Title of the system in water 5032 1LYS BB 1 11.352 9.625 13.584 0.2137 -0.1376 -0.4403 1LYS SC1 2 11.588 9.425 13.721 -0.1348 -0.0987 -0.0076 1LYS SC2 3 11.448 9.241 13.925 -0.1858 0.0694 -0.6557 2LYS BB 4 11.172 9.786 13.851 0.0292 -0.2528 -0.1263 2LYS SC1 5 11.348 9.908 14.066 0.4319 0.1727 -0.2172 2LYS SC2 6 11.519 10.171 14.239 -0.3210 -0.3668 -0.1451 3CYS BB 7 10.864 9.694 14.036 0.2524 -0.0167 0.1977 3CYS SC1 8 11.014 9.846 14.267 -0.3087 -0.1841 0.1211 4LEU BB 9 10.494 9.819 13.895 -0.1001 -0.0744 0.0877 4LEU SC1 10 10.681 10.122 13.833 0.1116 -0.1484 -0.1789 5PHE BB 11 10.282 9.878 13.607 0.0568 0.0056 -0.1090 5PHE SC1 12 10.033 9.879 13.756 -0.1834 -0.3135 0.2612 5PHE SC2 13 9.757 9.938 13.946 -0.2565 0.3654 -0.0290 5PHE SC3 14 9.822 10.146 13.754 0.3446 0.1227 -0.1096 6LYS BB 15 10.232 9.595 13.456 0.1788 0.1463 0.1331 6LYS SC1 16 10.521 9.583 13.253 0.3208 -0.2396 -0.1645 6LYS SC2 17 10.802 9.523 13.110 0.0595 -0.3043 0.2046 7LYS BB 18 10.114 9.340 13.504 0.1229 -0.2037 -0.1707 7LYS SC1 19 9.867 9.348 13.323 0.0199 -0.3020 -0.1369 7LYS SC2 20 9.681 9.223 13.104 -0.3085 0.1184 0.2785 8LYS BB 21 10.180 9.058 13.417 -0.1614 -0.0986 -0.1743 8LYS SC1 22 10.202 8.808 13.588 -0.0680 -0.6040 -0.0356 8LYS SC2 23 10.234 8.463 13.584 0.1417 0.2195 -0.1216 9ASN BB 24 10.013 8.914 13.133 0.0905 0.2877 -0.0788 9ASN SC1 25 10.046 9.017 12.849 0.0261 -0.0228 0.0962 10LYS BB 26 9.977 8.570 13.151 -0.2842 0.1230 -0.2641 10LYS SC1 27 9.732 8.509 13.007 -0.2778 0.2173 -0.3858 10LYS SC2 28 9.572 8.397 12.727 0.0056 0.3064 -0.2889 11LYS BB 29 10.237 8.372 13.049 -0.1340 0.0709 0.0942 11LYS SC1 30 10.362 8.596 12.912 0.1439 -0.0181 0.1298 11LYS SC2 31 10.427 8.735 12.613 -0.3439 0.0309 0.4542 12LYS BB 32 10.515 8.177 13.137 -0.1812 0.2769 -0.0218 12LYS SC1 33 10.437 8.002 13.361 -0.0503 -0.0801 -0.0082 12LYS SC2 34 10.237 7.751 13.424 -0.3698 0.3299 -0.3032 13GLY BB 35 10.817 8.225 13.086 0.2030 -0.2137 -0.0238 14LYS BB 36 11.103 8.288 13.251 0.1993 0.0812 0.0538 14LYS SC1 37 11.118 8.170 13.575 0.1010 -0.1811 -0.0255 14LYS SC2 38 11.153 8.385 13.837 0.0133 0.1846 0.0905 15GLU BB 39 11.311 8.274 13.007 -0.0831 0.2031 -0.2388 15GLU SC1 40 11.205 8.252 12.697 0.0807 -0.0920 0.0176 16LYS BB 41 11.558 8.454 12.978 0.1916 -0.2059 0.0512 16LYS SC1 42 11.732 8.320 13.226 0.3035 -0.0521 -0.1521 16LYS SC2 43 11.877 7.992 13.219 0.4618 -0.2358 -0.1181 17GLY BB 44 11.382 8.712 13.087 -0.0261 -0.1719 -0.1692 18GLY BB 45 11.262 8.719 12.775 0.0920 0.1523 0.4781 19LYS BB 46 11.403 8.691 12.485 0.4204 0.1941 0.0922 19LYS SC1 47 11.658 8.811 12.595 -0.0207 -0.3136 0.0602 19LYS SC2 48 11.755 8.877 12.918 -0.2998 -0.0217 -0.4299 20ASN BB 49 11.305 8.431 12.251 0.2383 -0.4347 -0.1647 20ASN SC1 50 11.038 8.302 12.111 0.0260 0.1948 0.4109 21ALA BB 51 11.613 8.422 12.115 0.0706 -0.3257 0.0199 21ALA SC1 52 11.526 8.203 11.983 0.3042 -0.5383 0.2098 22ILE BB 53 11.907 8.439 12.270 0.0511 -0.2889 -0.3253 22ILE SC1 54 11.799 8.294 12.559 0.2365 0.1054 -0.0481 23ASN BB 55 12.204 8.253 12.386 0.1145 0.0848 0.1868 23ASN SC1 56 12.509 8.386 12.347 -0.0459 -0.4837 -0.1087 24MET BB 57 12.247 7.934 12.268 -0.1114 -0.2378 -0.1713 24MET SC1 58 11.994 8.035 11.999 0.2210 -0.2764 -0.0434 25LYS BB 59 12.470 7.652 12.292 0.0833 -0.3586 0.0010 25LYS SC1 60 12.263 7.365 12.370 0.0098 -0.1786 -0.0271 25LYS SC2 61 12.042 7.133 12.348 -0.3125 -0.1888 0.0290 26ASP BB 62 12.720 7.535 12.477 -0.2232 0.1981 -0.2342 26ASP SC1 63 12.964 7.794 12.431 -0.0745 -0.1115 0.0125 27VAL BB 64 12.958 7.269 12.435 0.0135 0.0962 -0.2102 27VAL SC1 65 12.828 7.206 12.181 0.1384 -0.1365 -0.2187 28LYS BB 66 13.184 7.100 12.585 -0.0924 -0.1645 0.1735 28LYS SC1 67 13.224 6.843 12.364 -0.2353 -0.1650 0.2103 28LYS SC2 68 13.355 6.644 12.133 -0.1520 0.1640 -0.1188 29ASP BB 69 13.487 7.135 12.834 0.1393 -0.0192 0.1668 29ASP SC1 70 13.318 7.214 13.107 -0.2487 0.1093 0.0184 30LEU BB 71 13.786 7.224 12.711 0.0163 0.1240 -0.2685 30LEU SC1 72 13.747 7.559 12.586 -0.1442 -0.2493 0.0691 31GLY BB 73 14.001 7.293 12.974 -0.1685 -0.2834 0.1532 32LYS BB 74 14.141 7.626 12.893 0.0551 -0.2513 0.0860 32LYS SC1 75 14.435 7.569 12.831 -0.1608 -0.1980 0.0149 32LYS SC2 76 14.760 7.510 12.772 0.0393 0.0947 0.1278 33THR BB 77 13.873 7.837 12.928 0.0245 0.2253 -0.2566 33THR SC1 78 13.600 7.730 13.010 0.0928 0.1837 -0.0783 34MET BB 79 13.880 8.143 13.081 -0.0290 0.2850 -0.1054 34MET SC1 80 14.215 8.191 12.862 -0.2336 0.2278 -0.1651 35LYS BB 81 13.627 8.274 12.948 0.0555 -0.0052 -0.0781 35LYS SC1 82 13.783 8.397 12.704 0.2155 0.0495 -0.0885 35LYS SC2 83 13.794 8.258 12.378 0.1285 -0.1364 0.1350 36ASP BB 84 13.395 8.464 13.056 -0.0742 0.0341 -0.1678 36ASP SC1 85 13.646 8.627 13.252 0.4728 -0.3584 0.0242 37GLN BB 86 13.205 8.511 13.296 -0.0285 0.2460 0.2867 37GLN SC1 87 12.968 8.186 13.319 0.0220 0.1508 -0.2301 38ALA BB 88 13.144 8.763 13.485 0.0122 0.1349 0.0867 38ALA SC1 89 13.067 8.722 13.740 0.3863 0.0787 0.1972 39LEU BB 90 12.860 8.876 13.451 0.0496 0.3238 -0.3780 39LEU SC1 91 12.955 9.187 13.628 -0.1683 0.3133 -0.0895 40LYS BB 92 12.684 8.595 13.481 0.3295 0.0686 -0.1872 40LYS SC1 93 12.363 8.694 13.578 0.3048 -0.0133 0.2475 40LYS SC2 94 12.153 8.925 13.712 0.2145 -0.2391 -0.2732 41ASP BB 95 12.496 8.494 13.211 -0.1303 -0.1959 -0.0987 41ASP SC1 96 12.462 8.174 13.098 0.3064 0.0814 -0.1326 42ASP BB 97 12.428 8.770 13.072 0.1077 -0.0861 0.2861 42ASP SC1 98 12.593 8.746 12.771 -0.0138 0.2586 -0.0716 43ASP BB 99 12.273 8.978 13.204 -0.0139 0.0319 -0.0027 43ASP SC1 100 12.088 9.145 12.987 0.1402 -0.0320 0.3251 44ALA BB 101 12.501 9.124 13.418 -0.2434 -0.1099 -0.2473 44ALA SC1 102 12.694 9.223 13.257 -0.1054 -0.0505 -0.0494 45GLU BB 103 12.435 9.262 13.667 -0.1752 -0.1465 -0.1784 45GLU SC1 104 12.286 9.606 13.694 0.3423 -0.1675 -0.1963 46THR BB 105 12.501 9.192 14.002 -0.0938 -0.1721 -0.0389 46THR SC1 106 12.645 8.948 13.889 -0.2077 -0.0446 -0.4793 47GLY BB 107 12.260 9.042 14.152 -0.0633 0.1355 0.0197 48LEU BB 108 12.270 8.902 14.430 -0.3389 -0.0333 0.2644 48LEU SC1 109 12.107 8.600 14.272 -0.0216 0.2442 0.3637 49THR BB 110 12.363 9.063 14.682 0.3872 0.2850 -0.1610 49THR SC1 111 12.455 8.965 14.955 0.0848 -0.1614 -0.2077 50ASP BB 112 12.374 9.374 14.742 0.0871 -0.0068 -0.1967 50ASP SC1 113 12.595 9.506 14.484 -0.0625 0.0677 0.1984 51GLY BB 114 12.144 9.574 14.709 -0.0838 0.2218 -0.4267 52GLU BB 115 11.824 9.511 14.744 -0.4259 -0.3785 0.1028 52GLU SC1 116 11.824 9.815 14.961 -0.3341 0.2812 0.0839 53GLU BB 117 11.593 9.289 14.586 0.1395 0.0560 0.1486 53GLU SC1 118 11.670 9.504 14.233 0.1130 0.0448 0.1776 54LYS BB 119 11.319 9.310 14.742 -0.0058 -0.0268 -0.0638 54LYS SC1 120 11.044 9.524 14.682 0.3045 -0.0466 -0.1585 54LYS SC2 121 10.788 9.584 14.441 -0.0352 0.0514 0.1126 55GLU BB 122 11.087 9.109 14.661 -0.2357 0.1273 -0.2673 55GLU SC1 123 11.280 8.960 14.350 -0.2476 0.3125 -0.3195 56GLU BB 124 10.773 9.070 14.577 -0.2929 -0.3679 0.0845 56GLU SC1 125 10.836 9.101 14.190 0.1460 -0.0269 0.1173 57PRO BB 126 10.652 8.815 14.770 0.1997 0.2263 0.1628 57PRO SC1 127 10.827 8.823 15.024 0.3625 -0.0551 0.1481 58LYS BB 128 10.525 8.527 14.748 -0.1145 -0.4521 -0.2014 58LYS SC1 129 10.310 8.490 14.946 0.2023 0.0567 -0.1157 58LYS SC2 130 9.944 8.521 14.930 0.0708 -0.4282 0.1295 59GLU BB 131 10.528 8.359 14.503 0.0391 -0.3225 -0.3483 59GLU SC1 132 10.725 8.078 14.429 -0.2633 -0.1765 -0.1587 60GLU BB 133 10.233 8.408 14.318 -0.1294 -0.0613 -0.0752 60GLU SC1 134 10.519 8.406 14.001 0.0549 -0.0841 0.2619 61GLU BB 135 10.005 8.607 14.457 -0.2984 -0.3427 0.1782 61GLU SC1 136 10.227 8.894 14.562 0.1037 0.2956 0.0218 1LYS BB 137 21.757 6.686 7.338 -0.0890 0.0624 0.0403 1LYS SC1 138 21.631 6.655 7.050 0.0502 -0.1716 0.1293 1LYS SC2 139 21.515 6.808 6.735 -0.1306 0.3663 0.3245 2LYS BB 140 21.596 6.435 7.510 0.0644 0.3790 0.0001 2LYS SC1 141 21.707 6.153 7.410 0.0853 -0.3270 -0.4560 2LYS SC2 142 21.796 5.911 7.185 0.3567 -0.0470 0.0891 3CYS BB 143 21.552 6.354 7.848 -0.1974 -0.0799 -0.2728 3CYS SC1 144 21.380 6.120 7.666 0.0582 -0.0940 -0.2762 4LEU BB 145 21.481 6.509 8.137 0.1053 -0.0567 -0.0271 4LEU SC1 146 21.191 6.718 8.052 -0.3466 0.3420 0.2318 5PHE BB 147 21.696 6.476 8.462 0.2105 -0.0659 -0.1018 5PHE SC1 148 21.621 6.730 8.621 -0.3313 -0.1639 -0.3714 5PHE SC2 149 21.474 7.000 8.475 -0.4552 -0.0633 -0.0676 5PHE SC3 150 21.429 6.974 8.760 0.5064 0.2436 0.1490 6LYS BB 151 21.805 6.286 8.669 -0.0202 -0.2042 -0.0870 6LYS SC1 152 21.784 6.440 8.958 0.5497 0.1707 -0.1419 6LYS SC2 153 21.868 6.480 9.251 -0.0707 -0.0284 0.3102 7LYS BB 154 21.911 5.941 8.665 0.0241 -0.1662 0.2307 7LYS SC1 155 22.102 5.969 8.443 0.3412 0.0245 0.0066 7LYS SC2 156 22.422 5.989 8.224 0.0649 -0.4188 0.3235 8LYS BB 157 21.711 5.694 8.754 0.1368 0.1331 -0.3336 8LYS SC1 158 21.788 5.431 8.895 -0.2924 0.1656 -0.0095 8LYS SC2 159 21.868 5.099 8.788 -0.0316 -0.2655 0.0460 9ASN BB 160 21.473 5.552 8.594 0.0279 -0.3314 0.0816 9ASN SC1 161 21.376 5.362 8.832 -0.1380 0.0060 0.0828 10LYS BB 162 21.269 5.735 8.488 -0.2790 0.1816 -0.0286 10LYS SC1 163 21.174 5.571 8.208 0.1897 -0.2773 0.0481 10LYS SC2 164 21.302 5.274 8.205 0.6027 0.1043 0.2445 11LYS BB 165 21.034 5.813 8.672 -0.2732 0.3721 -0.0246 11LYS SC1 166 20.838 5.665 8.502 0.0182 0.0206 -0.0742 11LYS SC2 167 20.520 5.620 8.337 0.1059 -0.0239 0.0606 12LYS BB 168 20.987 6.001 8.901 0.2160 -0.1729 -0.1811 12LYS SC1 169 20.895 6.260 8.818 -0.1235 -0.1018 0.2395 12LYS SC2 170 20.814 6.560 8.757 0.0048 -0.0811 -0.0826 13GLY BB 171 21.152 6.053 9.122 0.3523 0.1549 -0.0448 14LYS BB 172 21.209 5.837 9.364 0.0761 0.0116 -0.1967 14LYS SC1 173 21.487 5.865 9.558 0.2126 -0.3042 0.0670 14LYS SC2 174 21.559 5.886 9.926 0.2239 0.3986 0.4582 15GLU BB 175 21.034 5.531 9.246 0.0662 -0.2782 -0.0793 15GLU SC1 176 21.127 5.204 9.383 0.2608 -0.0828 -0.1791 16LYS BB 177 20.740 5.618 9.094 -0.1132 0.3941 -0.0651 16LYS SC1 178 20.572 5.710 9.311 0.1789 -0.1055 -0.3874 16LYS SC2 179 20.264 5.864 9.228 -0.0808 0.0289 -0.1534 17GLY BB 180 20.602 5.582 8.794 -0.1404 -0.1661 0.2657 18GLY BB 181 20.336 5.496 8.752 0.1346 -0.3198 0.1175 19LYS BB 182 20.434 5.201 8.551 -0.2468 -0.1653 0.1669 19LYS SC1 183 20.540 5.131 8.848 0.0503 -0.1136 -0.1839 19LYS SC2 184 20.715 5.150 9.122 -0.2548 0.1071 -0.3257 20ASN BB 185 20.215 5.262 8.292 -0.2022 0.1798 0.0235 20ASN SC1 186 20.021 5.566 8.345 0.0870 -0.0087 0.1511 21ALA BB 187 19.984 5.022 8.438 -0.0109 0.1047 -0.2395 21ALA SC1 188 19.734 5.083 8.519 -0.0077 -0.3404 0.1537 22ILE BB 189 19.899 4.741 8.192 -0.0739 0.1536 0.0082 22ILE SC1 190 20.090 4.924 7.977 -0.2525 0.0372 -0.2540 23ASN BB 191 19.591 4.794 8.037 -0.0961 -0.2314 0.2069 23ASN SC1 192 19.397 4.663 8.321 -0.1270 0.0098 -0.4636 24MET BB 193 19.543 4.968 7.700 -0.1342 0.2399 -0.2850 24MET SC1 194 19.805 4.709 7.570 0.0867 0.0734 -0.3478 25LYS BB 195 19.395 5.270 7.722 -0.1561 0.2456 0.1308 25LYS SC1 196 19.241 5.361 7.995 -0.1322 0.5176 -0.1108 25LYS SC2 197 19.236 5.554 8.245 0.0164 -0.1920 0.5314 26ASP BB 198 19.151 5.158 7.485 -0.0035 -0.0134 -0.0927 26ASP SC1 199 18.956 5.337 7.272 -0.0310 -0.0967 0.1166 27VAL BB 200 18.965 4.898 7.482 -0.0515 0.1983 -0.0384 27VAL SC1 201 18.743 4.957 7.663 -0.2833 -0.7336 0.0377 28LYS BB 202 18.973 4.603 7.302 0.1103 -0.1930 0.0596 28LYS SC1 203 18.707 4.437 7.371 0.1031 -0.1414 0.1288 28LYS SC2 204 18.547 4.235 7.574 0.2091 0.0570 0.1641 29ASP BB 205 18.925 4.605 6.979 0.2958 0.1165 0.1592 29ASP SC1 206 18.759 4.823 6.809 0.1048 0.0732 -0.2036 30LEU BB 207 19.199 4.640 6.785 -0.2454 0.2217 0.2613 30LEU SC1 208 19.105 4.332 6.592 0.0800 -0.1594 -0.0293 31GLY BB 209 19.219 4.917 6.714 -0.1200 -0.1123 0.1640 32LYS BB 210 19.363 5.210 6.846 -0.2666 0.0806 -0.0122 32LYS SC1 211 19.467 5.378 6.626 -0.2676 0.2751 -0.2822 32LYS SC2 212 19.415 5.150 6.385 -0.2757 0.0642 -0.0767 33THR BB 213 19.470 5.379 7.125 0.0180 -0.0483 -0.2573 33THR SC1 214 19.599 5.172 7.309 0.0291 0.0684 -0.1319 34MET BB 215 19.441 5.630 7.321 -0.2092 0.1689 0.2422 34MET SC1 216 19.395 6.017 7.241 0.2668 0.1262 -0.2302 35LYS BB 217 19.681 5.621 7.549 0.0627 0.1515 -0.0167 35LYS SC1 218 19.677 5.947 7.614 0.1870 -0.1395 0.2545 35LYS SC2 219 19.513 6.127 7.872 -0.1554 -0.1359 -0.1106 36ASP BB 220 19.885 5.458 7.649 0.0538 0.4856 0.1113 36ASP SC1 221 20.083 5.559 7.878 0.0003 -0.1049 -0.1946 37GLN BB 222 20.050 5.188 7.550 0.1010 -0.0319 -0.0984 37GLN SC1 223 20.400 5.212 7.737 0.2372 -0.0190 -0.3506 38ALA BB 224 20.110 5.136 7.199 -0.0781 -0.0271 -0.0807 38ALA SC1 225 20.371 5.187 7.248 -0.0848 -0.0994 0.0344 39LEU BB 226 19.982 4.891 7.102 0.1282 -0.2585 0.1511 39LEU SC1 227 20.105 4.599 7.282 0.2813 -0.0978 -0.1543 40LYS BB 228 19.747 4.807 6.865 -0.0282 -0.0614 0.0613 40LYS SC1 229 19.675 4.511 6.933 0.3989 0.3286 0.1447 40LYS SC2 230 19.559 4.287 6.718 -0.1770 0.3985 -0.3046 41ASP BB 231 19.782 4.992 6.631 -0.0348 0.1492 0.1754 41ASP SC1 232 19.843 5.260 6.857 0.1220 0.4117 -0.0078 42ASP BB 233 19.802 4.978 6.351 0.0321 -0.1792 0.0888 42ASP SC1 234 19.765 5.184 6.051 0.0652 -0.3130 0.2240 43ASP BB 235 19.908 4.683 6.184 -0.1964 0.2208 -0.0719 43ASP SC1 236 19.879 4.520 6.481 -0.3334 -0.3933 0.2646 44ALA BB 237 20.188 4.723 5.979 0.0801 -0.2459 0.2688 44ALA SC1 238 20.242 4.934 5.819 -0.2282 0.1087 0.6111 45GLU BB 239 20.487 4.758 6.136 -0.2063 -0.2665 0.0673 45GLU SC1 240 20.583 4.548 5.841 -0.1404 -0.1900 0.0213 46THR BB 241 20.595 4.967 6.391 0.0495 0.0330 0.1539 46THR SC1 242 20.598 4.745 6.600 0.0529 -0.0136 0.1045 47GLY BB 243 20.599 5.262 6.507 0.2223 -0.4055 -0.1238 48LEU BB 244 20.638 5.557 6.406 -0.3591 -0.0678 0.1662 48LEU SC1 245 20.248 5.632 6.417 -0.2182 -0.2311 -0.0456 49THR BB 246 20.918 5.734 6.262 -0.0630 -0.2442 -0.0196 49THR SC1 247 20.892 5.742 5.958 0.1942 -0.1236 -0.0410 50ASP BB 248 20.886 6.052 6.370 -0.0014 -0.3462 -0.0870 50ASP SC1 249 20.690 6.193 6.140 -0.1863 -0.0301 0.1110 51GLY BB 250 20.983 6.319 6.560 0.1959 -0.1341 0.1742 52GLU BB 251 20.944 6.418 6.817 0.1488 -0.2986 0.0734 52GLU SC1 252 21.156 6.607 7.036 -0.0175 0.0149 -0.2391 53GLU BB 253 20.630 6.478 7.014 -0.0753 -0.0596 0.2518 53GLU SC1 254 20.679 6.844 6.844 0.2820 -0.1926 0.0508 54LYS BB 255 20.629 6.513 7.358 -0.0102 0.2095 0.0963 54LYS SC1 256 20.439 6.795 7.366 0.0086 0.0125 -0.1753 54LYS SC2 257 20.161 7.005 7.420 -0.1751 0.1733 0.3059 55GLU BB 258 20.702 6.262 7.574 -0.0630 0.1967 -0.4801 55GLU SC1 259 20.552 6.255 7.932 -0.1045 0.1162 -0.2008 56GLU BB 260 20.606 5.991 7.455 -0.1216 -0.0452 -0.1687 56GLU SC1 261 20.425 6.042 7.126 0.1548 0.1979 -0.2852 57PRO BB 262 20.803 5.845 7.369 0.0412 -0.0325 0.2171 57PRO SC1 263 20.712 5.550 7.434 -0.1406 0.1966 -0.3064 58LYS BB 264 21.109 5.892 7.433 0.0351 0.1978 -0.1417 58LYS SC1 265 21.022 5.973 7.690 -0.0080 0.0518 -0.0071 58LYS SC2 266 21.061 6.268 7.922 -0.0586 -0.0421 0.0019 59GLU BB 267 21.425 5.728 7.438 0.1164 0.1468 -0.0472 59GLU SC1 268 21.376 5.655 7.045 0.0251 -0.3713 0.2242 60GLU BB 269 21.479 5.497 7.666 -0.0909 0.0263 -0.1515 60GLU SC1 270 21.266 5.164 7.756 0.1184 -0.0161 -0.1306 61GLU BB 271 21.668 5.448 7.934 0.4427 0.0383 -0.4099 61GLU SC1 272 21.749 5.711 8.219 0.0254 0.1351 -0.1018 1LYS BB 273 19.268 5.733 0.324 -0.1222 0.1067 0.0253 1LYS SC1 274 19.168 5.710 0.016 0.1944 -0.3891 -0.1789 1LYS SC2 275 18.861 5.759 -0.182 -0.2108 -0.2258 0.0247 2LYS BB 276 19.188 5.464 0.536 0.0511 -0.2201 0.3380 2LYS SC1 277 18.992 5.240 0.465 0.3179 0.2294 0.1302 2LYS SC2 278 18.657 5.117 0.366 -0.0349 0.1509 0.0958 3CYS BB 279 19.393 5.197 0.663 0.1774 -0.0595 0.0353 3CYS SC1 280 19.539 5.061 0.409 -0.1473 -0.6185 -0.2934 4LEU BB 281 19.619 5.400 0.766 -0.1508 -0.0621 0.2579 4LEU SC1 282 19.538 5.457 1.093 -0.0622 -0.1215 0.0484 5PHE BB 283 19.881 5.156 0.842 0.0065 -0.1503 0.0773 5PHE SC1 284 19.675 4.944 0.883 -0.0996 0.1454 -0.1045 5PHE SC2 285 19.617 4.917 1.217 0.0564 -0.0471 -0.0911 5PHE SC3 286 19.380 4.940 1.051 -0.0197 0.0904 0.0350 6LYS BB 287 20.187 5.030 0.821 0.1171 0.2408 0.1503 6LYS SC1 288 20.061 4.775 1.016 -0.1591 0.2050 -0.2578 6LYS SC2 289 20.109 4.569 1.255 -0.0293 0.1055 -0.2914 7LYS BB 290 20.406 4.993 0.561 -0.0573 0.1768 -0.0287 7LYS SC1 291 20.477 5.132 0.260 -0.0515 -0.0264 0.0515 7LYS SC2 292 20.368 5.449 0.092 -0.0728 0.0665 0.0233 8LYS BB 293 20.669 4.866 0.634 0.2305 -0.0481 0.0950 8LYS SC1 294 20.754 4.759 0.929 0.1733 -0.0831 -0.3527 8LYS SC2 295 20.779 4.377 0.918 0.1535 0.0388 -0.4723 9ASN BB 296 20.944 5.079 0.654 -0.2692 -0.0074 -0.0698 9ASN SC1 297 20.887 5.318 0.419 0.0528 -0.0979 -0.2859 10LYS BB 298 20.983 5.182 0.982 -0.1650 -0.0986 -0.0455 10LYS SC1 299 21.040 5.433 1.118 -0.1683 -0.1531 0.0904 10LYS SC2 300 20.869 5.670 0.923 -0.1443 -0.0544 -0.0691 11LYS BB 301 20.742 5.090 1.201 0.1535 0.0759 -0.3626 11LYS SC1 302 20.778 5.089 1.503 0.1118 -0.0710 -0.2215 11LYS SC2 303 20.854 5.287 1.713 -0.0473 0.0529 0.2382 12LYS BB 304 20.443 4.948 1.217 0.0317 -0.1870 -0.6918 12LYS SC1 305 20.302 5.217 1.222 -0.2885 -0.0994 0.1178 12LYS SC2 306 20.196 5.502 1.027 0.0787 0.2268 -0.1828 13GLY BB 307 20.412 4.848 1.519 0.0003 0.2403 0.1755 14LYS BB 308 20.211 4.649 1.721 -0.2128 -0.0231 -0.0417 14LYS SC1 309 20.423 4.439 1.773 0.0933 -0.2558 0.1929 14LYS SC2 310 20.763 4.515 1.788 -0.0993 0.2017 -0.0121 15GLU BB 311 20.049 4.666 1.992 -0.0327 0.0921 -0.0461 15GLU SC1 312 20.171 4.998 2.148 0.0719 -0.0631 -0.1095 16LYS BB 313 19.818 4.440 2.009 0.0048 0.1141 0.1503 16LYS SC1 314 19.576 4.505 2.061 -0.0365 -0.3260 -0.4280 16LYS SC2 315 19.389 4.779 2.023 -0.1007 -0.6272 0.1140 17GLY BB 316 19.756 4.215 1.780 0.0333 -0.3310 -0.1365 18GLY BB 317 19.553 4.245 1.571 -0.4590 -0.0497 0.1628 19LYS BB 318 19.676 4.235 1.258 0.1356 -0.1056 0.1346 19LYS SC1 319 19.495 4.018 1.078 -0.2021 -0.2511 -0.0438 19LYS SC2 320 19.322 3.852 0.843 -0.2565 0.3261 0.0941 20ASN BB 321 19.667 4.496 1.061 -0.2969 -0.0002 0.2360 20ASN SC1 322 19.879 4.282 0.894 -0.2341 -0.0643 0.2583 21ALA BB 323 19.396 4.409 0.873 0.0457 -0.3114 0.0739 21ALA SC1 324 19.277 4.520 1.089 0.3804 0.2683 -0.0178 22ILE BB 325 19.306 4.685 0.686 0.3164 -0.0826 -0.0326 22ILE SC1 326 19.506 4.627 0.415 0.4637 -0.1084 0.0806 23ASN BB 327 19.028 4.825 0.554 0.2785 0.1229 0.0956 23ASN SC1 328 18.937 5.016 0.808 0.0806 -0.4086 -0.0210 24MET BB 329 18.945 4.737 0.253 -0.0656 -0.0502 -0.1092 24MET SC1 330 19.294 4.702 0.008 0.0497 0.0929 0.1938 25LYS BB 331 18.817 4.450 0.227 -0.2558 -0.0044 0.0352 25LYS SC1 332 18.703 4.514 -0.051 -0.0947 -0.0539 -0.1637 25LYS SC2 333 18.390 4.560 -0.137 0.0516 -0.0622 -0.2511 26ASP BB 334 18.702 4.397 0.493 0.1465 -0.3477 0.0396 26ASP SC1 335 18.605 4.071 0.568 -0.0338 -0.0828 -0.0889 27VAL BB 336 18.685 4.533 0.755 0.0870 0.1908 0.0185 27VAL SC1 337 18.929 4.560 0.912 0.1699 -0.3373 -0.0008 28LYS BB 338 18.556 4.851 0.753 0.4997 -0.1815 -0.0274 28LYS SC1 339 18.396 4.847 1.026 0.0011 0.1182 0.1457 28LYS SC2 340 18.091 4.667 1.024 -0.1248 -0.2506 -0.0186 29ASP BB 341 18.311 4.913 0.557 -0.0557 0.1894 0.0682 29ASP SC1 342 18.453 4.755 0.298 -0.0376 0.1447 -0.0247 30LEU BB 343 17.987 4.912 0.604 -0.2213 -0.1224 0.2160 30LEU SC1 344 17.987 5.030 0.267 0.0300 -0.1118 0.0584 31GLY BB 345 17.769 4.654 0.689 0.0337 -0.0464 0.0175 32LYS BB 346 17.456 4.700 0.561 0.0983 -0.0818 -0.1032 32LYS SC1 347 17.540 4.963 0.377 0.1934 -0.0167 0.0171 32LYS SC2 348 17.349 5.291 0.361 -0.2335 -0.0756 0.2407 33THR BB 349 17.378 4.532 0.283 0.2580 0.1524 0.0128 33THR SC1 350 17.079 4.503 0.336 0.1963 -0.2754 -0.4787 34MET BB 351 17.605 4.661 0.061 -0.1059 0.0913 0.0962 34MET SC1 352 17.996 4.603 0.156 -0.3719 0.2070 0.0270 35LYS BB 353 17.702 4.669 -0.265 0.1383 0.1451 -0.0519 35LYS SC1 354 17.941 4.925 -0.279 -0.1517 -0.0281 0.1573 35LYS SC2 355 18.119 5.248 -0.348 0.1541 -0.2120 -0.0580 36ASP BB 356 17.466 4.838 -0.432 -0.2771 -0.0301 0.1150 36ASP SC1 357 17.176 4.720 -0.348 -0.3206 0.3819 -0.6678 37GLN BB 358 17.494 4.871 -0.719 -0.0619 -0.1698 0.2324 37GLN SC1 359 17.205 4.616 -0.818 0.0612 -0.0815 -0.0520 38ALA BB 360 17.341 5.147 -0.734 0.1304 -0.1148 0.1328 38ALA SC1 361 17.104 5.028 -0.786 0.3240 -0.5325 0.1672 39LEU BB 362 17.257 5.409 -0.905 -0.0248 0.1724 -0.1762 39LEU SC1 363 16.919 5.472 -0.848 -0.1202 0.2586 -0.5961 40LYS BB 364 17.546 5.561 -0.898 -0.3784 0.0489 -0.1394 40LYS SC1 365 17.377 5.779 -1.023 -0.1149 -0.2206 0.2042 40LYS SC2 366 17.118 5.755 -1.257 0.3685 -0.0785 0.0345 41ASP BB 367 17.880 5.442 -0.896 0.0231 -0.1837 0.2102 41ASP SC1 368 17.892 5.384 -1.216 0.0129 -0.0520 0.4477 42ASP BB 369 17.905 5.162 -0.755 0.0101 0.0746 0.0889 42ASP SC1 370 17.694 5.247 -0.494 -0.1223 -0.2212 -0.2492 43ASP BB 371 17.997 4.887 -0.908 -0.4087 0.2057 0.0617 43ASP SC1 372 17.858 4.606 -0.727 0.2877 0.0888 0.0288 44ALA BB 373 17.965 4.891 -1.224 0.0867 -0.1198 0.3266 44ALA SC1 374 18.222 4.807 -1.233 0.2975 0.4921 0.0337 45GLU BB 375 17.698 4.915 -1.394 -0.2882 -0.0411 0.0509 45GLU SC1 376 17.452 4.636 -1.544 -0.1346 0.0023 -0.1566 46THR BB 377 17.582 5.174 -1.474 -0.1157 -0.0694 -0.0213 46THR SC1 378 17.413 5.396 -1.349 -0.0773 0.0631 -0.2034 47GLY BB 379 17.759 5.253 -1.714 0.0769 0.0171 0.2286 48LEU BB 380 17.757 5.560 -1.780 0.0701 -0.2110 -0.3974 48LEU SC1 381 17.748 5.658 -2.123 0.0725 -0.0536 0.0803 49THR BB 382 17.678 5.709 -1.509 -0.0833 -0.0968 -0.2241 49THR SC1 383 17.473 5.900 -1.630 0.1286 0.0026 -0.4339 50ASP BB 384 17.803 5.850 -1.279 0.3305 0.0222 0.0136 50ASP SC1 385 17.900 5.900 -0.946 -0.1141 -0.3270 -0.1048 51GLY BB 386 17.937 6.177 -1.294 0.1554 0.4458 -0.0668 52GLU BB 387 18.205 6.214 -1.213 0.1554 0.0463 0.0828 52GLU SC1 388 18.512 6.020 -1.380 0.4215 0.0151 -0.2215 53GLU BB 389 18.248 6.244 -0.889 0.2617 0.1152 -0.0827 53GLU SC1 390 18.169 6.633 -0.928 -0.0600 0.0441 -0.1951 54LYS BB 391 18.384 6.012 -0.716 0.3368 0.1862 -0.0486 54LYS SC1 392 18.482 5.844 -0.931 -0.1220 0.0460 -0.1824 54LYS SC2 393 18.238 5.728 -1.113 0.2457 0.0733 0.0610 55GLU BB 394 18.480 5.973 -0.408 0.0520 0.2554 0.2663 55GLU SC1 395 18.773 6.175 -0.428 -0.1357 0.0397 0.3808 56GLU BB 396 18.381 5.738 -0.234 -0.2009 0.0692 -0.3343 56GLU SC1 397 18.572 5.437 -0.248 -0.0742 0.0358 0.1959 57PRO BB 398 18.373 5.745 0.104 -0.0214 0.0090 0.4626 57PRO SC1 399 18.089 5.918 0.050 0.2393 -0.3680 0.0455 58LYS BB 400 18.615 6.044 0.123 0.1031 -0.1672 0.0298 58LYS SC1 401 18.492 6.352 -0.030 -0.1592 0.1806 -0.2522 58LYS SC2 402 18.161 6.343 -0.095 -0.0659 0.2170 0.2220 59GLU BB 403 18.706 6.243 0.374 0.1887 0.1245 0.1045 59GLU SC1 404 18.499 6.608 0.345 -0.2538 0.0373 0.1327 60GLU BB 405 18.985 6.164 0.531 -0.4031 0.0367 -0.0339 60GLU SC1 406 18.865 5.852 0.689 -0.0070 0.0116 0.3322 61GLU BB 407 19.248 6.316 0.533 -0.1392 0.0444 0.1729 61GLU SC1 408 19.303 6.627 0.781 -0.2523 0.2173 -0.1533 1LYS BB 409 21.542 14.070 6.809 -0.2454 0.0041 -0.1154 1LYS SC1 410 21.608 14.403 6.925 -0.1519 0.0593 -0.5148 1LYS SC2 411 21.804 14.669 6.866 0.0353 0.1985 0.2239 2LYS BB 412 21.844 14.022 6.785 0.0590 0.1568 -0.0320 2LYS SC1 413 22.033 13.947 6.588 0.0635 -0.1654 -0.0416 2LYS SC2 414 22.029 13.894 6.219 0.3087 0.1078 0.1315 3CYS BB 415 22.053 14.220 6.994 -0.1165 0.2812 0.0294 3CYS SC1 416 22.367 14.195 6.846 0.1315 -0.3351 -0.1607 4LEU BB 417 22.113 13.991 7.222 0.1203 0.4010 0.5292 4LEU SC1 418 22.479 14.028 7.267 -0.0600 0.1336 0.2808 5PHE BB 419 22.084 13.680 7.129 -0.2039 -0.1352 -0.0945 5PHE SC1 420 22.148 13.533 6.861 0.2035 0.1415 -0.0212 5PHE SC2 421 21.887 13.553 6.645 0.0802 0.3850 0.1456 5PHE SC3 422 21.965 13.284 6.721 -0.0600 0.3078 0.0213 6LYS BB 423 21.918 13.521 7.304 0.1282 0.0604 -0.0813 6LYS SC1 424 21.794 13.251 7.110 -0.4308 -0.6732 -0.0405 6LYS SC2 425 21.523 13.074 7.140 0.1146 0.0251 -0.1672 7LYS BB 426 21.954 13.392 7.627 0.0232 0.3217 -0.1658 7LYS SC1 427 22.243 13.272 7.573 -0.1867 0.0934 0.0524 7LYS SC2 428 22.555 13.302 7.729 0.0072 0.3312 -0.3762 8LYS BB 429 21.689 13.407 7.864 -0.0716 0.0920 0.2039 8LYS SC1 430 21.785 13.482 8.107 -0.4729 -0.2665 -0.0905 8LYS SC2 431 21.733 13.654 8.441 0.2003 0.1258 -0.0774 9ASN BB 432 21.389 13.236 7.897 0.1973 -0.0377 -0.2337 9ASN SC1 433 21.296 12.904 7.869 -0.0740 0.2325 -0.0884 10LYS BB 434 21.072 13.441 7.971 0.3910 0.4264 0.0389 10LYS SC1 435 21.174 13.687 7.716 0.1774 0.2124 0.0010 10LYS SC2 436 21.313 13.993 7.599 0.3382 -0.4963 -0.4015 11LYS BB 437 20.762 13.362 7.950 0.2101 -0.1477 -0.0390 11LYS SC1 438 20.811 13.082 7.811 0.0121 -0.1876 -0.0722 11LYS SC2 439 20.895 12.730 7.844 0.1539 0.6115 0.0874 12LYS BB 440 20.634 13.415 8.225 -0.2375 0.2710 -0.0832 12LYS SC1 441 20.902 13.442 8.431 0.2435 -0.0549 0.2694 12LYS SC2 442 20.999 13.336 8.743 -0.1513 -0.2809 0.0885 13GLY BB 443 20.326 13.552 8.353 -0.1795 0.0072 0.0068 14LYS BB 444 20.041 13.673 8.225 -0.1898 0.2140 -0.0155 14LYS SC1 445 19.975 13.335 8.165 -0.0835 -0.0094 0.0976 14LYS SC2 446 19.876 13.041 8.325 -0.0039 0.2573 0.2231 15GLU BB 447 19.953 13.979 8.237 0.0247 -0.3074 0.2810 15GLU SC1 448 19.615 13.971 8.316 0.1252 -0.1812 -0.0306 16LYS BB 449 20.129 14.231 8.199 0.0541 -0.1779 -0.1067 16LYS SC1 450 20.119 14.420 8.431 0.0975 -0.2491 -0.5401 16LYS SC2 451 19.916 14.204 8.639 -0.1089 0.2266 -0.0629 17GLY BB 452 20.092 14.482 8.019 0.1328 0.2368 -0.1943 18GLY BB 453 19.849 14.729 8.000 -0.2851 0.0566 0.0738 19LYS BB 454 20.005 15.021 7.933 -0.0720 0.0183 0.0044 19LYS SC1 455 19.772 15.170 8.030 0.3834 0.0743 0.1126 19LYS SC2 456 19.472 15.362 7.858 -0.3300 0.3717 0.2794 20ASN BB 457 20.260 14.869 7.855 -0.4694 0.4581 0.0443 20ASN SC1 458 20.226 15.026 7.527 0.1992 0.1981 0.0440 21ALA BB 459 20.524 14.702 7.996 -0.1053 -0.3135 -0.0916 21ALA SC1 460 20.523 14.598 8.245 0.3363 -0.0013 0.0504 22ILE BB 461 20.898 14.645 7.928 0.1297 -0.2454 -0.3525 22ILE SC1 462 20.823 14.465 7.649 -0.1582 -0.3853 -0.1899 23ASN BB 463 21.075 14.931 7.772 0.1132 0.0599 0.0686 23ASN SC1 464 21.059 14.785 7.458 0.0918 -0.2340 0.5205 24MET BB 465 21.404 14.986 7.775 0.0734 0.2012 -0.2047 24MET SC1 466 21.372 15.308 7.892 -0.2575 -0.2233 0.0491 25LYS BB 467 21.595 14.853 7.594 -0.2514 -0.0939 -0.1649 25LYS SC1 468 21.773 14.733 7.866 0.1039 -0.2028 0.0060 25LYS SC2 469 21.765 14.655 8.198 -0.0782 0.2848 0.1635 26ASP BB 470 21.517 14.797 7.277 0.2955 0.0973 0.2371 26ASP SC1 471 21.723 15.038 7.134 0.2482 -0.2122 0.0758 27VAL BB 472 21.329 14.589 7.153 0.5142 0.0153 -0.1080 27VAL SC1 473 21.284 14.312 7.234 0.0487 0.1433 0.1067 28LYS BB 474 21.182 14.730 6.887 0.1650 -0.0740 -0.2061 28LYS SC1 475 21.117 14.385 6.834 -0.0319 0.0320 0.2327 28LYS SC2 476 20.844 14.158 6.927 -0.1968 -0.1773 0.2972 29ASP BB 477 21.417 14.869 6.694 -0.2968 0.1039 0.0616 29ASP SC1 478 21.483 14.596 6.492 0.0521 -0.0651 0.4221 30LEU BB 479 21.269 15.050 6.479 -0.1836 0.2880 -0.0832 30LEU SC1 480 21.506 15.048 6.190 0.3064 0.2576 0.3095 31GLY BB 481 21.374 15.377 6.400 0.2092 -0.0647 0.0862 32LYS BB 482 21.194 15.413 6.128 -0.1783 -0.1043 0.2002 32LYS SC1 483 21.480 15.479 5.950 -0.1377 -0.0379 -0.3085 32LYS SC2 484 21.691 15.810 5.979 0.0322 0.0589 -0.0393 33THR BB 485 20.876 15.527 6.038 -0.3317 0.1683 -0.0986 33THR SC1 486 20.754 15.265 5.941 -0.2429 0.0888 0.0029 34MET BB 487 20.691 15.678 6.284 0.1912 0.0909 -0.1539 34MET SC1 488 20.310 15.517 6.122 0.0045 0.2109 -0.1714 35LYS BB 489 20.537 15.658 6.628 0.2568 -0.0141 0.5567 35LYS SC1 490 20.718 15.860 6.742 0.1608 -0.6025 -0.2048 35LYS SC2 491 20.982 15.896 6.899 0.0940 0.2276 -0.3207 36ASP BB 492 20.185 15.666 6.575 -0.1210 -0.1748 0.0843 36ASP SC1 493 20.176 15.920 6.375 -0.3478 -0.2225 -0.0444 37GLN BB 494 20.079 15.885 6.824 -0.3602 -0.3018 0.4099 37GLN SC1 495 20.283 16.162 6.737 0.1027 0.0396 -0.0719 38ALA BB 496 20.035 15.778 7.167 -0.0259 0.3532 0.1240 38ALA SC1 497 19.769 15.795 7.210 -0.0996 -0.0330 -0.1336 39LEU BB 498 20.101 15.429 7.048 0.1811 -0.2088 -0.0048 39LEU SC1 499 19.779 15.363 7.049 -0.1989 -0.2504 0.2713 40LYS BB 500 20.345 15.288 6.895 -0.1925 0.0179 0.1306 40LYS SC1 501 20.387 15.220 6.531 0.2275 -0.1694 -0.3835 40LYS SC2 502 20.209 15.073 6.257 -0.2168 0.1006 0.0302 41ASP BB 503 20.513 15.033 6.952 0.1284 -0.2606 0.3620 41ASP SC1 504 20.842 14.995 7.067 0.1428 -0.1175 -0.4838 42ASP BB 505 20.540 14.820 6.696 -0.0513 -0.2694 -0.1841 42ASP SC1 506 20.516 14.737 6.327 -0.0874 0.4545 -0.1105 43ASP BB 507 20.212 14.801 6.655 0.1172 0.1883 0.1434 43ASP SC1 508 20.191 14.469 6.805 0.0935 0.1554 -0.2284 44ALA BB 509 20.082 14.648 6.388 0.1339 -0.0842 0.5032 44ALA SC1 510 19.859 14.799 6.372 0.2579 0.0618 -0.1202 45GLU BB 511 19.872 14.426 6.371 0.2289 -0.4557 0.1549 45GLU SC1 512 19.550 14.453 6.108 -0.2955 0.0850 -0.0325 46THR BB 513 19.756 14.422 6.623 0.1973 0.0071 -0.3493 46THR SC1 514 19.759 14.698 6.753 -0.2087 -0.1904 0.1081 47GLY BB 515 19.636 14.260 6.911 0.3074 -0.2556 -0.2282 48LEU BB 516 19.836 14.049 6.979 -0.1206 0.1076 -0.2732 48LEU SC1 517 19.574 13.826 7.047 -0.1886 -0.1472 -0.2206 49THR BB 518 20.082 14.111 7.044 -0.0872 -0.2493 0.0036 49THR SC1 519 20.139 14.052 7.338 0.1219 -0.2315 -0.0324 50ASP BB 520 20.347 14.033 6.953 0.0788 0.1299 0.4484 50ASP SC1 521 20.520 14.168 7.223 -0.5188 0.0835 -0.0978 51GLY BB 522 20.487 13.869 6.688 -0.2927 0.1229 -0.0984 52GLU BB 523 20.443 13.821 6.383 -0.2069 0.1460 -0.0603 52GLU SC1 524 20.799 13.932 6.206 0.0448 0.1177 -0.3004 53GLU BB 525 20.127 13.888 6.238 -0.1333 0.2571 0.0401 53GLU SC1 526 19.914 13.786 6.551 0.1094 0.1651 -0.2675 54LYS BB 527 20.031 13.628 6.074 0.0551 -0.1687 -0.1272 54LYS SC1 528 19.855 13.436 6.222 -0.0022 0.4339 -0.2248 54LYS SC2 529 19.542 13.519 6.386 0.2464 0.2867 -0.0676 55GLU BB 530 19.912 13.662 5.744 -0.1485 0.0376 -0.1643 55GLU SC1 531 19.527 13.647 5.870 -0.3663 -0.0365 0.3888 56GLU BB 532 19.978 13.384 5.545 -0.2014 -0.1845 0.2453 56GLU SC1 533 19.770 13.591 5.253 0.0804 0.3853 0.0121 57PRO BB 534 20.229 13.388 5.390 -0.5158 -0.1779 -0.0373 57PRO SC1 535 20.372 13.154 5.567 -0.0390 0.3803 -0.0305 58LYS BB 536 20.486 13.613 5.481 0.0858 0.0537 0.0172 58LYS SC1 537 20.375 13.512 5.777 0.1384 0.0544 -0.1273 58LYS SC2 538 20.502 13.477 6.099 0.2174 -0.3397 0.0699 59GLU BB 539 20.719 13.666 5.278 -0.0708 0.2839 0.1573 59GLU SC1 540 21.025 13.397 5.352 0.0893 -0.2635 0.0999 60GLU BB 541 20.673 13.795 4.961 0.1026 -0.2120 -0.0754 60GLU SC1 542 20.514 13.464 4.770 0.0905 0.1683 0.0556 61GLU BB 543 20.435 14.011 4.935 0.1796 0.1812 0.2191 61GLU SC1 544 20.423 14.299 5.154 -0.0423 -0.0028 -0.1582 1LYS BB 545 7.858 7.538 19.053 0.2174 -0.0701 -0.0622 1LYS SC1 546 7.619 7.766 19.025 0.1463 0.3297 -0.3397 1LYS SC2 547 7.460 8.078 18.969 -0.2361 -0.2947 -0.0878 2LYS BB 548 7.740 7.357 19.363 -0.0144 -0.1024 -0.0562 2LYS SC1 549 7.640 7.122 19.222 0.1904 -0.4105 0.3923 2LYS SC2 550 7.481 6.781 19.143 0.2504 -0.0697 0.3132 3CYS BB 551 7.940 7.185 19.610 0.0281 -0.0967 -0.1201 3CYS SC1 552 8.211 7.359 19.781 -0.1723 -0.5115 0.2684 4LEU BB 553 7.796 7.075 19.891 -0.2903 0.2903 -0.2614 4LEU SC1 554 7.612 6.829 19.779 -0.2272 0.3170 0.1432 5PHE BB 555 7.863 6.853 20.164 -0.4784 -0.1099 -0.0994 5PHE SC1 556 7.588 6.707 20.230 -0.1316 0.1667 0.4266 5PHE SC2 557 7.373 6.471 20.348 0.1256 -0.3265 -0.0424 5PHE SC3 558 7.651 6.429 20.416 0.1422 0.0250 0.1321 6LYS BB 559 8.022 6.842 20.432 0.1879 0.3907 -0.2055 6LYS SC1 560 8.329 6.884 20.464 -0.3879 0.0864 0.3624 6LYS SC2 561 8.412 6.631 20.705 0.0844 -0.0383 0.2055 7LYS BB 562 7.872 7.112 20.603 0.2015 -0.0683 -0.2604 7LYS SC1 563 7.666 7.263 20.374 -0.3775 0.4843 -0.0327 7LYS SC2 564 7.926 7.407 20.192 -0.0845 0.2514 -0.0931 8LYS BB 565 7.858 7.224 20.914 0.0391 0.0523 0.0313 8LYS SC1 566 7.674 7.432 20.830 -0.2770 0.1263 -0.0513 8LYS SC2 567 7.722 7.747 20.932 -0.3127 0.2468 0.0169 9ASN BB 568 8.002 7.237 21.169 0.0666 0.1990 0.1148 9ASN SC1 569 7.949 7.600 21.265 -0.0812 0.2343 -0.2056 10LYS BB 570 7.962 7.134 21.472 0.1267 0.0038 -0.2195 10LYS SC1 571 7.915 6.860 21.384 0.0121 -0.1936 -0.2960 10LYS SC2 572 7.949 6.520 21.442 0.0705 0.2127 -0.1411 11LYS BB 573 7.866 7.302 21.717 -0.0736 0.1749 0.1823 11LYS SC1 574 8.111 7.494 21.665 0.1062 -0.3339 0.1014 11LYS SC2 575 8.453 7.544 21.646 -0.0456 -0.2390 -0.0066 12LYS BB 576 7.569 7.416 21.689 0.1979 0.0440 0.0992 12LYS SC1 577 7.428 7.261 21.880 0.2179 -0.1690 -0.0853 12LYS SC2 578 7.123 7.144 22.074 -0.5310 -0.2704 0.0411 13GLY BB 579 7.467 7.622 21.461 -0.3088 0.1309 0.1047 14LYS BB 580 7.432 7.497 21.181 0.1163 -0.0387 0.0440 14LYS SC1 581 7.235 7.724 21.084 -0.4815 -0.6358 -0.3550 14LYS SC2 582 7.182 7.704 20.735 -0.6976 0.0094 0.0546 15GLU BB 583 7.285 7.219 21.272 -0.2048 0.1820 -0.0028 15GLU SC1 584 7.526 6.966 21.108 -0.1009 0.4412 -0.0076 16LYS BB 585 7.023 7.062 21.214 0.0490 0.0611 0.1238 16LYS SC1 586 6.813 7.219 21.390 0.0821 -0.3730 -0.3218 16LYS SC2 587 6.681 7.501 21.472 -0.0519 -0.3773 0.0056 17GLY BB 588 6.796 7.062 20.974 -0.2010 -0.1199 -0.1759 18GLY BB 589 6.510 7.075 21.068 -0.2442 -0.0584 0.1387 19LYS BB 590 6.410 7.370 21.024 0.2167 0.2821 0.2019 19LYS SC1 591 6.103 7.348 21.110 0.1788 0.2509 -0.1242 19LYS SC2 592 5.747 7.246 20.929 -0.2734 -0.2342 0.3162 20ASN BB 593 6.351 7.685 21.243 0.0422 0.0466 -0.2651 20ASN SC1 594 6.581 7.951 21.333 0.0034 0.2408 -0.2190 21ALA BB 595 6.123 7.918 21.153 0.0476 0.4631 0.1033 21ALA SC1 596 5.911 7.947 21.318 0.2864 0.0268 0.5105 22ILE BB 597 6.158 8.231 21.017 -0.1961 0.0068 -0.1356 22ILE SC1 598 6.251 8.368 21.315 -0.2467 0.0354 -0.1328 23ASN BB 599 5.889 8.466 20.962 -0.1115 -0.1700 -0.1013 23ASN SC1 600 5.996 8.769 20.965 0.0917 0.1792 -0.4385 24MET BB 601 5.715 8.525 21.275 0.1014 0.0577 0.1302 24MET SC1 602 5.919 8.740 21.422 0.1779 0.0583 -0.0218 25LYS BB 603 5.408 8.591 21.400 0.3484 -0.1750 -0.2133 25LYS SC1 604 5.399 8.855 21.499 0.1587 -0.2436 -0.0780 25LYS SC2 605 5.488 9.014 21.790 0.0334 0.3196 0.2538 26ASP BB 606 5.320 8.421 21.684 0.0067 -0.0390 0.0020 26ASP SC1 607 5.234 8.674 21.918 -0.3108 -0.1714 0.0823 27VAL BB 608 5.502 8.181 21.808 -0.0333 0.1601 -0.4403 27VAL SC1 609 5.729 8.210 21.626 0.0940 -0.3851 -0.3857 28LYS BB 610 5.416 7.932 21.577 -0.0499 0.2580 0.0826 28LYS SC1 611 5.306 8.114 21.318 -0.0113 -0.0263 -0.2997 28LYS SC2 612 5.174 7.911 21.037 -0.4039 -0.3199 0.1402 29ASP BB 613 5.330 7.620 21.530 -0.2179 -0.0349 0.2292 29ASP SC1 614 5.317 7.515 21.177 0.2458 -0.1792 0.3726 30LEU BB 615 5.208 7.415 21.728 0.0205 0.0385 0.1385 30LEU SC1 616 4.876 7.584 21.743 -0.0108 -0.2013 -0.1312 31GLY BB 617 5.201 7.074 21.784 -0.0910 -0.2847 0.0253 32LYS BB 618 5.462 6.960 21.949 0.0093 0.1499 0.0179 32LYS SC1 619 5.633 6.832 21.692 0.0474 0.1313 -0.2438 32LYS SC2 620 5.695 6.578 21.456 -0.0374 -0.2003 0.0951 33THR BB 621 5.564 6.908 22.234 -0.0603 0.1304 -0.3772 33THR SC1 622 5.866 6.952 22.252 -0.0805 0.1058 0.2084 34MET BB 623 5.463 6.642 22.430 0.0344 0.1562 0.1558 34MET SC1 624 5.754 6.793 22.703 0.1596 -0.0349 0.1516 35LYS BB 625 5.492 6.393 22.225 0.0187 0.1464 0.0278 35LYS SC1 626 5.573 6.162 22.349 0.1015 0.0732 0.0751 35LYS SC2 627 5.845 6.016 22.539 0.3114 0.2704 -0.1939 36ASP BB 628 5.517 6.433 21.896 0.1408 0.4904 -0.0966 36ASP SC1 629 5.828 6.449 21.857 -0.5483 -0.0220 0.1375 37GLN BB 630 5.509 6.159 21.774 0.3037 -0.2129 -0.0879 37GLN SC1 631 5.137 6.102 21.725 -0.2595 -0.1243 -0.1759 38ALA BB 632 5.516 6.043 21.427 -0.1002 0.2431 -0.1107 38ALA SC1 633 5.290 5.950 21.311 -0.1875 0.2398 0.0592 39LEU BB 634 5.472 6.291 21.151 -0.1804 -0.2027 0.2416 39LEU SC1 635 5.159 6.346 21.170 -0.2028 0.3414 -0.1005 40LYS BB 636 5.597 6.267 20.858 -0.0242 0.0500 -0.1725 40LYS SC1 637 5.445 6.021 20.697 -0.2770 -0.4639 0.0935 40LYS SC2 638 5.267 5.961 20.443 0.1212 0.5333 0.1266 41ASP BB 639 5.906 6.380 20.810 -0.0163 -0.0659 0.3022 41ASP SC1 640 5.948 6.434 21.125 -0.1494 0.2874 0.0377 42ASP BB 641 6.093 6.128 20.719 -0.0906 -0.0150 -0.4177 42ASP SC1 642 5.908 5.857 20.779 -0.2711 0.1795 0.0004 43ASP BB 643 6.280 6.141 20.477 -0.1751 0.0052 0.2336 43ASP SC1 644 6.309 6.501 20.490 -0.2299 0.0594 -0.1404 44ALA BB 645 6.499 5.958 20.313 -0.2195 0.1066 -0.1885 44ALA SC1 646 6.590 5.731 20.428 -0.6475 -0.0993 -0.2327 45GLU BB 647 6.687 6.152 20.084 0.0561 -0.4108 -0.2296 45GLU SC1 648 6.568 6.110 19.739 -0.1602 -0.2030 -0.0352 46THR BB 649 6.854 6.432 20.065 -0.1968 -0.2158 0.0573 46THR SC1 650 6.704 6.642 20.227 -0.1599 0.0285 -0.2161 47GLY BB 651 6.943 6.411 19.691 -0.0534 0.0031 -0.0329 48LEU BB 652 7.076 6.642 19.471 -0.0069 0.0735 -0.0814 48LEU SC1 653 7.314 6.384 19.433 -0.1159 0.0708 -0.6788 49THR BB 654 6.804 6.935 19.446 -0.1384 -0.0763 0.0776 49THR SC1 655 6.903 7.214 19.520 -0.2674 0.0549 -0.2295 50ASP BB 656 6.493 6.947 19.351 -0.3730 0.0501 0.0815 50ASP SC1 657 6.202 6.875 19.569 0.0315 -0.3461 0.0137 51GLY BB 658 6.375 7.209 19.325 -0.2405 0.1418 -0.2646 52GLU BB 659 6.510 7.507 19.439 0.1417 0.4524 0.1549 52GLU SC1 660 6.781 7.494 19.141 0.1200 0.1031 0.0524 53GLU BB 661 6.636 7.638 19.710 -0.0581 0.1363 -0.0684 53GLU SC1 662 6.294 7.791 19.791 0.1994 -0.1368 -0.1690 54LYS BB 663 6.963 7.656 19.676 -0.0512 -0.1548 -0.3676 54LYS SC1 664 6.970 7.959 19.617 0.2522 -0.3460 -0.0248 54LYS SC2 665 6.977 8.319 19.522 -0.0320 0.0511 0.2143 55GLU BB 666 7.225 7.508 19.826 0.0275 -0.0378 0.0455 55GLU SC1 667 7.132 7.608 20.182 -0.0739 -0.0937 -0.2992 56GLU BB 668 7.565 7.572 19.943 -0.1008 0.0948 0.0321 56GLU SC1 669 7.842 7.644 19.763 -0.2318 0.1791 -0.2070 57PRO BB 670 7.612 7.850 20.091 -0.0567 -0.0207 0.1880 57PRO SC1 671 7.907 7.816 20.210 -0.0870 0.0848 -0.1113 58LYS BB 672 7.670 8.220 20.091 -0.1891 0.0862 0.2525 58LYS SC1 673 7.978 8.292 20.182 -0.0581 -0.0477 -0.0449 58LYS SC2 674 8.070 8.531 20.414 0.1211 0.1491 0.1294 59GLU BB 675 7.553 8.468 19.955 -0.0073 -0.0392 -0.0898 59GLU SC1 676 7.832 8.743 20.077 -0.4789 0.2015 0.0093 60GLU BB 677 7.328 8.528 19.723 -0.2750 0.1735 -0.1246 60GLU SC1 678 7.462 8.336 19.422 0.1911 -0.1462 0.3932 61GLU BB 679 7.249 8.790 19.465 -0.1161 0.3816 -0.1736 61GLU SC1 680 7.011 9.073 19.641 -0.0537 -0.0772 0.2338 1LYS BB 681 11.611 5.508 13.849 0.1170 0.3860 -0.1107 1LYS SC1 682 11.478 5.787 14.006 0.3402 0.2686 -0.5780 1LYS SC2 683 11.440 6.136 14.064 -0.0775 -0.0329 -0.2466 2LYS BB 684 11.808 5.513 13.603 -0.0803 -0.1990 0.0669 2LYS SC1 685 11.781 5.578 13.296 0.0876 -0.0577 -0.2693 2LYS SC2 686 12.028 5.470 13.112 0.1978 0.0357 -0.2703 3CYS BB 687 12.013 5.781 13.607 0.1555 -0.0729 0.1152 3CYS SC1 688 12.196 5.806 13.345 -0.0928 0.1268 -0.2177 4LEU BB 689 12.291 5.834 13.772 -0.2672 0.4122 0.0224 4LEU SC1 690 12.250 6.172 13.892 0.3133 0.0013 0.5179 5PHE BB 691 12.502 5.693 13.984 0.2449 -0.4111 0.2158 5PHE SC1 692 12.601 5.982 14.062 0.0482 0.1491 -0.1764 5PHE SC2 693 12.898 5.993 14.228 -0.1055 0.2308 0.0997 5PHE SC3 694 12.912 5.891 13.957 0.1026 -0.2270 0.2718 6LYS BB 695 12.718 5.526 13.817 -0.1587 -0.1072 -0.1875 6LYS SC1 696 12.972 5.431 14.027 0.2353 -0.3362 0.0201 6LYS SC2 697 12.978 5.143 14.236 0.2746 0.3418 0.1574 7LYS BB 698 12.851 5.452 13.512 -0.2878 -0.1253 -0.2905 7LYS SC1 699 13.157 5.519 13.318 -0.2360 0.0264 0.2638 7LYS SC2 700 13.391 5.387 13.499 -0.1360 0.2075 0.1936 8LYS BB 701 12.771 5.283 13.263 0.1675 -0.0326 0.0642 8LYS SC1 702 12.579 5.117 13.393 0.1247 -0.1910 -0.1578 8LYS SC2 703 12.548 5.136 13.724 -0.2587 0.1230 0.3149 9ASN BB 704 12.814 5.442 12.996 0.1726 -0.2810 -0.0202 9ASN SC1 705 12.844 5.794 13.066 0.0618 0.0879 -0.0306 10LYS BB 706 12.680 5.429 12.687 0.1826 0.4436 -0.3070 10LYS SC1 707 12.487 5.678 12.585 0.1630 -0.1901 -0.0151 10LYS SC2 708 12.292 5.790 12.318 0.0251 0.1841 0.1767 11LYS BB 709 12.763 5.135 12.557 -0.3141 0.2728 0.1085 11LYS SC1 710 12.524 4.963 12.609 -0.1703 -0.0084 -0.0668 11LYS SC2 711 12.179 4.868 12.722 -0.0564 0.1348 -0.0392 12LYS BB 712 13.113 5.075 12.628 -0.2628 0.2227 -0.0310 12LYS SC1 713 13.102 4.780 12.450 0.0339 -0.0130 -0.0663 12LYS SC2 714 13.317 4.634 12.656 0.0259 0.1264 -0.2112 13GLY BB 715 13.272 5.265 12.783 0.1003 0.2677 -0.0941 14LYS BB 716 13.251 5.588 12.808 -0.0677 0.0121 -0.2942 14LYS SC1 717 13.205 5.728 12.556 -0.0080 -0.0522 0.3284 14LYS SC2 718 13.191 5.904 12.256 0.2111 -0.2849 0.1117 15GLU BB 719 13.316 5.887 12.987 0.2226 -0.0721 -0.3319 15GLU SC1 720 13.557 5.775 13.279 0.1104 -0.2506 0.0185 16LYS BB 721 13.425 6.161 12.803 0.3332 -0.0317 0.2274 16LYS SC1 722 13.742 6.192 12.627 -0.1561 0.1862 0.2120 16LYS SC2 723 13.984 6.455 12.691 0.2519 0.1240 -0.0740 17GLY BB 724 13.293 6.411 12.998 -0.1901 -0.2142 0.0748 18GLY BB 725 12.983 6.293 12.997 0.1521 0.0105 0.3014 19LYS BB 726 12.702 6.253 13.189 0.1507 0.0164 -0.1056 19LYS SC1 727 12.454 6.467 13.161 0.0121 -0.3440 0.2532 19LYS SC2 728 12.101 6.441 13.134 0.1952 0.3950 0.2742 20ASN BB 729 12.563 5.988 13.333 0.2438 -0.2856 0.0596 20ASN SC1 730 12.282 6.155 13.412 0.2490 -0.0028 -0.2520 21ALA BB 731 12.801 5.894 13.568 -0.2719 0.0315 0.0177 21ALA SC1 732 12.681 6.078 13.724 -0.3792 0.2861 -0.3515 22ILE BB 733 13.125 5.846 13.628 -0.0533 -0.1968 0.1046 22ILE SC1 734 13.121 6.057 13.361 -0.0536 -0.0605 0.2115 23ASN BB 735 13.351 5.919 13.855 -0.1484 -0.2350 0.1551 23ASN SC1 736 13.665 5.954 13.714 -0.1428 0.2304 0.1424 24MET BB 737 13.266 6.194 14.028 -0.2318 -0.2123 -0.1579 24MET SC1 738 12.984 6.292 13.846 0.3288 0.3158 0.0662 25LYS BB 739 13.417 6.488 14.064 0.1471 -0.0466 -0.0314 25LYS SC1 740 13.691 6.338 14.018 -0.0476 0.1806 0.2533 25LYS SC2 741 13.712 6.050 14.168 -0.2185 -0.0009 0.4166 26ASP BB 742 13.282 6.756 13.967 -0.2530 0.3444 -0.1253 26ASP SC1 743 12.998 6.757 13.848 -0.0032 0.1816 -0.1966 27VAL BB 744 13.406 7.068 13.985 -0.0609 0.1335 -0.1090 27VAL SC1 745 13.668 7.161 13.894 0.2144 -0.3018 0.1982 28LYS BB 746 13.104 7.199 14.007 -0.0365 0.3305 -0.0151 28LYS SC1 747 12.996 7.255 13.725 -0.0243 0.2902 0.3568 28LYS SC2 748 12.908 7.071 13.427 -0.0259 -0.1039 -0.1742 29ASP BB 749 13.046 7.311 14.298 -0.0865 -0.0281 0.0633 29ASP SC1 750 13.374 7.274 14.400 0.1748 -0.2086 0.2590 30LEU BB 751 12.830 7.567 14.303 -0.0201 0.1569 0.0187 30LEU SC1 752 12.717 7.485 13.963 -0.3581 -0.0372 0.1998 31GLY BB 753 12.766 7.696 14.580 -0.2641 0.1119 0.0242 32LYS BB 754 12.922 7.542 14.824 -0.1721 -0.0134 -0.1713 32LYS SC1 755 13.043 7.798 15.017 0.1337 0.1205 0.0045 32LYS SC2 756 13.116 8.111 15.189 0.2469 -0.5587 -0.1900 33THR BB 757 13.093 7.279 14.795 -0.0963 0.2037 0.3258 33THR SC1 758 12.859 7.092 14.738 -0.0062 0.1904 -0.0261 34MET BB 759 13.287 7.012 14.929 -0.0264 0.0086 0.1040 34MET SC1 760 13.455 7.163 15.231 -0.3244 0.3127 0.0260 35LYS BB 761 13.310 6.804 14.735 0.1304 -0.1603 0.1026 35LYS SC1 762 13.218 6.509 14.816 0.0238 0.1251 0.0030 35LYS SC2 763 13.095 6.242 14.970 0.1397 0.2274 0.0280 36ASP BB 764 13.582 6.782 14.542 0.1567 0.0641 -0.2864 36ASP SC1 765 13.602 6.450 14.509 -0.1598 0.2578 -0.1307 37GLN BB 766 13.693 6.958 14.272 0.2207 0.4079 -0.0455 37GLN SC1 767 13.900 7.251 14.298 -0.2345 -0.0282 0.0412 38ALA BB 768 13.903 6.711 14.246 0.0761 -0.1719 -0.0453 38ALA SC1 769 13.940 6.654 13.985 0.0109 -0.0146 -0.0899 39LEU BB 770 14.191 6.871 14.264 0.2087 0.2003 0.0520 39LEU SC1 771 14.075 7.015 13.927 -0.0423 -0.0809 -0.2592 40LYS BB 772 14.349 7.083 14.473 0.0219 -0.0792 0.1070 40LYS SC1 773 14.574 6.897 14.602 -0.1798 -0.2870 0.1109 40LYS SC2 774 14.867 6.745 14.574 -0.1771 0.2303 0.1817 41ASP BB 775 14.243 7.325 14.644 0.0464 -0.2853 -0.1743 41ASP SC1 776 14.439 7.568 14.626 -0.3411 -0.0432 0.1229 42ASP BB 777 14.211 7.237 14.943 -0.0056 -0.0218 -0.2888 42ASP SC1 778 14.237 6.913 14.935 0.1417 -0.5131 -0.0893 43ASP BB 779 13.909 7.261 15.021 -0.1343 -0.1775 0.1843 43ASP SC1 780 13.719 7.229 14.719 0.0989 -0.0203 0.1837 44ALA BB 781 13.866 7.491 15.231 -0.1229 -0.3399 -0.0764 44ALA SC1 782 13.849 7.337 15.453 -0.1769 0.0233 0.1817 45GLU BB 783 13.762 7.806 15.279 0.2615 0.0948 0.2043 45GLU SC1 784 13.519 8.027 15.005 0.0298 -0.1209 0.1177 46THR BB 785 13.974 7.953 15.496 0.2550 -0.1800 -0.1240 46THR SC1 786 13.925 8.254 15.489 -0.0478 -0.2297 -0.2870 47GLY BB 787 14.297 8.036 15.426 0.2031 0.1866 0.0659 48LEU BB 788 14.374 8.303 15.669 -0.1654 -0.1430 0.2152 48LEU SC1 789 14.394 8.470 15.348 0.4995 -0.3821 -0.1102 49THR BB 790 14.139 8.519 15.771 -0.2181 -0.0654 -0.0706 49THR SC1 791 14.070 8.682 15.522 -0.1424 -0.1523 -0.1494 50ASP BB 792 14.308 8.655 16.115 0.3940 -0.0361 0.2989 50ASP SC1 793 14.010 8.465 16.217 -0.1430 -0.1761 -0.2818 51GLY BB 794 14.525 8.901 16.260 0.0058 0.3571 0.1014 52GLU BB 795 14.702 8.973 15.937 0.3526 -0.0424 -0.0478 52GLU SC1 796 14.774 9.302 16.045 -0.0967 -0.0239 -0.1317 53GLU BB 797 14.666 8.705 15.787 0.2180 -0.2247 0.0104 53GLU SC1 798 14.772 8.455 16.004 0.1049 -0.2151 -0.0843 54LYS BB 799 14.672 8.867 15.431 0.1250 -0.0798 -0.0338 54LYS SC1 800 14.831 8.647 15.264 -0.0167 0.2083 0.0088 54LYS SC2 801 15.040 8.428 15.066 -0.1754 -0.0815 0.0914 55GLU BB 802 14.433 8.928 15.247 0.0235 0.3837 0.0646 55GLU SC1 803 14.617 8.876 14.910 -0.1255 -0.0036 0.1727 56GLU BB 804 14.220 9.190 15.260 0.0234 -0.0682 -0.1079 56GLU SC1 805 14.039 9.185 15.597 0.1467 -0.1627 0.2232 57PRO BB 806 14.108 9.387 14.978 -0.0441 0.3411 0.0358 57PRO SC1 807 13.843 9.247 14.929 0.1764 0.1775 0.0898 58LYS BB 808 14.314 9.507 14.750 0.0566 0.2773 0.0297 58LYS SC1 809 14.562 9.352 14.706 -0.1293 -0.1275 -0.1190 58LYS SC2 810 14.880 9.277 14.595 -0.0649 -0.1202 -0.2455 59GLU BB 811 14.283 9.802 14.568 0.1762 -0.1419 -0.0354 59GLU SC1 812 14.403 10.108 14.751 -0.0290 0.1203 -0.2204 60GLU BB 813 14.180 9.867 14.249 0.0752 0.0752 0.2074 60GLU SC1 814 13.806 9.741 14.162 -0.1857 -0.2309 -0.4225 61GLU BB 815 14.381 9.842 13.985 -0.1529 -0.1485 0.4985 61GLU SC1 816 14.737 9.914 13.869 0.2821 -0.0770 -0.2511 1LYS BB 817 -1.925 15.053 20.886 -0.2532 -0.1835 0.0129 1LYS SC1 818 -2.000 14.743 20.850 -0.0753 -0.1103 -0.2537 1LYS SC2 819 -2.103 14.419 20.959 0.0269 -0.0834 0.2724 2LYS BB 820 -1.954 15.220 20.595 0.2201 -0.3804 0.2755 2LYS SC1 821 -1.839 15.019 20.402 0.2091 0.4000 0.5412 2LYS SC2 822 -1.861 14.860 20.059 0.2935 0.1282 -0.0449 3CYS BB 823 -2.251 15.310 20.408 -0.2198 0.1401 -0.0093 3CYS SC1 824 -2.227 14.952 20.311 0.2676 -0.1295 -0.2622 4LEU BB 825 -2.557 15.230 20.421 0.2897 -0.0331 -0.2942 4LEU SC1 826 -2.518 15.146 20.100 0.0743 -0.0736 0.2788 5PHE BB 827 -2.786 15.270 20.709 0.1645 0.3096 -0.0869 5PHE SC1 828 -3.040 15.098 20.705 0.1876 0.2747 0.2543 5PHE SC2 829 -3.298 15.121 20.925 -0.0060 0.0343 0.0584 5PHE SC3 830 -3.060 14.988 21.026 -0.1060 -0.1063 0.1130 6LYS BB 831 -2.871 15.405 20.978 0.0911 0.3553 -0.2161 6LYS SC1 832 -2.612 15.485 21.101 -0.0911 -0.0611 -0.1229 6LYS SC2 833 -2.450 15.583 21.414 0.0083 0.0817 -0.1756 7LYS BB 834 -3.076 15.506 21.155 -0.0674 -0.1564 -0.1095 7LYS SC1 835 -3.327 15.449 21.047 -0.3422 0.5050 0.0340 7LYS SC2 836 -3.617 15.627 20.956 -0.2127 0.2322 -0.1525 8LYS BB 837 -2.913 15.593 21.429 -0.1590 0.0320 0.2379 8LYS SC1 838 -3.146 15.508 21.625 -0.2972 0.1339 -0.2075 8LYS SC2 839 -3.178 15.261 21.885 -0.4895 -0.0856 -0.0393 9ASN BB 840 -2.926 15.917 21.552 0.0428 0.1445 0.3610 9ASN SC1 841 -3.218 15.935 21.453 -0.1275 -0.1906 0.2788 10LYS BB 842 -2.617 16.010 21.621 0.0676 0.1030 0.3083 10LYS SC1 843 -2.529 16.241 21.408 -0.0239 0.0312 0.4923 10LYS SC2 844 -2.458 16.396 21.134 -0.1393 -0.0899 0.0158 11LYS BB 845 -2.445 16.006 21.900 0.1257 -0.1554 -0.2133 11LYS SC1 846 -2.240 16.164 22.022 0.1236 -0.1686 -0.0967 11LYS SC2 847 -2.128 16.509 22.146 -0.0194 0.3525 -0.0550 12LYS BB 848 -2.258 15.744 21.855 -0.2050 0.2006 0.2274 12LYS SC1 849 -1.991 15.930 21.771 -0.1835 -0.1049 0.0176 12LYS SC2 850 -1.633 15.963 21.670 0.2613 0.1351 -0.1136 13GLY BB 851 -2.447 15.469 21.898 -0.2114 -0.0253 -0.0828 14LYS BB 852 -2.526 15.426 22.243 0.0379 0.1462 -0.1932 14LYS SC1 853 -2.556 15.746 22.245 0.1695 -0.1308 -0.0677 14LYS SC2 854 -2.778 16.026 22.434 0.0410 0.0790 -0.0271 15GLU BB 855 -2.808 15.308 22.362 0.0368 -0.0503 -0.0256 15GLU SC1 856 -3.000 15.654 22.509 0.1980 0.0445 -0.0337 16LYS BB 857 -2.888 15.032 22.272 0.1554 -0.2033 -0.2331 16LYS SC1 858 -2.690 14.915 22.072 -0.1673 0.0400 0.1720 16LYS SC2 859 -2.384 15.043 21.973 0.0016 -0.1099 -0.0798 17GLY BB 860 -2.956 14.711 22.330 -0.2892 -0.7155 0.3089 18GLY BB 861 -3.163 14.674 22.537 0.3079 -0.1739 -0.2185 19LYS BB 862 -3.415 14.392 22.560 -0.2583 0.0651 0.2266 19LYS SC1 863 -3.259 14.144 22.576 0.3527 -0.2929 -0.1665 19LYS SC2 864 -3.155 13.936 22.822 0.1621 0.1946 -0.0306 20ASN BB 865 -3.707 14.320 22.619 0.2158 -0.2927 -0.1804 20ASN SC1 866 -3.784 14.306 22.958 -0.0507 0.3536 -0.4933 21ALA BB 867 -3.972 14.414 22.431 -0.0513 -0.2321 -0.0185 21ALA SC1 868 -4.120 14.263 22.264 -0.2923 0.3386 -0.3501 22ILE BB 869 -4.156 14.628 22.676 -0.0768 0.1770 0.0086 22ILE SC1 870 -3.953 14.686 22.944 0.1131 -0.0019 -0.0938 23ASN BB 871 -4.157 14.965 22.650 0.0119 0.0376 0.1228 23ASN SC1 872 -4.147 15.175 22.361 -0.3484 -0.2230 0.2043 24MET BB 873 -4.111 15.103 22.973 0.1077 0.2998 0.1496 24MET SC1 874 -4.327 14.875 23.138 -0.2387 0.1625 0.0590 25LYS BB 875 -3.839 15.233 23.040 -0.0380 0.1788 -0.2839 25LYS SC1 876 -3.711 14.959 23.179 -0.1400 -0.0464 0.3702 25LYS SC2 877 -3.513 14.696 23.217 0.0899 -0.4392 0.2038 26ASP BB 878 -3.846 15.579 23.151 0.2630 -0.0336 0.1161 26ASP SC1 879 -4.197 15.622 23.145 0.0301 0.0699 0.0272 27VAL BB 880 -3.603 15.817 23.246 -0.3643 -0.1542 0.1563 27VAL SC1 881 -3.467 15.580 23.349 -0.0068 -0.0327 -0.0168 28LYS BB 882 -3.665 15.965 23.557 0.1479 0.0248 0.1152 28LYS SC1 883 -3.688 16.233 23.412 -0.0012 0.2674 -0.0810 28LYS SC2 884 -3.533 16.561 23.340 -0.1197 0.0159 -0.3453 29ASP BB 885 -3.755 15.802 23.781 0.1282 0.0750 0.1803 29ASP SC1 886 -4.076 15.922 23.813 0.2586 -0.1665 -0.1701 30LEU BB 887 -3.697 15.960 24.091 -0.1638 -0.2005 0.2923 30LEU SC1 888 -3.706 15.972 24.446 0.0473 -0.1492 0.2573 31GLY BB 889 -3.848 16.221 24.127 -0.2809 -0.3284 -0.0008 32LYS BB 890 -3.696 16.519 24.176 0.2483 -0.3156 -0.1052 32LYS SC1 891 -3.862 16.778 24.268 0.3211 0.1422 -0.1245 32LYS SC2 892 -4.072 17.076 24.302 0.0716 0.0727 0.0689 33THR BB 893 -3.600 16.614 23.893 -0.3314 0.0582 -0.2851 33THR SC1 894 -3.472 16.364 23.775 -0.1148 0.0826 -0.1095 34MET BB 895 -3.452 16.911 23.948 -0.0849 0.3720 0.0488 34MET SC1 896 -3.739 17.173 23.997 -0.2327 0.1693 -0.0179 35LYS BB 897 -3.118 16.792 23.860 0.1482 0.0118 0.0498 35LYS SC1 898 -3.152 16.621 23.597 0.1129 -0.1570 0.1546 35LYS SC2 899 -2.952 16.320 23.618 -0.0119 0.1779 0.0214 36ASP BB 900 -3.000 16.621 24.089 -0.0915 -0.3449 -0.0630 36ASP SC1 901 -3.248 16.380 24.162 -0.0015 0.1007 0.2754 37GLN BB 902 -2.762 16.593 24.281 -0.0344 -0.1851 0.1016 37GLN SC1 903 -2.847 16.749 24.615 -0.0472 0.1526 0.4139 38ALA BB 904 -2.487 16.766 24.214 0.0442 -0.1420 0.0453 38ALA SC1 905 -2.357 16.679 24.434 -0.2083 -0.1444 0.1970 39LEU BB 906 -2.476 16.856 23.886 0.0892 -0.0618 0.0461 39LEU SC1 907 -2.515 17.198 23.801 0.3913 0.1496 -0.1796 40LYS BB 908 -2.635 16.625 23.776 0.3860 0.1684 0.1453 40LYS SC1 909 -2.665 16.651 23.477 0.5715 0.1724 0.1521 40LYS SC2 910 -2.617 16.691 23.153 -0.0557 -0.3687 -0.2142 41ASP BB 911 -2.469 16.315 23.726 0.0533 -0.1422 -0.1132 41ASP SC1 912 -2.166 16.178 23.793 -0.2220 -0.0356 0.0870 42ASP BB 913 -2.564 16.192 23.412 0.0146 -0.0670 -0.1468 42ASP SC1 914 -2.841 16.304 23.200 -0.1442 0.0783 0.3509 43ASP BB 915 -2.624 15.890 23.382 -0.0916 -0.2820 0.3278 43ASP SC1 916 -2.848 15.884 23.652 0.0070 0.1197 -0.0461 44ALA BB 917 -2.553 15.705 23.139 0.1784 -0.0195 0.0515 44ALA SC1 918 -2.460 15.918 23.001 -0.2027 -0.0426 -0.2593 45GLU BB 919 -2.279 15.488 23.115 -0.0668 0.0302 -0.0910 45GLU SC1 920 -2.482 15.184 23.212 0.0983 -0.2906 0.0144 46THR BB 921 -2.008 15.556 23.216 -0.3383 -0.0359 0.1639 46THR SC1 922 -1.795 15.538 22.999 -0.1599 0.2343 0.3107 47GLY BB 923 -1.857 15.575 23.468 -0.0906 0.1362 -0.2679 48LEU BB 924 -1.887 15.774 23.720 -0.0135 -0.0454 0.0468 48LEU SC1 925 -1.576 15.967 23.810 0.0156 0.2795 0.3018 49THR BB 926 -2.028 15.654 23.961 0.0176 -0.1976 0.1556 49THR SC1 927 -2.052 15.902 24.136 -0.0398 0.1428 -0.3164 50ASP BB 928 -2.211 15.393 23.873 0.3119 -0.0324 -0.0118 50ASP SC1 929 -2.440 15.444 24.097 0.4789 -0.1798 -0.1610 51GLY BB 930 -2.196 15.300 23.551 0.3133 0.0784 -0.2744 52GLU BB 931 -2.038 15.034 23.346 -0.2162 -0.0506 -0.0929 52GLU SC1 932 -2.185 14.689 23.436 -0.0721 -0.0145 0.1211 53GLU BB 933 -1.745 15.170 23.362 -0.1414 0.2456 0.2260 53GLU SC1 934 -1.694 15.274 23.777 0.1495 -0.0739 -0.0038 54LYS BB 935 -1.591 15.100 23.122 0.1747 -0.0026 0.1464 54LYS SC1 936 -1.341 14.952 23.133 0.1111 0.0303 -0.2241 54LYS SC2 937 -0.964 14.783 23.093 0.1404 0.0556 -0.0019 55GLU BB 938 -1.501 15.209 22.816 -0.2026 0.0954 0.1645 55GLU SC1 939 -1.248 15.504 22.712 0.0026 -0.0575 0.0325 56GLU BB 940 -1.271 15.005 22.663 0.0239 0.0911 0.0578 56GLU SC1 941 -1.387 14.635 22.802 -0.0714 -0.3434 0.0803 57PRO BB 942 -1.269 14.943 22.347 0.2017 0.2325 0.1838 57PRO SC1 943 -0.958 14.990 22.287 -0.3707 -0.1774 0.2829 58LYS BB 944 -1.453 14.835 22.063 -0.1552 -0.2180 0.1428 58LYS SC1 945 -1.318 14.582 21.963 -0.1674 0.3139 -0.0809 58LYS SC2 946 -1.128 14.439 21.757 0.2457 -0.4606 -0.1790 59GLU BB 947 -1.817 14.808 22.059 -0.0200 -0.0244 -0.0068 59GLU SC1 948 -2.114 14.645 21.814 0.0237 -0.0252 -0.0472 60GLU BB 949 -1.845 15.078 21.876 -0.2632 0.0007 0.0293 60GLU SC1 950 -1.473 15.215 21.754 0.1022 -0.4222 -0.2629 61GLU BB 951 -1.990 15.312 21.976 -0.0633 0.2268 -0.0648 61GLU SC1 952 -2.078 15.209 22.312 0.1230 -0.1518 0.2134 1LYS BB 953 22.264 1.842 8.632 0.4280 0.2326 0.0632 1LYS SC1 954 22.206 1.948 8.308 0.0845 0.2034 -0.0247 1LYS SC2 955 22.288 2.030 7.955 0.1670 0.1253 0.3617 2LYS BB 956 22.179 1.462 8.627 0.0089 -0.1616 -0.0150 2LYS SC1 957 22.241 1.193 8.528 0.1803 -0.2416 -0.0630 2LYS SC2 958 22.299 0.858 8.423 -0.0724 -0.3331 -0.3517 3CYS BB 959 22.224 1.448 8.994 -0.2334 -0.0620 -0.3411 3CYS SC1 960 22.465 1.655 8.980 -0.3433 -0.0557 -0.1352 4LEU BB 961 22.021 1.569 9.212 0.1096 -0.0425 0.2433 4LEU SC1 962 22.180 1.384 9.451 0.0550 -0.2463 -0.2697 5PHE BB 963 21.762 1.826 9.196 -0.3512 -0.0745 0.1353 5PHE SC1 964 21.769 1.840 9.493 -0.1243 -0.0790 0.3718 5PHE SC2 965 21.869 2.131 9.638 -0.1463 0.2317 -0.2089 5PHE SC3 966 22.080 1.975 9.513 -0.1970 0.2200 -0.2803 6LYS BB 967 21.480 1.653 9.189 -0.0344 0.0904 0.1668 6LYS SC1 968 21.337 1.715 9.508 0.3104 -0.0201 0.0151 6LYS SC2 969 21.170 1.915 9.739 -0.1244 0.1887 -0.0182 7LYS BB 970 21.212 1.565 8.953 -0.1783 -0.1074 -0.0694 7LYS SC1 971 21.300 1.507 8.660 0.1085 -0.1721 -0.3169 7LYS SC2 972 21.053 1.472 8.459 0.0807 -0.2971 -0.0761 8LYS BB 973 20.944 1.734 8.894 0.5376 0.1565 -0.0434 8LYS SC1 974 21.048 2.035 8.822 0.2836 -0.1809 -0.1458 8LYS SC2 975 20.982 2.382 8.777 -0.0197 -0.0140 0.0562 9ASN BB 976 20.639 1.815 9.099 -0.0223 -0.2351 0.0252 9ASN SC1 977 20.631 2.089 8.886 0.1314 0.1781 0.6100 10LYS BB 978 20.371 1.601 9.059 0.1373 -0.0199 0.0619 10LYS SC1 979 20.284 1.451 8.806 -0.1526 -0.0154 0.3491 10LYS SC2 980 20.141 1.389 8.483 0.5198 -0.2197 0.0032 11LYS BB 981 20.430 1.408 9.305 -0.1554 0.1441 0.1887 11LYS SC1 982 20.166 1.247 9.346 -0.2159 -0.2088 -0.0868 11LYS SC2 983 19.871 1.047 9.308 0.1728 0.0097 0.1684 12LYS BB 984 20.443 1.624 9.559 0.0455 -0.0976 -0.3182 12LYS SC1 985 20.488 1.347 9.771 -0.4546 -0.2423 -0.1247 12LYS SC2 986 20.481 1.007 9.923 -0.0487 0.0508 -0.4094 13GLY BB 987 20.170 1.662 9.635 -0.2388 0.0348 0.0077 14LYS BB 988 20.068 1.948 9.743 -0.0388 -0.5754 0.2695 14LYS SC1 989 19.783 2.041 9.707 -0.0779 0.0412 -0.1807 14LYS SC2 990 19.583 2.302 9.790 -0.1415 -0.0770 -0.1368 15GLU BB 991 20.245 2.264 9.692 0.1107 -0.0006 -0.0951 15GLU SC1 992 20.014 2.499 9.915 0.0645 0.2746 0.2086 16LYS BB 993 20.485 2.471 9.746 -0.2092 0.0053 0.2727 16LYS SC1 994 20.472 2.534 9.439 -0.1614 -0.0902 -0.1355 16LYS SC2 995 20.354 2.354 9.209 0.0052 0.2736 -0.1446 17GLY BB 996 20.821 2.485 9.670 0.1627 0.1314 -0.1990 18GLY BB 997 21.117 2.290 9.635 -0.2294 -0.1651 -0.0400 19LYS BB 998 21.239 2.356 9.950 -0.0011 0.1253 0.0580 19LYS SC1 999 21.559 2.375 9.923 0.1038 -0.2049 0.2275 19LYS SC2 1000 21.895 2.419 10.029 0.4298 0.1948 -0.3437 20ASN BB 1001 21.203 2.580 10.243 0.0173 0.0208 0.2015 20ASN SC1 1002 20.921 2.642 10.124 0.0174 -0.2945 0.1075 21ALA BB 1003 21.225 2.602 10.576 -0.1901 0.0815 0.1128 21ALA SC1 1004 21.189 2.866 10.532 -0.2839 0.0822 0.1892 22ILE BB 1005 21.555 2.668 10.632 -0.0302 -0.2530 -0.0625 22ILE SC1 1006 21.812 2.858 10.513 -0.1458 0.1138 0.2557 23ASN BB 1007 21.707 2.503 10.901 0.1520 0.2404 -0.3503 23ASN SC1 1008 21.755 2.179 10.857 0.1848 -0.3496 0.0536 24MET BB 1009 21.890 2.576 11.158 0.0322 0.1555 0.1768 24MET SC1 1010 22.231 2.623 10.939 0.1842 -0.1020 0.3139 25LYS BB 1011 21.719 2.580 11.453 -0.4560 0.3801 0.2005 25LYS SC1 1012 21.577 2.842 11.356 0.4225 -0.0628 -0.2727 25LYS SC2 1013 21.549 3.065 11.604 0.1066 0.3662 0.2867 26ASP BB 1014 21.816 2.697 11.716 -0.0037 0.1840 0.0490 26ASP SC1 1015 21.608 2.791 12.005 0.0510 -0.3025 -0.1010 27VAL BB 1016 22.102 2.573 11.907 -0.2538 0.2307 0.4665 27VAL SC1 1017 22.242 2.748 11.719 -0.1745 -0.2952 0.0116 28LYS BB 1018 22.009 2.267 12.025 -0.0035 0.0676 0.0875 28LYS SC1 1019 21.861 2.239 11.681 0.0872 0.0465 -0.2226 28LYS SC2 1020 21.802 2.128 11.332 -0.1464 0.2496 -0.0783 29ASP BB 1021 22.237 2.083 12.177 0.0510 -0.1600 0.0024 29ASP SC1 1022 22.424 2.353 12.181 -0.2728 -0.1012 0.3075 30LEU BB 1023 22.233 1.788 12.108 0.0921 0.1524 0.4295 30LEU SC1 1024 21.986 1.556 12.204 0.3488 0.0214 0.4352 31GLY BB 1025 22.260 1.558 11.859 -0.0557 -0.0926 0.1111 32LYS BB 1026 22.242 1.243 11.915 0.1994 0.0344 0.1756 32LYS SC1 1027 22.076 1.089 11.688 0.1499 -0.2126 -0.0062 32LYS SC2 1028 21.752 0.970 11.592 0.0394 -0.0479 0.1295 33THR BB 1029 22.468 1.111 12.070 0.1036 0.2544 -0.1210 33THR SC1 1030 22.425 0.812 12.103 0.1155 0.2092 -0.4756 34MET BB 1031 22.588 1.319 12.255 -0.0718 0.1159 0.2850 34MET SC1 1032 22.353 1.426 12.512 -0.2990 -0.0340 -0.1568 35LYS BB 1033 22.694 1.593 12.176 0.2301 -0.3662 -0.2143 35LYS SC1 1034 22.623 1.818 12.375 -0.2626 0.2606 0.1628 35LYS SC2 1035 22.601 2.100 12.529 -0.2699 0.5416 0.0345 36ASP BB 1036 23.031 1.646 12.158 -0.0169 0.0143 0.1841 36ASP SC1 1037 23.012 1.559 11.844 -0.2216 0.0315 0.0826 37GLN BB 1038 23.285 1.453 12.218 -0.2405 0.1957 0.1671 37GLN SC1 1039 23.054 1.287 12.505 -0.1709 0.1026 0.4411 38ALA BB 1040 23.585 1.506 12.174 -0.0930 -0.4085 0.2871 38ALA SC1 1041 23.790 1.450 12.341 0.2951 0.0459 -0.0109 39LEU BB 1042 23.772 1.535 11.892 0.0799 -0.4035 0.0574 39LEU SC1 1043 24.073 1.468 12.073 0.0499 0.0958 0.0064 40LYS BB 1044 23.650 1.306 11.741 -0.6798 -0.0891 -0.1412 40LYS SC1 1045 23.870 1.205 11.549 0.2192 -0.1821 -0.1885 40LYS SC2 1046 24.124 1.288 11.280 0.5325 -0.1549 -0.3897 41ASP BB 1047 23.393 1.249 11.761 -0.0750 -0.0714 -0.2548 41ASP SC1 1048 23.424 1.036 12.046 0.1507 0.0230 -0.0225 42ASP BB 1049 23.208 1.093 11.538 0.0313 0.3629 0.4137 42ASP SC1 1050 23.433 1.083 11.300 -0.1810 0.1574 0.2191 43ASP BB 1051 22.903 1.215 11.519 -0.0249 -0.0621 0.0342 43ASP SC1 1052 22.686 1.027 11.701 -0.0098 0.1934 0.2231 44ALA BB 1053 22.805 1.469 11.370 -0.1323 0.0665 -0.1193 44ALA SC1 1054 22.715 1.378 11.133 0.0279 -0.1017 -0.1178 45GLU BB 1055 22.616 1.686 11.505 -0.2778 -0.0495 -0.2057 45GLU SC1 1056 22.636 2.019 11.304 -0.0689 -0.1041 -0.0837 46THR BB 1057 22.627 1.844 11.748 -0.1082 -0.0907 0.0330 46THR SC1 1058 22.398 2.044 11.769 0.0241 0.0460 0.2093 47GLY BB 1059 22.801 1.962 11.918 0.4408 -0.2012 0.0221 48LEU BB 1060 23.059 2.023 11.763 -0.3464 -0.2783 0.0197 48LEU SC1 1061 23.259 2.257 11.978 -0.0863 -0.3306 0.1977 49THR BB 1062 23.118 1.857 11.486 0.1511 -0.2268 0.0383 49THR SC1 1063 23.197 1.562 11.477 0.1469 -0.2212 -0.3699 50ASP BB 1064 23.228 1.951 11.241 0.0953 0.2260 -0.2181 50ASP SC1 1065 23.382 2.269 11.253 0.2222 -0.3272 0.1590 51GLY BB 1066 23.363 1.697 10.986 -0.2791 -0.1499 -0.1300 52GLU BB 1067 23.691 1.667 10.775 0.1363 0.0338 -0.0000 52GLU SC1 1068 23.537 1.329 10.573 -0.1255 0.0554 0.0394 53GLU BB 1069 23.949 1.610 10.995 0.1583 -0.1421 0.1374 53GLU SC1 1070 24.287 1.409 10.863 0.1738 -0.2704 0.2793 54LYS BB 1071 24.120 1.760 11.220 -0.1375 -0.2224 -0.0038 54LYS SC1 1072 23.943 1.781 11.484 -0.4871 -0.1436 0.1258 54LYS SC2 1073 23.972 1.954 11.814 0.2003 0.1614 0.1547 55GLU BB 1074 24.332 1.979 11.229 0.0387 0.1112 -0.1252 55GLU SC1 1075 24.426 2.012 11.591 -0.2753 0.0174 -0.1739 56GLU BB 1076 24.510 2.128 11.070 -0.1549 -0.1105 -0.2149 56GLU SC1 1077 24.857 1.985 11.190 0.1921 -0.3061 -0.2173 57PRO BB 1078 24.542 2.429 11.087 -0.2837 -0.1229 -0.0398 57PRO SC1 1079 24.398 2.485 11.365 0.0729 -0.1320 -0.0180 58LYS BB 1080 24.749 2.662 11.113 -0.2456 -0.1393 0.2775 58LYS SC1 1081 24.835 2.691 11.401 -0.0165 0.1370 -0.1044 58LYS SC2 1082 24.779 2.351 11.534 -0.3351 -0.0262 0.0492 59GLU BB 1083 24.906 2.722 10.866 0.1139 0.0471 0.0066 59GLU SC1 1084 24.786 2.656 10.511 -0.2891 -0.0429 -0.1340 60GLU BB 1085 25.217 2.858 10.850 0.3344 0.1373 0.1812 60GLU SC1 1086 25.237 2.960 11.219 -0.1558 0.2455 -0.2665 61GLU BB 1087 25.389 2.906 10.604 -0.0044 0.1356 -0.1009 61GLU SC1 1088 25.148 2.951 10.298 0.0888 0.1674 -0.1154 1LYS BB 1089 12.462 14.325 8.373 -0.1353 0.2770 0.1882 1LYS SC1 1090 12.644 14.558 8.172 0.1665 0.1093 -0.1202 1LYS SC2 1091 12.762 14.754 7.901 0.1812 -0.0962 0.2354 2LYS BB 1092 12.679 14.409 8.625 -0.0714 -0.0125 0.0728 2LYS SC1 1093 12.627 14.610 8.874 0.0188 -0.0782 -0.1207 2LYS SC2 1094 12.786 14.748 9.179 0.2435 0.2048 0.1631 3CYS BB 1095 12.936 14.232 8.783 0.0755 -0.0095 -0.0176 3CYS SC1 1096 12.897 14.269 9.119 -0.0902 -0.4022 -0.1176 4LEU BB 1097 13.278 14.247 8.823 -0.1745 0.3063 -0.1842 4LEU SC1 1098 13.501 14.303 9.116 -0.0620 0.2350 -0.3073 5PHE BB 1099 13.491 14.423 8.605 0.0870 -0.0876 -0.0469 5PHE SC1 1100 13.536 14.702 8.545 0.3847 -0.3953 -0.0312 5PHE SC2 1101 13.727 14.983 8.543 0.1660 -0.2434 -0.2259 5PHE SC3 1102 13.558 14.950 8.776 0.2605 -0.2630 -0.1592 6LYS BB 1103 13.588 14.322 8.290 -0.0061 -0.0420 -0.2595 6LYS SC1 1104 13.791 14.128 8.399 -0.2102 -0.3527 0.2633 6LYS SC2 1105 14.022 13.864 8.507 0.3458 0.0227 -0.2032 7LYS BB 1106 13.738 14.530 8.074 0.1632 0.3493 0.2566 7LYS SC1 1107 13.854 14.798 8.210 0.2602 0.1992 0.2365 7LYS SC2 1108 13.973 15.019 7.933 0.0389 0.0898 0.2184 8LYS BB 1109 13.822 14.426 7.757 0.1426 0.1323 -0.0493 8LYS SC1 1110 14.114 14.472 7.822 -0.0620 0.1546 -0.2323 8LYS SC2 1111 14.359 14.275 7.979 -0.3120 -0.0410 -0.1184 9ASN BB 1112 13.777 14.136 7.739 0.3174 0.2198 -0.0463 9ASN SC1 1113 13.954 14.026 8.021 0.0228 -0.1852 0.1269 10LYS BB 1114 13.709 13.921 7.484 -0.1317 0.1064 0.4701 10LYS SC1 1115 13.676 13.606 7.538 -0.3846 -0.4321 -0.0482 10LYS SC2 1116 13.703 13.269 7.653 -0.2031 -0.0739 0.2843 11LYS BB 1117 13.926 13.977 7.230 -0.0009 -0.0701 -0.1386 11LYS SC1 1118 13.858 13.912 6.939 -0.2981 -0.1984 -0.0324 11LYS SC2 1119 13.640 13.802 6.655 -0.3863 0.0762 0.2414 12LYS BB 1120 14.033 14.275 7.253 0.0274 -0.0285 -0.1051 12LYS SC1 1121 13.743 14.392 7.328 0.5669 -0.3214 -0.2541 12LYS SC2 1122 13.419 14.248 7.486 -0.0265 -0.3554 -0.3705 13GLY BB 1123 14.217 14.430 7.415 0.1868 -0.0837 0.1269 14LYS BB 1124 14.562 14.366 7.438 -0.3547 0.0967 -0.2683 14LYS SC1 1125 14.754 14.612 7.403 0.3722 0.1382 -0.2506 14LYS SC2 1126 14.853 14.916 7.335 -0.0105 0.1627 -0.0017 15GLU BB 1127 14.674 14.196 7.181 0.1176 0.1434 -0.2374 15GLU SC1 1128 14.765 13.847 7.410 -0.1449 0.2047 -0.1759 16LYS BB 1129 14.864 14.289 6.975 0.3562 -0.1224 0.0187 16LYS SC1 1130 14.814 14.624 6.994 0.0862 0.4497 0.1835 16LYS SC2 1131 14.692 14.908 6.857 -0.2763 0.0735 0.1141 17GLY BB 1132 15.186 14.353 6.914 -0.2144 -0.0918 0.2943 18GLY BB 1133 15.405 14.074 6.839 -0.0598 -0.0418 -0.0597 19LYS BB 1134 15.628 13.913 7.010 0.2237 -0.0358 0.0706 19LYS SC1 1135 15.478 13.974 7.269 -0.0711 -0.0948 -0.1787 19LYS SC2 1136 15.552 14.246 7.518 0.0558 0.0038 -0.2900 20ASN BB 1137 15.913 14.034 7.077 0.0287 0.0500 -0.1487 20ASN SC1 1138 15.978 14.184 7.384 -0.0545 -0.2915 -0.2284 21ALA BB 1139 16.150 14.017 6.918 0.2893 -0.2002 -0.0039 21ALA SC1 1140 16.092 13.914 6.675 -0.2188 -0.4642 0.2135 22ILE BB 1141 16.403 14.052 7.093 -0.0620 0.1115 0.2373 22ILE SC1 1142 16.521 14.147 6.787 -0.2773 -0.3575 -0.0030 23ASN BB 1143 16.559 13.785 7.121 0.1913 0.0210 0.3555 23ASN SC1 1144 16.609 13.722 7.416 0.2350 0.1683 -0.0185 24MET BB 1145 16.353 13.599 6.914 0.0999 -0.1371 -0.1969 24MET SC1 1146 16.473 13.762 6.622 0.0324 0.0070 -0.1209 25LYS BB 1147 16.042 13.559 6.942 0.1648 0.0868 -0.0621 25LYS SC1 1148 15.923 13.312 6.758 0.0474 -0.2180 -0.2013 25LYS SC2 1149 15.774 13.154 6.990 0.3234 -0.1380 -0.3403 26ASP BB 1150 15.901 13.515 7.258 0.1253 0.1207 -0.2436 26ASP SC1 1151 16.127 13.756 7.368 -0.0239 -0.0140 -0.3016 27VAL BB 1152 15.843 13.245 7.464 0.2607 -0.0494 -0.2621 27VAL SC1 1153 15.836 12.963 7.387 -0.1989 -0.1702 0.1673 28LYS BB 1154 15.860 13.326 7.790 0.0700 -0.3513 -0.1293 28LYS SC1 1155 15.619 13.468 7.975 -0.0243 0.1669 -0.1012 28LYS SC2 1156 15.420 13.752 7.904 0.2185 -0.0175 0.0214 29ASP BB 1157 15.872 13.096 7.995 -0.1417 -0.0307 -0.3806 29ASP SC1 1158 15.843 13.168 8.364 -0.0909 -0.0793 0.1371 30LEU BB 1159 15.857 12.798 7.784 -0.0087 0.0877 -0.0843 30LEU SC1 1160 16.168 12.797 7.611 -0.0526 -0.1889 0.1673 31GLY BB 1161 15.557 12.730 7.578 -0.0261 0.0476 -0.1045 32LYS BB 1162 15.298 12.724 7.732 -0.1893 0.0123 0.0465 32LYS SC1 1163 15.206 12.404 7.791 0.1976 -0.0563 0.1323 32LYS SC2 1164 15.033 12.277 7.550 -0.4994 0.3423 -0.0535 33THR BB 1165 15.060 12.777 7.502 0.0937 0.0880 -0.2725 33THR SC1 1166 15.009 12.586 7.270 -0.5466 0.0712 -0.1364 34MET BB 1167 14.877 13.007 7.615 -0.0449 -0.2275 0.1751 34MET SC1 1168 14.968 13.021 7.969 -0.1670 0.1080 -0.0424 35LYS BB 1169 14.521 12.950 7.671 -0.2420 -0.0941 0.3993 35LYS SC1 1170 14.517 12.974 7.961 -0.0995 -0.1056 0.3024 35LYS SC2 1171 14.369 12.956 8.277 -0.0114 0.1299 0.3159 36ASP BB 1172 14.272 12.857 7.471 -0.2027 0.0608 -0.2492 36ASP SC1 1173 14.050 13.098 7.429 0.0472 0.1560 -0.0229 37GLN BB 1174 14.069 12.604 7.393 0.0270 -0.0508 -0.0952 37GLN SC1 1175 14.225 12.323 7.202 0.2271 0.1859 0.2065 38ALA BB 1176 13.887 12.720 7.196 -0.1587 -0.4378 0.1731 38ALA SC1 1177 13.892 12.547 6.989 -0.0717 -0.1078 -0.1101 39LEU BB 1178 13.660 12.978 7.228 -0.0176 0.1120 0.0295 39LEU SC1 1179 13.624 13.155 6.939 0.1256 -0.2280 0.1020 40LYS BB 1180 13.457 12.932 7.407 0.0142 -0.2731 -0.1352 40LYS SC1 1181 13.280 12.782 7.218 0.2074 -0.1665 0.1312 40LYS SC2 1182 12.931 12.763 7.166 -0.0250 0.0660 0.2681 41ASP BB 1183 13.343 12.896 7.727 0.2609 -0.1228 -0.2054 41ASP SC1 1184 13.009 13.043 7.601 -0.0643 0.0734 0.2887 42ASP BB 1185 13.463 12.887 8.009 -0.0167 -0.0267 0.0072 42ASP SC1 1186 13.330 12.590 8.115 -0.3357 0.2227 0.4790 43ASP BB 1187 13.621 13.144 8.133 -0.0552 -0.0176 -0.1063 43ASP SC1 1188 13.925 12.959 8.212 0.1814 0.2007 -0.1395 44ALA BB 1189 13.613 13.306 8.456 0.0441 0.1295 -0.1551 44ALA SC1 1190 13.456 13.150 8.611 0.0956 0.3738 0.1523 45GLU BB 1191 13.553 13.600 8.433 0.1311 -0.1155 -0.0078 45GLU SC1 1192 13.204 13.482 8.273 0.0176 -0.1047 0.3101 46THR BB 1193 13.479 13.809 8.595 0.0712 -0.1960 0.1947 46THR SC1 1194 13.656 13.955 8.797 0.1119 -0.0289 0.0407 47GLY BB 1195 13.159 13.935 8.389 0.2638 -0.1028 -0.0005 48LEU BB 1196 13.097 14.217 8.299 -0.0319 -0.1297 0.0524 48LEU SC1 1197 13.086 14.522 8.517 -0.0875 -0.0107 -0.0903 49THR BB 1198 12.884 14.212 8.077 -0.0105 0.1989 0.2284 49THR SC1 1199 12.881 13.909 8.039 -0.4168 0.1910 0.2794 50ASP BB 1200 13.000 14.262 7.790 -0.2316 0.1751 -0.1751 50ASP SC1 1201 13.321 14.315 7.879 0.0663 0.3852 -0.0152 51GLY BB 1202 12.992 14.495 7.595 0.0427 -0.2613 0.3150 52GLU BB 1203 12.930 14.835 7.498 -0.1369 -0.0081 0.0310 52GLU SC1 1204 12.774 14.722 7.163 0.3993 -0.0677 0.1054 53GLU BB 1205 13.035 15.115 7.592 -0.2457 -0.0530 -0.0965 53GLU SC1 1206 13.018 15.168 7.952 -0.4465 0.2348 0.2394 54LYS BB 1207 13.211 15.250 7.371 0.3907 -0.2147 -0.0929 54LYS SC1 1208 13.031 15.510 7.349 0.2247 -0.1503 -0.2025 54LYS SC2 1209 12.836 15.787 7.255 -0.0136 0.1475 -0.1926 55GLU BB 1210 13.498 15.064 7.307 0.0456 -0.1151 -0.0965 55GLU SC1 1211 13.683 15.214 7.621 -0.2551 -0.0799 0.1600 56GLU BB 1212 13.595 15.065 7.011 0.0144 0.0744 0.1530 56GLU SC1 1213 13.357 15.349 6.891 0.0312 -0.1502 -0.2533 57PRO BB 1214 13.829 15.197 6.819 -0.0979 -0.1856 -0.4731 57PRO SC1 1215 13.784 15.061 6.580 0.1191 -0.0567 0.1253 58LYS BB 1216 14.055 15.470 6.874 0.1253 0.0505 0.1211 58LYS SC1 1217 14.070 15.422 6.575 -0.1503 -0.0504 0.0801 58LYS SC2 1218 13.935 15.709 6.338 0.1432 0.1985 -0.2147 59GLU BB 1219 14.242 15.467 7.096 0.0903 -0.0725 -0.0630 59GLU SC1 1220 14.205 15.828 7.220 -0.3116 -0.1141 0.0114 60GLU BB 1221 14.532 15.276 7.115 -0.0458 0.2009 0.3409 60GLU SC1 1222 14.368 14.896 7.226 0.2210 -0.0059 0.0494 61GLU BB 1223 14.857 15.313 7.037 0.0246 0.0471 0.3346 61GLU SC1 1224 14.947 15.600 6.724 0.2008 -0.0886 -0.0123 1LYS BB 1225 24.988 4.599 8.788 -0.0503 0.2220 -0.0204 1LYS SC1 1226 25.011 4.280 8.906 -0.3084 -0.0133 0.1897 1LYS SC2 1227 25.134 3.989 8.906 0.1479 0.1520 0.3216 2LYS BB 1228 24.680 4.585 8.996 0.1685 -0.0536 -0.0232 2LYS SC1 1229 24.555 4.915 9.041 -0.2664 0.0583 -0.1737 2LYS SC2 1230 24.564 5.223 9.196 -0.1473 -0.1765 -0.1738 3CYS BB 1231 24.510 4.320 8.962 -0.5011 0.1144 0.0847 3CYS SC1 1232 24.645 3.990 9.045 0.1055 0.1960 -0.3758 4LEU BB 1233 24.182 4.387 8.998 0.2540 0.0352 -0.0719 4LEU SC1 1234 24.228 4.068 9.197 0.0421 -0.0131 0.4012 5PHE BB 1235 24.196 4.567 9.271 0.0126 0.1015 0.0460 5PHE SC1 1236 24.481 4.480 9.351 0.1449 0.1207 0.0180 5PHE SC2 1237 24.561 4.150 9.368 0.4255 0.1640 -0.3422 5PHE SC3 1238 24.786 4.333 9.370 0.2681 0.3637 -0.0388 6LYS BB 1239 23.947 4.627 9.465 -0.0761 -0.1399 -0.0794 6LYS SC1 1240 23.910 4.830 9.666 -0.1594 -0.0712 0.1019 6LYS SC2 1241 23.955 5.129 9.861 -0.1087 0.0397 0.0225 7LYS BB 1242 23.570 4.614 9.409 -0.2317 -0.0414 -0.1244 7LYS SC1 1243 23.445 4.571 9.707 -0.2422 -0.1162 0.0897 7LYS SC2 1244 23.433 4.676 10.078 0.1214 0.0675 -0.1628 8LYS BB 1245 23.350 4.813 9.201 0.0122 0.0316 -0.3599 8LYS SC1 1246 23.341 5.074 9.335 0.1411 0.5943 0.0351 8LYS SC2 1247 23.442 5.399 9.297 0.2414 -0.0156 0.2497 9ASN BB 1248 23.237 4.798 8.924 -0.2598 0.0818 -0.0403 9ASN SC1 1249 23.488 4.817 8.652 -0.0138 -0.7870 -0.0876 10LYS BB 1250 23.083 4.564 8.801 0.0967 0.1825 0.1319 10LYS SC1 1251 23.124 4.499 8.530 0.0399 -0.0338 0.2724 10LYS SC2 1252 23.200 4.447 8.245 0.3141 -0.2245 0.1260 11LYS BB 1253 23.143 4.320 9.038 -0.1137 -0.2267 -0.0083 11LYS SC1 1254 23.461 4.408 9.046 0.0019 0.1142 -0.2647 11LYS SC2 1255 23.764 4.481 8.942 0.0170 -0.0654 0.1059 12LYS BB 1256 23.127 4.336 9.346 -0.0774 0.0321 -0.2316 12LYS SC1 1257 23.393 4.168 9.496 0.0839 0.2075 -0.1447 12LYS SC2 1258 23.528 3.854 9.607 0.3917 0.1300 0.0420 13GLY BB 1259 22.837 4.315 9.543 -0.2046 0.2206 0.4169 14LYS BB 1260 22.548 4.170 9.603 -0.4635 0.1304 0.3258 14LYS SC1 1261 22.433 4.483 9.609 -0.0419 -0.0237 0.3014 14LYS SC2 1262 22.201 4.707 9.565 0.1703 0.0183 0.0813 15GLU BB 1263 22.325 4.037 9.388 0.0795 0.0233 0.3233 15GLU SC1 1264 22.092 4.335 9.251 0.3783 0.1854 0.0665 16LYS BB 1265 22.431 3.910 9.131 0.0894 -0.4577 -0.1589 16LYS SC1 1266 22.461 3.646 8.980 0.2860 0.1574 -0.3732 16LYS SC2 1267 22.709 3.547 8.791 0.1402 0.0507 0.4979 17GLY BB 1268 22.658 3.973 8.895 0.1048 -0.3375 -0.0844 18GLY BB 1269 22.996 3.862 8.921 0.3292 -0.0294 -0.0423 19LYS BB 1270 23.156 3.560 8.887 -0.0017 -0.3788 0.0173 19LYS SC1 1271 23.113 3.499 8.570 -0.2493 0.0903 0.1901 19LYS SC2 1272 23.405 3.396 8.413 0.0351 0.0612 -0.0820 20ASN BB 1273 23.147 3.248 8.972 0.1130 -0.1142 -0.2554 20ASN SC1 1274 23.470 3.195 9.023 0.1810 0.1825 -0.0627 21ALA BB 1275 22.897 3.060 9.129 -0.2619 -0.0931 0.1325 21ALA SC1 1276 22.820 2.801 9.136 0.1898 -0.2424 -0.0895 22ILE BB 1277 22.583 3.122 8.967 -0.2168 -0.0311 0.0224 22ILE SC1 1278 22.515 2.818 8.827 0.1058 -0.2043 0.2281 23ASN BB 1279 22.309 3.241 9.092 -0.2597 -0.2494 -0.1430 23ASN SC1 1280 22.366 3.393 9.351 -0.1231 0.2051 -0.1361 24MET BB 1281 22.075 3.269 8.841 -0.1332 -0.2073 0.0273 24MET SC1 1282 22.114 2.924 8.658 -0.0289 -0.1185 0.0236 25LYS BB 1283 22.002 3.568 8.831 -0.1472 0.1929 0.2127 25LYS SC1 1284 21.980 3.633 9.146 -0.1507 0.2562 -0.0923 25LYS SC2 1285 22.013 3.690 9.522 0.0815 0.0275 0.2278 26ASP BB 1286 22.168 3.771 8.660 0.1578 0.0626 -0.1652 26ASP SC1 1287 21.885 3.873 8.445 0.0590 -0.2396 -0.1165 27VAL BB 1288 22.275 3.608 8.416 0.3327 -0.2554 -0.1905 27VAL SC1 1289 22.333 3.326 8.464 0.1623 -0.3149 -0.3236 28LYS BB 1290 21.968 3.439 8.254 -0.0301 -0.0611 -0.0555 28LYS SC1 1291 21.678 3.440 8.424 0.4181 -0.0523 -0.0808 28LYS SC2 1292 21.543 3.687 8.736 -0.1466 -0.2090 0.0467 29ASP BB 1293 21.806 3.643 8.070 0.0431 -0.3000 0.0340 29ASP SC1 1294 21.932 3.629 7.719 0.0445 0.1448 0.2039 30LEU BB 1295 21.754 3.964 8.044 -0.1015 -0.1262 0.0301 30LEU SC1 1296 21.507 4.091 7.805 0.2775 -0.0952 0.1785 31GLY BB 1297 21.977 4.196 8.088 -0.1510 -0.1234 0.2089 32LYS BB 1298 21.971 4.399 8.305 0.1426 0.0964 -0.2692 32LYS SC1 1299 22.047 4.317 8.590 0.1108 -0.1791 0.1880 32LYS SC2 1300 22.268 4.240 8.844 0.0590 -0.1288 -0.0939 33THR BB 1301 21.920 4.707 8.354 -0.0761 0.2076 -0.1695 33THR SC1 1302 21.732 4.705 8.594 0.1605 0.2264 0.0202 34MET BB 1303 22.083 5.063 8.335 0.2784 0.0672 0.0270 34MET SC1 1304 21.785 5.247 8.382 -0.0315 0.1179 -0.0869 35LYS BB 1305 22.416 5.135 8.279 0.5087 -0.1765 -0.2529 35LYS SC1 1306 22.364 5.199 8.013 0.0153 -0.5853 -0.3044 35LYS SC2 1307 22.036 5.194 7.871 0.0669 -0.1672 -0.1003 36ASP BB 1308 22.608 4.879 8.361 0.1210 0.1296 0.1205 36ASP SC1 1309 22.338 4.709 8.461 0.0663 -0.0386 -0.0380 37GLN BB 1310 22.930 4.810 8.319 -0.0997 -0.0490 0.0089 37GLN SC1 1311 23.142 5.081 8.512 0.4259 -0.0230 -0.0429 38ALA BB 1312 23.076 4.974 8.100 -0.2706 0.1067 0.2271 38ALA SC1 1313 23.109 4.803 7.894 0.2209 0.5393 -0.0762 39LEU BB 1314 23.231 5.220 7.991 -0.0609 0.1159 0.0195 39LEU SC1 1315 23.584 5.250 7.967 -0.3039 0.5211 -0.2414 40LYS BB 1316 23.015 5.460 7.930 0.0782 -0.0127 0.2667 40LYS SC1 1317 23.021 5.733 7.761 0.3357 0.1156 0.0859 40LYS SC2 1318 23.089 5.870 7.430 -0.0879 0.2304 -0.0189 41ASP BB 1319 22.693 5.496 7.918 0.2907 0.0508 0.0298 41ASP SC1 1320 22.655 5.551 8.244 -0.0138 -0.2049 -0.0368 42ASP BB 1321 22.568 5.729 7.819 -0.1374 -0.1995 -0.1741 42ASP SC1 1322 22.336 5.494 7.633 -0.0974 -0.1980 0.1607 43ASP BB 1323 22.544 6.054 7.744 0.0021 0.0102 0.1173 43ASP SC1 1324 22.879 6.158 7.742 -0.0037 0.0415 0.3567 44ALA BB 1325 22.285 6.206 7.860 0.0968 0.1724 -0.0059 44ALA SC1 1326 22.205 5.948 7.871 0.1720 0.1525 0.0955 45GLU BB 1327 22.316 6.501 7.847 -0.0635 -0.2017 0.0297 45GLU SC1 1328 22.151 6.538 7.569 -0.0325 -0.1611 0.1737 46THR BB 1329 22.163 6.600 8.139 -0.0247 0.1320 -0.0271 46THR SC1 1330 22.199 6.375 8.342 0.2959 0.3973 0.2219 47GLY BB 1331 22.309 6.879 8.284 -0.1456 -0.0231 0.1073 48LEU BB 1332 22.252 7.151 8.403 0.1593 -0.1508 -0.1454 48LEU SC1 1333 22.183 7.193 8.767 0.1361 -0.0501 0.2272 49THR BB 1334 22.379 7.407 8.308 -0.1191 -0.2823 -0.2903 49THR SC1 1335 22.538 7.399 8.048 0.2929 -0.0604 -0.0563 50ASP BB 1336 22.597 7.495 8.484 0.1711 -0.1714 0.3771 50ASP SC1 1337 22.589 7.782 8.680 0.0792 0.4242 -0.0868 51GLY BB 1338 22.835 7.318 8.624 -0.0393 0.1367 0.1496 52GLU BB 1339 23.138 7.222 8.537 -0.1452 -0.1201 -0.1054 52GLU SC1 1340 23.393 7.378 8.736 0.1261 -0.2137 -0.1614 53GLU BB 1341 23.110 7.337 8.225 -0.0913 -0.1069 -0.1406 53GLU SC1 1342 22.990 7.689 8.271 -0.3439 0.0918 -0.0948 54LYS BB 1343 23.307 7.268 8.015 -0.1273 0.0417 -0.0351 54LYS SC1 1344 23.494 7.550 7.895 -0.0773 -0.0843 -0.0379 54LYS SC2 1345 23.765 7.628 7.712 0.1085 -0.0855 0.0397 55GLU BB 1346 23.590 7.135 8.087 -0.0390 -0.0081 0.3057 55GLU SC1 1347 23.475 6.865 8.362 0.1586 -0.1043 -0.1429 56GLU BB 1348 23.869 7.328 8.051 -0.1936 -0.1196 -0.0476 56GLU SC1 1349 24.024 7.621 8.266 -0.0503 -0.1569 -0.1607 57PRO BB 1350 24.130 7.292 7.840 0.2487 0.2466 0.6847 57PRO SC1 1351 24.179 7.634 7.842 -0.2395 0.0714 -0.1738 58LYS BB 1352 24.152 7.380 7.497 0.2814 0.2588 0.2362 58LYS SC1 1353 24.444 7.379 7.568 -0.1109 0.1445 -0.0816 58LYS SC2 1354 24.484 7.740 7.506 -0.1785 0.0534 -0.0728 59GLU BB 1355 23.948 7.242 7.209 -0.0728 -0.1951 0.3475 59GLU SC1 1356 23.922 7.400 6.857 0.0101 0.2876 0.0353 60GLU BB 1357 24.053 6.954 7.246 0.0539 0.0358 -0.0444 60GLU SC1 1358 24.364 6.727 7.152 -0.0697 0.0204 0.0942 61GLU BB 1359 23.861 6.769 7.441 -0.3871 -0.1544 -0.0987 61GLU SC1 1360 23.554 6.695 7.305 -0.2069 -0.0960 -0.0843 1LYS BB 1361 12.731 6.698 18.092 0.1195 0.3564 -0.1893 1LYS SC1 1362 12.738 6.577 17.827 -0.1617 0.1146 0.0812 1LYS SC2 1363 12.629 6.405 17.525 -0.1249 0.2306 -0.0327 2LYS BB 1364 12.846 7.006 18.160 0.0575 -0.1468 -0.2431 2LYS SC1 1365 12.771 7.243 17.991 0.2310 0.3869 0.2568 2LYS SC2 1366 12.526 7.382 17.715 0.2421 0.2709 -0.0247 3CYS BB 1367 13.155 7.017 18.276 0.0787 -0.3232 0.0095 3CYS SC1 1368 13.023 7.021 18.579 0.0369 -0.1534 0.1028 4LEU BB 1369 13.412 7.060 18.070 -0.0105 0.6006 -0.2040 4LEU SC1 1370 13.347 7.372 17.978 0.3291 -0.0814 0.1542 5PHE BB 1371 13.689 7.094 18.232 -0.2253 -0.0702 -0.4426 5PHE SC1 1372 13.699 7.266 18.478 -0.1188 -0.1341 0.1541 5PHE SC2 1373 13.872 7.558 18.454 -0.1159 -0.1492 -0.0191 5PHE SC3 1374 13.997 7.353 18.616 0.0825 -0.1973 -0.2277 6LYS BB 1375 13.846 7.330 18.071 -0.0149 0.3299 0.3143 6LYS SC1 1376 14.158 7.420 18.225 -0.3417 -0.2873 0.0564 6LYS SC2 1377 14.301 7.686 18.406 -0.0169 -0.1351 -0.0761 7LYS BB 1378 13.812 7.288 17.748 -0.2067 -0.1250 -0.0731 7LYS SC1 1379 13.602 7.087 17.690 -0.2611 0.1221 0.0468 7LYS SC2 1380 13.529 6.744 17.700 -0.3364 -0.2154 0.2445 8LYS BB 1381 13.949 7.491 17.530 -0.0008 -0.0606 -0.4860 8LYS SC1 1382 13.912 7.737 17.715 0.1100 0.0389 0.0318 8LYS SC2 1383 13.924 8.071 17.779 -0.0688 0.1527 -0.1353 9ASN BB 1384 14.049 7.368 17.290 0.0254 -0.2478 0.0322 9ASN SC1 1385 13.820 7.318 17.114 -0.2210 0.0073 0.1582 10LYS BB 1386 14.358 7.399 17.264 -0.1335 0.1457 0.1181 10LYS SC1 1387 14.368 7.586 17.077 -0.2057 -0.2603 -0.2760 10LYS SC2 1388 14.566 7.841 17.050 0.0450 0.0922 -0.3984 11LYS BB 1389 14.659 7.498 17.403 -0.2068 -0.0868 0.1201 11LYS SC1 1390 14.619 7.753 17.560 -0.4607 0.1526 -0.0381 11LYS SC2 1391 14.671 8.069 17.637 -0.0259 0.0360 0.1795 12LYS BB 1392 14.959 7.596 17.287 -0.1851 0.0467 -0.0223 12LYS SC1 1393 15.201 7.732 17.083 -0.0284 0.0105 0.0580 12LYS SC2 1394 15.509 7.694 16.921 0.0509 0.0104 -0.3724 13GLY BB 1395 15.082 7.758 17.550 0.0967 -0.1501 0.2884 14LYS BB 1396 14.982 7.624 17.825 -0.1602 -0.0751 0.1121 14LYS SC1 1397 14.760 7.352 17.796 -0.1791 0.1382 0.0251 14LYS SC2 1398 14.635 7.077 17.587 0.1498 0.1932 0.1690 15GLU BB 1399 14.884 7.885 18.017 -0.0058 -0.0412 0.0051 15GLU SC1 1400 14.492 7.916 18.026 -0.0900 0.2471 0.4992 16LYS BB 1401 14.993 8.203 18.056 -0.2987 0.3424 -0.0978 16LYS SC1 1402 14.972 8.312 18.390 0.1155 0.4135 0.1260 16LYS SC2 1403 14.820 8.216 18.696 -0.0119 0.1352 0.1965 17GLY BB 1404 15.295 8.175 18.158 -0.1624 0.4076 -0.0030 18GLY BB 1405 15.405 8.070 17.861 -0.0098 0.0692 0.3136 19LYS BB 1406 15.492 7.788 17.813 0.1876 -0.1383 -0.2153 19LYS SC1 1407 15.334 7.721 18.051 0.3687 -0.2963 -0.2119 19LYS SC2 1408 15.152 7.799 18.360 -0.1555 -0.1047 0.0992 20ASN BB 1409 15.781 7.765 17.649 -0.1926 -0.0435 0.2376 20ASN SC1 1410 16.009 7.451 17.690 -0.0382 0.0921 -0.1723 21ALA BB 1411 15.954 7.900 17.902 0.1217 -0.0808 -0.0988 21ALA SC1 1412 16.160 7.909 17.727 0.6866 0.2741 0.5340 22ILE BB 1413 15.847 7.768 18.222 -0.2917 0.1766 -0.0372 22ILE SC1 1414 15.696 7.499 18.076 0.0402 -0.0446 0.0170 23ASN BB 1415 15.625 7.962 18.324 -0.0550 0.0492 0.3060 23ASN SC1 1416 15.687 8.284 18.146 -0.4334 -0.1358 0.3561 24MET BB 1417 15.781 8.111 18.598 -0.0975 0.0927 -0.1740 24MET SC1 1418 16.017 8.335 18.400 0.1145 0.0502 0.2510 25LYS BB 1419 15.996 7.968 18.750 -0.1807 0.3531 0.0473 25LYS SC1 1420 15.892 8.121 19.053 -0.1117 0.0380 -0.0036 25LYS SC2 1421 15.834 8.101 19.402 -0.0243 0.1930 0.0099 26ASP BB 1422 15.876 7.653 18.829 -0.0363 0.1792 -0.0074 26ASP SC1 1423 15.780 7.690 19.174 -0.2039 0.3841 0.1699 27VAL BB 1424 15.868 7.335 18.656 -0.0617 0.1399 -0.0894 27VAL SC1 1425 15.897 7.079 18.794 0.1051 0.0196 -0.3411 28LYS BB 1426 15.702 7.264 18.397 -0.1948 0.2491 -0.1114 28LYS SC1 1427 15.659 6.989 18.432 -0.2770 -0.2801 -0.1364 28LYS SC2 1428 15.639 6.672 18.353 -0.0259 -0.0389 -0.0483 29ASP BB 1429 15.457 7.441 18.432 0.2059 -0.2884 -0.0342 29ASP SC1 1430 15.433 7.699 18.654 0.1895 -0.0306 0.1118 30LEU BB 1431 15.210 7.316 18.271 0.3254 -0.0424 -0.1565 30LEU SC1 1432 15.295 6.964 18.183 0.0313 0.1334 -0.0594 31GLY BB 1433 15.004 7.455 18.555 0.2518 -0.0149 -0.1723 32LYS BB 1434 15.056 7.305 18.812 0.0136 0.0272 0.0478 32LYS SC1 1435 15.378 7.244 18.836 0.1435 -0.2127 0.0681 32LYS SC2 1436 15.631 7.311 19.019 -0.0125 0.0532 -0.1435 33THR BB 1437 14.847 7.098 18.909 -0.1147 0.1330 -0.1226 33THR SC1 1438 14.750 7.272 19.140 -0.0752 0.0893 -0.0727 34MET BB 1439 14.858 6.811 19.049 0.0681 -0.0691 -0.0307 34MET SC1 1440 14.490 6.764 19.016 0.0715 0.0232 -0.4782 35LYS BB 1441 15.028 6.524 19.042 -0.1353 -0.0882 0.0327 35LYS SC1 1442 15.321 6.490 19.100 -0.5541 -0.0518 0.0241 35LYS SC2 1443 15.449 6.151 19.048 0.0903 -0.2124 0.1377 36ASP BB 1444 15.043 6.440 18.744 -0.2582 0.4672 0.0718 36ASP SC1 1445 15.379 6.359 18.674 -0.1486 0.0904 -0.1007 37GLN BB 1446 14.841 6.249 18.622 0.2326 0.0241 -0.2059 37GLN SC1 1447 14.935 6.003 18.888 -0.0453 0.0483 -0.2291 38ALA BB 1448 14.563 6.335 18.567 -0.1748 -0.3786 -0.0581 38ALA SC1 1449 14.464 6.222 18.342 0.1507 -0.1739 -0.3125 39LEU BB 1450 14.319 6.507 18.677 -0.1853 -0.4472 -0.1691 39LEU SC1 1451 13.980 6.507 18.778 -0.2634 -0.0137 0.0673 40LYS BB 1452 14.260 6.821 18.604 0.0143 0.0959 -0.1087 40LYS SC1 1453 13.981 6.956 18.735 0.0650 0.1011 0.7363 40LYS SC2 1454 13.704 7.074 18.862 0.3861 -0.1997 0.1923 41ASP BB 1455 14.438 7.069 18.567 -0.1228 0.0499 -0.0835 41ASP SC1 1456 14.815 7.063 18.424 0.0308 -0.1630 -0.1625 42ASP BB 1457 14.431 7.322 18.691 0.0696 -0.2043 0.0820 42ASP SC1 1458 14.239 7.251 18.968 -0.0854 0.1421 -0.0131 43ASP BB 1459 14.608 7.581 18.772 -0.0741 0.0473 0.0765 43ASP SC1 1460 14.709 7.814 18.506 -0.4557 -0.1531 0.3684 44ALA BB 1461 14.558 7.631 19.052 0.1506 0.0499 -0.0509 44ALA SC1 1462 14.755 7.715 19.217 -0.2848 -0.2795 0.6861 45GLU BB 1463 14.240 7.655 19.181 0.2341 0.0993 -0.0390 45GLU SC1 1464 14.116 7.734 18.832 -0.3814 0.0996 -0.1350 46THR BB 1465 14.263 7.708 19.580 0.2439 0.1386 0.2848 46THR SC1 1466 14.329 7.495 19.788 0.0119 -0.0714 0.1486 47GLY BB 1467 14.264 7.934 19.820 -0.1412 0.4167 -0.0819 48LEU BB 1468 13.997 7.920 20.022 0.0026 -0.0194 -0.3174 48LEU SC1 1469 14.222 7.797 20.239 0.1283 0.0594 0.1405 49THR BB 1470 13.807 7.862 19.777 -0.1598 -0.1572 -0.1607 49THR SC1 1471 13.759 7.561 19.775 0.1441 -0.2090 -0.3939 50ASP BB 1472 13.728 8.130 19.649 -0.1556 0.4828 0.1519 50ASP SC1 1473 13.928 8.323 19.794 -0.1077 -0.1091 0.0586 51GLY BB 1474 13.390 8.210 19.631 -0.0655 -0.0339 0.0233 52GLU BB 1475 13.134 8.000 19.561 0.0496 -0.2838 -0.0376 52GLU SC1 1476 13.249 7.736 19.834 0.0604 0.0684 0.0100 53GLU BB 1477 13.125 7.998 19.205 -0.1145 -0.4174 0.0091 53GLU SC1 1478 12.876 8.244 19.032 0.2367 -0.0907 -0.0134 54LYS BB 1479 13.145 7.747 18.982 0.2103 0.0989 -0.1821 54LYS SC1 1480 13.211 7.917 18.725 0.1852 -0.2793 -0.0961 54LYS SC2 1481 13.272 8.071 18.435 0.5524 -0.3982 0.1776 55GLU BB 1482 12.893 7.545 18.887 0.1093 0.3106 0.1801 55GLU SC1 1483 12.818 7.318 19.176 0.3409 -0.2046 -0.1525 56GLU BB 1484 12.747 7.330 18.637 0.2110 -0.0600 -0.0517 56GLU SC1 1485 12.925 7.503 18.366 -0.0032 -0.0324 -0.1975 57PRO BB 1486 12.458 7.299 18.353 -0.2652 0.2393 -0.0353 57PRO SC1 1487 12.212 7.401 18.489 -0.1058 -0.0088 0.1865 58LYS BB 1488 12.267 6.997 18.193 0.0499 0.3050 -0.0482 58LYS SC1 1489 12.047 6.884 18.439 0.1900 -0.2589 0.2330 58LYS SC2 1490 11.752 6.765 18.483 -0.0997 -0.1258 -0.0383 59GLU BB 1491 12.272 6.791 17.915 0.2560 -0.0868 0.0542 59GLU SC1 1492 12.168 7.037 17.640 0.0307 -0.1417 -0.0016 60GLU BB 1493 12.287 6.456 17.975 -0.1583 0.0783 0.2132 60GLU SC1 1494 12.319 6.457 18.379 -0.2372 0.1601 0.1309 61GLU BB 1495 12.379 6.196 17.889 -0.1147 0.2659 0.1464 61GLU SC1 1496 12.079 6.183 17.623 0.2824 -0.1687 -0.0784 1LYS BB 1497 17.941 12.516 13.301 -0.1716 0.3392 0.1557 1LYS SC1 1498 17.987 12.345 13.100 0.2395 0.1713 0.1348 1LYS SC2 1499 18.095 12.239 12.778 0.2474 0.1866 0.1445 2LYS BB 1500 18.060 12.880 13.262 -0.1440 0.1552 0.2272 2LYS SC1 1501 17.814 13.015 13.122 0.0515 0.0938 -0.0551 2LYS SC2 1502 17.827 13.153 12.759 -0.0004 0.2012 0.0692 3CYS BB 1503 18.415 12.955 13.283 0.0814 0.1224 0.2333 3CYS SC1 1504 18.570 13.209 13.131 -0.1142 -0.0502 -0.2015 4LEU BB 1505 18.610 12.749 13.442 -0.0252 -0.0526 0.0878 4LEU SC1 1506 18.476 12.752 13.777 0.1184 0.0702 0.1731 5PHE BB 1507 18.885 12.651 13.259 0.1675 0.1598 -0.1063 5PHE SC1 1508 18.720 12.781 13.014 0.1309 0.1626 -0.0876 5PHE SC2 1509 18.759 13.089 12.875 -0.1101 0.2499 0.0323 5PHE SC3 1510 18.679 12.880 12.691 -0.2110 0.3175 -0.0016 6LYS BB 1511 19.116 12.820 13.360 -0.1306 0.1092 -0.0746 6LYS SC1 1512 18.883 13.094 13.388 0.1179 0.0667 0.0053 6LYS SC2 1513 18.656 13.270 13.569 0.2055 0.2092 -0.3029 7LYS BB 1514 19.247 13.015 13.117 0.2158 0.1585 -0.2833 7LYS SC1 1515 19.495 13.136 13.302 0.2407 0.0331 0.2525 7LYS SC2 1516 19.544 13.210 13.662 -0.0990 0.0666 0.0939 8LYS BB 1517 19.374 12.876 12.822 0.1067 0.0504 -0.1784 8LYS SC1 1518 19.088 12.769 12.804 -0.0217 -0.1227 0.4007 8LYS SC2 1519 18.878 12.558 12.622 0.0511 -0.2213 -0.1708 9ASN BB 1520 19.683 12.993 12.817 0.4414 -0.2128 0.3955 9ASN SC1 1521 19.897 13.153 13.010 -0.1350 -0.0705 0.4173 10LYS BB 1522 19.873 13.022 12.556 0.1210 0.3646 -0.0953 10LYS SC1 1523 20.105 12.792 12.622 0.1592 0.0249 0.1529 10LYS SC2 1524 20.338 12.868 12.423 -0.1353 0.0047 0.1388 11LYS BB 1525 19.863 12.861 12.257 -0.1116 0.1707 -0.1132 11LYS SC1 1526 19.875 12.700 11.978 0.2731 0.2524 -0.2284 11LYS SC2 1527 19.526 12.631 11.825 -0.2290 0.4285 0.4409 12LYS BB 1528 19.563 12.977 12.160 0.2187 -0.0697 -0.0062 12LYS SC1 1529 19.473 13.214 12.369 0.1189 0.1457 0.3180 12LYS SC2 1530 19.429 13.531 12.227 -0.1297 0.1140 -0.0196 13GLY BB 1531 19.426 13.119 11.889 -0.3661 0.0604 -0.2148 14LYS BB 1532 19.423 12.995 11.530 -0.1809 -0.2817 -0.1626 14LYS SC1 1533 19.143 12.911 11.425 -0.0804 0.2739 -0.4277 14LYS SC2 1534 18.849 13.007 11.174 -0.1778 -0.2023 -0.2555 15GLU BB 1535 19.571 12.793 11.358 -0.2343 0.5967 0.0895 15GLU SC1 1536 19.598 12.383 11.424 -0.2154 -0.0948 0.1025 16LYS BB 1537 19.850 12.882 11.115 0.0854 -0.2654 0.0699 16LYS SC1 1538 19.926 12.560 11.041 -0.1791 0.0278 0.2840 16LYS SC2 1539 20.046 12.280 11.146 -0.0157 0.0231 -0.5019 17GLY BB 1540 20.148 12.969 11.232 -0.1331 -0.0901 0.2756 18GLY BB 1541 20.117 13.229 10.941 -0.1332 -0.1876 0.2646 19LYS BB 1542 20.262 13.557 11.070 -0.1264 -0.0304 0.2248 19LYS SC1 1543 20.060 13.769 10.972 -0.0096 -0.2074 -0.0312 19LYS SC2 1544 19.842 13.779 10.741 0.0059 -0.0605 -0.4056 20ASN BB 1545 20.592 13.638 10.862 0.1023 -0.1637 0.0194 20ASN SC1 1546 20.409 13.883 10.660 -0.0418 0.0417 -0.0321 21ALA BB 1547 20.924 13.675 10.926 -0.0417 -0.1057 0.1152 21ALA SC1 1548 20.893 13.467 11.096 0.1173 -0.3439 -0.1392 22ILE BB 1549 21.034 13.932 11.105 -0.0521 0.1883 0.2317 22ILE SC1 1550 21.093 13.751 11.388 -0.3103 0.1225 0.2462 23ASN BB 1551 21.269 14.133 11.168 -0.1165 0.1579 -0.0896 23ASN SC1 1552 21.523 13.837 11.152 -0.0245 -0.3519 -0.1103 24MET BB 1553 21.496 14.330 10.931 0.1429 -0.2096 0.1629 24MET SC1 1554 21.881 14.286 11.010 0.3404 0.0605 -0.0950 25LYS BB 1555 21.388 14.644 11.027 -0.3368 -0.0686 0.1791 25LYS SC1 1556 21.565 14.747 10.774 0.3521 -0.2448 0.0372 25LYS SC2 1557 21.765 14.647 10.543 -0.1594 -0.0124 -0.2199 26ASP BB 1558 21.128 14.683 11.173 -0.1472 0.0488 0.0715 26ASP SC1 1559 21.233 14.500 11.461 0.3113 0.1368 -0.1943 27VAL BB 1560 20.960 14.985 11.101 0.1789 -0.1720 0.3501 27VAL SC1 1561 21.134 15.220 11.091 0.1745 -0.1813 -0.1426 28LYS BB 1562 20.690 14.931 10.912 -0.1337 0.2306 0.2461 28LYS SC1 1563 20.742 14.601 10.882 -0.0667 -0.3755 0.1726 28LYS SC2 1564 20.886 14.348 11.057 0.2488 -0.0776 0.1885 29ASP BB 1565 20.437 15.063 10.827 -0.0591 0.1663 0.1762 29ASP SC1 1566 20.402 14.843 10.529 -0.1201 -0.0167 -0.3394 30LEU BB 1567 20.111 15.064 10.844 -0.2534 -0.0168 0.0885 30LEU SC1 1568 20.053 15.208 11.176 0.1558 0.1082 -0.0679 31GLY BB 1569 19.830 14.887 10.765 0.1392 -0.1114 -0.2101 32LYS BB 1570 19.645 15.084 10.579 0.2521 0.1182 0.1610 32LYS SC1 1571 19.815 15.266 10.477 0.0566 0.0758 -0.1824 32LYS SC2 1572 19.918 15.391 10.185 -0.0149 -0.2322 0.0710 33THR BB 1573 19.317 15.153 10.593 0.1301 -0.2362 -0.2572 33THR SC1 1574 19.212 14.867 10.597 -0.2069 -0.1158 -0.1187 34MET BB 1575 19.198 15.175 10.312 -0.4214 0.1898 0.4564 34MET SC1 1576 19.482 15.291 10.075 0.2098 -0.2192 0.1266 35LYS BB 1577 19.082 14.892 10.149 -0.3319 -0.0423 0.1878 35LYS SC1 1578 18.838 14.757 10.321 -0.1286 0.3307 -0.0462 35LYS SC2 1579 18.552 14.607 10.443 -0.4983 0.0923 -0.3630 36ASP BB 1580 19.254 14.638 10.232 0.2903 0.0441 -0.1011 36ASP SC1 1581 19.278 14.522 9.901 -0.1432 -0.5022 -0.1685 37GLN BB 1582 19.546 14.764 10.225 -0.3407 -0.0548 -0.0260 37GLN SC1 1583 19.669 14.515 10.504 0.1805 0.0784 -0.2720 38ALA BB 1584 19.720 14.654 10.014 0.0952 0.2061 -0.1731 38ALA SC1 1585 19.883 14.809 9.865 0.1214 0.3705 0.0214 39LEU BB 1586 19.707 14.405 9.776 -0.2561 0.0028 -0.0027 39LEU SC1 1587 20.038 14.459 9.668 0.1833 0.0127 0.3267 40LYS BB 1588 19.610 14.125 9.792 0.0336 -0.0757 -0.0047 40LYS SC1 1589 19.810 14.040 9.531 -0.1446 -0.2758 0.0805 40LYS SC2 1590 19.918 13.699 9.526 -0.0401 0.3059 -0.1950 41ASP BB 1591 19.674 13.889 9.985 -0.2165 -0.1830 0.2620 41ASP SC1 1592 19.467 13.655 9.924 0.3023 -0.0700 0.2100 42ASP BB 1593 19.978 13.813 9.982 -0.0968 -0.1104 0.1627 42ASP SC1 1594 20.007 13.856 10.321 0.1776 -0.5260 0.1637 43ASP BB 1595 20.175 13.991 9.818 0.0133 0.0142 0.2905 43ASP SC1 1596 20.428 14.095 9.956 -0.2538 0.0411 0.0094 44ALA BB 1597 20.293 13.935 9.503 -0.2078 0.1104 -0.0580 44ALA SC1 1598 20.248 14.201 9.495 -0.2348 0.1442 0.6223 45GLU BB 1599 20.614 13.874 9.538 0.4071 0.0857 -0.0294 45GLU SC1 1600 20.623 14.050 9.191 -0.1794 -0.3222 -0.0779 46THR BB 1601 20.776 13.785 9.790 -0.5042 0.2230 -0.3258 46THR SC1 1602 20.919 14.054 9.810 0.0519 -0.0904 0.3998 47GLY BB 1603 20.762 13.460 9.933 -0.2584 0.4658 0.3003 48LEU BB 1604 21.077 13.366 9.941 0.0752 -0.0777 0.0592 48LEU SC1 1605 21.185 13.708 10.016 0.2078 0.2587 0.2122 49THR BB 1606 21.059 13.091 10.084 0.0392 0.1039 -0.1599 49THR SC1 1607 21.360 13.048 10.095 0.0355 0.0947 -0.0882 50ASP BB 1608 20.834 12.854 10.109 0.1249 0.0310 0.0994 50ASP SC1 1609 20.748 12.835 10.387 -0.1722 -0.5747 -0.1378 51GLY BB 1610 20.846 12.643 9.849 -0.1730 0.0190 0.1402 52GLU BB 1611 21.182 12.539 9.854 0.0518 0.2375 0.3713 52GLU SC1 1612 21.189 12.445 9.487 0.3105 -0.1422 0.0539 53GLU BB 1613 21.486 12.642 9.926 0.3350 0.2008 -0.1574 53GLU SC1 1614 21.671 12.699 10.282 0.0441 -0.2600 -0.2581 54LYS BB 1615 21.622 12.851 9.733 0.1341 0.0237 -0.2788 54LYS SC1 1616 21.513 13.138 9.671 -0.1622 0.0289 -0.1900 54LYS SC2 1617 21.274 13.355 9.429 0.0167 0.0509 -0.0961 55GLU BB 1618 21.915 12.781 9.581 0.2664 0.1301 -0.0589 55GLU SC1 1619 22.123 13.055 9.730 0.0132 0.1931 -0.2018 56GLU BB 1620 21.889 12.552 9.405 0.0043 0.0867 -0.0341 56GLU SC1 1621 22.020 12.276 9.595 0.2212 -0.0984 -0.4126 57PRO BB 1622 21.941 12.428 9.088 0.1799 -0.0057 0.5396 57PRO SC1 1623 22.218 12.326 9.160 -0.1448 -0.0492 -0.0526 58LYS BB 1624 21.698 12.507 8.845 -0.0836 -0.0619 0.2241 58LYS SC1 1625 21.738 12.205 8.764 -0.1958 0.1676 0.0747 58LYS SC2 1626 22.102 12.194 8.686 -0.2247 0.2850 0.0703 59GLU BB 1627 21.752 12.835 8.762 -0.1204 0.1333 0.3794 59GLU SC1 1628 22.137 12.700 8.710 0.0570 0.0380 0.0334 60GLU BB 1629 21.418 13.006 8.827 0.0446 0.1531 -0.1820 60GLU SC1 1630 21.137 12.828 8.654 -0.0141 0.0841 0.0060 61GLU BB 1631 21.429 13.286 8.985 -0.0215 -0.1328 0.1916 61GLU SC1 1632 21.728 13.453 8.867 0.1242 -0.1776 -0.0104 1LYS BB 1633 17.667 8.697 13.198 0.0900 0.3145 -0.1231 1LYS SC1 1634 17.398 8.504 13.152 -0.3117 -0.1075 -0.4839 1LYS SC2 1635 17.427 8.156 13.329 -0.0795 0.2690 0.1077 2LYS BB 1636 17.488 8.944 13.368 -0.1821 0.0848 0.0215 2LYS SC1 1637 17.171 8.968 13.393 -0.2814 0.1447 -0.0406 2LYS SC2 1638 16.918 9.012 13.650 -0.4735 -0.3147 -0.0768 3CYS BB 1639 17.531 9.248 13.424 0.1202 0.1089 0.1054 3CYS SC1 1640 17.285 9.342 13.262 0.3746 -0.1057 0.3829 4LEU BB 1641 17.840 9.389 13.562 0.1580 -0.0734 0.2338 4LEU SC1 1642 17.630 9.650 13.694 -0.2335 0.3957 0.1273 5PHE BB 1643 18.145 9.501 13.405 0.0352 0.1069 -0.1514 5PHE SC1 1644 18.291 9.228 13.504 0.0960 0.0266 -0.1681 5PHE SC2 1645 18.533 9.230 13.743 -0.1934 0.0993 0.1323 5PHE SC3 1646 18.339 9.016 13.765 -0.2094 0.0926 -0.0545 6LYS BB 1647 18.105 9.775 13.212 0.0433 0.1901 0.1360 6LYS SC1 1648 17.923 9.574 13.059 -0.1610 -0.2378 0.0991 6LYS SC2 1649 17.619 9.437 12.979 -0.1556 -0.3796 -0.1250 7LYS BB 1650 17.946 9.987 13.426 0.1383 0.1308 -0.0516 7LYS SC1 1651 17.724 10.066 13.269 0.0302 -0.0018 -0.4539 7LYS SC2 1652 17.441 10.224 13.206 -0.2908 0.0063 0.3229 8LYS BB 1653 17.912 10.008 13.756 -0.1433 -0.2362 -0.0879 8LYS SC1 1654 18.085 9.758 13.807 0.0349 0.0029 -0.1083 8LYS SC2 1655 18.182 9.432 13.927 0.0333 -0.1286 -0.1166 9ASN BB 1656 18.075 10.168 13.995 0.0499 -0.0212 -0.0333 9ASN SC1 1657 17.963 10.148 14.301 -0.2066 0.0679 -0.2422 10LYS BB 1658 18.188 10.471 13.878 0.0969 0.0317 -0.2497 10LYS SC1 1659 18.199 10.341 13.602 -0.0011 -0.0480 0.2777 10LYS SC2 1660 18.406 10.212 13.357 -0.2929 -0.0878 0.0545 11LYS BB 1661 18.080 10.817 13.854 0.1507 0.1394 0.1876 11LYS SC1 1662 18.353 10.916 13.963 -0.1734 0.0397 -0.1877 11LYS SC2 1663 18.561 10.809 14.281 0.2510 0.0968 0.1523 12LYS BB 1664 18.024 10.997 13.592 -0.0145 0.0239 0.2056 12LYS SC1 1665 18.066 11.280 13.633 0.1705 0.0205 0.3570 12LYS SC2 1666 17.917 11.564 13.747 0.2595 -0.3107 0.3380 13GLY BB 1667 17.890 10.888 13.286 0.0617 0.0114 -0.0976 14LYS BB 1668 17.756 11.003 13.027 -0.2131 -0.2246 -0.1690 14LYS SC1 1669 17.566 11.255 13.150 -0.0310 0.0973 0.3734 14LYS SC2 1670 17.542 11.617 13.115 0.2646 -0.2608 -0.2580 15GLU BB 1671 17.771 10.867 12.742 -0.2112 -0.0702 -0.2504 15GLU SC1 1672 17.694 10.458 12.878 -0.1145 -0.1217 -0.1795 16LYS BB 1673 17.862 10.957 12.460 0.0504 0.0462 -0.0102 16LYS SC1 1674 17.733 10.714 12.333 -0.1318 -0.0762 0.1596 16LYS SC2 1675 17.488 10.562 12.475 -0.0015 0.4299 0.1626 17GLY BB 1676 18.149 10.867 12.462 -0.4978 0.2011 0.4114 18GLY BB 1677 18.239 10.668 12.158 -0.0325 -0.2077 0.2551 19LYS BB 1678 18.268 10.674 11.811 -0.0409 0.0799 0.0926 19LYS SC1 1679 18.028 10.915 11.838 -0.0357 -0.0272 -0.1065 19LYS SC2 1680 18.098 11.257 11.924 -0.4102 0.0480 -0.3636 20ASN BB 1681 18.445 10.492 11.617 0.2492 -0.1496 -0.0635 20ASN SC1 1682 18.296 10.237 11.694 -0.4791 0.0552 0.0871 21ALA BB 1683 18.706 10.562 11.376 -0.0934 -0.0995 -0.1008 21ALA SC1 1684 18.507 10.734 11.316 0.1121 0.1736 -0.0183 22ILE BB 1685 18.733 10.505 11.026 -0.1743 -0.1114 -0.1008 22ILE SC1 1686 18.576 10.759 10.863 0.2583 0.1065 -0.1920 23ASN BB 1687 18.895 10.362 10.796 0.1467 0.3053 -0.2868 23ASN SC1 1688 18.723 10.300 10.526 -0.0405 0.1635 -0.1431 24MET BB 1689 19.172 10.351 10.633 0.0121 -0.2520 0.5399 24MET SC1 1690 19.213 10.719 10.569 0.2694 0.1939 -0.5355 25LYS BB 1691 19.227 10.165 10.370 0.2243 -0.0068 -0.0133 25LYS SC1 1692 19.553 10.153 10.462 0.2463 0.0411 0.3245 25LYS SC2 1693 19.783 9.952 10.555 0.1621 0.0887 0.2545 26ASP BB 1694 19.051 9.884 10.348 0.2560 -0.0383 0.4544 26ASP SC1 1695 18.883 9.905 10.639 0.3263 -0.0459 0.1511 27VAL BB 1696 18.792 9.791 10.156 -0.2067 -0.1659 0.0620 27VAL SC1 1697 18.722 10.073 10.125 -0.0156 -0.1275 -0.0335 28LYS BB 1698 18.743 9.646 9.869 0.1327 0.3155 0.1025 28LYS SC1 1699 18.452 9.750 9.956 0.3169 0.0350 0.0445 28LYS SC2 1700 18.355 9.504 10.197 -0.1402 0.0147 0.1445 29ASP BB 1701 19.039 9.572 9.810 0.0463 0.0181 -0.0345 29ASP SC1 1702 19.052 9.246 9.813 -0.3516 0.0188 0.0344 30LEU BB 1703 19.269 9.705 9.916 -0.1965 -0.0000 0.2497 30LEU SC1 1704 19.152 10.047 9.894 0.0913 -0.0310 0.0539 31GLY BB 1705 19.568 9.562 9.916 0.3536 -0.3055 0.2319 32LYS BB 1706 19.685 9.595 9.593 -0.0446 -0.0551 -0.1968 32LYS SC1 1707 20.010 9.577 9.689 -0.1637 0.1012 0.2322 32LYS SC2 1708 20.262 9.318 9.823 0.1237 0.0493 -0.0313 33THR BB 1709 19.516 9.860 9.506 -0.0704 0.0829 0.1865 33THR SC1 1710 19.221 9.937 9.502 -0.0398 0.1957 0.0123 34MET BB 1711 19.640 10.097 9.724 0.1101 0.2231 0.1069 34MET SC1 1712 19.648 10.009 10.040 0.1922 -0.2536 -0.1613 35LYS BB 1713 19.465 10.324 9.666 -0.0060 -0.0752 0.0923 35LYS SC1 1714 19.313 10.456 9.872 -0.0618 0.0516 -0.0946 35LYS SC2 1715 19.375 10.579 10.189 -0.5143 -0.3123 0.2776 36ASP BB 1716 19.354 10.403 9.385 0.0359 0.1403 0.1034 36ASP SC1 1717 19.417 10.139 9.179 0.0990 -0.4780 -0.1326 37GLN BB 1718 19.221 10.625 9.154 -0.0239 0.0664 -0.2440 37GLN SC1 1719 19.470 10.553 8.898 -0.0897 -0.1155 0.1038 38ALA BB 1720 19.219 10.979 9.211 0.1855 0.1444 0.0981 38ALA SC1 1721 19.387 11.020 9.004 0.1022 0.1345 0.0276 39LEU BB 1722 19.305 11.066 9.505 -0.3501 0.0325 0.1306 39LEU SC1 1723 19.024 11.266 9.558 0.6356 -0.1164 0.0372 40LYS BB 1724 19.577 11.223 9.499 -0.0249 0.1450 0.0206 40LYS SC1 1725 19.681 11.228 9.208 -0.1567 -0.1081 -0.5567 40LYS SC2 1726 19.887 11.317 8.923 -0.0634 -0.1961 0.0360 41ASP BB 1727 19.816 11.107 9.682 -0.1699 0.0351 -0.1840 41ASP SC1 1728 19.938 11.393 9.791 0.1343 -0.1619 0.0218 42ASP BB 1729 19.759 10.915 9.927 0.1178 -0.2079 -0.3663 42ASP SC1 1730 19.437 10.904 9.867 0.0025 -0.0960 -0.0567 43ASP BB 1731 19.800 10.576 9.960 -0.1575 -0.1338 0.1987 43ASP SC1 1732 20.053 10.661 10.165 0.0961 0.1651 0.0919 44ALA BB 1733 19.884 10.500 9.701 -0.4066 0.0937 0.0801 44ALA SC1 1734 20.006 10.266 9.643 -0.1503 0.2631 -0.0871 45GLU BB 1735 20.129 10.721 9.632 0.2337 0.1568 -0.3536 45GLU SC1 1736 20.230 10.634 9.295 -0.1636 0.2898 -0.0490 46THR BB 1737 20.315 10.887 9.862 -0.1374 0.0995 -0.0406 46THR SC1 1738 20.151 11.087 10.024 -0.2978 0.0506 -0.1406 47GLY BB 1739 20.593 10.879 9.995 -0.4627 0.1351 0.1744 48LEU BB 1740 20.826 10.953 9.711 -0.1612 -0.0283 -0.0395 48LEU SC1 1741 20.856 11.307 9.836 -0.0336 -0.1518 0.0556 49THR BB 1742 21.083 10.745 9.549 -0.0985 -0.2974 0.1982 49THR SC1 1743 21.130 10.462 9.650 -0.0355 -0.3185 0.1108 50ASP BB 1744 21.293 10.781 9.282 0.1004 -0.1592 -0.0592 50ASP SC1 1745 21.184 10.549 9.096 -0.0130 -0.0099 -0.3518 51GLY BB 1746 21.222 11.023 9.011 -0.1177 0.1336 -0.0089 52GLU BB 1747 21.053 10.997 8.729 -0.1504 0.1703 -0.1104 52GLU SC1 1748 20.690 11.154 8.834 0.3256 0.0372 0.3765 53GLU BB 1749 21.299 11.173 8.525 0.0248 0.0147 -0.1527 53GLU SC1 1750 21.277 11.001 8.167 -0.1161 0.0339 -0.1806 54LYS BB 1751 21.575 11.313 8.663 -0.0604 -0.1317 0.1508 54LYS SC1 1752 21.765 11.142 8.862 0.3039 -0.5111 -0.2861 54LYS SC2 1753 21.718 10.782 9.014 -0.0839 -0.1556 0.0302 55GLU BB 1754 21.858 11.405 8.540 -0.1473 0.4517 0.1707 55GLU SC1 1755 22.013 11.697 8.725 0.1345 -0.1418 -0.2598 56GLU BB 1756 22.068 11.154 8.539 -0.1551 -0.3645 0.2196 56GLU SC1 1757 21.955 10.831 8.577 -0.2324 0.2252 0.0219 57PRO BB 1758 22.401 11.097 8.581 0.0853 0.3058 0.2426 57PRO SC1 1759 22.525 10.873 8.376 -0.1928 -0.0078 -0.2580 58LYS BB 1760 22.693 11.171 8.802 -0.0204 -0.0910 -0.1975 58LYS SC1 1761 23.007 11.084 8.731 0.3325 0.0653 -0.2104 58LYS SC2 1762 23.286 10.833 8.658 0.2206 0.2022 0.0775 59GLU BB 1763 22.738 11.431 8.934 -0.2983 0.2652 0.1294 59GLU SC1 1764 22.474 11.486 9.255 -0.0876 -0.0519 0.2268 60GLU BB 1765 22.875 11.645 8.810 -0.0039 -0.1108 -0.3479 60GLU SC1 1766 23.200 11.583 8.609 -0.0776 -0.3885 -0.2035 61GLU BB 1767 22.858 11.960 8.768 0.0205 0.0522 -0.2464 61GLU SC1 1768 22.881 12.235 9.083 -0.1569 -0.1422 -0.3153 1LYS BB 1769 17.164 8.303 10.000 -0.1875 0.1663 -0.0069 1LYS SC1 1770 16.986 8.041 9.936 -0.3019 0.2496 0.1531 1LYS SC2 1771 16.956 7.678 9.915 -0.1733 -0.0833 0.2832 2LYS BB 1772 17.011 8.389 10.236 0.3757 0.0098 0.0174 2LYS SC1 1773 16.729 8.426 10.356 0.1640 -0.2046 0.0398 2LYS SC2 1774 16.426 8.243 10.292 -0.0284 -0.1443 0.2223 3CYS BB 1775 17.092 8.317 10.597 0.0176 0.2717 -0.2634 3CYS SC1 1776 16.780 8.203 10.676 -0.2510 -0.0520 0.0999 4LEU BB 1777 16.973 8.586 10.751 -0.0585 0.1561 0.3013 4LEU SC1 1778 17.249 8.585 10.935 0.0536 -0.1430 0.0374 5PHE BB 1779 16.858 8.774 10.539 0.1838 0.0663 0.0408 5PHE SC1 1780 17.010 9.039 10.555 -0.1697 0.0862 -0.0998 5PHE SC2 1781 16.935 9.313 10.368 -0.3423 -0.0561 -0.2421 5PHE SC3 1782 17.217 9.246 10.381 -0.2932 0.1610 -0.1589 6LYS BB 1783 16.529 8.849 10.447 0.3029 0.1172 -0.0047 6LYS SC1 1784 16.562 9.144 10.291 -0.0953 0.1930 0.2499 6LYS SC2 1785 16.589 9.252 9.938 -0.0834 -0.2910 0.1385 7LYS BB 1786 16.295 8.855 10.637 -0.2995 -0.1222 0.2618 7LYS SC1 1787 16.344 8.887 10.941 -0.0323 -0.2739 0.0166 7LYS SC2 1788 16.459 9.142 11.171 0.0354 0.0953 0.2296 8LYS BB 1789 15.928 8.875 10.559 0.0091 -0.0892 -0.2106 8LYS SC1 1790 15.740 8.881 10.815 0.1261 0.2055 -0.0887 8LYS SC2 1791 15.545 9.129 10.965 0.1197 0.0683 0.1702 9ASN BB 1792 15.712 8.626 10.437 -0.0538 -0.0093 0.0107 9ASN SC1 1793 15.700 8.637 10.158 0.0106 -0.1544 -0.1503 10LYS BB 1794 15.675 8.410 10.690 -0.1618 0.1180 -0.0430 10LYS SC1 1795 15.488 8.378 10.963 0.0648 0.1515 -0.1884 10LYS SC2 1796 15.485 8.622 11.190 0.3536 -0.0571 0.2513 11LYS BB 1797 15.861 8.168 10.847 0.0061 -0.0587 0.2284 11LYS SC1 1798 16.080 8.269 11.062 0.1099 0.0304 -0.0190 11LYS SC2 1799 16.268 8.267 11.312 0.2137 0.0440 -0.0894 12LYS BB 1800 15.638 7.904 10.956 -0.2522 -0.2011 0.1146 12LYS SC1 1801 15.586 7.830 11.266 0.1568 -0.2560 -0.0735 12LYS SC2 1802 15.743 7.755 11.515 -0.1452 -0.2088 -0.4305 13GLY BB 1803 15.369 8.010 10.888 0.0895 0.1010 -0.2042 14LYS BB 1804 15.173 7.761 11.072 -0.3657 0.3480 0.1472 14LYS SC1 1805 15.085 7.531 10.890 -0.0550 0.0411 -0.2492 14LYS SC2 1806 15.156 7.176 10.898 -0.1072 0.0036 -0.0194 15GLU BB 1807 14.889 7.720 11.268 0.0037 -0.2658 0.2926 15GLU SC1 1808 14.655 7.469 11.123 -0.0630 0.0829 0.1717 16LYS BB 1809 15.031 7.771 11.535 0.0239 0.1607 -0.2328 16LYS SC1 1810 14.902 7.535 11.685 0.0762 -0.1749 0.0763 16LYS SC2 1811 14.746 7.374 11.970 0.4090 0.0234 -0.1296 17GLY BB 1812 15.323 7.604 11.573 -0.1360 0.1439 0.3551 18GLY BB 1813 15.469 7.293 11.594 -0.1358 -0.2421 0.0906 19LYS BB 1814 15.799 7.256 11.570 0.1630 -0.0364 0.0236 19LYS SC1 1815 15.917 6.905 11.484 -0.2629 0.2237 0.0860 19LYS SC2 1816 16.196 6.721 11.580 -0.1364 0.1059 -0.1171 20ASN BB 1817 16.082 7.251 11.673 0.4369 -0.1397 0.0169 20ASN SC1 1818 16.074 7.216 12.003 -0.1959 -0.2614 0.0140 21ALA BB 1819 16.175 7.573 11.547 0.1665 -0.3586 -0.0581 21ALA SC1 1820 16.110 7.655 11.796 0.0835 -0.3395 -0.0858 22ILE BB 1821 16.500 7.545 11.542 -0.0934 -0.0027 0.4370 22ILE SC1 1822 16.553 7.863 11.655 0.1649 0.1196 -0.0041 23ASN BB 1823 16.758 7.568 11.400 0.1053 -0.2162 0.2818 23ASN SC1 1824 16.961 7.735 11.135 -0.1703 -0.0999 -0.2526 24MET BB 1825 16.997 7.393 11.531 -0.2073 -0.3102 -0.1150 24MET SC1 1826 17.252 7.454 11.211 0.3205 -0.0953 -0.1376 25LYS BB 1827 17.297 7.474 11.688 0.2380 0.1079 0.0490 25LYS SC1 1828 17.342 7.714 11.536 0.0056 0.2237 0.2051 25LYS SC2 1829 17.348 7.964 11.273 0.0313 -0.1425 0.3053 26ASP BB 1830 17.545 7.223 11.633 0.0915 -0.1249 0.0195 26ASP SC1 1831 17.299 7.036 11.461 0.0413 -0.1472 -0.3210 27VAL BB 1832 17.845 7.319 11.536 0.1679 -0.1052 -0.3805 27VAL SC1 1833 17.731 7.569 11.438 -0.1326 -0.1656 -0.1994 28LYS BB 1834 17.998 7.019 11.486 0.1785 0.0497 0.1444 28LYS SC1 1835 18.230 7.195 11.595 -0.1751 -0.0753 0.2273 28LYS SC2 1836 18.174 7.437 11.822 -0.2848 0.2609 -0.2500 29ASP BB 1837 17.884 6.892 11.788 0.1057 0.0685 -0.0382 29ASP SC1 1838 17.872 7.147 12.020 -0.0622 -0.3670 -0.0114 30LEU BB 1839 17.634 6.731 11.893 0.0563 0.2229 -0.1231 30LEU SC1 1840 17.818 6.503 12.111 0.1013 -0.1563 0.3207 31GLY BB 1841 17.613 6.857 12.222 0.1611 -0.3743 0.0043 32LYS BB 1842 17.942 6.826 12.308 0.0842 0.2185 -0.0593 32LYS SC1 1843 17.974 6.607 12.489 -0.2348 -0.0270 -0.0047 32LYS SC2 1844 18.172 6.333 12.556 -0.0200 0.1950 -0.3112 33THR BB 1845 18.000 7.100 12.497 -0.1326 0.1002 -0.1611 33THR SC1 1846 17.763 7.285 12.445 -0.1440 0.1539 0.0708 34MET BB 1847 17.991 6.985 12.811 0.2923 -0.1769 0.1693 34MET SC1 1848 18.178 6.660 12.942 0.0417 -0.0643 0.0683 35LYS BB 1849 17.858 7.050 13.127 -0.0203 0.1003 0.0611 35LYS SC1 1850 17.688 6.776 13.093 0.2046 0.0653 -0.2475 35LYS SC2 1851 17.444 6.564 12.936 0.0783 -0.1774 -0.2046 36ASP BB 1852 18.144 7.180 13.207 0.1047 0.2120 -0.0224 36ASP SC1 1853 18.194 7.205 13.570 -0.2229 -0.3314 -0.1015 37GLN BB 1854 18.140 7.516 13.227 -0.1188 -0.0543 0.0736 37GLN SC1 1855 18.490 7.672 13.362 0.0376 0.5155 0.0436 38ALA BB 1856 18.250 7.700 12.975 0.1448 0.3411 0.1636 38ALA SC1 1857 18.016 7.831 13.006 -0.1295 -0.1163 0.1276 39LEU BB 1858 18.416 7.953 12.943 0.0782 -0.0385 0.2866 39LEU SC1 1859 18.290 8.080 13.245 0.4137 0.0467 0.2395 40LYS BB 1860 18.765 8.032 12.898 0.0187 -0.0393 -0.0480 40LYS SC1 1861 18.796 8.047 12.566 0.1608 -0.3106 -0.1267 40LYS SC2 1862 18.980 8.013 12.285 -0.1263 0.2396 0.0504 41ASP BB 1863 18.935 8.313 12.896 -0.1059 0.0998 0.1674 41ASP SC1 1864 19.215 8.159 13.062 -0.2336 -0.1836 0.3296 42ASP BB 1865 18.917 8.534 12.614 -0.0094 0.1702 -0.4236 42ASP SC1 1866 18.712 8.761 12.600 0.0310 -0.0165 0.1419 43ASP BB 1867 18.789 8.416 12.239 -0.0084 0.0732 -0.0119 43ASP SC1 1868 19.146 8.395 12.211 0.0731 -0.0326 -0.0157 44ALA BB 1869 18.496 8.490 12.077 -0.0544 0.1461 -0.2548 44ALA SC1 1870 18.348 8.340 12.247 -0.1848 0.1172 -0.3915 45GLU BB 1871 18.383 8.477 11.769 -0.2349 -0.0994 -0.1750 45GLU SC1 1872 18.366 8.890 11.703 -0.0962 0.1256 -0.3230 46THR BB 1873 18.087 8.385 11.586 0.3385 -0.0032 -0.1660 46THR SC1 1874 17.858 8.550 11.702 0.1577 -0.2359 -0.1860 47GLY BB 1875 18.262 8.188 11.433 -0.3879 0.0362 0.0456 48LEU BB 1876 18.337 8.093 11.107 0.2493 -0.1012 0.0882 48LEU SC1 1877 18.341 7.749 11.091 -0.2159 -0.0465 -0.0398 49THR BB 1878 18.554 8.147 10.903 -0.2221 0.1193 0.1644 49THR SC1 1879 18.424 8.043 10.647 0.0220 -0.0502 0.1054 50ASP BB 1880 18.764 8.396 10.888 -0.2358 0.3147 -0.0285 50ASP SC1 1881 18.983 8.220 11.076 0.0874 0.2530 0.1665 51GLY BB 1882 18.602 8.685 10.885 0.1088 0.1498 -0.0051 52GLU BB 1883 18.460 8.729 10.639 -0.0277 -0.1347 -0.0207 52GLU SC1 1884 18.434 8.419 10.471 -0.2556 -0.0933 -0.0100 53GLU BB 1885 18.571 8.987 10.445 -0.1075 0.1235 -0.2249 53GLU SC1 1886 18.327 9.250 10.663 -0.2210 0.0883 -0.2506 54LYS BB 1887 18.935 9.018 10.358 0.0343 -0.1131 0.2043 54LYS SC1 1888 18.964 8.854 10.100 0.3115 0.0661 -0.1158 54LYS SC2 1889 18.849 8.848 9.757 -0.1339 0.2242 -0.1097 55GLU BB 1890 19.240 9.031 10.528 -0.0060 0.2337 0.2250 55GLU SC1 1891 19.356 8.713 10.354 0.1151 -0.0558 -0.0353 56GLU BB 1892 19.371 9.172 10.710 -0.1360 0.1345 0.0847 56GLU SC1 1893 19.294 9.009 11.063 0.0101 0.0377 -0.0090 57PRO BB 1894 19.454 9.463 10.847 -0.0348 -0.0428 -0.0510 57PRO SC1 1895 19.704 9.682 10.868 0.0014 -0.0409 -0.3008 58LYS BB 1896 19.152 9.504 10.976 -0.1867 -0.6481 -0.2767 58LYS SC1 1897 19.097 9.510 10.653 -0.3674 -0.1174 0.1173 58LYS SC2 1898 19.106 9.428 10.284 0.2044 0.2447 0.2600 59GLU BB 1899 19.189 9.715 11.256 0.2331 0.0736 0.1161 59GLU SC1 1900 19.474 9.925 11.248 -0.3267 -0.1921 0.1672 60GLU BB 1901 18.913 9.745 11.506 -0.2601 0.0649 0.0538 60GLU SC1 1902 18.647 10.025 11.416 -0.3189 -0.0313 -0.2653 61GLU BB 1903 19.093 9.848 11.739 0.0332 -0.1383 -0.0540 61GLU SC1 1904 19.110 9.570 11.939 0.2124 0.0673 0.2244 1LYS BB 1905 26.689 3.692 9.398 -0.0823 0.0772 -0.0861 1LYS SC1 1906 26.571 3.679 9.631 0.0707 0.0218 0.1240 1LYS SC2 1907 26.624 3.604 9.971 0.3043 -0.0089 -0.1572 2LYS BB 1908 27.009 3.801 9.397 0.0940 -0.1119 0.0051 2LYS SC1 1909 27.083 4.062 9.609 0.0274 -0.1473 0.4821 2LYS SC2 1910 27.410 4.017 9.762 -0.1408 -0.1349 0.0436 3CYS BB 1911 27.289 3.640 9.462 0.3867 0.3458 -0.0312 3CYS SC1 1912 27.025 3.445 9.597 0.0498 -0.3410 0.0180 4LEU BB 1913 27.428 3.355 9.337 -0.2478 0.1968 -0.2566 4LEU SC1 1914 27.724 3.343 9.566 0.2076 -0.1904 0.2909 5PHE BB 1915 27.387 3.129 9.054 -0.0732 0.0096 0.2302 5PHE SC1 1916 27.531 2.885 9.210 -0.0574 -0.0553 0.2601 5PHE SC2 1917 27.627 2.597 9.056 0.0004 0.1237 -0.0471 5PHE SC3 1918 27.469 2.562 9.297 0.3273 -0.1689 0.1335 6LYS BB 1919 27.122 3.179 8.871 -0.0536 -0.1802 -0.1515 6LYS SC1 1920 26.876 2.970 8.847 0.0773 -0.2611 -0.2137 6LYS SC2 1921 26.551 2.934 8.866 0.1058 -0.0555 -0.0456 7LYS BB 1922 27.164 3.394 8.573 0.0337 -0.1486 -0.2205 7LYS SC1 1923 27.427 3.441 8.610 -0.0195 0.0364 -0.2452 7LYS SC2 1924 27.698 3.511 8.825 0.2794 -0.1444 0.0700 8LYS BB 1925 26.932 3.639 8.655 -0.1508 -0.1566 -0.1382 8LYS SC1 1926 27.061 3.886 8.478 -0.2073 -0.1454 -0.4509 8LYS SC2 1927 27.232 4.165 8.298 -0.3584 0.4870 0.0167 9ASN BB 1928 26.658 3.647 8.845 -0.0072 -0.1091 0.2685 9ASN SC1 1929 26.641 3.356 8.710 0.1919 0.0880 -0.1461 10LYS BB 1930 26.355 3.709 8.880 0.1988 -0.1571 -0.0792 10LYS SC1 1931 26.280 3.628 8.608 -0.0597 0.0394 0.1516 10LYS SC2 1932 26.301 3.384 8.329 -0.1381 -0.1148 -0.1368 11LYS BB 1933 26.359 3.907 9.136 -0.0057 -0.1341 -0.0335 11LYS SC1 1934 26.138 4.096 8.927 -0.3707 0.0016 0.0239 11LYS SC2 1935 25.953 4.376 8.829 0.0372 -0.0554 0.0159 12LYS BB 1936 26.241 3.885 9.440 -0.1722 -0.0850 0.2852 12LYS SC1 1937 26.361 4.093 9.609 -0.2161 0.0178 -0.0487 12LYS SC2 1938 26.436 4.428 9.709 -0.0248 -0.2914 -0.2680 13GLY BB 1939 25.917 3.825 9.532 -0.0828 0.4322 -0.4166 14LYS BB 1940 25.773 3.500 9.552 -0.4141 -0.0475 0.2944 14LYS SC1 1941 25.805 3.432 9.863 0.1150 0.2379 -0.1925 14LYS SC2 1942 25.859 3.604 10.190 -0.2229 0.2628 -0.0639 15GLU BB 1943 25.891 3.277 9.369 0.0197 0.0738 -0.0014 15GLU SC1 1944 26.237 3.384 9.270 -0.0668 0.0966 0.0026 16LYS BB 1945 25.755 3.188 9.057 0.0036 0.2649 0.2451 16LYS SC1 1946 25.493 3.330 8.947 -0.0695 -0.2106 -0.2239 16LYS SC2 1947 25.196 3.121 8.975 0.0978 -0.2549 -0.1802 17GLY BB 1948 25.891 2.937 8.944 -0.3505 0.3166 -0.0760 18GLY BB 1949 25.853 2.597 9.055 0.1511 0.1966 0.0594 19LYS BB 1950 26.054 2.266 9.112 -0.1611 -0.2466 -0.0280 19LYS SC1 1951 26.071 2.194 8.789 0.2841 0.3710 -0.0442 19LYS SC2 1952 26.014 2.291 8.451 -0.4472 0.0429 -0.2594 20ASN BB 1953 26.267 2.376 9.244 0.2016 0.2405 -0.1846 20ASN SC1 1954 26.462 2.107 9.203 0.0183 -0.3741 -0.2784 21ALA BB 1955 26.298 2.561 9.499 0.0642 -0.1569 0.2072 21ALA SC1 1956 26.249 2.515 9.760 0.2143 -0.0106 0.2630 22ILE BB 1957 26.631 2.627 9.553 -0.1126 -0.0214 0.1311 22ILE SC1 1958 26.660 2.878 9.323 0.3536 0.2228 0.4390 23ASN BB 1959 26.748 2.751 9.861 0.1510 0.2365 0.6377 23ASN SC1 1960 27.017 2.917 9.870 -0.2811 0.0487 -0.1932 24MET BB 1961 26.487 2.663 10.080 0.0898 0.1336 -0.3209 24MET SC1 1962 26.249 2.333 10.158 -0.0023 -0.4122 -0.1427 25LYS BB 1963 26.401 2.806 10.354 -0.1844 0.0660 -0.0277 25LYS SC1 1964 26.094 2.828 10.399 -0.5963 0.2508 0.1102 25LYS SC2 1965 25.782 2.815 10.460 -0.1019 -0.2111 -0.1765 26ASP BB 1966 26.565 3.091 10.358 0.0181 0.0533 -0.4175 26ASP SC1 1967 26.454 3.177 10.047 -0.0245 0.1248 -0.2695 27VAL BB 1968 26.824 3.170 10.545 0.0692 0.0960 0.0468 27VAL SC1 1969 27.113 3.203 10.564 0.1225 -0.3031 0.0110 28LYS BB 1970 26.773 3.497 10.659 -0.0611 -0.0207 0.0432 28LYS SC1 1971 27.031 3.640 10.529 -0.0350 0.1390 0.0231 28LYS SC2 1972 27.250 3.916 10.465 0.1168 0.1121 -0.2466 29ASP BB 1973 26.901 3.634 10.988 0.0548 0.4611 -0.0307 29ASP SC1 1974 26.678 3.682 11.253 0.0504 0.0750 -0.0735 30LEU BB 1975 27.077 3.884 10.902 -0.0365 -0.2543 0.0920 30LEU SC1 1976 26.822 3.997 10.726 -0.0511 0.0179 -0.0769 31GLY BB 1977 27.374 4.008 11.001 -0.0699 0.0487 0.2148 32LYS BB 1978 27.541 4.025 11.308 -0.1896 0.1601 0.4139 32LYS SC1 1979 27.406 4.174 11.502 0.2622 -0.0964 0.1365 32LYS SC2 1980 27.244 4.441 11.573 -0.4848 0.0631 -0.3448 33THR BB 1981 27.742 3.783 11.416 0.1982 0.0829 0.1258 33THR SC1 1982 27.677 3.568 11.210 -0.0127 0.0592 0.2152 34MET BB 1983 27.943 3.946 11.592 -0.0526 0.0671 -0.2342 34MET SC1 1984 27.636 4.041 11.889 -0.1069 -0.3516 -0.1611 35LYS BB 1985 28.240 4.124 11.587 -0.2643 0.2004 0.1561 35LYS SC1 1986 28.362 3.987 11.865 -0.0812 0.1354 0.3304 35LYS SC2 1987 28.683 3.864 11.867 0.0693 0.0045 -0.2317 36ASP BB 1988 28.542 4.043 11.471 0.2237 -0.1675 -0.0569 36ASP SC1 1989 28.761 4.281 11.581 0.3359 0.0177 -0.2751 37GLN BB 1990 28.681 3.844 11.381 0.4735 0.0813 -0.0028 37GLN SC1 1991 29.052 3.804 11.460 0.3807 0.0892 0.0671 38ALA BB 1992 28.533 3.628 11.192 0.0427 -0.1130 -0.2088 38ALA SC1 1993 28.471 3.414 11.345 -0.0258 0.0046 -0.0698 39LEU BB 1994 28.486 3.784 10.903 0.3474 -0.0489 -0.0176 39LEU SC1 1995 28.701 3.664 10.692 -0.1049 -0.0531 -0.0861 40LYS BB 1996 28.439 4.078 10.975 -0.0593 0.2409 0.0810 40LYS SC1 1997 28.715 4.149 11.051 0.2032 -0.4078 0.1274 40LYS SC2 1998 28.694 4.437 11.187 0.1627 -0.3775 -0.0697 41ASP BB 1999 28.260 4.296 11.122 0.1875 0.0618 0.2107 41ASP SC1 2000 28.153 4.478 10.820 -0.0165 -0.3845 0.1841 42ASP BB 2001 27.970 4.223 11.205 -0.1161 -0.0184 0.4816 42ASP SC1 2002 27.967 3.927 10.981 0.0183 -0.1867 -0.2017 43ASP BB 2003 27.764 4.352 11.067 -0.2214 0.2574 0.4195 43ASP SC1 2004 27.508 4.518 11.242 -0.2974 -0.0738 0.0383 44ALA BB 2005 27.686 4.296 10.773 0.0929 -0.2757 -0.0319 44ALA SC1 2006 27.421 4.339 10.803 0.1579 -0.0510 0.2638 45GLU BB 2007 27.812 4.219 10.439 0.1346 -0.4210 -0.1063 45GLU SC1 2008 27.615 3.993 10.193 0.1453 -0.1361 0.0079 46THR BB 2009 28.115 4.131 10.552 -0.1913 0.1437 0.0637 46THR SC1 2010 28.188 3.837 10.587 0.0093 0.1870 0.0183 47GLY BB 2011 28.398 4.175 10.398 0.4518 -0.4156 -0.1223 48LEU BB 2012 28.560 4.365 10.236 -0.0174 -0.1290 0.0045 48LEU SC1 2013 28.860 4.441 10.428 0.0740 -0.1158 0.3608 49THR BB 2014 28.605 4.269 9.908 0.1908 0.1663 0.2440 49THR SC1 2015 28.573 4.497 9.709 0.0468 0.1650 0.2650 50ASP BB 2016 28.446 4.007 9.877 0.5069 0.2554 0.0487 50ASP SC1 2017 28.281 4.124 9.604 0.2618 -0.0863 -0.2328 51GLY BB 2018 28.537 3.755 9.654 0.0900 -0.4493 -0.1214 52GLU BB 2019 28.865 3.715 9.591 -0.2462 -0.1541 0.3045 52GLU SC1 2020 28.888 3.577 9.961 -0.2097 -0.0246 -0.1619 53GLU BB 2021 29.056 3.642 9.309 -0.0136 0.1382 0.1132 53GLU SC1 2022 29.143 4.000 9.205 0.0291 -0.3916 0.2456 54LYS BB 2023 29.032 3.314 9.161 -0.3145 0.0148 0.0566 54LYS SC1 2024 29.222 3.398 8.894 -0.1964 -0.2344 0.1893 54LYS SC2 2025 29.530 3.371 8.790 0.1472 0.0384 0.1186 55GLU BB 2026 28.760 3.165 9.033 0.3035 0.2455 0.0868 55GLU SC1 2027 28.707 2.884 9.278 0.2748 0.1715 0.0023 56GLU BB 2028 28.871 3.109 8.750 -0.1513 -0.0781 0.1806 56GLU SC1 2029 28.589 3.248 8.482 -0.0412 0.3139 -0.0515 57PRO BB 2030 28.907 2.821 8.561 0.0794 0.1744 -0.1006 57PRO SC1 2031 28.709 2.745 8.319 0.1383 0.0179 -0.1004 58LYS BB 2032 29.204 2.697 8.531 -0.2538 0.1087 -0.0688 58LYS SC1 2033 29.273 2.741 8.225 0.0666 0.0700 -0.1136 58LYS SC2 2034 29.432 2.829 7.907 -0.1940 0.1276 -0.4086 59GLU BB 2035 29.474 2.586 8.712 -0.3327 0.3707 -0.0177 59GLU SC1 2036 29.715 2.923 8.830 0.3705 0.2551 0.2885 60GLU BB 2037 29.532 2.502 9.013 -0.2672 0.1189 0.0238 60GLU SC1 2038 29.612 2.134 8.905 0.1386 -0.3935 -0.1237 61GLU BB 2039 29.368 2.562 9.283 -0.0862 0.0182 0.0759 61GLU SC1 2040 29.029 2.498 9.276 0.0327 -0.0827 -0.2143 1LYS BB 2041 7.544 7.630 23.527 -0.2244 -0.3790 0.0761 1LYS SC1 2042 7.295 7.806 23.629 0.1613 0.1742 -0.0138 1LYS SC2 2043 7.077 7.830 23.902 -0.0487 -0.2505 0.3084 2LYS BB 2044 7.862 7.694 23.660 -0.2148 -0.1196 0.0367 2LYS SC1 2045 7.875 8.041 23.730 -0.0656 -0.0005 0.2868 2LYS SC2 2046 8.118 8.223 23.974 -0.1585 -0.2265 -0.0724 3CYS BB 2047 7.885 7.383 23.790 0.0481 0.1002 -0.1121 3CYS SC1 2048 8.165 7.545 23.902 0.5637 -0.3120 0.0740 4LEU BB 2049 7.868 7.346 24.141 -0.0073 0.3614 0.0449 4LEU SC1 2050 7.648 7.060 24.108 0.2755 0.0021 0.2850 5PHE BB 2051 7.815 7.515 24.426 0.1630 -0.0680 -0.1578 5PHE SC1 2052 7.669 7.772 24.470 0.0012 0.0064 0.0581 5PHE SC2 2053 7.669 8.002 24.721 0.1366 0.1437 -0.0656 5PHE SC3 2054 7.902 8.007 24.548 0.0820 -0.0042 -0.1453 6LYS BB 2055 8.097 7.484 24.561 0.1357 0.2049 -0.0778 6LYS SC1 2056 8.221 7.782 24.608 0.0698 0.1571 -0.0848 6LYS SC2 2057 8.250 8.048 24.907 0.0552 -0.1991 -0.0974 7LYS BB 2058 8.378 7.310 24.516 -0.1050 0.0252 -0.0853 7LYS SC1 2059 8.460 7.356 24.220 -0.0853 0.1548 0.0713 7LYS SC2 2060 8.654 7.258 23.960 -0.0127 0.3218 -0.1311 8LYS BB 2061 8.583 7.092 24.739 -0.0075 -0.3375 -0.2649 8LYS SC1 2062 8.367 6.897 24.722 -0.0116 -0.3130 0.0322 8LYS SC2 2063 8.191 6.655 24.798 0.4519 0.0476 0.2027 9ASN BB 2064 8.621 7.283 24.973 -0.0994 0.0122 0.0161 9ASN SC1 2065 8.864 7.194 25.220 0.0783 0.0466 -0.1440 10LYS BB 2066 8.477 7.561 24.961 0.1626 0.1214 -0.0502 10LYS SC1 2067 8.237 7.428 25.085 0.2461 -0.2765 0.2943 10LYS SC2 2068 8.047 7.480 25.423 0.3501 -0.3318 0.0516 11LYS BB 2069 8.562 7.827 25.139 0.1210 0.2606 0.1491 11LYS SC1 2070 8.809 7.682 25.356 -0.0701 -0.4491 -0.3081 11LYS SC2 2071 9.064 7.882 25.500 -0.0610 -0.2708 0.0882 12LYS BB 2072 8.451 7.980 25.435 -0.2208 -0.0950 0.1229 12LYS SC1 2073 8.211 8.187 25.549 -0.3306 -0.1473 -0.0310 12LYS SC2 2074 7.999 8.464 25.646 -0.2518 -0.2665 0.0086 13GLY BB 2075 8.687 8.136 25.524 -0.0650 -0.2431 0.1182 14LYS BB 2076 8.887 8.270 25.256 0.1625 -0.1038 -0.1373 14LYS SC1 2077 8.983 8.041 25.067 -0.3645 0.1627 -0.4413 14LYS SC2 2078 8.945 7.883 24.791 0.0679 0.0344 0.0329 15GLU BB 2079 9.110 8.494 25.251 -0.0868 -0.0512 0.3265 15GLU SC1 2080 9.366 8.218 25.361 -0.3388 0.1472 -0.1622 16LYS BB 2081 8.965 8.781 25.185 0.0002 0.0218 0.0161 16LYS SC1 2082 8.771 8.704 24.981 0.0427 0.1423 0.1918 16LYS SC2 2083 8.637 8.915 24.706 -0.1578 -0.0197 0.0325 17GLY BB 2084 9.178 8.893 24.959 0.1764 -0.0659 -0.3523 18GLY BB 2085 9.260 9.104 25.161 -0.0639 0.0149 -0.0710 19LYS BB 2086 9.330 9.441 25.126 -0.1959 0.1027 -0.1254 19LYS SC1 2087 9.111 9.640 25.013 0.0380 0.0286 -0.1073 19LYS SC2 2088 8.820 9.827 24.928 -0.0448 0.2742 -0.0513 20ASN BB 2089 9.572 9.639 25.054 0.0593 -0.0108 -0.1009 20ASN SC1 2090 9.678 9.488 24.784 0.0861 -0.0507 0.1408 21ALA BB 2091 9.766 9.790 25.217 -0.0752 -0.1543 0.0621 21ALA SC1 2092 9.689 10.041 25.155 -0.2281 -0.1935 0.0904 22ILE BB 2093 10.018 9.842 25.092 0.1835 -0.0913 -0.3433 22ILE SC1 2094 10.062 10.164 24.988 -0.2729 0.1416 0.1382 23ASN BB 2095 10.209 9.654 24.920 0.2017 0.1158 -0.2201 23ASN SC1 2096 10.434 9.658 25.165 -0.1632 0.0774 0.0041 24MET BB 2097 10.117 9.400 24.732 -0.0428 0.2298 -0.2004 24MET SC1 2098 10.404 9.528 24.442 -0.1067 0.3409 0.0315 25LYS BB 2099 10.136 9.094 24.793 -0.0485 0.1266 0.2603 25LYS SC1 2100 10.399 9.051 24.636 -0.1841 0.3715 0.1763 25LYS SC2 2101 10.634 9.104 24.431 -0.0408 -0.3611 0.4022 26ASP BB 2102 9.991 8.993 25.029 0.2916 0.1033 0.0712 26ASP SC1 2103 10.000 8.679 24.948 -0.1984 -0.2383 -0.3663 27VAL BB 2104 9.906 9.052 25.340 -0.2560 0.4163 0.3943 27VAL SC1 2105 9.937 8.797 25.479 -0.1732 0.2117 0.0134 28LYS BB 2106 9.708 9.232 25.451 0.1430 0.1041 0.0780 28LYS SC1 2107 9.495 8.979 25.556 -0.6138 -0.0326 -0.2365 28LYS SC2 2108 9.212 8.740 25.627 -0.0110 -0.2849 0.2301 29ASP BB 2109 9.844 9.508 25.597 0.0029 0.2343 0.0173 29ASP SC1 2110 9.650 9.436 25.886 -0.0691 0.0696 -0.3919 30LEU BB 2111 10.149 9.499 25.485 0.2514 0.1955 -0.0194 30LEU SC1 2112 10.171 9.868 25.539 -0.0397 -0.1078 0.0017 31GLY BB 2113 10.383 9.528 25.626 -0.1588 0.2529 0.0456 32LYS BB 2114 10.403 9.397 25.932 -0.2395 -0.2894 -0.1557 32LYS SC1 2115 10.632 9.256 25.776 0.1068 0.1791 0.2606 32LYS SC2 2116 10.935 9.107 25.727 0.0409 0.0910 -0.0857 33THR BB 2117 10.109 9.243 26.001 0.0115 0.2541 -0.0650 33THR SC1 2118 9.971 9.427 26.202 0.0182 0.0536 0.1273 34MET BB 2119 9.946 9.067 25.855 0.1594 -0.1198 0.0803 34MET SC1 2120 10.113 8.740 25.911 -0.1818 0.2340 -0.2963 35LYS BB 2121 9.683 8.915 26.063 -0.0629 -0.1728 0.0445 35LYS SC1 2122 9.842 9.027 26.274 0.5402 -0.1050 -0.2189 35LYS SC2 2123 9.965 9.003 26.571 0.1642 0.0987 0.4709 36ASP BB 2124 9.366 8.962 26.036 -0.3914 -0.1015 0.0677 36ASP SC1 2125 9.216 8.878 26.342 0.2141 -0.5563 -0.0886 37GLN BB 2126 9.200 9.243 25.991 -0.0822 0.1354 0.1622 37GLN SC1 2127 9.091 9.341 26.365 -0.4872 0.1795 0.0084 38ALA BB 2128 9.106 9.196 25.693 -0.1025 0.2618 -0.2151 38ALA SC1 2129 9.272 9.288 25.501 -0.1831 0.0707 -0.3809 39LEU BB 2130 8.852 9.095 25.558 0.0446 0.1915 -0.3310 39LEU SC1 2131 8.889 9.384 25.405 -0.1407 0.4194 0.0643 40LYS BB 2132 8.530 9.050 25.652 -0.2943 0.0139 0.0260 40LYS SC1 2133 8.406 9.309 25.557 -0.2232 -0.2644 0.0215 40LYS SC2 2134 8.122 9.341 25.752 0.1334 -0.4558 -0.1271 41ASP BB 2135 8.334 8.782 25.617 0.0469 -0.1602 -0.2735 41ASP SC1 2136 8.008 8.938 25.626 -0.0879 0.0444 0.2008 42ASP BB 2137 8.510 8.501 25.754 -0.1065 -0.1231 0.0404 42ASP SC1 2138 8.790 8.615 25.588 0.3795 -0.0945 -0.1087 43ASP BB 2139 8.456 8.218 25.924 -0.0171 0.2084 -0.1691 43ASP SC1 2140 8.155 8.305 26.035 -0.1121 0.1111 -0.0930 44ALA BB 2141 8.723 8.202 26.118 0.1680 -0.1957 -0.4115 44ALA SC1 2142 8.811 8.458 26.107 0.5202 -0.2916 -0.0598 45GLU BB 2143 8.811 7.994 26.343 0.0727 -0.1681 -0.0158 45GLU SC1 2144 8.549 7.743 26.235 0.3338 0.1857 -0.4256 46THR BB 2145 9.128 8.016 26.365 -0.1527 0.0688 0.0644 46THR SC1 2146 9.323 7.783 26.393 -0.0824 0.1127 -0.0546 47GLY BB 2147 9.254 8.287 26.462 -0.0194 -0.1026 -0.0869 48LEU BB 2148 9.508 8.147 26.658 -0.2945 -0.2510 -0.2686 48LEU SC1 2149 9.611 8.151 26.298 0.3708 0.1100 -0.0669 49THR BB 2150 9.507 8.283 26.960 0.0876 -0.0656 0.1324 49THR SC1 2151 9.501 8.068 27.176 0.1973 -0.2678 -0.0612 50ASP BB 2152 9.631 8.576 26.949 -0.0940 -0.1142 0.2112 50ASP SC1 2153 9.342 8.700 27.098 0.0226 0.0041 0.1181 51GLY BB 2154 9.966 8.615 26.790 0.7174 0.1170 -0.1089 52GLU BB 2155 10.247 8.576 26.998 0.2434 -0.0863 0.0353 52GLU SC1 2156 10.344 8.882 26.878 -0.3793 -0.1473 -0.3736 53GLU BB 2157 10.328 8.320 27.135 0.1588 -0.0183 0.1173 53GLU SC1 2158 10.318 8.411 27.511 0.2249 0.0165 0.3326 54LYS BB 2159 10.419 8.106 26.887 -0.4067 0.1269 0.2781 54LYS SC1 2160 10.478 7.842 27.087 -0.0911 -0.1430 -0.1218 54LYS SC2 2161 10.322 7.540 27.197 -0.3640 0.1963 -0.2442 55GLU BB 2162 10.519 8.286 26.619 0.1234 -0.0290 0.0160 55GLU SC1 2163 10.503 7.991 26.404 -0.1139 -0.0156 -0.0289 56GLU BB 2164 10.673 8.564 26.661 0.2795 0.1456 -0.1196 56GLU SC1 2165 10.952 8.410 26.900 -0.0752 0.2316 -0.5175 57PRO BB 2166 10.724 8.750 26.407 -0.0983 0.1442 0.0679 57PRO SC1 2167 10.770 9.038 26.524 -0.0912 0.0023 0.2753 58LYS BB 2168 11.019 8.623 26.289 0.2604 -0.1063 -0.3005 58LYS SC1 2169 11.040 8.351 26.429 -0.4332 -0.1996 0.0413 58LYS SC2 2170 10.918 8.090 26.265 0.0809 0.1616 -0.2099 59GLU BB 2171 11.150 8.792 26.103 -0.1777 -0.1619 -0.1097 59GLU SC1 2172 11.414 8.513 25.993 0.0155 0.1193 0.0153 60GLU BB 2173 11.245 9.087 26.060 -0.0225 -0.0022 0.0161 60GLU SC1 2174 11.284 9.122 26.462 0.2879 0.0508 0.0743 61GLU BB 2175 11.357 9.296 25.842 0.0544 0.1849 0.1609 61GLU SC1 2176 11.336 9.326 25.445 0.0163 0.1668 -0.0841 1LYS BB 2177 7.298 9.363 26.862 0.1417 -0.0864 -0.0763 1LYS SC1 2178 7.473 9.153 26.922 0.1282 0.1192 -0.1804 1LYS SC2 2179 7.767 8.959 26.845 0.1286 -0.5617 -0.2914 2LYS BB 2180 7.170 9.206 26.611 -0.0838 -0.3175 0.2319 2LYS SC1 2181 7.284 9.285 26.288 0.2813 0.0145 -0.4172 2LYS SC2 2182 7.401 9.590 26.174 0.1105 0.1954 -0.1552 3CYS BB 2183 6.873 9.107 26.465 -0.1844 0.0255 0.0997 3CYS SC1 2184 7.000 8.833 26.344 0.5611 0.0975 -0.3555 4LEU BB 2185 6.598 9.264 26.477 0.3663 0.2743 0.1486 4LEU SC1 2186 6.365 9.003 26.361 -0.2142 -0.1806 0.1162 5PHE BB 2187 6.498 9.403 26.144 -0.1900 -0.1173 -0.0006 5PHE SC1 2188 6.652 9.152 26.039 0.0599 0.3957 -0.0480 5PHE SC2 2189 6.990 9.185 26.051 0.0838 0.1621 -0.0310 5PHE SC3 2190 6.877 9.170 25.785 0.1280 -0.1290 -0.0372 6LYS BB 2191 6.501 9.721 26.007 -0.1556 -0.0247 0.0602 6LYS SC1 2192 6.381 9.991 26.174 0.2080 -0.3005 -0.0035 6LYS SC2 2193 6.098 9.980 26.409 -0.1882 -0.1739 -0.0668 7LYS BB 2194 6.767 9.944 25.946 0.4924 0.0743 -0.0922 7LYS SC1 2195 6.826 10.056 26.270 -0.1160 0.1719 0.3430 7LYS SC2 2196 6.869 10.053 26.601 0.0471 -0.4948 -0.0840 8LYS BB 2197 6.878 10.008 25.604 0.2613 0.2287 0.2481 8LYS SC1 2198 6.581 9.978 25.458 -0.2650 0.0327 -0.0497 8LYS SC2 2199 6.375 9.704 25.521 0.4515 -0.2934 -0.0057 9ASN BB 2200 7.177 10.022 25.508 0.0586 -0.0935 0.1469 9ASN SC1 2201 7.253 10.247 25.712 0.0568 0.3576 -0.1363 10LYS BB 2202 7.210 9.997 25.188 -0.1404 -0.2765 0.2521 10LYS SC1 2203 7.037 10.338 25.239 0.2131 -0.1759 -0.2130 10LYS SC2 2204 6.878 10.465 25.528 -0.1491 -0.4722 0.2667 11LYS BB 2205 6.932 9.985 25.007 -0.1778 -0.0087 0.0266 11LYS SC1 2206 6.813 9.744 25.194 0.0062 -0.1285 -0.2184 11LYS SC2 2207 6.719 9.398 25.183 -0.2318 0.0519 0.1769 12LYS BB 2208 6.664 10.131 25.022 -0.3200 0.0896 0.1813 12LYS SC1 2209 6.623 10.417 24.832 0.0742 -0.1694 -0.2926 12LYS SC2 2210 6.489 10.468 24.519 0.1848 0.0601 0.1488 13GLY BB 2211 6.519 10.383 25.219 -0.1513 0.1004 0.0144 14LYS BB 2212 6.355 10.631 25.128 0.1319 -0.2818 -0.3479 14LYS SC1 2213 6.040 10.583 25.091 0.1554 0.3251 0.1291 14LYS SC2 2214 5.733 10.378 25.167 -0.1154 0.0302 -0.3955 15GLU BB 2215 6.343 10.868 24.910 -0.1582 0.1980 0.1831 15GLU SC1 2216 6.130 10.721 24.597 -0.0005 -0.0591 -0.2621 16LYS BB 2217 6.618 11.128 24.881 -0.0869 0.1148 -0.0261 16LYS SC1 2218 6.765 11.278 25.100 0.0303 -0.3685 -0.2077 16LYS SC2 2219 6.719 11.284 25.435 0.1158 0.2230 0.3962 17GLY BB 2220 6.713 11.315 24.603 -0.2256 -0.0862 0.1888 18GLY BB 2221 6.619 11.682 24.519 0.3429 -0.0390 0.1049 19LYS BB 2222 6.472 11.830 24.690 -0.2082 0.3000 -0.1946 19LYS SC1 2223 6.265 11.662 24.779 0.0557 0.1833 0.2069 19LYS SC2 2224 5.925 11.573 24.719 0.2192 -0.3964 -0.1267 20ASN BB 2225 6.434 12.172 24.662 0.2892 -0.1721 -0.0482 20ASN SC1 2226 6.623 12.397 24.805 0.0966 -0.1875 0.1130 21ALA BB 2227 6.138 12.326 24.691 -0.1329 -0.0304 -0.4730 21ALA SC1 2228 5.911 12.267 24.558 -0.0388 -0.0660 -0.6207 22ILE BB 2229 6.067 12.578 24.942 -0.0161 0.0362 0.0690 22ILE SC1 2230 5.733 12.550 24.881 -0.0293 0.6762 -0.2302 23ASN BB 2231 6.090 12.956 24.863 -0.3198 -0.3038 -0.2807 23ASN SC1 2232 6.376 13.064 24.759 0.1278 0.0789 -0.1817 24MET BB 2233 5.792 13.138 25.004 -0.1602 -0.0934 0.0514 24MET SC1 2234 5.653 12.835 25.216 -0.0301 -0.2590 -0.0589 25LYS BB 2235 5.697 13.411 25.102 -0.1436 0.0929 -0.2757 25LYS SC1 2236 5.660 13.309 25.393 0.4182 0.1589 -0.2686 25LYS SC2 2237 5.852 13.090 25.595 0.0565 -0.6337 0.0112 26ASP BB 2238 5.880 13.670 25.050 0.0429 0.1535 0.0091 26ASP SC1 2239 5.622 13.889 25.133 -0.3698 0.2633 0.2172 27VAL BB 2240 5.991 13.806 24.792 -0.1237 0.3080 0.0428 27VAL SC1 2241 6.264 13.887 24.859 -0.0716 0.1869 -0.0188 28LYS BB 2242 5.945 13.765 24.455 0.2447 0.4778 0.0388 28LYS SC1 2243 5.920 13.849 24.166 0.0698 -0.1022 0.1465 28LYS SC2 2244 5.919 13.819 23.821 0.0344 -0.3480 0.4885 29ASP BB 2245 5.717 13.531 24.421 -0.3735 -0.3199 0.4885 29ASP SC1 2246 5.456 13.788 24.421 -0.5955 0.1251 0.0617 30LEU BB 2247 5.609 13.265 24.569 0.1660 0.1162 -0.1702 30LEU SC1 2248 5.531 12.993 24.349 0.0346 -0.2218 0.3743 31GLY BB 2249 5.320 13.292 24.718 -0.3818 -0.1518 -0.1974 32LYS BB 2250 5.097 13.531 24.620 -0.1706 0.2213 -0.0039 32LYS SC1 2251 4.844 13.382 24.513 -0.0805 0.1062 -0.0576 32LYS SC2 2252 4.653 13.037 24.566 0.1406 -0.2623 0.1898 33THR BB 2253 5.088 13.843 24.663 0.0809 -0.0208 -0.0509 33THR SC1 2254 5.276 13.958 24.873 0.0152 -0.1803 0.0980 34MET BB 2255 5.058 14.032 24.411 -0.3470 -0.1218 0.0679 34MET SC1 2256 5.022 13.828 24.149 -0.1397 -0.0293 0.0438 35LYS BB 2257 4.836 14.253 24.393 -0.2587 0.0671 -0.1786 35LYS SC1 2258 4.619 14.084 24.286 0.0791 -0.0685 0.5429 35LYS SC2 2259 4.526 13.770 24.166 -0.0390 -0.1959 -0.2523 36ASP BB 2260 4.697 14.382 24.632 -0.0812 -0.1303 0.1748 36ASP SC1 2261 4.616 14.087 24.751 0.2407 -0.1071 0.0472 37GLN BB 2262 4.741 14.510 24.883 0.1709 -0.1050 0.0260 37GLN SC1 2263 4.440 14.609 25.078 0.3751 -0.0388 -0.2036 38ALA BB 2264 4.976 14.500 25.145 -0.2185 -0.1962 -0.3226 38ALA SC1 2265 4.847 14.655 25.324 0.0881 0.0816 -0.3324 39LEU BB 2266 5.169 14.810 25.129 0.0833 -0.1953 -0.2255 39LEU SC1 2267 5.163 15.049 25.367 0.1385 -0.1737 -0.1832 40LYS BB 2268 5.199 14.879 24.817 0.2816 0.1854 0.5873 40LYS SC1 2269 5.142 15.202 24.788 0.3279 0.1703 -0.2352 40LYS SC2 2270 4.887 15.236 24.510 -0.0567 -0.0440 0.3615 41ASP BB 2271 5.518 14.794 24.708 0.0876 0.4340 0.2320 41ASP SC1 2272 5.685 14.883 25.029 0.0780 0.1172 -0.1678 42ASP BB 2273 5.449 14.826 24.389 -0.2310 -0.2998 -0.3827 42ASP SC1 2274 5.626 15.022 24.162 -0.1322 -0.0375 -0.0122 43ASP BB 2275 5.137 14.917 24.235 0.5920 0.0787 -0.0542 43ASP SC1 2276 4.953 14.730 24.458 0.0770 0.4604 -0.1195 44ALA BB 2277 5.021 14.749 23.994 -0.0555 -0.0082 -0.0304 44ALA SC1 2278 4.976 14.780 23.730 -0.1463 0.1547 0.0027 45GLU BB 2279 4.836 14.484 23.970 0.0149 -0.2883 0.0721 45GLU SC1 2280 5.099 14.250 23.895 0.0558 -0.1023 0.0091 46THR BB 2281 4.575 14.408 23.811 -0.1885 0.0188 -0.0179 46THR SC1 2282 4.577 14.119 23.910 -0.1130 -0.0656 -0.2592 47GLY BB 2283 4.218 14.416 23.942 0.2176 0.0994 0.0334 48LEU BB 2284 3.904 14.418 23.834 0.1911 -0.1675 0.0596 48LEU SC1 2285 3.735 14.180 24.094 0.1300 0.1745 0.5286 49THR BB 2286 3.759 14.470 23.552 -0.1504 0.2333 0.0714 49THR SC1 2287 3.466 14.421 23.621 -0.1026 -0.1467 0.0265 50ASP BB 2288 3.960 14.649 23.345 0.0397 0.2850 -0.0365 50ASP SC1 2289 4.263 14.476 23.478 -0.1231 -0.1563 0.1883 51GLY BB 2290 3.917 14.802 23.018 -0.2334 -0.3051 -0.5804 52GLU BB 2291 3.845 15.071 22.881 0.1790 -0.1293 -0.3032 52GLU SC1 2292 4.199 15.289 22.889 0.0217 -0.0564 0.2130 53GLU BB 2293 3.567 15.159 22.886 0.3664 -0.0535 -0.1058 53GLU SC1 2294 3.522 15.344 22.561 0.1173 -0.1169 -0.1973 54LYS BB 2295 3.381 15.294 23.172 -0.1026 0.2498 -0.5210 54LYS SC1 2296 3.116 15.368 23.105 -0.3093 -0.1965 0.4334 54LYS SC2 2297 2.817 15.294 22.915 -0.0466 -0.1145 -0.1961 55GLU BB 2298 3.337 15.095 23.452 0.2973 0.2960 0.0052 55GLU SC1 2299 3.562 14.888 23.683 0.0129 -0.3222 -0.1224 56GLU BB 2300 3.039 14.948 23.334 0.0856 -0.0769 -0.0318 56GLU SC1 2301 3.044 14.839 22.953 0.1993 0.2149 0.0342 57PRO BB 2302 2.774 15.194 23.336 0.3241 -0.2083 -0.0888 57PRO SC1 2303 2.670 15.008 23.615 0.1548 -0.0929 0.0490 58LYS BB 2304 2.586 14.974 23.129 -0.0461 -0.0162 0.2534 58LYS SC1 2305 2.368 14.777 23.342 -0.1700 -0.1267 -0.0568 58LYS SC2 2306 2.260 14.498 23.389 0.0790 0.0555 0.5248 59GLU BB 2307 2.539 14.747 22.888 -0.3366 -0.3738 0.2493 59GLU SC1 2308 2.603 14.991 22.565 0.2339 -0.0183 0.1937 60GLU BB 2309 2.416 14.507 22.922 -0.0161 -0.1494 -0.1936 60GLU SC1 2310 2.044 14.549 22.876 -0.1841 -0.1818 0.1454 61GLU BB 2311 2.430 14.197 22.988 -0.0838 0.1484 0.1031 61GLU SC1 2312 2.506 13.951 22.710 -0.1443 0.0166 -0.0577 1LYS BB 2313 4.764 24.056 17.117 0.1317 0.0976 0.0105 1LYS SC1 2314 4.568 23.968 17.313 0.1678 0.2062 0.1494 1LYS SC2 2315 4.230 23.975 17.434 0.0865 -0.3243 0.3590 2LYS BB 2316 4.594 24.377 17.070 -0.3276 -0.2759 -0.0589 2LYS SC1 2317 4.767 24.445 16.785 -0.3730 0.1913 -0.0945 2LYS SC2 2318 4.884 24.577 16.475 0.0778 0.2081 0.0225 3CYS BB 2319 4.295 24.282 17.091 0.2936 -0.2395 0.3858 3CYS SC1 2320 4.248 24.410 17.423 -0.1862 0.2521 0.0905 4LEU BB 2321 4.258 24.124 16.806 0.0443 0.0042 0.0919 4LEU SC1 2322 4.439 24.175 16.509 -0.0898 0.0584 -0.0567 5PHE BB 2323 4.056 23.987 16.648 -0.1359 -0.0207 -0.3031 5PHE SC1 2324 3.947 24.195 16.480 0.1627 0.0798 -0.0501 5PHE SC2 2325 4.018 24.527 16.467 -0.1710 0.1526 -0.1150 5PHE SC3 2326 4.140 24.366 16.258 0.1226 0.2048 0.0105 6LYS BB 2327 4.012 23.674 16.676 0.0825 -0.0064 -0.1235 6LYS SC1 2328 3.790 23.609 16.539 0.1450 -0.0696 0.1921 6LYS SC2 2329 3.665 23.544 16.228 0.3355 0.2865 -0.2061 7LYS BB 2330 4.052 23.471 16.937 -0.1782 -0.1106 0.2754 7LYS SC1 2331 3.749 23.442 16.944 -0.2484 0.3876 -0.0540 7LYS SC2 2332 3.486 23.511 17.144 0.1087 0.2269 -0.4179 8LYS BB 2333 4.078 23.139 17.028 0.3292 0.2973 -0.1163 8LYS SC1 2334 4.339 23.139 17.097 0.1953 -0.0587 -0.2778 8LYS SC2 2335 4.557 23.060 17.399 -0.0207 -0.4845 -0.2310 9ASN BB 2336 3.832 22.867 17.009 0.1049 -0.4833 -0.2164 9ASN SC1 2337 3.541 23.064 16.917 -0.0901 -0.3646 0.1993 10LYS BB 2338 3.826 22.655 16.722 -0.0129 -0.2252 -0.2656 10LYS SC1 2339 4.079 22.492 16.707 -0.2162 -0.2044 -0.0369 10LYS SC2 2340 4.266 22.223 16.868 -0.0798 -0.3264 0.1643 11LYS BB 2341 3.685 22.780 16.523 -0.2792 0.0072 -0.2064 11LYS SC1 2342 3.409 22.627 16.392 0.1769 -0.0643 -0.0479 11LYS SC2 2343 3.482 22.286 16.521 -0.1210 -0.1146 0.0014 12LYS BB 2344 3.614 23.090 16.447 0.0818 -0.2626 -0.2697 12LYS SC1 2345 3.867 23.154 16.619 0.3477 0.0979 -0.4298 12LYS SC2 2346 4.155 22.952 16.605 0.2112 0.2724 0.2815 13GLY BB 2347 3.415 23.032 16.199 -0.1353 -0.2438 -0.0057 14LYS BB 2348 3.388 22.812 15.926 -0.0439 0.0951 -0.0261 14LYS SC1 2349 3.084 22.870 15.864 0.2765 0.0056 -0.0192 14LYS SC2 2350 2.801 22.758 15.597 0.1644 0.0914 -0.3969 15GLU BB 2351 3.583 22.536 15.933 -0.3012 0.2296 0.3004 15GLU SC1 2352 3.589 22.489 15.552 -0.3243 0.0097 -0.3664 16LYS BB 2353 3.471 22.234 16.029 -0.2651 0.0252 0.1496 16LYS SC1 2354 3.721 22.089 15.893 -0.3929 -0.0115 -0.1253 16LYS SC2 2355 3.853 22.072 15.630 0.1188 0.3830 -0.3862 17GLY BB 2356 3.190 22.245 15.865 0.0148 0.2287 0.0575 18GLY BB 2357 3.073 22.449 15.610 -0.0626 -0.0944 -0.1182 19LYS BB 2358 3.090 22.260 15.350 -0.1003 -0.0298 0.1791 19LYS SC1 2359 2.927 22.050 15.190 0.1396 0.0219 0.2058 19LYS SC2 2360 2.815 21.883 14.873 -0.1438 0.1121 -0.0793 20ASN BB 2361 3.350 22.110 15.293 -0.2084 -0.0779 0.2555 20ASN SC1 2362 3.438 22.422 15.089 -0.0239 0.1263 -0.1016 21ALA BB 2363 3.377 21.796 15.420 -0.3365 -0.0080 0.0048 21ALA SC1 2364 3.239 21.878 15.637 0.0600 -0.2025 0.3446 22ILE BB 2365 3.635 21.627 15.520 -0.2801 -0.0591 -0.0380 22ILE SC1 2366 3.549 21.368 15.315 0.1640 -0.0630 -0.2326 23ASN BB 2367 3.861 21.584 15.757 0.1508 0.0236 -0.0246 23ASN SC1 2368 4.190 21.700 15.714 -0.0750 0.4719 0.3490 24MET BB 2369 3.839 21.382 16.037 0.1710 -0.1650 -0.3114 24MET SC1 2370 4.046 21.092 16.060 0.0235 -0.1298 -0.0830 25LYS BB 2371 3.659 21.378 16.304 0.2881 -0.1910 0.1628 25LYS SC1 2372 3.521 21.189 16.497 -0.3639 0.1283 -0.0378 25LYS SC2 2373 3.223 21.219 16.657 0.1891 0.2176 -0.0700 26ASP BB 2374 3.473 21.659 16.490 -0.0345 0.1047 0.4212 26ASP SC1 2375 3.631 21.916 16.402 -0.1575 0.1873 -0.1178 27VAL BB 2376 3.570 21.697 16.783 0.0577 -0.1326 -0.2791 27VAL SC1 2377 3.675 21.435 16.855 -0.0143 -0.1210 -0.1279 28LYS BB 2378 3.388 22.001 16.876 -0.1444 0.1064 -0.0517 28LYS SC1 2379 3.602 22.052 17.059 0.0125 0.0557 0.2287 28LYS SC2 2380 3.474 21.813 17.271 0.2656 -0.2387 -0.3028 29ASP BB 2381 3.112 21.918 16.958 -0.0613 -0.2330 -0.0064 29ASP SC1 2382 3.081 21.647 16.715 0.0491 -0.2739 0.1840 30LEU BB 2383 2.908 22.175 16.954 -0.1623 0.0149 0.1130 30LEU SC1 2384 3.016 22.305 16.656 -0.5765 -0.3839 0.0459 31GLY BB 2385 2.684 22.030 16.786 0.0627 -0.0727 -0.2639 32LYS BB 2386 2.616 21.682 16.808 0.1492 0.0261 -0.1564 32LYS SC1 2387 2.420 21.645 17.102 -0.2526 -0.3288 0.3441 32LYS SC2 2388 2.069 21.601 17.148 -0.0277 0.3383 0.0170 33THR BB 2389 2.552 21.593 16.494 0.1284 -0.0839 -0.2248 33THR SC1 2390 2.713 21.822 16.374 -0.0396 0.1724 0.0266 34MET BB 2391 2.354 21.301 16.515 0.1446 -0.1986 -0.2336 34MET SC1 2392 2.297 21.253 16.860 -0.1671 -0.0170 -0.0177 35LYS BB 2393 2.110 21.111 16.406 0.0786 0.0653 -0.0069 35LYS SC1 2394 2.293 20.907 16.248 0.0078 0.1892 -0.1077 35LYS SC2 2395 2.287 20.529 16.407 0.2690 -0.0759 -0.0198 36ASP BB 2396 2.038 21.241 16.089 -0.3117 0.0131 0.1037 36ASP SC1 2397 1.741 21.177 15.971 0.1484 0.0203 0.2128 37GLN BB 2398 2.147 21.505 15.956 0.2043 0.2106 -0.1565 37GLN SC1 2399 2.526 21.499 15.992 0.0742 -0.0615 -0.1920 38ALA BB 2400 1.900 21.701 15.952 -0.1595 -0.0640 0.0374 38ALA SC1 2401 1.924 21.827 15.715 0.4159 0.2562 0.2450 39LEU BB 2402 1.815 21.952 16.148 -0.1112 -0.2382 0.1446 39LEU SC1 2403 1.953 22.187 15.941 -0.1816 -0.1194 -0.1239 40LYS BB 2404 1.523 22.107 16.311 0.0164 -0.0813 -0.0061 40LYS SC1 2405 1.388 21.877 16.141 0.1117 -0.0689 0.0288 40LYS SC2 2406 1.450 21.689 15.871 -0.0906 -0.0749 -0.1075 41ASP BB 2407 1.526 22.168 16.604 -0.1432 0.0196 -0.0460 41ASP SC1 2408 1.233 21.958 16.716 -0.2216 -0.0053 -0.2088 42ASP BB 2409 1.763 22.350 16.674 0.1074 0.1718 -0.2605 42ASP SC1 2410 1.846 22.192 16.981 -0.3685 0.1730 -0.1787 43ASP BB 2411 1.961 22.347 16.427 -0.0172 0.2162 0.0349 43ASP SC1 2412 2.252 22.297 16.574 -0.4596 -0.0884 0.0802 44ALA BB 2413 2.059 22.632 16.354 -0.2863 -0.5825 0.0594 44ALA SC1 2414 2.004 22.679 16.093 -0.2446 -0.2863 0.1001 45GLU BB 2415 2.117 22.734 16.678 0.3012 0.0297 0.2623 45GLU SC1 2416 2.107 23.108 16.576 0.1260 -0.3076 0.3060 46THR BB 2417 2.097 22.571 16.952 0.1527 0.2143 -0.1178 46THR SC1 2418 1.835 22.629 17.097 0.0070 -0.1625 -0.2155 47GLY BB 2419 2.278 22.263 17.016 -0.0516 0.1948 0.0074 48LEU BB 2420 2.307 22.034 17.210 -0.0757 0.0367 0.0720 48LEU SC1 2421 2.664 22.057 17.350 -0.0369 0.2715 -0.1290 49THR BB 2422 2.084 21.958 17.451 -0.1941 -0.0392 -0.0397 49THR SC1 2423 2.219 22.149 17.646 0.0248 0.1932 -0.4061 50ASP BB 2424 1.787 21.875 17.400 0.1055 0.1637 -0.1320 50ASP SC1 2425 1.573 22.009 17.614 0.3585 -0.0265 0.3067 51GLY BB 2426 1.675 21.551 17.419 0.0337 0.3451 0.0419 52GLU BB 2427 1.429 21.376 17.270 -0.0606 -0.0157 0.0285 52GLU SC1 2428 1.069 21.575 17.187 -0.0537 0.1812 -0.1399 53GLU BB 2429 1.668 21.199 17.142 0.2505 0.0873 0.1367 53GLU SC1 2430 1.970 21.104 17.336 -0.0276 0.2249 0.2123 54LYS BB 2431 1.662 20.989 16.934 -0.0378 0.2939 -0.2736 54LYS SC1 2432 1.776 21.052 16.647 0.4818 0.4399 -0.3164 54LYS SC2 2433 1.709 20.958 16.333 0.4408 -0.0278 -0.4460 55GLU BB 2434 1.486 20.722 16.868 0.1057 0.0264 -0.1268 55GLU SC1 2435 1.325 20.816 16.558 -0.0874 0.0477 0.1342 56GLU BB 2436 1.626 20.411 16.714 0.0648 -0.1185 0.1778 56GLU SC1 2437 1.729 20.469 16.351 0.2293 -0.2423 -0.1641 57PRO BB 2438 1.739 20.209 16.982 -0.1612 0.2208 0.0677 57PRO SC1 2439 2.028 20.191 17.084 0.1624 0.3148 -0.1538 58LYS BB 2440 1.630 20.133 17.290 -0.2293 0.0600 0.0972 58LYS SC1 2441 1.650 20.376 17.406 -0.0339 -0.1115 0.1806 58LYS SC2 2442 1.829 20.650 17.224 -0.1697 -0.1182 -0.1827 59GLU BB 2443 1.361 19.976 17.376 0.2382 -0.0723 0.0665 59GLU SC1 2444 1.540 19.747 17.681 0.0462 -0.0990 -0.1655 60GLU BB 2445 1.154 19.862 17.156 -0.1549 -0.4121 0.2563 60GLU SC1 2446 1.412 19.955 16.875 0.1668 0.1183 -0.0774 61GLU BB 2447 0.853 19.850 17.261 0.0109 -0.0022 -0.0770 61GLU SC1 2448 0.910 20.187 17.484 -0.2826 0.2253 0.1279 1LYS BB 2449 4.034 14.941 21.288 0.0652 0.2405 0.0458 1LYS SC1 2450 3.917 14.979 21.568 -0.1836 -0.0318 -0.3036 1LYS SC2 2451 3.718 15.268 21.676 -0.0029 0.1612 0.1614 2LYS BB 2452 4.377 14.982 21.338 -0.0114 -0.0518 -0.0141 2LYS SC1 2453 4.633 14.812 21.242 -0.1443 -0.0468 0.0171 2LYS SC2 2454 4.871 15.084 21.180 -0.1488 -0.0642 -0.0431 3CYS BB 2455 4.382 14.942 21.645 0.1830 -0.2593 -0.2949 3CYS SC1 2456 4.181 15.173 21.740 0.2274 -0.3557 -0.2156 4LEU BB 2457 4.704 14.860 21.696 0.1000 -0.3119 0.2301 4LEU SC1 2458 4.906 15.135 21.708 -0.1965 -0.1852 -0.1072 5PHE BB 2459 4.768 14.727 22.001 -0.0702 0.1433 0.1090 5PHE SC1 2460 5.053 14.684 21.962 0.1582 -0.3822 0.1920 5PHE SC2 2461 5.270 14.826 22.182 0.2007 0.0624 -0.1244 5PHE SC3 2462 5.289 14.538 22.158 0.3122 0.0259 0.3207 6LYS BB 2463 4.721 14.740 22.317 -0.0869 0.0726 -0.1334 6LYS SC1 2464 5.017 14.610 22.379 -0.3870 0.0689 -0.3985 6LYS SC2 2465 5.225 14.783 22.634 -0.1560 0.1113 -0.4034 7LYS BB 2466 4.759 14.931 22.588 0.0527 0.2042 0.2063 7LYS SC1 2467 4.578 15.182 22.542 -0.0453 0.2257 0.3154 7LYS SC2 2468 4.536 15.481 22.343 0.1284 -0.0458 -0.1565 8LYS BB 2469 4.574 14.838 22.857 0.0793 0.0650 0.0282 8LYS SC1 2470 4.638 15.122 23.017 0.1731 -0.3285 0.4992 8LYS SC2 2471 4.881 15.336 23.170 -0.1387 0.1985 -0.0459 9ASN BB 2472 4.257 14.754 22.740 0.0719 0.0130 -0.2600 9ASN SC1 2473 4.251 14.786 22.389 -0.0340 0.2198 -0.1425 10LYS BB 2474 4.114 14.446 22.677 -0.1153 0.0128 -0.0187 10LYS SC1 2475 3.923 14.347 22.455 0.1736 0.0838 0.1096 10LYS SC2 2476 3.958 14.450 22.150 -0.0885 0.0113 0.2912 11LYS BB 2477 3.885 14.375 22.868 -0.0346 0.1029 -0.1267 11LYS SC1 2478 3.636 14.560 22.802 0.0559 -0.2099 -0.4431 11LYS SC2 2479 3.403 14.804 22.661 0.2822 0.2260 -0.4364 12LYS BB 2480 3.720 14.092 22.832 0.2310 -0.1122 0.0853 12LYS SC1 2481 3.992 13.931 22.827 -0.2633 -0.2811 0.0067 12LYS SC2 2482 3.965 13.683 23.033 -0.2182 0.1285 -0.2236 13GLY BB 2483 3.436 13.964 22.777 0.0141 0.2367 0.2856 14LYS BB 2484 3.291 14.024 22.501 -0.1268 0.2348 -0.2539 14LYS SC1 2485 3.075 14.203 22.582 0.0183 0.0440 0.1945 14LYS SC2 2486 2.794 14.376 22.722 0.1569 -0.2301 0.0669 15GLU BB 2487 3.341 13.841 22.192 0.0774 0.0189 -0.0694 15GLU SC1 2488 3.300 14.147 21.937 0.1258 -0.2279 0.0074 16LYS BB 2489 3.201 13.503 22.235 -0.1364 -0.3448 0.0544 16LYS SC1 2490 3.444 13.439 22.369 0.3232 0.4241 0.0391 16LYS SC2 2491 3.739 13.556 22.195 0.0762 -0.2211 0.3881 17GLY BB 2492 3.251 13.231 22.020 0.2771 -0.3729 0.0448 18GLY BB 2493 3.264 13.351 21.720 0.1570 -0.0900 -0.0121 19LYS BB 2494 3.476 13.546 21.779 0.0920 -0.1499 -0.0493 19LYS SC1 2495 3.392 13.784 21.628 0.2136 0.1525 -0.0678 19LYS SC2 2496 3.186 14.031 21.449 0.1323 0.0322 0.0692 20ASN BB 2497 3.719 13.255 21.820 0.0277 0.1347 0.2715 20ASN SC1 2498 3.677 13.099 22.120 0.2283 0.1815 0.1091 21ALA BB 2499 3.837 13.053 21.537 -0.0324 -0.2043 0.0329 21ALA SC1 2500 3.828 12.812 21.658 0.4815 -0.2898 -0.0762 22ILE BB 2501 3.662 12.954 21.304 -0.1211 -0.0769 -0.0835 22ILE SC1 2502 3.739 12.623 21.336 0.0723 -0.0221 0.0353 23ASN BB 2503 3.663 13.020 20.944 0.0545 0.2288 0.3534 23ASN SC1 2504 3.654 12.715 20.851 0.2332 0.0478 0.0679 24MET BB 2505 3.396 13.190 20.777 0.0014 -0.0598 0.0812 24MET SC1 2506 3.166 12.947 20.844 -0.3718 0.1864 -0.0453 25LYS BB 2507 3.532 13.214 20.482 -0.4473 -0.0120 0.1808 25LYS SC1 2508 3.819 13.355 20.376 -0.1660 -0.1918 0.1370 25LYS SC2 2509 3.866 13.193 20.096 -0.0169 0.2821 0.1002 26ASP BB 2510 3.332 13.180 20.219 -0.1195 -0.0253 0.3667 26ASP SC1 2511 3.060 13.146 20.403 0.0619 0.2671 -0.0095 27VAL BB 2512 3.403 13.384 19.961 0.0030 -0.2844 0.1733 27VAL SC1 2513 3.596 13.540 20.115 -0.1210 0.1615 -0.1033 28LYS BB 2514 3.179 13.305 19.707 0.2221 -0.1738 -0.0216 28LYS SC1 2515 2.876 13.206 19.759 0.0272 -0.2476 -0.4611 28LYS SC2 2516 2.519 13.257 19.813 -0.1557 0.2027 -0.1185 29ASP BB 2517 3.019 13.543 19.514 0.1649 0.0811 -0.2191 29ASP SC1 2518 3.148 13.708 19.257 0.0308 -0.3627 -0.1845 30LEU BB 2519 2.784 13.681 19.619 0.1896 -0.3068 0.3666 30LEU SC1 2520 2.471 13.823 19.666 -0.0794 0.0448 0.1010 31GLY BB 2521 2.683 13.895 19.350 0.0329 0.1862 -0.2485 32LYS BB 2522 2.660 13.849 19.041 0.0180 -0.1907 0.1550 32LYS SC1 2523 2.421 13.725 18.918 -0.0434 -0.1079 -0.1570 32LYS SC2 2524 2.142 13.823 18.745 0.0042 -0.0912 0.1640 33THR BB 2525 2.866 13.948 18.794 0.0536 0.2853 0.0136 33THR SC1 2526 2.661 13.879 18.579 -0.0707 0.1351 0.1778 34MET BB 2527 3.014 14.210 18.762 -0.1251 0.0900 0.1347 34MET SC1 2528 2.822 14.396 18.940 0.0184 0.0222 0.3402 35LYS BB 2529 3.311 14.248 18.712 -0.2216 0.1512 0.3120 35LYS SC1 2530 3.376 14.431 18.958 -0.0901 -0.3984 -0.0183 35LYS SC2 2531 3.636 14.698 18.963 0.0589 0.1083 0.4009 36ASP BB 2532 3.624 14.169 18.755 0.0011 0.4521 0.0848 36ASP SC1 2533 3.748 14.221 18.470 -0.2394 -0.5102 0.2508 37GLN BB 2534 3.788 13.900 18.845 -0.2978 0.0660 0.1739 37GLN SC1 2535 3.817 13.736 18.520 0.1959 -0.0572 0.1219 38ALA BB 2536 3.935 14.011 19.140 -0.2777 -0.0794 0.3659 38ALA SC1 2537 4.151 13.858 19.196 0.0809 0.2077 -0.1409 39LEU BB 2538 3.888 14.348 19.147 -0.0819 -0.0237 0.2271 39LEU SC1 2539 4.174 14.520 19.065 -0.1903 0.2858 -0.2700 40LYS BB 2540 3.686 14.412 19.374 -0.0593 -0.1063 0.2450 40LYS SC1 2541 3.648 14.147 19.613 0.1054 -0.0435 -0.0246 40LYS SC2 2542 3.640 13.967 19.886 0.3673 -0.0059 0.3558 41ASP BB 2543 3.620 14.819 19.429 0.1692 0.3451 -0.1458 41ASP SC1 2544 3.354 14.881 19.255 0.1616 0.3276 0.0095 42ASP BB 2545 3.619 14.848 19.776 0.0859 0.3445 -0.1817 42ASP SC1 2546 3.603 15.127 19.872 0.0440 -0.0226 0.0157 43ASP BB 2547 3.586 14.574 19.903 0.0470 0.0290 -0.1981 43ASP SC1 2548 3.915 14.446 19.893 -0.0534 -0.3542 -0.0510 44ALA BB 2549 3.303 14.386 19.812 0.1624 -0.3401 -0.1626 44ALA SC1 2550 3.242 14.611 19.675 -0.3888 -0.0761 0.4581 45GLU BB 2551 3.031 14.304 20.030 -0.1096 -0.0199 -0.1158 45GLU SC1 2552 3.041 14.118 20.412 -0.0949 -0.0361 -0.0619 46THR BB 2553 2.756 14.197 19.831 -0.0320 0.0357 0.1715 46THR SC1 2554 2.526 14.324 19.986 -0.0564 0.0486 0.1249 47GLY BB 2555 2.769 14.273 19.584 -0.0397 -0.0307 0.0740 48LEU BB 2556 2.622 14.380 19.333 -0.2905 0.5159 -0.1418 48LEU SC1 2557 2.517 14.727 19.329 0.2160 0.3007 -0.0014 49THR BB 2558 2.302 14.338 19.504 -0.0089 -0.2758 0.0976 49THR SC1 2559 2.327 14.573 19.697 -0.1589 -0.1723 -0.0060 50ASP BB 2560 2.131 14.098 19.692 0.4443 0.0656 -0.1799 50ASP SC1 2561 2.097 14.314 19.956 0.0133 -0.2674 0.1194 51GLY BB 2562 1.974 13.852 19.577 0.2787 0.0245 0.0122 52GLU BB 2563 1.856 13.667 19.864 0.2019 -0.0615 0.0062 52GLU SC1 2564 1.978 13.399 19.640 -0.1567 0.2427 -0.0144 53GLU BB 2565 1.821 13.913 20.124 -0.0013 0.0395 0.0071 53GLU SC1 2566 1.910 13.569 20.374 -0.2731 0.3215 0.3521 54LYS BB 2567 1.481 13.900 20.096 0.0339 -0.1771 -0.0922 54LYS SC1 2568 1.385 13.715 20.362 0.0941 0.2219 0.2344 54LYS SC2 2569 1.334 13.400 20.261 0.1991 -0.1116 -0.0355 55GLU BB 2570 1.260 14.071 19.993 0.2460 0.0463 0.0354 55GLU SC1 2571 1.121 13.757 19.761 -0.2228 -0.1642 0.0723 56GLU BB 2572 1.100 14.267 20.130 -0.1197 0.2938 -0.2450 56GLU SC1 2573 0.942 14.223 20.480 0.1593 -0.1072 -0.3683 57PRO BB 2574 1.033 14.556 20.101 0.0187 -0.2240 -0.0832 57PRO SC1 2575 0.939 14.827 20.257 -0.0206 -0.0315 0.0267 58LYS BB 2576 0.902 14.717 19.862 0.1086 -0.2287 0.2585 58LYS SC1 2577 1.166 14.827 19.844 -0.1747 -0.0219 -0.2210 58LYS SC2 2578 1.405 14.619 19.730 0.2940 -0.1904 -0.1420 59GLU BB 2579 0.648 14.921 19.864 0.1187 -0.1897 -0.0626 59GLU SC1 2580 0.415 14.889 20.177 -0.2246 -0.0021 0.1037 60GLU BB 2581 0.457 15.084 19.623 -0.1729 0.2619 0.0096 60GLU SC1 2582 0.548 14.820 19.303 -0.0019 -0.2739 -0.3584 61GLU BB 2583 0.264 15.403 19.611 -0.1085 0.0013 0.0440 61GLU SC1 2584 -0.065 15.298 19.643 0.0550 -0.0423 0.3362 1LYS BB 2585 25.696 5.849 12.648 -0.0630 -0.0757 -0.0534 1LYS SC1 2586 25.694 5.655 12.879 -0.0411 0.0456 -0.3058 1LYS SC2 2587 25.836 5.492 13.186 0.0085 0.2630 -0.3298 2LYS BB 2588 25.784 5.588 12.377 -0.0145 0.1099 -0.0947 2LYS SC1 2589 25.525 5.532 12.220 0.0662 0.3474 -0.2356 2LYS SC2 2590 25.225 5.518 12.002 -0.4367 0.4465 0.1585 3CYS BB 2591 26.074 5.463 12.166 -0.3708 -0.3330 -0.0334 3CYS SC1 2592 25.824 5.270 12.027 -0.1185 -0.2583 -0.4160 4LEU BB 2593 26.198 5.175 12.201 -0.2034 -0.0120 0.1389 4LEU SC1 2594 26.226 5.051 12.551 0.2707 -0.3303 -0.0883 5PHE BB 2595 26.136 4.962 11.904 -0.0572 0.1028 -0.3017 5PHE SC1 2596 25.796 4.894 11.963 0.0351 0.2549 -0.0187 5PHE SC2 2597 25.770 4.556 11.937 0.2758 0.2247 0.0997 5PHE SC3 2598 25.535 4.705 11.856 0.1319 0.0248 0.1420 6LYS BB 2599 26.152 5.250 11.676 -0.3046 0.2826 -0.0155 6LYS SC1 2600 25.852 5.376 11.622 -0.0048 0.0354 0.5807 6LYS SC2 2601 25.633 5.288 11.369 0.0853 -0.0269 -0.2405 7LYS BB 2602 26.407 5.474 11.739 -0.0271 -0.1522 -0.1912 7LYS SC1 2603 26.571 5.405 11.494 -0.2425 0.2154 -0.1672 7LYS SC2 2604 26.799 5.218 11.312 0.0859 0.0966 0.0364 8LYS BB 2605 26.467 5.761 11.853 0.2280 0.0880 -0.1028 8LYS SC1 2606 26.440 5.727 12.169 -0.0911 -0.1196 -0.0383 8LYS SC2 2607 26.693 5.758 12.360 -0.1075 -0.1037 -0.1359 9ASN BB 2608 26.552 6.040 11.771 -0.0972 0.0644 0.0176 9ASN SC1 2609 26.829 6.181 11.969 -0.0717 -0.0015 -0.1432 10LYS BB 2610 26.361 6.302 11.747 0.0111 0.1366 0.0386 10LYS SC1 2611 26.545 6.486 11.950 -0.4640 0.2198 0.0927 10LYS SC2 2612 26.824 6.645 12.087 -0.0393 -0.4611 0.3785 11LYS BB 2613 26.177 6.305 11.483 0.0096 0.0614 -0.1183 11LYS SC1 2614 25.945 6.500 11.624 0.2463 0.2935 -0.2924 11LYS SC2 2615 25.675 6.767 11.764 -0.1006 0.3920 0.0846 12LYS BB 2616 26.213 6.387 11.179 0.1823 -0.2345 -0.0123 12LYS SC1 2617 26.464 6.575 11.281 -0.2573 -0.2709 -0.1035 12LYS SC2 2618 26.654 6.900 11.330 0.1303 0.2980 0.0227 13GLY BB 2619 26.341 6.313 10.917 0.0031 0.2329 -0.3349 14LYS BB 2620 26.164 6.188 10.706 0.0452 0.0483 0.2642 14LYS SC1 2621 25.843 6.205 10.837 0.2120 0.2453 0.2889 14LYS SC2 2622 25.540 6.044 10.916 0.0787 -0.0673 0.1196 15GLU BB 2623 26.270 5.929 10.604 -0.0008 -0.4336 0.1904 15GLU SC1 2624 26.463 6.081 10.336 0.0933 0.0312 0.0595 16LYS BB 2625 26.311 5.664 10.684 -0.2302 0.0517 -0.0295 16LYS SC1 2626 26.616 5.601 10.645 0.1891 0.0710 -0.2107 16LYS SC2 2627 26.665 5.684 10.293 -0.0826 0.1937 -0.4161 17GLY BB 2628 26.069 5.518 10.827 -0.1213 0.2596 -0.1010 18GLY BB 2629 25.843 5.463 10.622 -0.2811 0.2079 0.3712 19LYS BB 2630 25.712 5.173 10.470 0.0573 -0.1861 -0.2474 19LYS SC1 2631 25.897 4.916 10.437 0.3006 0.0531 -0.0011 19LYS SC2 2632 26.097 4.874 10.224 0.2873 -0.0298 0.2309 20ASN BB 2633 25.475 4.933 10.543 0.0901 -0.0924 0.0572 20ASN SC1 2634 25.645 4.693 10.682 -0.0413 0.0512 -0.1605 21ALA BB 2635 25.192 4.969 10.646 0.4591 -0.0966 0.2954 21ALA SC1 2636 25.005 4.870 10.815 0.0731 0.3367 0.1413 22ILE BB 2637 25.014 5.141 10.476 -0.0536 0.1309 -0.1502 22ILE SC1 2638 24.945 5.470 10.535 -0.1363 0.0829 0.0269 23ASN BB 2639 25.198 5.266 10.240 0.1139 -0.0180 0.0958 23ASN SC1 2640 25.227 5.648 10.255 -0.1347 0.2018 0.1113 24MET BB 2641 25.171 5.320 9.896 -0.1529 -0.4369 -0.0192 24MET SC1 2642 25.330 5.649 9.782 -0.0397 -0.0839 -0.1036 25LYS BB 2643 25.035 5.066 9.770 0.0697 0.2129 0.0635 25LYS SC1 2644 25.244 5.106 9.516 0.2081 -0.2752 0.2234 25LYS SC2 2645 25.592 4.937 9.535 0.0994 0.0313 -0.0848 26ASP BB 2646 25.145 4.744 9.889 -0.2626 -0.2936 0.2115 26ASP SC1 2647 25.223 4.808 10.188 -0.2527 0.2325 -0.2412 27VAL BB 2648 24.864 4.600 9.935 -0.3584 -0.0043 -0.2136 27VAL SC1 2649 24.729 4.547 9.681 0.0227 -0.0824 -0.4070 28LYS BB 2650 24.828 4.491 10.236 -0.3342 0.0664 0.2089 28LYS SC1 2651 24.656 4.306 10.096 0.0043 0.0718 -0.1521 28LYS SC2 2652 24.603 4.108 9.824 0.0102 -0.0070 0.1010 29ASP BB 2653 24.874 4.586 10.519 -0.0226 0.1530 0.1153 29ASP SC1 2654 25.072 4.264 10.563 0.0195 -0.5776 0.1821 30LEU BB 2655 24.690 4.554 10.815 -0.0595 -0.1314 0.0310 30LEU SC1 2656 24.379 4.514 10.649 0.2022 -0.0084 -0.3655 31GLY BB 2657 24.854 4.368 11.080 0.4120 0.2281 0.4375 32LYS BB 2658 24.936 4.057 11.042 -0.0024 0.2639 0.0056 32LYS SC1 2659 24.872 3.928 11.327 -0.2686 -0.2782 -0.3221 32LYS SC2 2660 24.590 3.962 11.529 -0.0340 0.1416 0.0180 33THR BB 2661 25.086 3.854 10.806 0.0013 -0.1137 0.0818 33THR SC1 2662 25.049 3.597 10.646 0.1611 0.0556 -0.2363 34MET BB 2663 25.375 3.897 10.985 -0.1162 0.1901 0.0683 34MET SC1 2664 25.429 4.212 11.095 -0.3331 0.1272 -0.1348 35LYS BB 2665 25.701 3.825 10.894 0.0125 0.1228 0.0737 35LYS SC1 2666 25.845 4.066 10.911 -0.4671 0.0696 0.0332 35LYS SC2 2667 26.184 4.150 10.980 0.1207 0.1023 -0.1902 36ASP BB 2668 25.946 3.591 10.919 0.0599 -0.1213 -0.3263 36ASP SC1 2669 25.924 3.478 10.631 -0.1170 0.2206 0.0923 37GLN BB 2670 26.219 3.704 11.125 0.0575 -0.1285 0.3482 37GLN SC1 2671 26.419 3.759 10.812 0.3002 0.0156 -0.0850 38ALA BB 2672 26.272 3.869 11.421 0.0528 0.1922 0.2239 38ALA SC1 2673 26.220 3.768 11.666 -0.2081 0.4689 0.2888 39LEU BB 2674 26.189 4.185 11.438 0.1017 0.1645 -0.0549 39LEU SC1 2675 26.026 4.056 11.739 0.1749 0.3403 -0.1658 40LYS BB 2676 26.325 4.478 11.360 0.0604 -0.3752 0.2956 40LYS SC1 2677 26.328 4.605 11.685 0.1544 0.4195 0.2438 40LYS SC2 2678 26.592 4.562 11.896 0.5147 0.0792 0.1178 41ASP BB 2679 26.611 4.590 11.336 -0.2114 -0.1656 -0.1929 41ASP SC1 2680 26.809 4.411 11.549 0.2740 -0.2861 -0.0449 42ASP BB 2681 26.700 4.605 11.029 -0.2917 0.0041 0.1219 42ASP SC1 2682 26.355 4.674 10.937 0.1130 0.2408 0.0291 43ASP BB 2683 26.732 4.907 10.987 0.0734 -0.2449 -0.0998 43ASP SC1 2684 26.924 4.877 10.724 0.2169 -0.3590 -0.3379 44ALA BB 2685 26.554 5.146 10.839 0.0949 -0.1130 0.1687 44ALA SC1 2686 26.496 5.391 10.935 -0.4937 -0.2112 0.1013 45GLU BB 2687 26.254 5.128 10.739 0.0590 -0.1055 -0.1992 45GLU SC1 2688 26.290 5.272 10.340 -0.0197 0.0893 -0.4006 46THR BB 2689 25.993 4.961 10.903 -0.0409 -0.2860 0.1894 46THR SC1 2690 25.996 5.158 11.136 0.0556 0.0894 -0.1188 47GLY BB 2691 25.663 5.099 10.929 0.1971 -0.2515 0.0591 48LEU BB 2692 25.402 4.993 11.071 0.0507 0.1495 0.0860 48LEU SC1 2693 25.499 4.698 11.230 -0.3527 -0.3195 0.0708 49THR BB 2694 25.206 5.222 11.217 0.0562 0.1980 0.1179 49THR SC1 2695 25.108 5.355 10.961 -0.4353 -0.1354 0.1193 50ASP BB 2696 25.092 5.207 11.516 0.1278 0.0964 0.4165 50ASP SC1 2697 25.234 5.527 11.556 -0.2297 -0.0456 0.3006 51GLY BB 2698 24.752 5.123 11.402 -0.4411 0.1055 -0.0041 52GLU BB 2699 24.543 5.193 11.610 -0.0424 -0.0509 -0.2391 52GLU SC1 2700 24.656 4.826 11.767 0.2191 -0.1500 -0.2772 53GLU BB 2701 24.236 5.302 11.568 -0.0352 0.2147 -0.2393 53GLU SC1 2702 24.307 5.686 11.609 -0.2034 -0.0534 -0.1162 54LYS BB 2703 24.018 5.038 11.483 -0.0238 0.2522 -0.0307 54LYS SC1 2704 24.095 4.915 11.745 -0.3568 0.1957 0.0571 54LYS SC2 2705 24.198 4.576 11.717 -0.1095 -0.2973 0.1797 55GLU BB 2706 24.018 4.966 11.179 -0.0949 -0.0369 -0.0563 55GLU SC1 2707 24.397 4.906 11.194 0.0661 0.1787 -0.0046 56GLU BB 2708 23.735 5.003 11.014 0.1431 0.0256 -0.0708 56GLU SC1 2709 23.534 4.901 11.328 -0.1312 -0.1490 -0.2854 57PRO BB 2710 23.723 5.091 10.677 -0.1919 0.0747 -0.2826 57PRO SC1 2711 23.434 5.156 10.581 -0.0140 -0.0334 -0.2675 58LYS BB 2712 23.823 5.414 10.637 -0.1409 0.0124 0.0208 58LYS SC1 2713 23.602 5.524 10.858 -0.5282 0.0582 -0.3757 58LYS SC2 2714 23.478 5.757 11.118 -0.0770 0.0176 0.1090 59GLU BB 2715 23.683 5.538 10.365 -0.3977 -0.0469 0.1286 59GLU SC1 2716 23.458 5.892 10.426 0.2400 0.1843 -0.2128 60GLU BB 2717 23.640 5.429 10.074 0.0793 -0.3462 -0.2053 60GLU SC1 2718 23.647 5.054 10.182 -0.2660 -0.1006 -0.0603 61GLU BB 2719 23.719 5.478 9.727 0.0764 -0.0393 0.0471 61GLU SC1 2720 23.490 5.779 9.554 0.1019 -0.1477 -0.0663 1LYS BB 2721 11.788 11.378 13.230 0.3408 0.3498 -0.2706 1LYS SC1 2722 11.818 11.212 12.919 0.0941 0.3138 0.0509 1LYS SC2 2723 12.066 11.204 12.635 0.0119 -0.1644 -0.3136 2LYS BB 2724 11.969 11.206 13.367 -0.2288 -0.0524 0.0332 2LYS SC1 2725 12.052 11.356 13.676 0.0506 0.2171 -0.2829 2LYS SC2 2726 12.013 11.355 14.041 0.0582 0.1583 -0.2408 3CYS BB 2727 11.904 10.951 13.495 0.0124 -0.0434 0.0006 3CYS SC1 2728 12.053 11.019 13.778 0.3871 0.1315 0.5757 4LEU BB 2729 11.845 10.650 13.518 -0.3326 0.0682 0.0648 4LEU SC1 2730 11.523 10.531 13.565 0.4476 0.0169 0.1614 5PHE BB 2731 11.830 10.456 13.222 0.2270 0.0150 -0.5969 5PHE SC1 2732 11.765 10.203 13.414 -0.4195 0.1418 -0.0409 5PHE SC2 2733 11.468 10.176 13.577 -0.3746 0.0279 0.0234 5PHE SC3 2734 11.507 9.988 13.360 -0.3160 -0.0113 0.0676 6LYS BB 2735 12.101 10.311 13.046 -0.1755 0.3782 -0.1261 6LYS SC1 2736 12.138 9.996 13.109 -0.1339 0.5155 -0.0541 6LYS SC2 2737 12.430 9.913 13.308 -0.2393 0.1517 0.0554 7LYS BB 2738 12.337 10.481 12.938 0.3334 -0.0762 0.1538 7LYS SC1 2739 12.288 10.464 12.628 -0.0191 -0.2573 -0.0585 7LYS SC2 2740 12.300 10.486 12.268 -0.0596 -0.0774 -0.2155 8LYS BB 2741 12.586 10.631 13.068 0.0764 0.0226 0.0801 8LYS SC1 2742 12.725 10.675 12.817 -0.0817 0.4493 0.4390 8LYS SC2 2743 13.042 10.730 12.976 0.0391 -0.1750 -0.3036 9ASN BB 2744 12.740 10.457 13.283 0.1376 0.0911 -0.1499 9ASN SC1 2745 12.814 10.146 13.275 -0.1566 -0.0468 0.1813 10LYS BB 2746 12.756 10.633 13.525 0.3029 -0.2625 -0.0561 10LYS SC1 2747 13.016 10.780 13.530 0.0301 0.2595 -0.1366 10LYS SC2 2748 13.251 10.674 13.821 -0.0584 -0.0659 -0.3161 11LYS BB 2749 12.780 10.530 13.835 0.3470 0.1272 0.2724 11LYS SC1 2750 12.505 10.501 13.966 0.0664 -0.1750 0.0054 11LYS SC2 2751 12.147 10.565 13.967 -0.3704 -0.0439 -0.0728 12LYS BB 2752 12.822 10.749 14.063 -0.1037 -0.2376 0.1447 12LYS SC1 2753 12.777 10.636 14.326 0.2722 -0.1843 -0.3723 12LYS SC2 2754 12.747 10.551 14.622 0.5160 0.1143 0.2809 13GLY BB 2755 13.075 11.001 14.070 0.2766 0.0576 0.2344 14LYS BB 2756 13.369 11.013 14.208 -0.1953 -0.1198 -0.0624 14LYS SC1 2757 13.588 10.742 14.156 -0.0155 -0.4973 -0.1393 14LYS SC2 2758 13.664 10.472 14.276 0.0439 -0.1844 0.1826 15GLU BB 2759 13.484 10.940 14.514 -0.2932 0.3851 -0.2831 15GLU SC1 2760 13.724 11.197 14.725 0.3193 -0.1037 -0.0006 16LYS BB 2761 13.582 10.651 14.693 0.1618 0.1699 -0.0656 16LYS SC1 2762 13.731 10.794 14.895 0.0665 0.2262 -0.2884 16LYS SC2 2763 13.663 10.988 15.149 0.2193 0.3194 0.3812 17GLY BB 2764 13.472 10.366 14.682 0.3096 -0.0617 0.1042 18GLY BB 2765 13.409 10.198 14.972 -0.1727 0.0156 -0.0047 19LYS BB 2766 13.512 9.875 14.877 0.3107 0.0224 -0.0092 19LYS SC1 2767 13.653 9.739 15.138 0.0442 0.2161 -0.0055 19LYS SC2 2768 13.922 9.585 15.321 -0.2821 -0.1753 -0.0426 20ASN BB 2769 13.257 9.716 14.771 -0.0174 0.0038 -0.1539 20ASN SC1 2770 13.376 9.614 14.449 -0.4081 -0.1699 -0.2646 21ALA BB 2771 13.246 9.425 14.904 -0.1232 0.1801 -0.1419 21ALA SC1 2772 13.495 9.353 14.831 -0.1628 -0.1162 0.0026 22ILE BB 2773 13.069 9.398 15.226 0.1272 0.2411 0.1124 22ILE SC1 2774 12.824 9.635 15.220 -0.1122 -0.0040 -0.0941 23ASN BB 2775 13.123 9.251 15.523 -0.2255 0.1731 -0.3125 23ASN SC1 2776 13.294 8.940 15.448 0.3172 -0.1418 0.0788 24MET BB 2777 12.850 9.373 15.699 -0.2547 0.4387 0.0731 24MET SC1 2778 13.007 9.707 15.797 -0.0051 -0.0222 0.0514 25LYS BB 2779 12.672 9.227 15.841 -0.0288 0.1066 -0.3440 25LYS SC1 2780 12.773 8.994 16.014 -0.3751 0.2498 -0.2654 25LYS SC2 2781 12.789 8.608 15.929 0.1961 -0.3079 0.0295 26ASP BB 2782 12.424 9.038 15.782 -0.1821 0.0735 0.1666 26ASP SC1 2783 12.208 9.188 15.609 0.3034 0.0755 -0.2907 27VAL BB 2784 12.239 8.940 16.017 -0.2437 -0.3210 0.0430 27VAL SC1 2785 12.452 8.760 16.104 0.0703 -0.0766 -0.1998 28LYS BB 2786 12.215 9.144 16.256 0.2101 -0.0243 0.1000 28LYS SC1 2787 12.386 9.335 16.184 -0.0952 -0.0183 0.2261 28LYS SC2 2788 12.541 9.639 16.041 0.1776 -0.4109 0.2611 29ASP BB 2789 11.988 9.046 16.431 0.0710 -0.0505 -0.1184 29ASP SC1 2790 11.840 8.877 16.192 0.0545 0.4171 -0.3336 30LEU BB 2791 11.985 8.769 16.663 0.0538 0.2520 0.0133 30LEU SC1 2792 12.150 8.525 16.445 -0.1439 -0.0167 -0.0854 31GLY BB 2793 11.778 8.515 16.579 0.0029 -0.2242 0.0164 32LYS BB 2794 11.524 8.521 16.390 -0.2158 -0.1243 0.1290 32LYS SC1 2795 11.213 8.494 16.491 0.2917 -0.0500 -0.0196 32LYS SC2 2796 10.853 8.579 16.581 -0.3176 0.2248 0.2517 33THR BB 2797 11.491 8.263 16.217 -0.3662 -0.1769 0.0192 33THR SC1 2798 11.620 8.055 16.398 -0.1649 0.0286 0.1174 34MET BB 2799 11.603 8.189 15.914 0.3191 -0.0418 -0.1571 34MET SC1 2800 11.922 8.027 15.993 0.1075 0.0873 -0.0340 35LYS BB 2801 11.410 8.199 15.646 0.1593 -0.2039 0.2623 35LYS SC1 2802 11.218 8.383 15.629 0.1867 -0.1067 0.1004 35LYS SC2 2803 11.105 8.676 15.626 0.1181 -0.2307 0.1414 36ASP BB 2804 11.514 8.252 15.323 0.2269 0.1981 -0.2181 36ASP SC1 2805 11.545 8.574 15.354 -0.1244 0.3302 -0.1949 37GLN BB 2806 11.328 8.033 15.133 -0.0239 -0.0332 -0.0384 37GLN SC1 2807 11.415 8.135 14.791 0.1187 -0.0189 0.1157 38ALA BB 2808 11.364 7.799 15.351 -0.1017 0.1287 0.1049 38ALA SC1 2809 11.501 7.632 15.189 -0.0211 0.3746 -0.0886 39LEU BB 2810 11.362 7.673 15.679 -0.2105 -0.0206 -0.0495 39LEU SC1 2811 10.987 7.630 15.707 -0.0865 -0.0902 -0.4318 40LYS BB 2812 11.630 7.592 15.860 0.0195 -0.3144 -0.0792 40LYS SC1 2813 11.591 7.777 16.083 0.2044 0.1015 -0.0913 40LYS SC2 2814 11.842 7.667 16.306 0.2539 0.2335 -0.1234 41ASP BB 2815 11.972 7.582 15.822 -0.1093 0.4613 -0.0230 41ASP SC1 2816 12.014 7.391 16.075 -0.1264 0.1487 0.0878 42ASP BB 2817 12.071 7.465 15.535 -0.3174 -0.0266 -0.1264 42ASP SC1 2818 12.184 7.721 15.304 0.2401 -0.1338 -0.2788 43ASP BB 2819 12.127 7.223 15.443 0.2018 -0.1811 -0.2405 43ASP SC1 2820 12.399 7.096 15.376 0.0231 -0.1935 -0.0532 44ALA BB 2821 11.995 6.943 15.391 0.1787 -0.2604 -0.1527 44ALA SC1 2822 11.811 6.825 15.549 0.0234 0.0853 -0.0668 45GLU BB 2823 11.907 6.920 15.117 -0.1020 -0.0435 -0.0476 45GLU SC1 2824 11.548 6.821 15.083 0.0819 0.2240 -0.2126 46THR BB 2825 12.221 6.831 14.997 0.1226 -0.0906 0.0376 46THR SC1 2826 12.462 7.004 14.925 0.1509 -0.2209 -0.1918 47GLY BB 2827 12.422 6.647 15.189 0.1213 -0.3569 0.3709 48LEU BB 2828 12.720 6.607 15.312 0.1408 0.0734 0.0631 48LEU SC1 2829 12.932 6.739 15.084 -0.2681 0.1332 0.4747 49THR BB 2830 12.785 6.406 15.549 0.0852 0.2524 0.1665 49THR SC1 2831 13.006 6.244 15.415 -0.0560 0.1887 0.0058 50ASP BB 2832 12.685 6.298 15.855 0.2238 0.0507 -0.0907 50ASP SC1 2833 12.900 6.441 16.078 0.0705 -0.0532 0.1826 51GLY BB 2834 12.360 6.332 15.955 0.2581 -0.1144 -0.0187 52GLU BB 2835 12.205 6.051 16.011 0.1529 -0.0667 0.0300 52GLU SC1 2836 11.808 6.043 16.026 0.1109 0.1206 -0.0127 53GLU BB 2837 12.390 5.837 15.850 0.2993 -0.2508 -0.0244 53GLU SC1 2838 12.630 5.849 16.157 -0.1709 0.2313 0.2430 54LYS BB 2839 12.380 5.689 15.571 -0.0615 0.0185 0.1789 54LYS SC1 2840 12.105 5.792 15.496 -0.0325 0.0575 0.0262 54LYS SC2 2841 11.885 6.074 15.572 -0.0944 0.1134 0.1554 55GLU BB 2842 12.531 5.749 15.304 -0.0446 -0.3797 -0.1738 55GLU SC1 2843 12.660 6.081 15.134 0.1624 -0.0614 -0.0560 56GLU BB 2844 12.731 5.528 15.080 0.1567 -0.0821 -0.1405 56GLU SC1 2845 12.975 5.731 14.856 0.2429 0.1626 0.0621 57PRO BB 2846 12.985 5.313 15.170 -0.2410 -0.0971 0.3142 57PRO SC1 2847 12.877 5.300 15.487 0.2528 0.2252 0.2992 58LYS BB 2848 13.303 5.313 15.134 -0.0686 0.2203 -0.0550 58LYS SC1 2849 13.353 5.395 15.419 0.1326 -0.4435 0.1628 58LYS SC2 2850 13.627 5.230 15.567 -0.2409 0.0217 -0.2648 59GLU BB 2851 13.536 5.192 14.939 0.0457 -0.1431 -0.1734 59GLU SC1 2852 13.624 4.905 15.161 -0.0071 -0.1734 -0.0101 60GLU BB 2853 13.667 5.282 14.660 0.2478 -0.2825 0.1905 60GLU SC1 2854 13.820 5.599 14.875 0.4125 -0.0834 -0.1370 61GLU BB 2855 13.434 5.174 14.447 0.1369 0.0769 -0.0882 61GLU SC1 2856 13.432 4.935 14.180 0.2174 0.1622 -0.0182 1LYS BB 2857 21.982 10.289 12.211 -0.0853 0.0967 0.0459 1LYS SC1 2858 22.181 10.540 12.134 -0.2047 -0.0053 0.0680 1LYS SC2 2859 22.138 10.704 11.818 0.1807 0.2792 -0.0358 2LYS BB 2860 21.697 10.464 12.173 -0.2288 -0.0678 -0.3229 2LYS SC1 2861 21.413 10.476 11.986 0.0126 0.1614 0.3855 2LYS SC2 2862 21.125 10.286 11.885 0.0843 -0.0186 0.1313 3CYS BB 2863 21.479 10.604 12.415 -0.0554 -0.1539 -0.1338 3CYS SC1 2864 21.187 10.540 12.342 -0.0463 -0.1616 -0.0628 4LEU BB 2865 21.574 10.634 12.814 0.1913 -0.0042 -0.0149 4LEU SC1 2866 21.782 10.882 12.990 0.1421 0.2731 -0.2813 5PHE BB 2867 21.315 10.718 13.064 -0.0380 0.3654 -0.2094 5PHE SC1 2868 21.132 10.490 13.142 0.0192 0.0320 0.2490 5PHE SC2 2869 20.854 10.368 12.989 -0.0708 0.0446 0.4011 5PHE SC3 2870 21.042 10.168 13.083 0.1319 0.0427 0.0084 6LYS BB 2871 21.200 11.007 12.960 0.0336 -0.0689 0.0365 6LYS SC1 2872 21.410 11.000 12.717 -0.0104 -0.1132 0.0462 6LYS SC2 2873 21.411 11.255 12.387 0.2762 -0.0897 -0.4140 7LYS BB 2874 20.889 11.018 12.999 -0.0757 -0.0580 -0.0197 7LYS SC1 2875 20.679 10.925 12.817 0.2811 -0.0294 -0.1046 7LYS SC2 2876 20.487 10.638 12.691 0.0197 -0.0381 -0.4355 8LYS BB 2877 20.866 11.078 13.354 -0.4761 -0.3070 0.0319 8LYS SC1 2878 21.052 10.842 13.400 -0.1419 -0.0329 -0.3797 8LYS SC2 2879 21.340 10.786 13.495 -0.0276 0.1576 -0.0942 9ASN BB 2880 20.640 11.173 13.631 -0.0235 0.2143 -0.0237 9ASN SC1 2881 20.498 10.894 13.579 0.0052 0.2144 -0.1494 10LYS BB 2882 20.555 11.378 13.859 -0.0832 0.0048 0.4963 10LYS SC1 2883 20.755 11.328 14.073 0.0123 0.0184 -0.1113 10LYS SC2 2884 20.978 11.428 14.297 0.3956 -0.0827 -0.2556 11LYS BB 2885 20.456 11.706 13.929 0.0734 0.1561 0.0107 11LYS SC1 2886 20.593 11.958 13.712 -0.1676 0.1794 0.1861 11LYS SC2 2887 20.813 12.040 13.431 0.0065 0.3827 -0.1452 12LYS BB 2888 20.178 11.725 14.050 -0.0997 -0.1213 0.1384 12LYS SC1 2889 20.250 11.908 14.314 0.1252 -0.2817 0.3135 12LYS SC2 2890 20.312 12.252 14.318 -0.0118 -0.2705 -0.1348 13GLY BB 2891 20.014 11.517 13.885 -0.2000 -0.0718 -0.0538 14LYS BB 2892 19.715 11.689 13.824 0.0465 0.0626 0.1354 14LYS SC1 2893 19.799 11.745 13.535 -0.2690 -0.0193 0.1483 14LYS SC2 2894 19.907 11.749 13.214 0.1270 0.0463 -0.1730 15GLU BB 2895 19.469 11.474 13.975 0.0117 0.1395 0.2499 15GLU SC1 2896 19.110 11.561 14.214 0.0243 0.1405 0.0457 16LYS BB 2897 19.327 11.249 13.799 0.0355 -0.0095 -0.1576 16LYS SC1 2898 19.011 11.354 13.760 -0.0184 0.2265 0.2059 16LYS SC2 2899 18.901 11.527 13.483 0.0484 -0.0015 0.3016 17GLY BB 2900 19.438 11.036 13.586 0.1695 -0.0598 -0.1178 18GLY BB 2901 19.599 10.982 13.309 0.1122 -0.2718 0.0654 19LYS BB 2902 19.460 10.954 13.014 0.1112 -0.3622 -0.0852 19LYS SC1 2903 19.173 10.810 13.020 -0.2318 0.1591 0.0052 19LYS SC2 2904 19.029 10.602 12.776 0.3249 0.0288 -0.4923 20ASN BB 2905 19.620 10.960 12.699 0.1946 -0.2136 -0.2898 20ASN SC1 2906 19.416 10.706 12.589 -0.3271 -0.1877 -0.0974 21ALA BB 2907 19.844 11.220 12.580 0.0594 -0.0596 0.1058 21ALA SC1 2908 20.052 11.056 12.527 0.0018 -0.0809 -0.0593 22ILE BB 2909 19.838 11.408 12.325 -0.2215 0.6289 -0.1227 22ILE SC1 2910 20.171 11.479 12.316 -0.1432 0.2993 0.0220 23ASN BB 2911 19.758 11.371 12.009 0.0693 0.1623 0.2629 23ASN SC1 2912 19.513 11.629 11.998 -0.4039 0.1856 -0.2637 24MET BB 2913 19.798 11.123 11.767 0.4733 -0.1084 0.2751 24MET SC1 2914 19.513 10.851 11.830 -0.1622 0.0028 -0.0832 25LYS BB 2915 19.980 10.963 11.480 -0.0752 0.1972 -0.0662 25LYS SC1 2916 19.989 10.666 11.545 -0.0489 0.0643 -0.0712 25LYS SC2 2917 19.973 10.512 11.864 0.2605 0.0804 0.3140 26ASP BB 2918 20.277 11.011 11.346 0.0454 0.0495 -0.0913 26ASP SC1 2919 20.525 10.943 11.601 0.0361 -0.0629 0.0035 27VAL BB 2920 20.354 11.289 11.117 -0.3058 0.3179 0.3220 27VAL SC1 2921 20.582 11.374 11.279 0.1344 0.0480 -0.1273 28LYS BB 2922 20.138 11.577 11.190 0.1090 -0.2405 0.0116 28LYS SC1 2923 20.338 11.771 11.217 -0.4023 -0.0963 -0.0564 28LYS SC2 2924 20.722 11.846 11.262 0.0310 -0.2454 -0.2775 29ASP BB 2925 19.863 11.423 11.266 -0.1082 -0.0058 0.2181 29ASP SC1 2926 19.743 11.563 11.542 0.1164 0.2090 -0.3835 30LEU BB 2927 19.754 11.354 10.942 -0.1172 0.2073 -0.0295 30LEU SC1 2928 19.996 11.099 11.012 -0.2607 -0.1662 0.3633 31GLY BB 2929 19.762 11.493 10.666 -0.1054 -0.2524 0.1528 32LYS BB 2930 19.609 11.820 10.683 0.2140 0.2028 0.1597 32LYS SC1 2931 19.407 11.743 10.936 0.2324 0.0844 -0.2195 32LYS SC2 2932 19.390 11.591 11.282 -0.3775 -0.0825 0.0239 33THR BB 2933 19.415 11.971 10.524 0.1480 0.0444 -0.0097 33THR SC1 2934 19.585 12.197 10.410 0.2876 -0.0250 0.0582 34MET BB 2935 19.176 12.101 10.724 0.4723 -0.0210 0.3953 34MET SC1 2936 19.180 12.482 10.662 0.0790 0.2480 0.1520 35LYS BB 2937 18.957 11.863 10.661 -0.0128 0.1310 -0.0030 35LYS SC1 2938 19.065 11.625 10.570 0.0051 0.1564 0.0789 35LYS SC2 2939 19.350 11.518 10.403 0.0085 0.3413 -0.5882 36ASP BB 2940 18.888 11.715 10.942 0.2376 0.0035 -0.1108 36ASP SC1 2941 18.814 11.402 10.886 -0.3882 -0.2734 0.4072 37GLN BB 2942 18.718 11.790 11.254 0.0363 0.0866 -0.0789 37GLN SC1 2943 18.768 12.172 11.171 0.1257 0.1921 -0.3416 38ALA BB 2944 18.560 11.506 11.320 0.0118 0.0344 -0.2938 38ALA SC1 2945 18.684 11.432 11.549 -0.1925 -0.1050 -0.2246 39LEU BB 2946 18.317 11.318 11.262 -0.0125 0.1236 0.0579 39LEU SC1 2947 18.585 11.067 11.193 0.0628 -0.3590 0.3915 40LYS BB 2948 18.003 11.323 11.207 0.3190 -0.3430 0.0999 40LYS SC1 2949 17.907 11.085 10.970 0.0764 -0.0949 -0.2797 40LYS SC2 2950 17.718 10.853 11.096 0.1097 0.0035 -0.4354 41ASP BB 2951 17.863 11.231 11.496 0.0672 0.2054 0.1286 41ASP SC1 2952 17.537 11.130 11.467 -0.3175 -0.6495 -0.0702 42ASP BB 2953 17.836 11.486 11.628 -0.0364 -0.0250 -0.0433 42ASP SC1 2954 18.175 11.549 11.641 -0.2080 0.2811 0.0113 43ASP BB 2955 17.766 11.624 11.939 -0.2241 0.3158 -0.4334 43ASP SC1 2956 17.500 11.759 11.826 -0.0679 -0.2708 -0.4346 44ALA BB 2957 17.743 11.386 12.192 0.5474 -0.2282 0.3058 44ALA SC1 2958 17.885 11.547 12.355 0.5305 0.0356 0.0684 45GLU BB 2959 17.495 11.412 12.362 0.1743 0.1036 0.1833 45GLU SC1 2960 17.281 11.066 12.317 -0.0860 -0.3614 0.0432 46THR BB 2961 17.313 11.668 12.276 -0.1327 -0.0882 0.1339 46THR SC1 2962 17.038 11.537 12.250 0.0415 -0.4213 -0.1048 47GLY BB 2963 17.390 11.992 12.217 0.4181 -0.3820 0.2690 48LEU BB 2964 17.305 12.221 12.438 0.1110 -0.1755 -0.1038 48LEU SC1 2965 17.087 12.349 12.173 -0.1451 -0.0898 -0.3337 49THR BB 2966 17.504 12.428 12.585 0.0543 0.0618 0.2060 49THR SC1 2967 17.618 12.200 12.753 0.1638 0.1528 0.2565 50ASP BB 2968 17.834 12.379 12.423 -0.3157 -0.2739 0.0668 50ASP SC1 2969 17.656 12.458 12.141 -0.0332 0.2707 -0.1665 51GLY BB 2970 18.021 12.222 12.199 -0.4227 -0.1733 -0.2433 52GLU BB 2971 18.321 12.267 12.323 0.0397 -0.0509 -0.1101 52GLU SC1 2972 18.350 12.576 12.523 0.0630 0.2263 0.0491 53GLU BB 2973 18.617 12.205 12.221 -0.0582 -0.0214 -0.3609 53GLU SC1 2974 18.875 12.448 12.144 -0.6509 0.0434 0.0063 54LYS BB 2975 18.625 11.900 12.106 -0.1685 0.3196 -0.0350 54LYS SC1 2976 18.718 11.773 11.838 0.2582 -0.1362 0.0532 54LYS SC2 2977 18.435 11.869 11.607 0.1748 -0.2740 -0.0934 55GLU BB 2978 18.556 11.686 12.388 -0.2186 -0.2553 0.2690 55GLU SC1 2979 18.257 11.849 12.550 0.0938 -0.1225 0.0689 56GLU BB 2980 18.725 11.407 12.528 0.0519 0.1348 0.0779 56GLU SC1 2981 18.514 11.086 12.633 -0.1499 -0.2932 -0.1643 57PRO BB 2982 19.017 11.544 12.646 0.2321 -0.1405 -0.0365 57PRO SC1 2983 19.260 11.567 12.435 -0.0887 -0.3582 -0.1443 58LYS BB 2984 19.098 11.783 12.882 -0.3217 0.0370 0.0284 58LYS SC1 2985 19.336 11.966 12.755 0.1565 -0.0119 -0.3866 58LYS SC2 2986 19.629 12.095 12.819 -0.1385 -0.2012 -0.2299 59GLU BB 2987 18.947 11.882 13.150 0.2080 -0.0516 0.0378 59GLU SC1 2988 19.035 12.248 13.028 0.1397 -0.1245 0.0194 60GLU BB 2989 18.654 11.860 13.218 -0.1321 0.0449 -0.0504 60GLU SC1 2990 18.721 11.963 13.628 -0.1489 0.0535 0.0825 61GLU BB 2991 18.352 11.957 13.145 0.2064 0.2559 -0.3325 61GLU SC1 2992 18.040 11.890 13.357 0.0980 0.1026 -0.0841 1LYS BB 2993 18.530 3.987 4.985 -0.3310 0.0718 0.1040 1LYS SC1 2994 18.537 4.326 4.927 -0.0560 0.1444 -0.1818 1LYS SC2 2995 18.355 4.552 5.126 0.0932 0.0904 0.1271 2LYS BB 2996 18.579 3.726 5.168 0.0996 -0.1185 0.2015 2LYS SC1 2997 18.382 3.472 5.255 0.0151 -0.0743 -0.1995 2LYS SC2 2998 18.161 3.151 5.259 0.0848 -0.1632 0.3285 3CYS BB 2999 18.603 3.730 5.507 -0.0579 -0.1119 0.0411 3CYS SC1 3000 18.628 3.390 5.530 0.0438 -0.2800 -0.3929 4LEU BB 3001 18.615 3.900 5.781 0.3669 -0.1299 0.0084 4LEU SC1 3002 18.880 3.657 5.795 0.2280 -0.1451 0.0187 5PHE BB 3003 18.394 3.897 6.028 -0.3802 -0.0359 0.1425 5PHE SC1 3004 18.315 3.609 6.041 0.1542 -0.1546 0.1196 5PHE SC2 3005 18.541 3.431 5.860 -0.0303 -0.2044 -0.0664 5PHE SC3 3006 18.388 3.277 6.051 0.1408 -0.1577 0.1118 6LYS BB 3007 18.154 4.089 6.051 -0.0220 -0.2560 0.2342 6LYS SC1 3008 18.045 4.000 6.335 0.3465 0.1624 0.3736 6LYS SC2 3009 17.818 4.017 6.603 -0.0250 0.5295 0.2821 7LYS BB 3010 18.134 4.347 5.956 0.1772 -0.0330 -0.1810 7LYS SC1 3011 18.452 4.420 5.915 0.0953 0.0198 -0.1797 7LYS SC2 3012 18.705 4.262 6.065 0.1953 -0.2583 -0.1348 8LYS BB 3013 17.958 4.580 5.931 0.1295 0.0020 0.1471 8LYS SC1 3014 18.111 4.850 5.990 0.3083 0.1804 0.1923 8LYS SC2 3015 18.168 5.026 6.251 0.0156 -0.1965 0.0031 9ASN BB 3016 17.667 4.694 5.971 0.2541 -0.1290 -0.0793 9ASN SC1 3017 17.556 4.558 5.729 -0.2164 0.0731 -0.2503 10LYS BB 3018 17.441 4.596 6.199 0.1125 -0.1372 0.2727 10LYS SC1 3019 17.145 4.497 6.201 0.1792 0.2801 0.0531 10LYS SC2 3020 16.974 4.213 6.263 -0.0888 0.0880 -0.2315 11LYS BB 3021 17.392 4.910 6.288 0.1505 0.0828 -0.1274 11LYS SC1 3022 17.481 5.183 6.116 0.0329 0.0838 0.2046 11LYS SC2 3023 17.440 5.499 5.884 -0.2177 0.1898 0.2200 12LYS BB 3024 17.209 5.005 6.568 0.1768 -0.2315 -0.2386 12LYS SC1 3025 16.955 5.130 6.373 -0.2677 -0.1707 -0.0219 12LYS SC2 3026 16.629 5.036 6.424 -0.4449 0.0107 0.0600 13GLY BB 3027 17.260 5.000 6.914 -0.0005 -0.0078 0.0597 14LYS BB 3028 17.233 4.716 7.155 -0.0001 0.2310 0.1124 14LYS SC1 3029 16.900 4.764 7.164 -0.1074 -0.1426 -0.3649 14LYS SC2 3030 16.553 4.820 7.134 0.2909 -0.1598 -0.2218 15GLU BB 3031 17.515 4.528 7.172 -0.3490 -0.4597 -0.4462 15GLU SC1 3032 17.484 4.280 6.892 -0.0249 -0.2149 -0.0972 16LYS BB 3033 17.767 4.775 7.277 0.0191 0.0375 -0.0397 16LYS SC1 3034 17.680 4.841 6.944 -0.0840 -0.1776 0.1572 16LYS SC2 3035 17.541 4.677 6.668 0.0994 0.3137 -0.0963 17GLY BB 3036 18.097 4.918 7.279 0.1383 0.1432 0.0501 18GLY BB 3037 18.259 5.193 7.417 0.0405 -0.1105 0.2216 19LYS BB 3038 18.459 5.495 7.291 -0.0400 0.1509 0.2224 19LYS SC1 3039 18.614 5.734 7.389 -0.2015 -0.2209 0.0296 19LYS SC2 3040 18.964 5.764 7.360 0.2387 -0.1931 0.2691 20ASN BB 3041 18.534 5.593 7.014 -0.0363 0.0373 -0.1523 20ASN SC1 3042 18.388 5.214 6.895 -0.3569 0.0550 0.0259 21ALA BB 3043 18.451 5.893 6.906 -0.0517 -0.0369 -0.0768 21ALA SC1 3044 18.353 5.981 7.142 0.2582 -0.2173 0.1264 22ILE BB 3045 18.557 5.935 6.635 0.0050 -0.1247 -0.0819 22ILE SC1 3046 18.549 5.604 6.551 0.2654 -0.1068 -0.1887 23ASN BB 3047 18.807 6.124 6.563 -0.0911 0.2937 -0.0313 23ASN SC1 3048 19.043 5.950 6.405 0.0298 -0.5033 0.2161 24MET BB 3049 19.069 6.296 6.698 0.1333 0.1400 -0.0144 24MET SC1 3050 19.305 6.053 6.783 -0.1562 0.0399 0.0621 25LYS BB 3051 19.144 6.599 6.542 -0.2580 0.1207 -0.2407 25LYS SC1 3052 19.350 6.622 6.327 0.0359 -0.1024 0.0934 25LYS SC2 3053 19.706 6.624 6.210 0.0260 -0.2433 0.2237 26ASP BB 3054 18.841 6.768 6.461 -0.3007 0.1337 -0.1783 26ASP SC1 3055 18.636 6.543 6.608 0.4248 0.2400 0.5071 27VAL BB 3056 18.862 7.010 6.234 0.1280 0.3000 -0.2349 27VAL SC1 3057 18.718 7.264 6.229 -0.1181 0.1763 0.1326 28LYS BB 3058 19.197 7.090 6.233 0.0964 -0.0184 0.0946 28LYS SC1 3059 19.221 7.152 5.931 -0.2260 0.0823 0.0418 28LYS SC2 3060 19.117 6.944 5.691 0.1139 0.1913 -0.1185 29ASP BB 3061 19.232 7.131 6.549 0.2693 -0.1690 0.2586 29ASP SC1 3062 19.489 7.353 6.531 -0.2689 0.2695 0.0765 30LEU BB 3063 19.081 7.035 6.802 0.0530 -0.2140 -0.1245 30LEU SC1 3064 19.346 6.866 6.892 0.3007 -0.1004 -0.2517 31GLY BB 3065 18.937 6.743 6.991 0.2040 -0.3361 0.1549 32LYS BB 3066 19.156 6.548 7.142 0.2893 -0.1180 0.1050 32LYS SC1 3067 19.403 6.417 7.007 0.0075 0.2415 0.0093 32LYS SC2 3068 19.674 6.260 6.905 0.0437 0.0824 -0.0946 33THR BB 3069 19.020 6.275 7.376 -0.2055 0.0963 0.2202 33THR SC1 3070 19.215 6.296 7.609 0.1298 -0.0209 -0.0408 34MET BB 3071 18.727 6.157 7.310 -0.1679 0.1139 -0.3475 34MET SC1 3072 18.668 6.308 6.991 -0.5413 -0.3381 -0.0357 35LYS BB 3073 18.406 6.235 7.444 -0.3091 0.1741 0.0674 35LYS SC1 3074 18.425 6.551 7.548 0.2450 0.0114 0.1412 35LYS SC2 3075 18.189 6.768 7.724 0.2983 -0.5018 -0.0978 36ASP BB 3076 18.088 6.184 7.482 0.1616 0.1059 -0.1716 36ASP SC1 3077 17.963 6.433 7.609 0.0938 -0.0357 -0.0669 37GLN BB 3078 17.883 6.112 7.231 -0.2827 -0.2625 0.0727 37GLN SC1 3079 17.591 6.136 7.518 -0.2377 -0.0736 0.2040 38ALA BB 3080 17.656 5.859 7.171 0.1455 0.0453 0.1865 38ALA SC1 3081 17.698 5.598 7.120 -0.0384 0.0078 0.2173 39LEU BB 3082 17.525 5.832 6.875 -0.0732 -0.1494 0.2810 39LEU SC1 3083 17.716 5.583 6.724 0.1857 -0.2464 0.3086 40LYS BB 3084 17.606 6.035 6.639 0.0680 -0.0485 0.0653 40LYS SC1 3085 17.396 6.208 6.667 0.2612 -0.0731 0.1454 40LYS SC2 3086 17.167 6.226 6.405 0.2235 -0.2202 0.1573 41ASP BB 3087 17.639 6.094 6.315 -0.2347 0.2348 0.0107 41ASP SC1 3088 17.423 5.870 6.178 -0.3329 -0.1517 -0.0440 42ASP BB 3089 17.778 6.325 6.094 0.0879 0.2869 0.0928 42ASP SC1 3090 17.619 6.520 6.337 -0.2884 -0.0553 0.3099 43ASP BB 3091 18.053 6.559 6.125 0.1192 -0.0324 0.2524 43ASP SC1 3092 18.220 6.495 5.839 0.1613 0.4946 -0.1759 44ALA BB 3093 18.049 6.888 6.137 0.0713 0.4747 -0.0064 44ALA SC1 3094 18.289 6.944 6.249 0.0349 0.2158 0.2134 45GLU BB 3095 18.104 6.985 5.834 -0.2183 0.0035 -0.1154 45GLU SC1 3096 17.822 7.104 5.580 -0.1166 0.2664 0.2011 46THR BB 3097 18.388 7.133 5.887 -0.0868 -0.1167 0.1365 46THR SC1 3098 18.470 7.403 5.770 -0.2079 -0.1400 -0.0044 47GLY BB 3099 18.709 7.030 5.850 -0.1875 0.0605 -0.0127 48LEU BB 3100 18.747 7.143 5.519 -0.4721 -0.3796 0.0530 48LEU SC1 3101 18.718 7.525 5.453 -0.4427 -0.2185 -0.2870 49THR BB 3102 18.833 6.897 5.229 0.1111 -0.1724 -0.0710 49THR SC1 3103 18.547 6.933 5.128 0.1019 -0.1239 -0.0278 50ASP BB 3104 18.824 6.559 5.237 -0.4588 -0.2798 0.0548 50ASP SC1 3105 18.835 6.618 5.603 -0.1875 -0.0150 -0.3530 51GLY BB 3106 18.673 6.309 5.043 0.0340 0.2181 0.3114 52GLU BB 3107 18.730 6.287 4.720 0.1380 0.1314 -0.2356 52GLU SC1 3108 18.432 6.025 4.626 0.1526 -0.2818 -0.1766 53GLU BB 3109 19.010 6.229 4.611 0.0774 0.0165 -0.1362 53GLU SC1 3110 19.105 5.894 4.669 0.2112 -0.1745 0.1479 54LYS BB 3111 19.177 6.319 4.312 0.0477 0.0704 -0.2767 54LYS SC1 3112 18.954 6.239 4.113 -0.0237 -0.4199 0.0311 54LYS SC2 3113 18.821 6.165 3.783 0.0432 -0.0014 -0.1822 55GLU BB 3114 19.205 6.670 4.203 -0.1004 0.1528 -0.1683 55GLU SC1 3115 18.940 6.647 3.953 0.1529 0.0596 -0.0903 56GLU BB 3116 19.343 6.964 4.227 -0.0472 -0.2356 0.2959 56GLU SC1 3117 19.750 6.936 4.280 -0.0626 -0.1409 0.1335 57PRO BB 3118 19.218 7.213 4.390 0.3556 -0.0843 0.0384 57PRO SC1 3119 19.178 7.489 4.233 0.0027 0.2156 0.1748 58LYS BB 3120 19.132 7.260 4.696 0.3469 0.0365 -0.2185 58LYS SC1 3121 19.193 7.548 4.712 -0.1649 0.2502 0.0693 58LYS SC2 3122 19.243 7.826 4.542 0.0610 0.2997 0.1380 59GLU BB 3123 18.907 7.047 4.781 -0.2342 0.3473 -0.1040 59GLU SC1 3124 19.071 6.737 4.660 -0.0333 0.1950 0.1016 60GLU BB 3125 18.644 7.050 4.662 -0.1244 -0.0617 0.0881 60GLU SC1 3126 18.724 7.327 4.392 0.0205 0.0473 -0.1055 61GLU BB 3127 18.407 6.923 4.665 -0.1894 0.1694 -0.0666 61GLU SC1 3128 18.223 7.149 4.916 0.1276 -0.2603 0.0195 1LYS BB 3129 24.981 9.882 12.740 0.1625 0.0487 0.0099 1LYS SC1 3130 24.779 9.997 12.518 0.0168 -0.1013 0.0309 1LYS SC2 3131 24.576 10.031 12.212 0.2084 -0.1123 -0.0864 2LYS BB 3132 25.271 9.803 12.612 -0.2797 -0.0647 0.1295 2LYS SC1 3133 25.379 9.502 12.468 -0.1430 -0.1726 -0.2760 2LYS SC2 3134 25.734 9.352 12.533 0.1664 -0.0728 -0.0379 3CYS BB 3135 25.568 9.953 12.634 -0.1231 -0.1437 -0.1065 3CYS SC1 3136 25.793 9.778 12.476 0.3158 -0.2311 0.2426 4LEU BB 3137 25.675 10.249 12.491 -0.1637 0.1528 -0.1403 4LEU SC1 3138 25.492 10.534 12.593 0.0845 -0.1578 0.2284 5PHE BB 3139 25.782 10.213 12.223 -0.0311 -0.0743 0.1573 5PHE SC1 3140 26.079 10.286 12.268 -0.2873 -0.0393 -0.2435 5PHE SC2 3141 26.259 10.197 11.993 0.0313 0.0420 -0.0664 5PHE SC3 3142 26.217 10.483 12.027 -0.1029 0.0257 -0.0873 6LYS BB 3143 25.711 10.134 11.924 0.1783 -0.1561 0.0292 6LYS SC1 3144 25.897 10.322 11.756 0.3017 0.3271 -0.1443 6LYS SC2 3145 26.124 10.408 11.536 0.1219 -0.1378 0.2379 7LYS BB 3146 25.398 10.113 11.795 0.3578 -0.0084 0.0651 7LYS SC1 3147 25.407 10.273 11.575 0.0494 0.0126 -0.1800 7LYS SC2 3148 25.244 10.396 11.295 0.3443 -0.2810 0.4259 8LYS BB 3149 25.285 9.809 11.797 -0.0837 -0.0061 0.0609 8LYS SC1 3150 25.512 9.630 11.743 0.2958 0.3224 -0.1822 8LYS SC2 3151 25.851 9.640 11.755 -0.2194 -0.3242 0.0401 9ASN BB 3152 25.007 9.656 11.740 -0.0158 -0.1576 0.0750 9ASN SC1 3153 24.905 9.439 12.014 0.4618 -0.2643 -0.1349 10LYS BB 3154 24.705 9.813 11.825 -0.1057 0.1667 -0.0295 10LYS SC1 3155 24.536 9.630 11.911 -0.1488 0.0001 -0.3180 10LYS SC2 3156 24.468 9.243 11.940 0.3658 0.0138 -0.2626 11LYS BB 3157 24.453 10.012 11.694 -0.1734 -0.1770 -0.0906 11LYS SC1 3158 24.191 9.844 11.607 -0.3064 -0.4006 -0.1945 11LYS SC2 3159 24.047 9.677 11.336 -0.3859 -0.1438 -0.1284 12LYS BB 3160 24.356 10.264 11.876 -0.1883 0.1499 0.1401 12LYS SC1 3161 24.031 10.210 11.845 -0.3219 -0.2784 0.0939 12LYS SC2 3162 23.847 10.088 12.132 -0.0980 -0.1549 -0.3738 13GLY BB 3163 24.655 10.425 11.788 0.0698 0.0621 0.0285 14LYS BB 3164 24.704 10.762 11.868 -0.2219 0.0800 0.0960 14LYS SC1 3165 24.679 10.935 11.606 0.0098 0.0344 0.2735 14LYS SC2 3166 24.797 11.237 11.423 0.0970 0.0144 -0.0099 15GLU BB 3167 24.774 10.849 12.188 0.3030 -0.0656 -0.1067 15GLU SC1 3168 25.130 10.960 12.047 -0.2104 -0.1658 0.0284 16LYS BB 3169 24.624 11.055 12.382 -0.4204 0.0491 0.0912 16LYS SC1 3170 24.835 11.126 12.584 0.0037 -0.1976 0.4707 16LYS SC2 3171 25.077 11.205 12.409 -0.2542 0.0077 -0.4752 17GLY BB 3172 24.294 10.956 12.491 0.3786 0.3053 -0.0834 18GLY BB 3173 24.193 10.618 12.541 0.0433 0.1511 -0.0071 19LYS BB 3174 23.921 10.493 12.387 0.0855 -0.2389 -0.0897 19LYS SC1 3175 23.895 10.737 12.250 0.0153 -0.0280 -0.0877 19LYS SC2 3176 23.824 10.782 11.910 -0.0986 0.2627 0.0691 20ASN BB 3177 23.726 10.325 12.585 -0.1060 -0.0211 -0.1247 20ASN SC1 3178 23.716 10.260 12.877 0.1193 0.1754 0.0183 21ALA BB 3179 23.475 10.340 12.446 0.0546 -0.1411 -0.0768 21ALA SC1 3180 23.485 10.387 12.181 -0.2664 -0.1814 -0.1003 22ILE BB 3181 23.343 10.016 12.424 -0.0291 0.1084 0.0026 22ILE SC1 3182 23.506 9.878 12.689 -0.1260 0.2287 0.1260 23ASN BB 3183 23.392 9.976 12.122 -0.3469 -0.2587 0.0040 23ASN SC1 3184 23.366 9.685 12.032 0.1102 0.1331 -0.0619 24MET BB 3185 23.287 10.107 11.802 0.0002 -0.0282 0.2748 24MET SC1 3186 23.189 10.453 11.733 0.1774 0.0295 0.0299 25LYS BB 3187 23.266 9.974 11.503 0.1131 0.0998 -0.0159 25LYS SC1 3188 23.029 10.135 11.353 0.1347 -0.0997 0.2346 25LYS SC2 3189 22.925 10.363 11.067 -0.0203 -0.1325 0.0741 26ASP BB 3190 23.298 9.656 11.498 -0.2023 -0.1210 -0.1639 26ASP SC1 3191 23.611 9.508 11.546 0.0507 -0.0766 -0.0830 27VAL BB 3192 23.000 9.586 11.429 -0.0981 -0.2748 0.2907 27VAL SC1 3193 23.023 9.578 11.138 -0.0458 -0.0253 0.2863 28LYS BB 3194 22.718 9.737 11.467 0.1508 -0.2811 -0.2161 28LYS SC1 3195 22.534 9.494 11.518 -0.1655 -0.0106 0.0137 28LYS SC2 3196 22.392 9.197 11.397 0.0258 -0.2137 0.1438 29ASP BB 3197 22.670 10.030 11.579 0.2024 -0.0079 -0.1357 29ASP SC1 3198 22.525 10.156 11.339 0.1884 0.1754 0.2199 30LEU BB 3199 22.763 10.140 11.818 0.0011 -0.1721 0.0585 30LEU SC1 3200 22.514 10.162 12.080 -0.5993 0.3278 0.2160 31GLY BB 3201 22.911 10.053 12.077 0.0265 0.3862 -0.3904 32LYS BB 3202 22.925 9.755 12.262 -0.0353 -0.3516 0.1175 32LYS SC1 3203 22.660 9.799 12.456 -0.1206 0.1802 -0.2864 32LYS SC2 3204 22.524 9.605 12.702 0.1943 -0.0597 -0.4040 33THR BB 3205 22.920 9.480 12.109 -0.2327 0.4524 -0.0701 33THR SC1 3206 22.834 9.403 11.827 0.2517 -0.0197 -0.1059 34MET BB 3207 22.632 9.311 12.256 -0.1974 -0.0149 -0.0780 34MET SC1 3208 22.694 9.164 12.564 -0.1330 -0.1486 -0.2554 35LYS BB 3209 22.332 9.367 12.211 0.0964 -0.0282 -0.0020 35LYS SC1 3210 22.127 9.314 12.486 0.1854 -0.2555 -0.2031 35LYS SC2 3211 21.761 9.214 12.605 -0.1037 -0.3181 -0.2910 36ASP BB 3212 22.248 9.360 11.815 -0.0665 0.0535 0.3747 36ASP SC1 3213 22.490 9.128 11.798 0.0927 -0.1563 -0.0678 37GLN BB 3214 21.923 9.294 11.658 -0.0556 0.0256 0.0411 37GLN SC1 3215 21.989 8.960 11.476 0.0083 0.1547 0.0035 38ALA BB 3216 21.683 9.111 11.757 0.0741 0.0225 -0.1067 38ALA SC1 3217 21.475 9.235 11.639 -0.1339 -0.0589 0.1670 39LEU BB 3218 21.616 8.770 11.690 0.2468 0.1323 0.0367 39LEU SC1 3219 21.879 8.509 11.826 -0.0503 -0.1103 -0.2628 40LYS BB 3220 21.402 8.839 11.434 -0.1710 -0.2190 0.1348 40LYS SC1 3221 21.506 9.048 11.223 0.1852 -0.0973 0.1708 40LYS SC2 3222 21.560 9.383 11.249 0.1149 0.2906 0.1981 41ASP BB 3223 21.265 8.596 11.318 -0.1674 0.1147 0.0762 41ASP SC1 3224 21.383 8.304 11.187 0.1985 -0.1747 -0.2260 42ASP BB 3225 20.974 8.574 11.206 -0.3120 0.2366 0.4895 42ASP SC1 3226 20.996 8.545 10.874 -0.0162 -0.0437 -0.1633 43ASP BB 3227 20.744 8.690 11.403 0.1451 0.1612 0.0439 43ASP SC1 3228 20.968 8.925 11.566 0.0838 -0.0429 0.2987 44ALA BB 3229 20.440 8.769 11.299 -0.2558 -0.0031 0.0699 44ALA SC1 3230 20.409 8.822 11.562 0.1601 0.2049 0.0866 45GLU BB 3231 20.327 8.952 11.075 0.0115 -0.1251 -0.0056 45GLU SC1 3232 20.071 8.742 10.837 -0.0611 -0.1926 0.2070 46THR BB 3233 20.541 9.187 11.081 0.6327 -0.2298 -0.2152 46THR SC1 3234 20.646 9.182 11.367 0.0287 -0.0293 0.0239 47GLY BB 3235 20.407 9.443 10.981 -0.2384 0.2425 0.1651 48LEU BB 3236 20.313 9.376 10.643 -0.2712 -0.3072 0.2851 48LEU SC1 3237 19.969 9.430 10.700 -0.1073 -0.0011 -0.1943 49THR BB 3238 20.436 9.349 10.312 -0.1201 -0.0287 0.2888 49THR SC1 3239 20.726 9.269 10.362 -0.0911 -0.1997 -0.1140 50ASP BB 3240 20.422 9.627 10.151 0.1323 -0.2292 0.1151 50ASP SC1 3241 20.755 9.630 10.027 0.1158 -0.0804 0.2493 51GLY BB 3242 20.223 9.765 10.405 -0.1524 0.0589 -0.1662 52GLU BB 3243 20.345 9.926 10.696 0.1011 0.2798 -0.3265 52GLU SC1 3244 20.129 10.252 10.799 -0.0500 -0.0587 0.0521 53GLU BB 3245 20.575 10.065 10.589 -0.0380 0.0572 0.0370 53GLU SC1 3246 20.835 9.909 10.801 -0.1663 0.3217 -0.2587 54LYS BB 3247 20.687 10.030 10.303 0.0265 -0.1687 -0.0037 54LYS SC1 3248 20.470 10.108 10.109 0.1542 0.1257 0.0856 54LYS SC2 3249 20.315 10.410 9.943 -0.1182 0.1955 0.1132 55GLU BB 3250 20.925 10.258 10.314 0.1724 -0.2096 -0.1257 55GLU SC1 3251 20.817 10.508 10.044 0.3043 0.0971 -0.0426 56GLU BB 3252 21.190 10.124 10.415 0.0808 -0.1291 -0.2645 56GLU SC1 3253 21.511 10.213 10.292 0.1288 0.2418 0.0319 57PRO BB 3254 21.328 10.019 10.709 0.1527 0.1939 -0.3435 57PRO SC1 3255 21.476 9.734 10.697 0.3610 0.1528 -0.3187 58LYS BB 3256 21.412 10.197 11.028 -0.0214 0.1170 0.0502 58LYS SC1 3257 21.688 10.193 10.876 0.0217 -0.0787 -0.1275 58LYS SC2 3258 21.869 10.443 10.747 -0.0284 0.3315 0.2561 59GLU BB 3259 21.494 10.053 11.326 -0.1313 0.1667 0.4065 59GLU SC1 3260 21.715 9.818 11.187 0.4191 0.2398 0.0293 60GLU BB 3261 21.513 10.179 11.640 -0.0468 0.1818 -0.3883 60GLU SC1 3262 21.785 10.456 11.625 0.3928 -0.0964 0.1442 61GLU BB 3263 21.692 9.988 11.925 -0.1135 -0.2117 -0.1022 61GLU SC1 3264 22.016 9.780 11.923 -0.2279 -0.0644 0.1686 1LYS BB 3265 19.977 10.618 17.963 0.0493 -0.4407 -0.0125 1LYS SC1 3266 19.872 10.790 17.762 0.0953 -0.3132 0.0347 1LYS SC2 3267 19.773 11.071 17.555 -0.0459 -0.1973 0.1431 2LYS BB 3268 19.734 10.415 18.083 0.0992 0.0096 -0.3422 2LYS SC1 3269 19.513 10.468 17.868 0.0547 0.0128 0.2675 2LYS SC2 3270 19.404 10.300 17.663 0.2575 -0.3178 0.1838 3CYS BB 3271 19.839 10.208 18.355 0.1023 -0.1034 0.1497 3CYS SC1 3272 19.589 10.051 18.498 0.2101 0.2688 0.0259 4LEU BB 3273 19.972 9.907 18.278 -0.2854 0.4670 0.1030 4LEU SC1 3274 19.772 9.713 18.486 0.2044 0.3218 -0.3171 5PHE BB 3275 20.303 9.900 18.177 0.1720 0.1608 0.2955 5PHE SC1 3276 20.539 9.710 18.271 0.0478 0.1804 -0.4599 5PHE SC2 3277 20.835 9.593 18.150 0.3172 -0.1500 0.4343 5PHE SC3 3278 20.857 9.806 18.345 -0.0893 0.2783 0.0383 6LYS BB 3279 20.474 9.933 17.889 -0.2868 0.2227 0.0283 6LYS SC1 3280 20.694 10.146 17.961 0.1259 0.1059 0.0752 6LYS SC2 3281 20.738 10.491 17.997 0.3005 -0.1594 -0.2363 7LYS BB 3282 20.310 9.932 17.614 -0.1555 0.2389 -0.2824 7LYS SC1 3283 20.526 9.717 17.444 -0.0099 -0.1673 -0.2358 7LYS SC2 3284 20.838 9.749 17.197 0.0215 -0.1832 -0.3101 8LYS BB 3285 20.068 9.749 17.441 -0.1156 0.2798 0.1914 8LYS SC1 3286 20.224 9.907 17.191 -0.0272 0.0300 0.2000 8LYS SC2 3287 20.263 10.252 17.244 -0.4616 0.1082 0.2245 9ASN BB 3288 20.184 9.415 17.335 -0.1389 0.0071 0.3405 9ASN SC1 3289 19.917 9.241 17.222 -0.1027 0.3122 0.0359 10LYS BB 3290 20.413 9.498 17.072 -0.1808 0.4033 -0.1368 10LYS SC1 3291 20.507 9.213 17.047 -0.0171 0.0273 0.1050 10LYS SC2 3292 20.644 8.876 17.123 0.0912 -0.3664 -0.2762 11LYS BB 3293 20.194 9.622 16.841 0.0418 -0.0472 0.1461 11LYS SC1 3294 20.084 9.305 16.784 0.0106 -0.3982 -0.0570 11LYS SC2 3295 20.049 9.004 16.633 0.0618 -0.3543 -0.0897 12LYS BB 3296 20.111 9.900 16.770 0.1304 -0.0419 -0.2379 12LYS SC1 3297 19.919 9.817 16.505 -0.4557 0.4420 -0.1449 12LYS SC2 3298 19.820 9.802 16.167 -0.2724 0.5408 -0.2880 13GLY BB 3299 20.149 10.207 16.840 0.0227 0.2437 0.3086 14LYS BB 3300 20.461 10.277 16.825 0.0535 0.0575 0.0700 14LYS SC1 3301 20.506 10.593 16.745 0.1601 -0.2982 0.2395 14LYS SC2 3302 20.384 10.811 16.553 0.2240 -0.0932 0.0950 15GLU BB 3303 20.704 10.151 17.050 0.1206 0.0522 0.0627 15GLU SC1 3304 20.714 10.147 17.453 -0.0766 0.1275 0.1108 16LYS BB 3305 21.052 10.116 16.934 0.1440 0.3216 -0.0599 16LYS SC1 3306 21.190 10.305 17.161 0.1825 -0.1908 -0.0261 16LYS SC2 3307 21.036 10.477 17.422 0.0251 0.1350 0.2527 17GLY BB 3308 21.238 9.806 16.998 -0.0536 0.0786 -0.0830 18GLY BB 3309 21.270 9.565 17.170 -0.3534 0.1517 -0.4338 19LYS BB 3310 21.535 9.629 17.390 0.0617 0.2376 -0.0371 19LYS SC1 3311 21.364 9.554 17.688 0.4180 -0.1333 0.3527 19LYS SC2 3312 21.204 9.459 17.997 -0.2772 -0.1349 -0.1231 20ASN BB 3313 21.678 9.927 17.357 -0.0973 -0.1909 0.4409 20ASN SC1 3314 21.626 10.060 17.053 -0.2513 -0.0392 -0.0356 21ALA BB 3315 21.972 9.824 17.567 0.2084 0.1377 0.3036 21ALA SC1 3316 22.049 9.567 17.595 0.1636 0.0927 0.0446 22ILE BB 3317 22.227 9.949 17.381 -0.1195 0.0438 0.1974 22ILE SC1 3318 22.363 10.204 17.561 -0.1627 -0.1039 0.4443 23ASN BB 3319 22.383 9.674 17.243 0.0845 0.1303 -0.0478 23ASN SC1 3320 22.433 9.814 16.964 0.0494 -0.0784 0.0476 24MET BB 3321 22.688 9.530 17.173 -0.1963 0.3301 0.1146 24MET SC1 3322 23.016 9.485 17.339 -0.0081 -0.0909 0.0992 25LYS BB 3323 22.735 9.493 16.881 0.0360 -0.2676 -0.0022 25LYS SC1 3324 23.058 9.559 16.905 -0.0736 0.1281 -0.4951 25LYS SC2 3325 23.304 9.378 16.961 -0.1077 0.0215 0.2108 26ASP BB 3326 22.616 9.667 16.598 -0.1200 -0.1952 -0.0136 26ASP SC1 3327 22.935 9.819 16.580 -0.2202 0.3691 -0.2357 27VAL BB 3328 22.514 9.342 16.411 0.1078 0.2538 -0.0509 27VAL SC1 3329 22.330 9.449 16.211 -0.1490 -0.0806 -0.0007 28LYS BB 3330 22.527 9.069 16.602 0.0740 0.0560 -0.2721 28LYS SC1 3331 22.198 9.040 16.516 0.1613 -0.0010 0.2625 28LYS SC2 3332 21.899 9.030 16.415 0.3913 0.1621 0.3828 29ASP BB 3333 22.489 8.978 16.939 0.1140 -0.2937 0.2778 29ASP SC1 3334 22.447 8.657 16.846 -0.1213 0.1415 -0.2649 30LEU BB 3335 22.373 9.054 17.219 0.1230 0.0064 -0.1284 30LEU SC1 3336 22.643 9.077 17.459 0.0150 0.2997 0.3801 31GLY BB 3337 22.132 8.888 17.345 -0.3955 -0.0212 -0.0229 32LYS BB 3338 22.114 8.560 17.197 -0.0136 0.0198 0.1054 32LYS SC1 3339 21.870 8.668 17.043 -0.3372 -0.0686 -0.0749 32LYS SC2 3340 21.619 8.837 17.239 0.0016 0.1538 0.0330 33THR BB 3341 22.294 8.267 17.226 -0.0170 -0.0160 -0.4091 33THR SC1 3342 22.101 8.039 17.164 -0.1817 -0.0154 0.0638 34MET BB 3343 22.509 8.103 17.433 0.3286 0.2202 0.2001 34MET SC1 3344 22.583 8.392 17.685 0.0134 0.0031 -0.0786 35LYS BB 3345 22.370 7.822 17.522 -0.1089 -0.1361 -0.1389 35LYS SC1 3346 22.346 7.905 17.856 -0.2799 0.2877 0.1795 35LYS SC2 3347 22.644 7.979 17.995 -0.0910 -0.2547 0.1129 36ASP BB 3348 22.069 7.703 17.436 -0.2475 -0.0417 0.0444 36ASP SC1 3349 22.179 7.565 17.144 0.3305 0.0271 0.0638 37GLN BB 3350 21.774 7.777 17.636 0.1162 0.0326 -0.0041 37GLN SC1 3351 21.637 7.437 17.771 0.0910 -0.2049 0.1653 38ALA BB 3352 21.548 7.774 17.370 0.1230 -0.0943 0.1366 38ALA SC1 3353 21.413 7.563 17.472 0.3919 -0.5027 -0.3061 39LEU BB 3354 21.335 8.000 17.260 -0.3112 -0.3039 -0.2416 39LEU SC1 3355 21.228 8.065 17.554 0.0079 0.5663 -0.0996 40LYS BB 3356 21.116 8.010 17.037 -0.0428 0.0008 0.1539 40LYS SC1 3357 20.814 7.966 16.988 0.2071 0.3246 -0.6565 40LYS SC2 3358 20.448 7.977 16.985 -0.1984 -0.1592 -0.4849 41ASP BB 3359 21.179 8.023 16.665 -0.0667 0.0196 0.3458 41ASP SC1 3360 21.100 8.353 16.635 -0.0053 0.1780 0.1026 42ASP BB 3361 21.434 7.918 16.638 -0.2798 0.1107 0.2126 42ASP SC1 3362 21.415 7.603 16.676 0.2493 0.1235 0.0799 43ASP BB 3363 21.620 7.961 16.370 -0.0750 0.1490 0.0139 43ASP SC1 3364 21.893 8.174 16.396 0.0087 0.1155 0.0260 44ALA BB 3365 21.622 7.833 16.050 0.4697 0.2638 -0.0109 44ALA SC1 3366 21.634 7.564 16.047 -0.0921 0.2269 0.0373 45GLU BB 3367 21.452 7.792 15.783 0.2327 -0.3528 0.1434 45GLU SC1 3368 21.274 7.439 15.724 0.3300 -0.1926 -0.2908 46THR BB 3369 21.418 7.821 15.415 0.1226 -0.0656 0.1768 46THR SC1 3370 21.700 7.717 15.365 0.0283 -0.1644 -0.1803 47GLY BB 3371 21.163 8.070 15.485 -0.1609 0.0383 0.2095 48LEU BB 3372 21.268 8.382 15.589 0.3405 0.0367 0.0167 48LEU SC1 3373 20.973 8.363 15.783 -0.4610 -0.1827 -0.0436 49THR BB 3374 21.151 8.720 15.468 0.2685 0.0022 0.0338 49THR SC1 3375 20.989 8.765 15.722 -0.1176 -0.0106 -0.2027 50ASP BB 3376 20.938 8.907 15.305 -0.0166 0.2078 -0.1373 50ASP SC1 3377 20.996 8.834 14.965 -0.0885 -0.2158 -0.3263 51GLY BB 3378 20.922 9.170 15.300 0.5387 0.2493 0.0361 52GLU BB 3379 20.714 9.415 15.367 0.1881 -0.2291 0.1148 52GLU SC1 3380 20.491 9.431 15.638 -0.2828 0.0160 0.1796 53GLU BB 3381 20.847 9.689 15.271 0.1575 0.3391 -0.1930 53GLU SC1 3382 21.229 9.523 15.309 0.0528 -0.1192 -0.1042 54LYS BB 3383 20.780 10.004 15.292 -0.0364 -0.2509 0.5031 54LYS SC1 3384 20.945 10.080 15.034 0.0564 -0.1308 0.2370 54LYS SC2 3385 21.140 10.177 14.751 0.0170 -0.0816 -0.0977 55GLU BB 3386 20.467 10.187 15.420 0.1717 0.2021 0.2090 55GLU SC1 3387 20.304 9.829 15.369 -0.1173 -0.0164 -0.1079 56GLU BB 3388 20.545 10.452 15.457 -0.1071 0.0457 -0.0965 56GLU SC1 3389 20.935 10.423 15.560 0.0853 -0.0536 -0.2752 57PRO BB 3390 20.301 10.723 15.488 0.0401 0.1387 0.0672 57PRO SC1 3391 20.323 10.977 15.290 -0.1934 -0.4493 -0.1430 58LYS BB 3392 19.992 10.569 15.396 -0.1994 -0.0802 -0.1081 58LYS SC1 3393 20.177 10.614 15.096 -0.1396 -0.0061 -0.4597 58LYS SC2 3394 20.457 10.575 15.031 0.0061 0.2843 -0.0031 59GLU BB 3395 19.732 10.465 15.569 0.1506 0.2102 0.3202 59GLU SC1 3396 19.552 10.262 15.310 -0.1154 -0.0325 0.0772 60GLU BB 3397 19.703 10.252 15.862 -0.1859 0.0510 -0.1082 60GLU SC1 3398 19.586 9.921 15.760 0.2541 -0.1455 0.0820 61GLU BB 3399 19.888 10.277 16.155 -0.0672 -0.2340 0.0878 61GLU SC1 3400 20.135 10.478 16.377 0.0072 0.0936 0.0478 1LYS BB 3401 18.244 10.683 9.500 0.0788 0.0206 0.1037 1LYS SC1 3402 18.270 10.905 9.265 0.1305 -0.4464 -0.5043 1LYS SC2 3403 18.415 11.196 9.099 0.3975 -0.0591 -0.2749 2LYS BB 3404 18.351 10.404 9.424 -0.0806 0.2859 0.1210 2LYS SC1 3405 18.641 10.405 9.299 -0.2791 0.0600 -0.3193 2LYS SC2 3406 18.909 10.211 9.257 -0.3638 0.3159 0.2335 3CYS BB 3407 18.068 10.183 9.337 0.1689 -0.3887 -0.0500 3CYS SC1 3408 17.826 10.399 9.408 -0.1752 -0.0996 -0.4254 4LEU BB 3409 17.843 10.095 9.112 0.0038 0.1838 0.3121 4LEU SC1 3410 18.140 10.037 8.892 -0.0016 -0.3156 -0.3107 5PHE BB 3411 17.595 10.221 9.104 0.1150 0.0931 0.1872 5PHE SC1 3412 17.600 10.367 8.837 -0.1459 -0.0440 -0.0686 5PHE SC2 3413 17.633 10.667 8.681 -0.0163 0.2362 0.4713 5PHE SC3 3414 17.861 10.489 8.657 -0.0540 0.2161 0.2321 6LYS BB 3415 17.344 10.002 9.254 -0.0799 0.2215 -0.0267 6LYS SC1 3416 17.155 9.764 9.172 -0.1754 -0.0544 0.2148 6LYS SC2 3417 17.123 9.585 8.894 0.4603 0.1450 0.1794 7LYS BB 3418 17.215 10.047 9.509 0.1525 -0.0717 0.0984 7LYS SC1 3419 17.180 9.869 9.810 0.1229 0.0281 0.1227 7LYS SC2 3420 17.135 9.850 10.150 0.0030 -0.0640 -0.0093 8LYS BB 3421 16.973 10.282 9.594 -0.1624 -0.1015 0.2308 8LYS SC1 3422 16.803 10.043 9.459 -0.0384 0.2859 0.4027 8LYS SC2 3423 16.454 9.988 9.319 -0.0915 0.3426 -0.1485 9ASN BB 3424 16.903 10.448 9.846 0.2548 0.1512 -0.2171 9ASN SC1 3425 16.758 10.660 9.626 -0.1345 -0.2053 -0.0024 10LYS BB 3426 16.969 10.382 10.171 -0.0791 0.2339 0.1575 10LYS SC1 3427 16.896 10.633 10.363 0.2500 0.0926 0.4050 10LYS SC2 3428 16.950 10.530 10.689 0.1324 0.0296 0.0561 11LYS BB 3429 16.858 10.175 10.425 -0.1008 -0.2708 0.0847 11LYS SC1 3430 16.540 10.092 10.420 0.0949 -0.2860 -0.2391 11LYS SC2 3431 16.305 9.836 10.512 0.1757 -0.0685 0.7024 12LYS BB 3432 17.162 10.076 10.606 -0.2598 0.1698 -0.2719 12LYS SC1 3433 17.252 9.858 10.836 -0.1563 -0.1376 -0.0386 12LYS SC2 3434 17.245 9.528 10.960 0.1139 -0.0444 -0.0694 13GLY BB 3435 17.332 10.274 10.777 0.1950 0.0309 0.0005 14LYS BB 3436 17.668 10.427 10.792 -0.2469 0.0798 0.1032 14LYS SC1 3437 17.779 10.542 10.551 -0.1593 0.0317 0.2776 14LYS SC2 3438 17.741 10.384 10.256 -0.2677 0.1939 0.1115 15GLU BB 3439 17.755 10.183 11.027 0.3597 -0.1517 0.1791 15GLU SC1 3440 17.437 10.315 11.229 -0.2057 0.3616 0.0863 16LYS BB 3441 17.680 9.854 11.026 0.2981 -0.2598 0.2755 16LYS SC1 3442 17.904 9.713 10.833 -0.3019 -0.1349 0.4230 16LYS SC2 3443 18.259 9.698 10.763 0.2833 0.4203 -0.0925 17GLY BB 3444 17.660 9.625 11.243 0.1553 0.1295 0.1134 18GLY BB 3445 17.634 9.272 11.191 0.1659 -0.2587 -0.1104 19LYS BB 3446 17.518 9.150 11.469 0.1197 0.0981 0.0706 19LYS SC1 3447 17.695 8.904 11.439 -0.1114 -0.0910 -0.0734 19LYS SC2 3448 18.012 8.942 11.332 -0.0703 -0.0632 -0.3338 20ASN BB 3449 17.389 9.296 11.731 -0.1281 -0.2640 0.0082 20ASN SC1 3450 17.426 9.603 11.647 -0.2913 0.1799 -0.2316 21ALA BB 3451 17.198 9.200 11.972 0.0024 -0.1238 -0.1493 21ALA SC1 3452 16.954 9.136 11.876 -0.0020 -0.1870 -0.0965 22ILE BB 3453 17.441 9.008 12.147 -0.2540 -0.1423 -0.0581 22ILE SC1 3454 17.299 8.849 12.413 0.1847 -0.1157 0.2012 23ASN BB 3455 17.696 8.942 12.281 0.0696 -0.1687 -0.4815 23ASN SC1 3456 17.637 8.640 12.110 -0.2471 -0.0351 0.0261 24MET BB 3457 17.785 9.101 12.564 -0.3265 -0.3075 0.0393 24MET SC1 3458 17.403 9.228 12.623 0.1659 0.0180 -0.1104 25LYS BB 3459 17.859 9.388 12.584 -0.0932 -0.1037 -0.1156 25LYS SC1 3460 18.138 9.366 12.751 -0.1554 0.0190 -0.0136 25LYS SC2 3461 18.355 9.442 12.976 -0.1357 -0.0812 -0.3019 26ASP BB 3462 17.739 9.614 12.371 0.2407 0.1375 0.1957 26ASP SC1 3463 17.754 9.368 12.085 -0.0399 0.1937 0.1242 27VAL BB 3464 18.075 9.581 12.259 0.1314 -0.1263 0.1487 27VAL SC1 3465 18.075 9.873 12.253 0.1993 -0.1264 0.1425 28LYS BB 3466 18.385 9.482 12.399 -0.0870 0.0072 0.4961 28LYS SC1 3467 18.524 9.601 12.132 -0.2355 -0.1692 0.2164 28LYS SC2 3468 18.664 9.800 11.892 -0.0220 -0.2031 -0.3222 29ASP BB 3469 18.637 9.646 12.623 0.1021 -0.2621 0.3084 29ASP SC1 3470 18.551 9.981 12.574 -0.2698 0.0294 -0.0008 30LEU BB 3471 18.868 9.580 12.818 0.2669 -0.1332 0.3172 30LEU SC1 3472 19.114 9.580 12.564 0.1203 -0.0369 0.5305 31GLY BB 3473 18.989 9.279 12.974 0.0917 -0.3274 -0.0550 32LYS BB 3474 19.245 9.100 12.824 0.0682 0.1129 0.1060 32LYS SC1 3475 19.119 9.010 12.547 -0.2715 -0.0974 0.1690 32LYS SC2 3476 18.957 8.835 12.243 0.0896 0.0339 0.0469 33THR BB 3477 19.464 9.315 12.753 -0.1552 -0.1755 0.1891 33THR SC1 3478 19.396 9.456 13.015 -0.0063 0.3331 -0.0344 34MET BB 3479 19.773 9.146 12.720 0.0516 0.1214 0.4281 34MET SC1 3480 19.875 9.153 12.309 -0.0986 -0.2653 0.0613 35LYS BB 3481 19.799 8.862 12.871 -0.0363 0.0825 0.0343 35LYS SC1 3482 19.778 8.608 12.684 -0.2509 0.1923 -0.0724 35LYS SC2 3483 19.724 8.336 12.459 -0.1266 0.1954 0.2294 36ASP BB 3484 19.706 8.855 13.159 0.0974 -0.0142 -0.2434 36ASP SC1 3485 19.341 8.889 13.235 0.0143 0.1292 0.1718 37GLN BB 3486 19.697 9.189 13.260 -0.2421 -0.1040 0.1487 37GLN SC1 3487 19.470 9.266 13.530 -0.4347 -0.0940 -0.3006 38ALA BB 3488 19.886 9.441 13.075 -0.0380 0.2618 -0.1789 38ALA SC1 3489 19.790 9.653 12.937 0.0228 0.2392 -0.2566 39LEU BB 3490 20.194 9.464 12.881 0.0127 -0.0963 -0.0732 39LEU SC1 3491 20.180 9.801 12.739 0.2297 -0.0598 0.0592 40LYS BB 3492 20.338 9.273 12.659 -0.2258 -0.0754 0.3064 40LYS SC1 3493 20.243 9.425 12.420 0.0787 0.1023 0.0963 40LYS SC2 3494 20.461 9.373 12.217 0.2162 -0.1073 0.2431 41ASP BB 3495 20.546 9.047 12.645 -0.2235 -0.3571 0.0785 41ASP SC1 3496 20.499 8.935 12.334 -0.1190 -0.4067 0.2510 42ASP BB 3497 20.806 8.913 12.804 0.1908 -0.3185 -0.5273 42ASP SC1 3498 21.065 9.137 12.801 0.0177 0.2840 -0.2239 43ASP BB 3499 20.696 8.839 13.089 0.0447 0.0372 0.2309 43ASP SC1 3500 20.507 9.145 13.082 -0.0939 0.1935 -0.2728 44ALA BB 3501 20.709 8.815 13.403 0.1647 0.0911 -0.0291 44ALA SC1 3502 20.583 8.578 13.374 -0.0183 0.1686 0.1131 45GLU BB 3503 20.670 9.109 13.502 -0.3039 0.0941 -0.0307 45GLU SC1 3504 20.386 8.968 13.733 -0.0291 -0.3125 0.0805 46THR BB 3505 20.948 9.226 13.591 0.2171 -0.1618 0.3202 46THR SC1 3506 21.166 9.365 13.429 -0.0594 0.0183 0.0936 47GLY BB 3507 20.917 9.331 13.921 -0.1414 0.0967 -0.2174 48LEU BB 3508 21.137 9.090 14.035 -0.0754 0.0282 -0.2803 48LEU SC1 3509 21.499 9.186 14.159 -0.0457 -0.0517 -0.0922 49THR BB 3510 20.945 8.815 14.099 -0.3616 0.1049 0.1487 49THR SC1 3511 21.183 8.706 14.256 -0.2495 0.1252 -0.0044 50ASP BB 3512 20.836 8.715 13.807 -0.1511 -0.1447 0.0664 50ASP SC1 3513 21.114 8.714 13.602 0.3048 -0.4727 -0.0401 51GLY BB 3514 20.599 8.552 13.742 0.4006 0.3753 -0.1204 52GLU BB 3515 20.574 8.201 13.738 -0.3804 -0.1590 -0.0705 52GLU SC1 3516 20.263 7.969 13.715 -0.3027 -0.0637 -0.1066 53GLU BB 3517 20.785 7.970 13.903 -0.1090 0.1575 0.3416 53GLU SC1 3518 20.942 7.736 13.646 0.1495 -0.1640 -0.1594 54LYS BB 3519 20.715 7.733 14.167 0.1679 0.2925 -0.2460 54LYS SC1 3520 20.981 7.566 14.203 -0.0605 -0.1667 -0.2295 54LYS SC2 3521 21.210 7.547 14.464 -0.2214 -0.0499 0.3533 55GLU BB 3522 20.640 7.910 14.442 0.1263 -0.1870 0.2943 55GLU SC1 3523 21.016 7.984 14.577 0.0735 0.3916 -0.1314 56GLU BB 3524 20.442 7.899 14.709 0.1368 0.0341 0.1706 56GLU SC1 3525 20.569 8.137 14.982 -0.0419 0.0801 0.5167 57PRO BB 3526 20.328 7.605 14.839 -0.0223 0.0256 -0.1764 57PRO SC1 3527 20.031 7.722 14.922 -0.0187 -0.1737 0.1240 58LYS BB 3528 20.472 7.407 15.075 0.0344 -0.1504 0.0620 58LYS SC1 3529 20.677 7.653 15.094 0.2345 -0.2153 0.2815 58LYS SC2 3530 20.969 7.894 15.040 -0.1510 0.1064 0.3197 59GLU BB 3531 20.470 7.122 15.232 0.2480 -0.1478 -0.1504 59GLU SC1 3532 20.237 7.134 15.501 -0.0427 -0.2534 -0.2221 60GLU BB 3533 20.792 7.065 15.269 0.0164 0.0166 -0.1533 60GLU SC1 3534 20.778 6.791 15.544 0.2206 0.1558 0.3211 61GLU BB 3535 21.078 7.149 15.045 0.1644 -0.0893 0.0201 61GLU SC1 3536 20.912 7.010 14.726 0.1503 0.0145 0.0845 1LYS BB 3537 25.086 6.123 8.859 0.4659 0.2282 -0.0824 1LYS SC1 3538 25.242 6.307 9.100 0.4581 -0.1308 -0.0684 1LYS SC2 3539 25.450 6.556 9.178 -0.1344 -0.1503 -0.2262 2LYS BB 3540 25.284 6.056 8.575 -0.1209 0.0556 -0.2765 2LYS SC1 3541 25.447 6.204 8.409 0.1824 -0.0873 -0.1888 2LYS SC2 3542 25.610 6.181 8.123 0.1811 -0.0701 -0.2030 3CYS BB 3543 25.175 5.809 8.396 -0.0570 -0.2480 -0.0573 3CYS SC1 3544 25.141 6.052 8.186 -0.0200 -0.6051 0.5518 4LEU BB 3545 24.866 5.751 8.433 -0.2261 0.0924 -0.1919 4LEU SC1 3546 24.915 5.420 8.581 0.0265 -0.0418 0.2543 5PHE BB 3547 24.619 5.709 8.247 0.1226 0.0350 0.1487 5PHE SC1 3548 24.515 5.445 8.355 -0.1367 0.2695 -0.0750 5PHE SC2 3549 24.562 5.116 8.283 0.0059 0.2675 0.0217 5PHE SC3 3550 24.357 5.249 8.127 -0.4584 -0.0073 0.3699 6LYS BB 3551 24.632 5.633 7.916 -0.0045 0.2475 -0.1823 6LYS SC1 3552 24.713 5.356 7.929 -0.3850 -0.2572 -0.1155 6LYS SC2 3553 24.755 4.983 7.921 0.4191 -0.0872 -0.0308 7LYS BB 3554 24.262 5.596 7.905 0.1145 0.1808 -0.1074 7LYS SC1 3555 24.281 5.521 7.613 0.1886 0.3059 -0.2394 7LYS SC2 3556 24.587 5.465 7.465 0.0967 -0.0952 0.1084 8LYS BB 3557 23.945 5.575 8.106 -0.0506 0.2848 0.1300 8LYS SC1 3558 24.114 5.472 8.354 -0.2800 0.5277 -0.0615 8LYS SC2 3559 24.090 5.163 8.605 0.0616 -0.2312 0.1259 9ASN BB 3560 23.713 5.781 8.264 -0.1917 0.1633 -0.0497 9ASN SC1 3561 23.424 5.682 8.082 0.0217 -0.0774 -0.4192 10LYS BB 3562 23.764 6.062 8.131 -0.1256 0.0263 -0.1623 10LYS SC1 3563 23.827 6.129 7.832 -0.2864 0.0406 -0.0354 10LYS SC2 3564 23.739 6.322 7.529 0.3293 -0.1080 -0.1336 11LYS BB 3565 23.714 6.356 8.243 0.2592 -0.0552 0.2571 11LYS SC1 3566 23.457 6.342 8.451 -0.3283 -0.1672 0.1707 11LYS SC2 3567 23.320 6.336 8.737 0.0039 -0.0422 0.1395 12LYS BB 3568 23.922 6.559 8.347 0.0036 0.1382 -0.2349 12LYS SC1 3569 24.182 6.367 8.348 -0.0707 0.1344 -0.0056 12LYS SC2 3570 24.478 6.272 8.450 0.2248 -0.0968 0.2654 13GLY BB 3571 23.904 6.836 8.222 -0.0915 0.2132 -0.0268 14LYS BB 3572 24.225 6.961 8.143 -0.0227 0.0915 -0.2358 14LYS SC1 3573 24.283 7.208 8.360 0.0037 -0.6123 -0.0450 14LYS SC2 3574 24.393 7.515 8.514 0.1843 -0.1633 -0.2031 15GLU BB 3575 24.420 6.676 8.165 0.1863 0.3529 0.1343 15GLU SC1 3576 24.527 6.550 7.826 -0.2041 0.0330 0.1045 16LYS BB 3577 24.780 6.621 8.235 -0.0793 -0.6174 -0.2097 16LYS SC1 3578 24.993 6.806 8.090 0.1532 0.2305 0.1111 16LYS SC2 3579 24.964 6.620 7.788 0.2183 -0.0276 0.0249 17GLY BB 3580 24.968 6.618 8.533 0.2447 -0.0809 0.0715 18GLY BB 3581 24.904 6.521 8.809 0.0485 0.1832 0.0672 19LYS BB 3582 24.625 6.472 8.897 -0.0152 0.0289 -0.2031 19LYS SC1 3583 24.480 6.650 8.709 -0.1675 -0.1088 -0.1494 19LYS SC2 3584 24.200 6.848 8.634 0.5262 0.0209 0.0098 20ASN BB 3585 24.615 6.185 9.019 -0.0718 0.0371 -0.0724 20ASN SC1 3586 24.485 5.991 8.758 -0.0782 -0.0039 0.0089 21ALA BB 3587 24.274 6.263 9.184 0.0485 0.1157 -0.2354 21ALA SC1 3588 24.340 6.523 9.217 -0.5706 0.2872 -0.2149 22ILE BB 3589 24.381 6.200 9.492 -0.0025 0.3170 -0.1034 22ILE SC1 3590 24.699 6.321 9.509 0.1591 -0.0938 -0.0783 23ASN BB 3591 24.507 5.894 9.548 -0.0664 0.1893 -0.1087 23ASN SC1 3592 24.609 5.669 9.309 -0.1493 0.1172 0.0874 24MET BB 3593 24.444 5.696 9.777 -0.3086 0.1046 -0.1023 24MET SC1 3594 24.401 5.933 10.052 -0.0589 0.0776 0.1183 25LYS BB 3595 24.233 5.495 9.898 0.2130 -0.1627 0.1076 25LYS SC1 3596 24.002 5.712 10.050 -0.4667 0.2941 0.0908 25LYS SC2 3597 23.724 5.882 9.962 -0.1465 -0.1518 0.3502 26ASP BB 3598 24.184 5.393 10.224 -0.0555 0.3793 0.1392 26ASP SC1 3599 24.119 5.063 10.246 -0.0372 0.0664 0.0813 27VAL BB 3600 24.478 5.496 10.283 0.0669 -0.1734 -0.3311 27VAL SC1 3601 24.538 5.394 10.550 -0.2624 -0.2488 -0.2818 28LYS BB 3602 24.715 5.338 10.120 0.2645 -0.0222 0.1296 28LYS SC1 3603 24.827 5.584 9.975 -0.1813 -0.0319 0.2856 28LYS SC2 3604 24.873 5.685 9.670 -0.3004 -0.2489 0.0669 29ASP BB 3605 24.508 5.118 9.909 0.2263 -0.0761 -0.3096 29ASP SC1 3606 24.621 5.267 9.628 -0.1769 -0.0100 0.0458 30LEU BB 3607 24.450 4.806 9.953 -0.2572 0.1446 0.0928 30LEU SC1 3608 24.338 4.551 9.820 0.2184 0.0853 0.0309 31GLY BB 3609 24.304 4.692 10.212 -0.4113 0.1109 0.2082 32LYS BB 3610 24.259 4.334 10.217 -0.1922 -0.5184 -0.2040 32LYS SC1 3611 24.407 4.120 10.404 -0.1458 -0.2871 -0.0309 32LYS SC2 3612 24.640 4.118 10.652 0.0330 0.1568 0.0663 33THR BB 3613 23.971 4.190 10.323 -0.0407 0.1453 -0.1319 33THR SC1 3614 23.999 4.320 10.597 0.0123 0.0889 -0.1103 34MET BB 3615 23.665 4.249 10.197 -0.0598 0.1400 -0.0363 34MET SC1 3616 23.723 4.193 9.824 0.1483 -0.1798 -0.2940 35LYS BB 3617 23.408 4.322 10.379 0.1734 0.0801 -0.3291 35LYS SC1 3618 23.523 4.309 10.651 -0.1931 -0.1997 0.2063 35LYS SC2 3619 23.593 4.561 10.925 0.2044 -0.0025 0.0580 36ASP BB 3620 23.232 4.010 10.358 -0.0586 -0.1961 -0.0189 36ASP SC1 3621 22.907 4.182 10.341 0.2422 0.2499 0.2141 37GLN BB 3622 23.122 3.873 10.608 0.3839 -0.3840 -0.2289 37GLN SC1 3623 23.274 3.635 10.802 0.2250 0.0460 0.0154 38ALA BB 3624 22.806 3.716 10.580 0.3205 -0.0156 0.0016 38ALA SC1 3625 22.613 3.751 10.766 0.2715 0.0894 -0.0677 39LEU BB 3626 22.556 3.818 10.324 -0.0872 -0.2270 0.0892 39LEU SC1 3627 22.306 3.911 10.580 0.1936 -0.1343 0.0642 40LYS BB 3628 22.471 3.503 10.189 0.2321 0.0832 0.0166 40LYS SC1 3629 22.153 3.586 10.233 0.1259 0.0051 0.0174 40LYS SC2 3630 21.875 3.611 10.075 0.2385 0.3899 0.0269 41ASP BB 3631 22.751 3.317 10.055 -0.0569 -0.2253 -0.1929 41ASP SC1 3632 22.545 3.057 10.060 0.3392 0.1434 0.1295 42ASP BB 3633 23.027 3.416 9.817 -0.1650 0.1785 0.0552 42ASP SC1 3634 23.065 3.188 9.555 0.0288 -0.2118 0.1703 43ASP BB 3635 23.332 3.487 9.849 0.1113 -0.0445 -0.0082 43ASP SC1 3636 23.278 3.814 9.949 0.1945 0.2203 0.0427 44ALA BB 3637 23.479 3.239 9.719 -0.0143 0.0660 -0.0710 44ALA SC1 3638 23.664 3.395 9.599 -0.3049 0.4371 -0.0546 45GLU BB 3639 23.326 2.915 9.870 -0.1216 -0.0072 0.0077 45GLU SC1 3640 23.221 3.102 10.169 -0.1711 -0.0398 0.2374 46THR BB 3641 23.328 2.598 9.828 -0.1604 0.1335 -0.0298 46THR SC1 3642 23.039 2.548 9.913 -0.0627 -0.4537 -0.0009 47GLY BB 3643 23.665 2.458 9.904 -0.1377 -0.1962 -0.0219 48LEU BB 3644 23.554 2.148 9.908 0.0258 -0.0773 -0.3061 48LEU SC1 3645 23.829 2.121 10.117 -0.2010 -0.1917 0.2195 49THR BB 3646 23.385 2.218 10.216 0.1238 -0.3584 -0.0985 49THR SC1 3647 23.483 2.415 10.427 -0.3474 0.1523 -0.3322 50ASP BB 3648 23.051 2.286 10.287 0.0147 -0.0565 0.2040 50ASP SC1 3649 23.084 2.499 10.569 0.1455 0.0012 0.2863 51GLY BB 3650 22.926 2.049 10.514 0.0459 -0.0857 0.0722 52GLU BB 3651 22.654 1.885 10.500 -0.0691 -0.0676 -0.4249 52GLU SC1 3652 22.646 1.498 10.618 0.1859 -0.2227 0.2656 53GLU BB 3653 22.322 1.985 10.456 -0.1220 -0.3244 -0.3523 53GLU SC1 3654 22.154 1.968 10.108 0.1687 -0.2470 -0.0500 54LYS BB 3655 22.134 1.796 10.619 0.1104 -0.1070 0.1452 54LYS SC1 3656 22.137 1.474 10.692 0.3028 0.0410 0.0439 54LYS SC2 3657 21.995 1.229 10.512 -0.2450 0.2027 0.0404 55GLU BB 3658 21.806 1.775 10.444 0.1358 0.0939 0.3587 55GLU SC1 3659 21.712 1.523 10.197 0.3599 0.1171 -0.3658 56GLU BB 3660 21.662 1.629 10.712 -0.2200 0.1170 -0.2862 56GLU SC1 3661 21.825 1.758 11.062 -0.2946 0.3559 -0.1962 57PRO BB 3662 21.342 1.577 10.789 0.0349 -0.1771 -0.1481 57PRO SC1 3663 21.469 1.341 11.004 -0.1446 -0.4496 0.3821 58LYS BB 3664 21.067 1.750 10.684 -0.1773 0.0058 -0.1197 58LYS SC1 3665 20.896 1.932 10.953 0.2829 0.4092 0.1240 58LYS SC2 3666 20.607 2.023 11.163 -0.1442 0.0701 -0.0950 59GLU BB 3667 20.868 1.673 10.458 0.0813 -0.1568 0.1503 59GLU SC1 3668 20.783 1.285 10.424 0.0382 -0.0887 -0.2726 60GLU BB 3669 20.648 1.879 10.399 -0.2794 -0.0855 -0.2330 60GLU SC1 3670 20.393 1.755 10.098 0.1164 -0.1965 -0.2356 61GLU BB 3671 20.546 2.000 10.688 0.0735 -0.0237 0.0146 61GLU SC1 3672 20.461 2.358 10.689 -0.0519 0.0275 0.2067 1LYS BB 3673 26.613 16.397 7.094 0.1855 0.1562 0.1460 1LYS SC1 3674 26.663 16.691 6.981 0.3236 0.1553 0.0725 1LYS SC2 3675 26.730 16.858 6.675 0.0807 0.1373 0.2054 2LYS BB 3676 26.298 16.286 7.182 0.1741 0.1858 -0.0601 2LYS SC1 3677 26.394 16.209 7.506 -0.0666 0.0814 0.0804 2LYS SC2 3678 26.635 16.026 7.736 0.0208 -0.3917 -0.0491 3CYS BB 3679 26.196 16.019 7.009 -0.1168 -0.0760 -0.0227 3CYS SC1 3680 26.377 16.180 6.739 0.1316 0.2108 -0.2349 4LEU BB 3681 25.888 16.005 6.854 -0.1373 -0.0120 0.1851 4LEU SC1 3682 25.982 16.228 6.575 0.0771 0.1883 -0.2828 5PHE BB 3683 25.761 15.756 6.944 0.2222 -0.2102 0.1122 5PHE SC1 3684 25.661 15.802 7.253 -0.1191 0.0786 -0.0080 5PHE SC2 3685 25.548 15.639 7.529 0.5011 0.0555 0.2495 5PHE SC3 3686 25.733 15.489 7.365 -0.1274 -0.0668 -0.3945 6LYS BB 3687 25.762 15.435 6.847 0.2343 -0.0173 0.1259 6LYS SC1 3688 25.946 15.262 6.984 0.2367 -0.1537 0.1187 6LYS SC2 3689 26.118 15.008 6.826 0.0347 0.0461 0.1743 7LYS BB 3690 25.616 15.167 6.721 -0.0449 -0.3086 0.1291 7LYS SC1 3691 25.362 15.264 6.672 0.3697 -0.1318 0.2704 7LYS SC2 3692 24.999 15.375 6.691 0.0083 0.5608 0.2247 8LYS BB 3693 25.660 14.860 6.761 0.1612 0.3574 -0.3587 8LYS SC1 3694 25.358 14.815 6.719 0.1108 0.4449 0.2988 8LYS SC2 3695 25.078 14.580 6.739 0.2322 0.2620 -0.2118 9ASN BB 3696 25.855 14.625 6.629 0.0450 0.0484 -0.1000 9ASN SC1 3697 26.079 14.757 6.366 -0.0384 0.1690 -0.0157 10LYS BB 3698 26.138 14.451 6.711 0.2517 -0.0775 0.1390 10LYS SC1 3699 26.168 14.137 6.592 -0.0420 0.1096 0.1237 10LYS SC2 3700 26.423 13.873 6.556 -0.2617 0.2670 -0.0704 11LYS BB 3701 26.454 14.680 6.695 0.1924 0.2603 -0.0936 11LYS SC1 3702 26.678 14.470 6.631 0.2323 -0.4236 0.0347 11LYS SC2 3703 26.923 14.424 6.834 0.2357 0.1843 0.0412 12LYS BB 3704 26.557 14.791 6.418 -0.0343 0.3154 -0.0668 12LYS SC1 3705 26.597 15.061 6.585 -0.1360 0.2667 0.4035 12LYS SC2 3706 26.542 15.284 6.801 0.0532 -0.0565 -0.1859 13GLY BB 3707 26.742 14.629 6.170 -0.2576 -0.2153 0.1836 14LYS BB 3708 26.690 14.559 5.820 0.0995 0.0530 0.0650 14LYS SC1 3709 26.534 14.282 5.843 0.2004 -0.3597 0.1626 14LYS SC2 3710 26.193 14.171 5.864 -0.0613 -0.3006 -0.0708 15GLU BB 3711 26.606 14.755 5.527 -0.0597 -0.0032 -0.0995 15GLU SC1 3712 26.354 14.471 5.451 -0.1512 -0.1868 -0.0418 16LYS BB 3713 26.775 14.917 5.266 0.1500 0.1572 0.1016 16LYS SC1 3714 27.041 14.838 5.213 -0.1640 0.0269 -0.0134 16LYS SC2 3715 27.383 14.921 5.274 0.1497 -0.1177 -0.0108 17GLY BB 3716 26.790 15.204 5.097 0.0045 -0.0730 -0.0050 18GLY BB 3717 26.519 15.415 5.102 0.0480 0.0273 -0.2113 19LYS BB 3718 26.162 15.349 5.011 0.1185 0.0449 -0.3192 19LYS SC1 3719 26.205 15.535 5.314 0.2231 -0.0018 -0.2289 19LYS SC2 3720 26.231 15.630 5.651 -0.0291 0.2788 0.0837 20ASN BB 3721 25.936 15.554 4.905 -0.0508 0.0115 -0.1417 20ASN SC1 3722 25.648 15.524 4.700 0.1582 -0.1044 0.0179 21ALA BB 3723 26.046 15.729 4.729 -0.1506 0.0490 -0.0254 21ALA SC1 3724 26.087 15.682 4.467 0.0916 -0.0696 0.0316 22ILE BB 3725 26.131 16.047 4.680 -0.1462 0.1394 0.1318 22ILE SC1 3726 26.382 16.218 4.835 -0.0532 0.3379 -0.2239 23ASN BB 3727 25.938 16.230 4.575 0.0858 0.1494 -0.3249 23ASN SC1 3728 25.927 16.228 4.257 -0.0518 -0.2045 -0.1005 24MET BB 3729 25.737 16.466 4.659 0.2483 -0.0542 -0.2424 24MET SC1 3730 25.812 16.845 4.669 0.0877 0.0913 -0.1567 25LYS BB 3731 25.593 16.415 4.945 -0.0064 0.1606 -0.1466 25LYS SC1 3732 25.301 16.345 4.835 -0.1756 -0.2205 0.3092 25LYS SC2 3733 25.008 16.277 4.706 -0.1460 0.0923 0.0914 26ASP BB 3734 25.646 16.137 5.022 0.1477 0.1375 -0.0267 26ASP SC1 3735 25.605 15.967 4.745 0.1103 -0.1325 -0.1241 27VAL BB 3736 25.956 15.988 5.079 -0.2528 0.2978 -0.0009 27VAL SC1 3737 25.850 15.880 5.329 -0.0389 0.1768 0.0393 28LYS BB 3738 26.242 16.038 5.281 -0.0857 0.3789 0.2237 28LYS SC1 3739 26.411 15.872 5.223 -0.1437 0.3422 0.0023 28LYS SC2 3740 26.439 15.765 4.865 -0.2832 0.4617 -0.1113 29ASP BB 3741 26.198 16.235 5.505 0.0145 -0.0084 0.0241 29ASP SC1 3742 25.864 16.348 5.416 -0.0575 -0.2513 -0.1341 30LEU BB 3743 26.356 16.445 5.681 0.1901 -0.0964 0.2486 30LEU SC1 3744 26.743 16.439 5.609 -0.1043 0.3866 -0.1027 31GLY BB 3745 26.310 16.673 5.870 0.2267 -0.0316 0.0530 32LYS BB 3746 26.239 16.552 6.187 0.0572 0.1067 -0.0612 32LYS SC1 3747 26.362 16.301 6.321 -0.0527 -0.1605 -0.1342 32LYS SC2 3748 26.617 16.060 6.325 0.3800 -0.2367 -0.2216 33THR BB 3749 25.905 16.490 6.250 -0.4160 0.1019 0.1249 33THR SC1 3750 25.956 16.225 6.107 0.3968 0.1760 0.2295 34MET BB 3751 25.726 16.617 6.473 0.0387 -0.4962 -0.0904 34MET SC1 3752 25.891 16.598 6.914 0.3582 -0.0358 -0.3480 35LYS BB 3753 25.456 16.464 6.598 -0.2997 -0.0189 -0.2459 35LYS SC1 3754 25.401 16.611 6.867 0.1625 -0.1813 -0.2063 35LYS SC2 3755 25.210 16.887 6.990 0.0907 -0.1753 -0.0868 36ASP BB 3756 25.284 16.412 6.318 -0.1093 0.1355 0.2301 36ASP SC1 3757 25.436 16.664 6.082 -0.0324 0.4182 -0.2685 37GLN BB 3758 25.261 16.168 6.148 -0.4052 0.0526 -0.1503 37GLN SC1 3759 25.551 16.255 5.902 -0.0049 -0.2526 0.4245 38ALA BB 3760 25.106 16.067 5.887 -0.0229 -0.0243 -0.1535 38ALA SC1 3761 25.150 16.195 5.653 -0.3176 0.0238 -0.1866 39LEU BB 3762 24.799 15.992 5.813 -0.0954 0.3066 0.1219 39LEU SC1 3763 24.934 15.916 5.482 0.2773 -0.0236 -0.2021 40LYS BB 3764 24.718 15.849 6.086 0.2382 -0.0989 -0.2361 40LYS SC1 3765 24.434 15.818 6.164 -0.1642 0.0188 -0.0565 40LYS SC2 3766 24.166 15.664 6.312 -0.2752 0.1967 0.3714 41ASP BB 3767 24.955 15.818 6.357 0.2007 -0.0728 0.2085 41ASP SC1 3768 24.901 16.165 6.480 0.1387 -0.0362 0.0974 42ASP BB 3769 25.271 15.739 6.370 0.1906 -0.0647 0.2466 42ASP SC1 3770 25.436 15.728 6.655 -0.1365 -0.1347 -0.0129 43ASP BB 3771 25.494 15.596 6.174 -0.1392 -0.2003 -0.0554 43ASP SC1 3772 25.507 15.794 5.946 0.1700 -0.4659 -0.1142 44ALA BB 3773 25.614 15.334 6.244 0.0696 0.2081 -0.1963 44ALA SC1 3774 25.417 15.158 6.300 0.2559 0.1446 0.3080 45GLU BB 3775 25.930 15.184 6.381 0.1273 -0.0115 0.2465 45GLU SC1 3776 26.049 15.167 6.066 -0.1865 0.2188 -0.1219 46THR BB 3777 26.189 15.392 6.524 -0.1613 -0.0606 -0.3160 46THR SC1 3778 26.434 15.354 6.347 0.0640 -0.0147 -0.0212 47GLY BB 3779 26.229 15.605 6.804 0.1236 -0.2789 -0.1321 48LEU BB 3780 26.308 15.542 7.096 0.2378 0.1700 -0.0320 48LEU SC1 3781 26.060 15.691 7.310 0.0754 0.0334 -0.0887 49THR BB 3782 26.595 15.658 7.125 -0.0308 -0.0843 0.1429 49THR SC1 3783 26.544 15.881 7.327 -0.1031 0.0173 0.0139 50ASP BB 3784 26.695 15.900 6.893 -0.1786 0.0152 -0.0133 50ASP SC1 3785 26.607 15.723 6.604 0.2626 -0.1482 0.0593 51GLY BB 3786 26.976 15.991 6.751 0.2882 0.0662 0.1619 52GLU BB 3787 27.052 16.214 6.456 0.0230 0.1902 -0.0977 52GLU SC1 3788 26.803 16.413 6.617 -0.0895 -0.1442 0.0382 53GLU BB 3789 27.392 16.210 6.481 -0.1982 0.3941 -0.0806 53GLU SC1 3790 27.439 16.553 6.631 0.0059 -0.3078 0.0302 54LYS BB 3791 27.477 15.914 6.475 0.0400 0.0417 0.0981 54LYS SC1 3792 27.369 15.789 6.738 -0.0937 -0.4208 -0.1813 54LYS SC2 3793 27.552 15.627 6.973 -0.2880 -0.3622 0.0094 55GLU BB 3794 27.831 15.842 6.382 0.1394 0.0795 0.3578 55GLU SC1 3795 27.898 15.767 6.699 0.1503 -0.1549 -0.0199 56GLU BB 3796 27.995 15.893 6.117 -0.0823 0.1991 0.1883 56GLU SC1 3797 28.312 15.723 6.193 -0.1087 -0.2088 -0.0310 57PRO BB 3798 28.045 15.698 5.818 -0.0771 0.2173 0.0844 57PRO SC1 3799 28.296 15.811 5.636 0.2046 0.0575 0.2567 58LYS BB 3800 28.141 15.355 5.736 0.1437 0.3455 -0.1830 58LYS SC1 3801 28.254 15.288 6.024 0.2748 0.0856 0.1616 58LYS SC2 3802 28.599 15.273 6.128 -0.0015 0.1637 0.0236 59GLU BB 3803 27.992 15.165 5.505 0.1561 0.1242 0.2121 59GLU SC1 3804 28.143 14.820 5.441 -0.1713 0.1811 0.1855 60GLU BB 3805 27.714 15.209 5.362 -0.2937 -0.1699 -0.1173 60GLU SC1 3806 27.490 15.129 5.652 -0.1416 0.0493 -0.2587 61GLU BB 3807 27.596 15.415 5.203 -0.1478 -0.2277 0.1239 61GLU SC1 3808 27.880 15.445 4.920 0.3785 -0.0463 -0.0959 1LYS BB 3809 16.800 5.979 17.265 -0.3716 -0.4454 0.0066 1LYS SC1 3810 17.015 6.199 17.256 0.2283 -0.0475 -0.0354 1LYS SC2 3811 17.260 6.479 17.327 -0.0761 0.3518 0.6026 2LYS BB 3812 16.549 6.081 17.090 0.0891 -0.1933 -0.0566 2LYS SC1 3813 16.553 6.385 17.054 0.2130 -0.3521 0.1442 2LYS SC2 3814 16.361 6.680 16.916 -0.4431 -0.4925 0.2488 3CYS BB 3815 16.504 5.795 16.900 -0.0886 -0.3261 -0.0839 3CYS SC1 3816 16.194 5.835 16.979 -0.1568 -0.2216 -0.1728 4LEU BB 3817 16.657 5.779 16.565 -0.1647 -0.2263 0.0913 4LEU SC1 3818 16.805 5.501 16.737 0.3516 0.4942 0.1790 5PHE BB 3819 16.760 5.969 16.266 0.2971 0.0956 0.1238 5PHE SC1 3820 16.474 5.966 16.162 0.0643 0.0521 -0.0774 5PHE SC2 3821 16.408 6.271 16.028 -0.3132 -0.0422 -0.1182 5PHE SC3 3822 16.274 6.215 16.278 -0.0158 -0.0665 0.0408 6LYS BB 3823 17.099 5.834 16.286 0.2040 -0.1534 0.2776 6LYS SC1 3824 17.357 5.897 16.516 0.4783 0.1214 -0.0945 6LYS SC2 3825 17.570 6.059 16.732 0.2358 -0.1812 0.1836 7LYS BB 3826 17.168 5.900 15.975 -0.0371 -0.3205 -0.0070 7LYS SC1 3827 17.129 6.217 15.964 -0.1115 0.0646 -0.3198 7LYS SC2 3828 16.864 6.441 16.043 -0.0488 0.2056 -0.0381 8LYS BB 3829 17.382 5.768 15.762 0.3038 0.2514 0.0142 8LYS SC1 3830 17.587 6.036 15.752 -0.0174 0.4404 -0.1562 8LYS SC2 3831 17.698 6.268 15.536 0.1639 -0.0232 -0.1539 9ASN BB 3832 17.469 5.444 15.660 0.0800 0.0085 0.1915 9ASN SC1 3833 17.150 5.423 15.608 0.1277 0.0705 -0.0533 10LYS BB 3834 17.620 5.223 15.885 -0.3370 -0.2057 0.2740 10LYS SC1 3835 17.381 4.960 15.993 -0.1052 -0.2840 0.0348 10LYS SC2 3836 17.214 4.611 15.987 -0.0256 -0.2626 -0.1427 11LYS BB 3837 17.923 5.183 15.750 0.2548 0.3348 0.0215 11LYS SC1 3838 17.868 4.949 15.592 -0.1116 0.1684 -0.0195 11LYS SC2 3839 17.802 4.800 15.261 -0.4872 -0.2894 0.0141 12LYS BB 3840 18.187 5.026 15.891 0.0901 -0.2930 0.1261 12LYS SC1 3841 18.058 5.093 16.203 -0.1717 0.1165 0.1240 12LYS SC2 3842 18.119 5.389 16.358 0.3548 0.0261 0.1329 13GLY BB 3843 18.261 4.751 15.817 -0.3148 -0.5096 -0.0690 14LYS BB 3844 17.974 4.552 15.772 0.2686 -0.3126 -0.1273 14LYS SC1 3845 17.998 4.391 16.033 0.0192 -0.1958 0.0445 14LYS SC2 3846 17.943 4.329 16.348 -0.0799 0.2133 0.0417 15GLU BB 3847 17.807 4.398 15.570 -0.1440 -0.0503 0.1857 15GLU SC1 3848 17.502 4.652 15.632 -0.1315 0.0119 0.1719 16LYS BB 3849 17.962 4.285 15.264 0.0486 -0.0311 -0.2704 16LYS SC1 3850 17.827 4.009 15.262 0.0828 -0.3083 -0.2707 16LYS SC2 3851 17.466 4.066 15.275 0.2361 -0.3291 -0.0955 17GLY BB 3852 17.890 4.402 14.979 -0.0093 -0.0974 0.1490 18GLY BB 3853 17.849 4.667 14.826 0.2259 0.0626 0.3416 19LYS BB 3854 17.669 4.517 14.593 0.0828 0.1869 0.3678 19LYS SC1 3855 17.405 4.447 14.714 -0.1537 0.0576 -0.2355 19LYS SC2 3856 17.155 4.251 14.577 -0.1109 0.0059 0.1243 20ASN BB 3857 17.579 4.687 14.319 0.0315 0.0722 -0.0144 20ASN SC1 3858 17.458 4.511 14.011 -0.0378 0.0901 0.1138 21ALA BB 3859 17.755 5.025 14.330 0.1403 0.1427 -0.5226 21ALA SC1 3860 17.568 5.213 14.384 0.2160 0.0531 0.1220 22ILE BB 3861 18.038 4.919 14.459 -0.2498 0.2688 0.2224 22ILE SC1 3862 18.126 5.222 14.329 0.0023 0.2257 0.2870 23ASN BB 3863 18.076 4.667 14.274 -0.1071 -0.0500 0.0587 23ASN SC1 3864 18.384 4.583 14.366 -0.3774 -0.5315 -0.5188 24MET BB 3865 18.105 4.751 13.963 0.1699 0.3341 0.1970 24MET SC1 3866 18.447 4.548 13.860 0.3777 0.0496 -0.3062 25LYS BB 3867 17.970 4.983 13.792 -0.0139 0.0126 -0.2641 25LYS SC1 3868 18.224 5.088 13.768 0.0164 0.1902 -0.2734 25LYS SC2 3869 18.273 5.409 13.893 0.1539 0.2047 -0.1854 26ASP BB 3870 17.792 4.945 13.535 0.1477 -0.2850 -0.2203 26ASP SC1 3871 17.725 4.622 13.657 -0.3758 0.4103 0.1032 27VAL BB 3872 17.473 4.956 13.475 -0.1202 0.0751 -0.0182 27VAL SC1 3873 17.411 4.792 13.241 -0.1948 0.2306 -0.1087 28LYS BB 3874 17.180 5.071 13.506 0.2906 0.1088 0.0466 28LYS SC1 3875 17.051 5.038 13.218 0.1449 -0.0397 -0.2428 28LYS SC2 3876 17.048 5.005 12.918 0.0579 -0.1410 0.1010 29ASP BB 3877 17.152 5.224 13.725 0.1025 0.2113 0.2861 29ASP SC1 3878 16.970 4.959 13.898 0.1389 0.0202 0.2728 30LEU BB 3879 16.976 5.427 13.843 0.0594 -0.2317 0.1305 30LEU SC1 3880 16.724 5.391 13.578 -0.1204 0.1389 -0.1642 31GLY BB 3881 16.799 5.462 14.096 0.0400 0.2643 -0.1686 32LYS BB 3882 16.992 5.630 14.309 -0.0319 0.2990 -0.2267 32LYS SC1 3883 16.988 5.733 14.592 -0.0745 -0.1070 -0.1313 32LYS SC2 3884 16.974 5.702 14.923 -0.1930 0.3484 -0.1595 33THR BB 3885 17.312 5.679 14.271 0.1696 0.1068 -0.1260 33THR SC1 3886 17.372 5.503 14.029 0.5002 -0.0059 0.0312 34MET BB 3887 17.459 5.550 14.544 0.1205 -0.0401 0.0147 34MET SC1 3888 17.241 5.342 14.790 0.1895 -0.0186 -0.2535 35LYS BB 3889 17.555 5.749 14.864 0.0618 -0.1046 0.0299 35LYS SC1 3890 17.725 5.519 14.978 -0.2766 0.1429 -0.2328 35LYS SC2 3891 17.813 5.338 15.314 -0.3642 -0.3017 0.0050 36ASP BB 3892 17.785 5.887 14.750 0.2244 -0.0718 0.0754 36ASP SC1 3893 17.831 5.804 14.370 -0.1570 0.0133 -0.1629 37GLN BB 3894 17.849 6.178 14.719 0.0799 0.1856 0.1092 37GLN SC1 3895 18.191 6.077 14.570 -0.0866 0.3015 -0.2173 38ALA BB 3896 17.597 6.399 14.655 -0.1905 0.3289 -0.1586 38ALA SC1 3897 17.591 6.495 14.907 -0.0672 -0.3857 0.1425 39LEU BB 3898 17.419 6.511 14.405 -0.2903 -0.3444 -0.0228 39LEU SC1 3899 17.415 6.782 14.622 -0.3281 -0.0285 0.0318 40LYS BB 3900 17.330 6.337 14.149 -0.1811 0.0714 -0.0703 40LYS SC1 3901 17.548 6.487 13.947 0.0411 -0.1495 -0.0240 40LYS SC2 3902 17.831 6.427 13.762 -0.2078 -0.0608 -0.1110 41ASP BB 3903 17.138 6.098 14.176 -0.2863 0.0508 0.2005 41ASP SC1 3904 17.138 5.894 13.898 0.1657 0.2166 -0.0185 42ASP BB 3905 16.876 6.115 14.336 0.0055 -0.0561 0.0420 42ASP SC1 3906 16.919 6.393 14.554 -0.2493 0.0130 -0.2998 43ASP BB 3907 16.618 6.229 14.153 0.1628 0.1046 0.4165 43ASP SC1 3908 16.762 6.169 13.853 -0.1246 -0.0653 0.0483 44ALA BB 3909 16.540 6.524 13.998 0.1031 0.0967 -0.1536 44ALA SC1 3910 16.304 6.442 13.895 0.2244 -0.1888 -0.2120 45GLU BB 3911 16.705 6.818 13.966 0.2474 -0.3296 0.0777 45GLU SC1 3912 16.372 6.945 14.041 0.1034 0.2086 -0.2736 46THR BB 3913 16.978 6.961 14.053 -0.1695 -0.2662 -0.1613 46THR SC1 3914 16.935 7.144 14.293 0.0597 -0.1147 -0.2323 47GLY BB 3915 17.311 6.878 14.162 0.2274 0.2112 0.1540 48LEU BB 3916 17.528 7.138 14.134 -0.0286 -0.0554 0.1386 48LEU SC1 3917 17.560 6.950 13.828 0.1055 -0.2354 -0.0218 49THR BB 3918 17.631 7.172 14.480 0.2682 -0.3412 -0.3390 49THR SC1 3919 17.915 7.068 14.447 0.3516 -0.3988 0.4014 50ASP BB 3920 17.313 7.211 14.633 -0.3309 -0.1014 0.0243 50ASP SC1 3921 17.203 7.494 14.501 0.3512 0.1515 -0.0230 51GLY BB 3922 17.438 7.456 14.875 -0.0482 0.0937 -0.0950 52GLU BB 3923 17.551 7.718 14.751 0.1624 -0.3372 -0.1975 52GLU SC1 3924 17.890 7.787 14.980 -0.1512 0.2415 -0.0347 53GLU BB 3925 17.501 7.963 14.598 0.0732 0.0423 -0.4934 53GLU SC1 3926 17.714 8.254 14.652 0.1319 0.1745 -0.4241 54LYS BB 3927 17.239 7.927 14.364 0.0105 0.0703 0.1198 54LYS SC1 3928 17.205 8.253 14.379 0.0261 0.1926 -0.0494 54LYS SC2 3929 17.142 8.472 14.148 0.0316 -0.1428 -0.3469 55GLU BB 3930 17.175 7.959 14.035 -0.2778 0.1208 -0.0074 55GLU SC1 3931 17.241 8.263 13.761 0.1618 -0.1125 0.1499 56GLU BB 3932 16.853 8.064 14.003 -0.0631 -0.1385 -0.1520 56GLU SC1 3933 16.761 7.787 13.796 0.0579 0.4223 0.2590 57PRO BB 3934 16.771 8.244 14.274 -0.0304 -0.0470 -0.2346 57PRO SC1 3935 16.827 8.109 14.529 0.0770 -0.2492 0.1808 58LYS BB 3936 16.523 8.518 14.273 -0.1042 -0.3513 0.0503 58LYS SC1 3937 16.314 8.543 14.005 -0.2517 0.3481 -0.1342 58LYS SC2 3938 16.277 8.609 13.700 -0.2925 0.2963 0.5155 59GLU BB 3939 16.637 8.859 14.256 0.1169 -0.1086 -0.3439 59GLU SC1 3940 17.024 8.930 14.226 -0.0769 -0.0431 0.2751 60GLU BB 3941 16.620 8.848 13.925 0.1744 -0.3891 0.0394 60GLU SC1 3942 16.771 8.525 13.837 -0.2323 -0.0370 0.0096 61GLU BB 3943 16.408 9.098 13.845 0.2636 0.0162 -0.1525 61GLU SC1 3944 16.534 9.199 13.502 0.0512 0.1187 -0.1734 1LYS BB 3945 20.513 7.487 6.188 -0.1292 0.0194 0.0932 1LYS SC1 3946 20.519 7.528 5.826 -0.0095 -0.0574 0.3070 1LYS SC2 3947 20.646 7.471 5.542 0.0233 -0.4485 -0.0046 2LYS BB 3948 20.177 7.359 6.056 -0.1024 0.1937 -0.4851 2LYS SC1 3949 19.899 7.527 6.176 0.0024 0.0900 -0.3342 2LYS SC2 3950 19.807 7.856 6.118 0.0114 0.3349 0.0450 3CYS BB 3951 20.157 7.230 5.790 -0.0040 0.1325 -0.1565 3CYS SC1 3952 20.296 7.480 5.542 0.1909 0.3020 -0.0836 4LEU BB 3953 19.911 7.152 5.637 0.0719 -0.0035 0.2141 4LEU SC1 3954 19.635 7.264 5.799 0.1826 0.1100 0.0546 5PHE BB 3955 19.946 6.985 5.346 0.2175 -0.0249 -0.1434 5PHE SC1 3956 20.232 7.152 5.303 -0.1403 0.3414 0.0589 5PHE SC2 3957 20.307 7.251 4.986 0.2287 -0.0133 0.0254 5PHE SC3 3958 20.430 7.407 5.197 0.4935 -0.1567 -0.0198 6LYS BB 3959 19.810 6.812 5.136 0.1431 0.1384 0.0600 6LYS SC1 3960 19.968 6.852 4.890 0.0735 -0.2672 0.3673 6LYS SC2 3961 20.012 6.719 4.624 0.0502 0.0354 0.0961 7LYS BB 3962 19.671 6.479 5.074 -0.0994 -0.1038 -0.0679 7LYS SC1 3963 19.376 6.530 4.939 0.0396 0.0115 -0.0652 7LYS SC2 3964 19.228 6.841 5.072 -0.2106 0.1539 0.0323 8LYS BB 3965 19.795 6.288 4.863 -0.0309 -0.2472 -0.0194 8LYS SC1 3966 19.481 6.196 4.697 0.6004 0.2002 -0.1027 8LYS SC2 3967 19.493 5.993 4.449 0.0202 -0.0875 0.0288 9ASN BB 3968 20.010 6.079 4.990 0.1742 0.2742 -0.1825 9ASN SC1 3969 20.272 6.089 4.733 -0.0660 -0.0569 0.0959 10LYS BB 3970 20.138 5.750 4.987 0.4410 -0.0556 0.2562 10LYS SC1 3971 19.877 5.616 5.129 0.1377 0.2055 -0.3038 10LYS SC2 3972 19.610 5.383 5.049 0.3507 0.2398 -0.4956 11LYS BB 3973 20.338 5.612 5.186 -0.1062 0.0065 -0.1138 11LYS SC1 3974 20.314 5.490 5.464 0.0617 0.1730 -0.3641 11LYS SC2 3975 20.354 5.468 5.783 0.2420 -0.0148 0.0460 12LYS BB 3976 20.640 5.565 5.156 0.2581 -0.1439 -0.1723 12LYS SC1 3977 20.707 5.550 4.888 -0.3308 -0.0597 -0.2273 12LYS SC2 3978 20.880 5.586 4.587 0.2033 -0.0686 -0.1010 13GLY BB 3979 20.728 5.380 5.441 0.2446 0.1237 0.3688 14LYS BB 3980 20.980 5.376 5.652 -0.1068 -0.4663 0.3080 14LYS SC1 3981 21.172 5.318 5.411 0.0931 -0.1743 0.4506 14LYS SC2 3982 21.304 5.008 5.380 -0.2708 0.1024 -0.1099 15GLU BB 3983 21.055 5.235 5.928 -0.0200 0.2276 -0.0036 15GLU SC1 3984 21.274 4.929 5.890 -0.1880 0.3296 0.0375 16LYS BB 3985 20.975 5.163 6.200 -0.1697 -0.1579 0.0251 16LYS SC1 3986 21.116 5.348 6.432 0.0926 -0.1383 0.3311 16LYS SC2 3987 21.071 5.521 6.733 -0.0523 -0.0152 0.0829 17GLY BB 3988 21.090 4.878 6.367 0.2671 0.1214 -0.2240 18GLY BB 3989 21.212 4.784 6.653 0.0424 -0.0404 -0.1404 19LYS BB 3990 21.504 4.606 6.756 0.3986 0.0110 0.1296 19LYS SC1 3991 21.691 4.863 6.789 -0.0360 -0.0355 0.0447 19LYS SC2 3992 21.869 5.137 6.613 -0.3806 0.0623 0.2298 20ASN BB 3993 21.599 4.259 6.687 -0.0703 -0.1969 -0.0505 20ASN SC1 3994 21.676 4.185 6.361 -0.1233 0.1190 -0.0158 21ALA BB 3995 21.603 3.958 6.856 -0.2473 -0.0326 -0.1535 21ALA SC1 3996 21.844 4.004 6.968 -0.3262 0.0532 -0.0158 22ILE BB 3997 21.363 3.867 7.039 0.2985 0.3552 0.0135 22ILE SC1 3998 21.483 3.595 7.207 -0.2523 0.0451 -0.0686 23ASN BB 3999 21.174 3.598 6.877 -0.0074 -0.0933 0.0663 23ASN SC1 4000 20.881 3.640 6.807 -0.2824 -0.0427 -0.0790 24MET BB 4001 21.263 3.334 6.694 -0.0405 -0.4853 -0.0283 24MET SC1 4002 20.990 3.201 6.589 -0.2385 0.3035 0.2387 25LYS BB 4003 21.490 3.351 6.445 -0.0523 -0.0630 -0.2988 25LYS SC1 4004 21.384 3.250 6.170 0.1952 -0.3311 -0.0275 25LYS SC2 4005 21.585 3.234 5.815 0.1902 0.0655 -0.0064 26ASP BB 4006 21.677 3.157 6.490 0.0616 0.2054 -0.1149 26ASP SC1 4007 21.673 2.894 6.658 -0.1224 0.1200 0.2145 27VAL BB 4008 22.013 3.101 6.449 0.0704 0.2822 -0.0111 27VAL SC1 4009 22.180 2.922 6.290 0.0426 0.0299 0.2362 28LYS BB 4010 22.194 3.321 6.594 0.2355 0.1708 0.1060 28LYS SC1 4011 22.115 3.600 6.524 0.2767 -0.0650 -0.0548 28LYS SC2 4012 21.869 3.788 6.353 -0.0022 0.2563 0.0396 29ASP BB 4013 22.193 3.331 6.954 -0.0295 -0.1849 0.2919 29ASP SC1 4014 22.445 3.106 6.933 0.1862 -0.2586 0.1054 30LEU BB 4015 22.336 3.591 7.024 0.4101 0.0550 -0.0852 30LEU SC1 4016 22.509 3.901 7.074 0.0692 0.0079 0.4710 31GLY BB 4017 22.554 3.441 7.226 -0.0210 0.0518 -0.0295 32LYS BB 4018 22.500 3.171 7.434 0.1316 0.0744 -0.1685 32LYS SC1 4019 22.351 3.380 7.618 0.0273 0.1615 -0.0381 32LYS SC2 4020 22.356 3.717 7.574 0.0217 -0.0513 0.1537 33THR BB 4021 22.654 3.005 7.673 0.0393 0.0370 0.1804 33THR SC1 4022 22.468 2.989 7.915 0.0788 -0.2762 0.1949 34MET BB 4023 22.897 2.804 7.711 -0.1273 -0.1825 -0.0754 34MET SC1 4024 23.104 3.126 7.732 0.0257 -0.4319 -0.2185 35LYS BB 4025 22.885 2.494 7.609 0.2066 0.1303 -0.1615 35LYS SC1 4026 22.865 2.255 7.869 -0.3164 -0.0843 -0.1887 35LYS SC2 4027 23.104 2.002 7.956 0.4172 -0.0109 -0.1230 36ASP BB 4028 22.901 2.451 7.301 0.0628 0.0277 -0.2101 36ASP SC1 4029 22.626 2.436 7.124 0.2014 -0.1768 0.0925 37GLN BB 4030 23.114 2.515 7.040 0.0893 0.0162 0.0691 37GLN SC1 4031 23.248 2.158 7.005 -0.2446 -0.1823 -0.1006 38ALA BB 4032 23.430 2.584 7.101 -0.3889 0.2698 0.2710 38ALA SC1 4033 23.503 2.834 7.029 0.0131 0.1147 0.1154 39LEU BB 4034 23.675 2.426 7.171 -0.0439 0.0147 -0.1292 39LEU SC1 4035 23.697 2.180 6.935 0.0493 0.2572 0.2918 40LYS BB 4036 23.597 2.302 7.474 -0.0780 0.2623 0.2758 40LYS SC1 4037 23.940 2.350 7.514 0.0247 0.1721 -0.1940 40LYS SC2 4038 24.170 2.179 7.693 0.3178 -0.0441 -0.1994 41ASP BB 4039 23.302 2.301 7.608 -0.2855 0.0988 -0.0817 41ASP SC1 4040 23.106 2.046 7.437 0.0194 -0.3620 -0.0681 42ASP BB 4041 23.330 2.495 7.893 -0.1897 -0.1904 -0.0581 42ASP SC1 4042 23.394 2.311 8.192 0.0947 -0.0638 -0.1044 43ASP BB 4043 23.451 2.778 7.833 -0.3089 0.0323 -0.1197 43ASP SC1 4044 23.661 2.760 7.540 -0.1312 0.0710 -0.2871 44ALA BB 4045 23.746 2.851 7.988 0.3219 0.1110 0.0884 44ALA SC1 4046 23.811 3.097 7.895 0.3398 0.0370 -0.1001 45GLU BB 4047 23.827 3.008 8.263 0.0341 0.0262 -0.3176 45GLU SC1 4048 24.208 2.939 8.178 0.3451 0.2255 0.0772 46THR BB 4049 23.914 3.363 8.233 -0.0107 0.0806 -0.2234 46THR SC1 4050 23.760 3.608 8.138 0.1222 0.1904 -0.1579 47GLY BB 4051 24.182 3.489 8.179 0.4019 0.1430 -0.0687 48LEU BB 4052 24.266 3.800 8.279 -0.2847 0.3060 0.2796 48LEU SC1 4053 24.018 3.732 8.526 0.0480 0.1442 -0.3527 49THR BB 4054 24.603 3.923 8.391 0.2756 0.3213 0.0545 49THR SC1 4055 24.560 3.970 8.689 0.1173 -0.1732 0.1186 50ASP BB 4056 24.590 4.194 8.224 -0.0089 0.1457 0.1310 50ASP SC1 4057 24.704 4.403 8.468 0.1618 -0.3976 -0.2226 51GLY BB 4058 24.573 4.099 7.918 -0.1209 -0.2263 -0.2598 52GLU BB 4059 24.398 4.178 7.673 -0.1978 -0.2788 -0.2313 52GLU SC1 4060 24.373 4.509 7.746 0.1652 -0.1829 -0.0310 53GLU BB 4061 24.624 4.092 7.430 0.3192 -0.3675 -0.1751 53GLU SC1 4062 24.724 3.816 7.585 -0.0204 0.2574 0.2187 54LYS BB 4063 24.728 4.446 7.336 0.0335 -0.1634 0.4134 54LYS SC1 4064 24.808 4.526 7.071 0.1415 0.3686 0.2304 54LYS SC2 4065 24.892 4.797 6.823 -0.1593 -0.1906 -0.3166 55GLU BB 4066 24.785 4.714 7.523 -0.3021 0.2893 -0.3421 55GLU SC1 4067 24.653 5.036 7.311 0.2283 -0.2262 -0.0526 56GLU BB 4068 25.131 4.684 7.621 0.3584 0.1708 0.1613 56GLU SC1 4069 25.245 4.870 7.959 0.0221 -0.0386 -0.0917 57PRO BB 4070 25.249 4.353 7.771 -0.1077 0.0507 0.1591 57PRO SC1 4071 25.530 4.366 7.608 -0.2580 0.1814 -0.0857 58LYS BB 4072 25.386 4.358 8.062 -0.1411 0.1080 0.2391 58LYS SC1 4073 25.582 4.583 8.050 -0.2520 -0.2818 -0.0038 58LYS SC2 4074 25.695 4.858 8.212 0.3799 0.1946 0.1451 59GLU BB 4075 25.575 4.125 8.240 0.2780 -0.2655 -0.0375 59GLU SC1 4076 25.792 4.432 8.388 -0.0204 -0.1577 0.2674 60GLU BB 4077 25.383 3.811 8.256 -0.1868 -0.1229 -0.0732 60GLU SC1 4078 25.350 3.722 8.624 0.1842 -0.0292 -0.0695 61GLU BB 4079 25.512 3.547 8.104 0.2605 -0.0857 0.0891 61GLU SC1 4080 25.469 3.723 7.746 -0.0369 0.2145 0.1708 1LYS BB 4081 20.248 7.876 11.417 0.3765 0.1791 -0.3944 1LYS SC1 4082 20.112 7.586 11.500 -0.0729 0.0285 0.0490 1LYS SC2 4083 20.092 7.288 11.672 0.1320 -0.2045 -0.1420 2LYS BB 4084 20.078 7.822 11.099 -0.2924 -0.0481 -0.1977 2LYS SC1 4085 19.771 7.959 11.111 -0.0782 0.1995 -0.3869 2LYS SC2 4086 19.514 8.197 11.118 -0.0246 -0.3565 -0.1340 3CYS BB 4087 20.156 7.586 10.812 0.1455 0.0394 0.0342 3CYS SC1 4088 20.423 7.591 10.582 -0.0622 0.2111 -0.3361 4LEU BB 4089 20.281 7.277 10.824 0.1147 -0.0039 -0.1444 4LEU SC1 4090 20.300 7.282 10.435 -0.2539 0.2796 -0.1037 5PHE BB 4091 20.625 7.316 10.850 -0.0421 0.0074 0.1215 5PHE SC1 4092 20.569 7.605 10.957 0.0295 0.3140 -0.3154 5PHE SC2 4093 20.765 7.834 11.116 0.0415 0.0585 0.0505 5PHE SC3 4094 20.857 7.753 10.853 0.4197 -0.0393 0.2062 6LYS BB 4095 20.846 7.315 10.596 0.2822 -0.3258 0.1272 6LYS SC1 4096 20.851 7.623 10.499 0.2290 -0.3026 -0.2065 6LYS SC2 4097 20.929 7.958 10.402 -0.0264 0.0514 0.1142 7LYS BB 4098 21.094 7.181 10.453 -0.2576 0.0658 -0.1547 7LYS SC1 4099 20.983 7.008 10.216 0.0400 -0.1613 0.0563 7LYS SC2 4100 20.728 6.898 10.036 0.2103 0.1881 -0.1563 8LYS BB 4101 21.198 6.867 10.577 -0.0671 -0.2033 -0.0040 8LYS SC1 4102 21.330 6.783 10.330 -0.0353 -0.0071 -0.2290 8LYS SC2 4103 21.555 6.813 10.105 -0.0050 0.1488 -0.3355 9ASN BB 4104 21.375 6.778 10.824 -0.1463 0.1441 -0.0410 9ASN SC1 4105 21.500 6.519 10.673 0.2311 -0.1146 0.0153 10LYS BB 4106 21.231 6.790 11.151 0.0251 0.1094 -0.2772 10LYS SC1 4107 20.959 6.643 11.214 -0.1037 -0.0022 -0.0361 10LYS SC2 4108 20.850 6.387 11.404 -0.0776 -0.0455 0.0423 11LYS BB 4109 21.209 7.065 11.350 0.0771 0.0080 -0.1196 11LYS SC1 4110 21.425 7.223 11.304 0.1854 -0.0782 0.2201 11LYS SC2 4111 21.701 7.489 11.293 0.1052 -0.1639 -0.0278 12LYS BB 4112 21.194 6.929 11.651 -0.0847 0.3086 0.0424 12LYS SC1 4113 21.511 6.855 11.733 0.1408 -0.2199 -0.1086 12LYS SC2 4114 21.757 6.655 11.851 0.0859 0.3354 -0.2971 13GLY BB 4115 20.905 6.719 11.661 0.1134 -0.0250 -0.1585 14LYS BB 4116 20.902 6.489 11.884 -0.2925 -0.0087 0.0601 14LYS SC1 4117 20.947 6.562 12.173 0.2448 -0.2464 -0.1711 14LYS SC2 4118 20.833 6.701 12.495 0.1876 0.0878 -0.0046 15GLU BB 4119 20.918 6.149 11.845 -0.0340 -0.0174 0.1824 15GLU SC1 4120 21.284 6.086 11.894 0.0154 -0.0042 0.1923 16LYS BB 4121 20.712 5.909 11.940 0.0240 0.2178 0.0651 16LYS SC1 4122 20.860 5.610 11.960 0.3614 -0.0078 -0.3154 16LYS SC2 4123 20.953 5.325 12.131 0.1255 -0.0653 0.2931 17GLY BB 4124 20.386 5.748 11.840 0.0703 -0.2204 -0.1276 18GLY BB 4125 20.271 5.635 11.567 0.3470 -0.3615 0.0790 19LYS BB 4126 20.282 5.779 11.288 -0.0587 0.0024 0.3513 19LYS SC1 4127 20.543 5.702 11.068 0.3136 -0.2671 0.3701 19LYS SC2 4128 20.840 5.506 11.068 0.3232 0.2194 -0.3904 20ASN BB 4129 20.184 6.096 11.140 0.3681 -0.2102 0.1307 20ASN SC1 4130 19.988 6.338 11.329 -0.1903 0.1167 0.3743 21ALA BB 4131 19.933 6.104 10.932 0.1216 0.1849 -0.0812 21ALA SC1 4132 20.061 6.153 10.699 0.3654 -0.1128 -0.0161 22ILE BB 4133 19.629 6.208 10.979 -0.1145 -0.2074 0.1089 22ILE SC1 4134 19.635 6.510 11.137 0.0705 -0.2013 0.0916 23ASN BB 4135 19.495 6.035 11.192 -0.2382 -0.1025 -0.0680 23ASN SC1 4136 19.250 6.011 10.940 0.0288 -0.5072 0.4109 24MET BB 4137 19.788 5.840 11.314 0.0044 0.1378 -0.0363 24MET SC1 4138 19.971 5.956 11.644 -0.0098 0.0670 0.0520 25LYS BB 4139 19.764 5.486 11.361 0.1287 -0.0861 -0.1276 25LYS SC1 4140 20.002 5.454 11.132 -0.0308 0.0042 -0.3055 25LYS SC2 4141 19.980 5.564 10.812 -0.0294 -0.0243 -0.0983 26ASP BB 4142 19.911 5.367 11.606 -0.1238 -0.0719 -0.3267 26ASP SC1 4143 20.073 5.060 11.560 0.2190 -0.0005 -0.3178 27VAL BB 4144 19.829 5.521 11.873 0.0429 -0.1323 -0.0773 27VAL SC1 4145 20.046 5.534 12.069 -0.2658 -0.3969 0.2984 28LYS BB 4146 19.496 5.470 11.947 0.0966 -0.0389 -0.0359 28LYS SC1 4147 19.544 5.184 11.810 -0.2004 -0.0081 -0.2920 28LYS SC2 4148 19.706 4.858 11.705 0.1675 0.1632 -0.1086 29ASP BB 4149 19.346 5.788 11.971 -0.1108 0.0087 0.2680 29ASP SC1 4150 19.476 6.010 11.748 -0.0074 -0.1856 0.0852 30LEU BB 4151 19.074 5.958 12.096 0.1728 0.0128 0.0463 30LEU SC1 4152 18.870 5.825 12.375 0.0943 0.2999 0.0123 31GLY BB 4153 19.062 6.277 12.033 0.5224 0.2719 -0.1643 32LYS BB 4154 19.219 6.459 11.858 -0.2003 0.1305 0.2061 32LYS SC1 4155 19.238 6.743 11.962 0.0572 0.1260 -0.2982 32LYS SC2 4156 19.164 6.952 11.697 0.0226 0.1520 -0.2953 33THR BB 4157 19.114 6.543 11.538 0.0437 -0.3682 -0.2260 33THR SC1 4158 18.824 6.452 11.562 0.0194 -0.2048 0.2021 34MET BB 4159 19.192 6.426 11.231 0.1754 -0.1422 0.0293 34MET SC1 4160 18.888 6.264 11.082 -0.0706 0.1376 -0.1270 35LYS BB 4161 19.206 6.605 10.955 -0.1278 0.0406 0.0182 35LYS SC1 4162 18.913 6.659 10.871 0.0567 -0.2360 -0.1085 35LYS SC2 4163 18.763 6.961 10.838 0.0465 -0.3216 0.2082 36ASP BB 4164 19.305 6.480 10.691 0.0824 0.2561 0.2418 36ASP SC1 4165 19.057 6.275 10.596 -0.0748 -0.4335 0.0949 37GLN BB 4166 19.340 6.618 10.386 0.0275 -0.0442 -0.5112 37GLN SC1 4167 19.456 6.306 10.194 -0.1762 0.0391 0.1614 38ALA BB 4168 19.186 6.902 10.164 0.0226 -0.3496 0.2003 38ALA SC1 4169 19.271 7.127 10.286 0.0921 -0.2958 0.0550 39LEU BB 4170 19.181 7.107 9.941 -0.1626 0.0529 -0.1527 39LEU SC1 4171 19.226 7.499 9.967 0.1115 -0.4677 -0.2259 40LYS BB 4172 19.034 7.037 9.685 -0.1943 -0.3002 -0.0334 40LYS SC1 4173 19.041 6.832 9.500 -0.1125 -0.0289 0.0414 40LYS SC2 4174 19.183 6.566 9.364 0.1010 0.2337 0.6070 41ASP BB 4175 18.713 7.141 9.750 0.1654 -0.1657 -0.0311 41ASP SC1 4176 18.749 7.152 10.076 -0.2651 -0.1454 0.2268 42ASP BB 4177 18.447 6.957 9.794 0.1869 0.0295 -0.0319 42ASP SC1 4178 18.382 6.947 9.471 0.0416 -0.0319 0.1557 43ASP BB 4179 18.372 6.749 9.996 -0.1340 -0.0014 -0.2726 43ASP SC1 4180 18.337 6.759 10.343 -0.2733 -0.0206 0.0919 44ALA BB 4181 18.472 6.406 10.092 -0.0006 0.0582 0.1019 44ALA SC1 4182 18.574 6.197 9.955 0.3622 0.3546 -0.0995 45GLU BB 4183 18.178 6.336 10.230 -0.1052 -0.2114 -0.1291 45GLU SC1 4184 18.127 5.968 10.093 -0.4675 0.2105 -0.0777 46THR BB 4185 17.893 6.445 10.145 0.2044 -0.0105 -0.0066 46THR SC1 4186 17.735 6.428 10.405 -0.1096 0.2133 -0.1776 47GLY BB 4187 17.904 6.764 10.148 0.0164 -0.0233 0.3728 48LEU BB 4188 17.738 7.018 10.025 -0.1567 0.2410 0.0198 48LEU SC1 4189 18.032 7.181 9.957 -0.1575 0.0063 -0.3763 49THR BB 4190 17.458 7.060 9.939 0.2210 0.0017 -0.1843 49THR SC1 4191 17.488 7.105 9.639 0.0500 -0.0661 -0.2130 50ASP BB 4192 17.192 7.248 9.984 0.0986 0.0719 -0.0762 50ASP SC1 4193 17.373 7.518 10.118 0.0935 -0.1799 -0.1296 51GLY BB 4194 16.883 7.213 9.853 -0.2037 0.3244 -0.4133 52GLU BB 4195 16.657 7.267 9.612 0.0974 -0.1960 -0.0114 52GLU SC1 4196 16.688 7.627 9.537 0.1242 -0.2476 0.0590 53GLU BB 4197 16.448 7.097 9.740 0.2538 -0.0324 -0.2728 53GLU SC1 4198 16.628 6.786 9.815 -0.0684 -0.1548 -0.1482 54LYS BB 4199 16.158 7.004 9.676 0.0693 0.1046 0.2995 54LYS SC1 4200 16.221 7.148 9.390 0.2607 -0.0438 -0.2302 54LYS SC2 4201 16.349 7.177 9.090 0.2131 0.1901 -0.1402 55GLU BB 4202 15.941 7.124 9.868 0.0545 0.0137 -0.1139 55GLU SC1 4203 15.690 7.087 9.518 0.0592 -0.0396 0.2913 56GLU BB 4204 16.120 7.408 9.994 0.2814 0.0035 0.2404 56GLU SC1 4205 16.218 7.545 9.678 0.0169 0.1791 -0.2882 57PRO BB 4206 16.101 7.617 10.295 0.0211 -0.2203 0.2826 57PRO SC1 4207 16.407 7.699 10.362 0.4572 0.3795 0.1538 58LYS BB 4208 15.952 7.600 10.618 -0.0451 -0.0072 0.1273 58LYS SC1 4209 15.711 7.822 10.428 0.2148 -0.0106 -0.0586 58LYS SC2 4210 15.461 8.070 10.471 0.0327 -0.1681 0.1674 59GLU BB 4211 15.834 7.280 10.777 -0.1465 0.0180 -0.2959 59GLU SC1 4212 15.988 7.342 11.133 -0.1309 0.2304 0.1690 60GLU BB 4213 15.638 7.107 10.630 -0.2106 0.1469 -0.4590 60GLU SC1 4214 15.881 6.870 10.384 -0.0113 0.5079 0.0651 61GLU BB 4215 15.410 6.858 10.673 0.2400 0.0902 -0.0523 61GLU SC1 4216 15.334 6.617 10.388 0.1999 -0.0450 -0.0148 1LYS BB 4217 18.627 8.460 7.147 -0.0741 -0.0878 0.4503 1LYS SC1 4218 18.416 8.291 7.299 0.2822 0.2368 -0.1834 1LYS SC2 4219 18.243 8.000 7.435 -0.1447 -0.2599 -0.3282 2LYS BB 4220 18.496 8.415 6.801 -0.1152 0.3452 0.1048 2LYS SC1 4221 18.457 8.729 6.731 -0.2507 0.1559 -0.1007 2LYS SC2 4222 18.581 8.830 6.416 -0.0910 0.0235 0.0618 3CYS BB 4223 18.694 8.298 6.552 -0.0886 -0.1052 -0.1100 3CYS SC1 4224 18.558 8.253 6.236 -0.4363 -0.6801 -0.4072 4LEU BB 4225 18.795 8.046 6.546 -0.0152 0.2032 -0.4006 4LEU SC1 4226 18.639 7.734 6.515 -0.3226 -0.3750 0.3763 5PHE BB 4227 19.026 7.897 6.717 0.0987 -0.1452 0.1271 5PHE SC1 4228 18.873 7.689 6.929 0.3051 -0.1590 -0.1775 5PHE SC2 4229 18.783 7.432 6.725 -0.0263 -0.1829 -0.0092 5PHE SC3 4230 18.563 7.582 6.839 0.1624 0.1016 -0.0081 6LYS BB 4231 19.288 8.002 6.936 0.1219 -0.1433 -0.1192 6LYS SC1 4232 19.312 7.814 7.197 -0.0477 0.1877 -0.1602 6LYS SC2 4233 19.070 7.551 7.319 -0.2537 -0.2774 -0.2298 7LYS BB 4234 19.331 8.269 7.166 -0.0408 0.3371 -0.1424 7LYS SC1 4235 19.646 8.269 7.063 0.2695 -0.0323 -0.2026 7LYS SC2 4236 19.681 8.190 6.736 0.4251 0.1831 0.0508 8LYS BB 4237 19.281 8.570 7.080 0.3354 -0.2458 -0.1120 8LYS SC1 4238 19.569 8.729 7.179 0.1346 -0.0626 0.2133 8LYS SC2 4239 19.859 8.933 7.273 0.2322 -0.1501 0.1765 9ASN BB 4240 19.037 8.736 7.281 -0.1820 -0.2854 0.1851 9ASN SC1 4241 18.951 8.437 7.447 -0.2133 -0.4744 -0.0380 10LYS BB 4242 18.936 9.037 7.199 0.0127 0.0938 -0.1359 10LYS SC1 4243 18.675 8.948 6.994 0.2091 -0.0595 0.3346 10LYS SC2 4244 18.320 9.066 7.008 -0.1396 -0.0188 -0.0647 11LYS BB 4245 18.726 9.339 7.278 0.0530 -0.0116 0.0276 11LYS SC1 4246 18.638 9.237 7.609 0.1570 -0.3072 -0.1866 11LYS SC2 4247 18.328 9.102 7.764 0.0068 -0.3989 0.0135 12LYS BB 4248 18.583 9.569 7.082 -0.0123 -0.1686 0.5276 12LYS SC1 4249 18.779 9.727 6.886 0.2009 -0.0675 -0.0399 12LYS SC2 4250 18.771 9.917 6.575 -0.3190 0.0928 -0.0771 13GLY BB 4251 18.337 9.499 6.833 -0.2104 0.1319 0.2731 14LYS BB 4252 18.018 9.438 6.927 -0.1833 -0.1130 0.2506 14LYS SC1 4253 17.874 9.431 6.686 0.0177 0.3119 0.3750 14LYS SC2 4254 17.645 9.629 6.614 0.0536 -0.5077 0.2222 15GLU BB 4255 17.757 9.592 7.081 0.1042 0.1386 -0.0613 15GLU SC1 4256 17.403 9.668 7.030 -0.1244 0.2155 -0.0367 16LYS BB 4257 17.766 9.456 7.387 -0.0471 0.2121 0.1253 16LYS SC1 4258 17.593 9.673 7.545 -0.0614 0.0247 0.1266 16LYS SC2 4259 17.308 9.850 7.503 0.3282 0.2201 0.1473 17GLY BB 4260 17.658 9.167 7.382 0.2375 0.1664 0.1135 18GLY BB 4261 17.540 9.014 7.619 0.1791 0.4259 0.0710 19LYS BB 4262 17.520 8.673 7.681 0.2507 -0.1340 -0.1113 19LYS SC1 4263 17.604 8.584 7.365 0.0285 -0.3846 0.0399 19LYS SC2 4264 17.729 8.755 7.144 0.2832 -0.0193 0.1473 20ASN BB 4265 17.203 8.600 7.647 0.2262 0.2511 0.0402 20ASN SC1 4266 17.296 8.357 7.445 0.0012 -0.2791 0.0895 21ALA BB 4267 17.019 8.358 7.810 -0.2029 0.0122 -0.0567 21ALA SC1 4268 16.855 8.284 7.609 0.0329 0.2941 -0.3647 22ILE BB 4269 16.859 8.449 8.024 -0.0369 -0.0419 0.0261 22ILE SC1 4270 16.936 8.780 8.044 -0.0082 -0.0375 -0.1474 23ASN BB 4271 16.786 8.174 8.192 0.0398 -0.0924 -0.0764 23ASN SC1 4272 16.838 7.979 7.958 -0.0916 0.5475 0.1309 24MET BB 4273 16.619 8.122 8.418 0.1675 0.0353 0.0567 24MET SC1 4274 16.574 8.417 8.627 0.2095 0.1350 -0.2049 25LYS BB 4275 16.486 7.924 8.578 -0.3786 -0.0146 0.0892 25LYS SC1 4276 16.333 8.076 8.812 0.0252 -0.3844 -0.0286 25LYS SC2 4277 16.150 8.057 9.090 0.1850 -0.1501 -0.0417 26ASP BB 4278 16.656 7.707 8.699 0.1066 0.1688 0.1859 26ASP SC1 4279 16.476 7.423 8.791 -0.0145 0.1583 0.0606 27VAL BB 4280 16.906 7.576 8.831 -0.0795 0.0029 -0.1309 27VAL SC1 4281 17.057 7.336 8.760 -0.1146 -0.0668 0.0278 28LYS BB 4282 17.082 7.724 9.077 0.1558 -0.1136 -0.0736 28LYS SC1 4283 17.329 7.641 9.258 0.0336 -0.0504 0.0765 28LYS SC2 4284 17.553 7.419 9.275 -0.5835 -0.0842 -0.2442 29ASP BB 4285 17.192 7.963 8.914 -0.0797 0.1232 0.2725 29ASP SC1 4286 16.977 8.056 8.691 0.2122 -0.0214 0.0684 30LEU BB 4287 17.326 8.229 9.063 0.3145 -0.2052 0.3357 30LEU SC1 4288 17.420 8.050 9.334 -0.0646 -0.1839 0.2870 31GLY BB 4289 17.609 8.403 9.108 -0.0867 -0.1257 0.2258 32LYS BB 4290 17.565 8.674 8.869 0.2095 0.1960 0.1537 32LYS SC1 4291 17.269 8.604 8.855 -0.1960 -0.1022 0.2194 32LYS SC2 4292 17.008 8.864 8.820 -0.2089 0.0122 0.2062 33THR BB 4293 17.739 8.747 8.620 -0.1256 0.1556 -0.0912 33THR SC1 4294 17.740 8.579 8.365 0.3616 0.0367 -0.0216 34MET BB 4295 17.935 9.008 8.611 0.1095 0.1436 0.1047 34MET SC1 4296 18.226 8.845 8.768 -0.2148 0.0263 0.2401 35LYS BB 4297 17.787 9.243 8.824 0.0484 0.1643 0.0651 35LYS SC1 4298 17.784 9.436 8.607 -0.0037 0.1186 0.1077 35LYS SC2 4299 17.684 9.297 8.278 0.1493 -0.0602 -0.3032 36ASP BB 4300 17.611 9.172 9.055 0.3753 -0.2231 -0.0757 36ASP SC1 4301 17.339 9.200 8.869 -0.1990 -0.4043 0.1244 37GLN BB 4302 17.658 9.282 9.363 0.1202 0.0329 0.3123 37GLN SC1 4303 17.235 9.347 9.315 0.0301 0.1555 -0.4453 38ALA BB 4304 17.929 9.480 9.397 -0.0605 0.3922 -0.0139 38ALA SC1 4305 17.988 9.486 9.134 0.0536 -0.0087 -0.0043 39LEU BB 4306 17.905 9.757 9.494 -0.1418 0.0973 -0.2383 39LEU SC1 4307 18.257 9.864 9.589 -0.2716 -0.0302 -0.1483 40LYS BB 4308 17.927 9.813 9.826 0.1476 -0.1840 0.1817 40LYS SC1 4309 17.993 9.558 9.952 0.0738 -0.2001 0.6518 40LYS SC2 4310 17.838 9.312 9.819 0.0732 -0.2279 0.2025 41ASP BB 4311 17.787 9.998 10.001 -0.2085 -0.0934 0.3564 41ASP SC1 4312 18.055 10.032 10.227 0.1168 0.1205 -0.1866 42ASP BB 4313 17.497 10.112 9.956 0.1358 0.0054 0.3046 42ASP SC1 4314 17.367 10.178 10.232 -0.0973 0.1754 0.2973 43ASP BB 4315 17.396 10.420 9.841 -0.1041 -0.1169 -0.1932 43ASP SC1 4316 17.455 10.431 9.523 -0.2284 -0.1842 -0.1667 44ALA BB 4317 17.459 10.702 9.931 0.2442 -0.0014 0.1405 44ALA SC1 4318 17.221 10.722 10.057 0.1566 0.0335 -0.0278 45GLU BB 4319 17.717 10.865 10.074 0.1760 0.0496 0.0837 45GLU SC1 4320 18.079 10.916 9.906 0.0096 0.1181 0.1832 46THR BB 4321 17.453 11.123 10.145 0.0407 -0.0978 0.0947 46THR SC1 4322 17.326 11.169 9.872 0.2141 -0.2696 -0.0176 47GLY BB 4323 17.265 11.052 10.334 0.1935 0.1400 0.2864 48LEU BB 4324 16.951 11.108 10.467 0.0485 0.1975 0.0438 48LEU SC1 4325 17.130 11.059 10.773 0.0496 -0.2012 -0.0628 49THR BB 4326 16.819 11.349 10.511 -0.2263 -0.0156 -0.3104 49THR SC1 4327 16.584 11.278 10.693 -0.0122 0.3044 0.1076 50ASP BB 4328 16.947 11.646 10.515 0.0963 -0.0487 -0.0027 50ASP SC1 4329 16.632 11.775 10.673 -0.0293 0.1478 -0.2770 51GLY BB 4330 16.842 11.802 10.264 -0.1231 0.1566 -0.0773 52GLU BB 4331 17.153 11.906 10.132 0.0608 -0.0647 0.2669 52GLU SC1 4332 16.953 11.943 9.804 -0.0868 -0.0643 -0.3000 53GLU BB 4333 17.361 11.950 10.379 -0.1588 0.0011 -0.2744 53GLU SC1 4334 17.611 11.727 10.152 -0.0761 0.0161 0.0323 54LYS BB 4335 17.338 12.285 10.412 0.3590 0.1153 -0.1705 54LYS SC1 4336 17.210 12.367 10.158 0.0633 -0.5611 -0.1647 54LYS SC2 4337 16.937 12.402 9.960 0.0241 0.0408 0.1185 55GLU BB 4338 17.392 12.498 10.651 -0.0346 -0.2168 -0.0091 55GLU SC1 4339 17.692 12.366 10.846 0.3261 -0.2675 -0.0655 56GLU BB 4340 17.232 12.769 10.784 -0.0864 0.3162 0.0545 56GLU SC1 4341 16.934 12.676 10.564 -0.2348 0.2114 0.0729 57PRO BB 4342 17.372 12.905 11.052 -0.1739 -0.1108 -0.2471 57PRO SC1 4343 17.162 12.825 11.232 0.0079 -0.2802 -0.0580 58LYS BB 4344 17.704 12.795 11.085 0.3196 -0.2667 0.1613 58LYS SC1 4345 17.692 12.886 10.750 -0.0067 0.0050 -0.4441 58LYS SC2 4346 17.894 12.675 10.552 -0.4362 -0.0199 -0.2218 59GLU BB 4347 17.969 12.970 11.085 0.2502 0.0115 -0.2543 59GLU SC1 4348 17.899 13.134 11.412 0.0826 0.0691 -0.3580 60GLU BB 4349 18.099 13.086 10.806 -0.0970 0.1017 -0.1755 60GLU SC1 4350 18.492 13.155 10.909 -0.1420 0.0008 -0.2009 61GLU BB 4351 18.013 13.315 10.577 0.0984 0.3060 0.0715 61GLU SC1 4352 17.835 13.083 10.315 0.0171 0.2969 0.4086 1LYS BB 4353 22.256 5.701 14.456 -0.2283 -0.2868 -0.1822 1LYS SC1 4354 22.384 5.731 14.717 -0.0986 0.1204 0.0247 1LYS SC2 4355 22.415 5.911 15.062 -0.0600 -0.1864 -0.0822 2LYS BB 4356 21.912 5.583 14.411 0.0790 0.0158 0.1751 2LYS SC1 4357 21.747 5.579 14.103 -0.2649 0.0397 -0.0209 2LYS SC2 4358 21.544 5.563 13.880 -0.1006 0.0452 -0.1810 3CYS BB 4359 21.603 5.716 14.513 0.0631 0.1889 -0.1880 3CYS SC1 4360 21.390 5.746 14.758 -0.2390 -0.6974 0.2879 4LEU BB 4361 21.383 5.491 14.374 0.2985 -0.2451 0.1032 4LEU SC1 4362 21.588 5.213 14.243 -0.0981 0.1082 -0.2453 5PHE BB 4363 21.023 5.507 14.455 0.0182 -0.1799 -0.1390 5PHE SC1 4364 21.011 5.209 14.385 0.2974 -0.0149 0.3662 5PHE SC2 4365 21.056 5.003 14.119 -0.1034 0.0315 0.2556 5PHE SC3 4366 21.274 5.008 14.310 0.2404 0.0813 -0.1248 6LYS BB 4367 20.986 5.690 14.725 0.0253 -0.1936 0.0330 6LYS SC1 4368 20.672 5.765 14.617 0.1939 -0.2908 -0.0617 6LYS SC2 4369 20.363 5.703 14.453 -0.0711 -0.2395 0.2519 7LYS BB 4370 20.906 5.531 15.006 -0.2687 -0.0541 0.2690 7LYS SC1 4371 20.787 5.801 15.187 -0.1513 -0.1342 0.1945 7LYS SC2 4372 20.447 6.006 15.271 0.0012 0.1634 -0.3716 8LYS BB 4373 21.070 5.364 15.260 0.0478 0.0185 0.2796 8LYS SC1 4374 20.816 5.326 15.517 0.3170 0.1162 -0.1538 8LYS SC2 4375 20.645 5.377 15.836 -0.2395 -0.1289 0.4108 9ASN BB 4376 21.178 5.103 15.141 0.0439 -0.2218 0.3243 9ASN SC1 4377 21.440 5.022 14.990 -0.0626 -0.0586 -0.1780 10LYS BB 4378 21.143 4.790 15.282 0.0572 -0.4156 0.0501 10LYS SC1 4379 21.445 4.878 15.382 -0.2057 -0.4448 -0.1360 10LYS SC2 4380 21.603 5.187 15.422 0.2896 -0.0821 0.0890 11LYS BB 4381 20.907 4.621 15.112 0.1383 -0.1664 0.0265 11LYS SC1 4382 20.824 4.879 14.929 -0.1504 -0.2981 0.2527 11LYS SC2 4383 20.883 5.156 14.801 0.0620 0.2873 0.1563 12LYS BB 4384 20.855 4.307 15.125 -0.0553 -0.1033 0.0087 12LYS SC1 4385 21.131 4.202 15.210 -0.2345 0.0845 0.2908 12LYS SC2 4386 21.477 4.056 15.128 -0.1758 -0.1165 -0.2247 13GLY BB 4387 20.681 4.087 14.937 0.3517 -0.3022 -0.2060 14LYS BB 4388 20.442 4.144 14.740 -0.1303 0.1850 0.0076 14LYS SC1 4389 20.481 4.463 14.777 0.0365 -0.2961 0.0226 14LYS SC2 4390 20.306 4.596 14.510 0.1742 -0.0507 -0.2172 15GLU BB 4391 20.540 4.179 14.399 -0.4917 0.0403 0.1275 15GLU SC1 4392 20.154 4.170 14.332 0.0240 -0.1487 -0.2578 16LYS BB 4393 20.729 4.007 14.181 0.1159 0.0516 0.0836 16LYS SC1 4394 20.533 3.727 14.187 -0.0270 -0.0204 0.1032 16LYS SC2 4395 20.384 3.400 14.236 -0.0426 0.5966 0.0520 17GLY BB 4396 21.044 4.071 14.235 -0.2673 -0.1716 -0.1928 18GLY BB 4397 21.140 4.186 13.936 -0.3049 0.1896 -0.1092 19LYS BB 4398 21.487 4.218 13.933 0.0908 0.1539 0.0394 19LYS SC1 4399 21.483 3.916 13.971 0.3898 -0.0532 -0.1494 19LYS SC2 4400 21.141 3.723 13.938 0.1055 0.0194 0.0894 20ASN BB 4401 21.751 4.392 13.856 0.0557 -0.0032 0.0697 20ASN SC1 4402 21.817 4.352 13.508 0.1659 -0.3263 -0.2641 21ALA BB 4403 21.894 4.385 14.166 0.2108 0.2335 0.2472 21ALA SC1 4404 22.087 4.553 14.078 0.3266 0.2094 0.4505 22ILE BB 4405 22.017 4.541 14.453 -0.2440 0.0558 -0.5242 22ILE SC1 4406 21.757 4.747 14.530 0.1523 0.2958 0.2854 23ASN BB 4407 22.216 4.276 14.533 0.3267 0.1346 -0.2166 23ASN SC1 4408 22.486 4.382 14.593 -0.0887 -0.1642 -0.0415 24MET BB 4409 22.051 3.929 14.490 -0.0084 -0.4320 0.1770 24MET SC1 4410 21.764 3.975 14.286 -0.1015 0.0210 0.3126 25LYS BB 4411 21.927 3.794 14.789 -0.0272 0.2745 0.2458 25LYS SC1 4412 22.131 3.583 14.759 -0.1196 0.0776 -0.0643 25LYS SC2 4413 22.455 3.539 14.606 0.2373 0.0708 -0.1052 26ASP BB 4414 21.703 3.621 14.675 0.1498 -0.1653 0.1905 26ASP SC1 4415 21.539 3.673 14.988 -0.1285 0.2503 0.1306 27VAL BB 4416 21.735 3.300 14.793 0.2259 0.0341 -0.0748 27VAL SC1 4417 21.572 3.152 14.600 0.1857 -0.1518 0.0967 28LYS BB 4418 21.538 3.196 15.084 0.0622 0.0340 -0.2355 28LYS SC1 4419 21.247 3.287 15.124 -0.3843 0.1025 0.0140 28LYS SC2 4420 21.034 3.071 15.127 -0.1660 -0.0379 -0.1142 29ASP BB 4421 21.513 2.835 15.143 -0.2056 0.1206 0.2515 29ASP SC1 4422 21.230 2.656 15.180 0.1042 0.2805 0.2343 30LEU BB 4423 21.698 2.621 15.291 0.3620 0.0829 0.1623 30LEU SC1 4424 21.700 2.765 15.619 -0.1904 0.2520 0.1809 31GLY BB 4425 21.524 2.307 15.399 0.1101 -0.2163 -0.0457 32LYS BB 4426 21.266 2.162 15.179 0.4111 -0.1836 0.0701 32LYS SC1 4427 21.445 2.058 14.949 -0.3047 -0.1730 0.0330 32LYS SC2 4428 21.800 2.071 14.907 0.2360 0.4415 -0.2294 33THR BB 4429 21.075 2.281 15.429 -0.0410 -0.1504 0.0022 33THR SC1 4430 20.814 2.360 15.292 -0.0658 -0.0630 0.0989 34MET BB 4431 20.956 2.074 15.630 0.0371 0.0306 0.0194 34MET SC1 4432 20.784 2.413 15.820 0.0736 -0.1512 0.1625 35LYS BB 4433 20.654 1.970 15.679 0.0013 0.1253 -0.2280 35LYS SC1 4434 20.548 1.986 15.989 -0.1063 -0.0080 0.2703 35LYS SC2 4435 20.429 2.157 16.274 0.2537 0.1205 0.1545 36ASP BB 4436 20.419 2.078 15.378 -0.2269 0.1604 0.1318 36ASP SC1 4437 20.362 1.877 15.111 0.2070 0.2135 0.4046 37GLN BB 4438 20.310 2.355 15.559 -0.1564 -0.0158 -0.0088 37GLN SC1 4439 20.338 2.630 15.298 -0.0281 0.0535 -0.2607 38ALA BB 4440 20.239 2.262 15.898 0.2859 0.3355 0.1800 38ALA SC1 4441 19.972 2.275 15.862 0.3184 0.5327 -0.0018 39LEU BB 4442 20.259 2.561 16.023 -0.1740 -0.1872 -0.1253 39LEU SC1 4443 20.467 2.718 15.818 0.3489 -0.3110 0.0189 40LYS BB 4444 20.129 2.728 16.311 0.1192 -0.0694 0.0332 40LYS SC1 4445 19.821 2.696 16.195 -0.0931 -0.0021 -0.5686 40LYS SC2 4446 19.646 2.769 15.898 -0.0884 0.1322 0.1225 41ASP BB 4447 20.128 2.679 16.638 -0.2014 -0.0293 0.2590 41ASP SC1 4448 20.339 2.415 16.572 0.2013 -0.1266 -0.0486 42ASP BB 4449 20.256 2.885 16.786 0.0403 -0.0625 -0.0540 42ASP SC1 4450 20.554 3.102 16.691 0.1760 0.1365 0.2273 43ASP BB 4451 20.248 2.858 17.084 0.1138 -0.3282 -0.0429 43ASP SC1 4452 20.139 3.086 17.269 0.2335 0.4010 0.1138 44ALA BB 4453 19.948 2.690 17.143 0.2836 -0.1429 0.0951 44ALA SC1 4454 19.945 2.494 16.957 -0.1692 0.0479 -0.1149 45GLU BB 4455 19.700 2.898 17.199 -0.1670 0.1579 0.1597 45GLU SC1 4456 19.553 2.814 17.521 -0.1124 0.2045 -0.1828 46THR BB 4457 19.593 3.201 17.261 -0.1030 -0.1716 -0.2238 46THR SC1 4458 19.521 3.434 17.445 0.1263 -0.1733 -0.1280 47GLY BB 4459 19.343 3.242 17.094 0.0503 -0.1234 -0.0921 48LEU BB 4460 19.431 3.153 16.829 0.1379 0.3447 -0.1129 48LEU SC1 4461 19.317 3.497 16.691 0.1852 0.5028 0.3824 49THR BB 4462 19.307 3.084 16.535 0.0737 -0.2882 -0.0607 49THR SC1 4463 19.036 2.964 16.461 -0.0112 -0.1956 0.0945 50ASP BB 4464 19.466 3.176 16.281 -0.1609 0.1135 -0.0773 50ASP SC1 4465 19.749 3.094 16.432 0.0232 -0.1738 0.2933 51GLY BB 4466 19.307 3.418 16.146 -0.0819 -0.0059 0.4079 52GLU BB 4467 19.289 3.735 16.153 -0.2908 -0.2532 -0.0032 52GLU SC1 4468 19.355 3.752 15.745 -0.0115 0.1689 -0.2466 53GLU BB 4469 19.166 3.955 16.338 -0.0183 -0.0910 0.2835 53GLU SC1 4470 18.868 4.019 16.130 -0.2715 -0.0958 -0.0206 54LYS BB 4471 19.241 3.922 16.650 0.0358 0.0248 -0.2792 54LYS SC1 4472 19.017 4.110 16.762 -0.1493 -0.4163 -0.0930 54LYS SC2 4473 18.817 4.331 16.564 0.4734 -0.1599 -0.1970 55GLU BB 4474 19.519 4.019 16.689 -0.2465 0.0625 0.3711 55GLU SC1 4475 19.653 4.067 16.315 0.1812 0.1131 0.0833 56GLU BB 4476 19.687 4.200 16.882 0.1183 -0.1285 0.1854 56GLU SC1 4477 19.348 4.239 17.115 -0.2144 -0.1297 0.1094 57PRO BB 4478 19.889 4.209 17.123 -0.0279 -0.0848 0.0232 57PRO SC1 4479 19.799 3.991 17.347 -0.1360 -0.2516 -0.1478 58LYS BB 4480 20.126 4.395 17.202 0.0083 -0.4003 -0.1711 58LYS SC1 4481 20.122 4.420 16.882 0.0225 -0.3160 -0.1132 58LYS SC2 4482 20.136 4.169 16.673 0.2654 -0.0331 0.1460 59GLU BB 4483 20.272 4.254 17.427 -0.0607 -0.0744 0.2439 59GLU SC1 4484 20.544 4.484 17.520 -0.0239 0.0545 0.0971 60GLU BB 4485 20.364 3.945 17.306 0.2784 -0.4056 0.1845 60GLU SC1 4486 20.666 3.928 17.538 -0.1248 -0.0091 0.0136 61GLU BB 4487 20.432 4.015 16.974 -0.0348 -0.1892 0.0871 61GLU SC1 4488 20.757 3.810 17.001 -0.0156 -0.0772 0.0183 1LYS BB 4489 14.369 9.096 11.744 0.1207 -0.0348 -0.1278 1LYS SC1 4490 14.222 8.983 11.468 -0.4609 0.4412 0.0579 1LYS SC2 4491 14.010 8.784 11.380 0.1521 0.1849 -0.1009 2LYS BB 4492 14.310 9.434 11.639 -0.2070 0.0640 -0.2792 2LYS SC1 4493 14.540 9.456 11.482 -0.1383 0.0038 0.2918 2LYS SC2 4494 14.765 9.430 11.214 -0.2419 -0.2809 0.2711 3CYS BB 4495 14.071 9.657 11.539 -0.1325 -0.2424 -0.0765 3CYS SC1 4496 14.246 9.867 11.706 0.2784 0.2439 0.0509 4LEU BB 4497 13.812 9.689 11.751 0.0997 -0.3216 -0.1124 4LEU SC1 4498 13.739 10.000 11.590 0.0939 -0.2314 0.1781 5PHE BB 4499 13.723 9.783 12.039 -0.2293 0.0017 0.0046 5PHE SC1 4500 13.483 9.860 11.952 0.0491 -0.1098 -0.1968 5PHE SC2 4501 13.289 9.951 11.688 -0.2638 -0.1508 0.0135 5PHE SC3 4502 13.396 9.682 11.675 -0.5303 -0.2630 0.0674 6LYS BB 4503 13.830 9.873 12.283 -0.0133 0.0959 -0.1383 6LYS SC1 4504 13.751 10.200 12.240 0.2775 -0.0939 0.1310 6LYS SC2 4505 13.527 10.456 12.298 0.4053 -0.1566 0.1138 7LYS BB 4506 13.997 9.634 12.543 -0.1574 0.2195 0.0506 7LYS SC1 4507 13.900 9.528 12.825 -0.0526 0.2697 -0.0635 7LYS SC2 4508 13.699 9.270 12.952 -0.2598 0.2652 -0.0043 8LYS BB 4509 14.211 9.775 12.561 0.0440 0.0110 -0.0133 8LYS SC1 4510 14.203 10.006 12.316 -0.3353 0.0308 -0.3089 8LYS SC2 4511 14.454 10.031 12.079 -0.1768 -0.1199 -0.1746 9ASN BB 4512 14.471 9.879 12.705 -0.0813 -0.1935 -0.1495 9ASN SC1 4513 14.587 10.167 12.510 0.1195 -0.1285 0.1891 10LYS BB 4514 14.629 9.872 12.973 0.2194 -0.0706 -0.3308 10LYS SC1 4515 14.444 9.766 13.180 -0.0513 -0.0535 0.0837 10LYS SC2 4516 14.457 9.716 13.523 0.0799 0.1076 0.0872 11LYS BB 4517 14.838 10.058 13.135 0.0153 0.2113 0.1517 11LYS SC1 4518 15.052 9.802 13.232 0.3871 0.0390 -0.4755 11LYS SC2 4519 15.334 9.707 13.106 0.1488 0.1345 0.0623 12LYS BB 4520 14.698 10.148 13.410 0.0503 -0.0543 -0.1604 12LYS SC1 4521 14.885 10.426 13.493 -0.0176 0.0058 -0.2527 12LYS SC2 4522 15.231 10.557 13.540 -0.1796 -0.1112 0.1113 13GLY BB 4523 14.425 10.164 13.586 0.1898 0.2899 0.5980 14LYS BB 4524 14.410 10.386 13.855 -0.2025 0.0202 0.1053 14LYS SC1 4525 14.546 10.310 14.106 -0.2175 -0.0515 0.0922 14LYS SC2 4526 14.617 10.056 14.340 -0.2761 -0.2462 0.0036 15GLU BB 4527 14.363 10.622 13.622 -0.0666 0.1016 -0.1085 15GLU SC1 4528 14.407 10.531 13.296 0.0172 -0.1888 -0.0738 16LYS BB 4529 14.313 10.957 13.729 0.1176 0.1636 0.1200 16LYS SC1 4530 14.556 11.158 13.806 -0.3876 0.3341 -0.1307 16LYS SC2 4531 14.828 11.307 13.679 -0.3799 0.1748 0.1597 17GLY BB 4532 14.035 11.170 13.669 0.2188 -0.2849 -0.1189 18GLY BB 4533 13.790 10.994 13.667 -0.2279 0.1503 0.1478 19LYS BB 4534 13.825 10.772 13.424 -0.1053 -0.1856 -0.1528 19LYS SC1 4535 13.989 10.988 13.244 -0.1914 -0.1614 -0.0124 19LYS SC2 4536 14.348 10.991 13.299 -0.2784 0.4673 -0.1988 20ASN BB 4537 13.594 10.582 13.507 -0.1870 0.0529 -0.1980 20ASN SC1 4538 13.667 10.271 13.480 0.1055 0.0527 -0.2491 21ALA BB 4539 13.373 10.616 13.257 -0.0520 -0.1505 0.0533 21ALA SC1 4540 13.460 10.871 13.243 -0.0828 -0.1222 0.3298 22ILE BB 4541 13.504 10.623 12.949 0.1592 0.1260 -0.1327 22ILE SC1 4542 13.664 10.923 12.927 -0.0809 0.2779 0.1309 23ASN BB 4543 13.562 10.365 12.744 -0.0155 0.3210 0.1182 23ASN SC1 4544 13.207 10.414 12.634 0.2563 -0.3064 0.1551 24MET BB 4545 13.723 10.092 12.711 -0.0990 -0.0464 0.2175 24MET SC1 4546 14.053 10.289 12.633 -0.1266 0.1578 0.1003 25LYS BB 4547 13.775 9.924 12.956 0.3525 0.1858 0.1797 25LYS SC1 4548 14.053 9.934 12.923 -0.2330 0.1766 0.0345 25LYS SC2 4549 14.293 10.209 13.016 0.1569 0.1657 0.1259 26ASP BB 4550 13.603 9.804 13.172 -0.0354 0.1042 0.1516 26ASP SC1 4551 13.368 9.577 13.017 0.3300 -0.0919 -0.1480 27VAL BB 4552 13.757 9.559 13.314 0.0326 -0.1205 0.1227 27VAL SC1 4553 14.031 9.623 13.236 0.0103 -0.1976 -0.0219 28LYS BB 4554 13.754 9.320 13.462 -0.0819 0.0641 -0.2061 28LYS SC1 4555 13.668 9.400 13.777 0.0868 -0.3568 0.1271 28LYS SC2 4556 13.394 9.523 13.945 0.1138 0.0564 0.1487 29ASP BB 4557 13.861 9.017 13.359 -0.0779 -0.0359 -0.2760 29ASP SC1 4558 14.053 9.054 13.100 -0.2571 -0.4694 -0.2234 30LEU BB 4559 14.043 8.785 13.545 0.0309 -0.2529 0.0427 30LEU SC1 4560 13.837 8.753 13.840 0.1169 0.3582 -0.0703 31GLY BB 4561 14.342 8.800 13.478 -0.0635 -0.0789 0.2110 32LYS BB 4562 14.472 8.519 13.353 0.0299 0.0270 0.2707 32LYS SC1 4563 14.238 8.384 13.322 0.1447 -0.0219 0.1407 32LYS SC2 4564 14.054 8.586 13.139 0.1550 -0.0206 -0.0010 33THR BB 4565 14.687 8.432 13.176 0.0936 0.2240 0.0886 33THR SC1 4566 14.860 8.677 13.121 0.1187 0.1753 -0.0508 34MET BB 4567 14.666 8.307 12.858 0.2439 0.0468 0.2063 34MET SC1 4568 14.610 7.957 12.834 -0.0458 -0.3317 -0.0518 35LYS BB 4569 14.717 8.465 12.585 0.4019 -0.1402 -0.1608 35LYS SC1 4570 14.813 8.205 12.455 0.1575 -0.1698 0.3989 35LYS SC2 4571 14.561 7.987 12.365 -0.2612 -0.2682 0.1232 36ASP BB 4572 14.829 8.741 12.608 -0.1530 -0.0362 -0.2484 36ASP SC1 4573 14.800 8.871 12.298 -0.0389 0.3311 -0.1173 37GLN BB 4574 15.122 8.883 12.753 0.2013 0.3483 -0.3235 37GLN SC1 4575 14.967 9.115 12.981 -0.1073 0.1595 -0.2588 38ALA BB 4576 15.362 8.920 12.541 0.0121 -0.0462 -0.1188 38ALA SC1 4577 15.322 8.812 12.297 -0.0168 0.3038 -0.2750 39LEU BB 4578 15.661 8.894 12.606 -0.1031 -0.2149 0.0857 39LEU SC1 4579 15.846 8.923 12.307 -0.2999 0.0198 0.0518 40LYS BB 4580 15.903 8.760 12.828 0.0708 0.0382 -0.2008 40LYS SC1 4581 16.005 9.042 12.935 0.1683 0.0361 -0.4641 40LYS SC2 4582 16.245 9.276 13.017 -0.2464 0.2071 -0.2050 41ASP BB 4583 15.730 8.693 13.088 -0.1076 -0.0205 0.0915 41ASP SC1 4584 15.470 8.927 13.042 0.0843 -0.0453 -0.2448 42ASP BB 4585 15.809 8.516 13.304 0.1601 0.0164 -0.0662 42ASP SC1 4586 15.549 8.410 13.502 0.1008 -0.0634 0.2453 43ASP BB 4587 16.088 8.360 13.277 0.0320 -0.3308 -0.0576 43ASP SC1 4588 16.328 8.483 13.073 -0.1692 0.0485 0.2874 44ALA BB 4589 16.106 8.074 13.257 0.0568 0.3936 0.0050 44ALA SC1 4590 15.893 8.000 13.405 0.3517 -0.5806 0.0163 45GLU BB 4591 15.953 7.825 13.093 -0.3162 0.0681 -0.1915 45GLU SC1 4592 16.093 7.542 13.324 -0.1193 -0.1837 0.1797 46THR BB 4593 15.854 7.840 12.803 -0.0526 0.0222 0.0216 46THR SC1 4594 16.107 7.771 12.648 0.2690 0.0394 0.5184 47GLY BB 4595 15.540 7.777 12.770 -0.1869 0.2079 0.2074 48LEU BB 4596 15.368 8.021 12.659 -0.0779 0.0347 0.2288 48LEU SC1 4597 15.062 8.089 12.821 -0.2596 -0.2012 -0.1417 49THR BB 4598 15.607 8.185 12.512 -0.1343 -0.0369 -0.1896 49THR SC1 4599 15.614 8.464 12.635 -0.1833 -0.1745 0.1358 50ASP BB 4600 15.790 8.111 12.237 0.1779 -0.2172 -0.1377 50ASP SC1 4601 15.972 7.877 12.248 -0.3452 -0.1414 -0.4524 51GLY BB 4602 15.729 8.174 11.879 -0.2682 0.0112 0.1448 52GLU BB 4603 15.396 8.064 11.704 -0.1870 -0.0231 0.3341 52GLU SC1 4604 15.244 8.056 12.066 -0.2994 -0.0024 0.0080 53GLU BB 4605 15.342 8.180 11.352 0.1200 -0.2046 -0.0726 53GLU SC1 4606 15.752 8.250 11.368 -0.0144 -0.1378 -0.1262 54LYS BB 4607 15.141 8.420 11.461 -0.2712 0.1254 -0.0431 54LYS SC1 4608 15.046 8.380 11.720 -0.2620 -0.1236 0.1881 54LYS SC2 4609 15.118 8.589 12.021 -0.0771 0.0975 -0.1051 55GLU BB 4610 15.016 8.617 11.220 -0.6476 -0.0708 -0.2778 55GLU SC1 4611 15.200 8.961 11.362 -0.1587 0.1155 0.1177 56GLU BB 4612 14.835 8.565 10.969 -0.0095 0.0979 0.0685 56GLU SC1 4613 15.053 8.317 10.743 -0.2891 -0.1064 0.3318 57PRO BB 4614 14.684 8.348 11.137 0.0780 0.0430 0.0700 57PRO SC1 4615 14.911 8.122 11.177 -0.1860 -0.2259 -0.0620 58LYS BB 4616 14.474 8.546 11.391 -0.1363 0.1506 0.2543 58LYS SC1 4617 14.342 8.648 11.088 -0.1821 -0.3907 -0.0030 58LYS SC2 4618 14.410 8.473 10.801 0.0722 0.1573 -0.1852 59GLU BB 4619 14.204 8.340 11.464 0.2083 0.1440 0.0235 59GLU SC1 4620 14.265 8.133 11.157 0.1710 -0.1359 0.1666 60GLU BB 4621 14.061 8.161 11.698 -0.1608 0.0540 -0.0962 60GLU SC1 4622 13.798 8.348 11.939 -0.0514 -0.1311 0.0948 61GLU BB 4623 14.342 8.077 11.930 0.0936 -0.0150 0.2024 61GLU SC1 4624 14.286 7.716 12.031 -0.0371 -0.1200 -0.1084 1LYS BB 4625 17.605 4.707 5.081 0.1279 0.0371 0.0442 1LYS SC1 4626 17.571 4.478 5.294 -0.0234 -0.0641 -0.4354 1LYS SC2 4627 17.317 4.274 5.449 0.2923 0.2290 0.3686 2LYS BB 4628 17.872 4.842 5.001 0.1973 -0.0867 -0.1730 2LYS SC1 4629 17.945 4.766 4.730 0.4148 0.0838 -0.0993 2LYS SC2 4630 17.866 4.921 4.430 -0.0754 -0.0068 -0.1197 3CYS BB 4631 17.863 5.201 5.094 0.0114 0.0062 -0.0695 3CYS SC1 4632 17.883 5.221 4.778 -0.0430 -0.5495 -0.1634 4LEU BB 4633 17.965 5.350 5.364 -0.1225 -0.0610 0.0174 4LEU SC1 4634 18.063 5.591 5.611 -0.0308 -0.2952 -0.1199 5PHE BB 4635 18.287 5.453 5.230 -0.0493 0.0611 0.0374 5PHE SC1 4636 18.412 5.303 4.988 -0.2375 -0.0472 0.1559 5PHE SC2 4637 18.234 5.267 4.700 0.3006 0.0530 -0.2056 5PHE SC3 4638 18.216 5.045 4.886 0.0315 -0.0604 -0.3620 6LYS BB 4639 18.370 5.769 5.131 -0.1244 -0.1392 -0.1226 6LYS SC1 4640 18.142 5.672 4.907 -0.0707 -0.0430 -0.5105 6LYS SC2 4641 18.069 5.722 4.610 -0.1487 -0.1116 0.4743 7LYS BB 4642 18.740 5.836 5.079 0.2273 0.1657 -0.0837 7LYS SC1 4643 18.874 5.961 5.305 0.0083 -0.1934 -0.0529 7LYS SC2 4644 18.928 6.205 5.557 0.3453 -0.2366 -0.3524 8LYS BB 4645 18.855 5.552 4.915 -0.0330 0.0073 -0.0340 8LYS SC1 4646 18.901 5.480 4.611 -0.2162 0.0848 -0.2658 8LYS SC2 4647 19.056 5.419 4.289 -0.0723 0.0001 -0.1639 9ASN BB 4648 19.148 5.450 4.947 -0.1655 -0.0768 -0.0811 9ASN SC1 4649 19.258 5.604 5.212 -0.2616 -0.0049 -0.0125 10LYS BB 4650 19.206 5.137 5.069 0.2332 -0.1009 -0.0558 10LYS SC1 4651 18.955 4.974 5.224 0.3016 -0.4097 0.0548 10LYS SC2 4652 18.792 4.962 5.562 -0.0872 0.2779 0.3811 11LYS BB 4653 19.432 4.923 4.991 0.1365 -0.2139 -0.0663 11LYS SC1 4654 19.328 4.630 5.014 0.1671 -0.1440 0.0743 11LYS SC2 4655 19.289 4.358 5.257 0.1024 0.1842 0.0958 12LYS BB 4656 19.626 4.978 4.760 -0.0275 -0.1887 0.0312 12LYS SC1 4657 19.862 4.832 4.941 -0.1615 0.1031 0.0596 12LYS SC2 4658 20.158 4.726 5.039 -0.0934 0.1688 0.1336 13GLY BB 4659 19.575 5.109 4.454 0.0735 -0.0541 -0.3493 14LYS BB 4660 19.786 5.041 4.164 0.2591 -0.2516 0.0907 14LYS SC1 4661 19.991 5.300 4.133 -0.2211 -0.1025 0.1970 14LYS SC2 4662 20.156 5.631 4.095 -0.3554 0.1238 -0.1769 15GLU BB 4663 20.041 4.799 4.070 0.1909 0.0964 -0.2923 15GLU SC1 4664 20.085 4.414 4.212 -0.0846 0.0577 -0.1911 16LYS BB 4665 20.188 4.986 3.864 -0.0618 0.2873 -0.1185 16LYS SC1 4666 20.495 4.830 3.875 0.1418 0.2194 -0.0527 16LYS SC2 4667 20.745 4.583 3.804 0.0177 -0.2743 -0.1862 17GLY BB 4668 20.173 4.850 3.582 -0.0053 -0.1791 0.0562 18GLY BB 4669 20.043 5.004 3.300 -0.0236 -0.0302 0.2804 19LYS BB 4670 19.891 4.792 3.065 -0.2344 -0.0059 -0.1138 19LYS SC1 4671 19.882 5.042 2.908 0.1266 0.0953 0.2088 19LYS SC2 4672 19.982 5.119 2.569 0.3433 -0.4542 -0.2671 20ASN BB 4673 19.653 4.567 3.201 0.1657 0.0521 -0.0995 20ASN SC1 4674 19.561 4.558 2.842 0.0514 0.2037 -0.1740 21ALA BB 4675 19.315 4.598 3.222 -0.1250 -0.2745 -0.2009 21ALA SC1 4676 19.277 4.861 3.272 -0.1966 -0.3130 -0.0469 22ILE BB 4677 19.225 4.430 3.493 0.0489 0.2720 0.0744 22ILE SC1 4678 19.287 4.464 3.827 0.0281 -0.3299 0.1505 23ASN BB 4679 18.925 4.241 3.556 -0.1993 -0.0886 0.0155 23ASN SC1 4680 18.725 4.468 3.478 -0.0320 -0.1191 0.0895 24MET BB 4681 19.051 4.021 3.740 0.0906 0.0208 0.1951 24MET SC1 4682 19.384 3.970 3.841 -0.0105 -0.0140 0.4091 25LYS BB 4683 18.882 3.739 3.678 0.1989 0.1715 0.0631 25LYS SC1 4684 18.638 3.911 3.578 -0.1765 0.0888 0.3152 25LYS SC2 4685 18.476 4.132 3.347 -0.0295 -0.0170 0.3841 26ASP BB 4686 19.019 3.534 3.492 -0.2004 -0.0812 -0.1074 26ASP SC1 4687 19.331 3.586 3.515 0.2970 -0.2060 -0.3439 27VAL BB 4688 19.132 3.231 3.444 -0.0833 -0.0251 -0.0103 27VAL SC1 4689 19.122 3.161 3.728 -0.2082 -0.2691 -0.0719 28LYS BB 4690 19.446 3.262 3.234 0.1486 0.2124 -0.2797 28LYS SC1 4691 19.195 3.198 3.069 -0.1998 -0.0471 0.4976 28LYS SC2 4692 18.888 3.413 3.061 0.0235 0.0783 0.3024 29ASP BB 4693 19.715 3.457 3.245 -0.1699 0.1168 -0.1626 29ASP SC1 4694 19.937 3.235 3.104 -0.2149 -0.0998 0.3365 30LEU BB 4695 19.736 3.773 3.201 -0.0788 0.1351 -0.2232 30LEU SC1 4696 19.960 3.921 2.972 -0.2195 0.2621 0.0627 31GLY BB 4697 19.761 3.896 3.528 0.0687 -0.1151 -0.0899 32LYS BB 4698 20.100 3.874 3.691 0.3233 0.3941 -0.1833 32LYS SC1 4699 20.106 3.569 3.633 0.0471 -0.0793 -0.0924 32LYS SC2 4700 20.066 3.266 3.533 -0.0669 -0.1961 -0.0341 33THR BB 4701 20.386 3.996 3.521 -0.3128 -0.2187 0.0586 33THR SC1 4702 20.591 4.158 3.677 -0.0477 -0.3555 -0.1396 34MET BB 4703 20.525 4.141 3.238 0.1255 0.0701 -0.1695 34MET SC1 4704 20.516 4.521 3.363 0.0133 0.4787 0.4065 35LYS BB 4705 20.356 4.090 2.954 -0.1213 -0.1983 0.0654 35LYS SC1 4706 20.478 3.798 2.877 0.1499 0.3633 0.4898 35LYS SC2 4707 20.536 3.691 2.575 0.0827 0.0989 0.0862 36ASP BB 4708 20.432 4.302 2.661 -0.1322 0.2092 -0.0729 36ASP SC1 4709 20.466 4.123 2.383 0.0272 0.3738 -0.1358 37GLN BB 4710 20.643 4.491 2.863 -0.0138 -0.1961 0.0555 37GLN SC1 4711 20.719 4.776 2.589 0.0461 -0.0805 0.0380 38ALA BB 4712 20.938 4.438 2.868 0.0014 -0.1290 0.3525 38ALA SC1 4713 21.011 4.408 3.127 -0.2182 -0.0966 0.4210 39LEU BB 4714 21.223 4.362 2.683 -0.1845 -0.0120 -0.2098 39LEU SC1 4715 21.386 4.148 2.949 0.2553 -0.3657 -0.3280 40LYS BB 4716 21.247 4.331 2.343 0.0178 -0.4355 -0.2449 40LYS SC1 4717 21.452 4.165 2.245 -0.3410 0.1178 -0.0257 40LYS SC2 4718 21.585 3.858 2.078 -0.0977 -0.2111 0.1306 41ASP BB 4719 21.176 4.460 2.067 0.0351 -0.0917 0.0161 41ASP SC1 4720 20.944 4.634 2.227 0.4270 -0.4786 -0.2264 42ASP BB 4721 21.232 4.369 1.741 0.3453 -0.0572 -0.1971 42ASP SC1 4722 21.448 4.110 1.694 -0.3424 -0.0400 -0.0648 43ASP BB 4723 21.128 4.401 1.444 0.1132 -0.3278 0.2125 43ASP SC1 4724 20.949 4.666 1.450 -0.0894 0.2075 0.2317 44ALA BB 4725 21.305 4.278 1.182 -0.0207 -0.1175 -0.2339 44ALA SC1 4726 21.187 4.319 0.943 -0.4644 -0.4406 -0.0848 45GLU BB 4727 21.429 3.996 1.228 0.0566 0.4286 0.2882 45GLU SC1 4728 21.504 3.959 0.852 -0.0689 -0.1612 0.2072 46THR BB 4729 21.278 3.761 1.404 -0.0195 0.0942 -0.2991 46THR SC1 4730 21.502 3.591 1.520 -0.3033 -0.0688 0.0259 47GLY BB 4731 21.061 3.964 1.606 -0.1939 0.0279 0.1908 48LEU BB 4732 20.779 4.046 1.679 -0.1745 0.0254 0.2941 48LEU SC1 4733 20.566 3.958 1.402 -0.0770 -0.0423 -0.1121 49THR BB 4734 20.562 4.051 1.943 -0.0005 -0.1989 -0.0444 49THR SC1 4735 20.791 4.183 2.095 -0.0125 -0.2452 0.0145 50ASP BB 4736 20.599 3.767 2.113 0.1655 -0.2690 -0.2766 50ASP SC1 4737 20.760 3.593 1.904 -0.4925 0.5050 0.2679 51GLY BB 4738 20.899 3.646 2.301 -0.2515 0.3833 0.4173 52GLU BB 4739 21.073 3.401 2.166 -0.3538 0.1454 -0.3364 52GLU SC1 4740 21.405 3.479 2.286 -0.0170 0.1409 -0.0203 53GLU BB 4741 21.015 3.151 1.978 0.0558 0.0678 -0.0331 53GLU SC1 4742 20.855 2.868 2.206 0.3350 -0.1381 -0.4064 54LYS BB 4743 21.002 3.170 1.644 -0.0159 -0.0068 0.0053 54LYS SC1 4744 20.677 3.172 1.672 -0.0298 0.3720 0.0176 54LYS SC2 4745 20.488 3.217 1.993 -0.1396 -0.1822 -0.0683 55GLU BB 4746 21.208 3.279 1.419 0.0427 0.0850 -0.0767 55GLU SC1 4747 20.984 3.096 1.134 0.2316 -0.1956 -0.2191 56GLU BB 4748 21.489 3.146 1.361 0.0452 -0.2437 -0.1201 56GLU SC1 4749 21.810 3.267 1.526 -0.0591 0.1618 0.0870 57PRO BB 4750 21.637 2.803 1.385 0.0115 0.1602 -0.1864 57PRO SC1 4751 21.574 2.860 1.703 0.1740 -0.3351 0.1993 58LYS BB 4752 21.514 2.490 1.467 0.0378 -0.1124 0.0477 58LYS SC1 4753 21.762 2.269 1.433 -0.1286 -0.2116 0.3914 58LYS SC2 4754 22.038 2.164 1.317 0.0478 -0.1697 -0.2201 59GLU BB 4755 21.263 2.392 1.187 -0.2605 -0.0670 -0.2851 59GLU SC1 4756 21.029 2.318 1.533 -0.1167 0.2660 0.0981 60GLU BB 4757 21.442 2.271 0.911 -0.1756 -0.1742 0.1016 60GLU SC1 4758 21.316 2.462 0.651 0.0061 -0.2607 -0.0288 61GLU BB 4759 21.689 2.104 1.012 0.1713 0.4892 0.0673 61GLU SC1 4760 22.014 2.144 0.842 0.3104 0.3247 -0.0149 1LYS BB 4761 19.527 7.584 13.715 0.0592 -0.0820 0.0689 1LYS SC1 4762 19.822 7.492 13.796 0.1848 -0.0632 0.1010 1LYS SC2 4763 20.076 7.254 13.708 0.1905 0.1431 -0.0609 2LYS BB 4764 19.321 7.395 13.725 -0.0647 -0.2385 -0.2502 2LYS SC1 4765 19.030 7.417 13.626 -0.1519 -0.3420 -0.0816 2LYS SC2 4766 18.947 7.624 13.390 -0.0957 0.1424 -0.1758 3CYS BB 4767 19.159 7.353 14.040 0.0254 -0.1687 -0.0924 3CYS SC1 4768 18.936 7.147 13.884 0.0328 0.5301 0.1990 4LEU BB 4769 19.114 7.564 14.285 0.3702 0.1352 -0.0532 4LEU SC1 4770 18.758 7.624 14.146 0.1111 0.3694 0.4380 5PHE BB 4771 19.352 7.630 14.536 0.2902 -0.2207 -0.3140 5PHE SC1 4772 19.485 7.451 14.722 -0.0753 -0.1661 -0.2050 5PHE SC2 4773 19.457 7.200 14.950 0.1548 0.1507 0.1856 5PHE SC3 4774 19.700 7.196 14.792 -0.1604 -0.2707 -0.3212 6LYS BB 4775 19.228 7.912 14.700 0.0397 0.3084 0.2320 6LYS SC1 4776 18.988 7.883 14.907 -0.1612 -0.2503 0.0112 6LYS SC2 4777 18.992 8.214 15.014 0.0174 -0.2142 -0.0008 7LYS BB 4778 19.407 8.106 14.882 0.0547 -0.2446 -0.3047 7LYS SC1 4779 19.344 8.366 14.714 0.3193 0.2450 0.2167 7LYS SC2 4780 19.490 8.656 14.538 0.4178 0.2630 0.1114 8LYS BB 4781 19.758 8.138 14.806 -0.0308 0.2190 -0.0088 8LYS SC1 4782 19.783 7.886 14.612 0.2733 -0.4770 -0.0831 8LYS SC2 4783 20.063 7.909 14.458 -0.3411 -0.0238 0.2339 9ASN BB 4784 20.029 8.174 14.946 -0.0814 0.2025 -0.2686 9ASN SC1 4785 20.185 8.489 14.881 -0.6139 0.1187 -0.0447 10LYS BB 4786 20.128 8.099 15.244 0.2611 -0.0972 0.2254 10LYS SC1 4787 20.267 7.848 15.244 0.1942 -0.0695 0.3857 10LYS SC2 4788 20.162 7.577 15.384 -0.0472 0.1901 0.0419 11LYS BB 4789 20.220 8.329 15.411 0.1708 0.0995 0.0379 11LYS SC1 4790 20.369 8.585 15.244 0.0470 0.2479 0.1813 11LYS SC2 4791 20.623 8.659 14.951 0.2041 0.0373 -0.0695 12LYS BB 4792 20.184 8.443 15.714 0.2381 -0.0162 -0.1147 12LYS SC1 4793 20.142 8.726 15.607 0.2041 -0.1488 -0.1357 12LYS SC2 4794 20.208 9.066 15.750 0.1657 -0.0551 0.2556 13GLY BB 4795 20.048 8.285 16.035 -0.3162 0.0141 -0.0705 14LYS BB 4796 20.286 8.379 16.296 -0.1204 0.3255 -0.1873 14LYS SC1 4797 20.387 8.081 16.347 -0.0512 -0.4829 -0.1018 14LYS SC2 4798 20.343 7.869 16.100 0.0681 0.0002 -0.2258 15GLU BB 4799 20.116 8.532 16.515 -0.0686 -0.1618 -0.1500 15GLU SC1 4800 20.117 8.247 16.791 -0.0427 -0.1113 0.0662 16LYS BB 4801 19.829 8.581 16.422 -0.0792 -0.0541 -0.0567 16LYS SC1 4802 19.653 8.345 16.271 -0.0899 0.0375 -0.1554 16LYS SC2 4803 19.403 8.134 16.227 0.0568 -0.3629 -0.0351 17GLY BB 4804 19.728 8.910 16.397 -0.2335 0.0535 0.1389 18GLY BB 4805 19.505 9.149 16.276 0.0608 0.6413 -0.0566 19LYS BB 4806 19.412 9.475 16.272 0.3807 0.0113 -0.0803 19LYS SC1 4807 19.536 9.500 15.984 0.0931 -0.0081 0.0170 19LYS SC2 4808 19.478 9.471 15.656 0.0275 0.0942 0.1957 20ASN BB 4809 19.538 9.556 16.572 0.2236 -0.0286 0.1277 20ASN SC1 4810 19.798 9.391 16.508 -0.2223 0.3285 0.3365 21ALA BB 4811 19.365 9.721 16.753 0.2650 -0.3168 -0.2207 21ALA SC1 4812 19.546 9.920 16.724 0.0079 -0.0917 -0.3302 22ILE BB 4813 19.038 9.689 16.892 -0.0754 0.0731 0.2385 22ILE SC1 4814 18.811 9.477 16.749 0.1623 0.0816 -0.1658 23ASN BB 4815 18.758 9.896 16.862 0.0191 0.1886 0.2116 23ASN SC1 4816 18.412 9.912 16.803 0.1085 0.0118 -0.1307 24MET BB 4817 18.813 10.157 16.980 -0.0235 -0.0012 0.3559 24MET SC1 4818 18.507 10.261 17.242 0.1376 -0.3533 0.3830 25LYS BB 4819 18.758 10.367 16.729 0.2291 -0.1683 0.1488 25LYS SC1 4820 18.833 10.192 16.450 0.3125 -0.1094 -0.0204 25LYS SC2 4821 19.002 10.246 16.183 0.0249 0.2064 -0.4107 26ASP BB 4822 18.968 10.628 16.798 0.0543 -0.0877 0.1934 26ASP SC1 4823 19.123 10.583 16.487 0.1794 -0.2252 -0.0682 27VAL BB 4824 18.831 10.915 16.660 -0.2305 -0.1507 0.1051 27VAL SC1 4825 18.741 11.012 16.399 0.1257 0.1229 0.0761 28LYS BB 4826 18.868 11.107 16.957 0.2137 -0.0297 0.2310 28LYS SC1 4827 18.989 11.406 16.929 -0.2201 0.3002 0.0363 28LYS SC2 4828 19.017 11.719 17.075 0.2082 0.1334 -0.2024 29ASP BB 4829 19.056 11.008 17.156 -0.0590 0.0723 0.0758 29ASP SC1 4830 19.356 11.071 17.304 0.1728 -0.1779 -0.0778 30LEU BB 4831 19.078 10.679 17.301 0.1026 0.1539 0.0737 30LEU SC1 4832 18.762 10.619 17.207 -0.0470 0.4226 0.1740 31GLY BB 4833 19.160 10.373 17.284 -0.3190 0.0771 -0.5362 32LYS BB 4834 18.954 10.226 17.528 0.3262 -0.0947 0.0231 32LYS SC1 4835 18.869 9.964 17.403 0.2504 -0.1396 0.3442 32LYS SC2 4836 18.602 9.797 17.268 0.1970 -0.1007 -0.2447 33THR BB 4837 18.940 10.115 17.860 -0.2157 -0.1267 -0.1225 33THR SC1 4838 18.734 10.295 17.994 -0.0361 -0.0610 0.0711 34MET BB 4839 18.736 9.848 17.800 0.3450 0.3310 -0.0569 34MET SC1 4840 18.466 10.064 17.683 0.1483 0.1831 0.0634 35LYS BB 4841 18.603 9.606 17.930 -0.2086 0.0357 -0.0933 35LYS SC1 4842 18.331 9.567 18.040 -0.0624 0.2442 0.3573 35LYS SC2 4843 18.043 9.324 18.057 0.3622 0.2418 -0.2441 36ASP BB 4844 18.821 9.552 18.203 -0.1129 0.1315 0.3442 36ASP SC1 4845 19.116 9.651 18.047 0.1616 0.1691 -0.1688 37GLN BB 4846 18.915 9.262 18.197 -0.1404 0.1778 -0.2282 37GLN SC1 4847 19.294 9.228 18.339 0.0843 -0.3370 -0.0325 38ALA BB 4848 18.679 9.076 18.141 0.1359 0.1992 0.0359 38ALA SC1 4849 18.812 8.899 17.987 0.5176 0.4820 0.0264 39LEU BB 4850 18.516 9.102 17.812 0.2754 0.1641 0.0756 39LEU SC1 4851 18.790 9.265 17.713 -0.0427 -0.0730 -0.4640 40LYS BB 4852 18.477 8.873 17.606 0.0248 -0.2836 0.1668 40LYS SC1 4853 18.812 8.804 17.610 0.0619 -0.0946 0.1750 40LYS SC2 4854 19.121 8.942 17.479 -0.1648 0.4953 0.1246 41ASP BB 4855 18.239 8.695 17.474 -0.1657 0.0652 -0.0797 41ASP SC1 4856 18.100 8.664 17.801 -0.2292 0.0197 0.2053 42ASP BB 4857 18.147 8.578 17.211 0.2718 0.2218 0.1021 42ASP SC1 4858 18.314 8.333 17.111 -0.0544 0.0217 0.0917 43ASP BB 4859 18.130 8.785 16.996 -0.3653 0.0865 -0.1834 43ASP SC1 4860 18.270 9.069 17.164 0.3294 -0.0163 -0.1051 44ALA BB 4861 17.813 8.716 16.822 -0.1113 0.0332 0.0746 44ALA SC1 4862 17.709 8.592 17.037 -0.1010 -0.0787 0.0160 45GLU BB 4863 17.520 8.836 16.709 0.0805 0.1795 0.1065 45GLU SC1 4864 17.554 8.907 16.374 -0.1164 0.3918 0.1152 46THR BB 4865 17.284 8.791 16.938 0.0564 0.3060 -0.2939 46THR SC1 4866 17.074 8.931 16.766 -0.4549 -0.0723 -0.0079 47GLY BB 4867 17.338 8.482 16.975 0.4373 -0.0815 0.0381 48LEU BB 4868 17.527 8.301 16.753 -0.0546 -0.4091 0.0673 48LEU SC1 4869 17.767 8.211 17.000 0.1430 0.0653 -0.0318 49THR BB 4870 17.569 8.325 16.456 0.2674 -0.1419 -0.0915 49THR SC1 4871 17.812 8.504 16.416 0.2524 -0.0394 0.2445 50ASP BB 4872 17.411 8.388 16.149 0.0704 -0.2604 -0.0039 50ASP SC1 4873 17.694 8.473 15.974 -0.1823 0.1915 -0.3366 51GLY BB 4874 17.170 8.579 16.157 0.0592 -0.1681 -0.1817 52GLU BB 4875 16.886 8.550 16.264 0.1001 0.5285 0.1684 52GLU SC1 4876 16.660 8.817 16.462 0.2524 -0.0070 -0.3033 53GLU BB 4877 16.757 8.254 16.165 -0.0635 0.3380 -0.1800 53GLU SC1 4878 17.056 8.047 16.018 -0.1085 0.3616 -0.0396 54LYS BB 4879 16.496 8.363 15.949 0.0981 0.0511 0.2513 54LYS SC1 4880 16.494 8.662 15.862 0.1327 0.0815 -0.0855 54LYS SC2 4881 16.354 8.833 16.085 0.3351 -0.1558 0.4849 55GLU BB 4882 16.193 8.376 16.083 0.1721 -0.2248 0.0997 55GLU SC1 4883 16.115 8.573 16.416 0.0784 -0.2388 0.2248 56GLU BB 4884 16.037 8.066 15.979 -0.2435 0.1639 -0.1807 56GLU SC1 4885 16.060 8.037 15.607 0.0282 -0.1119 0.0491 57PRO BB 4886 15.947 7.914 16.255 -0.2296 -0.1083 -0.1717 57PRO SC1 4887 15.682 7.794 16.093 0.1495 0.0035 -0.1419 58LYS BB 4888 16.253 8.030 16.423 -0.1869 -0.2324 0.1528 58LYS SC1 4889 16.421 7.967 16.202 -0.1172 -0.0461 0.0668 58LYS SC2 4890 16.488 7.854 15.906 -0.2978 0.2148 0.0175 59GLU BB 4891 16.375 7.811 16.655 -0.3296 0.1277 -0.2082 59GLU SC1 4892 16.724 8.009 16.716 -0.0137 -0.3165 -0.1295 60GLU BB 4893 16.253 7.690 16.909 0.1296 -0.1825 0.2584 60GLU SC1 4894 15.924 7.907 16.937 0.1046 0.0453 -0.3105 61GLU BB 4895 16.187 7.345 16.920 0.0183 -0.2402 0.2202 61GLU SC1 4896 16.456 7.181 16.741 0.1475 0.1075 -0.1183 1LYS BB 4897 15.299 10.121 5.921 0.0150 -0.0570 -0.0827 1LYS SC1 4898 15.556 9.930 5.848 0.0503 0.2264 0.0667 1LYS SC2 4899 15.657 9.701 5.607 0.0758 -0.0470 -0.0482 2LYS BB 4900 15.197 10.350 5.642 -0.0150 0.1272 -0.0769 2LYS SC1 4901 14.938 10.477 5.756 -0.3104 -0.2859 0.0898 2LYS SC2 4902 14.839 10.807 5.754 0.1155 0.0789 0.1885 3CYS BB 4903 15.456 10.419 5.363 -0.1419 -0.0978 -0.1840 3CYS SC1 4904 15.437 10.116 5.188 0.0824 -0.2174 0.2600 4LEU BB 4905 15.512 10.760 5.301 0.1233 0.1036 0.0731 4LEU SC1 4906 15.308 10.919 5.547 0.2268 0.2488 0.2533 5PHE BB 4907 15.768 11.020 5.317 -0.0653 -0.1404 -0.0012 5PHE SC1 4908 15.596 11.265 5.213 -0.2604 -0.0173 0.1676 5PHE SC2 4909 15.403 11.421 5.446 -0.1234 0.1723 0.1561 5PHE SC3 4910 15.605 11.588 5.320 0.0159 -0.0108 0.1325 6LYS BB 4911 15.984 10.998 5.066 0.2383 -0.2569 0.0226 6LYS SC1 4912 16.136 11.263 5.157 -0.2123 0.1698 -0.3557 6LYS SC2 4913 16.323 11.546 5.165 0.0418 -0.3241 0.1256 7LYS BB 4914 16.146 10.728 4.938 0.3946 0.0248 -0.0895 7LYS SC1 4915 15.799 10.605 5.003 0.4055 -0.1094 -0.1263 7LYS SC2 4916 15.542 10.365 4.922 0.3768 -0.1963 -0.0779 8LYS BB 4917 16.414 10.683 5.114 0.1778 0.3445 0.3464 8LYS SC1 4918 16.472 10.868 5.373 -0.1297 -0.2016 -0.0925 8LYS SC2 4919 16.371 10.721 5.592 -0.1082 -0.1671 -0.0568 9ASN BB 4920 16.690 10.566 5.008 0.1027 -0.1174 -0.0001 9ASN SC1 4921 16.880 10.657 4.739 -0.0170 0.2674 -0.0286 10LYS BB 4922 16.666 10.223 4.863 -0.0831 -0.0051 0.1255 10LYS SC1 4923 16.978 10.244 4.879 0.1380 -0.4428 -0.2315 10LYS SC2 4924 17.095 10.298 5.224 -0.1424 0.0238 -0.0990 11LYS BB 4925 16.658 9.938 4.916 0.2532 0.0137 0.0417 11LYS SC1 4926 16.598 9.816 4.663 0.1090 -0.2831 -0.0432 11LYS SC2 4927 16.304 9.756 4.476 -0.1924 -0.1911 0.2431 12LYS BB 4928 16.531 9.815 5.136 0.2185 0.1097 0.2184 12LYS SC1 4929 16.237 9.822 5.048 -0.0740 -0.0792 0.2469 12LYS SC2 4930 16.067 9.497 5.058 0.0125 -0.0358 -0.1280 13GLY BB 4931 16.554 9.862 5.433 0.2190 0.1601 -0.2621 14LYS BB 4932 16.490 9.685 5.699 -0.2439 -0.1074 -0.3272 14LYS SC1 4933 16.276 9.883 5.794 -0.2430 0.1610 0.0617 14LYS SC2 4934 16.071 9.905 6.075 0.3341 -0.3832 -0.2101 15GLU BB 4935 16.706 9.873 5.932 0.1186 -0.3539 -0.0491 15GLU SC1 4936 16.494 10.083 6.181 -0.1867 -0.1889 0.1731 16LYS BB 4937 16.843 9.633 6.137 0.0685 0.2363 -0.3243 16LYS SC1 4938 17.002 9.874 6.274 -0.0689 -0.2503 -0.1877 16LYS SC2 4939 16.996 10.188 6.127 -0.0085 0.2919 -0.1668 17GLY BB 4940 17.084 9.442 6.163 0.1348 -0.2324 0.7528 18GLY BB 4941 17.371 9.324 5.965 -0.1766 0.1656 0.0405 19LYS BB 4942 17.296 9.385 5.651 0.0112 -0.2422 -0.0635 19LYS SC1 4943 17.492 9.589 5.542 -0.1103 0.3500 0.3337 19LYS SC2 4944 17.790 9.704 5.387 -0.2950 0.1983 -0.3759 20ASN BB 4945 16.987 9.543 5.673 -0.0859 -0.2136 -0.0107 20ASN SC1 4946 17.168 9.779 5.829 0.1781 0.1384 0.2216 21ALA BB 4947 16.853 9.328 5.443 0.0838 0.1377 0.2052 21ALA SC1 4948 16.785 9.485 5.234 0.1616 0.0189 0.0896 22ILE BB 4949 17.135 9.137 5.252 0.3871 -0.0157 -0.2381 22ILE SC1 4950 17.208 9.469 5.227 0.1927 0.0527 0.0478 23ASN BB 4951 16.999 9.180 4.934 -0.1380 -0.1350 0.2119 23ASN SC1 4952 16.699 9.057 5.037 0.0642 -0.4139 -0.0113 24MET BB 4953 17.019 9.394 4.655 0.0226 -0.2233 -0.1080 24MET SC1 4954 17.124 9.713 4.771 0.0484 0.0809 0.0712 25LYS BB 4955 17.118 9.215 4.421 -0.4175 -0.2548 0.1529 25LYS SC1 4956 17.480 9.317 4.383 0.1845 0.0558 0.3090 25LYS SC2 4957 17.747 9.247 4.542 -0.0663 -0.0490 0.3188 26ASP BB 4958 17.016 9.048 4.169 0.0517 -0.1546 0.1999 26ASP SC1 4959 16.799 9.273 4.068 0.1575 -0.4203 -0.3112 27VAL BB 4960 17.202 8.734 4.052 -0.0375 -0.2349 0.0386 27VAL SC1 4961 17.185 8.789 3.766 0.2348 0.0152 0.0662 28LYS BB 4962 17.437 8.661 4.215 -0.1455 -0.0787 0.2929 28LYS SC1 4963 17.635 8.499 4.108 -0.1007 0.0957 -0.2011 28LYS SC2 4964 17.967 8.578 4.091 -0.0805 -0.1877 -0.2999 29ASP BB 4965 17.557 8.830 4.437 0.2732 -0.0109 -0.0887 29ASP SC1 4966 17.906 8.813 4.444 0.1395 0.1321 0.0993 30LEU BB 4967 17.443 8.932 4.682 -0.1846 -0.0040 -0.0697 30LEU SC1 4968 17.458 9.248 4.847 0.1551 -0.1107 -0.0967 31GLY BB 4969 17.385 8.858 5.002 -0.2581 -0.3135 0.0281 32LYS BB 4970 17.349 8.525 4.926 -0.1163 -0.1065 -0.2379 32LYS SC1 4971 17.284 8.483 4.599 0.2089 -0.0693 0.1325 32LYS SC2 4972 17.076 8.321 4.368 0.0648 0.1568 0.1422 33THR BB 4973 17.298 8.292 5.102 0.0028 -0.0827 -0.0884 33THR SC1 4974 17.415 8.373 5.372 -0.3543 0.1177 0.0118 34MET BB 4975 16.985 8.287 5.249 -0.0524 0.0025 0.0009 34MET SC1 4976 16.927 8.687 5.116 -0.1222 0.2361 0.3163 35LYS BB 4977 16.676 8.122 5.176 -0.0946 0.1401 -0.2292 35LYS SC1 4978 16.559 8.374 5.047 -0.1363 0.0612 0.3808 35LYS SC2 4979 16.416 8.613 5.245 -0.1973 -0.2005 0.2199 36ASP BB 4980 16.536 7.922 5.345 -0.1107 -0.1905 0.0130 36ASP SC1 4981 16.581 7.614 5.204 -0.4710 -0.2186 0.2226 37GLN BB 4982 16.771 7.812 5.548 0.0345 -0.2674 0.1058 37GLN SC1 4983 16.948 7.877 5.856 0.3444 0.0828 -0.0838 38ALA BB 4984 16.943 7.525 5.541 0.0871 0.2323 0.0553 38ALA SC1 4985 17.150 7.597 5.698 -0.1980 -0.3016 0.7252 39LEU BB 4986 16.852 7.293 5.387 0.4352 -0.1191 -0.0308 39LEU SC1 4987 17.152 7.328 5.221 0.0517 0.1685 -0.1312 40LYS BB 4988 16.695 7.098 5.578 -0.0669 0.2881 0.0847 40LYS SC1 4989 16.954 7.122 5.818 0.0249 0.5022 -0.0967 40LYS SC2 4990 17.234 6.954 5.954 0.3702 0.2336 0.0447 41ASP BB 4991 16.433 7.051 5.723 0.2231 -0.0082 -0.0917 41ASP SC1 4992 16.240 6.878 5.487 -0.2272 0.1863 -0.2436 42ASP BB 4993 16.372 7.260 5.956 -0.1303 0.0939 -0.1712 42ASP SC1 4994 16.623 7.497 5.950 0.1863 -0.2594 -0.0486 43ASP BB 4995 16.147 7.443 5.991 -0.0236 0.0293 -0.1403 43ASP SC1 4996 15.827 7.278 6.032 -0.4133 0.2448 -0.5683 44ALA BB 4997 16.124 7.507 6.360 -0.0559 -0.1270 0.1808 44ALA SC1 4998 16.131 7.772 6.412 -0.3390 -0.1075 0.1356 45GLU BB 4999 15.889 7.385 6.538 0.0405 -0.2971 -0.4100 45GLU SC1 5000 15.809 7.304 6.906 -0.1945 0.0109 0.0792 46THR BB 5001 15.556 7.345 6.461 0.2069 -0.0464 -0.0328 46THR SC1 5002 15.396 7.334 6.721 -0.0992 0.1775 -0.2044 47GLY BB 5003 15.436 7.375 6.179 -0.5941 0.2506 -0.3608 48LEU BB 5004 15.383 7.610 5.975 -0.0506 -0.1318 -0.0554 48LEU SC1 5005 15.167 7.453 5.717 -0.2381 -0.2382 -0.2910 49THR BB 5006 15.419 7.944 5.982 -0.0599 0.0282 0.4110 49THR SC1 5007 15.451 8.053 5.699 0.0099 0.0930 0.4435 50ASP BB 5008 15.480 8.182 6.181 -0.1458 -0.2158 0.0123 50ASP SC1 5009 15.392 8.062 6.505 0.5805 0.0616 -0.1398 51GLY BB 5010 15.738 8.346 6.037 0.6543 0.3593 -0.0299 52GLU BB 5011 15.704 8.386 5.740 -0.0718 -0.0546 -0.0767 52GLU SC1 5012 15.357 8.519 5.724 0.1672 0.2043 0.1008 53GLU BB 5013 15.861 8.674 5.722 -0.0076 0.1671 0.0371 53GLU SC1 5014 16.174 8.563 5.915 0.3931 0.1115 0.0122 54LYS BB 5015 16.024 8.755 5.430 0.0078 -0.0245 0.1524 54LYS SC1 5016 16.113 8.403 5.398 -0.0515 -0.2974 0.0057 54LYS SC2 5017 16.082 8.163 5.636 -0.2191 -0.0875 -0.2431 55GLU BB 5018 15.924 9.020 5.229 -0.0528 0.0578 -0.1597 55GLU SC1 5019 16.216 9.021 5.024 -0.5171 -0.0067 0.1911 56GLU BB 5020 15.851 9.275 5.407 0.0507 0.1489 0.2463 56GLU SC1 5021 15.611 9.506 5.170 -0.2409 -0.5424 -0.0676 57PRO BB 5022 15.759 9.127 5.723 -0.1984 -0.3615 0.3671 57PRO SC1 5023 15.505 8.962 5.581 0.1307 -0.4900 0.1059 58LYS BB 5024 15.589 9.332 5.909 -0.1980 0.1375 -0.0126 58LYS SC1 5025 15.308 9.191 5.958 0.6552 -0.4881 0.2472 58LYS SC2 5026 15.046 9.307 6.211 0.2522 -0.2569 0.1724 59GLU BB 5027 15.773 9.526 6.076 -0.1579 0.0165 0.0699 59GLU SC1 5028 16.053 9.509 5.825 -0.0083 -0.2094 0.0508 60GLU BB 5029 15.647 9.768 6.283 0.1972 -0.3615 0.1743 60GLU SC1 5030 15.879 9.788 6.607 -0.0419 -0.1465 -0.2259 61GLU BB 5031 15.366 9.682 6.198 -0.1615 0.2624 -0.0520 61GLU SC1 5032 15.148 9.667 5.876 0.0691 0.0851 -0.2027 25.38827 25.38827 25.38827