X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=examples%2FUNRES-Dock%2Foutput%2Fwham_T300K_0005.pdb;fp=examples%2FUNRES-Dock%2Foutput%2Fwham_T300K_0005.pdb;h=0be3c5376ed81ad0ab4cd92ce22209911e7a2574;hb=86a7a0fff3fb6d1c18791c4d2723ee3173d2cf65;hp=4d979b10a04bcac54b9e6e35dd8cdb80e8c15cd8;hpb=018446aca1e32faf80f41e818acbfc61e5d872c9;p=unres.git diff --git a/examples/UNRES-Dock/output/wham_T300K_0005.pdb b/examples/UNRES-Dock/output/wham_T300K_0005.pdb index 4d979b1..0be3c53 100644 --- a/examples/UNRES-Dock/output/wham_T300K_0005.pdb +++ b/examples/UNRES-Dock/output/wham_T300K_0005.pdb @@ -1,611 +1,611 @@ -REMARK CLUSTER 5 FREE ENERGY -1.26529E+01 AVE RMSD 0.00 -REMARK clustering ENERGY -1.20671E+01 RMS 0.00 -ATOM 1 CA ASP A 1 -0.318 -7.283 21.885 1.00 5.00 -ATOM 2 CB ASP A 1 -2.332 -6.999 21.436 1.00 5.00 -ATOM 3 CA TRP A 2 3.209 -8.700 21.555 1.00 5.00 -ATOM 4 CB TRP A 2 6.603 -9.686 20.499 1.00 5.00 -ATOM 5 CA THR A 3 1.717 -12.170 20.861 1.00 5.00 -ATOM 6 CB THR A 3 1.161 -13.084 21.935 1.00 5.00 -ATOM 7 CA THR A 4 -0.300 -10.314 18.131 1.00 5.00 -ATOM 8 CB THR A 4 -1.752 -10.500 18.461 1.00 5.00 -ATOM 9 CA PHE A 5 2.379 -7.902 17.163 1.00 5.00 -ATOM 10 CB PHE A 5 4.696 -6.185 17.074 1.00 5.00 -ATOM 11 CA ARG A 6 5.089 -10.540 16.852 1.00 5.00 -ATOM 12 CB ARG A 6 6.969 -13.602 17.230 1.00 5.00 -ATOM 13 CA ARG A 7 2.427 -12.587 14.696 1.00 5.00 -ATOM 14 CB ARG A 7 -0.074 -14.447 13.145 1.00 5.00 -ATOM 15 CA VAL A 8 1.736 -9.517 12.374 1.00 5.00 -ATOM 16 CB VAL A 8 1.597 -8.116 12.389 1.00 5.00 -ATOM 17 CA PHE A 9 5.459 -9.679 11.508 1.00 5.00 -ATOM 18 CB PHE A 9 6.297 -6.707 11.824 1.00 5.00 -ATOM 19 CA LEU A 10 6.976 -13.151 11.385 1.00 5.00 -ATOM 20 CB LEU A 10 8.359 -14.250 10.142 1.00 5.00 -ATOM 21 CA ILE A 11 8.832 -11.765 14.458 1.00 5.00 -ATOM 22 CB ILE A 11 8.805 -10.284 14.844 1.00 5.00 -ATOM 23 CA ASP A 12 11.614 -13.630 16.456 1.00 5.00 -ATOM 24 CB ASP A 12 13.121 -14.960 16.258 1.00 5.00 -ATOM 25 CA ASP A 13 11.029 -14.127 20.082 1.00 5.00 -ATOM 26 CB ASP A 13 10.003 -15.987 20.467 1.00 5.00 -ATOM 27 CA ALA A 14 14.621 -13.726 21.292 1.00 5.00 -ATOM 28 CB ALA A 14 15.422 -14.028 21.303 1.00 5.00 -ATOM 29 CA TRP A 15 14.036 -10.098 20.130 1.00 5.00 -ATOM 30 CB TRP A 15 16.285 -9.751 17.636 1.00 5.00 -ATOM 31 CA ARG A 16 10.999 -9.080 22.202 1.00 5.00 -ATOM 32 CB ARG A 16 8.286 -9.870 24.069 1.00 5.00 -ATOM 33 CA PRO A 17 12.796 -7.116 24.981 1.00 5.00 -ATOM 34 CB PRO A 17 13.572 -8.252 25.197 1.00 5.00 -ATOM 35 CA LEU A 18 13.760 -4.481 22.511 1.00 5.00 -ATOM 36 CB LEU A 18 15.739 -4.865 22.429 1.00 5.00 -ATOM 37 CA MET A 19 10.616 -4.621 20.518 1.00 5.00 -ATOM 38 CB MET A 19 11.154 -6.353 19.406 1.00 5.00 -ATOM 39 CA GLU A 20 8.051 -4.669 23.436 1.00 5.00 -ATOM 40 CB GLU A 20 8.272 -5.577 25.667 1.00 5.00 -ATOM 41 CA PRO A 21 9.563 -1.700 24.927 1.00 5.00 -ATOM 42 CB PRO A 21 10.419 -2.746 25.299 1.00 5.00 -ATOM 43 CA GLU A 22 8.502 0.312 21.981 1.00 5.00 -ATOM 44 CB GLU A 22 8.928 2.598 21.193 1.00 5.00 -ATOM 45 CA LEU A 23 5.044 -1.276 22.010 1.00 5.00 -ATOM 46 CB LEU A 23 3.770 -2.423 20.916 1.00 5.00 -ATOM 47 CA ALA A 24 4.004 0.877 24.843 1.00 5.00 -ATOM 48 CB ALA A 24 4.048 0.785 25.591 1.00 5.00 -ATOM 49 CA ASN A 25 4.357 4.464 23.434 1.00 5.00 -ATOM 50 CB ASN A 25 5.441 4.663 21.804 1.00 5.00 -ATOM 51 CA PRO A 26 1.691 5.382 21.254 1.00 5.00 -ATOM 52 CB PRO A 26 1.076 5.802 22.488 1.00 5.00 -ATOM 53 CA LEU A 27 3.879 7.081 18.653 1.00 5.00 -ATOM 54 CB LEU A 27 5.639 7.860 17.540 1.00 5.00 -ATOM 55 CA THR A 28 4.695 3.638 17.585 1.00 5.00 -ATOM 56 CB THR A 28 5.620 2.568 18.064 1.00 5.00 -ATOM 57 CA ALA A 29 1.069 2.440 17.491 1.00 5.00 -ATOM 58 CB ALA A 29 0.932 2.653 18.238 1.00 5.00 -ATOM 59 CA HIS A 30 0.485 5.383 15.143 1.00 5.00 -ATOM 60 CB HIS A 30 0.177 8.023 15.062 1.00 5.00 -ATOM 61 CA LEU A 31 3.656 4.296 13.228 1.00 5.00 -ATOM 62 CB LEU A 31 5.654 4.173 13.947 1.00 5.00 -ATOM 63 CA LEU A 32 2.011 0.882 12.832 1.00 5.00 -ATOM 64 CB LEU A 32 3.001 -0.825 13.351 1.00 5.00 -ATOM 65 CA ALA A 33 -1.263 1.977 11.212 1.00 5.00 -ATOM 66 CB ALA A 33 -1.303 2.478 11.808 1.00 5.00 -ATOM 67 CA GLU A 34 0.271 4.728 8.777 1.00 5.00 -ATOM 68 CB GLU A 34 0.393 6.953 10.491 1.00 5.00 -ATOM 69 CA TYR A 35 1.877 1.842 6.635 1.00 5.00 -ATOM 70 CB TYR A 35 3.770 -0.451 8.165 1.00 5.00 -ATOM 71 CA ASN A 36 -1.094 -0.327 7.199 1.00 5.00 -ATOM 72 CB ASN A 36 -2.409 -1.701 8.049 1.00 5.00 -ATOM 73 CA ARG A 37 -3.200 2.262 5.624 1.00 5.00 -ATOM 74 CB ARG A 37 -5.926 3.741 6.699 1.00 5.00 -ATOM 75 CA ARG A 38 -0.498 3.148 2.968 1.00 5.00 -ATOM 76 CB ARG A 38 1.121 5.744 4.291 1.00 5.00 -ATOM 77 CA CYS A 39 -0.049 -0.619 2.288 1.00 5.00 -ATOM 78 CB CYS A 39 0.653 -1.161 3.334 1.00 5.00 -ATOM 79 CA GLN A 40 -3.705 -0.948 1.208 1.00 5.00 -ATOM 80 CB GLN A 40 -6.130 0.324 1.776 1.00 5.00 -ATOM 81 CA THR A 41 -3.366 1.510 -1.387 1.00 5.00 -ATOM 82 CB THR A 41 -4.162 2.630 -0.957 1.00 5.00 -ATOM 83 CA GLU A 42 0.301 0.942 -2.387 1.00 5.00 -ATOM 84 CB GLU A 42 1.208 2.311 -0.585 1.00 5.00 -ATOM 85 CA GLU A 43 2.832 -1.536 -3.227 1.00 5.00 -ATOM 86 CB GLU A 43 4.497 -2.113 -4.855 1.00 5.00 -ATOM 87 CA VAL A 44 5.282 -1.151 -0.301 1.00 5.00 -ATOM 88 CB VAL A 44 4.759 -0.653 1.030 1.00 5.00 -ATOM 89 CA LEU A 45 8.719 -2.644 -1.612 1.00 5.00 -ATOM 90 CB LEU A 45 10.108 -3.163 -3.082 1.00 5.00 -ATOM 91 CA PRO A 46 9.503 -4.645 1.405 1.00 5.00 -ATOM 92 CB PRO A 46 8.648 -3.640 1.913 1.00 5.00 -ATOM 93 CA PRO A 47 7.445 -8.067 1.572 1.00 5.00 -ATOM 94 CB PRO A 47 8.632 -8.607 0.990 1.00 5.00 -ATOM 95 CA ARG A 48 5.565 -8.098 4.858 1.00 5.00 -ATOM 96 CB ARG A 48 4.143 -6.464 7.462 1.00 5.00 -ATOM 97 CA GLU A 49 7.072 -11.253 6.374 1.00 5.00 -ATOM 98 CB GLU A 49 5.591 -13.314 6.545 1.00 5.00 -ATOM 99 CA ASP A 50 10.647 -9.985 5.210 1.00 5.00 -ATOM 100 CB ASP A 50 12.030 -10.861 3.968 1.00 5.00 -ATOM 101 CA VAL A 51 10.526 -6.488 6.638 1.00 5.00 -ATOM 102 CB VAL A 51 9.176 -5.789 6.526 1.00 5.00 -ATOM 103 CA PHE A 52 11.555 -7.638 10.358 1.00 5.00 -ATOM 104 CB PHE A 52 11.261 -5.829 12.700 1.00 5.00 -ATOM 105 CA SER A 53 13.917 -10.070 8.628 1.00 5.00 -ATOM 106 CB SER A 53 13.897 -10.108 7.276 1.00 5.00 -ATOM 107 CA TRP A 54 16.811 -8.488 10.399 1.00 5.00 -ATOM 108 CB TRP A 54 16.364 -4.904 10.799 1.00 5.00 -ATOM 109 CA THR A 55 15.263 -10.685 13.232 1.00 5.00 -ATOM 110 CB THR A 55 14.317 -10.000 13.918 1.00 5.00 -ATOM 111 CA ARG A 56 15.323 -13.995 11.887 1.00 5.00 -ATOM 112 CB ARG A 56 12.375 -15.858 11.786 1.00 5.00 -ATOM 113 CA TYR A 57 19.097 -14.261 11.280 1.00 5.00 -ATOM 114 CB TYR A 57 18.095 -11.983 9.134 1.00 5.00 -ATOM 115 CA CYS A 58 20.662 -13.388 14.536 1.00 5.00 -ATOM 116 CB CYS A 58 21.408 -12.357 14.041 1.00 5.00 -ATOM 117 CA THR A 59 19.633 -12.852 18.117 1.00 5.00 -ATOM 118 CB THR A 59 19.590 -13.991 19.040 1.00 5.00 -ATOM 119 CA PRO A 60 20.176 -9.857 20.546 1.00 5.00 -ATOM 120 CB PRO A 60 18.871 -10.343 20.977 1.00 5.00 -ATOM 121 CA ASP A 61 23.040 -11.445 22.499 1.00 5.00 -ATOM 122 CB ASP A 61 22.092 -11.352 24.282 1.00 5.00 -ATOM 123 CA GLU A 62 24.301 -13.127 19.230 1.00 5.00 -ATOM 124 CB GLU A 62 23.497 -14.615 17.429 1.00 5.00 -ATOM 125 CA VAL A 63 24.609 -9.591 17.573 1.00 5.00 -ATOM 126 CB VAL A 63 23.418 -8.681 17.647 1.00 5.00 -ATOM 127 CA ARG A 64 28.384 -8.616 16.787 1.00 5.00 -ATOM 128 CB ARG A 64 28.900 -11.680 16.091 1.00 5.00 -ATOM 129 CA VAL A 65 28.547 -5.915 13.983 1.00 5.00 -ATOM 130 CB VAL A 65 29.659 -5.371 13.097 1.00 5.00 -ATOM 131 CA VAL A 66 25.478 -3.455 13.499 1.00 5.00 -ATOM 132 CB VAL A 66 24.597 -3.319 14.701 1.00 5.00 -ATOM 133 CA ILE A 67 25.810 -1.904 9.657 1.00 5.00 -ATOM 134 CB ILE A 67 26.873 -2.650 8.302 1.00 5.00 -ATOM 135 CA ILE A 68 23.098 1.022 9.380 1.00 5.00 -ATOM 136 CB ILE A 68 23.274 2.676 10.394 1.00 5.00 -ATOM 137 CA GLY A 69 21.739 2.225 6.026 1.00 5.00 -ATOM 138 CA GLN A 70 19.150 4.773 4.804 1.00 5.00 -ATOM 139 CB GLN A 70 20.488 5.804 2.757 1.00 5.00 -ATOM 140 CA ASP A 71 16.107 2.889 3.362 1.00 5.00 -ATOM 141 CB ASP A 71 16.616 4.152 1.896 1.00 5.00 -ATOM 142 CA PRO A 72 15.078 -0.389 1.648 1.00 5.00 -ATOM 143 CB PRO A 72 14.239 -0.267 2.720 1.00 5.00 -ATOM 144 CA TYR A 73 16.043 0.182 -2.013 1.00 5.00 -ATOM 145 CB TYR A 73 18.557 -1.831 -1.414 1.00 5.00 -ATOM 146 CA HIS A 74 12.508 0.003 -3.777 1.00 5.00 -ATOM 147 CB HIS A 74 13.015 1.654 -5.809 1.00 5.00 -ATOM 148 CA HIS A 75 12.960 -1.644 -7.044 1.00 5.00 -ATOM 149 CB HIS A 75 15.817 -1.861 -7.136 1.00 5.00 -ATOM 150 CA PRO A 76 11.335 -4.967 -7.788 1.00 5.00 -ATOM 151 CB PRO A 76 11.726 -4.882 -9.140 1.00 5.00 -ATOM 152 CA GLY A 77 12.640 -8.083 -5.865 1.00 5.00 -ATOM 153 CA GLN A 78 15.546 -5.955 -4.735 1.00 5.00 -ATOM 154 CB GLN A 78 15.504 -3.849 -4.058 1.00 5.00 -ATOM 155 CA ALA A 79 15.591 -5.226 -0.944 1.00 5.00 -ATOM 156 CB ALA A 79 14.799 -5.263 -0.740 1.00 5.00 -ATOM 157 CA HIS A 80 15.382 -8.326 1.371 1.00 5.00 -ATOM 158 CB HIS A 80 17.841 -9.439 1.360 1.00 5.00 -ATOM 159 CA GLY A 81 14.906 -6.159 4.410 1.00 5.00 -ATOM 160 CA LEU A 82 18.542 -6.132 5.523 1.00 5.00 -ATOM 161 CB LEU A 82 19.834 -7.722 5.929 1.00 5.00 -ATOM 162 CA ALA A 83 20.274 -2.719 4.918 1.00 5.00 -ATOM 163 CB ALA A 83 20.558 -2.487 5.673 1.00 5.00 -ATOM 164 CA PHE A 84 22.541 -3.239 1.674 1.00 5.00 -ATOM 165 CB PHE A 84 24.291 -1.387 3.354 1.00 5.00 -ATOM 166 CA SER A 85 21.341 -7.006 1.081 1.00 5.00 -ATOM 167 CB SER A 85 20.239 -6.277 1.269 1.00 5.00 -ATOM 168 CA VAL A 86 20.060 -7.772 -2.272 1.00 5.00 -ATOM 169 CB VAL A 86 20.951 -7.410 -3.444 1.00 5.00 -ATOM 170 CA ARG A 87 18.075 -11.092 -3.015 1.00 5.00 -ATOM 171 CB ARG A 87 16.122 -12.287 -0.580 1.00 5.00 -ATOM 172 CA ALA A 88 20.494 -13.819 -4.577 1.00 5.00 -ATOM 173 CB ALA A 88 20.533 -14.612 -4.473 1.00 5.00 -ATOM 174 CA ASN A 89 19.480 -12.845 -7.922 1.00 5.00 -ATOM 175 CB ASN A 89 17.592 -11.963 -7.937 1.00 5.00 -ATOM 176 CA VAL A 90 20.222 -8.986 -8.057 1.00 5.00 -ATOM 177 CB VAL A 90 18.979 -8.197 -7.575 1.00 5.00 -ATOM 178 CA PRO A 91 23.470 -7.672 -9.500 1.00 5.00 -ATOM 179 CB PRO A 91 22.610 -6.989 -10.427 1.00 5.00 -ATOM 180 CA PRO A 92 25.433 -5.766 -6.834 1.00 5.00 -ATOM 181 CB PRO A 92 26.443 -6.614 -7.291 1.00 5.00 -ATOM 182 CA PRO A 93 24.211 -2.132 -7.257 1.00 5.00 -ATOM 183 CB PRO A 93 23.300 -2.748 -6.293 1.00 5.00 -ATOM 184 CA PRO A 94 27.020 0.454 -7.315 1.00 5.00 -ATOM 185 CB PRO A 94 26.066 1.259 -7.860 1.00 5.00 -ATOM 186 CA SER A 95 26.860 0.808 -3.606 1.00 5.00 -ATOM 187 CB SER A 95 27.018 2.106 -3.570 1.00 5.00 -ATOM 188 CA LEU A 96 27.176 -2.833 -2.827 1.00 5.00 -ATOM 189 CB LEU A 96 25.540 -3.920 -2.052 1.00 5.00 -ATOM 190 CA ARG A 97 29.818 -3.389 -5.018 1.00 5.00 -ATOM 191 CB ARG A 97 30.706 -1.724 -7.902 1.00 5.00 -ATOM 192 CA ASN A 98 31.824 -0.620 -3.743 1.00 5.00 -ATOM 193 CB ASN A 98 32.403 1.083 -3.051 1.00 5.00 -ATOM 194 CA VAL A 99 31.165 -2.088 -0.115 1.00 5.00 -ATOM 195 CB VAL A 99 29.917 -1.932 0.801 1.00 5.00 -ATOM 196 CA LEU A 100 32.242 -5.571 -1.586 1.00 5.00 -ATOM 197 CB LEU A 100 30.318 -6.490 -2.284 1.00 5.00 -ATOM 198 CA ALA A 101 35.579 -4.271 -2.975 1.00 5.00 -ATOM 199 CB ALA A 101 35.398 -3.721 -3.510 1.00 5.00 -ATOM 200 CA ALA A 102 36.534 -2.657 0.222 1.00 5.00 -ATOM 201 CB ALA A 102 36.125 -2.334 0.819 1.00 5.00 -ATOM 202 CA VAL A 103 35.980 -6.185 1.791 1.00 5.00 -ATOM 203 CB VAL A 103 34.775 -7.044 1.815 1.00 5.00 -ATOM 204 CA LYS A 104 38.016 -7.734 -1.140 1.00 5.00 -ATOM 205 CB LYS A 104 38.594 -5.970 -3.499 1.00 5.00 -ATOM 206 CA ASN A 105 40.509 -5.082 -0.162 1.00 5.00 -ATOM 207 CB ASN A 105 40.611 -3.240 -0.479 1.00 5.00 -ATOM 208 CA CYS A 106 40.901 -5.632 3.600 1.00 5.00 -ATOM 209 CB CYS A 106 39.889 -4.676 4.054 1.00 5.00 -ATOM 210 CA TYR A 107 41.430 -9.676 3.161 1.00 5.00 -ATOM 211 CB TYR A 107 38.134 -10.319 3.381 1.00 5.00 -ATOM 212 CA PRO A 108 43.682 -10.486 0.393 1.00 5.00 -ATOM 213 CB PRO A 108 44.513 -9.495 0.995 1.00 5.00 -ATOM 214 CA GLU A 109 42.450 -14.263 0.167 1.00 5.00 -ATOM 215 CB GLU A 109 42.511 -15.703 2.231 1.00 5.00 -ATOM 216 CA ALA A 110 38.918 -13.644 0.280 1.00 5.00 -ATOM 217 CB ALA A 110 38.804 -12.902 0.419 1.00 5.00 -ATOM 218 CA ARG A 111 36.620 -16.059 -2.065 1.00 5.00 -ATOM 219 CB ARG A 111 37.849 -18.998 -3.189 1.00 5.00 -ATOM 220 CA MET A 112 33.903 -13.419 -3.086 1.00 5.00 -ATOM 221 CB MET A 112 34.215 -11.432 -2.414 1.00 5.00 -ATOM 222 CA SER A 113 30.884 -15.164 -4.624 1.00 5.00 -ATOM 223 CB SER A 113 29.759 -15.275 -4.012 1.00 5.00 -ATOM 224 CA GLY A 114 30.112 -12.088 -6.945 1.00 5.00 -ATOM 225 CA HIS A 115 26.661 -11.391 -5.279 1.00 5.00 -ATOM 226 CB HIS A 115 24.644 -12.196 -6.751 1.00 5.00 -ATOM 227 CA GLY A 116 25.071 -9.085 -2.942 1.00 5.00 -ATOM 228 CA CYS A 117 23.090 -11.632 -0.695 1.00 5.00 -ATOM 229 CB CYS A 117 23.653 -12.813 -0.535 1.00 5.00 -ATOM 230 CA LEU A 118 24.099 -9.933 2.682 1.00 5.00 -ATOM 231 CB LEU A 118 24.423 -7.969 2.277 1.00 5.00 -ATOM 232 CA GLU A 119 22.249 -12.656 4.680 1.00 5.00 -ATOM 233 CB GLU A 119 19.895 -12.888 5.079 1.00 5.00 -ATOM 234 CA LYS A 120 25.172 -14.848 5.484 1.00 5.00 -ATOM 235 CB LYS A 120 27.031 -16.102 3.415 1.00 5.00 -ATOM 236 CA TRP A 121 26.598 -11.570 7.120 1.00 5.00 -ATOM 237 CB TRP A 121 28.330 -9.013 4.960 1.00 5.00 -ATOM 238 CA ALA A 122 23.612 -11.605 9.621 1.00 5.00 -ATOM 239 CB ALA A 122 22.804 -11.380 9.679 1.00 5.00 -ATOM 240 CA ARG A 123 24.113 -15.125 10.376 1.00 5.00 -ATOM 241 CB ARG A 123 21.981 -16.580 12.907 1.00 5.00 -ATOM 242 CA ASP A 124 27.616 -14.220 11.205 1.00 5.00 -ATOM 243 CB ASP A 124 29.445 -14.641 11.075 1.00 5.00 -ATOM 244 CA GLY A 125 26.326 -12.142 14.192 1.00 5.00 -ATOM 245 CA VAL A 126 26.213 -8.739 11.983 1.00 5.00 -ATOM 246 CB VAL A 126 27.292 -8.866 10.910 1.00 5.00 -ATOM 247 CA LEU A 127 22.905 -6.770 12.040 1.00 5.00 -ATOM 248 CB LEU A 127 21.083 -6.320 13.015 1.00 5.00 -ATOM 249 CA LEU A 128 22.321 -4.793 8.804 1.00 5.00 -ATOM 250 CB LEU A 128 23.801 -6.014 7.812 1.00 5.00 -ATOM 251 CA LEU A 129 19.653 -2.243 9.718 1.00 5.00 -ATOM 252 CB LEU A 129 19.891 -1.916 11.665 1.00 5.00 -ATOM 253 CA ASN A 130 17.742 0.036 7.553 1.00 5.00 -ATOM 254 CB ASN A 130 16.487 -1.236 6.749 1.00 5.00 -ATOM 255 CA THR A 131 16.383 3.295 9.190 1.00 5.00 -ATOM 256 CB THR A 131 17.221 4.155 8.291 1.00 5.00 -ATOM 257 CA THR A 132 13.638 3.129 6.640 1.00 5.00 -ATOM 258 CB THR A 132 13.229 3.956 5.489 1.00 5.00 -ATOM 259 CA LEU A 133 11.915 -0.053 7.087 1.00 5.00 -ATOM 260 CB LEU A 133 12.245 -1.511 8.520 1.00 5.00 -ATOM 261 CA THR A 134 9.455 0.339 3.964 1.00 5.00 -ATOM 262 CB THR A 134 8.554 1.222 4.653 1.00 5.00 -ATOM 263 CA VAL A 135 9.461 1.760 0.477 1.00 5.00 -ATOM 264 CB VAL A 135 10.696 0.961 0.124 1.00 5.00 -ATOM 265 CA LYS A 136 7.339 2.553 -2.595 1.00 5.00 -ATOM 266 CB LYS A 136 5.265 4.113 -2.683 1.00 5.00 -ATOM 267 CA ARG A 137 7.704 0.496 -5.748 1.00 5.00 -ATOM 268 CB ARG A 137 8.603 -1.595 -8.352 1.00 5.00 -ATOM 269 CA GLY A 138 9.521 3.026 -7.585 1.00 5.00 -ATOM 270 CA ALA A 139 9.329 5.916 -5.016 1.00 5.00 -ATOM 271 CB ALA A 139 8.810 5.487 -5.203 1.00 5.00 -ATOM 272 CA ALA A 140 12.608 6.208 -3.161 1.00 5.00 -ATOM 273 CB ALA A 140 13.060 6.865 -3.346 1.00 5.00 -ATOM 274 CA ALA A 141 12.249 7.591 0.279 1.00 5.00 -ATOM 275 CB ALA A 141 12.057 8.330 0.049 1.00 5.00 -ATOM 276 CA SER A 142 8.620 7.657 0.617 1.00 5.00 -ATOM 277 CB SER A 142 7.820 7.187 -0.293 1.00 5.00 -ATOM 278 CA HIS A 143 7.748 6.240 3.878 1.00 5.00 -ATOM 279 CB HIS A 143 5.549 4.798 3.743 1.00 5.00 -ATOM 280 CA SER A 144 10.724 7.892 5.743 1.00 5.00 -ATOM 281 CB SER A 144 11.070 8.235 4.438 1.00 5.00 -ATOM 282 CA ARG A 145 8.439 10.883 6.228 1.00 5.00 -ATOM 283 CB ARG A 145 8.588 12.811 3.535 1.00 5.00 -ATOM 284 CA ILE A 146 6.263 8.374 8.509 1.00 5.00 -ATOM 285 CB ILE A 146 5.232 6.838 8.177 1.00 5.00 -ATOM 286 CA GLY A 147 8.322 7.661 11.877 1.00 5.00 -ATOM 287 CA TRP A 148 9.937 4.216 11.558 1.00 5.00 -ATOM 288 CB TRP A 148 9.037 1.163 10.454 1.00 5.00 -ATOM 289 CA ASP A 149 13.363 5.575 12.431 1.00 5.00 -ATOM 290 CB ASP A 149 14.247 6.956 11.159 1.00 5.00 -ATOM 291 CA ARG A 150 11.695 6.975 15.459 1.00 5.00 -ATOM 292 CB ARG A 150 10.425 7.881 18.218 1.00 5.00 -ATOM 293 CA PHE A 151 11.129 3.258 16.601 1.00 5.00 -ATOM 294 CB PHE A 151 9.752 0.757 15.913 1.00 5.00 -ATOM 295 CA VAL A 152 14.257 1.783 14.704 1.00 5.00 -ATOM 296 CB VAL A 152 13.679 1.553 13.332 1.00 5.00 -ATOM 297 CA GLY A 153 16.323 4.357 16.871 1.00 5.00 -ATOM 298 CA GLY A 154 14.753 2.783 20.031 1.00 5.00 -ATOM 299 CA VAL A 155 15.643 -0.910 19.996 1.00 5.00 -ATOM 300 CB VAL A 155 15.050 -1.547 18.809 1.00 5.00 -ATOM 301 CA ILE A 156 19.138 0.273 18.902 1.00 5.00 -ATOM 302 CB ILE A 156 18.941 1.058 17.186 1.00 5.00 -ATOM 303 CA ARG A 157 19.275 2.444 21.838 1.00 5.00 -ATOM 304 CB ARG A 157 20.492 5.372 21.968 1.00 5.00 -ATOM 305 CA ARG A 158 18.556 -0.523 24.250 1.00 5.00 -ATOM 306 CB ARG A 158 15.996 -0.328 26.645 1.00 5.00 -ATOM 307 CA LEU A 159 21.219 -2.622 22.492 1.00 5.00 -ATOM 308 CB LEU A 159 22.141 -3.775 20.892 1.00 5.00 -ATOM 309 CA ALA A 160 23.445 0.072 23.302 1.00 5.00 -ATOM 310 CB ALA A 160 23.756 0.634 22.895 1.00 5.00 -ATOM 311 CA ALA A 161 23.136 -0.685 27.183 1.00 5.00 -ATOM 312 CB ALA A 161 22.486 -0.363 27.341 1.00 5.00 -ATOM 313 CA ARG A 162 22.367 -4.446 26.480 1.00 5.00 -ATOM 314 CB ARG A 162 20.438 -7.235 25.778 1.00 5.00 -ATOM 315 CA ARG A 163 25.530 -5.849 24.751 1.00 5.00 -ATOM 316 CB ARG A 163 27.342 -8.041 22.576 1.00 5.00 -ATOM 317 CA PRO A 164 28.523 -4.096 25.725 1.00 5.00 -ATOM 318 CB PRO A 164 28.500 -4.609 26.967 1.00 5.00 -ATOM 319 CA GLY A 165 31.031 -4.820 22.873 1.00 5.00 -ATOM 320 CA LEU A 166 30.016 -4.328 19.486 1.00 5.00 -ATOM 321 CB LEU A 166 28.237 -5.180 19.129 1.00 5.00 -ATOM 322 CA VAL A 167 30.967 -2.505 16.352 1.00 5.00 -ATOM 323 CB VAL A 167 32.242 -2.498 15.660 1.00 5.00 -ATOM 324 CA PHE A 168 28.985 0.109 14.528 1.00 5.00 -ATOM 325 CB PHE A 168 26.839 0.008 16.466 1.00 5.00 -ATOM 326 CA MET A 169 30.623 0.855 11.263 1.00 5.00 -ATOM 327 CB MET A 169 31.090 -0.727 9.983 1.00 5.00 -ATOM 328 CA LEU A 170 28.406 3.843 10.277 1.00 5.00 -ATOM 329 CB LEU A 170 27.716 4.048 12.121 1.00 5.00 -ATOM 330 CA TRP A 171 28.718 4.903 6.606 1.00 5.00 -ATOM 331 CB TRP A 171 29.422 1.708 5.780 1.00 5.00 -ATOM 332 CA GLY A 172 27.307 8.582 5.601 1.00 5.00 -ATOM 333 CA THR A 173 26.859 11.733 7.571 1.00 5.00 -ATOM 334 CB THR A 173 27.813 12.854 7.398 1.00 5.00 -ATOM 335 CA HIS A 174 23.041 11.114 7.433 1.00 5.00 -ATOM 336 CB HIS A 174 20.989 9.585 6.253 1.00 5.00 -ATOM 337 CA ALA A 175 23.871 7.647 9.012 1.00 5.00 -ATOM 338 CB ALA A 175 24.279 7.108 8.794 1.00 5.00 -ATOM 339 CA GLN A 176 26.376 9.034 11.388 1.00 5.00 -ATOM 340 CB GLN A 176 28.286 9.116 9.869 1.00 5.00 -ATOM 341 CA ASN A 177 24.102 11.776 12.368 1.00 5.00 -ATOM 342 CB ASN A 177 24.683 13.042 10.761 1.00 5.00 -ATOM 343 CA ALA A 178 21.396 9.011 13.116 1.00 5.00 -ATOM 344 CB ALA A 178 21.491 8.478 12.617 1.00 5.00 -ATOM 345 CA ILE A 179 23.490 6.527 15.762 1.00 5.00 -ATOM 346 CB ILE A 179 22.937 4.803 15.450 1.00 5.00 -ATOM 347 CA ARG A 180 25.672 7.991 18.510 1.00 5.00 -ATOM 348 CB ARG A 180 27.617 10.155 16.418 1.00 5.00 -ATOM 349 CA PRO A 181 26.148 4.935 20.928 1.00 5.00 -ATOM 350 CB PRO A 181 26.317 4.520 19.653 1.00 5.00 -ATOM 351 CA ASP A 182 28.696 5.379 23.535 1.00 5.00 -ATOM 352 CB ASP A 182 26.860 5.488 24.366 1.00 5.00 -ATOM 353 CA PRO A 183 32.295 5.131 22.114 1.00 5.00 -ATOM 354 CB PRO A 183 31.907 6.210 21.305 1.00 5.00 -ATOM 355 CA ARG A 184 33.924 4.094 25.402 1.00 5.00 -ATOM 356 CB ARG A 184 33.981 7.372 25.763 1.00 5.00 -ATOM 357 CA VAL A 185 31.280 1.032 25.493 1.00 5.00 -ATOM 358 CB VAL A 185 30.291 0.173 26.153 1.00 5.00 -ATOM 359 CA HIS A 186 31.145 0.163 21.740 1.00 5.00 -ATOM 360 CB HIS A 186 28.782 -1.197 21.694 1.00 5.00 -ATOM 361 CA CYS A 187 33.487 0.659 18.734 1.00 5.00 -ATOM 362 CB CYS A 187 34.803 0.334 18.223 1.00 5.00 -ATOM 363 CA VAL A 188 31.660 3.143 16.330 1.00 5.00 -ATOM 364 CB VAL A 188 30.711 4.312 16.389 1.00 5.00 -ATOM 365 CA LEU A 189 33.726 3.335 13.037 1.00 5.00 -ATOM 366 CB LEU A 189 34.658 1.438 12.840 1.00 5.00 -ATOM 367 CA LYS A 190 31.851 6.157 11.289 1.00 5.00 -ATOM 368 CB LYS A 190 33.132 6.587 14.021 1.00 5.00 -ATOM 369 CA PHE A 191 32.759 6.628 7.673 1.00 5.00 -ATOM 370 CB PHE A 191 35.439 5.355 6.962 1.00 5.00 -ATOM 371 CA SER A 192 32.268 8.458 4.353 1.00 5.00 -ATOM 372 CB SER A 192 33.491 8.897 4.195 1.00 5.00 -ATOM 373 CA HIS A 193 29.877 6.876 1.604 1.00 5.00 -ATOM 374 CB HIS A 193 29.202 9.398 0.684 1.00 5.00 -ATOM 375 CA PRO A 194 29.231 3.641 0.047 1.00 5.00 -ATOM 376 CB PRO A 194 28.537 3.294 1.302 1.00 5.00 -ATOM 377 CA SER A 195 28.352 5.319 -3.165 1.00 5.00 -ATOM 378 CB SER A 195 28.181 6.587 -2.941 1.00 5.00 -ATOM 379 CA PRO A 196 30.717 6.687 -5.747 1.00 5.00 -ATOM 380 CB PRO A 196 29.812 5.710 -6.330 1.00 5.00 -ATOM 381 CA LEU A 197 30.107 10.434 -5.151 1.00 5.00 -ATOM 382 CB LEU A 197 29.474 12.384 -5.238 1.00 5.00 -ATOM 383 CA SER A 198 32.407 10.593 -2.106 1.00 5.00 -ATOM 384 CB SER A 198 32.440 9.306 -2.145 1.00 5.00 -ATOM 385 CA LYS A 199 35.811 11.798 -0.978 1.00 5.00 -ATOM 386 CB LYS A 199 37.660 14.252 -0.743 1.00 5.00 -ATOM 387 CA VAL A 200 37.807 8.602 -0.625 1.00 5.00 -ATOM 388 CB VAL A 200 37.355 7.864 0.514 1.00 5.00 -ATOM 389 CA PRO A 201 36.388 6.156 -3.115 1.00 5.00 -ATOM 390 CB PRO A 201 37.784 5.984 -3.639 1.00 5.00 -ATOM 391 CA PHE A 202 35.212 3.557 -0.467 1.00 5.00 -ATOM 392 CB PHE A 202 33.228 4.146 1.965 1.00 5.00 -ATOM 393 CA GLY A 203 37.980 1.083 -1.314 1.00 5.00 -ATOM 394 CA THR A 204 40.255 1.634 1.679 1.00 5.00 -ATOM 395 CB THR A 204 41.522 2.402 1.706 1.00 5.00 -ATOM 396 CA CYS A 205 37.712 0.996 4.418 1.00 5.00 -ATOM 397 CB CYS A 205 36.367 0.766 4.466 1.00 5.00 -ATOM 398 CA GLN A 206 39.763 -1.131 6.711 1.00 5.00 -ATOM 399 CB GLN A 206 42.518 -1.532 6.544 1.00 5.00 -ATOM 400 CA HIS A 207 36.733 -1.048 8.876 1.00 5.00 -ATOM 401 CB HIS A 207 34.801 0.751 8.258 1.00 5.00 -ATOM 402 CA PHE A 208 36.215 -4.839 9.003 1.00 5.00 -ATOM 403 CB PHE A 208 34.617 -4.214 6.562 1.00 5.00 -ATOM 404 CA LEU A 209 39.990 -5.152 9.814 1.00 5.00 -ATOM 405 CB LEU A 209 41.399 -6.117 8.571 1.00 5.00 -ATOM 406 CA VAL A 210 39.043 -2.767 12.667 1.00 5.00 -ATOM 407 CB VAL A 210 39.454 -1.346 12.643 1.00 5.00 -ATOM 408 CA ALA A 211 35.775 -4.952 13.250 1.00 5.00 -ATOM 409 CB ALA A 211 35.440 -5.027 12.502 1.00 5.00 -ATOM 410 CA ASN A 212 38.284 -7.811 13.432 1.00 5.00 -ATOM 411 CB ASN A 212 38.431 -8.417 11.547 1.00 5.00 -ATOM 412 CA ARG A 213 40.586 -5.950 15.600 1.00 5.00 -ATOM 413 CB ARG A 213 42.106 -6.924 13.561 1.00 5.00 -ATOM 414 CA TYR A 214 38.418 -4.385 18.110 1.00 5.00 -ATOM 415 CB TYR A 214 35.326 -3.597 19.238 1.00 5.00 -ATOM 416 CA LEU A 215 36.444 -7.627 18.370 1.00 5.00 -ATOM 417 CB LEU A 215 34.652 -7.673 17.332 1.00 5.00 -ATOM 418 CA GLU A 216 39.983 -9.427 18.871 1.00 5.00 -ATOM 419 CB GLU A 216 41.585 -9.588 16.653 1.00 5.00 -ATOM 420 CA THR A 217 40.226 -7.385 21.856 1.00 5.00 -ATOM 421 CB THR A 217 39.769 -5.976 21.717 1.00 5.00 -ATOM 422 CA ARG A 218 37.444 -9.068 23.737 1.00 5.00 -ATOM 423 CB ARG A 218 34.221 -8.345 22.760 1.00 5.00 -ATOM 424 CA SER A 219 37.112 -12.572 23.172 1.00 5.00 -ATOM 425 CB SER A 219 36.884 -12.954 24.357 1.00 5.00 -ATOM 426 CA ILE A 220 35.294 -13.214 20.005 1.00 5.00 -ATOM 427 CB ILE A 220 33.980 -12.320 19.487 1.00 5.00 -ATOM 428 CA SER A 221 35.436 -14.725 16.760 1.00 5.00 -ATOM 429 CB SER A 221 34.587 -14.744 15.615 1.00 5.00 -ATOM 430 CA PRO A 222 36.634 -12.545 13.602 1.00 5.00 -ATOM 431 CB PRO A 222 37.789 -13.388 13.375 1.00 5.00 -ATOM 432 CA ILE A 223 33.767 -12.042 11.245 1.00 5.00 -ATOM 433 CB ILE A 223 32.641 -10.950 12.231 1.00 5.00 -ATOM 434 CA ASP A 224 34.854 -14.049 8.323 1.00 5.00 -ATOM 435 CB ASP A 224 33.262 -14.626 7.222 1.00 5.00 -ATOM 436 CA TRP A 225 33.808 -11.447 5.777 1.00 5.00 -ATOM 437 CB TRP A 225 32.324 -8.603 6.739 1.00 5.00 -ATOM 438 CA SER A 226 33.512 -13.071 2.218 1.00 5.00 -ATOM 439 CB SER A 226 34.060 -14.083 1.504 1.00 5.00 -ATOM 440 CA VAL A 227 29.997 -13.280 0.717 1.00 5.00 -ATOM 441 CB VAL A 227 28.668 -13.023 1.360 1.00 5.00 +REMARK CLUSTER 5 FREE ENERGY -1.39113E+01 AVE RMSD 0.00 +REMARK clustering ENERGY -1.13166E+01 RMS 0.00 +ATOM 1 CA ASP A 1 18.698 -3.921 -11.027 1.00 5.00 +ATOM 2 CB ASP A 1 17.676 -5.626 -10.923 1.00 5.00 +ATOM 3 CA TRP A 2 16.369 -3.012 -8.165 1.00 5.00 +ATOM 4 CB TRP A 2 16.396 -1.576 -5.046 1.00 5.00 +ATOM 5 CA THR A 3 13.318 -2.570 -10.291 1.00 5.00 +ATOM 6 CB THR A 3 14.065 -2.319 -11.562 1.00 5.00 +ATOM 7 CA THR A 4 11.929 -6.026 -9.486 1.00 5.00 +ATOM 8 CB THR A 4 11.834 -6.959 -10.574 1.00 5.00 +ATOM 9 CA PHE A 5 14.540 -6.581 -6.663 1.00 5.00 +ATOM 10 CB PHE A 5 16.333 -7.818 -4.643 1.00 5.00 +ATOM 11 CA ARG A 6 12.720 -3.563 -4.931 1.00 5.00 +ATOM 12 CB ARG A 6 10.962 -1.000 -3.949 1.00 5.00 +ATOM 13 CA ARG A 7 9.254 -4.836 -5.802 1.00 5.00 +ATOM 14 CB ARG A 7 9.243 -3.614 -8.659 1.00 5.00 +ATOM 15 CA VAL A 8 9.982 -8.489 -4.791 1.00 5.00 +ATOM 16 CB VAL A 8 10.927 -9.671 -4.791 1.00 5.00 +ATOM 17 CA PHE A 9 10.699 -7.651 -0.915 1.00 5.00 +ATOM 18 CB PHE A 9 13.473 -8.535 -0.322 1.00 5.00 +ATOM 19 CA LEU A 10 8.911 -4.537 -1.140 1.00 5.00 +ATOM 20 CB LEU A 10 7.154 -4.018 -2.189 1.00 5.00 +ATOM 21 CA ILE A 11 11.586 -2.098 0.036 1.00 5.00 +ATOM 22 CB ILE A 11 13.090 -3.048 -0.776 1.00 5.00 +ATOM 23 CA ASP A 12 10.387 1.388 0.774 1.00 5.00 +ATOM 24 CB ASP A 12 9.523 2.022 2.474 1.00 5.00 +ATOM 25 CA ASP A 13 12.689 3.517 -1.532 1.00 5.00 +ATOM 26 CB ASP A 13 11.283 4.805 -1.295 1.00 5.00 +ATOM 27 CA ALA A 14 14.707 5.918 1.000 1.00 5.00 +ATOM 28 CB ALA A 14 14.578 5.813 1.698 1.00 5.00 +ATOM 29 CA TRP A 15 16.796 2.702 1.366 1.00 5.00 +ATOM 30 CB TRP A 15 18.274 0.762 4.047 1.00 5.00 +ATOM 31 CA ARG A 16 17.981 2.437 -2.159 1.00 5.00 +ATOM 32 CB ARG A 16 16.232 2.707 -5.124 1.00 5.00 +ATOM 33 CA PRO A 17 21.039 4.754 -1.736 1.00 5.00 +ATOM 34 CB PRO A 17 20.099 5.260 -0.783 1.00 5.00 +ATOM 35 CA LEU A 18 22.470 2.281 0.790 1.00 5.00 +ATOM 36 CB LEU A 18 22.587 1.707 2.495 1.00 5.00 +ATOM 37 CA MET A 19 20.954 -1.128 -0.593 1.00 5.00 +ATOM 38 CB MET A 19 20.022 -3.476 -0.605 1.00 5.00 +ATOM 39 CA GLU A 20 21.573 -0.892 -4.363 1.00 5.00 +ATOM 40 CB GLU A 20 20.193 0.567 -5.818 1.00 5.00 +ATOM 41 CA PRO A 21 25.278 -1.188 -4.215 1.00 5.00 +ATOM 42 CB PRO A 21 24.925 -0.112 -3.358 1.00 5.00 +ATOM 43 CA GLU A 22 25.202 -4.872 -3.226 1.00 5.00 +ATOM 44 CB GLU A 22 24.696 -4.591 -0.569 1.00 5.00 +ATOM 45 CA LEU A 23 22.877 -6.068 -5.773 1.00 5.00 +ATOM 46 CB LEU A 23 21.064 -5.264 -5.185 1.00 5.00 +ATOM 47 CA ALA A 24 25.589 -5.169 -8.248 1.00 5.00 +ATOM 48 CB ALA A 24 26.114 -4.545 -8.378 1.00 5.00 +ATOM 49 CA ASN A 25 28.183 -7.600 -6.496 1.00 5.00 +ATOM 50 CB ASN A 25 29.773 -7.475 -5.253 1.00 5.00 +ATOM 51 CA PRO A 26 28.629 -11.409 -6.879 1.00 5.00 +ATOM 52 CB PRO A 26 29.888 -11.042 -6.326 1.00 5.00 +ATOM 53 CA LEU A 27 27.336 -13.103 -3.932 1.00 5.00 +ATOM 54 CB LEU A 27 27.235 -12.997 -1.854 1.00 5.00 +ATOM 55 CA THR A 28 24.058 -10.882 -4.276 1.00 5.00 +ATOM 56 CB THR A 28 24.740 -9.652 -4.849 1.00 5.00 +ATOM 57 CA ALA A 29 22.353 -12.501 -7.216 1.00 5.00 +ATOM 58 CB ALA A 29 22.551 -12.302 -7.853 1.00 5.00 +ATOM 59 CA HIS A 30 23.463 -15.775 -6.095 1.00 5.00 +ATOM 60 CB HIS A 30 26.136 -15.584 -6.585 1.00 5.00 +ATOM 61 CA LEU A 31 22.177 -15.622 -2.650 1.00 5.00 +ATOM 62 CB LEU A 31 21.688 -14.567 -1.082 1.00 5.00 +ATOM 63 CA LEU A 32 19.006 -14.417 -3.857 1.00 5.00 +ATOM 64 CB LEU A 32 17.448 -13.224 -4.769 1.00 5.00 +ATOM 65 CA ALA A 33 18.847 -17.310 -6.364 1.00 5.00 +ATOM 66 CB ALA A 33 19.121 -17.273 -7.091 1.00 5.00 +ATOM 67 CA GLU A 34 19.954 -19.540 -3.556 1.00 5.00 +ATOM 68 CB GLU A 34 22.263 -19.707 -2.314 1.00 5.00 +ATOM 69 CA TYR A 35 17.360 -18.115 -1.276 1.00 5.00 +ATOM 70 CB TYR A 35 15.557 -15.534 -0.119 1.00 5.00 +ATOM 71 CA ASN A 36 14.673 -18.451 -4.003 1.00 5.00 +ATOM 72 CB ASN A 36 13.469 -16.796 -4.111 1.00 5.00 +ATOM 73 CA ARG A 37 15.668 -22.131 -4.562 1.00 5.00 +ATOM 74 CB ARG A 37 13.753 -24.781 -5.536 1.00 5.00 +ATOM 75 CA ARG A 38 15.202 -22.981 -0.854 1.00 5.00 +ATOM 76 CB ARG A 38 18.212 -23.925 -1.954 1.00 5.00 +ATOM 77 CA CYS A 39 11.784 -21.595 -1.276 1.00 5.00 +ATOM 78 CB CYS A 39 12.035 -20.279 -1.082 1.00 5.00 +ATOM 79 CA GLN A 40 10.770 -24.392 -3.819 1.00 5.00 +ATOM 80 CB GLN A 40 8.844 -24.974 -5.658 1.00 5.00 +ATOM 81 CA THR A 41 11.519 -27.294 -1.706 1.00 5.00 +ATOM 82 CB THR A 41 12.702 -28.200 -1.857 1.00 5.00 +ATOM 83 CA GLU A 42 10.830 -25.369 1.554 1.00 5.00 +ATOM 84 CB GLU A 42 12.287 -24.234 3.076 1.00 5.00 +ATOM 85 CA GLU A 43 8.636 -23.285 4.221 1.00 5.00 +ATOM 86 CB GLU A 43 6.436 -23.948 5.132 1.00 5.00 +ATOM 87 CA VAL A 44 10.778 -20.127 4.805 1.00 5.00 +ATOM 88 CB VAL A 44 11.916 -20.117 3.700 1.00 5.00 +ATOM 89 CA LEU A 45 9.708 -18.094 7.892 1.00 5.00 +ATOM 90 CB LEU A 45 8.733 -17.969 9.652 1.00 5.00 +ATOM 91 CA PRO A 46 9.854 -14.486 6.733 1.00 5.00 +ATOM 92 CB PRO A 46 11.105 -14.923 6.314 1.00 5.00 +ATOM 93 CA PRO A 47 6.737 -14.445 4.755 1.00 5.00 +ATOM 94 CB PRO A 47 6.190 -14.404 6.084 1.00 5.00 +ATOM 95 CA ARG A 48 8.239 -12.924 1.784 1.00 5.00 +ATOM 96 CB ARG A 48 8.589 -15.332 -0.651 1.00 5.00 +ATOM 97 CA GLU A 49 6.604 -9.534 1.653 1.00 5.00 +ATOM 98 CB GLU A 49 5.207 -7.527 1.695 1.00 5.00 +ATOM 99 CA ASP A 50 7.588 -9.227 5.334 1.00 5.00 +ATOM 100 CB ASP A 50 7.601 -10.254 7.154 1.00 5.00 +ATOM 101 CA VAL A 51 11.499 -9.808 4.791 1.00 5.00 +ATOM 102 CB VAL A 51 11.320 -10.908 3.846 1.00 5.00 +ATOM 103 CA PHE A 52 12.541 -6.059 4.384 1.00 5.00 +ATOM 104 CB PHE A 52 15.514 -6.150 3.667 1.00 5.00 +ATOM 105 CA SER A 53 9.956 -4.548 6.679 1.00 5.00 +ATOM 106 CB SER A 53 10.210 -5.325 7.722 1.00 5.00 +ATOM 107 CA TRP A 54 12.960 -2.942 8.352 1.00 5.00 +ATOM 108 CB TRP A 54 16.028 -3.881 7.398 1.00 5.00 +ATOM 109 CA THR A 55 13.358 -0.701 5.546 1.00 5.00 +ATOM 110 CB THR A 55 14.469 -1.083 4.516 1.00 5.00 +ATOM 111 CA ARG A 56 9.740 0.121 5.453 1.00 5.00 +ATOM 112 CB ARG A 56 9.467 -2.686 3.427 1.00 5.00 +ATOM 113 CA TYR A 57 9.752 1.173 9.084 1.00 5.00 +ATOM 114 CB TYR A 57 8.859 -1.862 10.332 1.00 5.00 +ATOM 115 CA CYS A 58 11.933 4.061 8.886 1.00 5.00 +ATOM 116 CB CYS A 58 12.752 3.632 9.945 1.00 5.00 +ATOM 117 CA THR A 59 14.805 5.827 6.901 1.00 5.00 +ATOM 118 CB THR A 59 14.330 7.030 6.192 1.00 5.00 +ATOM 119 CA PRO A 60 18.615 5.690 6.595 1.00 5.00 +ATOM 120 CB PRO A 60 18.435 5.900 5.254 1.00 5.00 +ATOM 121 CA ASP A 61 19.406 9.124 8.030 1.00 5.00 +ATOM 122 CB ASP A 61 19.763 10.741 6.929 1.00 5.00 +ATOM 123 CA GLU A 62 16.395 8.345 10.500 1.00 5.00 +ATOM 124 CB GLU A 62 15.064 10.169 8.933 1.00 5.00 +ATOM 125 CA VAL A 63 17.888 5.116 12.045 1.00 5.00 +ATOM 126 CB VAL A 63 18.536 4.261 11.122 1.00 5.00 +ATOM 127 CA ARG A 64 19.110 6.380 15.395 1.00 5.00 +ATOM 128 CB ARG A 64 17.217 9.459 15.563 1.00 5.00 +ATOM 129 CA VAL A 65 19.835 3.016 16.904 1.00 5.00 +ATOM 130 CB VAL A 65 19.272 3.185 18.333 1.00 5.00 +ATOM 131 CA VAL A 66 20.586 -0.576 15.799 1.00 5.00 +ATOM 132 CB VAL A 66 21.088 -1.150 14.424 1.00 5.00 +ATOM 133 CA ILE A 67 19.872 -3.550 18.211 1.00 5.00 +ATOM 134 CB ILE A 67 18.525 -3.078 19.562 1.00 5.00 +ATOM 135 CA ILE A 68 21.115 -6.845 16.333 1.00 5.00 +ATOM 136 CB ILE A 68 22.927 -7.385 15.826 1.00 5.00 +ATOM 137 CA GLY A 69 19.955 -10.581 16.581 1.00 5.00 +ATOM 138 CA GLN A 70 20.726 -13.818 15.006 1.00 5.00 +ATOM 139 CB GLN A 70 23.242 -13.057 15.944 1.00 5.00 +ATOM 140 CA ASP A 71 17.697 -15.193 13.202 1.00 5.00 +ATOM 141 CB ASP A 71 17.176 -15.811 15.082 1.00 5.00 +ATOM 142 CA PRO A 72 14.072 -14.494 12.409 1.00 5.00 +ATOM 143 CB PRO A 72 14.962 -14.085 11.327 1.00 5.00 +ATOM 144 CA TYR A 73 11.940 -16.709 14.433 1.00 5.00 +ATOM 145 CB TYR A 73 10.818 -14.181 16.327 1.00 5.00 +ATOM 146 CA HIS A 74 11.255 -20.207 13.674 1.00 5.00 +ATOM 147 CB HIS A 74 11.395 -19.494 16.299 1.00 5.00 +ATOM 148 CA HIS A 75 7.476 -20.323 13.557 1.00 5.00 +ATOM 149 CB HIS A 75 5.500 -20.267 15.268 1.00 5.00 +ATOM 150 CA PRO A 76 4.314 -19.456 11.474 1.00 5.00 +ATOM 151 CB PRO A 76 4.417 -20.871 11.474 1.00 5.00 +ATOM 152 CA GLY A 77 3.370 -16.547 13.746 1.00 5.00 +ATOM 153 CA GLN A 78 6.412 -15.358 15.897 1.00 5.00 +ATOM 154 CB GLN A 78 6.652 -14.797 18.338 1.00 5.00 +ATOM 155 CA ALA A 79 7.989 -13.539 13.193 1.00 5.00 +ATOM 156 CB ALA A 79 8.257 -14.073 12.678 1.00 5.00 +ATOM 157 CA HIS A 80 7.654 -10.273 11.141 1.00 5.00 +ATOM 158 CB HIS A 80 6.734 -8.592 13.171 1.00 5.00 +ATOM 159 CA GLY A 81 11.023 -9.555 9.966 1.00 5.00 +ATOM 160 CA LEU A 82 12.125 -7.157 12.846 1.00 5.00 +ATOM 161 CB LEU A 82 12.154 -5.414 12.490 1.00 5.00 +ATOM 162 CA ALA A 83 14.578 -8.796 15.283 1.00 5.00 +ATOM 163 CB ALA A 83 15.315 -8.927 15.510 1.00 5.00 +ATOM 164 CA PHE A 84 13.331 -9.084 18.901 1.00 5.00 +ATOM 165 CB PHE A 84 15.486 -10.356 20.558 1.00 5.00 +ATOM 166 CA SER A 85 9.585 -8.695 18.009 1.00 5.00 +ATOM 167 CB SER A 85 9.564 -7.909 16.941 1.00 5.00 +ATOM 168 CA VAL A 86 6.345 -10.611 17.629 1.00 5.00 +ATOM 169 CB VAL A 86 5.575 -10.945 18.923 1.00 5.00 +ATOM 170 CA ARG A 87 3.194 -9.953 15.554 1.00 5.00 +ATOM 171 CB ARG A 87 4.405 -12.002 12.820 1.00 5.00 +ATOM 172 CA ALA A 88 1.634 -8.872 19.002 1.00 5.00 +ATOM 173 CB ALA A 88 1.722 -8.246 19.482 1.00 5.00 +ATOM 174 CA ASN A 89 -0.875 -11.712 18.252 1.00 5.00 +ATOM 175 CB ASN A 89 -0.192 -12.568 16.610 1.00 5.00 +ATOM 176 CA VAL A 90 2.003 -14.061 19.819 1.00 5.00 +ATOM 177 CB VAL A 90 2.461 -15.027 18.825 1.00 5.00 +ATOM 178 CA PRO A 91 3.492 -14.257 23.525 1.00 5.00 +ATOM 179 CB PRO A 91 3.833 -15.546 23.054 1.00 5.00 +ATOM 180 CA PRO A 92 6.855 -12.078 23.792 1.00 5.00 +ATOM 181 CB PRO A 92 6.309 -11.420 24.914 1.00 5.00 +ATOM 182 CA PRO A 93 9.299 -15.141 23.745 1.00 5.00 +ATOM 183 CB PRO A 93 9.535 -14.441 22.486 1.00 5.00 +ATOM 184 CA PRO A 94 11.211 -15.230 27.057 1.00 5.00 +ATOM 185 CB PRO A 94 11.236 -16.652 26.898 1.00 5.00 +ATOM 186 CA SER A 95 14.267 -13.445 25.611 1.00 5.00 +ATOM 187 CB SER A 95 15.497 -13.290 25.346 1.00 5.00 +ATOM 188 CA LEU A 96 12.353 -10.670 24.278 1.00 5.00 +ATOM 189 CB LEU A 96 11.034 -9.994 22.783 1.00 5.00 +ATOM 190 CA ARG A 97 10.338 -10.257 27.524 1.00 5.00 +ATOM 191 CB ARG A 97 9.988 -12.801 29.604 1.00 5.00 +ATOM 192 CA ASN A 98 13.787 -10.120 29.320 1.00 5.00 +ATOM 193 CB ASN A 98 14.152 -12.132 28.874 1.00 5.00 +ATOM 194 CA VAL A 99 14.643 -7.277 27.100 1.00 5.00 +ATOM 195 CB VAL A 99 14.658 -7.346 25.587 1.00 5.00 +ATOM 196 CA LEU A 100 11.124 -5.722 27.941 1.00 5.00 +ATOM 197 CB LEU A 100 9.785 -6.677 26.778 1.00 5.00 +ATOM 198 CA ALA A 101 11.879 -6.233 31.608 1.00 5.00 +ATOM 199 CB ALA A 101 11.995 -6.836 32.067 1.00 5.00 +ATOM 200 CA ALA A 102 15.004 -4.199 30.898 1.00 5.00 +ATOM 201 CB ALA A 102 15.134 -4.323 30.207 1.00 5.00 +ATOM 202 CA VAL A 103 12.977 -1.319 29.700 1.00 5.00 +ATOM 203 CB VAL A 103 12.978 -1.071 28.222 1.00 5.00 +ATOM 204 CA LYS A 104 10.856 -1.492 32.906 1.00 5.00 +ATOM 205 CB LYS A 104 8.469 -3.356 33.333 1.00 5.00 +ATOM 206 CA ASN A 105 13.970 -1.408 35.048 1.00 5.00 +ATOM 207 CB ASN A 105 15.158 -2.970 34.608 1.00 5.00 +ATOM 208 CA CYS A 106 15.745 1.652 33.511 1.00 5.00 +ATOM 209 CB CYS A 106 16.507 1.161 32.543 1.00 5.00 +ATOM 210 CA TYR A 107 12.339 3.543 32.869 1.00 5.00 +ATOM 211 CB TYR A 107 12.327 3.914 29.514 1.00 5.00 +ATOM 212 CA PRO A 108 9.848 3.678 35.750 1.00 5.00 +ATOM 213 CB PRO A 108 11.107 3.529 36.440 1.00 5.00 +ATOM 214 CA GLU A 109 7.145 5.651 34.417 1.00 5.00 +ATOM 215 CB GLU A 109 8.159 6.074 32.155 1.00 5.00 +ATOM 216 CA ALA A 110 6.908 3.299 31.518 1.00 5.00 +ATOM 217 CB ALA A 110 7.381 2.634 31.390 1.00 5.00 +ATOM 218 CA ARG A 111 3.600 1.263 31.633 1.00 5.00 +ATOM 219 CB ARG A 111 0.482 1.839 30.287 1.00 5.00 +ATOM 220 CA MET A 112 3.938 -1.633 29.278 1.00 5.00 +ATOM 221 CB MET A 112 6.119 -2.610 29.573 1.00 5.00 +ATOM 222 CA SER A 113 1.121 -3.286 27.473 1.00 5.00 +ATOM 223 CB SER A 113 1.758 -3.112 26.401 1.00 5.00 +ATOM 224 CA GLY A 114 2.654 -6.622 27.976 1.00 5.00 +ATOM 225 CA HIS A 115 3.747 -7.697 24.639 1.00 5.00 +ATOM 226 CB HIS A 115 2.141 -9.349 23.153 1.00 5.00 +ATOM 227 CA GLY A 116 6.666 -7.866 22.163 1.00 5.00 +ATOM 228 CA CYS A 117 5.345 -5.277 19.588 1.00 5.00 +ATOM 229 CB CYS A 117 4.644 -4.485 20.465 1.00 5.00 +ATOM 230 CA LEU A 118 8.636 -3.560 18.816 1.00 5.00 +ATOM 231 CB LEU A 118 9.998 -4.681 19.747 1.00 5.00 +ATOM 232 CA GLU A 119 7.317 -1.550 15.997 1.00 5.00 +ATOM 233 CB GLU A 119 5.371 -2.800 15.543 1.00 5.00 +ATOM 234 CA LYS A 120 6.519 1.349 18.062 1.00 5.00 +ATOM 235 CB LYS A 120 4.745 0.938 20.451 1.00 5.00 +ATOM 236 CA TRP A 121 10.283 1.724 18.364 1.00 5.00 +ATOM 237 CB TRP A 121 10.196 -0.085 21.321 1.00 5.00 +ATOM 238 CA ALA A 122 11.004 1.054 14.693 1.00 5.00 +ATOM 239 CB ALA A 122 11.240 0.700 14.036 1.00 5.00 +ATOM 240 CA ARG A 123 8.589 3.905 13.744 1.00 5.00 +ATOM 241 CB ARG A 123 6.198 2.115 11.640 1.00 5.00 +ATOM 242 CA ASP A 124 10.673 6.073 15.950 1.00 5.00 +ATOM 243 CB ASP A 124 10.143 7.352 17.481 1.00 5.00 +ATOM 244 CA GLY A 125 13.943 5.196 14.537 1.00 5.00 +ATOM 245 CA VAL A 126 15.275 1.996 16.126 1.00 5.00 +ATOM 246 CB VAL A 126 14.253 0.976 16.729 1.00 5.00 +ATOM 247 CA LEU A 127 16.207 -0.542 13.167 1.00 5.00 +ATOM 248 CB LEU A 127 17.102 -0.924 11.389 1.00 5.00 +ATOM 249 CA LEU A 128 16.078 -3.798 14.870 1.00 5.00 +ATOM 250 CB LEU A 128 15.174 -4.258 16.716 1.00 5.00 +ATOM 251 CA LEU A 129 18.269 -6.093 12.699 1.00 5.00 +ATOM 252 CB LEU A 129 20.127 -6.000 11.826 1.00 5.00 +ATOM 253 CA ASN A 130 18.620 -9.887 11.734 1.00 5.00 +ATOM 254 CB ASN A 130 16.677 -9.748 11.260 1.00 5.00 +ATOM 255 CA THR A 131 21.740 -10.912 10.233 1.00 5.00 +ATOM 256 CB THR A 131 22.973 -10.005 10.230 1.00 5.00 +ATOM 257 CA THR A 132 20.113 -14.343 9.358 1.00 5.00 +ATOM 258 CB THR A 132 20.256 -15.345 10.427 1.00 5.00 +ATOM 259 CA LEU A 133 17.345 -12.710 7.310 1.00 5.00 +ATOM 260 CB LEU A 133 16.184 -11.040 6.769 1.00 5.00 +ATOM 261 CA THR A 134 15.872 -16.307 6.616 1.00 5.00 +ATOM 262 CB THR A 134 15.758 -16.846 5.166 1.00 5.00 +ATOM 263 CA VAL A 135 14.591 -19.108 8.551 1.00 5.00 +ATOM 264 CB VAL A 135 14.565 -18.900 10.123 1.00 5.00 +ATOM 265 CA LYS A 136 13.124 -22.603 7.783 1.00 5.00 +ATOM 266 CB LYS A 136 14.383 -24.708 6.647 1.00 5.00 +ATOM 267 CA ARG A 137 9.666 -22.851 9.163 1.00 5.00 +ATOM 268 CB ARG A 137 6.593 -24.666 9.369 1.00 5.00 +ATOM 269 CA GLY A 138 10.545 -26.001 11.254 1.00 5.00 +ATOM 270 CA ALA A 139 14.288 -25.118 11.863 1.00 5.00 +ATOM 271 CB ALA A 139 14.885 -25.405 11.358 1.00 5.00 +ATOM 272 CA ALA A 140 16.704 -23.173 13.575 1.00 5.00 +ATOM 273 CB ALA A 140 16.431 -23.688 14.129 1.00 5.00 +ATOM 274 CA ALA A 141 19.302 -21.322 11.646 1.00 5.00 +ATOM 275 CB ALA A 141 20.039 -21.127 11.842 1.00 5.00 +ATOM 276 CA SER A 142 18.840 -23.319 8.361 1.00 5.00 +ATOM 277 CB SER A 142 18.232 -24.398 7.855 1.00 5.00 +ATOM 278 CA HIS A 143 19.517 -20.350 6.189 1.00 5.00 +ATOM 279 CB HIS A 143 17.636 -21.160 4.338 1.00 5.00 +ATOM 280 CA SER A 144 22.554 -18.688 8.055 1.00 5.00 +ATOM 281 CB SER A 144 22.608 -19.547 9.133 1.00 5.00 +ATOM 282 CA ARG A 145 25.060 -20.459 5.876 1.00 5.00 +ATOM 283 CB ARG A 145 22.770 -23.085 5.468 1.00 5.00 +ATOM 284 CA ILE A 146 23.860 -18.740 2.636 1.00 5.00 +ATOM 285 CB ILE A 146 22.239 -17.753 3.131 1.00 5.00 +ATOM 286 CA GLY A 147 25.979 -15.628 3.016 1.00 5.00 +ATOM 287 CA TRP A 148 23.079 -13.653 4.743 1.00 5.00 +ATOM 288 CB TRP A 148 20.450 -11.605 4.343 1.00 5.00 +ATOM 289 CA ASP A 149 25.424 -11.618 7.018 1.00 5.00 +ATOM 290 CB ASP A 149 25.983 -12.577 8.772 1.00 5.00 +ATOM 291 CA ARG A 150 27.761 -10.451 4.271 1.00 5.00 +ATOM 292 CB ARG A 150 28.205 -8.978 1.250 1.00 5.00 +ATOM 293 CA PHE A 151 24.714 -8.585 2.646 1.00 5.00 +ATOM 294 CB PHE A 151 22.328 -9.375 1.069 1.00 5.00 +ATOM 295 CA VAL A 152 23.294 -7.268 5.868 1.00 5.00 +ATOM 296 CB VAL A 152 22.161 -7.829 6.495 1.00 5.00 +ATOM 297 CA GLY A 153 26.539 -6.056 7.469 1.00 5.00 +ATOM 298 CA GLY A 154 27.334 -4.884 3.956 1.00 5.00 +ATOM 299 CA VAL A 155 24.036 -2.632 4.024 1.00 5.00 +ATOM 300 CB VAL A 155 22.680 -3.201 4.058 1.00 5.00 +ATOM 301 CA ILE A 156 24.716 -1.775 7.771 1.00 5.00 +ATOM 302 CB ILE A 156 23.350 -1.068 8.417 1.00 5.00 +ATOM 303 CA ARG A 157 28.457 -1.053 7.343 1.00 5.00 +ATOM 304 CB ARG A 157 30.698 -4.310 6.237 1.00 5.00 +ATOM 305 CA ARG A 158 27.665 1.488 4.542 1.00 5.00 +ATOM 306 CB ARG A 158 26.935 0.175 2.567 1.00 5.00 +ATOM 307 CA LEU A 159 25.014 3.309 6.826 1.00 5.00 +ATOM 308 CB LEU A 159 23.204 4.156 7.401 1.00 5.00 +ATOM 309 CA ALA A 160 27.350 3.637 9.701 1.00 5.00 +ATOM 310 CB ALA A 160 27.322 2.881 9.596 1.00 5.00 +ATOM 311 CA ALA A 161 29.819 5.168 7.606 1.00 5.00 +ATOM 312 CB ALA A 161 30.452 5.153 7.172 1.00 5.00 +ATOM 313 CA ARG A 162 26.999 7.652 6.342 1.00 5.00 +ATOM 314 CB ARG A 162 24.125 6.886 4.486 1.00 5.00 +ATOM 315 CA ARG A 163 25.929 8.610 9.798 1.00 5.00 +ATOM 316 CB ARG A 163 22.675 8.597 10.956 1.00 5.00 +ATOM 317 CA PRO A 164 28.512 9.407 12.187 1.00 5.00 +ATOM 318 CB PRO A 164 28.576 10.354 11.118 1.00 5.00 +ATOM 319 CA GLY A 165 26.412 8.993 15.243 1.00 5.00 +ATOM 320 CA LEU A 166 24.988 5.428 15.551 1.00 5.00 +ATOM 321 CB LEU A 166 23.784 4.750 13.945 1.00 5.00 +ATOM 322 CA VAL A 167 24.226 3.608 18.910 1.00 5.00 +ATOM 323 CB VAL A 167 23.603 4.594 19.801 1.00 5.00 +ATOM 324 CA PHE A 168 24.788 -0.191 18.456 1.00 5.00 +ATOM 325 CB PHE A 168 25.472 -0.409 15.481 1.00 5.00 +ATOM 326 CA MET A 169 23.605 -2.352 21.495 1.00 5.00 +ATOM 327 CB MET A 169 22.043 -3.653 22.378 1.00 5.00 +ATOM 328 CA LEU A 170 25.612 -5.464 20.847 1.00 5.00 +ATOM 329 CB LEU A 170 27.073 -4.929 19.409 1.00 5.00 +ATOM 330 CA TRP A 171 23.531 -8.429 22.512 1.00 5.00 +ATOM 331 CB TRP A 171 20.257 -7.778 20.988 1.00 5.00 +ATOM 332 CA GLY A 172 25.815 -11.682 22.847 1.00 5.00 +ATOM 333 CA THR A 173 29.448 -12.824 21.910 1.00 5.00 +ATOM 334 CB THR A 173 29.774 -14.124 22.377 1.00 5.00 +ATOM 335 CA HIS A 174 28.392 -13.882 18.331 1.00 5.00 +ATOM 336 CB HIS A 174 27.912 -14.363 15.726 1.00 5.00 +ATOM 337 CA ALA A 175 26.573 -10.349 17.866 1.00 5.00 +ATOM 338 CB ALA A 175 26.432 -10.075 18.560 1.00 5.00 +ATOM 339 CA GLN A 176 29.692 -8.454 18.864 1.00 5.00 +ATOM 340 CB GLN A 176 28.746 -8.193 21.432 1.00 5.00 +ATOM 341 CA ASN A 177 31.838 -10.661 16.774 1.00 5.00 +ATOM 342 CB ASN A 177 31.867 -11.997 18.335 1.00 5.00 +ATOM 343 CA ALA A 178 29.492 -9.953 13.866 1.00 5.00 +ATOM 344 CB ALA A 178 28.903 -10.095 14.354 1.00 5.00 +ATOM 345 CA ILE A 179 29.344 -6.021 14.013 1.00 5.00 +ATOM 346 CB ILE A 179 27.669 -5.257 13.387 1.00 5.00 +ATOM 347 CA ARG A 180 32.602 -4.062 15.006 1.00 5.00 +ATOM 348 CB ARG A 180 35.558 -5.591 15.996 1.00 5.00 +ATOM 349 CA PRO A 181 31.178 -0.559 14.426 1.00 5.00 +ATOM 350 CB PRO A 181 30.371 -1.178 15.367 1.00 5.00 +ATOM 351 CA ASP A 182 33.900 2.123 14.186 1.00 5.00 +ATOM 352 CB ASP A 182 33.217 3.177 12.590 1.00 5.00 +ATOM 353 CA PRO A 183 34.625 2.690 18.067 1.00 5.00 +ATOM 354 CB PRO A 183 35.590 1.675 17.747 1.00 5.00 +ATOM 355 CA ARG A 184 35.468 6.274 18.576 1.00 5.00 +ATOM 356 CB ARG A 184 36.766 8.138 21.079 1.00 5.00 +ATOM 357 CA VAL A 185 32.249 7.746 16.692 1.00 5.00 +ATOM 358 CB VAL A 185 32.054 8.783 15.579 1.00 5.00 +ATOM 359 CA HIS A 186 29.307 5.201 17.553 1.00 5.00 +ATOM 360 CB HIS A 186 29.733 4.330 14.996 1.00 5.00 +ATOM 361 CA CYS A 187 27.831 4.419 20.837 1.00 5.00 +ATOM 362 CB CYS A 187 27.223 4.857 22.082 1.00 5.00 +ATOM 363 CA VAL A 188 28.883 0.828 20.936 1.00 5.00 +ATOM 364 CB VAL A 188 30.041 0.387 20.068 1.00 5.00 +ATOM 365 CA LEU A 189 27.222 -0.839 23.958 1.00 5.00 +ATOM 366 CB LEU A 189 26.014 0.735 24.729 1.00 5.00 +ATOM 367 CA LYS A 190 28.103 -4.388 24.598 1.00 5.00 +ATOM 368 CB LYS A 190 30.362 -3.944 22.700 1.00 5.00 +ATOM 369 CA PHE A 191 26.469 -6.880 27.101 1.00 5.00 +ATOM 370 CB PHE A 191 25.667 -5.503 29.608 1.00 5.00 +ATOM 371 CA SER A 192 25.268 -10.567 27.296 1.00 5.00 +ATOM 372 CB SER A 192 26.275 -10.429 28.135 1.00 5.00 +ATOM 373 CA HIS A 193 22.219 -12.675 26.034 1.00 5.00 +ATOM 374 CB HIS A 193 23.746 -14.677 24.694 1.00 5.00 +ATOM 375 CA PRO A 194 18.976 -11.109 27.128 1.00 5.00 +ATOM 376 CB PRO A 194 18.697 -10.326 25.935 1.00 5.00 +ATOM 377 CA SER A 195 18.113 -14.885 27.568 1.00 5.00 +ATOM 378 CB SER A 195 19.101 -15.731 27.220 1.00 5.00 +ATOM 379 CA PRO A 196 17.405 -16.829 30.924 1.00 5.00 +ATOM 380 CB PRO A 196 16.137 -17.010 30.293 1.00 5.00 +ATOM 381 CA LEU A 197 20.590 -18.802 30.815 1.00 5.00 +ATOM 382 CB LEU A 197 20.108 -20.078 29.276 1.00 5.00 +ATOM 383 CA SER A 198 22.916 -15.839 30.866 1.00 5.00 +ATOM 384 CB SER A 198 22.921 -15.162 29.715 1.00 5.00 +ATOM 385 CA LYS A 199 25.188 -15.632 33.736 1.00 5.00 +ATOM 386 CB LYS A 199 28.019 -15.768 34.925 1.00 5.00 +ATOM 387 CA VAL A 200 23.821 -11.996 34.190 1.00 5.00 +ATOM 388 CB VAL A 200 23.981 -10.938 33.162 1.00 5.00 +ATOM 389 CA PRO A 201 20.113 -11.783 34.128 1.00 5.00 +ATOM 390 CB PRO A 201 20.101 -10.808 35.194 1.00 5.00 +ATOM 391 CA PHE A 202 19.942 -9.231 31.448 1.00 5.00 +ATOM 392 CB PHE A 202 21.315 -8.245 29.121 1.00 5.00 +ATOM 393 CA GLY A 203 17.459 -6.998 33.164 1.00 5.00 +ATOM 394 CA THR A 204 20.254 -5.448 35.183 1.00 5.00 +ATOM 395 CB THR A 204 21.462 -5.939 35.852 1.00 5.00 +ATOM 396 CA CYS A 205 21.071 -3.631 31.723 1.00 5.00 +ATOM 397 CB CYS A 205 20.123 -3.693 30.601 1.00 5.00 +ATOM 398 CA GLN A 206 21.177 0.096 31.664 1.00 5.00 +ATOM 399 CB GLN A 206 20.760 2.349 33.247 1.00 5.00 +ATOM 400 CA HIS A 207 21.466 0.086 27.977 1.00 5.00 +ATOM 401 CB HIS A 207 22.449 -2.163 26.657 1.00 5.00 +ATOM 402 CA PHE A 208 18.245 1.432 27.617 1.00 5.00 +ATOM 403 CB PHE A 208 18.066 -0.964 25.909 1.00 5.00 +ATOM 404 CA LEU A 209 19.157 4.550 29.601 1.00 5.00 +ATOM 405 CB LEU A 209 18.040 5.434 31.044 1.00 5.00 +ATOM 406 CA VAL A 210 22.936 4.841 28.343 1.00 5.00 +ATOM 407 CB VAL A 210 23.436 3.550 28.937 1.00 5.00 +ATOM 408 CA ALA A 211 21.470 4.699 24.862 1.00 5.00 +ATOM 409 CB ALA A 211 20.772 4.306 24.779 1.00 5.00 +ATOM 410 CA ASN A 212 19.281 7.827 26.007 1.00 5.00 +ATOM 411 CB ASN A 212 17.542 6.821 26.253 1.00 5.00 +ATOM 412 CA ARG A 213 22.269 9.932 27.430 1.00 5.00 +ATOM 413 CB ARG A 213 21.609 8.186 30.251 1.00 5.00 +ATOM 414 CA TYR A 214 24.263 9.876 24.135 1.00 5.00 +ATOM 415 CB TYR A 214 25.510 8.594 21.232 1.00 5.00 +ATOM 416 CA LEU A 215 21.054 10.889 22.304 1.00 5.00 +ATOM 417 CB LEU A 215 19.788 9.602 21.896 1.00 5.00 +ATOM 418 CA GLU A 216 20.107 13.864 24.429 1.00 5.00 +ATOM 419 CB GLU A 216 20.568 15.178 26.128 1.00 5.00 +ATOM 420 CA THR A 217 23.808 14.731 24.339 1.00 5.00 +ATOM 421 CB THR A 217 24.607 13.819 25.047 1.00 5.00 +ATOM 422 CA ARG A 218 23.351 15.217 20.623 1.00 5.00 +ATOM 423 CB ARG A 218 25.189 15.852 17.899 1.00 5.00 +ATOM 424 CA SER A 219 19.830 16.562 20.537 1.00 5.00 +ATOM 425 CB SER A 219 19.647 17.636 19.863 1.00 5.00 +ATOM 426 CA ILE A 220 18.476 13.527 18.613 1.00 5.00 +ATOM 427 CB ILE A 220 19.773 12.953 17.283 1.00 5.00 +ATOM 428 CA SER A 221 15.262 13.112 20.930 1.00 5.00 +ATOM 429 CB SER A 221 14.123 12.407 20.648 1.00 5.00 +ATOM 430 CA PRO A 222 15.423 9.953 23.455 1.00 5.00 +ATOM 431 CB PRO A 222 14.979 11.008 24.336 1.00 5.00 +ATOM 432 CA ILE A 223 13.188 7.156 22.113 1.00 5.00 +ATOM 433 CB ILE A 223 13.321 6.229 20.417 1.00 5.00 +ATOM 434 CA ASP A 224 9.917 6.122 23.804 1.00 5.00 +ATOM 435 CB ASP A 224 9.139 7.218 22.223 1.00 5.00 +ATOM 436 CA TRP A 225 10.906 2.622 24.862 1.00 5.00 +ATOM 437 CB TRP A 225 13.777 1.879 22.432 1.00 5.00 +ATOM 438 CA SER A 226 7.293 2.043 26.346 1.00 5.00 +ATOM 439 CB SER A 226 7.188 3.302 25.751 1.00 5.00 +ATOM 440 CA VAL A 227 5.911 -1.068 24.881 1.00 5.00 +ATOM 441 CB VAL A 227 5.784 -2.472 25.387 1.00 5.00 TER TER -ATOM 442 CA THR C 1 40.414 0.709 -19.370 1.00 5.00 -ATOM 443 CB THR C 1 40.840 -0.224 -18.377 1.00 5.00 -ATOM 444 CA ASN C 2 40.782 -1.827 -22.175 1.00 5.00 -ATOM 445 CB ASN C 2 42.527 -2.570 -21.852 1.00 5.00 -ATOM 446 CA LEU C 3 38.931 -4.367 -20.183 1.00 5.00 -ATOM 447 CB LEU C 3 40.036 -5.050 -18.530 1.00 5.00 -ATOM 448 CA SER C 4 36.155 -1.451 -20.467 1.00 5.00 -ATOM 449 CB SER C 4 35.810 -0.390 -19.865 1.00 5.00 -ATOM 450 CA ASP C 5 36.670 -1.554 -24.112 1.00 5.00 -ATOM 451 CB ASP C 5 37.466 -1.651 -25.934 1.00 5.00 -ATOM 452 CA ILE C 6 34.783 -4.737 -24.159 1.00 5.00 -ATOM 453 CB ILE C 6 34.965 -6.503 -23.512 1.00 5.00 -ATOM 454 CA ILE C 7 31.931 -2.967 -22.326 1.00 5.00 -ATOM 455 CB ILE C 7 32.162 -2.971 -20.488 1.00 5.00 -ATOM 456 CA GLU C 8 31.783 -0.289 -25.021 1.00 5.00 -ATOM 457 CB GLU C 8 33.467 1.222 -24.444 1.00 5.00 -ATOM 458 CA LYS C 9 32.007 -2.954 -27.766 1.00 5.00 -ATOM 459 CB LYS C 9 34.163 -2.400 -29.780 1.00 5.00 -ATOM 460 CA GLU C 10 29.499 -5.435 -25.896 1.00 5.00 -ATOM 461 CB GLU C 10 30.273 -7.469 -27.000 1.00 5.00 -ATOM 462 CA THR C 11 27.024 -2.516 -24.776 1.00 5.00 -ATOM 463 CB THR C 11 27.034 -1.839 -23.483 1.00 5.00 -ATOM 464 CA GLY C 12 27.499 0.908 -25.870 1.00 5.00 -ATOM 465 CA LYS C 13 27.792 3.082 -22.656 1.00 5.00 -ATOM 466 CB LYS C 13 26.252 4.341 -20.237 1.00 5.00 -ATOM 467 CA GLN C 14 30.757 4.556 -21.169 1.00 5.00 -ATOM 468 CB GLN C 14 31.835 6.229 -19.893 1.00 5.00 -ATOM 469 CA LEU C 15 31.272 1.976 -18.146 1.00 5.00 -ATOM 470 CB LEU C 15 29.700 0.869 -17.413 1.00 5.00 -ATOM 471 CA VAL C 16 34.394 2.797 -15.649 1.00 5.00 -ATOM 472 CB VAL C 16 35.286 4.038 -15.555 1.00 5.00 -ATOM 473 CA ILE C 17 34.567 -0.665 -13.676 1.00 5.00 -ATOM 474 CB ILE C 17 35.722 -1.331 -14.993 1.00 5.00 -ATOM 475 CA GLN C 18 34.198 0.961 -10.081 1.00 5.00 -ATOM 476 CB GLN C 18 33.037 3.419 -10.947 1.00 5.00 -ATOM 477 CA GLU C 19 34.227 -2.349 -8.172 1.00 5.00 -ATOM 478 CB GLU C 19 33.692 -4.305 -8.425 1.00 5.00 -ATOM 479 CA SER C 20 36.288 -5.703 -8.315 1.00 5.00 -ATOM 480 CB SER C 20 37.504 -5.307 -8.007 1.00 5.00 -ATOM 481 CA ILE C 21 34.922 -9.057 -7.161 1.00 5.00 -ATOM 482 CB ILE C 21 33.101 -8.576 -6.650 1.00 5.00 -ATOM 483 CA LEU C 22 36.708 -12.359 -6.908 1.00 5.00 -ATOM 484 CB LEU C 22 38.648 -12.739 -6.471 1.00 5.00 -ATOM 485 CA MET C 23 34.952 -15.663 -7.816 1.00 5.00 -ATOM 486 CB MET C 23 32.732 -15.827 -7.723 1.00 5.00 -ATOM 487 CA LEU C 24 35.594 -19.258 -6.694 1.00 5.00 -ATOM 488 CB LEU C 24 33.963 -19.800 -5.502 1.00 5.00 -ATOM 489 CA PRO C 25 35.075 -21.761 -9.316 1.00 5.00 -ATOM 490 CB PRO C 25 36.406 -22.036 -8.878 1.00 5.00 -ATOM 491 CA GLU C 26 32.106 -23.416 -7.510 1.00 5.00 -ATOM 492 CB GLU C 26 33.274 -24.722 -5.900 1.00 5.00 -ATOM 493 CA GLU C 27 30.265 -20.277 -6.704 1.00 5.00 -ATOM 494 CB GLU C 27 28.264 -18.407 -5.878 1.00 5.00 -ATOM 495 CA VAL C 28 30.875 -19.029 -10.392 1.00 5.00 -ATOM 496 CB VAL C 28 32.065 -18.842 -11.227 1.00 5.00 -ATOM 497 CA GLU C 29 30.170 -22.656 -11.669 1.00 5.00 -ATOM 498 CB GLU C 29 30.640 -25.430 -11.535 1.00 5.00 -ATOM 499 CA GLU C 30 26.369 -22.274 -11.191 1.00 5.00 -ATOM 500 CB GLU C 30 23.765 -22.960 -10.502 1.00 5.00 -ATOM 501 CA VAL C 31 26.156 -18.467 -11.648 1.00 5.00 -ATOM 502 CB VAL C 31 26.683 -17.309 -10.866 1.00 5.00 -ATOM 503 CA ILE C 32 27.019 -18.843 -15.292 1.00 5.00 -ATOM 504 CB ILE C 32 28.563 -17.868 -15.738 1.00 5.00 -ATOM 505 CA GLY C 33 26.350 -22.151 -17.369 1.00 5.00 -ATOM 506 CA ASN C 34 29.949 -22.778 -18.016 1.00 5.00 -ATOM 507 CB ASN C 34 30.009 -23.294 -19.968 1.00 5.00 -ATOM 508 CA LYS C 35 32.611 -23.579 -15.507 1.00 5.00 -ATOM 509 CB LYS C 35 34.234 -24.528 -12.949 1.00 5.00 -ATOM 510 CA PRO C 36 35.620 -21.539 -16.251 1.00 5.00 -ATOM 511 CB PRO C 36 34.519 -20.645 -16.368 1.00 5.00 -ATOM 512 CA GLU C 37 38.591 -23.341 -14.709 1.00 5.00 -ATOM 513 CB GLU C 37 37.521 -25.458 -15.263 1.00 5.00 -ATOM 514 CA SER C 38 40.146 -20.624 -12.626 1.00 5.00 -ATOM 515 CB SER C 38 40.896 -19.555 -12.989 1.00 5.00 -ATOM 516 CA ASP C 39 39.332 -17.914 -9.908 1.00 5.00 -ATOM 517 CB ASP C 39 39.852 -19.022 -8.346 1.00 5.00 -ATOM 518 CA ILE C 40 37.145 -15.439 -11.735 1.00 5.00 -ATOM 519 CB ILE C 40 36.355 -15.467 -13.497 1.00 5.00 -ATOM 520 CA LEU C 41 37.784 -11.599 -11.162 1.00 5.00 -ATOM 521 CB LEU C 41 39.189 -10.082 -11.756 1.00 5.00 -ATOM 522 CA VAL C 42 34.309 -10.060 -11.367 1.00 5.00 -ATOM 523 CB VAL C 42 33.425 -11.149 -10.753 1.00 5.00 -ATOM 524 CA HIS C 43 34.735 -6.227 -12.415 1.00 5.00 -ATOM 525 CB HIS C 43 37.102 -5.355 -13.401 1.00 5.00 -ATOM 526 CA THR C 44 31.235 -4.722 -11.775 1.00 5.00 -ATOM 527 CB THR C 44 30.680 -5.839 -10.843 1.00 5.00 -ATOM 528 CA ALA C 45 29.784 -1.545 -13.130 1.00 5.00 -ATOM 529 CB ALA C 45 29.570 -2.090 -13.643 1.00 5.00 -ATOM 530 CA TYR C 46 26.367 0.487 -12.899 1.00 5.00 -ATOM 531 CB TYR C 46 23.588 -0.169 -10.975 1.00 5.00 -ATOM 532 CA ASP C 47 24.461 1.906 -16.036 1.00 5.00 -ATOM 533 CB ASP C 47 24.424 1.658 -18.077 1.00 5.00 -ATOM 534 CA GLU C 48 22.342 4.488 -14.148 1.00 5.00 -ATOM 535 CB GLU C 48 23.517 4.377 -12.534 1.00 5.00 -ATOM 536 CA SER C 49 19.581 5.079 -16.769 1.00 5.00 -ATOM 537 CB SER C 49 19.233 5.846 -17.799 1.00 5.00 -ATOM 538 CA THR C 50 19.004 1.491 -17.402 1.00 5.00 -ATOM 539 CB THR C 50 19.634 0.251 -18.062 1.00 5.00 -ATOM 540 CA ASP C 51 19.269 1.197 -13.612 1.00 5.00 -ATOM 541 CB ASP C 51 18.307 1.173 -11.834 1.00 5.00 -ATOM 542 CA GLU C 52 21.398 -1.792 -14.433 1.00 5.00 -ATOM 543 CB GLU C 52 22.544 -3.280 -15.922 1.00 5.00 -ATOM 544 CA ASN C 53 24.312 -3.755 -13.454 1.00 5.00 -ATOM 545 CB ASN C 53 24.411 -3.782 -11.415 1.00 5.00 -ATOM 546 CA VAL C 54 26.947 -4.691 -15.952 1.00 5.00 -ATOM 547 CB VAL C 54 26.764 -4.247 -17.409 1.00 5.00 -ATOM 548 CA MET C 55 29.287 -7.456 -14.300 1.00 5.00 -ATOM 549 CB MET C 55 29.256 -9.556 -12.943 1.00 5.00 -ATOM 550 CA LEU C 56 32.527 -8.171 -16.440 1.00 5.00 -ATOM 551 CB LEU C 56 34.033 -7.266 -17.579 1.00 5.00 -ATOM 552 CA LEU C 57 33.909 -11.685 -15.288 1.00 5.00 -ATOM 553 CB LEU C 57 32.281 -12.849 -14.779 1.00 5.00 -ATOM 554 CA THR C 58 37.711 -11.711 -16.118 1.00 5.00 -ATOM 555 CB THR C 58 38.283 -10.386 -15.942 1.00 5.00 -ATOM 556 CA SER C 59 39.715 -14.966 -15.674 1.00 5.00 -ATOM 557 CB SER C 59 40.289 -14.292 -16.626 1.00 5.00 -ATOM 558 CA ASP C 60 42.153 -13.851 -12.904 1.00 5.00 -ATOM 559 CB ASP C 60 42.300 -14.962 -11.137 1.00 5.00 -ATOM 560 CA ALA C 61 45.141 -12.056 -12.116 1.00 5.00 -ATOM 561 CB ALA C 61 45.256 -12.451 -11.475 1.00 5.00 -ATOM 562 CA PRO C 62 47.363 -10.340 -14.888 1.00 5.00 -ATOM 563 CB PRO C 62 48.336 -10.267 -13.938 1.00 5.00 -ATOM 564 CA GLU C 63 45.630 -12.927 -16.983 1.00 5.00 -ATOM 565 CB GLU C 63 45.110 -15.532 -17.169 1.00 5.00 -ATOM 566 CA TYR C 64 42.685 -10.555 -17.648 1.00 5.00 -ATOM 567 CB TYR C 64 44.238 -8.198 -15.864 1.00 5.00 -ATOM 568 CA LYS C 65 41.041 -13.092 -19.782 1.00 5.00 -ATOM 569 CB LYS C 65 41.633 -15.758 -21.261 1.00 5.00 -ATOM 570 CA PRO C 66 37.460 -11.596 -20.586 1.00 5.00 -ATOM 571 CB PRO C 66 38.103 -11.314 -21.842 1.00 5.00 -ATOM 572 CA TRP C 67 35.145 -14.870 -20.251 1.00 5.00 -ATOM 573 CB TRP C 67 34.115 -18.054 -20.517 1.00 5.00 -ATOM 574 CA ALA C 68 31.673 -13.651 -19.260 1.00 5.00 -ATOM 575 CB ALA C 68 30.949 -13.811 -18.912 1.00 5.00 -ATOM 576 CA LEU C 69 29.839 -10.304 -19.904 1.00 5.00 -ATOM 577 CB LEU C 69 30.304 -8.535 -20.664 1.00 5.00 -ATOM 578 CA VAL C 70 26.866 -10.248 -17.425 1.00 5.00 -ATOM 579 CB VAL C 70 26.889 -11.065 -16.311 1.00 5.00 -ATOM 580 CA ILE C 71 24.138 -7.715 -18.563 1.00 5.00 -ATOM 581 CB ILE C 71 23.934 -7.410 -20.502 1.00 5.00 -ATOM 582 CA GLN C 72 21.924 -7.827 -14.864 1.00 5.00 -ATOM 583 CB GLN C 72 24.188 -8.443 -13.396 1.00 5.00 -ATOM 584 CA ASP C 73 18.568 -6.000 -14.889 1.00 5.00 -ATOM 585 CB ASP C 73 17.155 -5.751 -16.194 1.00 5.00 -ATOM 586 CA SER C 74 16.599 -4.530 -12.275 1.00 5.00 -ATOM 587 CB SER C 74 15.811 -3.411 -12.244 1.00 5.00 -ATOM 588 CA ASN C 75 14.081 -7.370 -11.574 1.00 5.00 -ATOM 589 CB ASN C 75 13.902 -8.249 -13.445 1.00 5.00 -ATOM 590 CA GLY C 76 17.395 -9.618 -11.299 1.00 5.00 -ATOM 591 CA GLU C 77 17.168 -10.693 -15.030 1.00 5.00 -ATOM 592 CB GLU C 77 15.459 -10.988 -16.429 1.00 5.00 -ATOM 593 CA ASN C 78 20.810 -11.524 -15.913 1.00 5.00 -ATOM 594 CB ASN C 78 22.304 -12.669 -15.676 1.00 5.00 -ATOM 595 CA LYS C 79 21.639 -11.651 -19.613 1.00 5.00 -ATOM 596 CB LYS C 79 20.715 -9.617 -21.573 1.00 5.00 -ATOM 597 CA ILE C 80 25.115 -13.439 -19.693 1.00 5.00 -ATOM 598 CB ILE C 80 25.544 -15.299 -19.424 1.00 5.00 -ATOM 599 CA LYS C 81 26.622 -13.385 -23.190 1.00 5.00 -ATOM 600 CB LYS C 81 27.022 -10.957 -23.631 1.00 5.00 -ATOM 601 CA MET C 82 29.483 -15.509 -22.873 1.00 5.00 -ATOM 602 CB MET C 82 29.749 -17.287 -21.288 1.00 5.00 -ATOM 603 CA LEU C 83 32.070 -13.909 -24.965 1.00 5.00 -ATOM 604 CB LEU C 83 33.319 -13.295 -23.444 1.00 5.00 +ATOM 442 CA THR C 1 8.470 -28.896 13.488 1.00 5.00 +ATOM 443 CB THR C 1 8.185 -27.485 13.651 1.00 5.00 +ATOM 444 CA ASN C 2 10.392 -31.652 15.332 1.00 5.00 +ATOM 445 CB ASN C 2 11.866 -31.495 13.862 1.00 5.00 +ATOM 446 CA LEU C 3 11.681 -28.974 17.833 1.00 5.00 +ATOM 447 CB LEU C 3 11.589 -27.458 16.463 1.00 5.00 +ATOM 448 CA SER C 4 8.033 -28.172 18.474 1.00 5.00 +ATOM 449 CB SER C 4 7.521 -27.129 17.850 1.00 5.00 +ATOM 450 CA ASP C 5 6.854 -31.725 18.794 1.00 5.00 +ATOM 451 CB ASP C 5 7.785 -32.926 17.645 1.00 5.00 +ATOM 452 CA ILE C 6 10.014 -32.407 21.238 1.00 5.00 +ATOM 453 CB ILE C 6 11.816 -31.794 21.303 1.00 5.00 +ATOM 454 CA ILE C 7 8.666 -29.428 23.407 1.00 5.00 +ATOM 455 CB ILE C 7 8.636 -27.622 22.751 1.00 5.00 +ATOM 456 CA GLU C 8 5.167 -30.608 23.304 1.00 5.00 +ATOM 457 CB GLU C 8 3.567 -29.735 21.593 1.00 5.00 +ATOM 458 CA LYS C 9 6.016 -34.165 24.024 1.00 5.00 +ATOM 459 CB LYS C 9 7.861 -35.698 23.523 1.00 5.00 +ATOM 460 CA GLU C 10 8.651 -33.331 26.794 1.00 5.00 +ATOM 461 CB GLU C 10 10.658 -32.832 25.628 1.00 5.00 +ATOM 462 CA THR C 11 6.723 -30.723 28.737 1.00 5.00 +ATOM 463 CB THR C 11 7.125 -29.266 28.934 1.00 5.00 +ATOM 464 CA GLY C 12 3.168 -31.559 28.098 1.00 5.00 +ATOM 465 CA LYS C 13 2.185 -28.326 26.384 1.00 5.00 +ATOM 466 CB LYS C 13 1.935 -25.603 26.798 1.00 5.00 +ATOM 467 CA GLN C 14 2.070 -26.913 22.777 1.00 5.00 +ATOM 468 CB GLN C 14 -0.155 -25.929 22.086 1.00 5.00 +ATOM 469 CA LEU C 15 4.774 -24.584 23.591 1.00 5.00 +ATOM 470 CB LEU C 15 5.413 -24.513 25.328 1.00 5.00 +ATOM 471 CA VAL C 16 5.483 -22.419 20.373 1.00 5.00 +ATOM 472 CB VAL C 16 5.194 -20.950 20.206 1.00 5.00 +ATOM 473 CA ILE C 17 9.070 -22.001 19.414 1.00 5.00 +ATOM 474 CB ILE C 17 9.351 -22.492 17.539 1.00 5.00 +ATOM 475 CA GLN C 18 9.639 -17.995 19.244 1.00 5.00 +ATOM 476 CB GLN C 18 8.424 -18.202 21.730 1.00 5.00 +ATOM 477 CA GLU C 19 13.349 -16.713 19.202 1.00 5.00 +ATOM 478 CB GLU C 19 13.416 -14.773 20.744 1.00 5.00 +ATOM 479 CA SER C 20 16.190 -18.904 17.793 1.00 5.00 +ATOM 480 CB SER C 20 16.166 -19.436 16.603 1.00 5.00 +ATOM 481 CA ILE C 21 19.444 -17.698 19.270 1.00 5.00 +ATOM 482 CB ILE C 21 19.474 -16.491 20.341 1.00 5.00 +ATOM 483 CA LEU C 22 23.231 -18.400 19.499 1.00 5.00 +ATOM 484 CB LEU C 22 24.252 -16.571 19.222 1.00 5.00 +ATOM 485 CA MET C 23 25.288 -19.769 22.260 1.00 5.00 +ATOM 486 CB MET C 23 24.266 -20.663 24.297 1.00 5.00 +ATOM 487 CA LEU C 24 29.063 -20.678 22.149 1.00 5.00 +ATOM 488 CB LEU C 24 30.977 -19.756 22.112 1.00 5.00 +ATOM 489 CA PRO C 25 30.327 -23.798 24.013 1.00 5.00 +ATOM 490 CB PRO C 25 30.535 -24.595 22.877 1.00 5.00 +ATOM 491 CA GLU C 26 32.134 -21.925 26.560 1.00 5.00 +ATOM 492 CB GLU C 26 33.834 -21.770 24.845 1.00 5.00 +ATOM 493 CA GLU C 27 29.023 -19.706 26.730 1.00 5.00 +ATOM 494 CB GLU C 27 28.403 -17.515 25.857 1.00 5.00 +ATOM 495 CA VAL C 28 26.946 -23.023 27.297 1.00 5.00 +ATOM 496 CB VAL C 28 26.921 -23.935 26.119 1.00 5.00 +ATOM 497 CA GLU C 29 29.521 -24.003 30.108 1.00 5.00 +ATOM 498 CB GLU C 29 30.408 -26.182 31.057 1.00 5.00 +ATOM 499 CA GLU C 30 28.178 -21.232 31.961 1.00 5.00 +ATOM 500 CB GLU C 30 26.900 -19.785 31.190 1.00 5.00 +ATOM 501 CA VAL C 31 24.711 -22.324 33.124 1.00 5.00 +ATOM 502 CB VAL C 31 23.585 -21.431 33.568 1.00 5.00 +ATOM 503 CA ILE C 32 24.373 -25.959 32.000 1.00 5.00 +ATOM 504 CB ILE C 32 23.621 -26.418 30.221 1.00 5.00 +ATOM 505 CA GLY C 33 27.609 -27.685 33.196 1.00 5.00 +ATOM 506 CA ASN C 34 28.632 -30.157 30.591 1.00 5.00 +ATOM 507 CB ASN C 34 26.700 -30.725 30.933 1.00 5.00 +ATOM 508 CA LYS C 35 30.325 -28.994 27.545 1.00 5.00 +ATOM 509 CB LYS C 35 32.306 -30.625 26.605 1.00 5.00 +ATOM 510 CA PRO C 36 28.147 -29.646 24.546 1.00 5.00 +ATOM 511 CB PRO C 36 27.256 -29.263 25.530 1.00 5.00 +ATOM 512 CA GLU C 37 30.947 -29.554 21.990 1.00 5.00 +ATOM 513 CB GLU C 37 32.208 -30.935 20.470 1.00 5.00 +ATOM 514 CA SER C 38 28.977 -27.387 19.415 1.00 5.00 +ATOM 515 CB SER C 38 27.940 -27.849 18.692 1.00 5.00 +ATOM 516 CA ASP C 39 27.578 -23.905 18.697 1.00 5.00 +ATOM 517 CB ASP C 39 27.803 -21.874 18.465 1.00 5.00 +ATOM 518 CA ILE C 40 24.383 -24.357 20.668 1.00 5.00 +ATOM 519 CB ILE C 40 23.721 -25.621 21.899 1.00 5.00 +ATOM 520 CA LEU C 41 21.452 -22.743 19.322 1.00 5.00 +ATOM 521 CB LEU C 41 21.418 -23.615 17.432 1.00 5.00 +ATOM 522 CA VAL C 42 18.984 -21.486 21.726 1.00 5.00 +ATOM 523 CB VAL C 42 19.580 -20.339 22.542 1.00 5.00 +ATOM 524 CA HIS C 43 15.287 -22.362 20.521 1.00 5.00 +ATOM 525 CB HIS C 43 14.363 -22.879 17.949 1.00 5.00 +ATOM 526 CA THR C 44 13.548 -20.163 23.310 1.00 5.00 +ATOM 527 CB THR C 44 14.575 -19.184 23.240 1.00 5.00 +ATOM 528 CA ALA C 45 9.903 -20.867 24.164 1.00 5.00 +ATOM 529 CB ALA C 45 9.686 -21.570 24.332 1.00 5.00 +ATOM 530 CA TYR C 46 7.281 -19.624 26.507 1.00 5.00 +ATOM 531 CB TYR C 46 6.958 -16.488 27.526 1.00 5.00 +ATOM 532 CA ASP C 47 4.481 -20.968 28.925 1.00 5.00 +ATOM 533 CB ASP C 47 4.167 -22.822 29.604 1.00 5.00 +ATOM 534 CA GLU C 48 2.807 -17.777 29.751 1.00 5.00 +ATOM 535 CB GLU C 48 3.236 -15.348 29.284 1.00 5.00 +ATOM 536 CA SER C 49 0.078 -19.280 32.042 1.00 5.00 +ATOM 537 CB SER C 49 -0.716 -20.443 32.318 1.00 5.00 +ATOM 538 CA THR C 50 2.798 -20.209 34.463 1.00 5.00 +ATOM 539 CB THR C 50 3.218 -21.516 34.772 1.00 5.00 +ATOM 540 CA ASP C 51 5.904 -18.132 33.641 1.00 5.00 +ATOM 541 CB ASP C 51 7.408 -16.804 34.157 1.00 5.00 +ATOM 542 CA GLU C 52 8.029 -21.043 32.255 1.00 5.00 +ATOM 543 CB GLU C 52 8.454 -23.247 31.535 1.00 5.00 +ATOM 544 CA ASN C 53 10.498 -20.519 29.612 1.00 5.00 +ATOM 545 CB ASN C 53 10.955 -18.778 30.584 1.00 5.00 +ATOM 546 CA VAL C 54 11.371 -23.597 27.915 1.00 5.00 +ATOM 547 CB VAL C 54 10.695 -24.749 27.439 1.00 5.00 +ATOM 548 CA MET C 55 14.978 -23.202 26.309 1.00 5.00 +ATOM 549 CB MET C 55 15.707 -22.300 28.298 1.00 5.00 +ATOM 550 CA LEU C 56 15.364 -26.171 24.109 1.00 5.00 +ATOM 551 CB LEU C 56 14.799 -26.744 22.132 1.00 5.00 +ATOM 552 CA LEU C 57 19.027 -25.920 23.267 1.00 5.00 +ATOM 553 CB LEU C 57 19.764 -24.978 24.903 1.00 5.00 +ATOM 554 CA THR C 58 19.396 -27.463 19.750 1.00 5.00 +ATOM 555 CB THR C 58 18.530 -26.576 19.006 1.00 5.00 +ATOM 556 CA SER C 59 22.789 -27.447 18.271 1.00 5.00 +ATOM 557 CB SER C 59 23.813 -28.293 18.704 1.00 5.00 +ATOM 558 CA ASP C 60 23.674 -25.901 14.984 1.00 5.00 +ATOM 559 CB ASP C 60 25.423 -25.108 14.266 1.00 5.00 +ATOM 560 CA ALA C 61 22.100 -25.078 11.625 1.00 5.00 +ATOM 561 CB ALA C 61 22.354 -24.384 11.545 1.00 5.00 +ATOM 562 CA PRO C 62 20.508 -27.908 9.741 1.00 5.00 +ATOM 563 CB PRO C 62 21.065 -27.312 8.515 1.00 5.00 +ATOM 564 CA GLU C 63 22.043 -30.680 11.887 1.00 5.00 +ATOM 565 CB GLU C 63 24.182 -29.917 12.565 1.00 5.00 +ATOM 566 CA TYR C 64 19.801 -30.180 14.732 1.00 5.00 +ATOM 567 CB TYR C 64 19.188 -27.287 13.146 1.00 5.00 +ATOM 568 CA LYS C 65 19.791 -32.648 17.811 1.00 5.00 +ATOM 569 CB LYS C 65 22.800 -32.178 17.464 1.00 5.00 +ATOM 570 CA PRO C 66 18.198 -31.442 21.214 1.00 5.00 +ATOM 571 CB PRO C 66 17.722 -32.836 21.333 1.00 5.00 +ATOM 572 CA TRP C 67 21.096 -30.965 23.560 1.00 5.00 +ATOM 573 CB TRP C 67 24.067 -31.095 21.882 1.00 5.00 +ATOM 574 CA ALA C 68 18.965 -30.390 26.496 1.00 5.00 +ATOM 575 CB ALA C 68 19.649 -30.112 26.804 1.00 5.00 +ATOM 576 CA LEU C 69 15.569 -29.360 27.532 1.00 5.00 +ATOM 577 CB LEU C 69 13.542 -29.328 27.654 1.00 5.00 +ATOM 578 CA VAL C 70 16.363 -26.018 29.548 1.00 5.00 +ATOM 579 CB VAL C 70 17.682 -25.502 29.609 1.00 5.00 +ATOM 580 CA ILE C 71 13.294 -25.058 31.707 1.00 5.00 +ATOM 581 CB ILE C 71 12.355 -26.366 31.661 1.00 5.00 +ATOM 582 CA GLN C 72 13.822 -21.508 33.193 1.00 5.00 +ATOM 583 CB GLN C 72 14.492 -19.192 33.554 1.00 5.00 +ATOM 584 CA ASP C 73 11.204 -19.962 35.847 1.00 5.00 +ATOM 585 CB ASP C 73 10.450 -20.033 37.739 1.00 5.00 +ATOM 586 CA SER C 74 9.336 -17.183 37.501 1.00 5.00 +ATOM 587 CB SER C 74 8.212 -16.543 37.346 1.00 5.00 +ATOM 588 CA ASN C 75 12.313 -16.887 39.853 1.00 5.00 +ATOM 589 CB ASN C 75 11.841 -18.717 40.826 1.00 5.00 +ATOM 590 CA GLY C 76 15.365 -17.851 37.676 1.00 5.00 +ATOM 591 CA GLU C 77 15.726 -21.501 38.785 1.00 5.00 +ATOM 592 CB GLU C 77 14.400 -22.687 40.503 1.00 5.00 +ATOM 593 CA ASN C 78 16.667 -23.323 35.575 1.00 5.00 +ATOM 594 CB ASN C 78 17.504 -23.147 33.841 1.00 5.00 +ATOM 595 CA LYS C 79 15.358 -26.821 35.877 1.00 5.00 +ATOM 596 CB LYS C 79 14.172 -29.632 35.300 1.00 5.00 +ATOM 597 CA ILE C 80 17.780 -28.293 33.410 1.00 5.00 +ATOM 598 CB ILE C 80 19.425 -27.425 34.135 1.00 5.00 +ATOM 599 CA LYS C 81 17.267 -31.605 31.845 1.00 5.00 +ATOM 600 CB LYS C 81 14.789 -32.373 30.618 1.00 5.00 +ATOM 601 CA MET C 82 19.572 -33.921 29.624 1.00 5.00 +ATOM 602 CB MET C 82 21.750 -34.796 30.332 1.00 5.00 +ATOM 603 CA LEU C 83 17.255 -35.187 26.920 1.00 5.00 +ATOM 604 CB LEU C 83 16.576 -33.668 25.691 1.00 5.00 TER CONECT 1 3 2 CONECT 3 5 4