB 3285 9.613 14.390 10.493 0.3063 0.0209 -0.0569 8LYS SC1 3286 9.553 14.473 10.744 -0.3879 0.1599 0.0504 8LYS SC2 3287 9.385 14.452 11.054 -0.0369 0.3912 0.0363 9ASN BB 3288 9.746 14.646 10.294 0.3332 0.1589 -0.0653 9ASN SC1 3289 9.485 14.844 10.238 -0.3777 -0.2608 0.0807 10LYS BB 3290 10.070 14.596 10.161 0.2911 -0.2934 0.0438 10LYS SC1 3291 10.252 14.333 10.201 0.0337 0.2368 -0.0091 10LYS SC2 3292 10.406 14.068 10.310 0.3246 0.1144 0.3951 11LYS BB 3293 10.360 14.785 10.072 -0.3203 -0.1337 0.2969 11LYS SC1 3294 10.408 14.880 9.754 -0.0809 0.1814 0.1172 11LYS SC2 3295 10.251 14.868 9.412 -0.1311 0.0814 -0.2025 12LYS BB 3296 10.377 15.034 10.295 -0.1432 -0.1077 0.1919 12LYS SC1 3297 10.687 14.947 10.299 0.1919 -0.0170 -0.3594 12LYS SC2 3298 11.042 14.950 10.188 0.0665 0.1725 -0.3251 13GLY BB 3299 10.343 15.309 10.081 0.3264 -0.2497 0.2120 14LYS BB 3300 10.497 15.570 10.177 0.0224 -0.3482 -0.0689 14LYS SC1 3301 10.760 15.670 10.068 -0.1512 -0.0973 0.3103 14LYS SC2 3302 10.957 15.958 9.956 0.1863 0.0676 -0.1155 15GLU BB 3303 10.280 15.816 10.108 0.0556 -0.1832 0.2437 15GLU SC1 3304 10.545 16.107 10.096 -0.3103 0.2531 0.0577 16LYS BB 3305 10.124 15.968 10.410 -0.0052 -0.1558 0.0377 16LYS SC1 3306 10.062 15.813 10.635 -0.1238 -0.0052 -0.0032 16LYS SC2 3307 10.052 15.650 10.950 -0.3682 0.2067 0.1456 17GLY BB 3308 10.092 16.308 10.520 -0.1412 0.0849 -0.2379 18GLY BB 3309 10.234 16.424 10.796 0.1858 0.3623 0.0883 19LYS BB 3310 10.510 16.424 11.025 0.1839 -0.1030 0.3159 19LYS SC1 3311 10.649 16.313 10.786 0.2282 0.3029 0.2447 19LYS SC2 3312 10.583 16.071 10.582 0.0947 -0.0486 -0.0509 20ASN BB 3313 10.651 16.656 11.109 0.0734 -0.3148 -0.4469 20ASN SC1 3314 10.711 16.713 11.451 -0.1070 -0.1701 0.1660 21ALA BB 3315 10.951 16.592 10.969 0.0082 -0.2523 -0.1532 21ALA SC1 3316 10.981 16.570 10.702 -0.0873 0.1432 -0.2028 22ILE BB 3317 11.121 16.306 11.017 -0.1862 -0.1589 -0.2403 22ILE SC1 3318 11.123 16.180 10.700 -0.0995 -0.2695 -0.1962 23ASN BB 3319 11.262 16.101 11.266 -0.1409 -0.1945 0.1131 23ASN SC1 3320 11.363 15.792 11.100 -0.1300 -0.0445 -0.2899 24MET BB 3321 11.077 16.091 11.538 -0.0555 -0.2282 0.0949 24MET SC1 3322 11.009 15.713 11.424 -0.0192 -0.1204 0.1018 25LYS BB 3323 11.218 16.183 11.838 -0.2346 -0.2384 0.0955 25LYS SC1 3324 11.135 15.935 11.990 0.0252 -0.1645 -0.2919 25LYS SC2 3325 11.249 15.908 12.295 0.0724 0.3621 -0.1793 26ASP BB 3326 11.512 16.137 11.940 -0.2751 -0.1076 0.2419 26ASP SC1 3327 11.765 16.164 11.761 -0.1943 0.0547 0.0276 27VAL BB 3328 11.703 15.923 12.162 0.1481 0.1568 -0.2574 27VAL SC1 3329 11.530 15.710 12.062 -0.0993 0.2461 -0.0325 28LYS BB 3330 11.817 16.158 12.368 0.2590 -0.2330 -0.0202 28LYS SC1 3331 12.163 16.106 12.422 -0.0543 0.1185 -0.0850 28LYS SC2 3332 12.459 15.936 12.511 0.0434 -0.3029 0.0244 29ASP BB 3333 11.573 16.176 12.604 0.2691 0.0658 0.1165 29ASP SC1 3334 11.658 15.962 12.857 0.1045 0.1053 -0.1281 30LEU BB 3335 11.243 16.211 12.696 0.1920 -0.1258 -0.5885 30LEU SC1 3336 11.022 16.236 13.002 -0.1380 0.3420 0.0671 31GLY BB 3337 11.008 15.924 12.672 -0.0513 -0.0615 0.0609 32LYS BB 3338 10.735 15.957 12.514 0.4767 -0.1432 0.2199 32LYS SC1 3339 10.771 15.894 12.175 -0.0954 0.1272 0.0492 32LYS SC2 3340 10.786 15.766 11.852 0.1806 0.1730 0.2195 33THR BB 3341 10.400 15.993 12.561 0.1241 -0.1693 -0.2316 33THR SC1 3342 10.449 16.218 12.762 -0.1330 -0.2396 -0.0848 34MET BB 3343 10.137 15.936 12.427 0.0097 0.1711 0.2362 34MET SC1 3344 10.042 15.560 12.510 -0.0500 -0.3905 0.2245 35LYS BB 3345 9.961 15.951 12.171 -0.0374 0.3720 -0.0419 35LYS SC1 3346 9.750 15.776 12.162 0.0183 -0.0562 -0.1667 35LYS SC2 3347 9.512 15.611 12.383 0.1520 0.0072 0.0474 36ASP BB 3348 9.884 16.291 12.120 0.0030 -0.2744 0.2012 36ASP SC1 3349 10.141 16.484 12.013 -0.1366 -0.3724 0.3063 37GLN BB 3350 9.602 16.444 12.046 0.0783 0.2403 -0.2093 37GLN SC1 3351 9.338 16.350 11.756 0.1279 0.2230 -0.0285 38ALA BB 3352 9.671 16.741 11.940 0.0730 -0.0666 -0.0229 38ALA SC1 3353 9.544 16.763 11.702 -0.3473 0.2666 0.2173 39LEU BB 3354 9.945 16.896 11.880 -0.1381 0.0989 0.2652 39LEU SC1 3355 9.919 16.878 11.542 0.0814 -0.3601 -0.1623 40LYS BB 3356 10.226 16.969 12.046 -0.1107 0.0319 -0.3157 40LYS SC1 3357 10.201 17.280 12.070 -0.0862 0.2535 -0.0083 40LYS SC2 3358 10.330 17.647 12.009 0.2348 0.0772 -0.0026 41ASP BB 3359 10.395 16.827 12.251 -0.1805 0.0679 0.0962 41ASP SC1 3360 10.471 17.101 12.420 -0.1338 -0.3982 -0.2150 42ASP BB 3361 10.640 16.621 12.178 0.2849 0.0569 -0.0298 42ASP SC1 3362 10.706 16.453 12.499 -0.0055 -0.0925 0.6064 43ASP BB 3363 10.876 16.794 12.153 -0.2133 -0.1926 -0.1691 43ASP SC1 3364 11.114 16.654 11.958 0.0223 -0.2630 0.2377 44ALA BB 3365 10.875 17.131 12.209 -0.2026 -0.0519 -0.2701 44ALA SC1 3366 10.995 17.267 12.008 0.0756 0.1624 0.0312 45GLU BB 3367 10.840 17.315 12.526 0.1000 -0.0452 0.1529 45GLU SC1 3368 11.265 17.211 12.515 -0.0637 0.2015 -0.0411 46THR BB 3369 10.768 17.215 12.811 0.0182 -0.0363 -0.0754 46THR SC1 3370 10.999 17.018 12.833 -0.0334 -0.0596 0.3440 47GLY BB 3371 10.587 16.999 12.910 0.5040 -0.1480 0.2047 48LEU BB 3372 10.251 17.130 12.912 -0.0686 -0.2594 0.2489 48LEU SC1 3373 10.377 17.479 12.895 -0.1152 -0.2893 -0.3349 49THR BB 3374 10.016 16.972 12.847 -0.0171 -0.1447 -0.0590 49THR SC1 3375 10.012 16.944 12.544 -0.2423 0.1093 -0.0834 50ASP BB 3376 9.861 16.713 12.910 0.2082 0.1743 -0.0338 50ASP SC1 3377 9.536 16.882 12.943 0.1523 0.2111 -0.3115 51GLY BB 3378 9.746 16.593 13.233 0.0609 -0.4761 -0.0922 52GLU BB 3379 9.878 16.419 13.465 0.1525 -0.1064 0.0975 52GLU SC1 3380 10.022 16.750 13.586 0.1019 -0.1617 -0.1511 53GLU BB 3381 9.695 16.154 13.453 0.3789 -0.3445 0.2546 53GLU SC1 3382 9.732 15.931 13.133 0.3167 0.4022 -0.1400 54LYS BB 3383 9.822 15.989 13.695 -0.2971 0.1658 0.0556 54LYS SC1 3384 9.562 15.839 13.811 0.3123 0.0929 -0.1881 54LYS SC2 3385 9.401 15.537 13.869 -0.0848 0.1746 -0.4510 55GLU BB 3386 10.077 15.772 13.702 0.0667 -0.2084 0.0288 55GLU SC1 3387 9.996 15.587 13.395 -0.1616 -0.0693 -0.2652 56GLU BB 3388 10.138 15.637 14.032 -0.2338 0.1660 -0.3441 56GLU SC1 3389 9.823 15.490 14.115 0.1115 0.0252 0.1668 57PRO BB 3390 10.251 15.808 14.263 0.0459 0.0450 -0.1126 57PRO SC1 3391 10.260 16.083 14.095 -0.2664 0.1607 0.2836 58LYS BB 3392 10.144 15.792 14.578 0.1897 0.2460 -0.1253 58LYS SC1 3393 10.000 15.530 14.533 0.3677 -0.0122 -0.0715 58LYS SC2 3394 10.216 15.316 14.440 -0.0061 0.2960 0.2894 59GLU BB 3395 10.396 15.706 14.715 -0.0822 -0.2257 0.1771 59GLU SC1 3396 10.675 15.800 14.452 0.0427 0.2317 0.0718 60GLU BB 3397 10.371 15.494 15.006 0.3061 -0.2342 -0.1999 60GLU SC1 3398 10.267 15.109 14.849 0.4168 -0.1831 -0.1784 61GLU BB 3399 10.483 15.663 15.248 -0.2773 0.1171 -0.1808 61GLU SC1 3400 10.432 15.532 15.604 0.3199 0.0051 -0.2875 1LYS BB 3401 14.254 15.880 15.167 -0.1085 0.1544 -0.3447 1LYS SC1 3402 14.198 15.618 15.262 -0.4804 -0.1512 -0.0150 1LYS SC2 3403 14.329 15.279 15.358 0.0019 -0.1555 -0.2646 2LYS BB 3404 14.030 16.079 15.249 0.1670 0.0936 -0.1157 2LYS SC1 3405 14.004 16.146 15.552 -0.3705 0.0974 0.0206 2LYS SC2 3406 13.782 16.239 15.827 -0.0147 0.1270 0.1345 3CYS BB 3407 13.868 16.315 15.121 0.0253 0.1411 -0.2697 3CYS SC1 3408 13.578 16.303 15.216 0.2204 0.1330 -0.0232 4LEU BB 3409 13.939 16.588 15.003 -0.2932 -0.0533 -0.0047 4LEU SC1 3410 13.775 16.877 14.980 0.3156 0.0820 -0.0419 5PHE BB 3411 14.089 16.661 14.712 0.0267 -0.0500 0.0071 5PHE SC1 3412 13.962 16.620 14.455 0.2167 0.1101 -0.1133 5PHE SC2 3413 13.753 16.436 14.260 0.3929 -0.0272 -0.1750 5PHE SC3 3414 14.036 16.385 14.221 0.4289 -0.3354 0.3804 6LYS BB 3415 14.409 16.595 14.623 0.3233 -0.0162 -0.3814 6LYS SC1 3416 14.374 16.538 14.317 0.0081 -0.1836 -0.1740 6LYS SC2 3417 14.528 16.715 14.047 -0.4219 -0.3993 -0.1699 7LYS BB 3418 14.608 16.321 14.693 0.1303 -0.2848 -0.0119 7LYS SC1 3419 14.704 16.083 14.507 -0.2314 0.1056 -0.0645 7LYS SC2 3420 14.633 15.826 14.321 -0.0883 -0.0984 0.2456 8LYS BB 3421 14.732 16.303 14.946 -0.1274 0.0278 -0.2025 8LYS SC1 3422 14.722 16.614 14.965 0.1159 -0.2941 -0.0714 8LYS SC2 3423 14.397 16.658 15.084 -0.1228 0.1115 0.4986 9ASN BB 3424 14.715 16.076 15.135 0.3540 0.2484 0.0345 9ASN SC1 3425 14.507 16.188 15.362 0.0357 -0.1910 -0.0269 10LYS BB 3426 14.955 16.038 15.339 0.1465 -0.0120 -0.1977 10LYS SC1 3427 15.150 16.248 15.078 0.0608 0.0723 0.0963 10LYS SC2 3428 15.414 16.398 14.855 0.0988 0.0856 0.0364 11LYS BB 3429 14.963 16.029 15.670 0.1350 -0.2511 -0.0636 11LYS SC1 3430 14.892 16.329 15.757 0.2194 -0.2985 -0.2525 11LYS SC2 3431 15.061 16.618 15.775 0.1598 0.3079 0.2669 12LYS BB 3432 15.081 15.902 15.956 -0.0422 0.0852 0.1487 12LYS SC1 3433 14.916 16.127 16.129 0.3091 -0.2202 -0.2806 12LYS SC2 3434 14.825 16.368 16.368 -0.0193 -0.2348 0.0629 13GLY BB 3435 15.096 15.608 16.018 -0.1561 -0.0229 0.1612 14LYS BB 3436 15.396 15.412 16.040 -0.1721 0.0478 -0.0191 14LYS SC1 3437 15.463 15.418 15.738 0.0615 0.0741 -0.0402 14LYS SC2 3438 15.420 15.286 15.398 -0.1556 -0.2912 -0.1114 15GLU BB 3439 15.566 15.493 16.316 0.1021 -0.1798 0.1355 15GLU SC1 3440 15.250 15.753 16.433 -0.1441 0.1256 0.1682 16LYS BB 3441 15.697 15.219 16.458 -0.0287 0.3021 0.3097 16LYS SC1 3442 16.025 15.310 16.424 -0.1647 0.1136 -0.0273 16LYS SC2 3443 16.236 15.618 16.399 -0.0611 0.0332 0.3099 17GLY BB 3444 15.526 14.976 16.686 0.0693 -0.0896 -0.0259 18GLY BB 3445 15.285 14.684 16.687 0.0910 -0.0743 0.0986 19LYS BB 3446 14.967 14.630 16.663 0.1813 -0.0924 -0.0067 19LYS SC1 3447 14.865 14.815 16.440 -0.1754 0.0092 -0.0729 19LYS SC2 3448 14.580 14.850 16.240 0.1279 0.1471 -0.2225 20ASN BB 3449 14.761 14.553 16.873 -0.2999 0.0441 -0.1141 20ASN SC1 3450 14.759 14.797 17.099 0.3387 0.2982 0.2029 21ALA BB 3451 14.441 14.547 16.685 -0.0660 -0.0586 0.0641 21ALA SC1 3452 14.541 14.798 16.682 0.1027 -0.1253 -0.0763 22ILE BB 3453 14.127 14.498 16.732 -0.0598 0.1498 0.1285 22ILE SC1 3454 13.917 14.297 16.554 -0.1433 0.1854 0.1856 23ASN BB 3455 13.907 14.687 16.868 -0.0939 -0.2102 0.1790 23ASN SC1 3456 13.903 14.466 17.109 -0.2514 -0.4253 -0.1376 24MET BB 3457 13.797 14.947 16.669 -0.1461 0.0550 0.0124 24MET SC1 3458 13.956 15.264 16.839 0.1303 -0.0525 0.2435 25LYS BB 3459 13.720 14.759 16.362 0.0960 0.1883 0.4621 25LYS SC1 3460 13.553 14.563 16.583 -0.0014 -0.1055 0.1191 25LYS SC2 3461 13.281 14.480 16.731 0.1566 0.0303 0.2102 26ASP BB 3462 13.728 14.841 16.077 -0.1238 -0.1960 -0.3237 26ASP SC1 3463 13.483 15.097 16.089 -0.1242 0.1306 -0.1282 27VAL BB 3464 13.538 14.766 15.820 -0.0163 0.1351 -0.0036 27VAL SC1 3465 13.549 14.485 15.742 -0.0895 0.0962 0.1234 28LYS BB 3466 13.582 14.985 15.589 -0.1249 -0.0359 0.0021 28LYS SC1 3467 13.274 15.031 15.564 0.2826 0.0012 0.1479 28LYS SC2 3468 13.020 15.169 15.398 -0.0370 -0.5378 -0.3009 29ASP BB 3469 13.742 14.841 15.355 -0.0479 -0.0538 0.0969 29ASP SC1 3470 14.035 14.962 15.558 0.0546 0.0038 -0.3831 30LEU BB 3471 13.689 14.474 15.309 -0.0021 0.0672 -0.2908 30LEU SC1 3472 13.987 14.540 15.104 0.1541 -0.1159 0.0382 31GLY BB 3473 13.605 14.475 15.008 0.0873 -0.1717 -0.1912 32LYS BB 3474 13.610 14.749 14.840 -0.0951 -0.0230 0.1458 32LYS SC1 3475 13.908 14.862 14.768 0.0265 -0.1985 0.1012 32LYS SC2 3476 14.133 15.027 14.537 -0.2288 0.1809 0.3308 33THR BB 3477 13.283 14.922 14.741 0.2352 0.0267 -0.0556 33THR SC1 3478 13.167 14.644 14.697 -0.6486 0.3015 0.3194 34MET BB 3479 13.353 15.055 14.422 0.2879 0.3079 0.0622 34MET SC1 3480 13.705 14.954 14.412 0.2034 -0.0381 -0.1234 35LYS BB 3481 13.208 14.821 14.268 0.1835 0.1600 0.4217 35LYS SC1 3482 13.450 14.603 14.150 -0.2247 -0.3530 0.3448 35LYS SC2 3483 13.534 14.488 14.455 -0.0955 -0.0261 0.2842 36ASP BB 3484 12.899 14.859 14.111 0.2500 0.0988 0.1087 36ASP SC1 3485 13.049 15.089 13.923 0.5117 0.0439 0.2715 37GLN BB 3486 12.744 14.569 14.019 -0.0769 -0.1516 0.1746 37GLN SC1 3487 12.499 14.692 13.750 -0.0123 -0.0339 0.0084 38ALA BB 3488 12.645 14.324 14.190 0.6344 0.0080 -0.0250 38ALA SC1 3489 12.822 14.188 14.342 0.1340 -0.4236 0.2010 39LEU BB 3490 12.793 14.084 13.935 0.3352 0.2336 -0.0285 39LEU SC1 3491 12.483 13.933 13.914 -0.0278 0.1276 0.0253 40LYS BB 3492 13.005 13.911 13.998 0.0908 0.1684 0.0992 40LYS SC1 3493 12.843 13.660 14.002 -0.0947 0.2035 -0.1019 40LYS SC2 3494 12.808 13.295 13.898 -0.3339 0.0661 -0.0732 41ASP BB 3495 13.322 13.890 14.042 -0.1061 -0.1877 0.2750 41ASP SC1 3496 13.325 13.863 14.381 -0.0073 0.3105 0.0793 42ASP BB 3497 13.575 14.130 14.065 -0.0252 0.0517 -0.1300 42ASP SC1 3498 13.586 14.297 13.751 0.1076 0.1949 -0.0163 43ASP BB 3499 13.884 13.958 14.069 -0.1298 -0.1561 0.0855 43ASP SC1 3500 13.982 13.992 13.743 0.2557 0.2132 0.1762 44ALA BB 3501 14.123 14.163 14.165 0.0831 -0.0289 -0.2001 44ALA SC1 3502 14.124 14.044 14.406 -0.1067 0.0849 -0.1411 45GLU BB 3503 14.297 14.368 14.032 -0.1598 -0.0538 -0.0036 45GLU SC1 3504 14.379 14.731 14.201 0.0645 0.1474 -0.1873 46THR BB 3505 14.622 14.303 13.922 0.0593 -0.2244 0.1564 46THR SC1 3506 14.627 14.583 13.799 0.1706 -0.2380 0.1291 47GLY BB 3507 14.712 14.066 13.668 -0.2924 0.1521 0.0338 48LEU BB 3508 14.606 13.803 13.641 0.0011 0.0139 0.1129 48LEU SC1 3509 14.836 13.738 13.928 0.2474 0.3105 -0.3220 49THR BB 3510 14.309 13.722 13.562 0.0254 -0.0677 0.2441 49THR SC1 3511 14.284 13.418 13.562 -0.3529 -0.0492 -0.2521 50ASP BB 3512 14.193 13.915 13.287 -0.1114 -0.2450 -0.2252 50ASP SC1 3513 14.553 13.967 13.203 0.1553 0.2581 -0.0977 51GLY BB 3514 14.092 13.769 13.018 -0.1043 0.1097 -0.3264 52GLU BB 3515 13.996 13.959 12.806 0.1227 0.0347 0.0636 52GLU SC1 3516 13.839 13.724 12.563 -0.1419 -0.2043 0.1638 53GLU BB 3517 13.920 14.228 12.911 -0.0130 -0.0038 -0.0668 53GLU SC1 3518 13.632 14.486 13.009 -0.1434 -0.2373 0.3531 54LYS BB 3519 14.140 14.422 13.081 0.3027 0.0428 -0.0228 54LYS SC1 3520 14.283 14.616 12.858 0.1025 0.0979 0.0486 54LYS SC2 3521 14.449 14.907 12.808 0.1649 -0.2944 -0.2771 55GLU BB 3522 14.037 14.649 13.279 0.1700 -0.2607 0.4889 55GLU SC1 3523 13.699 14.689 13.503 -0.1358 -0.0060 -0.1118 56GLU BB 3524 14.216 14.929 13.213 0.1708 0.0037 -0.1298 56GLU SC1 3525 14.199 15.293 13.056 -0.1345 -0.1884 -0.2416 57PRO BB 3526 14.524 14.988 13.292 -0.0015 -0.0096 -0.0183 57PRO SC1 3527 14.539 14.718 13.459 0.1262 0.0543 -0.0905 58LYS BB 3528 14.796 15.197 13.446 0.0217 0.0645 0.0878 58LYS SC1 3529 14.946 14.897 13.561 -0.2808 0.1716 -0.1778 58LYS SC2 3530 15.053 14.762 13.906 -0.1681 -0.1067 0.6131 59GLU BB 3531 14.889 15.552 13.568 -0.1113 0.0403 0.1867 59GLU SC1 3532 14.946 15.669 13.195 0.0598 0.1460 0.0240 60GLU BB 3533 14.840 15.477 13.908 -0.0804 -0.0914 0.3543 60GLU SC1 3534 14.476 15.666 13.886 -0.1554 0.2038 0.2298 61GLU BB 3535 15.043 15.595 14.112 0.0351 -0.1045 0.0411 61GLU SC1 3536 15.150 15.945 14.286 0.0405 -0.0807 -0.3579 1LYS BB 3537 15.410 14.635 18.046 0.1065 -0.0670 0.2055 1LYS SC1 3538 15.204 14.725 17.784 -0.0339 0.0990 -0.1270 1LYS SC2 3539 14.857 14.693 17.715 0.2429 0.0172 0.1385 2LYS BB 3540 15.415 14.306 18.004 0.1794 0.1333 -0.0827 2LYS SC1 3541 15.724 14.281 18.055 -0.3924 0.1221 -0.2555 2LYS SC2 3542 15.936 14.234 18.328 0.0110 0.1389 -0.0630 3CYS BB 3543 15.167 14.118 18.209 -0.1193 0.1806 0.2485 3CYS SC1 3544 15.150 14.406 18.390 0.1353 0.4525 -0.0716 4LEU BB 3545 15.139 13.755 18.127 -0.0804 -0.4686 0.0826 4LEU SC1 3546 14.890 13.484 18.029 -0.3195 -0.1552 0.2421 5PHE BB 3547 15.296 13.665 17.862 0.2482 0.2073 -0.1027 5PHE SC1 3548 15.345 13.946 17.693 -0.2342 0.1943 -0.4593 5PHE SC2 3549 15.604 13.992 17.478 -0.0161 0.1113 -0.2192 5PHE SC3 3550 15.656 14.071 17.752 -0.0710 -0.3610 -0.0640 6LYS BB 3551 15.513 13.484 17.751 -0.0342 -0.2695 -0.0958 6LYS SC1 3552 15.778 13.622 17.619 -0.0547 0.0128 -0.0406 6LYS SC2 3553 16.002 13.393 17.471 0.2477 0.1214 0.2527 7LYS BB 3554 15.531 13.209 17.638 0.0276 0.2762 -0.0676 7LYS SC1 3555 15.734 13.113 17.880 0.2676 -0.0530 0.2709 7LYS SC2 3556 15.772 13.099 18.246 0.2152 -0.1604 0.3735 8LYS BB 3557 15.625 13.131 17.324 0.1635 -0.0810 0.1074 8LYS SC1 3558 15.880 12.948 17.469 -0.0781 -0.1614 -0.0481 8LYS SC2 3559 16.013 12.635 17.536 -0.0960 0.1881 0.3137 9ASN BB 3560 15.375 13.047 17.106 -0.0332 -0.2715 0.1315 9ASN SC1 3561 15.496 13.325 16.922 -0.3690 -0.4360 -0.2909 10LYS BB 3562 15.220 12.773 17.098 0.1231 -0.1228 -0.3180 10LYS SC1 3563 15.379 12.612 16.877 -0.0278 -0.1251 -0.1147 10LYS SC2 3564 15.646 12.507 16.628 -0.3057 0.0964 -0.0522 11LYS BB 3565 15.109 12.575 17.233 -0.1649 -0.1262 0.0865 11LYS SC1 3566 14.895 12.481 16.954 -0.2005 -0.1259 -0.1684 11LYS SC2 3567 14.796 12.497 16.640 -0.0643 -0.0076 -0.2486 12LYS BB 3568 15.186 12.470 17.493 -0.2687 -0.0020 -0.0108 12LYS SC1 3569 15.375 12.246 17.451 0.1455 -0.4234 0.2983 12LYS SC2 3570 15.302 11.909 17.502 -0.3615 0.2814 -0.2765 13GLY BB 3571 15.032 12.343 17.793 0.0112 0.0842 0.2590 14LYS BB 3572 14.678 12.274 17.871 0.0989 0.3397 0.4730 14LYS SC1 3573 14.446 12.178 18.120 0.0587 0.0021 -0.2047 14LYS SC2 3574 14.277 11.962 18.322 0.0719 -0.0813 0.0135 15GLU BB 3575 14.609 11.930 17.731 -0.2190 -0.0545 -0.1736 15GLU SC1 3576 14.356 12.081 17.457 -0.2423 0.1467 -0.0601 16LYS BB 3577 14.825 11.678 17.684 0.1368 0.2346 0.1903 16LYS SC1 3578 14.758 11.611 17.984 0.2350 0.4941 0.1333 16LYS SC2 3579 14.703 11.349 18.177 0.0732 -0.2798 -0.0566 17GLY BB 3580 15.014 11.549 17.484 0.0985 -0.4092 0.4406 18GLY BB 3581 14.955 11.662 17.175 -0.1945 -0.0816 0.0732 19LYS BB 3582 14.959 11.481 16.874 -0.1183 0.0049 0.1886 19LYS SC1 3583 15.073 11.586 16.558 -0.0529 -0.2522 0.0993 19LYS SC2 3584 15.035 11.900 16.351 0.1787 -0.1451 -0.0847 20ASN BB 3585 14.769 11.237 16.816 -0.0234 0.0088 0.0323 20ASN SC1 3586 14.979 10.972 16.779 -0.2662 -0.0831 0.3754 21ALA BB 3587 14.553 11.117 16.565 0.0049 -0.0127 0.1228 21ALA SC1 3588 14.370 10.955 16.679 0.0214 -0.0634 0.0778 22ILE BB 3589 14.453 11.153 16.234 0.0311 -0.2427 -0.2001 22ILE SC1 3590 14.166 11.333 16.273 0.1112 -0.0352 -0.5293 23ASN BB 3591 14.533 11.406 16.009 0.0593 -0.0775 -0.0276 23ASN SC1 3592 14.858 11.514 16.063 0.1292 -0.4776 -0.2547 24MET BB 3593 14.366 11.687 15.999 -0.0828 0.3152 0.1109 24MET SC1 3594 13.987 11.641 15.912 -0.1501 -0.0312 -0.1957 25LYS BB 3595 14.489 11.959 16.057 0.1075 -0.0267 0.0109 25LYS SC1 3596 14.456 12.137 15.739 0.0693 0.0085 -0.2684 25LYS SC2 3597 14.407 12.507 15.688 -0.0012 0.2126 -0.2759 26ASP BB 3598 14.462 12.259 16.194 0.1732 0.1210 -0.3636 26ASP SC1 3599 14.656 12.097 16.444 0.1859 -0.2216 -0.4254 27VAL BB 3600 14.142 12.250 16.318 -0.1766 -0.2635 0.2400 27VAL SC1 3601 14.061 12.089 16.089 -0.2509 -0.0335 0.1004 28LYS BB 3602 14.017 12.469 16.584 -0.1801 0.1794 0.2809 28LYS SC1 3603 13.994 12.233 16.786 -0.3360 -0.1363 -0.0081 28LYS SC2 3604 14.133 12.046 17.055 -0.0433 0.1291 0.1184 29ASP BB 3605 13.701 12.602 16.637 -0.0781 0.0220 0.0211 29ASP SC1 3606 13.785 12.846 16.399 -0.1202 0.1519 0.1570 30LEU BB 3607 13.540 12.404 16.528 -0.4746 -0.0737 0.0056 30LEU SC1 3608 13.778 12.109 16.437 0.1153 -0.1686 0.5080 31GLY BB 3609 13.286 12.410 16.331 -0.1078 0.2337 -0.1979 32LYS BB 3610 12.916 12.420 16.371 0.2116 -0.1555 0.3012 32LYS SC1 3611 12.869 12.722 16.400 -0.0024 0.1175 0.6171 32LYS SC2 3612 12.855 13.014 16.525 0.0102 -0.0217 0.0887 33THR BB 3613 12.645 12.336 16.258 0.2355 0.0875 0.1738 33THR SC1 3614 12.664 12.531 16.025 0.2004 0.2012 0.2649 34MET BB 3615 12.610 12.062 16.232 -0.1615 0.1217 -0.3759 34MET SC1 3616 12.616 11.933 15.918 -0.4576 -0.2686 -0.1315 35LYS BB 3617 12.474 11.902 16.491 0.2315 -0.1269 0.0535 35LYS SC1 3618 12.189 11.839 16.538 0.0251 0.1631 0.3391 35LYS SC2 3619 12.011 11.821 16.826 0.2124 0.3494 -0.0369 36ASP BB 3620 12.603 11.707 16.738 -0.5017 0.2451 -0.0451 36ASP SC1 3621 12.599 11.420 16.558 -0.2615 -0.2673 0.3867 37GLN BB 3622 12.803 11.893 16.997 -0.1143 0.0156 -0.0523 37GLN SC1 3623 13.131 11.775 16.821 0.2061 0.1560 0.2362 38ALA BB 3624 12.472 12.007 16.992 -0.1941 0.1428 0.0501 38ALA SC1 3625 12.377 11.966 17.241 0.0684 -0.1682 0.1056 39LEU BB 3626 12.559 12.311 17.085 -0.0448 -0.0805 -0.0378 39LEU SC1 3627 12.395 12.326 17.385 0.2292 0.2819 -0.2060 40LYS BB 3628 12.851 12.383 17.216 -0.1581 -0.0815 0.1123 40LYS SC1 3629 12.793 12.188 17.433 -0.0108 0.0978 0.2056 40LYS SC2 3630 12.953 12.032 17.672 0.0598 -0.4009 0.0763 41ASP BB 3631 12.976 12.658 17.276 -0.0521 0.1701 -0.2408 41ASP SC1 3632 12.681 12.812 17.174 0.1528 0.0625 0.1575 42ASP BB 3633 13.279 12.692 17.225 0.0152 0.4174 0.1658 42ASP SC1 3634 13.290 12.682 16.879 0.2769 0.1236 -0.2072 43ASP BB 3635 13.398 13.004 17.255 0.1898 0.1308 -0.3107 43ASP SC1 3636 13.140 13.190 17.392 0.0644 0.1044 -0.1271 44ALA BB 3637 13.604 13.271 17.180 -0.1798 -0.1620 0.0340 44ALA SC1 3638 13.607 13.402 17.416 -0.1080 -0.5418 0.2519 45GLU BB 3639 13.916 13.160 17.104 0.1269 0.0031 0.0308 45GLU SC1 3640 13.986 13.548 17.154 0.1043 0.0264 -0.0848 46THR BB 3641 13.958 13.055 16.818 -0.2424 -0.1825 0.1833 46THR SC1 3642 14.072 12.775 16.862 -0.2241 -0.2036 0.0104 47GLY BB 3643 14.091 13.287 16.658 -0.0320 -0.2720 0.1435 48LEU BB 3644 14.422 13.235 16.657 -0.1861 -0.6206 0.1898 48LEU SC1 3645 14.531 13.272 16.990 -0.0748 -0.0292 0.5554 49THR BB 3646 14.655 13.105 16.490 -0.0713 -0.0701 0.0397 49THR SC1 3647 14.678 13.281 16.242 -0.2845 0.1077 0.1425 50ASP BB 3648 14.600 12.823 16.306 -0.2888 -0.4215 0.0269 50ASP SC1 3649 14.427 12.714 16.578 -0.1461 0.2511 -0.3181 51GLY BB 3650 14.601 12.703 16.014 0.1214 -0.4132 -0.1764 52GLU BB 3651 14.462 12.985 15.812 0.0418 0.1833 -0.2417 52GLU SC1 3652 14.264 13.193 16.068 -0.1405 0.1060 0.3022 53GLU BB 3653 14.726 13.209 15.705 0.0163 -0.0561 -0.2771 53GLU SC1 3654 14.939 12.893 15.594 -0.0476 0.2824 -0.0033 54LYS BB 3655 14.810 13.395 15.422 -0.0276 -0.0307 -0.3005 54LYS SC1 3656 14.661 13.245 15.175 -0.2114 -0.0988 0.1552 54LYS SC2 3657 14.346 13.209 15.054 -0.3516 -0.0122 0.1038 55GLU BB 3658 14.964 13.675 15.387 -0.0769 -0.2155 -0.2480 55GLU SC1 3659 14.855 13.659 15.001 -0.1926 -0.0104 -0.1865 56GLU BB 3660 14.899 13.962 15.420 0.0136 -0.0743 -0.1443 56GLU SC1 3661 14.548 14.118 15.608 0.2172 0.1194 0.0351 57PRO BB 3662 15.175 14.131 15.389 -0.0634 0.4747 0.2920 57PRO SC1 3663 15.065 14.277 15.090 0.1044 -0.1629 0.5033 58LYS BB 3664 15.330 14.453 15.472 -0.0315 -0.0080 -0.3799 58LYS SC1 3665 15.519 14.539 15.230 -0.5518 0.3226 0.3430 58LYS SC2 3666 15.796 14.733 15.043 0.0329 -0.1084 0.1021 59GLU BB 3667 15.386 14.482 15.792 -0.2941 0.2644 0.3175 59GLU SC1 3668 15.722 14.658 15.816 -0.2171 0.0525 0.1772 60GLU BB 3669 15.463 14.206 15.924 0.0706 0.1130 0.1762 60GLU SC1 3670 15.280 13.862 15.745 0.0430 -0.2169 0.2039 61GLU BB 3671 15.654 14.039 16.115 0.0767 -0.2333 0.2613 61GLU SC1 3672 15.620 14.064 16.502 -0.0392 -0.1558 0.1844 1LYS BB 3673 13.101 20.187 13.746 0.3464 0.1936 -0.2584 1LYS SC1 3674 13.101 20.139 13.402 0.0995 0.0766 0.3555 1LYS SC2 3675 13.170 20.367 13.166 0.3596 -0.1003 -0.4509 2LYS BB 3676 12.746 20.226 13.759 -0.1435 0.0142 0.0469 2LYS SC1 3677 12.663 20.536 13.908 -0.1762 0.0401 0.1630 2LYS SC2 3678 12.710 20.816 14.101 -0.0938 0.1497 -0.2092 3CYS BB 3679 12.495 20.121 13.717 -0.1472 0.0355 -0.0378 3CYS SC1 3680 12.397 20.244 13.406 0.1252 0.4422 -0.1241 4LEU BB 3681 12.385 19.781 13.714 -0.1107 0.3000 0.1130 4LEU SC1 3682 12.419 19.870 14.056 -0.0404 -0.4045 -0.2294 5PHE BB 3683 12.100 19.641 13.775 0.0057 -0.2974 0.0418 5PHE SC1 3684 12.132 19.545 14.080 0.0211 -0.1335 0.2193 5PHE SC2 3685 12.400 19.582 14.286 0.1993 0.5906 -0.1107 5PHE SC3 3686 12.183 19.770 14.329 -0.1316 0.2100 -0.0517 6LYS BB 3687 11.761 19.796 13.767 -0.0876 -0.2275 -0.0847 6LYS SC1 3688 11.655 19.541 13.670 0.1941 0.0259 0.1837 6LYS SC2 3689 11.426 19.291 13.565 0.1654 0.1588 -0.1095 7LYS BB 3690 11.613 19.982 14.017 0.0787 -0.1103 -0.2212 7LYS SC1 3691 11.744 19.786 14.196 -0.2368 0.1357 -0.2562 7LYS SC2 3692 11.784 19.854 14.481 0.0622 -0.1099 0.0579 8LYS BB 3693 11.343 20.191 14.040 -0.2016 0.0759 -0.2434 8LYS SC1 3694 11.105 20.205 14.278 -0.3653 0.1004 -0.1324 8LYS SC2 3695 10.833 20.033 14.450 -0.0163 -0.2557 -0.1560 9ASN BB 3696 11.266 20.415 13.826 -0.0059 -0.0848 -0.4164 9ASN SC1 3697 11.473 20.731 13.700 0.0816 -0.0721 0.3168 10LYS BB 3698 11.171 20.410 13.530 0.0012 -0.3802 0.2711 10LYS SC1 3699 10.944 20.253 13.552 0.3008 -0.0850 0.4938 10LYS SC2 3700 10.611 20.150 13.646 -0.0970 -0.1221 0.0801 11LYS BB 3701 11.179 20.604 13.292 -0.0890 -0.2524 0.1050 11LYS SC1 3702 11.357 20.422 13.119 -0.4292 0.0021 -0.1001 11LYS SC2 3703 11.617 20.212 13.030 -0.0431 -0.2319 -0.0710 12LYS BB 3704 10.976 20.763 13.057 -0.0561 -0.0609 -0.1812 12LYS SC1 3705 11.202 20.948 13.011 0.0403 -0.2173 -0.0076 12LYS SC2 3706 11.336 21.160 12.764 -0.0665 -0.3061 -0.0460 13GLY BB 3707 10.919 20.878 12.713 0.0781 0.1878 -0.1130 14LYS BB 3708 11.104 20.708 12.513 -0.1124 0.0649 0.1166 14LYS SC1 3709 10.922 20.434 12.570 0.0644 0.1309 0.1215 14LYS SC2 3710 10.879 20.171 12.740 0.3392 0.0640 0.2300 15GLU BB 3711 11.144 20.694 12.197 -0.1459 0.1069 0.2003 15GLU SC1 3712 11.047 20.376 12.052 -0.1864 0.0357 -0.0436 16LYS BB 3713 11.133 20.893 11.985 -0.0620 -0.1057 0.2265 16LYS SC1 3714 11.010 20.730 11.724 0.2080 -0.2129 -0.1154 16LYS SC2 3715 10.892 20.750 11.388 -0.1473 -0.1303 0.3721 17GLY BB 3716 11.318 21.159 11.938 -0.2147 0.3167 -0.0574 18GLY BB 3717 11.324 21.432 12.025 0.2461 -0.3188 0.3398 19LYS BB 3718 11.570 21.511 12.227 -0.1338 -0.1010 0.0115 19LYS SC1 3719 11.793 21.389 12.040 0.0512 -0.2376 0.4766 19LYS SC2 3720 12.113 21.334 11.872 -0.0183 0.2637 -0.1635 20ASN BB 3721 11.552 21.833 12.250 -0.0142 -0.2155 -0.0733 20ASN SC1 3722 11.411 21.944 11.964 0.0951 0.2832 0.0328 21ALA BB 3723 11.829 22.055 12.196 0.0949 0.1092 0.1891 21ALA SC1 3724 11.909 22.060 11.939 -0.0978 0.1142 0.1278 22ILE BB 3725 12.059 21.987 12.403 0.1093 0.0423 0.2612 22ILE SC1 3726 12.115 21.748 12.166 0.1442 -0.1553 0.4661 23ASN BB 3727 12.366 22.156 12.462 -0.2276 -0.2096 0.0161 23ASN SC1 3728 12.542 21.996 12.203 0.0296 0.0998 -0.1226 24MET BB 3729 12.350 22.450 12.432 -0.1460 -0.1009 0.0002 24MET SC1 3730 12.724 22.461 12.579 -0.0926 0.0142 -0.0513 25LYS BB 3731 12.074 22.600 12.364 -0.0208 0.0036 0.0500 25LYS SC1 3732 12.019 22.414 12.139 -0.0415 0.0702 -0.1862 25LYS SC2 3733 12.287 22.320 11.963 0.2507 -0.0982 0.1128 26ASP BB 3734 11.746 22.590 12.459 0.1357 0.0449 0.3230 26ASP SC1 3735 11.618 22.289 12.497 0.2217 -0.2304 0.2378 27VAL BB 3736 11.734 22.602 12.781 0.1595 0.0301 -0.1398 27VAL SC1 3737 11.985 22.730 12.855 0.0613 0.2569 -0.1909 28LYS BB 3738 11.649 22.327 12.956 -0.2694 -0.0471 -0.0441 28LYS SC1 3739 11.390 22.290 12.893 0.1055 -0.2903 0.0977 28LYS SC2 3740 11.256 22.038 12.693 0.2892 0.1636 -0.0746 29ASP BB 3741 11.902 22.165 13.037 -0.0985 0.1443 0.2118 29ASP SC1 3742 12.144 21.985 12.853 -0.2821 0.1384 -0.1071 30LEU BB 3743 11.969 21.966 13.269 -0.3009 0.1410 -0.1490 30LEU SC1 3744 12.068 22.204 13.489 -0.3660 -0.3426 0.1297 31GLY BB 3745 11.800 21.724 13.154 0.1351 0.1343 -0.2826 32LYS BB 3746 11.956 21.452 13.028 -0.0470 0.1078 -0.2330 32LYS SC1 3747 12.015 21.395 13.349 -0.1340 -0.1179 0.1673 32LYS SC2 3748 12.296 21.379 13.570 0.2381 0.2760 0.0065 33THR BB 3749 12.236 21.568 12.985 0.1481 -0.2603 -0.0467 33THR SC1 3750 12.333 21.681 13.251 -0.0274 -0.1092 -0.0452 34MET BB 3751 12.462 21.355 12.858 0.2225 0.0455 0.4759 34MET SC1 3752 12.736 21.522 12.941 -0.2780 -0.1377 0.1007 35LYS BB 3753 12.415 21.095 12.713 0.0803 -0.0161 -0.0207 35LYS SC1 3754 12.439 20.806 12.869 -0.2324 -0.3842 0.3539 35LYS SC2 3755 12.569 20.535 12.686 -0.2472 0.1289 0.1376 36ASP BB 3756 12.675 20.967 12.528 0.0077 -0.3521 -0.0442 36ASP SC1 3757 12.484 20.809 12.314 0.0396 -0.1918 0.2053 37GLN BB 3758 12.986 20.921 12.629 0.1501 -0.0573 0.0301 37GLN SC1 3759 13.009 20.610 12.387 -0.1351 -0.2857 -0.0809 38ALA BB 3760 13.113 20.768 12.911 -0.2998 0.0885 0.1461 38ALA SC1 3761 13.329 20.931 12.912 -0.1719 -0.0791 0.2362 39LEU BB 3762 12.803 20.695 13.057 -0.3693 0.1958 0.2718 39LEU SC1 3763 12.767 21.049 12.994 -0.3554 0.1334 -0.1669 40LYS BB 3764 12.667 20.430 13.196 -0.1313 -0.1676 -0.1713 40LYS SC1 3765 12.446 20.681 13.333 0.0299 0.5090 0.1775 40LYS SC2 3766 12.114 20.644 13.386 -0.2354 -0.2241 -0.4334 41ASP BB 3767 12.627 20.143 13.043 -0.2652 0.0170 0.0912 41ASP SC1 3768 12.705 19.897 13.252 -0.1001 -0.5014 -0.2131 42ASP BB 3769 12.818 20.084 12.831 -0.0056 0.0313 -0.0588 42ASP SC1 3770 12.994 20.356 12.789 -0.2721 0.2129 -0.1807 43ASP BB 3771 12.727 19.810 12.678 0.1364 -0.3544 -0.2502 43ASP SC1 3772 12.423 19.711 12.659 0.2533 0.3035 -0.0374 44ALA BB 3773 12.868 19.660 12.448 -0.1901 0.2950 0.0622 44ALA SC1 3774 12.858 19.809 12.223 -0.1380 -0.1825 -0.2723 45GLU BB 3775 12.932 19.362 12.559 -0.1137 -0.1688 -0.2213 45GLU SC1 3776 12.642 19.282 12.787 -0.2665 0.1218 -0.0030 46THR BB 3777 13.229 19.296 12.681 0.1238 0.1275 -0.0877 46THR SC1 3778 13.485 19.443 12.604 0.1304 0.0897 -0.1383 47GLY BB 3779 13.415 19.104 12.940 -0.1950 0.1274 0.4148 48LEU BB 3780 13.701 18.930 12.903 -0.2554 -0.2528 0.0905 48LEU SC1 3781 13.908 19.170 12.749 -0.0331 0.2135 -0.2264 49THR BB 3782 13.539 18.659 12.708 -0.0448 -0.0972 0.3090 49THR SC1 3783 13.279 18.813 12.671 0.0124 -0.0720 -0.0143 50ASP BB 3784 13.647 18.316 12.626 0.1549 0.1633 -0.2487 50ASP SC1 3785 13.364 18.121 12.565 0.0756 -0.3375 -0.3388 51GLY BB 3786 13.791 18.190 12.399 -0.2909 0.0161 -0.0943 52GLU BB 3787 13.703 17.876 12.344 0.2614 -0.0221 0.0029 52GLU SC1 3788 14.097 17.866 12.492 0.0400 0.3242 0.2233 53GLU BB 3789 13.458 17.713 12.152 -0.0277 -0.3295 0.0682 53GLU SC1 3790 13.499 17.928 11.800 0.0266 0.0655 -0.0078 54LYS BB 3791 13.496 17.365 12.287 0.0077 0.0155 0.0018 54LYS SC1 3792 13.302 17.301 12.042 0.1941 0.1281 0.2301 54LYS SC2 3793 13.000 17.480 12.015 0.3126 -0.0626 -0.2279 55GLU BB 3794 13.331 17.101 12.458 0.1427 -0.2227 0.0141 55GLU SC1 3795 12.906 17.169 12.418 -0.0748 0.1279 -0.1681 56GLU BB 3796 13.267 17.052 12.777 -0.1737 -0.1440 -0.1052 56GLU SC1 3797 13.636 17.016 12.889 0.1857 -0.3449 0.3970 57PRO BB 3798 13.146 17.265 12.974 0.0031 0.1953 -0.2818 57PRO SC1 3799 12.825 17.239 12.885 -0.1361 -0.0857 -0.0342 58LYS BB 3800 13.328 17.425 13.192 0.0204 -0.0187 0.3715 58LYS SC1 3801 13.495 17.620 13.029 -0.0936 -0.4325 -0.1111 58LYS SC2 3802 13.674 17.872 12.842 0.4317 -0.0973 0.3702 59GLU BB 3803 13.251 17.600 13.441 -0.0690 0.3121 0.0748 59GLU SC1 3804 13.556 17.606 13.686 -0.2599 0.5645 -0.0259 60GLU BB 3805 13.081 17.842 13.485 0.2527 -0.4526 0.0021 60GLU SC1 3806 12.781 18.038 13.245 -0.3664 -0.2193 -0.0335 61GLU BB 3807 13.016 18.044 13.790 0.0868 -0.0016 -0.2978 61GLU SC1 3808 13.271 17.901 14.030 -0.0888 0.1511 0.3507 1LYS BB 3809 15.646 20.144 16.789 0.2111 0.1934 -0.3278 1LYS SC1 3810 15.504 20.388 16.883 -0.0496 -0.1559 -0.0256 1LYS SC2 3811 15.326 20.596 17.120 0.2105 -0.1208 -0.6094 2LYS BB 3812 15.884 20.086 17.025 0.0380 -0.0696 0.0332 2LYS SC1 3813 15.941 20.358 17.117 -0.1308 -0.0517 -0.1028 2LYS SC2 3814 16.126 20.606 17.260 -0.3180 0.1187 -0.1805 3CYS BB 3815 15.963 19.838 17.251 0.1224 -0.1410 -0.0225 3CYS SC1 3816 15.792 19.574 17.359 0.0408 -0.1217 -0.3921 4LEU BB 3817 16.026 19.998 17.518 -0.1546 -0.5313 0.3553 4LEU SC1 3818 16.359 19.922 17.492 0.1277 -0.2215 -0.0180 5PHE BB 3819 15.882 19.997 17.786 0.1400 -0.3407 -0.0516 5PHE SC1 3820 15.943 20.299 17.809 0.1941 -0.0268 0.0854 5PHE SC2 3821 15.891 20.449 17.508 0.0349 0.5727 0.3982 5PHE SC3 3822 15.684 20.494 17.707 0.0048 -0.0379 0.5239 6LYS BB 3823 15.854 19.751 17.965 -0.1075 0.0571 0.1502 6LYS SC1 3824 15.999 19.781 18.245 -0.1617 0.0841 -0.0929 6LYS SC2 3825 16.177 19.863 18.482 0.0796 0.0849 -0.0741 7LYS BB 3826 15.671 19.487 17.827 0.3331 0.2403 0.3474 7LYS SC1 3827 15.786 19.229 17.933 -0.0750 -0.1532 0.0548 7LYS SC2 3828 15.656 18.898 18.074 -0.0256 -0.0190 -0.0672 8LYS BB 3829 15.448 19.576 17.640 -0.1940 -0.1470 0.2525 8LYS SC1 3830 15.474 19.388 17.420 -0.4066 0.0133 0.3427 8LYS SC2 3831 15.635 19.334 17.075 0.1096 -0.0605 -0.0935 9ASN BB 3832 15.112 19.638 17.703 -0.2588 0.0103 -0.0658 9ASN SC1 3833 15.139 19.932 17.880 0.0560 0.0040 0.1811 10LYS BB 3834 14.895 19.482 17.863 -0.0917 -0.2128 -0.1995 10LYS SC1 3835 14.925 19.660 18.124 -0.0358 0.2947 -0.0066 10LYS SC2 3836 14.984 19.613 18.454 0.0011 0.4702 0.1481 11LYS BB 3837 14.667 19.429 17.661 0.2196 0.0102 0.0092 11LYS SC1 3838 14.613 19.611 17.435 0.1553 0.2892 0.2395 11LYS SC2 3839 14.599 19.849 17.188 0.4534 0.3573 -0.2240 12LYS BB 3840 14.650 19.193 17.385 -0.1011 -0.0081 0.0832 12LYS SC1 3841 14.409 19.139 17.209 -0.2174 -0.2184 0.1968 12LYS SC2 3842 14.057 19.170 17.127 -0.0809 0.0904 -0.2008 13GLY BB 3843 14.883 18.960 17.278 -0.0491 0.1309 -0.0376 14LYS BB 3844 15.184 19.118 17.192 -0.1239 0.1029 0.1329 14LYS SC1 3845 15.096 19.275 17.435 0.1950 -0.2540 -0.0401 14LYS SC2 3846 15.000 19.091 17.699 0.2561 0.0517 0.2715 15GLU BB 3847 15.305 18.974 16.962 -0.1145 0.0848 0.1884 15GLU SC1 3848 15.637 18.795 17.206 0.0958 -0.0516 0.1802 16LYS BB 3849 15.166 18.694 16.961 0.0531 0.0201 0.1524 16LYS SC1 3850 15.236 18.632 16.649 -0.0347 -0.0456 0.1694 16LYS SC2 3851 15.043 18.512 16.420 -0.0222 -0.4055 -0.0748 17GLY BB 3852 14.957 18.548 17.122 0.5359 0.3152 -0.1293 18GLY BB 3853 14.707 18.541 17.352 0.1544 -0.3592 -0.0289 19LYS BB 3854 14.444 18.696 17.256 0.0695 0.1385 0.1828 19LYS SC1 3855 14.558 18.792 17.020 -0.0925 -0.2290 -0.0897 19LYS SC2 3856 14.810 18.980 16.843 0.0631 0.1622 -0.0107 20ASN BB 3857 14.192 18.544 17.189 -0.0362 0.1619 0.1769 20ASN SC1 3858 13.998 18.747 16.992 0.1453 -0.2909 0.0839 21ALA BB 3859 14.041 18.215 17.300 0.1775 -0.2378 -0.1228 21ALA SC1 3860 14.192 18.265 17.518 0.0771 -0.3153 -0.0347 22ILE BB 3861 13.792 18.111 17.418 0.1400 0.3085 -0.0128 22ILE SC1 3862 13.952 17.963 17.681 -0.1290 0.1882 0.0873 23ASN BB 3863 13.605 17.964 17.238 0.3095 -0.0663 0.2027 23ASN SC1 3864 13.560 17.629 17.127 -0.3952 0.2019 0.3473 24MET BB 3865 13.318 18.065 17.072 -0.4842 -0.1703 0.0455 24MET SC1 3866 13.372 18.410 17.014 0.1526 0.2732 0.3251 25LYS BB 3867 13.024 18.029 17.203 -0.2657 0.1782 0.0171 25LYS SC1 3868 13.076 17.823 17.441 0.1091 0.0906 0.0053 25LYS SC2 3869 13.250 17.537 17.423 0.1855 0.0725 0.1384 26ASP BB 3870 13.011 18.279 17.425 0.1314 0.0680 0.0845 26ASP SC1 3871 12.690 18.248 17.595 0.0647 -0.4379 0.0655 27VAL BB 3872 13.033 18.637 17.336 -0.1056 -0.0067 -0.2707 27VAL SC1 3873 13.055 18.670 17.626 -0.0124 -0.0069 -0.2775 28LYS BB 3874 12.823 18.944 17.250 -0.0661 -0.0563 -0.0261 28LYS SC1 3875 13.035 19.199 17.229 -0.3178 -0.0950 0.1071 28LYS SC2 3876 12.941 19.473 17.423 0.1209 -0.3364 -0.0299 29ASP BB 3877 12.679 18.921 16.929 -0.3603 0.1004 0.2302 29ASP SC1 3878 12.365 18.980 17.061 -0.0122 -0.5812 -0.2098 30LEU BB 3879 12.963 18.884 16.777 0.3594 -0.1703 0.1766 30LEU SC1 3880 13.245 18.813 17.004 0.1749 0.2236 -0.0827 31GLY BB 3881 13.128 18.657 16.538 -0.0524 0.0494 -0.0969 32LYS BB 3882 13.255 18.850 16.339 0.0136 -0.0330 0.3653 32LYS SC1 3883 13.471 19.036 16.436 -0.1350 0.0605 0.3331 32LYS SC2 3884 13.364 19.221 16.700 -0.1884 0.0771 -0.0456 33THR BB 3885 13.460 18.627 16.190 -0.1730 0.1341 -0.0910 33THR SC1 3886 13.326 18.601 15.917 0.1030 0.2142 -0.2384 34MET BB 3887 13.613 18.461 16.409 -0.0385 -0.2970 0.2534 34MET SC1 3888 13.605 18.738 16.706 -0.2461 0.0605 -0.1074 35LYS BB 3889 13.358 18.256 16.531 0.1152 0.1764 -0.2420 35LYS SC1 3890 13.155 18.224 16.334 0.0825 -0.0229 0.1519 35LYS SC2 3891 13.119 18.176 16.019 -0.2904 -0.4337 -0.0807 36ASP BB 3892 13.505 17.936 16.475 -0.0303 -0.0626 -0.0856 36ASP SC1 3893 13.619 17.899 16.777 0.0687 0.2220 0.0446 37GLN BB 3894 13.666 17.925 16.226 0.3159 -0.1288 0.1180 37GLN SC1 3895 13.597 18.193 15.952 -0.1433 -0.0062 -0.0668 38ALA BB 3896 13.944 17.886 16.069 0.0093 -0.0849 -0.4057 38ALA SC1 3897 14.020 17.774 15.835 0.1398 -0.0568 -0.3776 39LEU BB 3898 14.199 17.742 16.252 -0.4172 -0.0505 0.2662 39LEU SC1 3899 14.323 18.070 16.236 -0.0702 0.1562 0.0580 40LYS BB 3900 14.225 17.457 16.219 0.0077 -0.4889 0.1712 40LYS SC1 3901 14.116 17.280 15.969 0.1906 0.3008 0.0869 40LYS SC2 3902 14.204 17.062 15.709 0.2686 0.0962 0.0737 41ASP BB 3903 14.120 17.231 16.439 -0.0462 -0.0561 -0.0846 41ASP SC1 3904 14.258 17.232 16.739 -0.2263 -0.4546 -0.1585 42ASP BB 3905 13.877 17.124 16.486 0.1877 0.1325 0.2182 42ASP SC1 3906 13.879 16.904 16.242 -0.0269 0.0975 -0.0126 43ASP BB 3907 13.754 16.995 16.778 -0.0738 0.0890 0.0560 43ASP SC1 3908 13.420 17.050 16.748 -0.1674 -0.0849 0.3675 44ALA BB 3909 13.948 16.840 16.983 0.4047 -0.2689 0.3366 44ALA SC1 3910 13.805 16.862 17.211 -0.2229 -0.1954 -0.0400 45GLU BB 3911 14.037 16.515 17.053 0.4444 0.0530 -0.1764 45GLU SC1 3912 13.766 16.414 17.299 -0.4702 -0.0507 -0.1788 46THR BB 3913 14.296 16.365 17.221 -0.0093 -0.3187 0.2460 46THR SC1 3914 14.518 16.554 17.309 -0.1403 -0.0310 -0.0217 47GLY BB 3915 14.166 16.373 17.523 -0.3634 -0.0660 -0.0362 48LEU BB 3916 14.406 16.512 17.774 0.0845 -0.0008 0.0398 48LEU SC1 3917 14.381 16.216 17.946 -0.2992 -0.0262 -0.1838 49THR BB 3918 14.724 16.594 17.727 -0.0074 -0.1603 0.0504 49THR SC1 3919 14.607 16.848 17.607 0.2482 0.0261 0.1840 50ASP BB 3920 14.952 16.428 17.541 -0.6041 0.3820 0.0406 50ASP SC1 3921 15.128 16.211 17.757 -0.0940 0.1111 0.0718 51GLY BB 3922 15.204 16.424 17.298 -0.2211 -0.2495 -0.1999 52GLU BB 3923 15.416 16.666 17.175 0.0151 0.1941 -0.1624 52GLU SC1 3924 15.684 16.715 17.419 0.0058 0.0168 0.3842 53GLU BB 3925 15.180 16.908 17.092 0.0010 -0.0530 -0.0275 53GLU SC1 3926 14.856 16.714 17.056 -0.4041 0.0617 -0.0561 54LYS BB 3927 15.253 17.257 17.063 -0.4334 0.2258 -0.1858 54LYS SC1 3928 15.111 17.487 17.206 -0.1576 0.1452 -0.1133 54LYS SC2 3929 15.216 17.834 17.211 -0.2737 0.0592 -0.0703 55GLU BB 3930 15.488 17.441 16.900 0.3244 0.0967 0.1613 55GLU SC1 3931 15.243 17.683 16.787 0.0534 0.2692 0.1637 56GLU BB 3932 15.802 17.495 16.988 0.1054 -0.0731 -0.1541 56GLU SC1 3933 15.647 17.586 17.373 -0.4208 0.2198 -0.1282 57PRO BB 3934 16.034 17.738 16.893 -0.0661 -0.1453 0.0420 57PRO SC1 3935 16.335 17.686 17.025 0.1517 -0.0368 0.0511 58LYS BB 3936 16.132 17.988 16.646 -0.0889 0.4279 0.0911 58LYS SC1 3937 16.080 18.188 16.849 0.0024 -0.1763 0.0342 58LYS SC2 3938 16.285 18.432 16.985 -0.1628 -0.0312 0.2026 59GLU BB 3939 16.419 18.013 16.491 -0.0856 -0.0026 -0.2764 59GLU SC1 3940 16.610 18.124 16.859 -0.1219 0.1938 0.1697 60GLU BB 3941 16.300 18.100 16.182 0.2406 -0.0585 -0.0492 60GLU SC1 3942 16.576 17.868 16.005 0.2311 0.0997 0.0234 61GLU BB 3943 16.016 18.017 16.145 -0.3159 0.2203 0.1747 61GLU SC1 3944 15.844 18.225 16.376 0.3581 0.1519 -0.0472 1LYS BB 3945 15.947 18.707 13.796 0.2044 0.0788 0.0682 1LYS SC1 3946 15.651 18.765 13.935 -0.0183 -0.1321 0.0083 1LYS SC2 3947 15.385 19.026 13.962 -0.0354 0.0982 0.1977 2LYS BB 3948 16.075 18.898 14.046 0.0581 -0.2293 -0.0832 2LYS SC1 3949 16.035 18.724 14.281 0.3452 -0.0595 0.0258 2LYS SC2 3950 16.183 18.447 14.436 0.0705 0.2225 0.3245 3CYS BB 3951 15.870 19.125 14.206 -0.0198 0.3279 -0.0490 3CYS SC1 3952 16.099 19.306 14.416 -0.0736 -0.0543 0.1459 4LEU BB 3953 15.655 18.963 14.415 -0.1507 -0.1955 0.2792 4LEU SC1 3954 15.663 19.173 14.665 0.2173 -0.1034 0.0974 5PHE BB 3955 15.662 18.699 14.597 -0.0051 -0.0891 -0.1473 5PHE SC1 3956 15.956 18.747 14.746 0.3235 -0.2371 0.3284 5PHE SC2 3957 16.012 19.052 14.886 -0.0988 0.1693 -0.3350 5PHE SC3 3958 16.161 18.998 14.644 0.1515 -0.2622 -0.0975 6LYS BB 3959 15.328 18.712 14.725 -0.0304 0.1806 -0.5657 6LYS SC1 3960 15.283 19.000 14.851 0.1340 0.2469 0.5720 6LYS SC2 3961 15.353 19.328 14.941 -0.1714 -0.0968 -0.1362 7LYS BB 3962 15.023 18.687 14.662 -0.1026 0.0860 -0.1334 7LYS SC1 3963 14.940 18.566 14.933 0.2582 0.0057 -0.1193 7LYS SC2 3964 15.167 18.524 15.152 -0.0486 -0.2854 0.0905 8LYS BB 3965 14.880 18.417 14.508 -0.1064 0.0711 0.2119 8LYS SC1 3966 14.802 18.185 14.671 -0.2783 -0.5968 0.1283 8LYS SC2 3967 14.857 17.882 14.778 -0.3213 -0.0623 0.1849 9ASN BB 3968 14.957 18.241 14.219 -0.4690 0.0158 0.4356 9ASN SC1 3969 14.624 18.190 14.089 0.1738 0.2425 0.1504 10LYS BB 3970 15.252 18.102 14.128 0.1030 -0.1247 -0.0072 10LYS SC1 3971 15.229 17.943 14.440 -0.1753 0.3164 -0.2057 10LYS SC2 3972 15.436 17.803 14.762 -0.1457 -0.1406 0.2052 11LYS BB 3973 15.330 17.851 13.969 -0.0080 0.0042 0.4452 11LYS SC1 3974 15.220 17.926 13.752 -0.0134 0.0860 0.0591 11LYS SC2 3975 14.923 17.832 13.595 -0.2958 -0.1466 0.0837 12LYS BB 3976 15.132 17.573 14.012 -0.0710 0.1146 0.2539 12LYS SC1 3977 15.406 17.390 13.922 -0.2624 0.2719 -0.3963 12LYS SC2 3978 15.736 17.200 13.764 -0.0757 0.0656 -0.4113 13GLY BB 3979 14.868 17.416 13.807 0.2237 -0.0881 -0.0463 14LYS BB 3980 14.789 17.356 13.463 -0.1911 -0.1154 -0.3214 14LYS SC1 3981 14.831 17.040 13.440 0.2144 0.4049 -0.1349 14LYS SC2 3982 14.844 16.743 13.206 0.2008 0.3707 0.1651 15GLU BB 3983 14.599 17.544 13.355 -0.1368 0.0519 -0.0836 15GLU SC1 3984 14.310 17.222 13.366 0.0619 -0.3509 -0.0621 16LYS BB 3985 14.572 17.617 13.052 -0.0721 -0.3053 0.1401 16LYS SC1 3986 14.469 17.505 12.816 -0.1771 0.1177 0.0845 16LYS SC2 3987 14.283 17.447 12.587 0.2350 -0.0924 0.0722 17GLY BB 3988 14.890 17.481 12.920 -0.2417 0.4756 -0.4345 18GLY BB 3989 15.042 17.634 12.687 -0.1636 0.1343 -0.0296 19LYS BB 3990 15.060 18.008 12.744 -0.0283 0.0913 -0.0913 19LYS SC1 3991 15.326 18.141 12.590 0.2389 -0.1280 0.0386 19LYS SC2 3992 15.377 18.456 12.397 0.2488 0.3721 0.2372 20ASN BB 3993 14.857 18.264 12.850 -0.2186 0.1448 0.3359 20ASN SC1 3994 14.870 18.397 12.539 0.1068 0.1133 0.1596 21ALA BB 3995 14.529 18.289 12.898 -0.1473 -0.0092 0.1114 21ALA SC1 3996 14.384 18.296 12.670 0.2562 -0.0648 -0.1568 22ILE BB 3997 14.365 18.462 13.081 0.0457 -0.1521 0.2754 22ILE SC1 3998 14.575 18.731 13.087 -0.0775 -0.0197 -0.4267 23ASN BB 3999 14.206 18.304 13.334 0.0996 -0.0676 0.2038 23ASN SC1 4000 14.206 18.002 13.340 0.3104 -0.3611 0.3026 24MET BB 4001 14.011 18.365 13.550 -0.2079 -0.3417 -0.2725 24MET SC1 4002 14.301 18.341 13.804 0.0579 -0.0390 0.4613 25LYS BB 4003 13.742 18.607 13.573 -0.3506 -0.0630 -0.0343 25LYS SC1 4004 13.522 18.422 13.560 -0.1306 0.1765 0.0138 25LYS SC2 4005 13.459 18.098 13.605 0.1349 0.0270 0.2601 26ASP BB 4006 13.639 18.821 13.366 -0.3375 0.0940 -0.0494 26ASP SC1 4007 13.304 18.754 13.242 0.0033 -0.4242 -0.5289 27VAL BB 4008 13.677 19.168 13.387 0.0335 0.2586 0.1384 27VAL SC1 4009 13.882 19.263 13.203 -0.0340 0.2933 0.0805 28LYS BB 4010 13.562 19.369 13.694 0.2342 -0.0512 -0.0607 28LYS SC1 4011 13.240 19.403 13.696 0.0852 -0.1426 -0.0741 28LYS SC2 4012 12.986 19.210 13.830 -0.0142 0.1694 0.2369 29ASP BB 4013 13.521 19.272 13.998 0.1398 0.2879 -0.2087 29ASP SC1 4014 13.242 19.172 14.155 0.2340 -0.0313 0.2974 30LEU BB 4015 13.797 19.271 14.132 0.1113 0.3618 -0.3588 30LEU SC1 4016 13.896 18.959 14.323 -0.1821 -0.1798 -0.2266 31GLY BB 4017 14.042 19.244 13.914 0.1248 0.0037 -0.0037 32LYS BB 4018 14.296 19.264 14.148 0.0035 0.0589 0.1911 32LYS SC1 4019 14.459 18.985 14.220 0.0952 -0.1650 0.0230 32LYS SC2 4020 14.736 18.918 14.369 -0.2909 0.0024 -0.2258 33THR BB 4021 14.201 19.536 14.321 -0.1324 -0.1221 -0.2212 33THR SC1 4022 14.260 19.725 14.089 -0.1192 0.0657 -0.0676 34MET BB 4023 14.271 19.656 14.636 -0.0321 0.0162 0.2258 34MET SC1 4024 14.072 19.966 14.557 0.2491 0.0235 0.0130 35LYS BB 4025 14.588 19.615 14.810 0.3592 -0.1132 0.0676 35LYS SC1 4026 14.733 19.895 14.825 -0.1369 -0.0463 -0.0605 35LYS SC2 4027 14.718 20.139 15.121 0.2046 0.2542 -0.2361 36ASP BB 4028 14.704 19.400 14.960 -0.1266 -0.3823 0.2231 36ASP SC1 4029 14.853 19.178 14.783 0.2119 0.2616 0.0680 37GLN BB 4030 14.689 19.197 15.198 0.0270 0.0065 -0.0797 37GLN SC1 4031 15.034 19.036 15.204 -0.1879 0.0649 -0.0112 38ALA BB 4032 14.422 19.068 15.258 0.6448 -0.2299 -0.1546 38ALA SC1 4033 14.323 18.849 15.136 -0.1902 0.1840 -0.2920 39LEU BB 4034 14.249 18.906 15.523 -0.0418 -0.2726 0.2688 39LEU SC1 4035 13.969 18.909 15.295 -0.5753 -0.1004 -0.3640 40LYS BB 4036 14.175 19.058 15.792 0.0091 -0.0791 0.2242 40LYS SC1 4037 14.101 18.846 15.980 0.1010 -0.4926 0.0092 40LYS SC2 4038 14.132 18.863 16.319 -0.4198 -0.0202 0.2859 41ASP BB 4039 14.158 19.385 15.846 -0.2348 -0.1012 -0.1537 41ASP SC1 4040 14.016 19.473 15.568 -0.0461 -0.2078 -0.0786 42ASP BB 4041 14.345 19.700 15.808 0.1582 0.2009 -0.2420 42ASP SC1 4042 14.580 19.500 16.022 -0.0721 -0.1064 0.0871 43ASP BB 4043 14.339 19.779 15.487 0.1248 -0.2714 -0.3536 43ASP SC1 4044 14.599 19.741 15.293 0.0749 0.0826 0.0255 44ALA BB 4045 14.302 20.032 15.197 -0.2941 0.0738 0.1201 44ALA SC1 4046 14.214 19.878 14.994 -0.0382 0.1499 -0.0529 45GLU BB 4047 14.178 20.333 15.310 0.2347 0.0029 -0.0112 45GLU SC1 4048 14.463 20.520 15.138 -0.0417 0.1945 -0.1103 46THR BB 4049 13.878 20.303 15.203 0.3936 -0.0588 0.1653 46THR SC1 4050 13.920 20.115 14.967 -0.3978 -0.0110 -0.0408 47GLY BB 4051 13.598 20.527 15.281 -0.1005 -0.2382 -0.1291 48LEU BB 4052 13.452 20.525 15.536 0.0571 -0.2883 -0.2201 48LEU SC1 4053 13.211 20.702 15.362 0.1174 -0.0487 0.1451 49THR BB 4054 13.296 20.270 15.545 0.0357 0.1398 0.2905 49THR SC1 4055 12.998 20.331 15.520 0.0728 0.1602 -0.2080 50ASP BB 4056 13.466 20.037 15.455 -0.0832 -0.0158 0.1935 50ASP SC1 4057 13.520 20.022 15.109 -0.1308 -0.1814 0.1046 51GLY BB 4058 13.208 19.800 15.388 0.1709 0.0292 -0.2330 52GLU BB 4059 13.095 19.822 15.094 -0.1200 -0.0516 0.2455 52GLU SC1 4060 12.802 20.063 15.091 0.1718 0.0957 0.3555 53GLU BB 4061 13.241 19.733 14.874 0.0124 -0.0798 0.1828 53GLU SC1 4062 13.335 19.359 14.912 -0.0306 0.2624 0.2687 54LYS BB 4063 13.170 19.939 14.615 0.0133 -0.0858 -0.0182 54LYS SC1 4064 13.343 19.758 14.419 -0.2470 -0.0835 -0.0355 54LYS SC2 4065 13.494 19.451 14.462 0.3193 0.0891 0.2484 55GLU BB 4066 12.919 20.193 14.610 0.1322 -0.2641 -0.0965 55GLU SC1 4067 12.926 20.103 14.215 0.0982 -0.0525 0.3071 56GLU BB 4068 13.113 20.482 14.599 0.0269 0.0267 -0.1785 56GLU SC1 4069 13.457 20.624 14.412 -0.1055 0.1272 -0.2829 57PRO BB 4070 13.053 20.792 14.508 -0.0666 0.1355 0.2459 57PRO SC1 4071 13.270 21.038 14.606 -0.4274 0.0002 -0.2930 58LYS BB 4072 12.704 20.816 14.624 -0.0453 -0.1885 0.0043 58LYS SC1 4073 12.680 20.565 14.804 -0.0686 0.1593 0.3112 58LYS SC2 4074 12.457 20.301 14.811 -0.0755 -0.1367 0.3478 59GLU BB 4075 12.429 20.913 14.485 -0.1870 -0.2547 -0.5420 59GLU SC1 4076 12.222 20.679 14.708 -0.1677 -0.0367 0.2650 60GLU BB 4077 12.365 21.140 14.250 0.0938 -0.0877 -0.0702 60GLU SC1 4078 12.081 20.938 14.046 -0.1305 -0.2425 -0.0612 61GLU BB 4079 12.548 21.310 14.001 -0.2958 -0.6001 -0.3632 61GLU SC1 4080 12.479 21.659 14.085 -0.0459 -0.0273 -0.0696 1LYS BB 4081 4.758 15.740 23.887 0.0438 -0.3852 0.1581 1LYS SC1 4082 5.082 15.815 23.785 0.1354 0.0137 -0.0514 1LYS SC2 4083 5.423 15.909 23.646 -0.0331 0.0461 0.1641 2LYS BB 4084 4.752 15.968 24.161 -0.2345 0.0595 0.0110 2LYS SC1 4085 4.498 16.180 24.180 0.0945 0.2098 0.0863 2LYS SC2 4086 4.555 16.457 23.960 0.0902 0.1924 0.1329 3CYS BB 4087 5.006 16.001 24.446 0.0951 -0.1840 0.1110 3CYS SC1 4088 4.697 15.840 24.550 0.0611 0.0119 -0.4956 4LEU BB 4089 5.227 16.117 24.205 -0.3178 0.0577 -0.4614 4LEU SC1 4090 5.048 16.444 24.188 0.0307 0.1924 -0.1308 5PHE BB 4091 5.382 16.329 24.465 0.3462 0.0675 -0.1044 5PHE SC1 4092 5.170 16.427 24.667 -0.0114 -0.1718 -0.1370 5PHE SC2 4093 4.833 16.464 24.659 0.0602 0.8280 0.0897 5PHE SC3 4094 4.946 16.411 24.921 0.0612 -0.1756 -0.0724 6LYS BB 4095 5.697 16.408 24.351 -0.4804 0.1423 -0.0833 6LYS SC1 4096 5.836 16.176 24.520 0.0209 -0.2342 -0.0935 6LYS SC2 4097 5.890 15.939 24.818 -0.2325 0.0459 -0.4010 7LYS BB 4098 5.685 16.726 24.277 -0.1696 0.3305 0.0966 7LYS SC1 4099 5.429 16.811 24.425 -0.1210 0.5822 -0.0146 7LYS SC2 4100 5.242 16.958 24.697 -0.0777 -0.3863 -0.2597 8LYS BB 4101 5.944 16.803 24.061 -0.1930 -0.2919 -0.2734 8LYS SC1 4102 6.009 16.518 23.983 0.2448 -0.0307 -0.2111 8LYS SC2 4103 6.204 16.468 23.741 0.1774 -0.1395 0.0796 9ASN BB 4104 5.929 17.112 23.968 0.2161 -0.4115 -0.0240 9ASN SC1 4105 6.176 17.316 24.001 -0.5328 -0.0945 0.2594 10LYS BB 4106 5.717 17.269 23.765 -0.1343 0.0023 0.0824 10LYS SC1 4107 5.613 17.093 23.510 -0.5751 0.0519 0.2094 10LYS SC2 4108 5.378 16.799 23.360 0.1296 -0.1754 -0.1061 11LYS BB 4109 5.822 17.565 23.602 0.2122 -0.1959 0.1908 11LYS SC1 4110 5.538 17.561 23.474 0.0494 0.0575 -0.1256 11LYS SC2 4111 5.189 17.686 23.550 0.2877 0.3423 -0.2290 12LYS BB 4112 6.145 17.607 23.657 -0.1037 -0.0657 -0.1767 12LYS SC1 4113 6.284 17.903 23.662 -0.2499 -0.3278 0.0465 12LYS SC2 4114 6.260 18.132 23.927 0.1064 -0.2841 0.1473 13GLY BB 4115 6.427 17.403 23.607 0.0759 0.2030 0.2728 14LYS BB 4116 6.647 17.622 23.488 0.0183 0.0941 -0.0590 14LYS SC1 4117 6.859 17.725 23.674 0.5009 -0.0438 -0.2427 14LYS SC2 4118 7.161 17.890 23.719 -0.1442 -0.0599 -0.2927 15GLU BB 4119 6.909 17.559 23.265 0.1838 0.0254 -0.0170 15GLU SC1 4120 6.741 17.462 22.887 -0.3154 -0.0579 0.0949 16LYS BB 4121 7.177 17.688 23.330 0.1101 0.4217 -0.1017 16LYS SC1 4122 7.369 17.600 23.081 0.0763 -0.4048 -0.2963 16LYS SC2 4123 7.184 17.592 22.767 -0.0768 -0.0748 0.0501 17GLY BB 4124 7.373 17.974 23.327 -0.1994 -0.0956 -0.1415 18GLY BB 4125 7.616 17.968 23.155 0.1504 0.1794 -0.2328 19LYS BB 4126 7.868 18.075 23.361 0.1389 -0.1189 0.1247 19LYS SC1 4127 7.731 18.392 23.429 0.2192 -0.0254 -0.2623 19LYS SC2 4128 7.565 18.689 23.569 -0.2022 -0.0570 0.3017 20ASN BB 4129 8.147 18.161 23.378 0.0474 0.0360 -0.0370 20ASN SC1 4130 8.341 17.944 23.181 -0.0066 0.0006 0.0966 21ALA BB 4131 8.350 18.150 23.662 -0.1065 -0.0770 0.0063 21ALA SC1 4132 8.432 18.382 23.774 0.1660 -0.0126 -0.3088 22ILE BB 4133 8.442 17.888 23.760 -0.1109 0.1804 0.2137 22ILE SC1 4134 8.726 18.075 23.770 0.0454 -0.0555 0.2799 23ASN BB 4135 8.250 17.798 23.969 0.1027 0.1111 0.0306 23ASN SC1 4136 8.285 17.923 24.220 -0.0629 0.3875 0.0493 24MET BB 4137 7.948 17.618 23.997 0.0152 -0.0036 0.4737 24MET SC1 4138 7.926 17.664 24.285 -0.0315 -0.1221 -0.0171 25LYS BB 4139 7.938 17.292 23.797 0.0377 -0.0069 -0.0383 25LYS SC1 4140 8.066 17.174 24.034 0.1621 0.2389 -0.2772 25LYS SC2 4141 8.018 16.890 24.223 0.1966 -0.0805 -0.2297 26ASP BB 4142 7.894 17.156 23.503 -0.0662 0.1104 0.0354 26ASP SC1 4143 8.109 17.231 23.261 -0.0153 0.1175 -0.0012 27VAL BB 4144 7.625 17.127 23.238 -0.0012 -0.1865 0.2806 27VAL SC1 4145 7.516 17.354 23.385 -0.0193 -0.0629 0.0796 28LYS BB 4146 7.578 16.846 23.184 -0.0841 -0.0185 0.0166 28LYS SC1 4147 7.763 16.704 23.417 -0.3591 -0.1016 0.2482 28LYS SC2 4148 7.900 16.370 23.450 0.3664 -0.0598 -0.1660 29ASP BB 4149 7.601 16.790 22.821 0.2601 0.0694 0.2998 29ASP SC1 4150 7.274 16.709 22.855 -0.1766 0.2513 0.0482 30LEU BB 4151 7.730 16.906 22.583 0.1056 0.2557 -0.1812 30LEU SC1 4152 7.556 17.178 22.418 0.1669 0.0174 -0.1138 31GLY BB 4153 7.750 16.754 22.275 0.1550 0.2966 -0.2308 32LYS BB 4154 7.519 16.761 22.071 0.1261 0.1089 -0.0769 32LYS SC1 4155 7.266 16.928 22.182 0.1060 0.0913 -0.3532 32LYS SC2 4156 6.895 17.019 22.166 0.2362 0.2260 0.1696 33THR BB 4157 7.675 16.815 21.749 0.1343 0.0623 -0.1032 33THR SC1 4158 7.583 16.990 21.517 0.1832 0.1606 -0.0486 34MET BB 4159 7.526 16.503 21.668 -0.1317 -0.0016 0.5081 34MET SC1 4160 7.862 16.226 21.661 0.0602 0.2276 0.0872 35LYS BB 4161 7.311 16.285 21.695 0.0559 -0.1799 0.1882 35LYS SC1 4162 7.449 16.214 21.979 -0.0914 0.1262 0.1164 35LYS SC2 4163 7.588 16.090 22.272 0.2272 -0.2628 0.2752 36ASP BB 4164 6.979 16.231 21.577 -0.1252 0.0039 0.1189 36ASP SC1 4165 6.894 16.099 21.906 -0.4035 -0.0210 0.0757 37GLN BB 4166 6.883 16.470 21.462 0.2561 -0.0048 0.0970 37GLN SC1 4167 7.149 16.502 21.222 -0.0540 -0.2497 -0.0428 38ALA BB 4168 6.592 16.464 21.272 0.0016 0.0072 0.1837 38ALA SC1 4169 6.626 16.567 21.025 0.1850 -0.0309 0.1919 39LEU BB 4170 6.286 16.395 21.320 -0.1022 0.0455 -0.0780 39LEU SC1 4171 5.987 16.599 21.438 0.3140 0.1127 -0.2428 40LYS BB 4172 6.239 16.081 21.158 -0.1850 -0.3176 0.0907 40LYS SC1 4173 6.347 16.128 20.860 0.0598 -0.0915 0.3907 40LYS SC2 4174 6.590 16.271 20.691 -0.0959 0.2103 0.0933 41ASP BB 4175 6.376 15.795 21.213 -0.1094 -0.0442 -0.3326 41ASP SC1 4176 6.687 15.733 21.071 -0.0239 -0.2541 -0.1009 42ASP BB 4177 6.444 15.666 21.497 0.1611 0.0639 0.0289 42ASP SC1 4178 6.246 15.353 21.434 0.1289 0.0925 -0.0387 43ASP BB 4179 6.489 15.860 21.752 0.2352 0.3639 -0.0457 43ASP SC1 4180 6.192 16.014 21.665 0.0105 0.0488 -0.0336 44ALA BB 4181 6.385 15.820 22.052 0.1425 0.2094 0.1669 44ALA SC1 4182 6.534 15.913 22.258 0.3114 -0.1240 0.2023 45GLU BB 4183 6.069 15.826 22.110 0.0111 0.0395 -0.0606 45GLU SC1 4184 5.923 15.504 22.123 0.0450 0.0230 -0.0253 46THR BB 4185 5.994 16.095 22.113 0.0406 0.0815 -0.0160 46THR SC1 4186 5.875 16.174 22.383 -0.0039 0.2140 -0.0736 47GLY BB 4187 5.901 16.320 21.916 0.0001 0.4031 -0.0750 48LEU BB 4188 6.165 16.510 21.833 -0.3361 -0.0804 0.1330 48LEU SC1 4189 6.055 16.875 21.882 0.3865 -0.0490 0.1006 49THR BB 4190 6.399 16.362 21.974 -0.1249 -0.0936 0.0685 49THR SC1 4191 6.510 16.343 21.691 -0.1446 -0.0937 0.0607 50ASP BB 4192 6.564 16.607 22.093 0.1717 0.0048 -0.1312 50ASP SC1 4193 6.736 16.743 21.829 -0.1420 -0.2673 -0.0515 51GLY BB 4194 6.437 16.794 22.328 0.1810 0.1334 0.1552 52GLU BB 4195 6.343 16.692 22.662 0.1187 -0.4367 0.2129 52GLU SC1 4196 6.524 16.373 22.721 0.1377 -0.0261 -0.0315 53GLU BB 4197 6.232 16.835 22.935 -0.0641 -0.0045 0.0917 53GLU SC1 4198 6.273 17.220 22.892 -0.0315 0.0944 0.0760 54LYS BB 4199 6.215 16.760 23.225 -0.1851 0.0545 0.3734 54LYS SC1 4200 6.502 16.855 23.336 0.2199 0.1492 0.2406 54LYS SC2 4201 6.610 17.206 23.244 0.0889 -0.0161 -0.1722 55GLU BB 4202 6.045 16.460 23.236 -0.1593 -0.0438 -0.0752 55GLU SC1 4203 6.263 16.187 23.385 -0.0295 -0.2586 -0.3080 56GLU BB 4204 5.759 16.346 23.152 -0.0080 0.2087 -0.0451 56GLU SC1 4205 5.496 16.364 23.388 -0.0181 -0.1484 -0.2047 57PRO BB 4206 5.489 16.491 22.954 -0.1305 -0.1281 0.1660 57PRO SC1 4207 5.694 16.593 22.735 -0.3404 0.0144 0.1557 58LYS BB 4208 5.194 16.499 22.982 -0.1171 -0.1240 -0.0402 58LYS SC1 4209 5.100 16.426 22.672 -0.3421 0.1202 0.4888 58LYS SC2 4210 4.986 16.578 22.402 0.4477 0.4693 0.0622 59GLU BB 4211 5.031 16.521 23.297 0.4265 -0.0247 0.1468 59GLU SC1 4212 4.902 16.899 23.304 0.1367 -0.1649 -0.1727 60GLU BB 4213 4.788 16.359 23.388 0.1784 0.2013 -0.0853 60GLU SC1 4214 4.770 16.176 23.044 -0.0656 0.1658 -0.0005 61GLU BB 4215 4.652 16.155 23.645 -0.0998 -0.1989 0.2198 61GLU SC1 4216 4.502 15.883 23.433 -0.1059 0.0027 0.0755 1LYS BB 4217 13.724 10.608 14.715 -0.0654 -0.1546 0.1179 1LYS SC1 4218 13.441 10.772 14.666 0.1153 -0.1214 -0.0583 1LYS SC2 4219 13.105 10.779 14.490 0.2113 0.3157 -0.0185 2LYS BB 4220 13.776 10.287 14.563 0.3546 -0.3077 0.3287 2LYS SC1 4221 13.583 10.052 14.631 0.2313 0.2620 -0.1566 2LYS SC2 4222 13.249 9.939 14.798 -0.1545 -0.1866 0.3671 3CYS BB 4223 13.816 10.258 14.241 -0.0413 0.4312 -0.0664 3CYS SC1 4224 13.922 10.460 13.997 0.1069 -0.1749 0.3015 4LEU BB 4225 13.527 10.110 14.107 0.2597 -0.0392 -0.2109 4LEU SC1 4226 13.770 9.863 14.008 0.2138 0.1270 0.1327 5PHE BB 4227 13.233 10.304 14.000 0.2991 -0.1331 0.0470 5PHE SC1 4228 13.090 10.169 13.715 -0.0986 -0.1514 -0.1087 5PHE SC2 4229 12.993 10.466 13.582 -0.0918 0.0412 0.3008 5PHE SC3 4230 13.114 10.281 13.395 -0.4899 0.1192 -0.0508 6LYS BB 4231 13.122 10.595 13.991 -0.0609 -0.2609 0.0678 6LYS SC1 4232 12.821 10.482 13.931 0.0773 0.2747 -0.0552 6LYS SC2 4233 12.737 10.172 13.976 0.3473 -0.0882 -0.1411 7LYS BB 4234 13.274 10.776 13.732 -0.0194 -0.1385 -0.3708 7LYS SC1 4235 13.147 10.819 13.468 -0.3054 -0.0810 0.2058 7LYS SC2 4236 12.875 10.773 13.255 0.0515 -0.0257 -0.0718 8LYS BB 4237 13.550 10.921 13.845 -0.3186 -0.2706 -0.4128 8LYS SC1 4238 13.756 10.873 13.544 0.5028 -0.3143 -0.1484 8LYS SC2 4239 13.776 10.971 13.256 0.0666 -0.1275 0.3096 9ASN BB 4240 13.608 11.224 13.970 0.1228 -0.2232 0.0195 9ASN SC1 4241 13.908 11.338 14.028 -0.2265 0.2807 0.2755 10LYS BB 4242 13.405 11.546 13.956 0.1303 -0.0476 0.3781 10LYS SC1 4243 13.522 11.691 13.693 0.3456 -0.0164 -0.1328 10LYS SC2 4244 13.692 11.914 13.457 -0.2155 0.3519 0.0264 11LYS BB 4245 13.417 11.762 14.201 -0.0533 -0.0499 -0.0513 11LYS SC1 4246 13.653 11.585 14.318 -0.1702 0.0757 -0.2550 11LYS SC2 4247 13.883 11.442 14.495 -0.1930 -0.0801 0.1548 12LYS BB 4248 13.493 12.033 14.225 0.3244 0.1732 -0.2158 12LYS SC1 4249 13.472 12.091 14.542 0.1306 -0.1631 0.2406 12LYS SC2 4250 13.409 11.831 14.765 0.0601 0.1843 -0.2798 13GLY BB 4251 13.290 12.279 14.162 0.3018 0.1083 -0.4100 14LYS BB 4252 13.260 12.542 14.004 0.2354 -0.2020 -0.1560 14LYS SC1 4253 13.256 12.478 13.724 0.1951 0.0981 -0.0900 14LYS SC2 4254 13.104 12.583 13.426 0.3030 -0.0064 -0.2515 15GLU BB 4255 13.387 12.853 14.062 0.1371 0.0136 -0.2769 15GLU SC1 4256 13.206 13.078 13.803 -0.0539 -0.0879 -0.0359 16LYS BB 4257 13.683 12.985 14.045 0.0297 0.0386 0.0801 16LYS SC1 4258 13.688 13.218 14.199 0.3661 0.1368 0.0905 16LYS SC2 4259 13.617 13.567 14.215 0.3785 0.1102 -0.0271 17GLY BB 4260 13.707 13.211 13.807 -0.0392 0.1128 0.1646 18GLY BB 4261 13.515 13.475 13.773 0.1760 -0.1959 -0.2209 19LYS BB 4262 13.572 13.747 13.576 0.2023 0.0095 -0.3976 19LYS SC1 4263 13.810 13.653 13.492 -0.0928 0.2104 -0.4017 19LYS SC2 4264 13.981 13.440 13.274 -0.1067 0.0231 -0.0728 20ASN BB 4265 13.366 13.993 13.487 -0.0821 -0.0120 -0.0828 20ASN SC1 4266 13.317 14.316 13.401 -0.1263 0.0644 0.0697 21ALA BB 4267 13.125 13.953 13.290 0.2844 0.1229 0.3230 21ALA SC1 4268 12.938 13.930 13.484 -0.1470 0.3949 -0.0430 22ILE BB 4269 13.008 14.172 13.059 0.0221 -0.0884 -0.0420 22ILE SC1 4270 12.711 14.096 13.208 0.1082 -0.2064 0.0715 23ASN BB 4271 12.989 13.950 12.791 0.1376 -0.1807 0.0077 23ASN SC1 4272 13.231 13.738 12.846 0.2708 -0.1933 0.0384 24MET BB 4273 12.990 14.107 12.455 -0.2088 -0.0249 0.3885 24MET SC1 4274 12.609 14.000 12.391 -0.1150 0.1438 0.0884 25LYS BB 4275 13.235 14.283 12.277 -0.1885 -0.3187 -0.1920 25LYS SC1 4276 13.092 14.308 11.959 0.0113 0.0336 -0.0373 25LYS SC2 4277 12.732 14.300 12.049 -0.1683 -0.3307 0.2992 26ASP BB 4278 13.163 14.621 12.256 -0.3795 -0.2526 0.0651 26ASP SC1 4279 12.852 14.563 12.385 0.2297 -0.1044 -0.1846 27VAL BB 4280 12.954 14.691 11.969 0.2058 -0.0473 -0.0596 27VAL SC1 4281 12.825 14.914 12.106 0.5039 -0.2542 0.5993 28LYS BB 4282 13.091 14.717 11.699 -0.0452 -0.1118 0.1021 28LYS SC1 4283 13.026 14.927 11.508 0.1751 -0.0913 0.1209 28LYS SC2 4284 13.212 15.220 11.490 0.0166 -0.3017 -0.1240 29ASP BB 4285 13.312 14.419 11.579 0.0715 0.1564 0.1588 29ASP SC1 4286 13.329 14.502 11.254 0.1408 -0.1283 0.2678 30LEU BB 4287 13.400 14.141 11.643 0.1291 -0.1880 -0.0236 30LEU SC1 4288 13.465 14.079 12.010 0.0289 0.1882 -0.3098 31GLY BB 4289 13.129 13.960 11.664 0.0056 -0.3488 0.1912 32LYS BB 4290 12.956 13.751 11.495 -0.1858 -0.0210 -0.0949 32LYS SC1 4291 12.863 13.521 11.671 -0.3856 0.1563 -0.0741 32LYS SC2 4292 12.978 13.350 11.941 -0.3284 0.1972 0.0484 33THR BB 4293 12.957 13.642 11.167 -0.3456 0.4018 0.0651 33THR SC1 4294 12.662 13.566 11.185 -0.2782 0.1046 -0.0281 34MET BB 4295 13.230 13.525 11.101 0.0048 0.0248 0.1135 34MET SC1 4296 13.341 13.805 10.917 -0.0876 0.3139 0.0333 35LYS BB 4297 13.337 13.372 11.397 -0.1358 -0.1976 0.0384 35LYS SC1 4298 13.611 13.256 11.348 -0.2578 0.0781 0.1546 35LYS SC2 4299 13.691 12.968 11.424 -0.1038 -0.3229 -0.2439 36ASP BB 4300 13.410 13.551 11.666 0.4163 0.0346 0.0310 36ASP SC1 4301 13.456 13.367 11.933 -0.1240 -0.1991 0.1821 37GLN BB 4302 13.673 13.752 11.678 0.1353 0.2245 -0.0923 37GLN SC1 4303 13.757 13.715 12.077 0.0393 -0.0163 0.1028 38ALA BB 4304 14.003 13.766 11.557 0.6049 -0.0951 -0.0463 38ALA SC1 4305 14.032 13.620 11.782 -0.0771 -0.1569 0.0228 39LEU BB 4306 14.070 14.054 11.649 -0.1784 0.3164 -0.0582 39LEU SC1 4307 13.825 14.134 11.870 0.0764 -0.1707 0.7605 40LYS BB 4308 14.331 14.058 11.822 0.1211 -0.0672 -0.1676 40LYS SC1 4309 14.171 14.088 12.083 0.0375 0.2543 -0.2755 40LYS SC2 4310 14.218 13.966 12.398 -0.2021 -0.2579 -0.2554 41ASP BB 4311 14.568 14.262 11.704 0.2170 -0.0548 0.0798 41ASP SC1 4312 14.475 14.152 11.367 0.0122 -0.3222 0.2127 42ASP BB 4313 14.609 14.528 11.909 0.0233 0.0194 0.2964 42ASP SC1 4314 14.536 14.349 12.206 -0.1275 -0.0404 -0.0454 43ASP BB 4315 14.623 14.813 11.822 0.1975 0.1806 0.0561 43ASP SC1 4316 14.937 14.857 11.912 0.1558 -0.1059 0.3032 44ALA BB 4317 14.391 15.131 11.812 -0.1361 0.0349 -0.1323 44ALA SC1 4318 14.191 15.102 11.633 0.1172 0.2285 -0.4576 45GLU BB 4319 14.483 15.339 12.080 -0.0786 -0.0081 0.0816 45GLU SC1 4320 14.117 15.292 12.219 -0.4160 0.0798 0.1907 46THR BB 4321 14.803 15.236 12.213 -0.3345 -0.1674 -0.0758 46THR SC1 4322 14.764 15.032 12.437 0.0154 -0.1554 0.0016 47GLY BB 4323 15.090 15.417 12.222 0.0382 0.2228 0.1828 48LEU BB 4324 15.378 15.472 12.389 -0.3191 0.0021 -0.0728 48LEU SC1 4325 15.582 15.416 12.153 -0.0282 0.1493 0.0287 49THR BB 4326 15.436 15.764 12.404 0.1390 0.1691 -0.0178 49THR SC1 4327 15.230 15.964 12.301 0.0372 0.1443 0.1353 50ASP BB 4328 15.735 15.899 12.466 -0.4724 0.5957 0.0621 50ASP SC1 4329 15.765 15.842 12.802 0.0094 -0.0377 -0.0024 51GLY BB 4330 15.892 16.059 12.255 -0.3717 -0.0432 -0.2255 52GLU BB 4331 16.107 16.207 12.400 0.1115 -0.2880 -0.0817 52GLU SC1 4332 16.307 15.852 12.406 0.0856 0.0416 0.1460 53GLU BB 4333 16.205 16.493 12.547 -0.1472 -0.1114 0.1264 53GLU SC1 4334 16.487 16.443 12.724 -0.1146 0.2120 -0.2355 54LYS BB 4335 16.250 16.738 12.337 -0.2085 -0.0713 -0.0175 54LYS SC1 4336 16.456 16.560 12.101 -0.2346 0.0674 -0.1560 54LYS SC2 4337 16.530 16.239 12.254 0.2179 -0.0399 0.0558 55GLU BB 4338 16.461 16.965 12.404 0.0363 0.1345 -0.1236 55GLU SC1 4339 16.630 17.005 12.033 0.1043 0.2522 0.0690 56GLU BB 4340 16.410 17.272 12.495 -0.0626 0.0852 -0.0040 56GLU SC1 4341 16.117 17.226 12.696 -0.3674 0.3367 0.3440 57PRO BB 4342 16.634 17.495 12.411 -0.1781 -0.0991 -0.0916 57PRO SC1 4343 16.721 17.493 12.751 -0.0758 -0.3081 -0.3115 58LYS BB 4344 16.707 17.486 12.091 -0.2319 -0.2470 0.0672 58LYS SC1 4345 17.007 17.401 12.093 -0.3593 0.1975 -0.3057 58LYS SC2 4346 16.988 17.209 11.807 0.1752 -0.1426 0.1459 59GLU BB 4347 16.720 17.787 11.870 -0.0102 -0.4264 0.1281 59GLU SC1 4348 16.947 17.642 11.613 0.0679 -0.3075 0.2216 60GLU BB 4349 16.736 18.127 11.933 -0.0946 -0.2106 0.1725 60GLU SC1 4350 17.084 18.222 11.930 0.1100 -0.1396 0.2454 61GLU BB 4351 16.669 18.186 11.624 -0.1021 -0.2002 0.2129 61GLU SC1 4352 16.305 18.258 11.602 -0.3120 -0.1797 0.1562 1LYS BB 4353 19.034 14.142 19.197 0.1840 0.2697 -0.1150 1LYS SC1 4354 19.087 14.322 19.518 0.3790 0.4993 0.1603 1LYS SC2 4355 18.851 14.571 19.691 0.1323 -0.1257 0.1984 2LYS BB 4356 19.150 13.867 19.001 0.1922 -0.0887 -0.1174 2LYS SC1 4357 19.004 13.792 18.721 0.0800 0.0034 -0.2799 2LYS SC2 4358 18.846 13.743 18.421 -0.3293 -0.0729 0.1084 3CYS BB 4359 19.428 13.714 18.936 -0.1613 -0.0330 -0.0400 3CYS SC1 4360 19.604 13.928 19.106 0.2672 -0.0131 0.2577 4LEU BB 4361 19.414 13.391 19.023 -0.1260 0.1090 -0.2352 4LEU SC1 4362 19.556 13.167 18.849 0.0133 -0.2131 0.1438 5PHE BB 4363 19.514 13.379 19.333 -0.0380 0.0967 0.0726 5PHE SC1 4364 19.780 13.621 19.340 -0.2298 -0.1798 -0.0078 5PHE SC2 4365 20.021 13.861 19.338 -0.2308 -0.1759 -0.3992 5PHE SC3 4366 19.843 13.867 19.566 -0.0123 -0.0271 -0.2281 6LYS BB 4367 19.334 13.361 19.642 -0.2709 -0.0604 0.0447 6LYS SC1 4368 19.485 13.621 19.740 0.5117 0.2089 0.1436 6LYS SC2 4369 19.630 13.839 19.928 -0.1928 0.2616 0.0629 7LYS BB 4370 19.446 13.099 19.757 0.4938 0.0808 -0.0848 7LYS SC1 4371 19.260 13.152 20.021 -0.1157 0.4084 0.3708 7LYS SC2 4372 19.174 12.819 20.221 -0.1558 -0.1640 0.0976 8LYS BB 4373 19.313 12.780 19.767 -0.0776 0.0785 -0.1658 8LYS SC1 4374 19.074 12.660 19.575 0.5301 -0.5315 -0.2052 8LYS SC2 4375 18.752 12.807 19.569 0.5235 0.1264 0.1071 9ASN BB 4376 19.501 12.646 19.982 -0.2009 -0.2593 -0.0577 9ASN SC1 4377 19.541 12.308 20.019 -0.2930 -0.2527 0.1645 10LYS BB 4378 19.655 12.792 20.227 -0.0272 -0.1839 0.4980 10LYS SC1 4379 19.935 12.618 20.264 0.3388 0.0949 -0.2749 10LYS SC2 4380 20.080 12.339 20.172 0.1658 0.0343 -0.1087 11LYS BB 4381 19.605 13.115 20.292 -0.0853 -0.0245 0.2079 11LYS SC1 4382 19.755 13.095 20.557 -0.0131 0.0884 0.2313 11LYS SC2 4383 20.049 13.308 20.612 0.2187 -0.3409 -0.0472 12LYS BB 4384 19.785 13.403 20.171 0.0356 -0.0051 0.0732 12LYS SC1 4385 19.599 13.577 20.433 0.4934 0.0140 0.3508 12LYS SC2 4386 19.306 13.597 20.649 -0.1539 0.0977 -0.0100 13GLY BB 4387 20.095 13.578 20.184 0.0773 -0.1040 0.1045 14LYS BB 4388 19.989 13.851 20.309 -0.1166 -0.2088 0.0610 14LYS SC1 4389 19.968 14.101 20.131 -0.0408 0.1796 -0.1667 14LYS SC2 4390 20.069 14.468 20.079 -0.3557 -0.0784 0.0849 15GLU BB 4391 19.909 13.846 20.623 0.2153 0.1888 -0.2974 15GLU SC1 4392 20.285 13.758 20.734 0.0821 -0.0882 0.1696 16LYS BB 4393 19.629 13.914 20.853 0.0066 -0.1451 -0.3162 16LYS SC1 4394 19.812 14.108 21.053 0.0138 0.1940 -0.1190 16LYS SC2 4395 19.878 14.163 21.407 -0.3321 -0.5470 0.3890 17GLY BB 4396 19.491 13.733 21.131 -0.0700 -0.0835 0.3929 18GLY BB 4397 19.130 13.711 21.136 -0.0323 0.1469 0.2631 19LYS BB 4398 18.898 13.860 21.317 -0.1102 0.1828 0.0858 19LYS SC1 4399 18.939 14.149 21.322 -0.1936 -0.0242 0.0046 19LYS SC2 4400 18.809 14.448 21.449 0.4661 0.0219 -0.1423 20ASN BB 4401 18.928 13.708 21.627 -0.0366 0.2395 0.1705 20ASN SC1 4402 19.286 13.748 21.651 0.1360 -0.7170 0.3870 21ALA BB 4403 18.576 13.593 21.654 0.1885 0.3248 -0.0957 21ALA SC1 4404 18.498 13.601 21.396 -0.1210 0.0117 -0.0207 22ILE BB 4405 18.302 13.692 21.811 0.1640 -0.0057 -0.2350 22ILE SC1 4406 18.238 13.878 21.532 -0.1406 -0.2332 -0.3213 23ASN BB 4407 18.121 13.443 21.957 -0.1081 0.2544 -0.0123 23ASN SC1 4408 18.319 13.227 22.201 -0.0729 -0.2755 0.2157 24MET BB 4409 17.754 13.596 21.979 -0.0796 0.0350 0.3371 24MET SC1 4410 17.753 13.766 22.243 0.0281 0.1197 0.2394 25LYS BB 4411 17.599 13.394 21.761 0.2476 0.1286 -0.0093 25LYS SC1 4412 17.827 13.237 21.638 -0.0091 0.2700 -0.1736 25LYS SC2 4413 17.997 12.981 21.755 0.0025 -0.4231 0.1772 26ASP BB 4414 17.286 13.278 21.940 -0.1541 -0.1384 0.0055 26ASP SC1 4415 17.093 13.208 21.686 -0.1165 -0.0690 -0.2943 27VAL BB 4416 17.069 13.395 22.115 0.2274 -0.0249 0.1594 27VAL SC1 4417 16.919 13.150 22.167 -0.4158 0.2381 -0.3160 28LYS BB 4418 17.043 13.730 21.979 0.0364 0.2393 -0.1958 28LYS SC1 4419 17.202 13.652 21.722 0.0175 0.1914 -0.1641 28LYS SC2 4420 17.286 13.642 21.376 -0.1196 -0.5225 -0.0928 29ASP BB 4421 17.266 13.892 22.069 0.0225 -0.0206 -0.1521 29ASP SC1 4422 17.456 14.000 21.832 -0.1332 -0.0852 0.2374 30LEU BB 4423 17.339 13.974 22.372 -0.2413 0.1208 -0.0785 30LEU SC1 4424 17.632 14.149 22.445 0.1871 -0.1691 -0.0200 31GLY BB 4425 17.097 14.096 22.523 -0.1550 0.0941 -0.0446 32LYS BB 4426 17.021 14.403 22.397 0.1944 -0.2132 0.2051 32LYS SC1 4427 16.756 14.435 22.581 0.3510 -0.0591 0.0469 32LYS SC2 4428 16.595 14.335 22.890 -0.1956 0.1457 0.3136 33THR BB 4429 16.870 14.482 22.062 0.0317 -0.0072 -0.0774 33THR SC1 4430 17.000 14.234 21.942 -0.2355 -0.0877 -0.2105 34MET BB 4431 16.766 14.768 21.941 0.3559 0.1606 -0.1615 34MET SC1 4432 16.452 14.782 22.065 0.4531 0.1314 0.2561 35LYS BB 4433 16.871 15.056 22.019 -0.2708 -0.0480 0.1650 35LYS SC1 4434 16.678 15.205 22.148 0.0336 0.2878 0.3639 35LYS SC2 4435 16.555 15.479 22.278 0.1194 0.0240 -0.2023 36ASP BB 4436 17.129 15.146 22.199 -0.1027 -0.0032 0.1970 36ASP SC1 4437 17.152 14.846 22.320 -0.4401 -0.0202 -0.1961 37GLN BB 4438 17.385 15.243 22.026 -0.1406 0.1502 -0.1552 37GLN SC1 4439 17.107 15.372 21.730 0.1273 0.0253 0.1404 38ALA BB 4440 17.525 15.496 22.238 -0.1119 -0.3015 -0.0041 38ALA SC1 4441 17.302 15.570 22.372 0.0029 0.0784 -0.0116 39LEU BB 4442 17.819 15.723 22.171 -0.1055 0.1488 0.2906 39LEU SC1 4443 17.654 15.928 22.417 0.1040 -0.1749 -0.0401 40LYS BB 4444 18.121 15.592 22.226 -0.1266 -0.2319 0.0715 40LYS SC1 4445 18.090 15.332 22.365 0.1966 0.0742 -0.2398 40LYS SC2 4446 17.741 15.231 22.492 -0.2280 -0.2504 0.1094 41ASP BB 4447 18.401 15.675 22.256 0.0143 0.4110 -0.0462 41ASP SC1 4448 18.416 15.589 22.604 0.1712 -0.1358 0.2369 42ASP BB 4449 18.590 15.508 22.019 -0.0542 0.0585 -0.2015 42ASP SC1 4450 18.338 15.323 21.877 0.0152 -0.1096 -0.1682 43ASP BB 4451 18.870 15.475 22.027 0.2230 -0.1782 -0.2205 43ASP SC1 4452 18.931 15.255 22.308 0.0281 -0.1680 0.0434 44ALA BB 4453 19.007 15.751 22.116 0.2998 -0.0346 -0.0598 44ALA SC1 4454 19.079 15.919 21.917 -0.1103 0.2547 0.0236 45GLU BB 4455 19.228 15.619 22.419 0.4044 -0.0011 0.0383 45GLU SC1 4456 19.184 15.990 22.528 0.1467 0.0961 0.1599 46THR BB 4457 19.432 15.388 22.334 -0.2492 0.2130 0.3265 46THR SC1 4458 19.692 15.464 22.194 -0.2683 -0.2571 0.0138 47GLY BB 4459 19.442 15.134 22.189 0.1827 0.0211 0.0827 48LEU BB 4460 19.734 14.942 22.105 0.2001 -0.0179 -0.0633 48LEU SC1 4461 19.949 15.113 22.277 -0.1582 -0.0420 -0.3983 49THR BB 4462 19.919 14.797 21.890 -0.1448 -0.0157 -0.0423 49THR SC1 4463 19.862 14.957 21.637 -0.0247 -0.0724 -0.1060 50ASP BB 4464 19.756 14.523 21.758 0.4423 0.2076 0.0102 50ASP SC1 4465 20.089 14.412 21.676 0.2113 0.1535 -0.0511 51GLY BB 4466 19.529 14.491 21.549 -0.0725 0.1081 -0.0931 52GLU BB 4467 19.215 14.558 21.639 -0.0297 0.1397 -0.1431 52GLU SC1 4468 19.141 14.223 21.756 0.0597 0.0402 0.2043 53GLU BB 4469 19.062 14.843 21.620 -0.1539 0.3535 -0.0452 53GLU SC1 4470 18.942 14.922 21.258 0.2032 0.1957 0.3146 54LYS BB 4471 19.076 14.970 21.962 0.0341 -0.2469 0.1016 54LYS SC1 4472 19.186 15.289 21.808 0.7763 0.4219 -0.1466 54LYS SC2 4473 19.299 15.600 21.880 -0.0034 -0.1033 0.3422 55GLU BB 4474 19.087 14.766 22.245 -0.3386 0.1324 0.1313 55GLU SC1 4475 19.367 14.566 22.090 0.3519 0.1252 0.0350 56GLU BB 4476 18.816 14.821 22.402 0.0762 -0.1527 0.0749 56GLU SC1 4477 18.512 14.539 22.427 -0.1089 0.1705 -0.0183 57PRO BB 4478 18.817 14.791 22.730 0.1566 -0.1638 -0.0374 57PRO SC1 4479 18.672 15.070 22.739 -0.0084 0.0901 -0.0793 58LYS BB 4480 19.034 14.937 23.001 -0.1640 0.1928 0.1089 58LYS SC1 4481 18.805 14.843 23.158 0.1797 0.0556 -0.0909 58LYS SC2 4482 18.759 14.523 23.178 0.1804 0.1764 0.0968 59GLU BB 4483 19.335 15.030 22.954 0.0941 0.2534 0.1695 59GLU SC1 4484 19.493 15.398 22.883 0.0744 -0.2211 0.1096 60GLU BB 4485 19.505 14.990 23.254 -0.0699 -0.0166 -0.1413 60GLU SC1 4486 19.461 15.367 23.471 0.1109 -0.2252 0.1021 61GLU BB 4487 19.469 14.733 23.494 0.2373 0.0750 0.0111 61GLU SC1 4488 19.822 14.567 23.493 0.1227 0.2419 -0.0522 1LYS BB 4489 19.317 20.644 13.352 0.0204 0.2969 -0.0732 1LYS SC1 4490 19.392 20.392 13.444 -0.0407 0.1070 -0.5029 1LYS SC2 4491 19.393 20.137 13.245 -0.2603 0.1935 0.2988 2LYS BB 4492 19.017 20.779 13.428 0.0404 -0.0365 0.0101 2LYS SC1 4493 18.987 20.614 13.712 0.4507 0.0823 0.1233 2LYS SC2 4494 18.929 20.522 14.049 0.3286 -0.2347 -0.1141 3CYS BB 4495 18.775 20.770 13.305 0.4205 0.0189 0.0474 3CYS SC1 4496 18.687 20.511 13.502 0.3201 0.3749 -0.1301 4LEU BB 4497 18.698 20.869 12.953 0.2895 0.2630 0.3023 4LEU SC1 4498 18.804 21.201 12.904 0.0165 0.4035 0.1718 5PHE BB 4499 18.414 20.772 12.745 0.3637 -0.0061 -0.1428 5PHE SC1 4500 18.400 20.950 12.492 0.4943 0.4010 0.1746 5PHE SC2 4501 18.285 20.824 12.197 -0.1165 0.4037 0.3972 5PHE SC3 4502 18.342 21.109 12.197 -0.3250 0.4469 0.3364 6LYS BB 4503 18.220 20.527 12.737 -0.0676 -0.0912 -0.0408 6LYS SC1 4504 18.455 20.421 12.525 -0.1903 -0.2920 0.0843 6LYS SC2 4505 18.581 20.600 12.241 -0.2150 0.0583 0.1022 7LYS BB 4506 18.013 20.490 12.479 -0.1483 0.2600 -0.0375 7LYS SC1 4507 17.937 20.824 12.422 -0.1855 -0.4523 0.0811 7LYS SC2 4508 17.913 21.025 12.132 -0.3322 -0.0780 -0.0552 8LYS BB 4509 18.111 20.167 12.390 0.2174 -0.0474 0.1911 8LYS SC1 4510 18.013 20.079 12.680 -0.2193 0.0762 0.0921 8LYS SC2 4511 18.205 19.812 12.821 -0.0414 0.1178 0.0981 9ASN BB 4512 18.275 20.190 12.144 0.1035 -0.4098 0.0894 9ASN SC1 4513 18.596 20.054 12.232 0.0262 -0.2393 -0.1350 10LYS BB 4514 18.219 20.376 11.925 -0.1215 -0.2725 0.1179 10LYS SC1 4515 18.272 20.237 11.694 0.1777 -0.1356 0.2022 10LYS SC2 4516 18.491 20.115 11.394 -0.0156 -0.0471 -0.1772 11LYS BB 4517 17.941 20.599 11.980 -0.0383 -0.1494 0.1928 11LYS SC1 4518 17.683 20.684 11.808 0.1055 0.3287 0.0239 11LYS SC2 4519 17.499 20.810 11.499 0.0178 -0.1191 -0.2511 12LYS BB 4520 17.755 20.390 12.097 0.1512 -0.0283 0.2487 12LYS SC1 4521 17.576 20.186 11.959 -0.2235 0.3076 -0.4245 12LYS SC2 4522 17.493 19.935 11.737 -0.1681 0.0503 0.0135 13GLY BB 4523 17.640 20.217 12.354 0.1665 -0.4048 -0.3227 14LYS BB 4524 17.504 20.267 12.608 -0.1350 0.1946 -0.0346 14LYS SC1 4525 17.565 20.551 12.667 0.0612 -0.2759 -0.3141 14LYS SC2 4526 17.385 20.864 12.688 0.0777 -0.0781 -0.3238 15GLU BB 4527 17.290 20.018 12.679 -0.0122 0.4045 -0.2123 15GLU SC1 4528 16.893 20.106 12.631 -0.0131 0.0137 0.0409 16LYS BB 4529 17.265 19.951 13.024 0.0424 0.2557 0.0932 16LYS SC1 4530 16.928 20.045 13.102 0.0205 -0.1864 0.0914 16LYS SC2 4531 16.603 20.012 12.953 -0.3738 0.3610 -0.1810 17GLY BB 4532 17.193 19.642 13.186 -0.0963 -0.1991 0.1312 18GLY BB 4533 17.410 19.398 13.338 -0.3155 -0.2849 0.1505 19LYS BB 4534 17.272 19.363 13.599 -0.0170 -0.2748 -0.2486 19LYS SC1 4535 16.972 19.335 13.508 0.1151 0.0987 -0.2632 19LYS SC2 4536 16.692 19.177 13.322 0.0530 0.0271 -0.1974 20ASN BB 4537 17.320 19.208 13.841 0.0965 -0.1997 -0.0985 20ASN SC1 4538 17.227 19.320 14.087 0.0653 0.2372 0.2326 21ALA BB 4539 17.578 19.046 13.944 -0.2702 -0.0405 0.1382 21ALA SC1 4540 17.497 18.830 13.804 -0.2110 -0.0246 0.0792 22ILE BB 4541 17.684 19.129 14.198 0.3228 0.1159 -0.0793 22ILE SC1 4542 17.670 19.465 14.146 0.4804 0.1921 0.3309 23ASN BB 4543 17.904 18.903 14.337 -0.1468 -0.1146 0.1496 23ASN SC1 4544 18.036 18.692 14.138 -0.0342 0.0581 0.0453 24MET BB 4545 17.930 18.749 14.599 -0.2348 0.3793 -0.1467 24MET SC1 4546 18.116 18.962 14.845 0.0462 0.1048 0.1026 25LYS BB 4547 17.896 18.422 14.612 0.1842 -0.0996 -0.2835 25LYS SC1 4548 18.126 18.314 14.433 -0.0839 -0.2561 -0.1671 25LYS SC2 4549 18.391 18.485 14.300 0.0764 0.0673 -0.1333 26ASP BB 4550 17.690 18.322 14.822 -0.1590 -0.1856 -0.1069 26ASP SC1 4551 17.430 18.224 14.645 0.4231 -0.0792 0.0730 27VAL BB 4552 17.509 18.334 15.113 0.2421 -0.1981 -0.1582 27VAL SC1 4553 17.655 18.502 15.303 -0.1740 -0.0842 0.0727 28LYS BB 4554 17.236 18.540 15.159 0.1057 0.0047 0.2508 28LYS SC1 4555 17.196 18.637 15.441 -0.0147 -0.1593 -0.0628 28LYS SC2 4556 17.058 18.612 15.789 0.2278 0.0612 0.3854 29ASP BB 4557 17.106 18.500 14.829 -0.3094 0.0731 -0.0391 29ASP SC1 4558 16.779 18.562 14.950 0.2282 -0.0044 -0.1029 30LEU BB 4559 17.281 18.668 14.659 0.2337 -0.2840 0.5528 30LEU SC1 4560 17.194 18.935 14.879 -0.5607 -0.0277 -0.1930 31GLY BB 4561 17.500 18.604 14.416 0.1707 0.1103 -0.0953 32LYS BB 4562 17.538 18.370 14.206 -0.0276 0.0326 0.0018 32LYS SC1 4563 17.678 18.566 14.020 0.3698 0.2487 -0.0021 32LYS SC2 4564 17.860 18.664 13.720 -0.5633 -0.2900 -0.3048 33THR BB 4565 17.616 18.087 14.261 -0.0555 0.1706 -0.1402 33THR SC1 4566 17.376 17.912 14.331 0.1506 -0.1345 -0.1778 34MET BB 4567 17.815 17.801 14.085 0.1938 0.0479 0.2439 34MET SC1 4568 17.535 17.556 13.963 0.0060 -0.0202 0.1568 35LYS BB 4569 18.133 17.713 14.057 -0.2528 -0.0974 0.1165 35LYS SC1 4570 18.102 17.720 14.371 -0.3316 -0.2583 0.2557 35LYS SC2 4571 17.968 17.938 14.532 0.1349 0.0383 -0.2686 36ASP BB 4572 18.364 17.738 13.842 0.0383 0.2371 -0.1448 36ASP SC1 4573 18.605 17.601 14.081 0.0243 0.1522 0.3417 37GLN BB 4574 18.395 17.391 13.688 -0.0976 0.0898 0.2418 37GLN SC1 4575 18.751 17.218 13.855 -0.3654 -0.0594 -0.0678 38ALA BB 4576 18.536 17.472 13.406 0.1241 0.0119 0.3064 38ALA SC1 4577 18.763 17.350 13.487 0.0057 -0.2825 0.2114 39LEU BB 4578 18.449 17.353 13.127 0.1363 -0.2318 0.0093 39LEU SC1 4579 18.749 17.249 12.964 -0.4412 0.0120 0.2569 40LYS BB 4580 18.146 17.447 13.165 0.3517 0.1184 -0.0696 40LYS SC1 4581 18.020 17.234 13.363 0.1321 -0.0962 -0.2482 40LYS SC2 4582 18.100 16.981 13.634 0.0839 0.0964 0.2696 41ASP BB 4583 17.983 17.703 13.110 -0.0711 0.4594 0.0295 41ASP SC1 4584 17.822 17.610 12.827 0.1606 -0.3670 0.2957 42ASP BB 4585 18.006 18.025 13.150 0.1867 0.0341 0.2866 42ASP SC1 4586 17.675 18.048 13.269 0.2665 0.2545 -0.1152 43ASP BB 4587 18.282 18.162 13.271 -0.4920 -0.0080 0.0410 43ASP SC1 4588 18.153 18.101 13.580 -0.0768 0.0801 -0.3425 44ALA BB 4589 18.433 18.340 13.128 -0.1878 -0.1152 -0.1339 44ALA SC1 4590 18.257 18.545 13.142 -0.2307 -0.1464 -0.2095 45GLU BB 4591 18.761 18.267 13.130 -0.0328 0.4484 0.0758 45GLU SC1 4592 18.781 18.438 13.502 0.1997 0.1062 -0.1452 46THR BB 4593 18.810 18.142 12.849 0.0688 0.2916 0.1592 46THR SC1 4594 18.935 18.208 12.579 -0.3516 0.1162 -0.0895 47GLY BB 4595 18.934 17.828 12.789 -0.0381 -0.2016 -0.1465 48LEU BB 4596 18.844 17.596 12.651 0.1027 -0.1737 -0.0636 48LEU SC1 4597 19.049 17.334 12.660 -0.1569 0.0212 0.1244 49THR BB 4598 18.525 17.531 12.688 -0.2810 -0.0299 0.0115 49THR SC1 4599 18.452 17.370 12.440 0.0570 0.0469 -0.1436 50ASP BB 4600 18.362 17.792 12.847 -0.0470 0.0313 0.1941 50ASP SC1 4601 18.578 17.809 13.105 0.0322 -0.2039 -0.0594 51GLY BB 4602 18.366 18.087 12.798 -0.3669 -0.4632 -0.1437 52GLU BB 4603 18.423 18.350 12.617 0.3694 0.0220 0.0775 52GLU SC1 4604 18.200 18.245 12.292 0.0708 0.0712 -0.0015 53GLU BB 4605 18.457 18.635 12.693 -0.0345 0.1295 0.0790 53GLU SC1 4606 18.830 18.641 12.768 0.2267 -0.1010 -0.3844 54LYS BB 4607 18.468 18.833 12.472 -0.2594 0.1315 0.1976 54LYS SC1 4608 18.313 18.719 12.217 0.1357 -0.2605 0.1150 54LYS SC2 4609 18.042 18.558 12.019 0.0579 0.2248 -0.1346 55GLU BB 4610 18.319 19.111 12.414 0.0144 0.1518 0.3375 55GLU SC1 4611 18.571 19.303 12.174 0.4590 0.2010 0.0741 56GLU BB 4612 18.020 19.218 12.330 -0.1874 0.0939 0.1889 56GLU SC1 4613 17.983 19.454 12.647 0.4244 -0.2726 -0.2826 57PRO BB 4614 17.907 19.440 12.138 0.1606 -0.3840 0.2008 57PRO SC1 4615 18.130 19.497 11.950 -0.4289 0.3119 0.2556 58LYS BB 4616 17.605 19.444 11.997 -0.0630 -0.0245 0.2286 58LYS SC1 4617 17.488 19.178 11.833 0.3599 -0.0107 -0.1714 58LYS SC2 4618 17.490 18.994 11.518 0.3264 0.0681 -0.2572 59GLU BB 4619 17.674 19.513 11.662 0.1230 0.0341 0.0753 59GLU SC1 4620 17.958 19.273 11.585 -0.0329 -0.1714 0.0164 60GLU BB 4621 17.369 19.498 11.524 -0.2706 0.2836 -0.0278 60GLU SC1 4622 17.570 19.499 11.169 -0.1795 0.1192 -0.1517 61GLU BB 4623 17.205 19.581 11.800 -0.0579 0.0275 0.0454 61GLU SC1 4624 16.943 19.322 11.926 -0.0121 0.1617 0.0342 1LYS BB 4625 20.441 14.045 22.235 0.1650 -0.0691 0.2955 1LYS SC1 4626 20.721 14.014 22.112 -0.2197 -0.2625 -0.2168 1LYS SC2 4627 21.021 14.163 21.998 -0.1742 0.1324 0.0516 2LYS BB 4628 20.228 13.886 22.440 -0.4465 0.1221 0.1868 2LYS SC1 4629 19.988 14.130 22.417 0.2761 0.1167 -0.2534 2LYS SC2 4630 19.982 14.258 22.103 -0.0411 0.0567 -0.0007 3CYS BB 4631 20.191 13.914 22.716 0.0424 0.2485 0.1456 3CYS SC1 4632 20.377 14.035 22.934 -0.2854 -0.1482 0.4409 4LEU BB 4633 19.935 13.681 22.896 0.0015 0.0581 -0.0766 4LEU SC1 4634 20.164 13.406 22.833 0.0212 0.0693 0.1486 5PHE BB 4635 19.738 13.688 22.613 -0.1130 -0.4580 0.0763 5PHE SC1 4636 19.415 13.807 22.701 0.0568 0.0178 -0.1714 5PHE SC2 4637 19.208 13.950 22.472 0.1448 0.2226 -0.1247 5PHE SC3 4638 19.268 14.113 22.704 -0.2456 -0.1217 0.2364 6LYS BB 4639 19.629 13.487 22.390 0.2766 0.0201 0.0877 6LYS SC1 4640 19.448 13.698 22.213 0.0738 -0.0421 0.1364 6LYS SC2 4641 19.182 13.915 22.073 -0.0815 0.2024 0.1894 7LYS BB 4642 19.607 13.135 22.420 0.1771 0.2344 0.0319 7LYS SC1 4643 19.438 13.121 22.719 -0.0407 -0.0863 0.2667 7LYS SC2 4644 19.197 13.123 23.028 -0.1856 -0.0217 -0.0195 8LYS BB 4645 19.502 13.063 22.119 0.0337 -0.2083 -0.0278 8LYS SC1 4646 19.130 13.059 22.113 0.0017 -0.0423 0.3205 8LYS SC2 4647 18.770 13.028 22.151 0.4793 0.0194 0.1253 9ASN BB 4648 19.737 12.866 21.935 -0.1634 -0.2462 0.3736 9ASN SC1 4649 19.816 13.110 21.661 -0.3949 0.0940 -0.0755 10LYS BB 4650 19.835 12.577 22.037 0.1500 -0.0431 -0.0717 10LYS SC1 4651 19.819 12.443 21.789 -0.2415 -0.2387 -0.1367 10LYS SC2 4652 19.904 12.346 21.524 -0.0455 -0.3752 0.1612 11LYS BB 4653 19.973 12.378 22.305 -0.2970 0.0174 0.1577 11LYS SC1 4654 19.916 12.588 22.474 -0.0836 0.1422 -0.1558 11LYS SC2 4655 20.006 12.914 22.301 0.0924 0.2830 0.0416 12LYS BB 4656 19.824 12.111 22.468 -0.2419 0.3631 -0.1015 12LYS SC1 4657 20.097 12.087 22.712 0.1803 0.1888 0.1665 12LYS SC2 4658 20.445 12.017 22.601 -0.0371 -0.0032 0.5015 13GLY BB 4659 19.997 11.877 22.374 -0.1438 -0.0380 0.0964 14LYS BB 4660 20.080 11.641 22.585 0.1739 0.1458 0.1089 14LYS SC1 4661 19.778 11.683 22.676 0.1800 0.1941 -0.1487 14LYS SC2 4662 19.555 11.916 22.838 0.1875 0.0611 0.3732 15GLU BB 4663 20.247 11.570 22.866 0.1550 -0.0140 -0.1753 15GLU SC1 4664 19.951 11.722 23.106 0.0425 -0.2835 -0.3541 16LYS BB 4665 20.477 11.329 22.777 0.1400 0.2695 -0.2077 16LYS SC1 4666 20.470 11.124 22.997 -0.1531 -0.0293 -0.4647 16LYS SC2 4667 20.726 11.080 23.216 0.1293 0.0696 0.2040 17GLY BB 4668 20.824 11.370 22.834 -0.0298 -0.1978 0.1638 18GLY BB 4669 20.982 11.293 22.502 0.0431 0.3993 0.3278 19LYS BB 4670 21.211 11.047 22.354 -0.1765 -0.0187 0.2197 19LYS SC1 4671 21.499 11.136 22.432 0.0911 0.1398 -0.0297 19LYS SC2 4672 21.523 10.961 22.736 -0.2936 -0.0040 0.2848 20ASN BB 4673 21.118 10.769 22.207 0.4001 0.1858 -0.2646 20ASN SC1 4674 20.792 10.787 22.039 -0.4211 0.3030 0.1459 21ALA BB 4675 21.170 10.422 22.222 0.0721 -0.3148 -0.0232 21ALA SC1 4676 21.226 10.287 21.994 -0.0473 -0.0026 -0.2427 22ILE BB 4677 20.952 10.331 22.509 -0.2856 -0.1721 -0.3550 22ILE SC1 4678 21.012 10.022 22.641 -0.0015 0.1329 0.2709 23ASN BB 4679 20.855 10.502 22.812 -0.0400 0.2505 0.0568 23ASN SC1 4680 21.038 10.296 22.978 -0.3459 0.1195 -0.1860 24MET BB 4681 20.706 10.801 22.732 -0.1152 -0.0323 -0.1414 24MET SC1 4682 20.320 10.682 22.839 0.0415 -0.2283 -0.1443 25LYS BB 4683 20.666 10.950 22.450 -0.0112 -0.1905 0.6090 25LYS SC1 4684 20.369 10.978 22.494 0.0363 -0.2284 -0.1858 25LYS SC2 4685 20.161 11.223 22.410 0.0093 0.2912 -0.0327 26ASP BB 4686 20.647 11.240 22.218 0.1840 0.0386 0.0328 26ASP SC1 4687 20.419 11.505 22.269 -0.1572 0.1199 -0.3219 27VAL BB 4688 20.939 11.469 22.140 -0.1114 0.0560 0.2564 27VAL SC1 4689 20.976 11.252 21.948 -0.0995 0.0163 0.3032 28LYS BB 4690 20.922 11.824 22.067 0.2184 0.1695 0.3847 28LYS SC1 4691 21.127 11.836 21.837 0.1287 0.1389 -0.1058 28LYS SC2 4692 21.391 11.541 21.702 -0.0677 -0.1090 0.2133 29ASP BB 4693 20.825 12.105 22.168 0.0695 -0.0546 -0.0842 29ASP SC1 4694 20.871 12.155 22.479 0.3881 0.0923 0.1433 30LEU BB 4695 20.813 12.417 22.083 -0.2914 0.0976 -0.1143 30LEU SC1 4696 21.103 12.421 21.875 -0.0804 -0.1225 0.0024 31GLY BB 4697 20.742 12.541 21.747 -0.1195 -0.2854 0.0477 32LYS BB 4698 20.620 12.788 21.665 -0.1712 -0.1495 0.2066 32LYS SC1 4699 20.855 12.777 21.446 0.0731 -0.2784 -0.1128 32LYS SC2 4700 21.202 12.733 21.450 0.3767 0.3084 0.1346 33THR BB 4701 20.611 12.858 21.998 0.3047 -0.1264 0.0030 33THR SC1 4702 20.343 12.727 22.061 0.2540 -0.2048 -0.3551 34MET BB 4703 20.839 12.957 22.212 -0.2218 -0.0151 0.0689 34MET SC1 4704 21.109 12.792 22.159 -0.0604 0.1098 -0.0223 35LYS BB 4705 20.913 13.242 22.237 0.1324 -0.1136 0.0780 35LYS SC1 4706 21.225 13.204 22.265 0.2278 0.1471 0.0515 35LYS SC2 4707 21.489 13.248 22.476 0.0184 -0.0769 0.1056 36ASP BB 4708 20.819 13.486 22.206 -0.1526 -0.0207 -0.1139 36ASP SC1 4709 21.012 13.685 22.013 -0.1042 -0.2049 -0.0423 37GLN BB 4710 20.600 13.559 22.410 -0.0167 -0.0484 -0.3910 37GLN SC1 4711 20.637 13.295 22.657 0.2847 0.2665 0.0280 38ALA BB 4712 20.747 13.840 22.594 0.0269 -0.1879 -0.0930 38ALA SC1 4713 20.602 13.752 22.804 0.0650 -0.2679 -0.1000 39LEU BB 4714 21.018 13.910 22.439 -0.0140 0.3776 -0.1393 39LEU SC1 4715 21.137 13.553 22.518 0.3011 -0.2064 -0.1269 40LYS BB 4716 21.131 14.212 22.463 -0.1544 0.0814 -0.0388 40LYS SC1 4717 21.436 14.183 22.477 -0.2850 -0.0816 -0.1334 40LYS SC2 4718 21.776 14.180 22.441 -0.1653 0.0679 0.1575 41ASP BB 4719 21.044 14.516 22.583 0.0328 -0.2211 -0.2028 41ASP SC1 4720 21.283 14.520 22.834 -0.0094 0.1619 -0.0296 42ASP BB 4721 20.873 14.749 22.428 -0.0352 0.3493 0.1790 42ASP SC1 4722 20.752 14.448 22.268 0.3163 0.1676 0.0399 43ASP BB 4723 20.615 14.833 22.541 -0.2292 -0.0483 -0.2152 43ASP SC1 4724 20.546 15.179 22.608 -0.0927 -0.0537 0.2313 44ALA BB 4725 20.608 14.826 22.853 -0.0602 0.0866 0.1775 44ALA SC1 4726 20.427 14.626 22.872 0.2003 -0.1784 -0.0272 45GLU BB 4727 20.706 15.033 23.033 -0.1543 -0.0423 -0.2124 45GLU SC1 4728 20.595 14.883 23.361 -0.5397 -0.0592 -0.1239 46THR BB 4729 20.857 15.279 22.929 -0.3327 -0.0783 0.2648 46THR SC1 4730 20.705 15.521 23.035 0.2537 0.4441 -0.0197 47GLY BB 4731 21.167 15.257 22.907 -0.0422 -0.0086 -0.0013 48LEU BB 4732 21.267 15.471 22.704 -0.2204 0.0071 0.0839 48LEU SC1 4733 20.978 15.723 22.761 0.0273 0.2583 0.2953 49THR BB 4734 21.598 15.531 22.644 -0.2504 0.0374 -0.3739 49THR SC1 4735 21.653 15.259 22.519 -0.5986 -0.1487 -0.1383 50ASP BB 4736 21.679 15.834 22.524 -0.3683 0.3264 0.0375 50ASP SC1 4737 21.729 15.711 22.186 0.1226 0.3898 0.1986 51GLY BB 4738 22.001 15.899 22.559 -0.0205 -0.2429 0.2659 52GLU BB 4739 22.112 16.177 22.741 0.1781 -0.0831 -0.0061 52GLU SC1 4740 22.477 16.223 22.872 0.0320 0.1090 -0.1216 53GLU BB 4741 21.883 16.407 22.739 -0.2001 0.1278 -0.0245 53GLU SC1 4742 21.931 16.658 22.467 0.1019 0.0122 0.0231 54LYS BB 4743 21.506 16.397 22.820 0.1445 -0.0017 0.1174 54LYS SC1 4744 21.401 16.263 22.553 -0.0090 -0.0007 0.1081 54LYS SC2 4745 21.531 16.172 22.225 -0.0215 0.1033 0.1785 55GLU BB 4746 21.513 16.539 23.122 -0.1524 0.2936 0.1567 55GLU SC1 4747 21.867 16.619 23.259 -0.0483 0.0423 0.2296 56GLU BB 4748 21.273 16.571 23.294 0.1848 -0.0327 0.2667 56GLU SC1 4749 21.023 16.408 23.023 0.1209 0.1414 0.1573 57PRO BB 4750 21.159 16.915 23.352 0.1541 0.1589 -0.1374 57PRO SC1 4751 21.404 16.999 23.167 -0.3247 0.5925 -0.0234 58LYS BB 4752 21.138 17.038 23.691 -0.0562 0.1858 -0.1880 58LYS SC1 4753 21.383 17.219 23.778 0.1731 -0.0981 -0.1309 58LYS SC2 4754 21.447 17.578 23.828 -0.1206 0.0288 -0.1290 59GLU BB 4755 20.861 16.984 23.885 0.1047 0.1903 0.1098 59GLU SC1 4756 20.615 17.292 23.930 -0.0325 0.1455 0.2180 60GLU BB 4757 20.785 16.656 23.957 0.1274 0.1065 -0.3038 60GLU SC1 4758 21.137 16.469 23.824 -0.0428 -0.3286 -0.2975 61GLU BB 4759 20.749 16.469 24.215 0.0625 -0.0531 0.2015 61GLU SC1 4760 21.007 16.364 24.344 0.2236 0.2918 -0.0274 1LYS BB 4761 18.269 12.236 19.082 0.0951 0.2378 0.1153 1LYS SC1 4762 18.462 12.004 18.960 -0.0012 -0.1987 -0.1432 1LYS SC2 4763 18.736 11.841 18.945 0.3089 -0.0578 -0.0059 2LYS BB 4764 18.357 12.520 18.896 -0.0759 0.0245 0.1929 2LYS SC1 4765 18.459 12.504 18.589 -0.0256 0.2955 0.0727 2LYS SC2 4766 18.319 12.589 18.268 -0.0693 0.5399 -0.1807 3CYS BB 4767 18.252 12.792 19.020 0.2481 0.1717 0.1944 3CYS SC1 4768 17.974 12.787 18.870 -0.3849 -0.3691 -0.4640 4LEU BB 4769 18.365 13.085 18.996 -0.2890 0.1170 0.0063 4LEU SC1 4770 18.661 13.022 18.808 0.0179 -0.0549 -0.3520 5PHE BB 4771 18.195 13.327 19.115 -0.0126 -0.0100 0.0049 5PHE SC1 4772 18.463 13.404 19.308 0.0959 -0.1161 0.0572 5PHE SC2 4773 18.766 13.314 19.435 0.3400 0.0195 -0.4035 5PHE SC3 4774 18.656 13.133 19.236 0.1064 -0.0365 -0.2289 6LYS BB 4775 18.228 13.611 18.995 0.0151 -0.2573 0.0469 6LYS SC1 4776 17.951 13.623 18.790 0.0426 -0.2190 -0.0468 6LYS SC2 4777 17.727 13.590 18.513 -0.1348 -0.1226 -0.2646 7LYS BB 4778 18.155 13.909 19.087 -0.0067 0.0285 -0.0541 7LYS SC1 4779 18.259 14.137 18.957 0.2389 -0.2758 0.0191 7LYS SC2 4780 18.345 14.356 18.705 0.0610 0.1818 -0.1220 8LYS BB 4781 18.127 13.904 19.401 -0.0247 -0.1868 0.3660 8LYS SC1 4782 18.462 13.874 19.383 -0.0847 0.1275 0.2312 8LYS SC2 4783 18.777 13.704 19.248 -0.0809 -0.2708 -0.0891 9ASN BB 4784 17.882 13.717 19.559 -0.0358 -0.0355 -0.3045 9ASN SC1 4785 18.159 13.549 19.648 -0.1364 -0.3510 -0.1585 10LYS BB 4786 17.680 13.726 19.820 -0.0425 -0.0294 0.0570 10LYS SC1 4787 17.504 13.930 19.911 -0.2290 0.2598 -0.1904 10LYS SC2 4788 17.385 13.959 20.197 -0.0003 0.0849 -0.0965 11LYS BB 4789 17.426 13.460 19.874 0.1327 -0.1196 0.0181 11LYS SC1 4790 17.415 13.303 19.613 -0.1764 0.1904 -0.2729 11LYS SC2 4791 17.440 12.966 19.565 -0.1663 0.2099 -0.0723 12LYS BB 4792 17.557 13.179 20.031 0.1116 -0.2974 -0.2778 12LYS SC1 4793 17.840 13.154 20.107 -0.2251 -0.3165 0.4137 12LYS SC2 4794 18.063 12.913 20.178 0.2110 -0.3700 -0.0527 13GLY BB 4795 17.375 12.875 20.015 0.2326 0.1150 -0.1349 14LYS BB 4796 17.159 12.693 19.838 -0.0746 0.0152 -0.0400 14LYS SC1 4797 16.980 12.556 20.072 0.3945 0.0871 0.0323 14LYS SC2 4798 16.800 12.697 20.310 -0.0380 -0.1684 0.2811 15GLU BB 4799 17.160 12.466 19.599 0.0559 -0.0505 -0.4180 15GLU SC1 4800 17.438 12.580 19.330 -0.2170 0.4478 0.2442 16LYS BB 4801 16.905 12.410 19.405 -0.2016 0.0126 -0.2213 16LYS SC1 4802 16.902 12.656 19.219 -0.4346 -0.1005 0.2418 16LYS SC2 4803 16.741 12.930 19.060 -0.3359 -0.1460 -0.1686 17GLY BB 4804 16.642 12.368 19.464 -0.3149 0.2833 -0.3824 18GLY BB 4805 16.513 12.253 19.700 -0.1231 -0.3878 -0.1125 19LYS BB 4806 16.212 12.156 19.744 -0.2057 0.1113 -0.1036 19LYS SC1 4807 16.355 11.813 19.711 -0.0497 -0.0962 0.1133 19LYS SC2 4808 16.590 11.552 19.815 -0.1799 0.4626 -0.2279 20ASN BB 4809 15.913 12.226 19.915 -0.2910 -0.0856 0.4633 20ASN SC1 4810 16.081 12.082 20.190 0.0442 -0.0315 0.3974 21ALA BB 4811 15.848 12.438 20.091 0.0675 -0.0248 -0.1787 21ALA SC1 4812 16.079 12.559 20.162 0.0471 0.0716 -0.2736 22ILE BB 4813 15.568 12.609 20.157 -0.0646 0.1202 -0.2182 22ILE SC1 4814 15.721 12.847 19.966 0.3223 0.0703 0.0193 23ASN BB 4815 15.269 12.588 20.053 -0.1653 0.2366 -0.0461 23ASN SC1 4816 15.038 12.734 20.262 -0.2958 0.0373 -0.1517 24MET BB 4817 15.028 12.429 19.837 -0.1087 0.2108 0.0958 24MET SC1 4818 15.110 12.566 19.583 0.0369 0.0049 -0.2220 25LYS BB 4819 14.769 12.617 19.890 -0.3690 -0.0287 0.0240 25LYS SC1 4820 14.947 12.906 19.855 -0.2607 -0.1569 0.0320 25LYS SC2 4821 15.061 13.202 19.820 0.6874 -0.4619 -0.4346 26ASP BB 4822 14.655 12.398 20.124 -0.2290 0.2290 -0.0260 26ASP SC1 4823 14.658 12.106 19.940 0.2270 -0.0700 -0.1412 27VAL BB 4824 14.321 12.366 20.109 -0.0258 -0.1833 -0.3043 27VAL SC1 4825 14.141 12.341 20.337 0.4687 0.1462 0.1460 28LYS BB 4826 14.169 12.647 20.000 0.2775 -0.1574 0.2008 28LYS SC1 4827 13.883 12.628 19.984 0.0961 -0.1260 -0.3050 28LYS SC2 4828 13.659 12.509 20.261 -0.0603 -0.1516 -0.1345 29ASP BB 4829 14.246 12.881 19.749 0.0027 0.0487 0.0526 29ASP SC1 4830 14.477 13.092 19.829 -0.1559 -0.0265 -0.3143 30LEU BB 4831 14.143 13.030 19.433 0.4380 0.0676 -0.1986 30LEU SC1 4832 14.129 12.668 19.372 -0.1327 -0.1315 0.2141 31GLY BB 4833 14.396 13.022 19.279 -0.1497 -0.3135 -0.3595 32LYS BB 4834 14.648 12.903 19.419 -0.3269 -0.2456 -0.0291 32LYS SC1 4835 14.630 12.596 19.374 0.0638 0.0599 -0.1048 32LYS SC2 4836 14.797 12.260 19.437 0.0282 0.0243 0.2715 33THR BB 4837 14.916 13.123 19.413 0.0421 0.1264 0.0027 33THR SC1 4838 14.904 13.426 19.379 -0.1629 0.1540 0.2894 34MET BB 4839 15.200 13.050 19.400 -0.0341 0.1879 -0.0003 34MET SC1 4840 15.463 13.084 19.627 -0.0339 0.0791 0.0652 35LYS BB 4841 15.427 13.035 19.095 0.0577 0.2156 -0.0058 35LYS SC1 4842 15.556 12.748 19.082 -0.4796 0.1338 0.2744 35LYS SC2 4843 15.747 12.449 19.124 0.2384 -0.0502 0.1002 36ASP BB 4844 15.659 13.264 19.025 0.2100 -0.0272 -0.1772 36ASP SC1 4845 15.914 13.189 18.830 -0.5303 0.1403 -0.1763 37GLN BB 4846 15.578 13.564 18.888 0.2256 0.0495 0.0716 37GLN SC1 4847 15.695 13.491 18.510 0.1377 -0.0345 -0.2602 38ALA BB 4848 15.263 13.556 18.785 0.0584 0.0661 -0.1930 38ALA SC1 4849 15.300 13.526 18.519 -0.0192 -0.0765 -0.1884 39LEU BB 4850 14.939 13.697 18.918 -0.0504 0.1491 -0.2338 39LEU SC1 4851 14.945 13.830 18.618 -0.1365 -0.0101 0.0079 40LYS BB 4852 14.618 13.673 18.923 -0.2474 0.4881 0.0157 40LYS SC1 4853 14.543 13.892 18.802 0.4361 -0.1023 0.0514 40LYS SC2 4854 14.278 14.047 18.626 0.1419 0.1409 0.0434 41ASP BB 4855 14.554 13.365 19.071 -0.0556 -0.0463 0.3039 41ASP SC1 4856 14.286 13.472 19.224 -0.2280 -0.0279 0.1161 42ASP BB 4857 14.697 13.073 18.931 0.0581 -0.2555 0.0043 42ASP SC1 4858 15.015 13.225 18.993 -0.1902 -0.0496 0.3321 43ASP BB 4859 14.731 12.942 18.685 0.0295 -0.3282 0.0680 43ASP SC1 4860 14.433 12.928 18.542 0.1252 0.0382 -0.2581 44ALA BB 4861 14.785 12.618 18.566 0.1600 -0.1511 0.0450 44ALA SC1 4862 14.696 12.526 18.804 0.0826 0.2587 0.1813 45GLU BB 4863 15.142 12.575 18.628 0.0103 -0.3673 0.1309 45GLU SC1 4864 15.359 12.356 18.859 0.1225 -0.2542 -0.1067 46THR BB 4865 15.365 12.522 18.375 -0.1999 0.0463 0.1849 46THR SC1 4866 15.444 12.810 18.309 0.0848 -0.0392 0.1392 47GLY BB 4867 15.547 12.295 18.197 0.1805 0.0535 -0.2945 48LEU BB 4868 15.465 12.193 17.908 -0.2911 0.0542 -0.4281 48LEU SC1 4869 15.648 11.891 17.740 0.0930 0.1115 -0.2141 49THR BB 4870 15.688 12.396 17.760 -0.0838 -0.0244 0.1217 49THR SC1 4871 15.748 12.241 17.504 0.0145 0.0485 0.0999 50ASP BB 4872 15.610 12.693 17.715 -0.1072 0.0203 0.0882 50ASP SC1 4873 15.318 12.661 17.904 0.3415 0.1416 -0.0567 51GLY BB 4874 15.567 12.667 17.373 -0.5010 0.6950 0.2969 52GLU BB 4875 15.735 12.499 17.139 -0.0366 0.1263 0.1605 52GLU SC1 4876 15.782 12.817 16.965 0.2247 0.3332 0.0891 53GLU BB 4877 15.982 12.255 17.130 -0.0490 -0.0814 0.1395 53GLU SC1 4878 15.808 11.986 16.858 -0.0937 0.0689 0.0771 54LYS BB 4879 16.158 12.187 17.416 -0.2653 0.3191 -0.2308 54LYS SC1 4880 16.259 11.895 17.348 -0.2656 0.0098 0.0467 54LYS SC2 4881 16.444 11.554 17.422 -0.0069 0.1934 -0.0820 55GLU BB 4882 16.441 12.328 17.396 0.2126 0.2527 -0.1306 55GLU SC1 4883 16.660 11.998 17.509 -0.1765 0.0223 0.1172 56GLU BB 4884 16.514 12.619 17.626 -0.1217 0.0232 0.1298 56GLU SC1 4885 16.241 12.471 17.870 0.0829 -0.1601 -0.2818 57PRO BB 4886 16.797 12.821 17.577 -0.3035 0.1565 -0.2056 57PRO SC1 4887 16.972 12.758 17.819 -0.0552 0.1661 0.0892 58LYS BB 4888 16.797 13.097 17.396 0.1464 -0.0884 0.1923 58LYS SC1 4889 16.988 13.279 17.575 0.1530 -0.2228 -0.1019 58LYS SC2 4890 17.261 13.541 17.612 0.0030 0.0588 -0.0883 59GLU BB 4891 16.943 13.258 17.130 -0.3268 -0.1033 -0.0735 59GLU SC1 4892 16.940 13.614 17.242 -0.0636 0.0578 0.1244 60GLU BB 4893 16.845 13.105 16.855 0.1893 0.0793 -0.2129 60GLU SC1 4894 16.471 13.083 16.981 0.0138 -0.2674 -0.0597 61GLU BB 4895 17.030 12.819 16.841 -0.4799 0.0257 0.1239 61GLU SC1 4896 17.111 12.767 17.194 0.4430 -0.0357 0.0664 1LYS BB 4897 15.852 15.721 13.737 -0.0236 -0.2023 0.0584 1LYS SC1 4898 15.612 15.918 13.658 -0.1004 0.0716 0.0627 1LYS SC2 4899 15.250 15.822 13.749 -0.0846 0.2726 0.1782 2LYS BB 4900 16.040 15.786 14.012 -0.1258 -0.2523 -0.3173 2LYS SC1 4901 16.106 15.636 14.309 -0.2709 0.3833 0.0844 2LYS SC2 4902 15.827 15.497 14.491 -0.2453 -0.1889 -0.0629 3CYS BB 4903 16.314 15.972 14.016 0.0794 0.1304 0.1890 3CYS SC1 4904 16.356 16.002 14.364 -0.3580 0.2137 0.2635 4LEU BB 4905 16.368 16.285 14.050 0.4480 -0.0030 0.2737 4LEU SC1 4906 16.411 16.430 14.343 0.2234 0.2094 0.1125 5PHE BB 4907 16.580 16.323 13.798 -0.0869 -0.0563 -0.1145 5PHE SC1 4908 16.340 16.330 13.620 0.1567 -0.0207 -0.1629 5PHE SC2 4909 16.059 16.140 13.644 0.1242 0.0389 -0.0629 5PHE SC3 4910 16.270 16.029 13.480 0.0427 -0.0065 -0.1380 6LYS BB 4911 16.752 16.147 13.621 0.1794 0.2859 0.1514 6LYS SC1 4912 16.611 15.878 13.692 0.1833 -0.3020 -0.1789 6LYS SC2 4913 16.715 15.621 13.883 -0.1953 0.2354 0.3170 7LYS BB 4914 16.940 16.283 13.387 -0.2173 -0.0187 -0.2195 7LYS SC1 4915 16.821 16.573 13.422 -0.3508 0.1732 -0.3326 7LYS SC2 4916 16.823 16.972 13.343 0.2451 0.0610 -0.2135 8LYS BB 4917 17.100 15.995 13.209 -0.1900 -0.0490 0.2087 8LYS SC1 4918 17.101 16.103 12.934 0.2181 0.1976 -0.3152 8LYS SC2 4919 17.167 16.323 12.670 0.0681 -0.0111 -0.0398 9ASN BB 4920 17.462 16.017 13.192 -0.2049 -0.1036 -0.1539 9ASN SC1 4921 17.563 16.189 12.914 0.3229 0.0767 -0.2291 10LYS BB 4922 17.646 15.890 13.420 0.1334 0.3117 -0.5578 10LYS SC1 4923 17.974 15.826 13.371 -0.2589 -0.0763 -0.0090 10LYS SC2 4924 18.301 15.984 13.293 -0.2057 0.0551 0.4165 11LYS BB 4925 17.645 15.725 13.753 -0.2639 0.0039 0.1607 11LYS SC1 4926 17.896 15.516 13.709 0.1426 -0.0980 0.1064 11LYS SC2 4927 18.132 15.305 13.854 -0.0513 -0.3343 0.1410 12LYS BB 4928 17.595 15.954 13.991 0.1662 0.0562 0.0830 12LYS SC1 4929 17.653 16.188 13.790 -0.1892 0.2579 -0.0649 12LYS SC2 4930 17.473 16.364 13.550 -0.2751 -0.1453 0.0551 13GLY BB 4931 17.349 16.182 14.089 0.1678 0.2015 -0.2319 14LYS BB 4932 17.307 16.252 14.383 -0.0693 0.5288 -0.0221 14LYS SC1 4933 17.038 16.458 14.410 0.0644 -0.0538 -0.0020 14LYS SC2 4934 16.829 16.275 14.645 0.0754 -0.1033 0.0643 15GLU BB 4935 17.191 15.951 14.527 0.2426 -0.0059 0.2583 15GLU SC1 4936 17.108 15.750 14.160 -0.1714 -0.1591 0.1233 16LYS BB 4937 17.323 15.741 14.687 -0.3846 0.2964 0.0809 16LYS SC1 4938 17.638 15.659 14.646 0.1174 -0.1363 -0.2069 16LYS SC2 4939 17.864 15.448 14.585 0.0136 0.2382 0.0668 17GLY BB 4940 17.182 15.676 14.960 -0.3267 0.0409 0.1764 18GLY BB 4941 17.039 15.406 15.032 0.1770 -0.0427 0.0106 19LYS BB 4942 16.720 15.371 14.986 -0.1909 0.0681 0.2305 19LYS SC1 4943 16.635 15.562 15.235 -0.0717 -0.2954 -0.0444 19LYS SC2 4944 16.631 15.693 15.563 0.0222 -0.0824 -0.0327 20ASN BB 4945 16.469 15.397 14.766 -0.1134 -0.5175 -0.3456 20ASN SC1 4946 16.292 15.677 14.666 -0.2401 0.4264 0.0316 21ALA BB 4947 16.441 15.187 14.536 0.1899 -0.0130 -0.0323 21ALA SC1 4948 16.188 15.283 14.535 0.1694 -0.0432 0.3714 22ILE BB 4949 16.655 14.975 14.555 0.2003 0.0778 -0.1022 22ILE SC1 4950 16.612 14.935 14.891 -0.1176 0.0123 -0.1476 23ASN BB 4951 16.695 14.641 14.440 -0.1225 -0.0153 -0.0608 23ASN SC1 4952 16.947 14.580 14.652 0.5685 0.0799 -0.1053 24MET BB 4953 16.689 14.420 14.219 0.0650 0.0109 -0.2395 24MET SC1 4954 16.334 14.263 14.177 -0.1548 -0.1587 0.0976 25LYS BB 4955 16.809 14.071 14.161 0.1058 -0.0995 -0.0538 25LYS SC1 4956 16.629 13.932 14.011 0.1285 0.2862 -0.2728 25LYS SC2 4957 16.364 13.909 13.768 -0.2143 0.1710 -0.1304 26ASP BB 4958 17.112 13.989 14.226 -0.1081 0.0329 -0.0667 26ASP SC1 4959 17.098 14.089 14.547 -0.1085 0.2508 0.2516 27VAL BB 4960 17.322 13.989 14.012 0.3777 0.4114 -0.0336 27VAL SC1 4961 17.561 13.886 14.143 0.0609 -0.1776 0.1186 28LYS BB 4962 17.471 14.240 13.871 -0.1367 0.0510 0.0619 28LYS SC1 4963 17.674 14.010 13.692 0.0152 -0.0087 0.0453 28LYS SC2 4964 17.869 13.818 13.425 -0.1077 -0.0264 -0.1245 29ASP BB 4965 17.322 14.532 13.850 -0.1322 -0.1079 0.0990 29ASP SC1 4966 17.037 14.360 13.860 0.1520 0.1729 0.2698 30LEU BB 4967 17.481 14.764 13.996 0.2453 -0.3113 0.1775 30LEU SC1 4968 17.663 14.524 14.197 0.0678 0.2489 0.2365 31GLY BB 4969 17.283 15.043 13.992 -0.1109 0.2832 0.0971 32LYS BB 4970 17.142 15.010 13.688 -0.3049 -0.0592 -0.0014 32LYS SC1 4971 16.956 14.777 13.682 0.0353 -0.0802 -0.1064 32LYS SC2 4972 16.959 14.750 14.066 -0.2211 0.1816 0.3099 33THR BB 4973 17.431 14.916 13.457 -0.0984 -0.0224 -0.3838 33THR SC1 4974 17.404 14.616 13.405 0.1701 -0.1230 0.0154 34MET BB 4975 17.764 14.874 13.553 0.1515 -0.0342 0.1138 34MET SC1 4976 17.824 14.576 13.696 0.2807 0.0801 0.0052 35LYS BB 4977 17.974 14.898 13.318 0.0359 0.2158 -0.1170 35LYS SC1 4978 17.868 15.138 13.130 0.1220 0.0426 -0.2475 35LYS SC2 4979 17.919 15.501 13.082 -0.1163 -0.0873 0.0953 36ASP BB 4980 18.242 15.019 13.472 0.0023 0.1271 -0.1629 36ASP SC1 4981 18.252 15.304 13.331 -0.2595 0.1642 0.1085 37GLN BB 4982 18.474 14.816 13.590 -0.0018 0.1229 -0.2359 37GLN SC1 4983 18.319 14.570 13.843 -0.2530 -0.4034 0.1048 38ALA BB 4984 18.643 14.635 13.314 -0.0982 0.3229 -0.3058 38ALA SC1 4985 18.838 14.498 13.440 -0.0276 0.5829 -0.1239 39LEU BB 4986 18.736 14.622 12.991 0.1264 0.0553 0.0377 39LEU SC1 4987 19.049 14.671 13.147 0.1389 0.0396 -0.1207 40LYS BB 4988 18.521 14.628 12.757 -0.2606 0.1885 0.1627 40LYS SC1 4989 18.574 14.616 12.432 -0.2609 -0.4823 0.1630 40LYS SC2 4990 18.539 14.635 12.031 -0.2407 -0.2510 -0.4723 41ASP BB 4991 18.226 14.518 12.798 -0.1990 -0.0041 0.0761 41ASP SC1 4992 18.049 14.686 12.553 0.0751 -0.3055 -0.0645 42ASP BB 4993 18.052 14.243 12.820 -0.1723 -0.1662 0.0201 42ASP SC1 4994 17.899 14.106 12.566 0.3071 0.2300 -0.0917 43ASP BB 4995 18.199 13.986 12.930 0.2785 -0.2650 0.1584 43ASP SC1 4996 18.245 14.016 13.267 0.1768 -0.1372 -0.1213 44ALA BB 4997 18.488 13.930 12.787 0.2637 0.0097 0.1412 44ALA SC1 4998 18.420 14.116 12.603 0.2840 -0.0677 0.0544 45GLU BB 4999 18.647 13.652 12.783 0.1368 0.1110 -0.0687 45GLU SC1 5000 18.710 13.787 12.432 0.0158 0.1278 0.3594 46THR BB 5001 18.391 13.486 12.803 -0.1553 0.0363 0.1842 46THR SC1 5002 18.506 13.206 12.838 -0.0864 0.0161 -0.1686 47GLY BB 5003 18.151 13.435 12.621 0.5102 0.1173 0.2844 48LEU BB 5004 17.859 13.324 12.605 -0.1272 -0.1557 -0.2730 48LEU SC1 5005 17.867 13.085 12.275 0.2626 0.1475 -0.2533 49THR BB 5006 17.602 13.422 12.794 -0.0960 0.0032 -0.1522 49THR SC1 5007 17.511 13.661 12.628 -0.1467 -0.1305 -0.3194 50ASP BB 5008 17.592 13.303 13.080 0.3042 -0.0992 0.1524 50ASP SC1 5009 17.512 13.585 13.251 0.0346 0.3774 0.2096 51GLY BB 5010 17.339 13.216 13.130 0.3684 0.2267 -0.1746 52GLU BB 5011 17.171 13.046 12.921 -0.0300 0.0486 -0.2737 52GLU SC1 5012 17.295 13.126 12.575 0.1303 0.0233 0.1510 53GLU BB 5013 16.900 13.008 13.108 -0.0431 0.2942 -0.0851 53GLU SC1 5014 16.563 13.057 12.928 0.2505 -0.2121 0.0871 54LYS BB 5015 16.962 12.969 13.442 -0.0520 0.1236 -0.1757 54LYS SC1 5016 17.184 12.797 13.390 0.3372 0.0474 0.0020 54LYS SC2 5017 17.470 12.797 13.166 -0.0194 -0.0890 -0.1322 55GLU BB 5018 16.767 12.973 13.730 0.2171 -0.1572 -0.2187 55GLU SC1 5019 16.657 12.620 13.705 -0.1124 0.4894 -0.0282 56GLU BB 5020 16.666 13.174 13.961 -0.3302 -0.1759 -0.2260 56GLU SC1 5021 16.646 13.521 13.768 -0.0041 0.1754 0.1426 57PRO BB 5022 16.829 13.303 14.240 0.3220 -0.1608 0.1373 57PRO SC1 5023 16.890 13.602 14.172 -0.6835 0.0919 0.1601 58LYS BB 5024 17.056 13.115 14.315 -0.0334 0.1203 -0.3244 58LYS SC1 5025 17.171 13.042 14.027 0.0418 -0.4399 0.3876 58LYS SC2 5026 17.113 13.365 13.860 0.3924 -0.2890 -0.2584 59GLU BB 5027 16.980 13.008 14.670 0.1631 -0.1604 -0.1013 59GLU SC1 5028 16.850 12.660 14.579 0.0731 0.1187 -0.0201 60GLU BB 5029 16.703 13.109 14.834 -0.0302 0.0845 0.0182 60GLU SC1 5030 16.500 13.206 14.526 -0.1864 0.1468 -0.3586 61GLU BB 5031 16.734 13.428 14.975 -0.2448 0.0334 -0.1505 61GLU SC1 5032 17.142 13.332 15.061 0.0385 -0.0237 -0.1312 30.00000 30.00000 30.00000