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=9339cbc5f1d9d6777a8df844bf9348fbc7cb3a5c;hb=018446aca1e32faf80f41e818acbfc61e5d872c9;hp=0000000000000000000000000000000000000000;hpb=88d4f45c783f3644ff7ae49572b7b609ef3c9617;p=unres.git diff --git a/examples/UNRES-Dock/output/wham_T300K_0004.pdb b/examples/UNRES-Dock/output/wham_T300K_0004.pdb new file mode 100644 index 0000000..9339cbc --- /dev/null +++ b/examples/UNRES-Dock/output/wham_T300K_0004.pdb @@ -0,0 +1,921 @@ +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 +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 +TER +CONECT 1 3 2 +CONECT 3 5 4 +CONECT 5 7 6 +CONECT 7 9 8 +CONECT 9 11 10 +CONECT 11 13 12 +CONECT 13 15 14 +CONECT 15 17 16 +CONECT 17 19 18 +CONECT 19 21 20 +CONECT 21 23 22 +CONECT 23 25 24 +CONECT 25 27 26 +CONECT 27 29 28 +CONECT 29 31 30 +CONECT 31 33 32 +CONECT 33 35 34 +CONECT 35 37 36 +CONECT 37 39 38 +CONECT 39 41 40 +CONECT 41 43 42 +CONECT 43 45 44 +CONECT 45 47 46 +CONECT 47 49 48 +CONECT 49 51 50 +CONECT 51 53 52 +CONECT 53 55 54 +CONECT 55 57 56 +CONECT 57 59 58 +CONECT 59 61 60 +CONECT 61 63 62 +CONECT 63 65 64 +CONECT 65 67 66 +CONECT 67 69 68 +CONECT 69 71 70 +CONECT 71 73 72 +CONECT 73 75 74 +CONECT 75 77 76 +CONECT 77 79 78 +CONECT 79 81 80 +CONECT 81 83 82 +CONECT 83 85 84 +CONECT 85 87 86 +CONECT 87 89 88 +CONECT 89 91 90 +CONECT 91 93 92 +CONECT 93 95 94 +CONECT 95 97 96 +CONECT 97 99 98 +CONECT 99 101 100 +CONECT 101 103 102 +CONECT 103 105 104 +CONECT 105 107 106 +CONECT 107 109 108 +CONECT 109 111 110 +CONECT 111 113 112 +CONECT 113 115 114 +CONECT 115 117 116 +CONECT 117 119 118 +CONECT 119 121 120 +CONECT 121 123 122 +CONECT 123 125 124 +CONECT 125 127 126 +CONECT 127 129 128 +CONECT 129 131 130 +CONECT 131 133 132 +CONECT 133 135 134 +CONECT 135 137 136 +CONECT 137 138 +CONECT 138 140 139 +CONECT 140 142 141 +CONECT 142 144 143 +CONECT 144 146 145 +CONECT 146 148 147 +CONECT 148 150 149 +CONECT 150 152 151 +CONECT 152 153 +CONECT 153 155 154 +CONECT 155 157 156 +CONECT 157 159 158 +CONECT 159 160 +CONECT 160 162 161 +CONECT 162 164 163 +CONECT 164 166 165 +CONECT 166 168 167 +CONECT 168 170 169 +CONECT 170 172 171 +CONECT 172 174 173 +CONECT 174 176 175 +CONECT 176 178 177 +CONECT 178 180 179 +CONECT 180 182 181 +CONECT 182 184 183 +CONECT 184 186 185 +CONECT 186 188 187 +CONECT 188 190 189 +CONECT 190 192 191 +CONECT 192 194 193 +CONECT 194 196 195 +CONECT 196 198 197 +CONECT 198 200 199 +CONECT 200 202 201 +CONECT 202 204 203 +CONECT 204 206 205 +CONECT 206 208 207 +CONECT 208 210 209 +CONECT 210 212 211 +CONECT 212 214 213 +CONECT 214 216 215 +CONECT 216 218 217 +CONECT 218 220 219 +CONECT 220 222 221 +CONECT 222 224 223 +CONECT 224 225 +CONECT 225 227 226 +CONECT 227 228 +CONECT 228 230 229 +CONECT 230 232 231 +CONECT 232 234 233 +CONECT 234 236 235 +CONECT 236 238 237 +CONECT 238 240 239 +CONECT 240 242 241 +CONECT 242 244 243 +CONECT 244 245 +CONECT 245 247 246 +CONECT 247 249 248 +CONECT 249 251 250 +CONECT 251 253 252 +CONECT 253 255 254 +CONECT 255 257 256 +CONECT 257 259 258 +CONECT 259 261 260 +CONECT 261 263 262 +CONECT 263 265 264 +CONECT 265 267 266 +CONECT 267 269 268 +CONECT 269 270 +CONECT 270 272 271 +CONECT 272 274 273 +CONECT 274 276 275 +CONECT 276 278 277 +CONECT 278 280 279 +CONECT 280 282 281 +CONECT 282 284 283 +CONECT 284 286 285 +CONECT 286 287 +CONECT 287 289 288 +CONECT 289 291 290 +CONECT 291 293 292 +CONECT 293 295 294 +CONECT 295 297 296 +CONECT 297 298 +CONECT 298 299 +CONECT 299 301 300 +CONECT 301 303 302 +CONECT 303 305 304 +CONECT 305 307 306 +CONECT 307 309 308 +CONECT 309 311 310 +CONECT 311 313 312 +CONECT 313 315 314 +CONECT 315 317 316 +CONECT 317 319 318 +CONECT 319 320 +CONECT 320 322 321 +CONECT 322 324 323 +CONECT 324 326 325 +CONECT 326 328 327 +CONECT 328 330 329 +CONECT 330 332 331 +CONECT 332 333 +CONECT 333 335 334 +CONECT 335 337 336 +CONECT 337 339 338 +CONECT 339 341 340 +CONECT 341 343 342 +CONECT 343 345 344 +CONECT 345 347 346 +CONECT 347 349 348 +CONECT 349 351 350 +CONECT 351 353 352 +CONECT 353 355 354 +CONECT 355 357 356 +CONECT 357 359 358 +CONECT 359 361 360 +CONECT 361 363 362 +CONECT 363 365 364 +CONECT 365 367 366 +CONECT 367 369 368 +CONECT 369 371 370 +CONECT 371 373 372 +CONECT 373 375 374 +CONECT 375 377 376 +CONECT 377 379 378 +CONECT 379 381 380 +CONECT 381 383 382 +CONECT 383 385 384 +CONECT 385 387 386 +CONECT 387 389 388 +CONECT 389 391 390 +CONECT 391 393 392 +CONECT 393 394 +CONECT 394 396 395 +CONECT 396 398 397 +CONECT 398 400 399 +CONECT 400 402 401 +CONECT 402 404 403 +CONECT 404 406 405 +CONECT 406 408 407 +CONECT 408 410 409 +CONECT 410 412 411 +CONECT 412 414 413 +CONECT 414 416 415 +CONECT 416 418 417 +CONECT 418 420 419 +CONECT 420 422 421 +CONECT 422 424 423 +CONECT 424 426 425 +CONECT 426 428 427 +CONECT 428 430 429 +CONECT 430 432 431 +CONECT 432 434 433 +CONECT 434 436 435 +CONECT 436 438 437 +CONECT 438 440 439 +CONECT 440 441 +CONECT 442 444 443 +CONECT 444 446 445 +CONECT 446 448 447 +CONECT 448 450 449 +CONECT 450 452 451 +CONECT 452 454 453 +CONECT 454 456 455 +CONECT 456 458 457 +CONECT 458 460 459 +CONECT 460 462 461 +CONECT 462 464 463 +CONECT 464 465 +CONECT 465 467 466 +CONECT 467 469 468 +CONECT 469 471 470 +CONECT 471 473 472 +CONECT 473 475 474 +CONECT 475 477 476 +CONECT 477 479 478 +CONECT 479 481 480 +CONECT 481 483 482 +CONECT 483 485 484 +CONECT 485 487 486 +CONECT 487 489 488 +CONECT 489 491 490 +CONECT 491 493 492 +CONECT 493 495 494 +CONECT 495 497 496 +CONECT 497 499 498 +CONECT 499 501 500 +CONECT 501 503 502 +CONECT 503 505 504 +CONECT 505 506 +CONECT 506 508 507 +CONECT 508 510 509 +CONECT 510 512 511 +CONECT 512 514 513 +CONECT 514 516 515 +CONECT 516 518 517 +CONECT 518 520 519 +CONECT 520 522 521 +CONECT 522 524 523 +CONECT 524 526 525 +CONECT 526 528 527 +CONECT 528 530 529 +CONECT 530 532 531 +CONECT 532 534 533 +CONECT 534 536 535 +CONECT 536 538 537 +CONECT 538 540 539 +CONECT 540 542 541 +CONECT 542 544 543 +CONECT 544 546 545 +CONECT 546 548 547 +CONECT 548 550 549 +CONECT 550 552 551 +CONECT 552 554 553 +CONECT 554 556 555 +CONECT 556 558 557 +CONECT 558 560 559 +CONECT 560 562 561 +CONECT 562 564 563 +CONECT 564 566 565 +CONECT 566 568 567 +CONECT 568 570 569 +CONECT 570 572 571 +CONECT 572 574 573 +CONECT 574 576 575 +CONECT 576 578 577 +CONECT 578 580 579 +CONECT 580 582 581 +CONECT 582 584 583 +CONECT 584 586 585 +CONECT 586 588 587 +CONECT 588 590 589 +CONECT 590 591 +CONECT 591 593 592 +CONECT 593 595 594 +CONECT 595 597 596 +CONECT 597 599 598 +CONECT 599 601 600 +CONECT 601 603 602 +CONECT 603 604 +ENDMDL +TER