X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=examples%2FUNRES-Dock%2Foutput%2Fwham_T300K_0004.pdb;fp=examples%2FUNRES-Dock%2Foutput%2Fwham_T300K_0004.pdb;h=683243aad0d0e05db366893b740b2aaa2a389a70;hb=86a7a0fff3fb6d1c18791c4d2723ee3173d2cf65;hp=9339cbc5f1d9d6777a8df844bf9348fbc7cb3a5c;hpb=018446aca1e32faf80f41e818acbfc61e5d872c9;p=unres.git diff --git a/examples/UNRES-Dock/output/wham_T300K_0004.pdb b/examples/UNRES-Dock/output/wham_T300K_0004.pdb index 9339cbc..683243a 100644 --- a/examples/UNRES-Dock/output/wham_T300K_0004.pdb +++ b/examples/UNRES-Dock/output/wham_T300K_0004.pdb @@ -1,611 +1,611 @@ -REMARK CLUSTER 4 FREE ENERGY -1.28158E+01 AVE RMSD 0.00 -REMARK clustering ENERGY -1.20610E+01 RMS 0.00 -ATOM 1 CA ASP A 1 7.892 5.027 30.144 1.00 5.00 -ATOM 2 CB ASP A 1 6.200 4.047 29.446 1.00 5.00 -ATOM 3 CA TRP A 2 10.332 2.970 27.897 1.00 5.00 -ATOM 4 CB TRP A 2 11.182 3.536 24.676 1.00 5.00 -ATOM 5 CA THR A 3 11.224 0.020 30.215 1.00 5.00 -ATOM 6 CB THR A 3 10.677 -0.053 31.566 1.00 5.00 -ATOM 7 CA THR A 4 8.139 -1.558 28.779 1.00 5.00 -ATOM 8 CB THR A 4 7.150 -1.858 29.861 1.00 5.00 -ATOM 9 CA PHE A 5 8.438 -0.332 25.217 1.00 5.00 -ATOM 10 CB PHE A 5 8.670 0.850 22.481 1.00 5.00 -ATOM 11 CA ARG A 6 11.664 -2.386 25.593 1.00 5.00 -ATOM 12 CB ARG A 6 14.095 -3.808 26.950 1.00 5.00 -ATOM 13 CA ARG A 7 9.624 -5.217 27.214 1.00 5.00 -ATOM 14 CB ARG A 7 8.160 -7.590 29.188 1.00 5.00 -ATOM 15 CA VAL A 8 6.721 -5.159 24.698 1.00 5.00 -ATOM 16 CB VAL A 8 6.154 -3.845 24.383 1.00 5.00 -ATOM 17 CA PHE A 9 8.918 -6.097 21.494 1.00 5.00 -ATOM 18 CB PHE A 9 7.764 -3.788 20.039 1.00 5.00 -ATOM 19 CA LEU A 10 11.684 -7.755 23.303 1.00 5.00 -ATOM 20 CB LEU A 10 11.657 -9.212 24.825 1.00 5.00 -ATOM 21 CA ILE A 11 14.466 -4.998 22.875 1.00 5.00 -ATOM 22 CB ILE A 11 13.820 -3.238 22.763 1.00 5.00 -ATOM 23 CA ASP A 12 18.306 -4.355 23.188 1.00 5.00 -ATOM 24 CB ASP A 12 19.242 -3.215 21.729 1.00 5.00 -ATOM 25 CA ASP A 13 19.053 -1.935 26.040 1.00 5.00 -ATOM 26 CB ASP A 13 17.452 -1.701 27.429 1.00 5.00 -ATOM 27 CA ALA A 14 21.995 -0.385 23.865 1.00 5.00 -ATOM 28 CB ALA A 14 22.365 -0.830 23.320 1.00 5.00 -ATOM 29 CA TRP A 15 19.357 0.838 21.120 1.00 5.00 -ATOM 30 CB TRP A 15 19.453 0.656 17.707 1.00 5.00 -ATOM 31 CA ARG A 16 17.621 3.006 23.704 1.00 5.00 -ATOM 32 CB ARG A 16 15.954 4.628 26.379 1.00 5.00 -ATOM 33 CA PRO A 17 20.096 5.584 22.748 1.00 5.00 -ATOM 34 CB PRO A 17 20.998 4.514 23.124 1.00 5.00 -ATOM 35 CA LEU A 18 18.432 6.293 19.653 1.00 5.00 -ATOM 36 CB LEU A 18 20.018 5.556 18.484 1.00 5.00 -ATOM 37 CA MET A 19 15.218 4.767 20.613 1.00 5.00 -ATOM 38 CB MET A 19 15.599 2.699 21.254 1.00 5.00 -ATOM 39 CA GLU A 20 13.254 6.489 23.154 1.00 5.00 -ATOM 40 CB GLU A 20 11.952 7.832 24.437 1.00 5.00 -ATOM 41 CA PRO A 21 13.939 9.905 22.177 1.00 5.00 -ATOM 42 CB PRO A 21 15.336 9.607 21.881 1.00 5.00 -ATOM 43 CA GLU A 22 11.625 9.101 19.325 1.00 5.00 -ATOM 44 CB GLU A 22 12.147 6.630 18.089 1.00 5.00 -ATOM 45 CA LEU A 23 8.910 7.756 21.470 1.00 5.00 -ATOM 46 CB LEU A 23 7.682 6.378 22.567 1.00 5.00 -ATOM 47 CA ALA A 24 8.825 11.421 22.711 1.00 5.00 -ATOM 48 CB ALA A 24 9.521 11.824 22.867 1.00 5.00 -ATOM 49 CA ASN A 25 6.968 11.928 19.464 1.00 5.00 -ATOM 50 CB ASN A 25 8.576 10.767 19.260 1.00 5.00 -ATOM 51 CA PRO A 26 3.204 11.536 19.721 1.00 5.00 -ATOM 52 CB PRO A 26 3.219 12.947 19.359 1.00 5.00 -ATOM 53 CA LEU A 27 2.607 10.199 16.226 1.00 5.00 -ATOM 54 CB LEU A 27 1.008 11.068 14.898 1.00 5.00 -ATOM 55 CA THR A 28 5.308 7.414 17.025 1.00 5.00 -ATOM 56 CB THR A 28 6.696 7.098 16.771 1.00 5.00 -ATOM 57 CA ALA A 29 3.275 6.394 20.035 1.00 5.00 -ATOM 58 CB ALA A 29 3.465 6.603 20.807 1.00 5.00 -ATOM 59 CA HIS A 30 0.297 6.448 17.947 1.00 5.00 -ATOM 60 CB HIS A 30 -1.570 7.341 16.093 1.00 5.00 -ATOM 61 CA LEU A 31 2.123 3.623 15.952 1.00 5.00 -ATOM 62 CB LEU A 31 3.870 3.782 14.817 1.00 5.00 -ATOM 63 CA LEU A 32 1.764 1.461 19.073 1.00 5.00 -ATOM 64 CB LEU A 32 3.279 0.383 20.160 1.00 5.00 -ATOM 65 CA ALA A 33 -1.799 2.228 18.862 1.00 5.00 -ATOM 66 CB ALA A 33 -1.780 2.952 18.691 1.00 5.00 -ATOM 67 CA GLU A 34 -2.505 0.787 15.294 1.00 5.00 -ATOM 68 CB GLU A 34 -1.880 2.853 14.406 1.00 5.00 -ATOM 69 CA TYR A 35 -0.172 -2.182 15.505 1.00 5.00 -ATOM 70 CB TYR A 35 2.424 -3.764 16.830 1.00 5.00 -ATOM 71 CA ASN A 36 -1.917 -2.785 18.978 1.00 5.00 -ATOM 72 CB ASN A 36 -0.373 -2.427 20.274 1.00 5.00 -ATOM 73 CA ARG A 37 -5.315 -3.240 17.349 1.00 5.00 -ATOM 74 CB ARG A 37 -5.352 -1.293 19.469 1.00 5.00 -ATOM 75 CA ARG A 38 -3.908 -4.813 14.170 1.00 5.00 -ATOM 76 CB ARG A 38 -3.790 -2.318 11.938 1.00 5.00 -ATOM 77 CA CYS A 39 -2.435 -7.733 15.962 1.00 5.00 -ATOM 78 CB CYS A 39 -1.193 -7.635 16.377 1.00 5.00 -ATOM 79 CA GLN A 40 -5.676 -8.404 17.631 1.00 5.00 -ATOM 80 CB GLN A 40 -7.748 -7.841 18.709 1.00 5.00 -ATOM 81 CA THR A 41 -7.778 -8.229 14.579 1.00 5.00 -ATOM 82 CB THR A 41 -9.070 -7.685 14.160 1.00 5.00 -ATOM 83 CA GLU A 42 -5.192 -9.748 12.280 1.00 5.00 -ATOM 84 CB GLU A 42 -6.011 -9.655 9.878 1.00 5.00 -ATOM 85 CA GLU A 43 -1.859 -12.172 12.497 1.00 5.00 -ATOM 86 CB GLU A 43 0.377 -13.690 13.112 1.00 5.00 -ATOM 87 CA VAL A 44 1.033 -9.837 11.567 1.00 5.00 -ATOM 88 CB VAL A 44 1.177 -8.536 12.275 1.00 5.00 -ATOM 89 CA LEU A 45 4.249 -10.575 9.791 1.00 5.00 -ATOM 90 CB LEU A 45 5.204 -11.156 7.989 1.00 5.00 -ATOM 91 CA PRO A 46 7.254 -10.814 12.261 1.00 5.00 -ATOM 92 CB PRO A 46 7.312 -9.468 11.831 1.00 5.00 -ATOM 93 CA PRO A 47 5.516 -12.509 15.315 1.00 5.00 -ATOM 94 CB PRO A 47 6.014 -13.721 14.746 1.00 5.00 -ATOM 95 CA ARG A 48 6.464 -9.772 17.685 1.00 5.00 -ATOM 96 CB ARG A 48 4.631 -8.237 21.002 1.00 5.00 -ATOM 97 CA GLU A 49 9.006 -11.884 19.216 1.00 5.00 -ATOM 98 CB GLU A 49 7.825 -11.827 21.377 1.00 5.00 -ATOM 99 CA ASP A 50 10.972 -10.634 16.231 1.00 5.00 -ATOM 100 CB ASP A 50 12.118 -12.046 15.147 1.00 5.00 -ATOM 101 CA VAL A 51 10.228 -6.973 15.176 1.00 5.00 -ATOM 102 CB VAL A 51 8.858 -6.394 15.333 1.00 5.00 -ATOM 103 CA PHE A 52 13.418 -5.738 16.712 1.00 5.00 -ATOM 104 CB PHE A 52 12.224 -3.413 18.070 1.00 5.00 -ATOM 105 CA SER A 53 15.341 -8.878 16.069 1.00 5.00 -ATOM 106 CB SER A 53 15.076 -10.022 15.601 1.00 5.00 -ATOM 107 CA TRP A 54 17.730 -6.592 14.108 1.00 5.00 -ATOM 108 CB TRP A 54 15.703 -3.542 13.375 1.00 5.00 -ATOM 109 CA THR A 55 18.556 -4.667 17.280 1.00 5.00 -ATOM 110 CB THR A 55 17.897 -3.690 18.061 1.00 5.00 -ATOM 111 CA ARG A 56 19.312 -7.908 19.174 1.00 5.00 -ATOM 112 CB ARG A 56 17.335 -9.463 21.335 1.00 5.00 -ATOM 113 CA TYR A 57 22.341 -8.589 16.754 1.00 5.00 -ATOM 114 CB TYR A 57 19.866 -9.827 14.754 1.00 5.00 -ATOM 115 CA CYS A 58 24.957 -5.852 17.500 1.00 5.00 -ATOM 116 CB CYS A 58 24.769 -5.644 16.145 1.00 5.00 -ATOM 117 CA THR A 59 25.649 -2.510 19.172 1.00 5.00 -ATOM 118 CB THR A 59 26.352 -2.813 20.450 1.00 5.00 -ATOM 119 CA PRO A 60 24.997 0.980 17.688 1.00 5.00 -ATOM 120 CB PRO A 60 24.209 1.216 18.838 1.00 5.00 -ATOM 121 CA ASP A 61 28.700 1.654 17.753 1.00 5.00 -ATOM 122 CB ASP A 61 29.014 1.764 19.706 1.00 5.00 -ATOM 123 CA GLU A 62 29.673 -1.634 15.782 1.00 5.00 -ATOM 124 CB GLU A 62 30.016 -4.115 15.952 1.00 5.00 -ATOM 125 CA VAL A 63 27.006 -1.066 13.117 1.00 5.00 -ATOM 126 CB VAL A 63 25.714 -0.650 13.775 1.00 5.00 -ATOM 127 CA ARG A 64 29.178 -1.274 10.056 1.00 5.00 -ATOM 128 CB ARG A 64 32.299 -2.806 10.723 1.00 5.00 -ATOM 129 CA VAL A 65 27.088 -1.494 6.741 1.00 5.00 -ATOM 130 CB VAL A 65 27.555 -2.069 5.481 1.00 5.00 -ATOM 131 CA VAL A 66 23.441 -0.610 6.994 1.00 5.00 -ATOM 132 CB VAL A 66 22.878 0.362 7.889 1.00 5.00 -ATOM 133 CA ILE A 67 21.117 -2.560 4.469 1.00 5.00 -ATOM 134 CB ILE A 67 22.152 -3.533 3.155 1.00 5.00 -ATOM 135 CA ILE A 68 17.356 -1.245 3.649 1.00 5.00 -ATOM 136 CB ILE A 68 17.140 0.612 3.222 1.00 5.00 -ATOM 137 CA GLY A 69 14.249 -3.257 2.875 1.00 5.00 -ATOM 138 CA GLN A 70 10.928 -1.985 1.919 1.00 5.00 -ATOM 139 CB GLN A 70 12.385 -1.967 -0.177 1.00 5.00 -ATOM 140 CA ASP A 71 8.301 -4.500 3.398 1.00 5.00 -ATOM 141 CB ASP A 71 6.749 -4.784 2.114 1.00 5.00 -ATOM 142 CA PRO A 72 8.738 -7.500 5.898 1.00 5.00 -ATOM 143 CB PRO A 72 8.252 -6.940 7.052 1.00 5.00 -ATOM 144 CA TYR A 73 8.024 -10.606 3.768 1.00 5.00 -ATOM 145 CB TYR A 73 10.878 -10.763 2.008 1.00 5.00 -ATOM 146 CA HIS A 74 4.336 -11.288 3.459 1.00 5.00 -ATOM 147 CB HIS A 74 5.081 -10.207 1.050 1.00 5.00 -ATOM 148 CA HIS A 75 4.264 -15.123 3.548 1.00 5.00 -ATOM 149 CB HIS A 75 6.734 -14.743 2.392 1.00 5.00 -ATOM 150 CA PRO A 76 4.299 -17.134 6.731 1.00 5.00 -ATOM 151 CB PRO A 76 3.222 -17.796 6.031 1.00 5.00 -ATOM 152 CA GLY A 77 7.941 -18.544 7.495 1.00 5.00 -ATOM 153 CA GLN A 78 10.340 -16.223 5.496 1.00 5.00 -ATOM 154 CB GLN A 78 9.989 -17.122 2.964 1.00 5.00 -ATOM 155 CA ALA A 79 10.479 -13.416 8.146 1.00 5.00 -ATOM 156 CB ALA A 79 9.803 -13.269 8.630 1.00 5.00 -ATOM 157 CA HIS A 80 12.743 -13.359 10.907 1.00 5.00 -ATOM 158 CB HIS A 80 15.473 -13.323 10.601 1.00 5.00 -ATOM 159 CA GLY A 81 12.574 -9.731 11.289 1.00 5.00 -ATOM 160 CA LEU A 82 15.332 -8.556 9.081 1.00 5.00 -ATOM 161 CB LEU A 82 17.316 -8.580 9.908 1.00 5.00 -ATOM 162 CA ALA A 83 14.957 -7.288 5.496 1.00 5.00 -ATOM 163 CB ALA A 83 14.390 -6.909 5.165 1.00 5.00 -ATOM 164 CA PHE A 84 16.272 -9.765 2.808 1.00 5.00 -ATOM 165 CB PHE A 84 17.915 -7.320 1.722 1.00 5.00 -ATOM 166 CA SER A 85 16.927 -12.674 5.077 1.00 5.00 -ATOM 167 CB SER A 85 17.585 -11.883 6.053 1.00 5.00 -ATOM 168 CA VAL A 86 15.138 -16.065 5.690 1.00 5.00 -ATOM 169 CB VAL A 86 15.582 -16.374 4.256 1.00 5.00 -ATOM 170 CA ARG A 87 14.841 -18.511 8.655 1.00 5.00 -ATOM 171 CB ARG A 87 12.273 -16.801 10.111 1.00 5.00 -ATOM 172 CA ALA A 88 17.164 -21.306 7.518 1.00 5.00 -ATOM 173 CB ALA A 88 17.427 -21.916 8.006 1.00 5.00 -ATOM 174 CA ASN A 89 14.443 -23.777 6.758 1.00 5.00 -ATOM 175 CB ASN A 89 13.488 -23.796 8.554 1.00 5.00 -ATOM 176 CA VAL A 90 13.378 -22.216 3.468 1.00 5.00 -ATOM 177 CB VAL A 90 12.332 -21.473 4.313 1.00 5.00 -ATOM 178 CA PRO A 91 14.532 -21.690 -0.174 1.00 5.00 -ATOM 179 CB PRO A 91 13.180 -21.375 -0.275 1.00 5.00 -ATOM 180 CA PRO A 92 15.818 -18.238 -0.896 1.00 5.00 -ATOM 181 CB PRO A 92 16.725 -19.069 -1.638 1.00 5.00 -ATOM 182 CA PRO A 93 13.338 -16.008 -2.404 1.00 5.00 -ATOM 183 CB PRO A 93 13.268 -15.630 -1.024 1.00 5.00 -ATOM 184 CA PRO A 94 14.873 -14.832 -5.936 1.00 5.00 -ATOM 185 CB PRO A 94 13.619 -15.300 -6.288 1.00 5.00 -ATOM 186 CA SER A 95 15.848 -11.289 -4.514 1.00 5.00 -ATOM 187 CB SER A 95 15.213 -10.660 -3.523 1.00 5.00 -ATOM 188 CA LEU A 96 17.692 -13.210 -1.905 1.00 5.00 -ATOM 189 CB LEU A 96 18.178 -12.903 0.030 1.00 5.00 -ATOM 190 CA ARG A 97 19.399 -15.558 -4.226 1.00 5.00 -ATOM 191 CB ARG A 97 20.132 -17.928 -6.754 1.00 5.00 -ATOM 192 CA ASN A 98 20.432 -12.308 -6.182 1.00 5.00 -ATOM 193 CB ASN A 98 18.995 -11.192 -6.833 1.00 5.00 -ATOM 194 CA VAL A 99 22.091 -10.849 -3.043 1.00 5.00 -ATOM 195 CB VAL A 99 21.955 -10.361 -1.658 1.00 5.00 -ATOM 196 CA LEU A 100 23.628 -14.400 -2.384 1.00 5.00 -ATOM 197 CB LEU A 100 22.236 -15.599 -1.340 1.00 5.00 -ATOM 198 CA ALA A 101 24.957 -14.880 -5.927 1.00 5.00 -ATOM 199 CB ALA A 101 24.668 -14.478 -6.441 1.00 5.00 -ATOM 200 CA ALA A 102 26.235 -11.452 -6.052 1.00 5.00 -ATOM 201 CB ALA A 102 25.755 -10.857 -6.125 1.00 5.00 -ATOM 202 CA VAL A 103 28.601 -12.275 -3.307 1.00 5.00 -ATOM 203 CB VAL A 103 27.386 -12.167 -2.438 1.00 5.00 -ATOM 204 CA LYS A 104 29.443 -15.576 -5.244 1.00 5.00 -ATOM 205 CB LYS A 104 27.273 -17.453 -6.442 1.00 5.00 -ATOM 206 CA ASN A 105 30.716 -13.307 -8.146 1.00 5.00 -ATOM 207 CB ASN A 105 29.563 -11.888 -9.032 1.00 5.00 -ATOM 208 CA CYS A 106 32.894 -11.179 -5.808 1.00 5.00 -ATOM 209 CB CYS A 106 31.849 -10.229 -5.700 1.00 5.00 -ATOM 210 CA TYR A 107 33.881 -13.685 -3.285 1.00 5.00 -ATOM 211 CB TYR A 107 31.583 -13.776 -0.942 1.00 5.00 -ATOM 212 CA PRO A 108 35.153 -17.025 -4.733 1.00 5.00 -ATOM 213 CB PRO A 108 35.632 -16.118 -5.723 1.00 5.00 -ATOM 214 CA GLU A 109 37.384 -18.012 -1.938 1.00 5.00 -ATOM 215 CB GLU A 109 39.022 -16.632 -3.002 1.00 5.00 -ATOM 216 CA ALA A 110 34.286 -17.745 0.591 1.00 5.00 -ATOM 217 CB ALA A 110 33.863 -17.117 0.741 1.00 5.00 -ATOM 218 CA ARG A 111 32.847 -21.098 1.427 1.00 5.00 -ATOM 219 CB ARG A 111 32.551 -19.996 4.396 1.00 5.00 -ATOM 220 CA MET A 112 29.175 -20.234 0.655 1.00 5.00 -ATOM 221 CB MET A 112 28.105 -20.213 -1.612 1.00 5.00 -ATOM 222 CA SER A 113 26.740 -22.646 2.483 1.00 5.00 -ATOM 223 CB SER A 113 25.768 -21.809 2.842 1.00 5.00 -ATOM 224 CA GLY A 114 23.614 -22.462 0.183 1.00 5.00 -ATOM 225 CA HIS A 115 21.023 -20.883 2.485 1.00 5.00 -ATOM 226 CB HIS A 115 20.406 -23.528 2.912 1.00 5.00 -ATOM 227 CA GLY A 116 19.605 -17.520 3.231 1.00 5.00 -ATOM 228 CA CYS A 117 19.807 -16.819 7.064 1.00 5.00 -ATOM 229 CB CYS A 117 18.785 -16.885 8.030 1.00 5.00 -ATOM 230 CA LEU A 118 21.471 -13.500 7.569 1.00 5.00 -ATOM 231 CB LEU A 118 21.462 -13.000 5.847 1.00 5.00 -ATOM 232 CA GLU A 119 21.843 -13.636 11.324 1.00 5.00 -ATOM 233 CB GLU A 119 20.904 -15.143 12.637 1.00 5.00 -ATOM 234 CA LYS A 120 25.639 -14.201 10.662 1.00 5.00 -ATOM 235 CB LYS A 120 26.575 -16.192 9.306 1.00 5.00 -ATOM 236 CA TRP A 121 26.176 -11.302 8.339 1.00 5.00 -ATOM 237 CB TRP A 121 25.469 -10.380 5.261 1.00 5.00 -ATOM 238 CA ALA A 122 24.216 -9.634 11.349 1.00 5.00 -ATOM 239 CB ALA A 122 23.468 -9.683 11.415 1.00 5.00 -ATOM 240 CA ARG A 123 26.632 -10.854 14.220 1.00 5.00 -ATOM 241 CB ARG A 123 24.464 -11.196 17.665 1.00 5.00 -ATOM 242 CA ASP A 124 29.496 -9.346 12.239 1.00 5.00 -ATOM 243 CB ASP A 124 30.701 -10.087 10.877 1.00 5.00 -ATOM 244 CA GLY A 125 27.766 -5.902 11.531 1.00 5.00 -ATOM 245 CA VAL A 126 25.506 -5.231 8.573 1.00 5.00 -ATOM 246 CB VAL A 126 25.751 -5.857 7.306 1.00 5.00 -ATOM 247 CA LEU A 127 22.255 -3.989 10.014 1.00 5.00 -ATOM 248 CB LEU A 127 21.447 -2.835 11.603 1.00 5.00 -ATOM 249 CA LEU A 128 19.424 -4.959 7.627 1.00 5.00 -ATOM 250 CB LEU A 128 20.220 -6.759 6.760 1.00 5.00 -ATOM 251 CA LEU A 129 16.787 -2.227 8.268 1.00 5.00 -ATOM 252 CB LEU A 129 17.550 -0.690 9.279 1.00 5.00 -ATOM 253 CA ASN A 130 13.233 -2.752 7.173 1.00 5.00 -ATOM 254 CB ASN A 130 13.170 -3.522 9.000 1.00 5.00 -ATOM 255 CA THR A 131 11.619 0.471 6.081 1.00 5.00 -ATOM 256 CB THR A 131 12.468 1.525 5.373 1.00 5.00 -ATOM 257 CA THR A 132 8.123 -1.159 7.002 1.00 5.00 -ATOM 258 CB THR A 132 7.183 -1.428 5.830 1.00 5.00 -ATOM 259 CA LEU A 133 8.338 -3.546 9.980 1.00 5.00 -ATOM 260 CB LEU A 133 9.346 -3.027 11.884 1.00 5.00 -ATOM 261 CA THR A 134 4.974 -5.051 9.884 1.00 5.00 -ATOM 262 CB THR A 134 4.553 -4.791 11.354 1.00 5.00 -ATOM 263 CA VAL A 135 2.850 -6.829 7.395 1.00 5.00 -ATOM 264 CB VAL A 135 3.082 -6.945 5.899 1.00 5.00 -ATOM 265 CA LYS A 136 -0.701 -8.684 7.134 1.00 5.00 -ATOM 266 CB LYS A 136 -3.290 -7.988 6.128 1.00 5.00 -ATOM 267 CA ARG A 137 -0.411 -12.467 6.333 1.00 5.00 -ATOM 268 CB ARG A 137 1.064 -14.531 8.614 1.00 5.00 -ATOM 269 CA GLY A 138 -0.586 -12.367 2.737 1.00 5.00 -ATOM 270 CA ALA A 139 -0.709 -8.506 2.366 1.00 5.00 -ATOM 271 CB ALA A 139 -0.917 -8.109 3.011 1.00 5.00 -ATOM 272 CA ALA A 140 1.769 -6.767 0.339 1.00 5.00 -ATOM 273 CB ALA A 140 1.745 -6.768 -0.445 1.00 5.00 -ATOM 274 CA ALA A 141 2.546 -3.709 2.262 1.00 5.00 -ATOM 275 CB ALA A 141 2.917 -3.225 1.892 1.00 5.00 -ATOM 276 CA SER A 142 -0.871 -3.207 4.211 1.00 5.00 -ATOM 277 CB SER A 142 -1.104 -3.906 5.320 1.00 5.00 -ATOM 278 CA HIS A 143 1.020 -1.488 7.120 1.00 5.00 -ATOM 279 CB HIS A 143 1.148 -2.352 9.562 1.00 5.00 -ATOM 280 CA SER A 144 2.939 1.167 5.400 1.00 5.00 -ATOM 281 CB SER A 144 3.189 1.504 4.205 1.00 5.00 -ATOM 282 CA ARG A 145 0.067 3.625 6.196 1.00 5.00 -ATOM 283 CB ARG A 145 -2.266 3.364 3.854 1.00 5.00 -ATOM 284 CA ILE A 146 1.030 3.443 9.810 1.00 5.00 -ATOM 285 CB ILE A 146 1.586 1.924 10.927 1.00 5.00 -ATOM 286 CA GLY A 147 4.698 5.036 10.132 1.00 5.00 -ATOM 287 CA TRP A 148 7.138 2.309 10.593 1.00 5.00 -ATOM 288 CB TRP A 148 6.564 -0.176 13.417 1.00 5.00 -ATOM 289 CA ASP A 149 9.004 4.297 7.938 1.00 5.00 -ATOM 290 CB ASP A 149 7.022 4.326 7.781 1.00 5.00 -ATOM 291 CA ARG A 150 9.014 7.611 10.056 1.00 5.00 -ATOM 292 CB ARG A 150 7.093 8.667 12.645 1.00 5.00 -ATOM 293 CA PHE A 151 10.214 5.837 13.393 1.00 5.00 -ATOM 294 CB PHE A 151 9.841 3.141 14.628 1.00 5.00 -ATOM 295 CA VAL A 152 12.632 3.872 10.904 1.00 5.00 -ATOM 296 CB VAL A 152 12.195 2.566 10.383 1.00 5.00 -ATOM 297 CA GLY A 153 13.573 7.365 9.374 1.00 5.00 -ATOM 298 CA GLY A 154 14.171 9.007 12.850 1.00 5.00 -ATOM 299 CA VAL A 155 16.350 5.976 14.392 1.00 5.00 -ATOM 300 CB VAL A 155 16.028 5.013 15.483 1.00 5.00 -ATOM 301 CA ILE A 156 18.543 5.636 11.265 1.00 5.00 -ATOM 302 CB ILE A 156 18.058 4.860 9.811 1.00 5.00 -ATOM 303 CA ARG A 157 19.163 9.460 11.244 1.00 5.00 -ATOM 304 CB ARG A 157 19.464 12.195 11.743 1.00 5.00 -ATOM 305 CA ARG A 158 20.221 9.305 14.780 1.00 5.00 -ATOM 306 CB ARG A 158 17.450 10.285 16.464 1.00 5.00 -ATOM 307 CA LEU A 159 22.411 6.432 13.544 1.00 5.00 -ATOM 308 CB LEU A 159 22.531 4.421 13.103 1.00 5.00 -ATOM 309 CA ALA A 160 24.037 8.289 10.663 1.00 5.00 -ATOM 310 CB ALA A 160 23.435 8.577 10.375 1.00 5.00 -ATOM 311 CA ALA A 161 24.498 11.255 13.127 1.00 5.00 -ATOM 312 CB ALA A 161 23.662 11.366 13.221 1.00 5.00 -ATOM 313 CA ARG A 162 26.141 9.038 15.833 1.00 5.00 -ATOM 314 CB ARG A 162 25.454 6.717 18.072 1.00 5.00 -ATOM 315 CA ARG A 163 28.488 6.949 13.751 1.00 5.00 -ATOM 316 CB ARG A 163 29.285 3.688 14.434 1.00 5.00 -ATOM 317 CA PRO A 164 30.154 9.075 11.049 1.00 5.00 -ATOM 318 CB PRO A 164 30.564 9.641 12.276 1.00 5.00 -ATOM 319 CA GLY A 165 31.559 6.144 8.633 1.00 5.00 -ATOM 320 CA LEU A 166 28.804 3.704 7.790 1.00 5.00 -ATOM 321 CB LEU A 166 27.284 3.007 9.132 1.00 5.00 -ATOM 322 CA VAL A 167 28.899 1.894 4.320 1.00 5.00 -ATOM 323 CB VAL A 167 30.283 1.419 3.891 1.00 5.00 -ATOM 324 CA PHE A 168 25.130 2.163 3.580 1.00 5.00 -ATOM 325 CB PHE A 168 22.644 3.410 4.393 1.00 5.00 -ATOM 326 CA MET A 169 23.971 -0.212 0.761 1.00 5.00 -ATOM 327 CB MET A 169 24.659 -1.953 -0.919 1.00 5.00 -ATOM 328 CA LEU A 170 20.811 1.627 -0.342 1.00 5.00 -ATOM 329 CB LEU A 170 20.680 3.662 0.136 1.00 5.00 -ATOM 330 CA TRP A 171 19.000 -0.709 -2.842 1.00 5.00 -ATOM 331 CB TRP A 171 20.759 -3.505 -2.385 1.00 5.00 -ATOM 332 CA GLY A 172 16.428 1.027 -5.239 1.00 5.00 -ATOM 333 CA THR A 173 15.119 4.304 -6.380 1.00 5.00 -ATOM 334 CB THR A 173 15.397 4.605 -7.812 1.00 5.00 -ATOM 335 CA HIS A 174 12.610 4.030 -3.441 1.00 5.00 -ATOM 336 CB HIS A 174 10.519 2.988 -4.942 1.00 5.00 -ATOM 337 CA ALA A 175 15.463 3.051 -1.465 1.00 5.00 -ATOM 338 CB ALA A 175 15.927 2.467 -1.421 1.00 5.00 -ATOM 339 CA GLN A 176 17.989 5.658 -1.931 1.00 5.00 -ATOM 340 CB GLN A 176 18.337 5.482 -4.388 1.00 5.00 -ATOM 341 CA ASN A 177 15.132 8.214 -1.798 1.00 5.00 -ATOM 342 CB ASN A 177 14.674 7.788 -3.685 1.00 5.00 -ATOM 343 CA ALA A 178 14.031 6.879 1.679 1.00 5.00 -ATOM 344 CB ALA A 178 13.518 6.515 1.947 1.00 5.00 -ATOM 345 CA ILE A 179 17.630 7.181 3.236 1.00 5.00 -ATOM 346 CB ILE A 179 17.662 7.395 4.807 1.00 5.00 -ATOM 347 CA ARG A 180 19.869 10.050 2.215 1.00 5.00 -ATOM 348 CB ARG A 180 18.954 9.591 -1.058 1.00 5.00 -ATOM 349 CA PRO A 181 22.873 10.054 4.542 1.00 5.00 -ATOM 350 CB PRO A 181 23.303 8.847 3.901 1.00 5.00 -ATOM 351 CA ASP A 182 25.257 12.886 4.467 1.00 5.00 -ATOM 352 CB ASP A 182 25.350 14.234 6.127 1.00 5.00 -ATOM 353 CA PRO A 183 27.470 12.039 1.333 1.00 5.00 -ATOM 354 CB PRO A 183 26.637 13.109 0.874 1.00 5.00 -ATOM 355 CA ARG A 184 30.844 13.501 2.451 1.00 5.00 -ATOM 356 CB ARG A 184 29.775 15.642 4.756 1.00 5.00 -ATOM 357 CA VAL A 185 30.489 11.417 5.809 1.00 5.00 -ATOM 358 CB VAL A 185 30.512 12.063 7.218 1.00 5.00 -ATOM 359 CA HIS A 186 29.175 7.779 4.507 1.00 5.00 -ATOM 360 CB HIS A 186 28.032 7.543 6.917 1.00 5.00 -ATOM 361 CA CYS A 187 30.080 5.403 1.720 1.00 5.00 -ATOM 362 CB CYS A 187 31.310 5.285 0.945 1.00 5.00 -ATOM 363 CA VAL A 188 26.563 5.561 0.259 1.00 5.00 -ATOM 364 CB VAL A 188 26.001 6.776 -0.337 1.00 5.00 -ATOM 365 CA LEU A 189 26.545 2.734 -2.457 1.00 5.00 -ATOM 366 CB LEU A 189 27.678 1.309 -1.529 1.00 5.00 -ATOM 367 CA LYS A 190 23.470 2.682 -4.720 1.00 5.00 -ATOM 368 CB LYS A 190 22.265 5.411 -5.499 1.00 5.00 -ATOM 369 CA PHE A 191 22.161 -0.265 -6.658 1.00 5.00 -ATOM 370 CB PHE A 191 21.548 -3.239 -6.484 1.00 5.00 -ATOM 371 CA SER A 192 19.524 -1.146 -8.796 1.00 5.00 -ATOM 372 CB SER A 192 19.781 -1.043 -10.088 1.00 5.00 -ATOM 373 CA HIS A 193 17.024 -3.309 -6.695 1.00 5.00 -ATOM 374 CB HIS A 193 14.564 -2.517 -6.375 1.00 5.00 -ATOM 375 CA PRO A 194 17.484 -6.977 -6.192 1.00 5.00 -ATOM 376 CB PRO A 194 17.728 -6.795 -4.873 1.00 5.00 -ATOM 377 CA SER A 195 14.468 -8.189 -8.153 1.00 5.00 -ATOM 378 CB SER A 195 13.412 -7.387 -8.365 1.00 5.00 -ATOM 379 CA PRO A 196 14.505 -10.046 -11.121 1.00 5.00 -ATOM 380 CB PRO A 196 14.089 -11.002 -10.154 1.00 5.00 -ATOM 381 CA LEU A 197 13.330 -7.331 -13.452 1.00 5.00 -ATOM 382 CB LEU A 197 11.441 -6.970 -14.030 1.00 5.00 -ATOM 383 CA SER A 198 15.385 -4.235 -12.856 1.00 5.00 -ATOM 384 CB SER A 198 16.293 -3.695 -12.159 1.00 5.00 -ATOM 385 CA LYS A 199 17.252 -4.082 -16.039 1.00 5.00 -ATOM 386 CB LYS A 199 17.401 -1.447 -17.938 1.00 5.00 -ATOM 387 CA VAL A 200 20.759 -4.916 -14.617 1.00 5.00 -ATOM 388 CB VAL A 200 21.652 -4.573 -13.482 1.00 5.00 -ATOM 389 CA PRO A 201 21.793 -8.462 -13.713 1.00 5.00 -ATOM 390 CB PRO A 201 22.822 -8.569 -14.747 1.00 5.00 -ATOM 391 CA PHE A 202 21.703 -8.099 -9.995 1.00 5.00 -ATOM 392 CB PHE A 202 18.875 -7.440 -10.248 1.00 5.00 -ATOM 393 CA GLY A 203 24.996 -10.141 -9.844 1.00 5.00 -ATOM 394 CA THR A 204 27.673 -7.809 -10.671 1.00 5.00 -ATOM 395 CB THR A 204 28.322 -7.656 -12.046 1.00 5.00 -ATOM 396 CA CYS A 205 26.793 -5.504 -7.696 1.00 5.00 -ATOM 397 CB CYS A 205 26.033 -5.980 -6.707 1.00 5.00 -ATOM 398 CA GLN A 206 30.347 -5.663 -5.880 1.00 5.00 -ATOM 399 CB GLN A 206 32.399 -4.838 -6.722 1.00 5.00 -ATOM 400 CA HIS A 207 28.720 -2.947 -3.271 1.00 5.00 -ATOM 401 CB HIS A 207 27.128 -1.956 -5.348 1.00 5.00 -ATOM 402 CA PHE A 208 30.090 -5.490 -0.639 1.00 5.00 -ATOM 403 CB PHE A 208 27.811 -7.042 -1.567 1.00 5.00 -ATOM 404 CA LEU A 209 33.659 -5.541 -2.068 1.00 5.00 -ATOM 405 CB LEU A 209 34.963 -6.903 -3.036 1.00 5.00 -ATOM 406 CA VAL A 210 33.714 -1.773 -2.429 1.00 5.00 -ATOM 407 CB VAL A 210 32.517 -1.392 -3.286 1.00 5.00 -ATOM 408 CA ALA A 211 32.326 -1.695 1.131 1.00 5.00 -ATOM 409 CB ALA A 211 31.769 -2.184 1.018 1.00 5.00 -ATOM 410 CA ASN A 212 35.499 -3.468 2.268 1.00 5.00 -ATOM 411 CB ASN A 212 34.636 -4.952 3.193 1.00 5.00 -ATOM 412 CA ARG A 213 37.790 -1.693 0.141 1.00 5.00 -ATOM 413 CB ARG A 213 39.991 -3.276 -1.722 1.00 5.00 -ATOM 414 CA TYR A 214 36.665 1.330 2.295 1.00 5.00 -ATOM 415 CB TYR A 214 34.650 3.560 3.791 1.00 5.00 -ATOM 416 CA LEU A 215 36.127 -0.323 5.584 1.00 5.00 -ATOM 417 CB LEU A 215 34.667 -1.408 6.458 1.00 5.00 -ATOM 418 CA GLU A 216 39.920 -0.877 5.616 1.00 5.00 -ATOM 419 CB GLU A 216 40.202 -2.898 4.088 1.00 5.00 -ATOM 420 CA THR A 217 40.299 2.979 4.459 1.00 5.00 -ATOM 421 CB THR A 217 39.338 3.917 4.063 1.00 5.00 -ATOM 422 CA ARG A 218 39.437 3.769 7.972 1.00 5.00 -ATOM 423 CB ARG A 218 35.801 2.880 8.009 1.00 5.00 -ATOM 424 CA SER A 219 40.842 0.420 9.247 1.00 5.00 -ATOM 425 CB SER A 219 41.585 0.371 10.244 1.00 5.00 -ATOM 426 CA ILE A 220 37.577 -1.126 10.534 1.00 5.00 -ATOM 427 CB ILE A 220 36.405 -1.106 12.051 1.00 5.00 -ATOM 428 CA SER A 221 38.054 -4.910 9.157 1.00 5.00 -ATOM 429 CB SER A 221 37.293 -5.792 9.862 1.00 5.00 -ATOM 430 CA PRO A 222 36.225 -5.792 6.032 1.00 5.00 -ATOM 431 CB PRO A 222 37.381 -6.588 5.791 1.00 5.00 -ATOM 432 CA ILE A 223 33.230 -8.176 6.537 1.00 5.00 -ATOM 433 CB ILE A 223 32.049 -6.857 7.149 1.00 5.00 -ATOM 434 CA ASP A 224 33.063 -11.973 5.937 1.00 5.00 -ATOM 435 CB ASP A 224 32.530 -13.095 7.441 1.00 5.00 -ATOM 436 CA TRP A 225 29.797 -11.994 4.003 1.00 5.00 -ATOM 437 CB TRP A 225 30.231 -8.807 3.435 1.00 5.00 -ATOM 438 CA SER A 226 30.526 -15.599 3.101 1.00 5.00 -ATOM 439 CB SER A 226 31.454 -15.595 4.163 1.00 5.00 -ATOM 440 CA VAL A 227 27.181 -17.045 4.303 1.00 5.00 -ATOM 441 CB VAL A 227 26.142 -16.103 3.751 1.00 5.00 +REMARK CLUSTER 4 FREE ENERGY -1.39726E+01 AVE RMSD 0.00 +REMARK clustering ENERGY -1.13297E+01 RMS 0.00 +ATOM 1 CA ASP A 1 -1.867 22.368 16.949 1.00 5.00 +ATOM 2 CB ASP A 1 -1.089 21.030 15.592 1.00 5.00 +ATOM 3 CA TRP A 2 1.570 21.414 18.723 1.00 5.00 +ATOM 4 CB TRP A 2 2.746 23.100 15.891 1.00 5.00 +ATOM 5 CA THR A 3 0.046 20.777 22.178 1.00 5.00 +ATOM 6 CB THR A 3 -1.120 21.577 22.340 1.00 5.00 +ATOM 7 CA THR A 4 -2.603 18.418 20.509 1.00 5.00 +ATOM 8 CB THR A 4 -3.407 18.994 19.458 1.00 5.00 +ATOM 9 CA PHE A 5 -0.190 16.403 18.334 1.00 5.00 +ATOM 10 CB PHE A 5 2.526 15.685 16.938 1.00 5.00 +ATOM 11 CA ARG A 6 2.158 16.467 21.330 1.00 5.00 +ATOM 12 CB ARG A 6 3.796 17.249 24.415 1.00 5.00 +ATOM 13 CA ARG A 7 -0.401 14.757 23.934 1.00 5.00 +ATOM 14 CB ARG A 7 -3.594 16.237 23.657 1.00 5.00 +ATOM 15 CA VAL A 8 -1.079 12.210 21.231 1.00 5.00 +ATOM 16 CB VAL A 8 -1.997 13.132 20.463 1.00 5.00 +ATOM 17 CA PHE A 9 2.333 11.455 20.361 1.00 5.00 +ATOM 18 CB PHE A 9 3.778 11.274 17.665 1.00 5.00 +ATOM 19 CA LEU A 10 3.740 11.634 23.732 1.00 5.00 +ATOM 20 CB LEU A 10 3.109 9.874 24.773 1.00 5.00 +ATOM 21 CA ILE A 11 6.491 14.100 23.082 1.00 5.00 +ATOM 22 CB ILE A 11 6.399 14.916 21.682 1.00 5.00 +ATOM 23 CA ASP A 12 8.932 15.549 25.428 1.00 5.00 +ATOM 24 CB ASP A 12 9.795 14.015 26.286 1.00 5.00 +ATOM 25 CA ASP A 13 9.651 19.247 25.471 1.00 5.00 +ATOM 26 CB ASP A 13 8.350 19.469 27.049 1.00 5.00 +ATOM 27 CA ALA A 14 13.306 19.636 24.315 1.00 5.00 +ATOM 28 CB ALA A 14 13.960 19.421 24.734 1.00 5.00 +ATOM 29 CA TRP A 15 11.956 18.982 20.877 1.00 5.00 +ATOM 30 CB TRP A 15 13.470 16.443 19.457 1.00 5.00 +ATOM 31 CA ARG A 16 9.385 21.676 20.036 1.00 5.00 +ATOM 32 CB ARG A 16 6.284 20.276 19.191 1.00 5.00 +ATOM 33 CA PRO A 17 11.964 24.065 18.425 1.00 5.00 +ATOM 34 CB PRO A 17 12.638 23.241 19.309 1.00 5.00 +ATOM 35 CA LEU A 18 12.365 21.772 15.519 1.00 5.00 +ATOM 36 CB LEU A 18 14.367 21.910 15.442 1.00 5.00 +ATOM 37 CA MET A 19 9.073 19.817 15.490 1.00 5.00 +ATOM 38 CB MET A 19 9.139 17.993 16.881 1.00 5.00 +ATOM 39 CA GLU A 20 6.201 22.434 15.720 1.00 5.00 +ATOM 40 CB GLU A 20 5.901 23.743 17.705 1.00 5.00 +ATOM 41 CA PRO A 21 7.877 24.317 12.881 1.00 5.00 +ATOM 42 CB PRO A 21 9.010 24.328 13.706 1.00 5.00 +ATOM 43 CA GLU A 22 6.602 21.550 10.747 1.00 5.00 +ATOM 44 CB GLU A 22 8.800 19.949 11.443 1.00 5.00 +ATOM 45 CA LEU A 23 2.886 21.327 11.911 1.00 5.00 +ATOM 46 CB LEU A 23 2.543 19.337 12.351 1.00 5.00 +ATOM 47 CA ALA A 24 2.388 24.239 9.652 1.00 5.00 +ATOM 48 CB ALA A 24 2.873 24.842 9.598 1.00 5.00 +ATOM 49 CA ASN A 25 2.997 22.290 6.371 1.00 5.00 +ATOM 50 CB ASN A 25 4.781 21.634 6.837 1.00 5.00 +ATOM 51 CA PRO A 26 -0.160 20.809 5.007 1.00 5.00 +ATOM 52 CB PRO A 26 -0.161 21.452 3.733 1.00 5.00 +ATOM 53 CA LEU A 27 1.380 17.483 4.109 1.00 5.00 +ATOM 54 CB LEU A 27 1.975 15.711 3.080 1.00 5.00 +ATOM 55 CA THR A 28 2.452 17.293 7.734 1.00 5.00 +ATOM 56 CB THR A 28 3.756 17.338 8.409 1.00 5.00 +ATOM 57 CA ALA A 29 -1.335 17.294 8.877 1.00 5.00 +ATOM 58 CB ALA A 29 -2.011 17.603 8.526 1.00 5.00 +ATOM 59 CA HIS A 30 -1.823 14.806 5.924 1.00 5.00 +ATOM 60 CB HIS A 30 -2.534 16.724 4.079 1.00 5.00 +ATOM 61 CA LEU A 31 0.950 12.748 7.551 1.00 5.00 +ATOM 62 CB LEU A 31 3.048 12.789 7.428 1.00 5.00 +ATOM 63 CA LEU A 32 -0.882 12.459 11.080 1.00 5.00 +ATOM 64 CB LEU A 32 0.101 12.699 12.936 1.00 5.00 +ATOM 65 CA ALA A 33 -4.179 12.515 9.172 1.00 5.00 +ATOM 66 CB ALA A 33 -4.562 12.967 8.641 1.00 5.00 +ATOM 67 CA GLU A 34 -2.935 9.461 6.938 1.00 5.00 +ATOM 68 CB GLU A 34 -1.069 9.467 5.447 1.00 5.00 +ATOM 69 CA TYR A 35 -1.221 8.031 10.101 1.00 5.00 +ATOM 70 CB TYR A 35 1.690 7.901 11.994 1.00 5.00 +ATOM 71 CA ASN A 36 -4.197 7.468 12.449 1.00 5.00 +ATOM 72 CB ASN A 36 -4.975 9.235 12.852 1.00 5.00 +ATOM 73 CA ARG A 37 -6.466 6.712 9.437 1.00 5.00 +ATOM 74 CB ARG A 37 -5.659 9.058 7.039 1.00 5.00 +ATOM 75 CA ARG A 38 -4.260 3.995 8.577 1.00 5.00 +ATOM 76 CB ARG A 38 -1.628 5.567 8.150 1.00 5.00 +ATOM 77 CA CYS A 39 -4.376 2.698 12.274 1.00 5.00 +ATOM 78 CB CYS A 39 -3.414 3.142 13.082 1.00 5.00 +ATOM 79 CA GLN A 40 -7.845 1.761 11.692 1.00 5.00 +ATOM 80 CB GLN A 40 -9.277 3.212 9.819 1.00 5.00 +ATOM 81 CA THR A 41 -7.399 -1.395 9.764 1.00 5.00 +ATOM 82 CB THR A 41 -8.571 -1.154 8.865 1.00 5.00 +ATOM 83 CA GLU A 42 -3.766 -1.947 9.833 1.00 5.00 +ATOM 84 CB GLU A 42 -3.919 -0.220 7.666 1.00 5.00 +ATOM 85 CA GLU A 43 -2.023 -3.076 13.134 1.00 5.00 +ATOM 86 CB GLU A 43 -1.355 -5.075 14.194 1.00 5.00 +ATOM 87 CA VAL A 44 1.099 -0.645 13.406 1.00 5.00 +ATOM 88 CB VAL A 44 1.015 0.789 12.928 1.00 5.00 +ATOM 89 CA LEU A 45 4.304 -1.731 14.544 1.00 5.00 +ATOM 90 CB LEU A 45 5.643 -3.451 14.875 1.00 5.00 +ATOM 91 CA PRO A 46 5.504 1.329 16.350 1.00 5.00 +ATOM 92 CB PRO A 46 5.623 1.768 14.985 1.00 5.00 +ATOM 93 CA PRO A 47 3.710 1.257 19.576 1.00 5.00 +ATOM 94 CB PRO A 47 4.794 0.496 20.071 1.00 5.00 +ATOM 95 CA ARG A 48 2.177 4.705 19.317 1.00 5.00 +ATOM 96 CB ARG A 48 0.659 7.262 18.274 1.00 5.00 +ATOM 97 CA GLU A 49 3.661 6.192 22.409 1.00 5.00 +ATOM 98 CB GLU A 49 4.220 5.076 24.411 1.00 5.00 +ATOM 99 CA ASP A 50 6.821 4.602 21.015 1.00 5.00 +ATOM 100 CB ASP A 50 7.233 3.193 19.612 1.00 5.00 +ATOM 101 CA VAL A 51 6.740 6.326 17.799 1.00 5.00 +ATOM 102 CB VAL A 51 5.630 6.011 16.958 1.00 5.00 +ATOM 103 CA PHE A 52 8.853 9.437 18.891 1.00 5.00 +ATOM 104 CB PHE A 52 8.665 11.680 17.048 1.00 5.00 +ATOM 105 CA SER A 53 10.702 7.544 21.371 1.00 5.00 +ATOM 106 CB SER A 53 10.644 6.299 20.830 1.00 5.00 +ATOM 107 CA TRP A 54 13.891 9.425 20.348 1.00 5.00 +ATOM 108 CB TRP A 54 13.001 10.701 17.444 1.00 5.00 +ATOM 109 CA THR A 55 12.754 12.544 21.980 1.00 5.00 +ATOM 110 CB THR A 55 11.356 12.186 21.896 1.00 5.00 +ATOM 111 CA ARG A 56 12.723 10.913 25.408 1.00 5.00 +ATOM 112 CB ARG A 56 9.209 9.705 24.929 1.00 5.00 +ATOM 113 CA TYR A 57 16.201 9.447 25.621 1.00 5.00 +ATOM 114 CB TYR A 57 16.836 8.760 22.311 1.00 5.00 +ATOM 115 CA CYS A 58 18.076 12.841 25.082 1.00 5.00 +ATOM 116 CB CYS A 58 18.883 12.227 24.076 1.00 5.00 +ATOM 117 CA THR A 59 17.664 16.367 24.059 1.00 5.00 +ATOM 118 CB THR A 59 17.884 16.855 25.301 1.00 5.00 +ATOM 119 CA PRO A 60 18.493 18.360 20.929 1.00 5.00 +ATOM 120 CB PRO A 60 17.446 19.146 21.344 1.00 5.00 +ATOM 121 CA ASP A 61 21.480 20.162 22.548 1.00 5.00 +ATOM 122 CB ASP A 61 21.759 22.259 22.107 1.00 5.00 +ATOM 123 CA GLU A 62 22.564 16.884 24.127 1.00 5.00 +ATOM 124 CB GLU A 62 21.749 14.898 25.316 1.00 5.00 +ATOM 125 CA VAL A 63 23.612 14.955 20.954 1.00 5.00 +ATOM 126 CB VAL A 63 23.282 14.074 19.797 1.00 5.00 +ATOM 127 CA ARG A 64 26.860 14.200 18.749 1.00 5.00 +ATOM 128 CB ARG A 64 28.693 13.157 21.350 1.00 5.00 +ATOM 129 CA VAL A 65 25.927 11.016 16.578 1.00 5.00 +ATOM 130 CB VAL A 65 26.246 9.809 17.382 1.00 5.00 +ATOM 131 CA VAL A 66 22.772 10.817 14.384 1.00 5.00 +ATOM 132 CB VAL A 66 22.075 11.793 13.378 1.00 5.00 +ATOM 133 CA ILE A 67 22.796 7.152 13.213 1.00 5.00 +ATOM 134 CB ILE A 67 23.970 5.736 13.697 1.00 5.00 +ATOM 135 CA ILE A 68 19.743 6.954 10.610 1.00 5.00 +ATOM 136 CB ILE A 68 19.434 7.834 8.873 1.00 5.00 +ATOM 137 CA GLY A 69 17.746 3.877 8.847 1.00 5.00 +ATOM 138 CA GLN A 70 14.707 2.680 6.716 1.00 5.00 +ATOM 139 CB GLN A 70 14.973 1.289 4.801 1.00 5.00 +ATOM 140 CA ASP A 71 11.812 1.469 8.688 1.00 5.00 +ATOM 141 CB ASP A 71 10.078 0.660 8.035 1.00 5.00 +ATOM 142 CA PRO A 72 10.821 0.114 12.210 1.00 5.00 +ATOM 143 CB PRO A 72 9.917 1.210 12.202 1.00 5.00 +ATOM 144 CA TYR A 73 11.249 -3.786 12.213 1.00 5.00 +ATOM 145 CB TYR A 73 14.081 -3.015 13.827 1.00 5.00 +ATOM 146 CA HIS A 74 7.922 -5.622 11.496 1.00 5.00 +ATOM 147 CB HIS A 74 9.030 -6.599 9.277 1.00 5.00 +ATOM 148 CA HIS A 75 7.161 -8.460 13.283 1.00 5.00 +ATOM 149 CB HIS A 75 9.589 -8.956 12.225 1.00 5.00 +ATOM 150 CA PRO A 76 5.290 -8.597 16.709 1.00 5.00 +ATOM 151 CB PRO A 76 4.933 -9.752 15.977 1.00 5.00 +ATOM 152 CA GLY A 77 7.655 -6.481 19.112 1.00 5.00 +ATOM 153 CA GLN A 78 11.144 -6.221 17.705 1.00 5.00 +ATOM 154 CB GLN A 78 12.961 -6.417 16.105 1.00 5.00 +ATOM 155 CA ALA A 79 10.971 -2.313 17.474 1.00 5.00 +ATOM 156 CB ALA A 79 10.761 -2.117 16.703 1.00 5.00 +ATOM 157 CA HIS A 80 10.932 -0.081 20.410 1.00 5.00 +ATOM 158 CB HIS A 80 13.455 0.527 21.324 1.00 5.00 +ATOM 159 CA GLY A 81 11.300 2.923 18.436 1.00 5.00 +ATOM 160 CA LEU A 82 14.952 4.029 17.766 1.00 5.00 +ATOM 161 CB LEU A 82 15.795 4.283 19.535 1.00 5.00 +ATOM 162 CA ALA A 83 16.557 2.732 14.181 1.00 5.00 +ATOM 163 CB ALA A 83 17.036 3.235 13.978 1.00 5.00 +ATOM 164 CA PHE A 84 18.740 -0.348 14.267 1.00 5.00 +ATOM 165 CB PHE A 84 20.737 1.219 12.808 1.00 5.00 +ATOM 166 CA SER A 85 17.960 -0.820 17.990 1.00 5.00 +ATOM 167 CB SER A 85 17.901 -0.004 18.787 1.00 5.00 +ATOM 168 CA VAL A 86 15.605 -3.765 19.302 1.00 5.00 +ATOM 169 CB VAL A 86 16.016 -5.056 18.817 1.00 5.00 +ATOM 170 CA ARG A 87 13.765 -4.258 22.569 1.00 5.00 +ATOM 171 CB ARG A 87 10.752 -3.096 22.400 1.00 5.00 +ATOM 172 CA ALA A 88 16.587 -6.129 24.558 1.00 5.00 +ATOM 173 CB ALA A 88 17.115 -5.998 25.176 1.00 5.00 +ATOM 174 CA ASN A 89 14.264 -9.193 24.471 1.00 5.00 +ATOM 175 CB ASN A 89 12.798 -7.703 24.910 1.00 5.00 +ATOM 176 CA VAL A 90 14.658 -10.405 20.743 1.00 5.00 +ATOM 177 CB VAL A 90 13.928 -9.172 20.557 1.00 5.00 +ATOM 178 CA PRO A 91 17.835 -11.497 18.868 1.00 5.00 +ATOM 179 CB PRO A 91 16.899 -11.849 17.827 1.00 5.00 +ATOM 180 CA PRO A 92 19.687 -8.423 17.343 1.00 5.00 +ATOM 181 CB PRO A 92 20.770 -9.431 17.542 1.00 5.00 +ATOM 182 CA PRO A 93 18.669 -8.205 13.574 1.00 5.00 +ATOM 183 CB PRO A 93 18.104 -6.929 13.907 1.00 5.00 +ATOM 184 CA PRO A 94 21.451 -9.495 10.981 1.00 5.00 +ATOM 185 CB PRO A 94 20.445 -10.405 10.544 1.00 5.00 +ATOM 186 CA SER A 95 22.827 -6.094 10.622 1.00 5.00 +ATOM 187 CB SER A 95 21.733 -5.361 10.376 1.00 5.00 +ATOM 188 CA LEU A 96 22.579 -5.150 14.273 1.00 5.00 +ATOM 189 CB LEU A 96 21.412 -4.132 15.754 1.00 5.00 +ATOM 190 CA ARG A 97 24.834 -8.345 14.925 1.00 5.00 +ATOM 191 CB ARG A 97 23.284 -11.006 13.833 1.00 5.00 +ATOM 192 CA ASN A 98 27.195 -6.426 12.204 1.00 5.00 +ATOM 193 CB ASN A 98 26.334 -5.815 10.496 1.00 5.00 +ATOM 194 CA VAL A 99 26.824 -2.834 13.904 1.00 5.00 +ATOM 195 CB VAL A 99 25.759 -1.791 14.241 1.00 5.00 +ATOM 196 CA LEU A 100 27.400 -4.794 17.180 1.00 5.00 +ATOM 197 CB LEU A 100 25.601 -5.766 17.487 1.00 5.00 +ATOM 198 CA ALA A 101 30.179 -6.661 15.558 1.00 5.00 +ATOM 199 CB ALA A 101 30.719 -7.286 15.577 1.00 5.00 +ATOM 200 CA ALA A 102 31.382 -3.446 14.070 1.00 5.00 +ATOM 201 CB ALA A 102 31.080 -3.502 13.394 1.00 5.00 +ATOM 202 CA VAL A 103 31.430 -2.317 17.671 1.00 5.00 +ATOM 203 CB VAL A 103 30.562 -2.655 18.871 1.00 5.00 +ATOM 204 CA LYS A 104 33.783 -5.437 18.454 1.00 5.00 +ATOM 205 CB LYS A 104 34.993 -6.405 21.005 1.00 5.00 +ATOM 206 CA ASN A 105 36.370 -4.774 15.816 1.00 5.00 +ATOM 207 CB ASN A 105 36.505 -4.289 13.886 1.00 5.00 +ATOM 208 CA CYS A 106 37.069 -0.983 16.852 1.00 5.00 +ATOM 209 CB CYS A 106 36.680 0.092 16.052 1.00 5.00 +ATOM 210 CA TYR A 107 37.156 -0.953 20.358 1.00 5.00 +ATOM 211 CB TYR A 107 34.033 0.094 20.051 1.00 5.00 +ATOM 212 CA PRO A 108 38.664 -4.192 21.278 1.00 5.00 +ATOM 213 CB PRO A 108 39.602 -3.906 20.255 1.00 5.00 +ATOM 214 CA GLU A 109 38.328 -4.187 25.037 1.00 5.00 +ATOM 215 CB GLU A 109 39.246 -2.862 26.786 1.00 5.00 +ATOM 216 CA ALA A 110 34.727 -2.961 24.728 1.00 5.00 +ATOM 217 CB ALA A 110 34.696 -3.275 23.993 1.00 5.00 +ATOM 218 CA ARG A 111 32.545 -5.810 26.348 1.00 5.00 +ATOM 219 CB ARG A 111 32.331 -9.339 26.399 1.00 5.00 +ATOM 220 CA MET A 112 29.137 -6.991 25.384 1.00 5.00 +ATOM 221 CB MET A 112 29.763 -6.736 23.034 1.00 5.00 +ATOM 222 CA SER A 113 26.006 -8.278 26.759 1.00 5.00 +ATOM 223 CB SER A 113 24.932 -7.608 26.318 1.00 5.00 +ATOM 224 CA GLY A 114 25.006 -10.085 23.347 1.00 5.00 +ATOM 225 CA HIS A 115 21.713 -8.349 22.946 1.00 5.00 +ATOM 226 CB HIS A 115 19.373 -9.737 23.209 1.00 5.00 +ATOM 227 CA GLY A 116 20.659 -5.139 21.160 1.00 5.00 +ATOM 228 CA CYS A 117 19.205 -2.532 23.440 1.00 5.00 +ATOM 229 CB CYS A 117 19.753 -3.118 24.641 1.00 5.00 +ATOM 230 CA LEU A 118 20.839 0.630 21.998 1.00 5.00 +ATOM 231 CB LEU A 118 21.947 0.673 20.154 1.00 5.00 +ATOM 232 CA GLU A 119 18.840 2.662 24.614 1.00 5.00 +ATOM 233 CB GLU A 119 16.577 2.906 25.383 1.00 5.00 +ATOM 234 CA LYS A 120 22.092 2.843 26.595 1.00 5.00 +ATOM 235 CB LYS A 120 25.007 2.592 25.724 1.00 5.00 +ATOM 236 CA TRP A 121 23.384 5.056 23.526 1.00 5.00 +ATOM 237 CB TRP A 121 25.646 2.837 21.943 1.00 5.00 +ATOM 238 CA ALA A 122 20.154 6.952 23.620 1.00 5.00 +ATOM 239 CB ALA A 122 19.660 6.480 23.745 1.00 5.00 +ATOM 240 CA ARG A 123 21.173 8.829 26.539 1.00 5.00 +ATOM 241 CB ARG A 123 18.154 7.975 27.513 1.00 5.00 +ATOM 242 CA ASP A 124 24.678 9.200 25.504 1.00 5.00 +ATOM 243 CB ASP A 124 25.045 7.108 25.634 1.00 5.00 +ATOM 244 CA GLY A 125 23.934 11.265 22.429 1.00 5.00 +ATOM 245 CA VAL A 126 22.789 8.784 19.767 1.00 5.00 +ATOM 246 CB VAL A 126 22.365 7.373 20.058 1.00 5.00 +ATOM 247 CA LEU A 127 20.097 10.064 17.419 1.00 5.00 +ATOM 248 CB LEU A 127 19.162 11.873 16.799 1.00 5.00 +ATOM 249 CA LEU A 128 19.535 6.684 15.944 1.00 5.00 +ATOM 250 CB LEU A 128 20.140 5.022 16.305 1.00 5.00 +ATOM 251 CA LEU A 129 16.626 7.740 13.530 1.00 5.00 +ATOM 252 CB LEU A 129 17.364 9.499 12.734 1.00 5.00 +ATOM 253 CA ASN A 130 14.096 5.997 11.543 1.00 5.00 +ATOM 254 CB ASN A 130 13.731 4.123 12.269 1.00 5.00 +ATOM 255 CA THR A 131 13.162 8.288 8.301 1.00 5.00 +ATOM 256 CB THR A 131 14.210 8.037 7.343 1.00 5.00 +ATOM 257 CA THR A 132 10.214 5.741 7.865 1.00 5.00 +ATOM 258 CB THR A 132 10.523 4.613 7.048 1.00 5.00 +ATOM 259 CA LEU A 133 8.684 5.854 11.406 1.00 5.00 +ATOM 260 CB LEU A 133 9.054 6.543 13.227 1.00 5.00 +ATOM 261 CA THR A 134 5.641 3.539 10.718 1.00 5.00 +ATOM 262 CB THR A 134 4.628 4.410 10.321 1.00 5.00 +ATOM 263 CA VAL A 135 5.178 -0.150 9.934 1.00 5.00 +ATOM 264 CB VAL A 135 6.375 -1.087 10.208 1.00 5.00 +ATOM 265 CA LYS A 136 2.144 -2.426 9.031 1.00 5.00 +ATOM 266 CB LYS A 136 0.828 -0.851 6.748 1.00 5.00 +ATOM 267 CA ARG A 137 2.453 -5.438 11.163 1.00 5.00 +ATOM 268 CB ARG A 137 2.575 -6.632 14.421 1.00 5.00 +ATOM 269 CA GLY A 138 3.441 -7.705 8.317 1.00 5.00 +ATOM 270 CA ALA A 139 4.214 -4.805 5.797 1.00 5.00 +ATOM 271 CB ALA A 139 4.079 -3.999 5.672 1.00 5.00 +ATOM 272 CA ALA A 140 7.953 -3.198 5.484 1.00 5.00 +ATOM 273 CB ALA A 140 8.226 -3.915 5.206 1.00 5.00 +ATOM 274 CA ALA A 141 7.905 0.244 3.979 1.00 5.00 +ATOM 275 CB ALA A 141 7.850 0.376 3.240 1.00 5.00 +ATOM 276 CA SER A 142 4.307 0.230 3.624 1.00 5.00 +ATOM 277 CB SER A 142 3.605 0.109 4.769 1.00 5.00 +ATOM 278 CA HIS A 143 4.237 3.678 5.184 1.00 5.00 +ATOM 279 CB HIS A 143 2.331 3.049 7.013 1.00 5.00 +ATOM 280 CA SER A 144 6.994 5.148 3.324 1.00 5.00 +ATOM 281 CB SER A 144 8.160 4.627 3.379 1.00 5.00 +ATOM 282 CA ARG A 145 4.735 6.540 0.893 1.00 5.00 +ATOM 283 CB ARG A 145 3.292 4.632 -1.675 1.00 5.00 +ATOM 284 CA ILE A 146 3.324 8.776 3.641 1.00 5.00 +ATOM 285 CB ILE A 146 4.049 8.295 5.365 1.00 5.00 +ATOM 286 CA GLY A 147 5.751 11.813 3.778 1.00 5.00 +ATOM 287 CA TRP A 148 7.272 10.629 7.118 1.00 5.00 +ATOM 288 CB TRP A 148 6.847 9.974 10.428 1.00 5.00 +ATOM 289 CA ASP A 149 10.693 11.216 5.483 1.00 5.00 +ATOM 290 CB ASP A 149 9.452 10.361 3.943 1.00 5.00 +ATOM 291 CA ARG A 150 9.931 14.780 4.683 1.00 5.00 +ATOM 292 CB ARG A 150 7.106 16.392 3.208 1.00 5.00 +ATOM 293 CA PHE A 151 9.194 15.266 8.561 1.00 5.00 +ATOM 294 CB PHE A 151 7.471 14.282 10.774 1.00 5.00 +ATOM 295 CA VAL A 152 12.325 13.531 9.438 1.00 5.00 +ATOM 296 CB VAL A 152 12.642 12.322 10.188 1.00 5.00 +ATOM 297 CA GLY A 153 14.006 15.727 6.819 1.00 5.00 +ATOM 298 CA GLY A 154 12.671 18.960 8.497 1.00 5.00 +ATOM 299 CA VAL A 155 13.676 17.744 12.005 1.00 5.00 +ATOM 300 CB VAL A 155 12.663 16.768 12.436 1.00 5.00 +ATOM 301 CA ILE A 156 17.205 16.420 10.981 1.00 5.00 +ATOM 302 CB ILE A 156 17.200 14.843 9.975 1.00 5.00 +ATOM 303 CA ARG A 157 17.562 19.840 9.027 1.00 5.00 +ATOM 304 CB ARG A 157 15.393 19.501 6.508 1.00 5.00 +ATOM 305 CA ARG A 158 16.292 21.804 11.965 1.00 5.00 +ATOM 306 CB ARG A 158 14.896 24.602 10.750 1.00 5.00 +ATOM 307 CA LEU A 159 18.813 20.068 14.103 1.00 5.00 +ATOM 308 CB LEU A 159 19.504 18.309 14.942 1.00 5.00 +ATOM 309 CA ALA A 160 21.952 20.017 11.864 1.00 5.00 +ATOM 310 CB ALA A 160 21.703 19.950 11.137 1.00 5.00 +ATOM 311 CA ALA A 161 21.449 23.706 11.292 1.00 5.00 +ATOM 312 CB ALA A 161 20.712 23.894 11.272 1.00 5.00 +ATOM 313 CA ARG A 162 21.106 24.518 15.013 1.00 5.00 +ATOM 314 CB ARG A 162 19.723 27.802 15.952 1.00 5.00 +ATOM 315 CA ARG A 163 23.997 22.223 16.467 1.00 5.00 +ATOM 316 CB ARG A 163 24.700 20.446 19.229 1.00 5.00 +ATOM 317 CA PRO A 164 27.544 22.467 14.608 1.00 5.00 +ATOM 318 CB PRO A 164 27.449 23.884 14.825 1.00 5.00 +ATOM 319 CA GLY A 165 29.467 19.270 15.569 1.00 5.00 +ATOM 320 CA LEU A 166 27.157 16.352 15.031 1.00 5.00 +ATOM 321 CB LEU A 166 25.252 15.668 15.255 1.00 5.00 +ATOM 322 CA VAL A 167 28.681 12.979 13.482 1.00 5.00 +ATOM 323 CB VAL A 167 29.394 12.195 14.495 1.00 5.00 +ATOM 324 CA PHE A 168 26.335 11.681 10.538 1.00 5.00 +ATOM 325 CB PHE A 168 24.833 14.162 10.280 1.00 5.00 +ATOM 326 CA MET A 169 26.868 7.953 10.287 1.00 5.00 +ATOM 327 CB MET A 169 28.217 7.248 12.177 1.00 5.00 +ATOM 328 CA LEU A 170 24.878 7.327 6.979 1.00 5.00 +ATOM 329 CB LEU A 170 23.740 8.431 5.658 1.00 5.00 +ATOM 330 CA TRP A 171 24.748 3.773 5.887 1.00 5.00 +ATOM 331 CB TRP A 171 26.294 2.747 8.599 1.00 5.00 +ATOM 332 CA GLY A 172 23.938 3.331 2.232 1.00 5.00 +ATOM 333 CA THR A 173 22.831 4.802 -0.899 1.00 5.00 +ATOM 334 CB THR A 173 23.416 4.150 -2.136 1.00 5.00 +ATOM 335 CA HIS A 174 19.182 4.566 0.477 1.00 5.00 +ATOM 336 CB HIS A 174 16.558 3.948 0.251 1.00 5.00 +ATOM 337 CA ALA A 175 20.393 6.353 3.512 1.00 5.00 +ATOM 338 CB ALA A 175 20.638 5.790 3.943 1.00 5.00 +ATOM 339 CA GLN A 176 22.728 8.635 1.573 1.00 5.00 +ATOM 340 CB GLN A 176 24.844 7.410 1.356 1.00 5.00 +ATOM 341 CA ASN A 177 20.442 9.877 -0.901 1.00 5.00 +ATOM 342 CB ASN A 177 20.274 8.605 -2.370 1.00 5.00 +ATOM 343 CA ALA A 178 18.185 10.886 1.901 1.00 5.00 +ATOM 344 CB ALA A 178 17.729 10.335 2.101 1.00 5.00 +ATOM 345 CA ILE A 179 20.022 13.531 3.924 1.00 5.00 +ATOM 346 CB ILE A 179 20.489 12.775 5.596 1.00 5.00 +ATOM 347 CA ARG A 180 23.047 15.513 2.646 1.00 5.00 +ATOM 348 CB ARG A 180 23.209 14.462 -0.519 1.00 5.00 +ATOM 349 CA PRO A 181 24.308 17.745 5.626 1.00 5.00 +ATOM 350 CB PRO A 181 25.098 16.733 6.074 1.00 5.00 +ATOM 351 CA ASP A 182 26.939 20.232 5.230 1.00 5.00 +ATOM 352 CB ASP A 182 27.418 22.183 4.862 1.00 5.00 +ATOM 353 CA PRO A 183 30.248 18.308 4.947 1.00 5.00 +ATOM 354 CB PRO A 183 29.796 17.960 3.634 1.00 5.00 +ATOM 355 CA ARG A 184 31.925 21.568 6.123 1.00 5.00 +ATOM 356 CB ARG A 184 32.700 24.648 4.582 1.00 5.00 +ATOM 357 CA VAL A 185 29.948 21.790 9.113 1.00 5.00 +ATOM 358 CB VAL A 185 28.978 22.587 9.807 1.00 5.00 +ATOM 359 CA HIS A 186 29.877 18.260 10.336 1.00 5.00 +ATOM 360 CB HIS A 186 27.517 19.020 11.762 1.00 5.00 +ATOM 361 CA CYS A 187 31.608 14.865 10.200 1.00 5.00 +ATOM 362 CB CYS A 187 32.193 14.101 11.235 1.00 5.00 +ATOM 363 CA VAL A 188 29.448 12.682 7.644 1.00 5.00 +ATOM 364 CB VAL A 188 28.969 12.696 6.162 1.00 5.00 +ATOM 365 CA LEU A 189 30.753 8.983 7.550 1.00 5.00 +ATOM 366 CB LEU A 189 31.686 8.872 9.372 1.00 5.00 +ATOM 367 CA LYS A 190 29.129 7.248 4.468 1.00 5.00 +ATOM 368 CB LYS A 190 28.400 9.408 2.481 1.00 5.00 +ATOM 369 CA PHE A 191 29.304 3.373 4.006 1.00 5.00 +ATOM 370 CB PHE A 191 31.497 3.195 5.946 1.00 5.00 +ATOM 371 CA SER A 192 27.718 0.354 2.064 1.00 5.00 +ATOM 372 CB SER A 192 27.638 -0.272 0.943 1.00 5.00 +ATOM 373 CA HIS A 193 24.738 -1.067 4.014 1.00 5.00 +ATOM 374 CB HIS A 193 22.513 0.384 3.623 1.00 5.00 +ATOM 375 CA PRO A 194 24.964 -3.029 7.362 1.00 5.00 +ATOM 376 CB PRO A 194 23.853 -2.185 7.736 1.00 5.00 +ATOM 377 CA SER A 195 22.695 -6.057 5.699 1.00 5.00 +ATOM 378 CB SER A 195 22.802 -5.337 4.660 1.00 5.00 +ATOM 379 CA PRO A 196 24.923 -9.061 4.927 1.00 5.00 +ATOM 380 CB PRO A 196 24.451 -9.485 6.154 1.00 5.00 +ATOM 381 CA LEU A 197 23.906 -9.014 1.385 1.00 5.00 +ATOM 382 CB LEU A 197 22.708 -8.266 -0.017 1.00 5.00 +ATOM 383 CA SER A 198 26.571 -6.234 1.090 1.00 5.00 +ATOM 384 CB SER A 198 27.521 -6.762 1.902 1.00 5.00 +ATOM 385 CA LYS A 199 29.603 -5.764 -0.830 1.00 5.00 +ATOM 386 CB LYS A 199 31.078 -3.489 -1.433 1.00 5.00 +ATOM 387 CA VAL A 200 31.871 -4.790 2.323 1.00 5.00 +ATOM 388 CB VAL A 200 31.177 -3.373 2.791 1.00 5.00 +ATOM 389 CA PRO A 201 31.882 -6.837 5.494 1.00 5.00 +ATOM 390 CB PRO A 201 33.214 -7.289 5.084 1.00 5.00 +ATOM 391 CA PHE A 202 30.543 -4.484 7.815 1.00 5.00 +ATOM 392 CB PHE A 202 29.038 -2.108 7.087 1.00 5.00 +ATOM 393 CA GLY A 203 33.259 -5.546 10.211 1.00 5.00 +ATOM 394 CA THR A 204 35.388 -3.299 7.846 1.00 5.00 +ATOM 395 CB THR A 204 35.089 -2.860 6.382 1.00 5.00 +ATOM 396 CA CYS A 205 34.047 -0.261 9.865 1.00 5.00 +ATOM 397 CB CYS A 205 34.014 -0.613 11.227 1.00 5.00 +ATOM 398 CA GLN A 206 35.773 2.209 12.156 1.00 5.00 +ATOM 399 CB GLN A 206 37.696 3.695 10.726 1.00 5.00 +ATOM 400 CA HIS A 207 33.221 5.060 12.226 1.00 5.00 +ATOM 401 CB HIS A 207 31.826 3.240 11.031 1.00 5.00 +ATOM 402 CA PHE A 208 33.028 4.888 16.126 1.00 5.00 +ATOM 403 CB PHE A 208 31.591 2.449 15.314 1.00 5.00 +ATOM 404 CA LEU A 209 36.868 5.300 16.143 1.00 5.00 +ATOM 405 CB LEU A 209 38.580 5.149 16.742 1.00 5.00 +ATOM 406 CA VAL A 210 36.768 8.144 13.589 1.00 5.00 +ATOM 407 CB VAL A 210 36.667 8.405 12.123 1.00 5.00 +ATOM 408 CA ALA A 211 33.611 9.568 15.309 1.00 5.00 +ATOM 409 CB ALA A 211 33.143 9.106 15.088 1.00 5.00 +ATOM 410 CA ASN A 212 35.741 9.681 18.520 1.00 5.00 +ATOM 411 CB ASN A 212 34.933 8.050 19.452 1.00 5.00 +ATOM 412 CA ARG A 213 38.597 11.413 16.992 1.00 5.00 +ATOM 413 CB ARG A 213 40.736 9.503 15.328 1.00 5.00 +ATOM 414 CA TYR A 214 36.143 13.835 15.782 1.00 5.00 +ATOM 415 CB TYR A 214 33.400 15.656 14.681 1.00 5.00 +ATOM 416 CA LEU A 215 34.246 14.211 18.988 1.00 5.00 +ATOM 417 CB LEU A 215 33.256 12.476 19.454 1.00 5.00 +ATOM 418 CA GLU A 216 37.563 14.476 20.949 1.00 5.00 +ATOM 419 CB GLU A 216 38.476 12.260 21.179 1.00 5.00 +ATOM 420 CA THR A 217 38.833 17.003 18.496 1.00 5.00 +ATOM 421 CB THR A 217 38.751 16.534 17.055 1.00 5.00 +ATOM 422 CA ARG A 218 35.860 19.489 19.181 1.00 5.00 +ATOM 423 CB ARG A 218 34.465 20.574 16.357 1.00 5.00 +ATOM 424 CA SER A 219 35.939 19.098 22.968 1.00 5.00 +ATOM 425 CB SER A 219 35.184 20.064 23.281 1.00 5.00 +ATOM 426 CA ILE A 220 33.121 16.354 23.287 1.00 5.00 +ATOM 427 CB ILE A 220 31.737 16.707 22.003 1.00 5.00 +ATOM 428 CA SER A 221 33.085 13.407 25.467 1.00 5.00 +ATOM 429 CB SER A 221 32.200 13.100 26.308 1.00 5.00 +ATOM 430 CA PRO A 222 34.108 10.562 23.224 1.00 5.00 +ATOM 431 CB PRO A 222 35.178 10.870 24.118 1.00 5.00 +ATOM 432 CA ILE A 223 31.344 7.865 23.070 1.00 5.00 +ATOM 433 CB ILE A 223 29.915 8.542 22.482 1.00 5.00 +ATOM 434 CA ASP A 224 31.651 4.569 24.808 1.00 5.00 +ATOM 435 CB ASP A 224 30.103 5.020 26.094 1.00 5.00 +ATOM 436 CA TRP A 225 30.267 2.655 21.788 1.00 5.00 +ATOM 437 CB TRP A 225 30.039 5.349 19.329 1.00 5.00 +ATOM 438 CA SER A 226 30.068 -0.735 23.761 1.00 5.00 +ATOM 439 CB SER A 226 30.939 -0.660 24.641 1.00 5.00 +ATOM 440 CA VAL A 227 27.080 -2.682 25.010 1.00 5.00 +ATOM 441 CB VAL A 227 25.860 -1.889 24.578 1.00 5.00 TER TER -ATOM 442 CA THR C 1 55.303 -5.600 -9.675 1.00 5.00 -ATOM 443 CB THR C 1 55.188 -6.598 -8.694 1.00 5.00 -ATOM 444 CA ASN C 2 53.882 -6.330 -12.708 1.00 5.00 -ATOM 445 CB ASN C 2 54.643 -8.156 -12.698 1.00 5.00 -ATOM 446 CA LEU C 3 50.425 -6.706 -11.163 1.00 5.00 -ATOM 447 CB LEU C 3 49.857 -8.605 -11.076 1.00 5.00 -ATOM 448 CA SER C 4 50.642 -3.392 -9.360 1.00 5.00 -ATOM 449 CB SER C 4 49.995 -3.620 -8.223 1.00 5.00 -ATOM 450 CA ASP C 5 52.094 -1.319 -12.006 1.00 5.00 -ATOM 451 CB ASP C 5 53.735 -0.802 -12.980 1.00 5.00 -ATOM 452 CA ILE C 6 49.680 -2.613 -14.575 1.00 5.00 -ATOM 453 CB ILE C 6 48.835 -4.348 -14.733 1.00 5.00 -ATOM 454 CA ILE C 7 46.803 -0.617 -12.982 1.00 5.00 -ATOM 455 CB ILE C 7 46.509 -1.438 -11.232 1.00 5.00 -ATOM 456 CA GLU C 8 49.212 2.257 -12.214 1.00 5.00 -ATOM 457 CB GLU C 8 50.207 1.651 -9.926 1.00 5.00 -ATOM 458 CA LYS C 9 50.069 2.340 -15.812 1.00 5.00 -ATOM 459 CB LYS C 9 52.065 1.860 -17.809 1.00 5.00 -ATOM 460 CA GLU C 10 46.910 1.362 -17.517 1.00 5.00 -ATOM 461 CB GLU C 10 47.378 -0.242 -19.745 1.00 5.00 -ATOM 462 CA THR C 11 44.927 3.975 -15.589 1.00 5.00 -ATOM 463 CB THR C 11 44.578 3.350 -14.276 1.00 5.00 -ATOM 464 CA GLY C 12 47.315 6.646 -14.335 1.00 5.00 -ATOM 465 CA LYS C 13 47.093 6.400 -10.478 1.00 5.00 -ATOM 466 CB LYS C 13 45.136 8.224 -8.753 1.00 5.00 -ATOM 467 CA GLN C 14 48.920 4.526 -7.631 1.00 5.00 -ATOM 468 CB GLN C 14 50.653 6.171 -6.280 1.00 5.00 -ATOM 469 CA LEU C 15 46.772 2.050 -5.854 1.00 5.00 -ATOM 470 CB LEU C 15 45.815 2.483 -7.497 1.00 5.00 -ATOM 471 CA VAL C 16 47.539 -1.413 -4.405 1.00 5.00 -ATOM 472 CB VAL C 16 48.139 -0.795 -3.249 1.00 5.00 -ATOM 473 CA ILE C 17 45.962 -5.010 -4.766 1.00 5.00 -ATOM 474 CB ILE C 17 46.593 -6.283 -5.964 1.00 5.00 -ATOM 475 CA GLN C 18 43.555 -4.997 -1.833 1.00 5.00 -ATOM 476 CB GLN C 18 43.799 -2.360 -0.801 1.00 5.00 -ATOM 477 CA GLU C 19 42.520 -8.829 -2.289 1.00 5.00 -ATOM 478 CB GLU C 19 40.121 -9.161 -2.498 1.00 5.00 -ATOM 479 CA SER C 20 42.851 -11.578 -4.858 1.00 5.00 -ATOM 480 CB SER C 20 44.176 -11.857 -4.873 1.00 5.00 -ATOM 481 CA ILE C 21 39.373 -13.182 -5.567 1.00 5.00 -ATOM 482 CB ILE C 21 37.858 -12.503 -4.389 1.00 5.00 -ATOM 483 CA LEU C 22 39.272 -16.393 -7.854 1.00 5.00 -ATOM 484 CB LEU C 22 40.996 -17.542 -7.487 1.00 5.00 -ATOM 485 CA MET C 23 36.483 -16.451 -10.544 1.00 5.00 -ATOM 486 CB MET C 23 35.136 -14.249 -10.124 1.00 5.00 -ATOM 487 CA LEU C 24 35.064 -19.115 -12.382 1.00 5.00 -ATOM 488 CB LEU C 24 34.842 -21.040 -11.563 1.00 5.00 -ATOM 489 CA PRO C 25 34.489 -18.366 -16.236 1.00 5.00 -ATOM 490 CB PRO C 25 35.332 -19.493 -16.270 1.00 5.00 -ATOM 491 CA GLU C 26 30.988 -18.750 -16.057 1.00 5.00 -ATOM 492 CB GLU C 26 30.471 -21.157 -15.688 1.00 5.00 -ATOM 493 CA GLU C 27 31.229 -16.127 -13.035 1.00 5.00 -ATOM 494 CB GLU C 27 32.418 -16.714 -10.913 1.00 5.00 -ATOM 495 CA VAL C 28 33.202 -14.067 -15.810 1.00 5.00 -ATOM 496 CB VAL C 28 34.438 -14.529 -15.074 1.00 5.00 -ATOM 497 CA GLU C 29 30.834 -14.698 -18.746 1.00 5.00 -ATOM 498 CB GLU C 29 29.271 -15.838 -20.183 1.00 5.00 -ATOM 499 CA GLU C 30 27.787 -13.391 -17.124 1.00 5.00 -ATOM 500 CB GLU C 30 25.924 -12.795 -16.146 1.00 5.00 -ATOM 501 CA VAL C 31 29.547 -10.158 -16.062 1.00 5.00 -ATOM 502 CB VAL C 31 30.208 -10.959 -14.997 1.00 5.00 -ATOM 503 CA ILE C 32 32.199 -9.845 -18.875 1.00 5.00 -ATOM 504 CB ILE C 32 34.026 -10.311 -18.464 1.00 5.00 -ATOM 505 CA GLY C 33 31.188 -10.313 -22.608 1.00 5.00 -ATOM 506 CA ASN C 34 33.362 -13.301 -22.889 1.00 5.00 -ATOM 507 CB ASN C 34 34.200 -12.449 -24.493 1.00 5.00 -ATOM 508 CA LYS C 35 33.609 -17.053 -22.189 1.00 5.00 -ATOM 509 CB LYS C 35 33.757 -19.028 -23.980 1.00 5.00 -ATOM 510 CA PRO C 36 37.146 -16.687 -20.915 1.00 5.00 -ATOM 511 CB PRO C 36 36.362 -15.848 -20.121 1.00 5.00 -ATOM 512 CA GLU C 37 38.584 -20.391 -20.829 1.00 5.00 -ATOM 513 CB GLU C 37 37.980 -21.487 -22.889 1.00 5.00 -ATOM 514 CA SER C 38 40.156 -20.596 -17.436 1.00 5.00 -ATOM 515 CB SER C 38 41.221 -20.017 -17.951 1.00 5.00 -ATOM 516 CA ASP C 39 39.656 -19.648 -13.618 1.00 5.00 -ATOM 517 CB ASP C 39 39.499 -21.063 -12.077 1.00 5.00 -ATOM 518 CA ILE C 40 40.225 -15.933 -13.373 1.00 5.00 -ATOM 519 CB ILE C 40 39.728 -15.314 -15.160 1.00 5.00 -ATOM 520 CA LEU C 41 42.013 -14.243 -10.475 1.00 5.00 -ATOM 521 CB LEU C 41 44.051 -14.880 -9.790 1.00 5.00 -ATOM 522 CA VAL C 42 39.871 -11.120 -9.669 1.00 5.00 -ATOM 523 CB VAL C 42 38.451 -10.842 -9.071 1.00 5.00 -ATOM 524 CA HIS C 43 42.429 -8.863 -8.298 1.00 5.00 -ATOM 525 CB HIS C 43 44.712 -10.189 -8.915 1.00 5.00 -ATOM 526 CA THR C 44 40.622 -5.914 -6.894 1.00 5.00 -ATOM 527 CB THR C 44 39.869 -5.969 -5.691 1.00 5.00 -ATOM 528 CA ALA C 45 42.124 -2.470 -6.266 1.00 5.00 -ATOM 529 CB ALA C 45 42.514 -2.531 -6.956 1.00 5.00 -ATOM 530 CA TYR C 46 40.262 0.394 -4.616 1.00 5.00 -ATOM 531 CB TYR C 46 37.971 0.531 -2.247 1.00 5.00 -ATOM 532 CA ASP C 47 40.421 3.720 -5.980 1.00 5.00 -ATOM 533 CB ASP C 47 41.186 4.038 -7.914 1.00 5.00 -ATOM 534 CA GLU C 48 39.035 5.184 -2.676 1.00 5.00 -ATOM 535 CB GLU C 48 38.070 4.122 -0.813 1.00 5.00 -ATOM 536 CA SER C 49 40.111 8.838 -3.859 1.00 5.00 -ATOM 537 CB SER C 49 41.432 8.945 -3.775 1.00 5.00 -ATOM 538 CA THR C 50 37.688 8.520 -6.694 1.00 5.00 -ATOM 539 CB THR C 50 38.802 8.980 -7.445 1.00 5.00 -ATOM 540 CA ASP C 51 35.277 5.893 -4.989 1.00 5.00 -ATOM 541 CB ASP C 51 33.854 6.783 -3.811 1.00 5.00 -ATOM 542 CA GLU C 52 36.199 3.288 -7.419 1.00 5.00 -ATOM 543 CB GLU C 52 37.391 5.074 -9.187 1.00 5.00 -ATOM 544 CA ASN C 53 36.661 -0.564 -7.604 1.00 5.00 -ATOM 545 CB ASN C 53 36.415 -1.655 -5.980 1.00 5.00 -ATOM 546 CA VAL C 54 39.539 -1.066 -10.150 1.00 5.00 -ATOM 547 CB VAL C 54 40.905 -0.609 -10.462 1.00 5.00 -ATOM 548 CA MET C 55 39.297 -5.070 -10.892 1.00 5.00 -ATOM 549 CB MET C 55 37.502 -6.004 -9.213 1.00 5.00 -ATOM 550 CA LEU C 56 42.160 -6.790 -12.834 1.00 5.00 -ATOM 551 CB LEU C 56 43.909 -6.586 -11.811 1.00 5.00 -ATOM 552 CA LEU C 57 40.923 -10.122 -13.702 1.00 5.00 -ATOM 553 CB LEU C 57 38.829 -10.377 -14.118 1.00 5.00 -ATOM 554 CA THR C 58 44.077 -12.211 -14.380 1.00 5.00 -ATOM 555 CB THR C 58 45.001 -11.369 -13.661 1.00 5.00 -ATOM 556 CA SER C 59 44.237 -15.672 -15.681 1.00 5.00 -ATOM 557 CB SER C 59 45.360 -15.885 -16.108 1.00 5.00 -ATOM 558 CA ASP C 60 44.637 -17.983 -12.497 1.00 5.00 -ATOM 559 CB ASP C 60 43.595 -18.928 -11.015 1.00 5.00 -ATOM 560 CA ALA C 61 47.908 -19.036 -11.055 1.00 5.00 -ATOM 561 CB ALA C 61 47.608 -19.418 -10.443 1.00 5.00 -ATOM 562 CA PRO C 62 51.795 -18.641 -11.782 1.00 5.00 -ATOM 563 CB PRO C 62 51.840 -19.906 -11.124 1.00 5.00 -ATOM 564 CA GLU C 63 50.906 -17.617 -15.382 1.00 5.00 -ATOM 565 CB GLU C 63 51.670 -18.273 -17.971 1.00 5.00 -ATOM 566 CA TYR C 64 49.576 -14.238 -14.092 1.00 5.00 -ATOM 567 CB TYR C 64 49.271 -14.376 -10.722 1.00 5.00 -ATOM 568 CA LYS C 65 48.214 -12.839 -17.403 1.00 5.00 -ATOM 569 CB LYS C 65 49.423 -14.210 -19.502 1.00 5.00 -ATOM 570 CA PRO C 66 46.102 -9.651 -17.613 1.00 5.00 -ATOM 571 CB PRO C 66 46.897 -9.395 -18.726 1.00 5.00 -ATOM 572 CA TRP C 67 42.543 -10.347 -18.949 1.00 5.00 -ATOM 573 CB TRP C 67 40.328 -12.249 -21.029 1.00 5.00 -ATOM 574 CA ALA C 68 40.088 -7.629 -18.377 1.00 5.00 -ATOM 575 CB ALA C 68 39.536 -7.693 -17.826 1.00 5.00 -ATOM 576 CA LEU C 69 40.676 -4.400 -16.451 1.00 5.00 -ATOM 577 CB LEU C 69 42.306 -3.176 -16.103 1.00 5.00 -ATOM 578 CA VAL C 70 37.195 -4.230 -14.663 1.00 5.00 -ATOM 579 CB VAL C 70 36.439 -5.355 -14.224 1.00 5.00 -ATOM 580 CA ILE C 71 36.841 -0.322 -13.757 1.00 5.00 -ATOM 581 CB ILE C 71 38.273 0.520 -14.636 1.00 5.00 -ATOM 582 CA GLN C 72 33.576 -0.142 -11.609 1.00 5.00 -ATOM 583 CB GLN C 72 33.825 0.288 -8.859 1.00 5.00 -ATOM 584 CA ASP C 73 31.859 2.935 -10.384 1.00 5.00 -ATOM 585 CB ASP C 73 31.181 4.458 -11.548 1.00 5.00 -ATOM 586 CA SER C 74 29.827 3.695 -7.146 1.00 5.00 -ATOM 587 CB SER C 74 30.026 4.495 -6.162 1.00 5.00 -ATOM 588 CA ASN C 75 26.773 4.024 -9.623 1.00 5.00 -ATOM 589 CB ASN C 75 25.675 5.351 -10.620 1.00 5.00 -ATOM 590 CA GLY C 76 26.628 0.140 -10.401 1.00 5.00 -ATOM 591 CA GLU C 77 28.617 0.706 -13.747 1.00 5.00 -ATOM 592 CB GLU C 77 28.843 1.628 -15.818 1.00 5.00 -ATOM 593 CA ASN C 78 31.523 -1.625 -14.905 1.00 5.00 -ATOM 594 CB ASN C 78 31.722 -2.823 -13.220 1.00 5.00 -ATOM 595 CA LYS C 79 33.673 -0.353 -17.974 1.00 5.00 -ATOM 596 CB LYS C 79 33.579 2.546 -18.771 1.00 5.00 -ATOM 597 CA ILE C 80 35.671 -3.166 -19.001 1.00 5.00 -ATOM 598 CB ILE C 80 34.697 -4.588 -19.730 1.00 5.00 -ATOM 599 CA LYS C 81 39.124 -2.201 -20.505 1.00 5.00 -ATOM 600 CB LYS C 81 40.168 0.296 -20.639 1.00 5.00 -ATOM 601 CA MET C 82 39.892 -5.574 -22.264 1.00 5.00 -ATOM 602 CB MET C 82 38.820 -7.709 -22.104 1.00 5.00 -ATOM 603 CA LEU C 83 43.602 -5.311 -22.197 1.00 5.00 -ATOM 604 CB LEU C 83 43.734 -6.053 -20.271 1.00 5.00 +ATOM 442 CA THR C 1 50.556 15.111 13.165 1.00 5.00 +ATOM 443 CB THR C 1 49.126 15.272 12.753 1.00 5.00 +ATOM 444 CA ASN C 2 52.400 13.336 10.362 1.00 5.00 +ATOM 445 CB ASN C 2 52.766 11.400 9.904 1.00 5.00 +ATOM 446 CA LEU C 3 49.435 14.279 8.061 1.00 5.00 +ATOM 447 CB LEU C 3 48.680 12.651 6.855 1.00 5.00 +ATOM 448 CA SER C 4 49.965 17.720 9.330 1.00 5.00 +ATOM 449 CB SER C 4 49.815 18.809 9.989 1.00 5.00 +ATOM 450 CA ASP C 5 53.457 18.343 7.938 1.00 5.00 +ATOM 451 CB ASP C 5 53.810 16.429 8.393 1.00 5.00 +ATOM 452 CA ILE C 6 51.673 16.753 4.745 1.00 5.00 +ATOM 453 CB ILE C 6 51.512 15.049 3.662 1.00 5.00 +ATOM 454 CA ILE C 7 49.468 19.885 4.695 1.00 5.00 +ATOM 455 CB ILE C 7 48.256 19.781 6.024 1.00 5.00 +ATOM 456 CA GLU C 8 52.786 21.883 5.255 1.00 5.00 +ATOM 457 CB GLU C 8 52.053 22.231 7.609 1.00 5.00 +ATOM 458 CA LYS C 9 54.715 20.780 2.274 1.00 5.00 +ATOM 459 CB LYS C 9 56.049 18.936 0.763 1.00 5.00 +ATOM 460 CA GLU C 10 52.246 20.466 -0.633 1.00 5.00 +ATOM 461 CB GLU C 10 52.531 17.979 -0.693 1.00 5.00 +ATOM 462 CA THR C 11 50.073 23.113 0.381 1.00 5.00 +ATOM 463 CB THR C 11 49.004 22.441 0.964 1.00 5.00 +ATOM 464 CA GLY C 12 52.463 25.711 2.082 1.00 5.00 +ATOM 465 CA LYS C 13 49.657 26.534 4.714 1.00 5.00 +ATOM 466 CB LYS C 13 47.125 28.353 5.329 1.00 5.00 +ATOM 467 CA GLN C 14 49.522 25.897 8.414 1.00 5.00 +ATOM 468 CB GLN C 14 50.625 25.276 10.826 1.00 5.00 +ATOM 469 CA LEU C 15 46.370 24.015 8.576 1.00 5.00 +ATOM 470 CB LEU C 15 46.430 24.125 6.488 1.00 5.00 +ATOM 471 CA VAL C 16 43.815 22.484 10.744 1.00 5.00 +ATOM 472 CB VAL C 16 43.225 23.659 11.453 1.00 5.00 +ATOM 473 CA ILE C 17 42.377 18.855 10.146 1.00 5.00 +ATOM 474 CB ILE C 17 43.560 17.302 9.939 1.00 5.00 +ATOM 475 CA GLN C 18 38.989 19.760 11.020 1.00 5.00 +ATOM 476 CB GLN C 18 38.454 22.251 10.673 1.00 5.00 +ATOM 477 CA GLU C 19 37.268 16.359 10.692 1.00 5.00 +ATOM 478 CB GLU C 19 35.486 18.102 11.104 1.00 5.00 +ATOM 479 CA SER C 20 37.982 12.760 9.574 1.00 5.00 +ATOM 480 CB SER C 20 38.189 12.305 10.826 1.00 5.00 +ATOM 481 CA ILE C 21 35.174 11.557 7.309 1.00 5.00 +ATOM 482 CB ILE C 21 34.197 13.222 7.008 1.00 5.00 +ATOM 483 CA LEU C 22 34.546 8.167 5.772 1.00 5.00 +ATOM 484 CB LEU C 22 35.483 6.443 6.596 1.00 5.00 +ATOM 485 CA MET C 23 33.199 8.765 2.246 1.00 5.00 +ATOM 486 CB MET C 23 32.330 11.184 2.329 1.00 5.00 +ATOM 487 CA LEU C 24 32.887 5.345 0.477 1.00 5.00 +ATOM 488 CB LEU C 24 30.895 5.405 0.352 1.00 5.00 +ATOM 489 CA PRO C 25 35.301 3.964 -2.140 1.00 5.00 +ATOM 490 CB PRO C 25 35.513 3.069 -1.016 1.00 5.00 +ATOM 491 CA GLU C 26 32.665 4.315 -4.926 1.00 5.00 +ATOM 492 CB GLU C 26 31.441 2.664 -3.831 1.00 5.00 +ATOM 493 CA GLU C 27 31.842 7.885 -3.419 1.00 5.00 +ATOM 494 CB GLU C 27 31.539 10.045 -2.257 1.00 5.00 +ATOM 495 CA VAL C 28 35.266 8.972 -3.891 1.00 5.00 +ATOM 496 CB VAL C 28 35.494 8.585 -2.410 1.00 5.00 +ATOM 497 CA GLU C 29 35.642 7.433 -7.300 1.00 5.00 +ATOM 498 CB GLU C 29 38.083 7.220 -7.376 1.00 5.00 +ATOM 499 CA GLU C 30 32.664 9.783 -8.260 1.00 5.00 +ATOM 500 CB GLU C 30 30.652 9.832 -9.726 1.00 5.00 +ATOM 501 CA VAL C 31 34.698 13.027 -7.315 1.00 5.00 +ATOM 502 CB VAL C 31 34.625 12.964 -5.865 1.00 5.00 +ATOM 503 CA ILE C 32 38.307 11.647 -8.377 1.00 5.00 +ATOM 504 CB ILE C 32 39.282 11.039 -6.828 1.00 5.00 +ATOM 505 CA GLY C 33 39.769 10.160 -11.380 1.00 5.00 +ATOM 506 CA ASN C 34 41.454 7.256 -9.590 1.00 5.00 +ATOM 507 CB ASN C 34 43.306 8.130 -9.985 1.00 5.00 +ATOM 508 CA LYS C 35 39.945 4.298 -7.641 1.00 5.00 +ATOM 509 CB LYS C 35 37.251 2.769 -7.628 1.00 5.00 +ATOM 510 CA PRO C 36 41.657 3.813 -4.240 1.00 5.00 +ATOM 511 CB PRO C 36 41.333 5.150 -4.010 1.00 5.00 +ATOM 512 CA GLU C 37 40.474 0.438 -2.633 1.00 5.00 +ATOM 513 CB GLU C 37 41.927 -1.039 -1.486 1.00 5.00 +ATOM 514 CA SER C 38 39.585 1.231 0.994 1.00 5.00 +ATOM 515 CB SER C 38 40.475 2.168 0.964 1.00 5.00 +ATOM 516 CA ASP C 39 37.122 2.919 3.036 1.00 5.00 +ATOM 517 CB ASP C 39 36.367 1.372 4.131 1.00 5.00 +ATOM 518 CA ILE C 40 38.735 6.467 2.776 1.00 5.00 +ATOM 519 CB ILE C 40 39.444 7.250 1.371 1.00 5.00 +ATOM 520 CA LEU C 41 39.573 8.906 5.623 1.00 5.00 +ATOM 521 CB LEU C 41 39.694 8.080 7.521 1.00 5.00 +ATOM 522 CA VAL C 42 39.039 12.501 4.089 1.00 5.00 +ATOM 523 CB VAL C 42 37.661 12.735 3.571 1.00 5.00 +ATOM 524 CA HIS C 43 40.988 14.879 6.575 1.00 5.00 +ATOM 525 CB HIS C 43 42.957 13.247 7.473 1.00 5.00 +ATOM 526 CA THR C 44 39.058 18.276 5.775 1.00 5.00 +ATOM 527 CB THR C 44 37.751 18.000 5.116 1.00 5.00 +ATOM 528 CA ALA C 45 41.051 21.726 6.554 1.00 5.00 +ATOM 529 CB ALA C 45 41.743 21.749 6.742 1.00 5.00 +ATOM 530 CA TYR C 46 39.248 25.038 6.364 1.00 5.00 +ATOM 531 CB TYR C 46 36.503 23.389 7.083 1.00 5.00 +ATOM 532 CA ASP C 47 42.036 27.759 5.324 1.00 5.00 +ATOM 533 CB ASP C 47 42.818 27.353 3.715 1.00 5.00 +ATOM 534 CA GLU C 48 40.076 31.017 5.513 1.00 5.00 +ATOM 535 CB GLU C 48 39.841 31.304 8.290 1.00 5.00 +ATOM 536 CA SER C 49 42.369 33.363 3.492 1.00 5.00 +ATOM 537 CB SER C 49 43.575 33.750 3.306 1.00 5.00 +ATOM 538 CA THR C 50 41.021 32.022 0.171 1.00 5.00 +ATOM 539 CB THR C 50 42.125 31.409 -0.799 1.00 5.00 +ATOM 540 CA ASP C 51 37.988 29.962 1.624 1.00 5.00 +ATOM 541 CB ASP C 51 36.289 30.693 2.147 1.00 5.00 +ATOM 542 CA GLU C 52 40.457 26.967 0.230 1.00 5.00 +ATOM 543 CB GLU C 52 41.755 26.064 -1.803 1.00 5.00 +ATOM 544 CA ASN C 53 38.772 23.744 1.447 1.00 5.00 +ATOM 545 CB ASN C 53 36.736 23.964 1.432 1.00 5.00 +ATOM 546 CA VAL C 54 41.994 21.763 1.558 1.00 5.00 +ATOM 547 CB VAL C 54 43.198 21.365 2.493 1.00 5.00 +ATOM 548 CA MET C 55 40.859 18.060 1.536 1.00 5.00 +ATOM 549 CB MET C 55 38.594 18.121 0.660 1.00 5.00 +ATOM 550 CA LEU C 56 43.367 15.520 2.738 1.00 5.00 +ATOM 551 CB LEU C 56 45.361 15.788 3.420 1.00 5.00 +ATOM 552 CA LEU C 57 42.425 11.968 1.504 1.00 5.00 +ATOM 553 CB LEU C 57 40.947 12.447 0.213 1.00 5.00 +ATOM 554 CA THR C 58 43.964 8.998 3.569 1.00 5.00 +ATOM 555 CB THR C 58 44.499 9.082 4.906 1.00 5.00 +ATOM 556 CA SER C 59 43.446 5.355 3.817 1.00 5.00 +ATOM 557 CB SER C 59 44.137 4.809 2.984 1.00 5.00 +ATOM 558 CA ASP C 60 42.135 3.877 7.168 1.00 5.00 +ATOM 559 CB ASP C 60 40.641 2.615 7.284 1.00 5.00 +ATOM 560 CA ALA C 61 42.694 5.286 10.759 1.00 5.00 +ATOM 561 CB ALA C 61 42.130 5.181 11.253 1.00 5.00 +ATOM 562 CA PRO C 62 45.404 3.026 12.127 1.00 5.00 +ATOM 563 CB PRO C 62 44.264 2.240 12.444 1.00 5.00 +ATOM 564 CA GLU C 63 46.849 2.708 8.592 1.00 5.00 +ATOM 565 CB GLU C 63 45.885 2.992 6.393 1.00 5.00 +ATOM 566 CA TYR C 64 47.131 6.449 7.557 1.00 5.00 +ATOM 567 CB TYR C 64 48.384 8.946 9.541 1.00 5.00 +ATOM 568 CA LYS C 65 48.546 5.624 4.142 1.00 5.00 +ATOM 569 CB LYS C 65 49.102 4.747 1.027 1.00 5.00 +ATOM 570 CA PRO C 66 48.397 9.183 2.565 1.00 5.00 +ATOM 571 CB PRO C 66 49.791 9.259 3.027 1.00 5.00 +ATOM 572 CA TRP C 67 46.758 8.973 -0.813 1.00 5.00 +ATOM 573 CB TRP C 67 44.930 7.870 -3.827 1.00 5.00 +ATOM 574 CA ALA C 68 44.725 11.915 -2.060 1.00 5.00 +ATOM 575 CB ALA C 68 44.047 11.642 -2.323 1.00 5.00 +ATOM 576 CA LEU C 69 45.724 15.732 -1.636 1.00 5.00 +ATOM 577 CB LEU C 69 46.968 17.148 -0.803 1.00 5.00 +ATOM 578 CA VAL C 70 42.184 17.401 -2.780 1.00 5.00 +ATOM 579 CB VAL C 70 40.956 16.801 -3.069 1.00 5.00 +ATOM 580 CA ILE C 71 42.607 21.284 -2.963 1.00 5.00 +ATOM 581 CB ILE C 71 44.359 21.865 -2.749 1.00 5.00 +ATOM 582 CA GLN C 72 38.891 22.689 -3.354 1.00 5.00 +ATOM 583 CB GLN C 72 36.779 21.523 -3.470 1.00 5.00 +ATOM 584 CA ASP C 73 38.116 26.475 -4.063 1.00 5.00 +ATOM 585 CB ASP C 73 37.922 27.517 -5.712 1.00 5.00 +ATOM 586 CA SER C 74 35.433 28.766 -3.210 1.00 5.00 +ATOM 587 CB SER C 74 35.325 29.921 -2.549 1.00 5.00 +ATOM 588 CA ASN C 75 32.892 27.634 -5.731 1.00 5.00 +ATOM 589 CB ASN C 75 33.674 28.310 -7.412 1.00 5.00 +ATOM 590 CA GLY C 76 33.798 23.977 -5.554 1.00 5.00 +ATOM 591 CA GLU C 77 36.426 23.813 -8.586 1.00 5.00 +ATOM 592 CB GLU C 77 35.861 25.275 -10.433 1.00 5.00 +ATOM 593 CA ASN C 78 38.820 21.153 -7.357 1.00 5.00 +ATOM 594 CB ASN C 78 36.972 20.640 -7.246 1.00 5.00 +ATOM 595 CA LYS C 79 42.540 20.725 -8.001 1.00 5.00 +ATOM 596 CB LYS C 79 43.528 23.485 -7.090 1.00 5.00 +ATOM 597 CA ILE C 80 43.021 17.135 -6.916 1.00 5.00 +ATOM 598 CB ILE C 80 42.640 15.713 -7.717 1.00 5.00 +ATOM 599 CA LYS C 81 46.634 16.536 -6.234 1.00 5.00 +ATOM 600 CB LYS C 81 48.001 18.915 -4.901 1.00 5.00 +ATOM 601 CA MET C 82 46.981 12.549 -5.937 1.00 5.00 +ATOM 602 CB MET C 82 48.052 11.595 -7.528 1.00 5.00 +ATOM 603 CA LEU C 83 49.973 12.102 -3.507 1.00 5.00 +ATOM 604 CB LEU C 83 49.033 12.043 -1.641 1.00 5.00 TER CONECT 1 3 2 CONECT 3 5 4