X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=examples%2FUNRES-Dock%2Foutput%2Fwham_T300K_0009.pdb;h=76b2b7fc32677cc93fad2fbbe3bed724d9732145;hb=86a7a0fff3fb6d1c18791c4d2723ee3173d2cf65;hp=a766bb2629ed978305be89652867af4fa4ecfcba;hpb=018446aca1e32faf80f41e818acbfc61e5d872c9;p=unres.git diff --git a/examples/UNRES-Dock/output/wham_T300K_0009.pdb b/examples/UNRES-Dock/output/wham_T300K_0009.pdb index a766bb2..76b2b7f 100644 --- a/examples/UNRES-Dock/output/wham_T300K_0009.pdb +++ b/examples/UNRES-Dock/output/wham_T300K_0009.pdb @@ -1,611 +1,611 @@ -REMARK CLUSTER 9 FREE ENERGY -1.19298E+01 AVE RMSD 0.00 -REMARK clustering ENERGY -1.16056E+01 RMS 0.00 -ATOM 1 CA ASP A 1 7.232 18.924 -1.988 1.00 5.00 -ATOM 2 CB ASP A 1 7.470 18.411 -3.923 1.00 5.00 -ATOM 3 CA TRP A 2 8.201 19.164 1.685 1.00 5.00 -ATOM 4 CB TRP A 2 9.691 17.843 4.294 1.00 5.00 -ATOM 5 CA THR A 3 5.055 20.014 3.572 1.00 5.00 -ATOM 6 CB THR A 3 5.038 21.327 2.967 1.00 5.00 -ATOM 7 CA THR A 4 3.144 17.179 1.819 1.00 5.00 -ATOM 8 CB THR A 4 3.298 17.863 0.527 1.00 5.00 -ATOM 9 CA PHE A 5 5.070 14.176 1.957 1.00 5.00 -ATOM 10 CB PHE A 5 7.920 13.414 1.395 1.00 5.00 -ATOM 11 CA ARG A 6 5.514 15.016 5.541 1.00 5.00 -ATOM 12 CB ARG A 6 7.016 17.204 7.323 1.00 5.00 -ATOM 13 CA ARG A 7 1.814 15.203 6.378 1.00 5.00 -ATOM 14 CB ARG A 7 -0.499 17.623 5.122 1.00 5.00 -ATOM 15 CA VAL A 8 1.438 11.820 4.621 1.00 5.00 -ATOM 16 CB VAL A 8 1.789 11.604 3.206 1.00 5.00 -ATOM 17 CA PHE A 9 4.225 10.431 6.445 1.00 5.00 -ATOM 18 CB PHE A 9 6.342 9.212 4.932 1.00 5.00 -ATOM 19 CA LEU A 10 3.319 11.959 9.711 1.00 5.00 -ATOM 20 CB LEU A 10 1.367 12.095 10.584 1.00 5.00 -ATOM 21 CA ILE A 11 6.908 13.104 10.123 1.00 5.00 -ATOM 22 CB ILE A 11 7.492 13.116 8.364 1.00 5.00 -ATOM 23 CA ASP A 12 7.981 15.973 12.425 1.00 5.00 -ATOM 24 CB ASP A 12 7.394 15.582 14.448 1.00 5.00 -ATOM 25 CA ASP A 13 9.081 19.378 12.267 1.00 5.00 -ATOM 26 CB ASP A 13 8.713 21.337 11.980 1.00 5.00 -ATOM 27 CA ALA A 14 12.490 19.058 14.026 1.00 5.00 -ATOM 28 CB ALA A 14 12.473 19.002 14.716 1.00 5.00 -ATOM 29 CA TRP A 15 13.217 16.793 11.067 1.00 5.00 -ATOM 30 CB TRP A 15 14.156 13.902 9.683 1.00 5.00 -ATOM 31 CA ARG A 16 13.144 19.267 8.166 1.00 5.00 -ATOM 32 CB ARG A 16 11.077 21.516 5.437 1.00 5.00 -ATOM 33 CA PRO A 17 16.578 20.465 8.309 1.00 5.00 -ATOM 34 CB PRO A 17 16.448 20.045 9.676 1.00 5.00 -ATOM 35 CA LEU A 18 17.869 17.404 6.773 1.00 5.00 -ATOM 36 CB LEU A 18 18.510 16.052 8.302 1.00 5.00 -ATOM 37 CA MET A 19 14.716 15.890 5.021 1.00 5.00 -ATOM 38 CB MET A 19 13.204 14.496 5.006 1.00 5.00 -ATOM 39 CA GLU A 20 13.619 18.350 2.387 1.00 5.00 -ATOM 40 CB GLU A 20 12.281 19.876 1.435 1.00 5.00 -ATOM 41 CA PRO A 21 17.419 18.444 0.775 1.00 5.00 -ATOM 42 CB PRO A 21 17.626 18.737 2.170 1.00 5.00 -ATOM 43 CA GLU A 22 16.522 15.093 -0.268 1.00 5.00 -ATOM 44 CB GLU A 22 17.433 12.897 0.005 1.00 5.00 -ATOM 45 CA LEU A 23 12.956 15.480 -1.765 1.00 5.00 -ATOM 46 CB LEU A 23 11.241 16.617 -1.346 1.00 5.00 -ATOM 47 CA ALA A 24 15.092 17.343 -4.573 1.00 5.00 -ATOM 48 CB ALA A 24 14.947 18.129 -4.489 1.00 5.00 -ATOM 49 CA ASN A 25 17.338 14.281 -5.536 1.00 5.00 -ATOM 50 CB ASN A 25 17.046 12.398 -5.048 1.00 5.00 -ATOM 51 CA PRO A 26 15.535 12.904 -8.499 1.00 5.00 -ATOM 52 CB PRO A 26 16.446 13.617 -9.159 1.00 5.00 -ATOM 53 CA LEU A 27 15.363 9.341 -7.184 1.00 5.00 -ATOM 54 CB LEU A 27 16.542 8.262 -8.479 1.00 5.00 -ATOM 55 CA THR A 28 13.563 10.923 -4.140 1.00 5.00 -ATOM 56 CB THR A 28 13.956 11.191 -2.826 1.00 5.00 -ATOM 57 CA ALA A 29 10.225 11.266 -6.308 1.00 5.00 -ATOM 58 CB ALA A 29 10.077 11.453 -7.023 1.00 5.00 -ATOM 59 CA HIS A 30 11.469 8.075 -8.155 1.00 5.00 -ATOM 60 CB HIS A 30 10.696 8.962 -10.682 1.00 5.00 -ATOM 61 CA LEU A 31 11.716 6.047 -5.041 1.00 5.00 -ATOM 62 CB LEU A 31 13.327 6.915 -3.968 1.00 5.00 -ATOM 63 CA LEU A 32 8.760 7.323 -3.472 1.00 5.00 -ATOM 64 CB LEU A 32 9.032 7.969 -1.439 1.00 5.00 -ATOM 65 CA ALA A 33 7.013 6.858 -6.684 1.00 5.00 -ATOM 66 CB ALA A 33 7.609 7.141 -7.049 1.00 5.00 -ATOM 67 CA GLU A 34 7.820 2.898 -6.651 1.00 5.00 -ATOM 68 CB GLU A 34 8.624 1.376 -8.331 1.00 5.00 -ATOM 69 CA TYR A 35 6.796 2.743 -2.831 1.00 5.00 -ATOM 70 CB TYR A 35 5.973 2.029 0.357 1.00 5.00 -ATOM 71 CA ASN A 36 3.546 3.880 -4.268 1.00 5.00 -ATOM 72 CB ASN A 36 2.995 5.664 -3.441 1.00 5.00 -ATOM 73 CA ARG A 37 2.475 1.345 -6.892 1.00 5.00 -ATOM 74 CB ARG A 37 2.683 -0.004 -9.151 1.00 5.00 -ATOM 75 CA ARG A 38 3.908 -1.285 -4.517 1.00 5.00 -ATOM 76 CB ARG A 38 6.296 -1.599 -6.878 1.00 5.00 -ATOM 77 CA CYS A 39 1.613 -0.071 -1.921 1.00 5.00 -ATOM 78 CB CYS A 39 1.911 0.808 -0.948 1.00 5.00 -ATOM 79 CA GLN A 40 -1.433 -0.769 -4.424 1.00 5.00 -ATOM 80 CB GLN A 40 -0.989 -0.515 -7.105 1.00 5.00 -ATOM 81 CA THR A 41 -0.199 -4.496 -4.889 1.00 5.00 -ATOM 82 CB THR A 41 0.956 -4.025 -5.606 1.00 5.00 -ATOM 83 CA GLU A 42 1.412 -5.712 -1.537 1.00 5.00 -ATOM 84 CB GLU A 42 2.453 -4.001 -1.247 1.00 5.00 -ATOM 85 CA GLU A 43 1.054 -5.545 2.049 1.00 5.00 -ATOM 86 CB GLU A 43 -0.630 -5.504 3.856 1.00 5.00 -ATOM 87 CA VAL A 44 4.011 -3.538 3.196 1.00 5.00 -ATOM 88 CB VAL A 44 4.892 -2.698 2.413 1.00 5.00 -ATOM 89 CA LEU A 45 5.069 -3.692 6.825 1.00 5.00 -ATOM 90 CB LEU A 45 4.849 -4.869 8.579 1.00 5.00 -ATOM 91 CA PRO A 46 5.480 0.008 8.039 1.00 5.00 -ATOM 92 CB PRO A 46 6.384 -0.184 6.961 1.00 5.00 -ATOM 93 CA PRO A 47 1.808 0.885 9.007 1.00 5.00 -ATOM 94 CB PRO A 47 2.026 0.244 10.227 1.00 5.00 -ATOM 95 CA ARG A 48 2.376 3.698 6.575 1.00 5.00 -ATOM 96 CB ARG A 48 2.414 5.965 4.173 1.00 5.00 -ATOM 97 CA GLU A 49 2.139 6.225 9.314 1.00 5.00 -ATOM 98 CB GLU A 49 0.934 4.241 10.274 1.00 5.00 -ATOM 99 CA ASP A 50 4.625 4.051 11.486 1.00 5.00 -ATOM 100 CB ASP A 50 5.370 3.623 13.395 1.00 5.00 -ATOM 101 CA VAL A 51 6.808 4.898 8.492 1.00 5.00 -ATOM 102 CB VAL A 51 6.573 4.543 7.061 1.00 5.00 -ATOM 103 CA PHE A 52 8.601 8.044 9.662 1.00 5.00 -ATOM 104 CB PHE A 52 10.677 9.042 7.937 1.00 5.00 -ATOM 105 CA SER A 53 7.998 6.988 12.991 1.00 5.00 -ATOM 106 CB SER A 53 6.775 6.694 13.013 1.00 5.00 -ATOM 107 CA TRP A 54 11.611 7.438 14.560 1.00 5.00 -ATOM 108 CB TRP A 54 13.938 7.566 11.694 1.00 5.00 -ATOM 109 CA THR A 55 11.733 11.116 13.659 1.00 5.00 -ATOM 110 CB THR A 55 11.443 11.570 12.284 1.00 5.00 -ATOM 111 CA ARG A 56 8.749 11.726 16.059 1.00 5.00 -ATOM 112 CB ARG A 56 6.467 10.672 13.799 1.00 5.00 -ATOM 113 CA TYR A 57 10.207 10.518 19.319 1.00 5.00 -ATOM 114 CB TYR A 57 9.336 7.969 17.439 1.00 5.00 -ATOM 115 CA CYS A 58 13.019 12.639 19.579 1.00 5.00 -ATOM 116 CB CYS A 58 13.826 11.567 19.519 1.00 5.00 -ATOM 117 CA THR A 59 14.700 15.592 17.467 1.00 5.00 -ATOM 118 CB THR A 59 13.845 16.494 18.072 1.00 5.00 -ATOM 119 CA PRO A 60 17.980 15.517 15.573 1.00 5.00 -ATOM 120 CB PRO A 60 17.086 15.671 14.461 1.00 5.00 -ATOM 121 CA ASP A 61 19.799 17.768 18.062 1.00 5.00 -ATOM 122 CB ASP A 61 20.507 19.377 17.054 1.00 5.00 -ATOM 123 CA GLU A 62 18.515 15.524 20.684 1.00 5.00 -ATOM 124 CB GLU A 62 16.362 15.335 21.812 1.00 5.00 -ATOM 125 CA VAL A 63 20.156 12.339 19.800 1.00 5.00 -ATOM 126 CB VAL A 63 20.405 11.617 18.446 1.00 5.00 -ATOM 127 CA ARG A 64 23.189 10.838 20.934 1.00 5.00 -ATOM 128 CB ARG A 64 21.904 9.859 23.849 1.00 5.00 -ATOM 129 CA VAL A 65 23.269 7.253 19.593 1.00 5.00 -ATOM 130 CB VAL A 65 23.204 6.568 20.890 1.00 5.00 -ATOM 131 CA VAL A 66 22.457 5.903 15.887 1.00 5.00 -ATOM 132 CB VAL A 66 22.541 6.786 14.713 1.00 5.00 -ATOM 133 CA ILE A 67 21.862 2.019 15.860 1.00 5.00 -ATOM 134 CB ILE A 67 21.326 1.362 17.617 1.00 5.00 -ATOM 135 CA ILE A 68 21.035 0.899 12.209 1.00 5.00 -ATOM 136 CB ILE A 68 21.996 1.344 10.646 1.00 5.00 -ATOM 137 CA GLY A 69 19.446 -2.248 11.125 1.00 5.00 -ATOM 138 CA GLN A 70 18.324 -4.299 8.069 1.00 5.00 -ATOM 139 CB GLN A 70 20.393 -5.622 8.357 1.00 5.00 -ATOM 140 CA ASP A 71 14.587 -3.911 7.132 1.00 5.00 -ATOM 141 CB ASP A 71 14.604 -5.725 7.948 1.00 5.00 -ATOM 142 CA PRO A 72 11.550 -3.398 9.211 1.00 5.00 -ATOM 143 CB PRO A 72 11.055 -2.568 8.181 1.00 5.00 -ATOM 144 CA TYR A 73 10.393 -6.900 10.486 1.00 5.00 -ATOM 145 CB TYR A 73 12.594 -6.889 13.061 1.00 5.00 -ATOM 146 CA HIS A 74 8.064 -8.667 8.271 1.00 5.00 -ATOM 147 CB HIS A 74 9.375 -10.674 6.968 1.00 5.00 -ATOM 148 CA HIS A 75 5.096 -10.281 10.119 1.00 5.00 -ATOM 149 CB HIS A 75 6.247 -12.190 11.556 1.00 5.00 -ATOM 150 CA PRO A 76 1.766 -8.085 10.832 1.00 5.00 -ATOM 151 CB PRO A 76 1.252 -9.361 10.293 1.00 5.00 -ATOM 152 CA GLY A 77 2.821 -6.221 13.929 1.00 5.00 -ATOM 153 CA GLN A 78 6.476 -6.877 14.207 1.00 5.00 -ATOM 154 CB GLN A 78 6.507 -9.598 14.871 1.00 5.00 -ATOM 155 CA ALA A 79 7.507 -3.224 13.440 1.00 5.00 -ATOM 156 CB ALA A 79 7.395 -2.678 12.914 1.00 5.00 -ATOM 157 CA HIS A 80 7.385 0.319 14.930 1.00 5.00 -ATOM 158 CB HIS A 80 8.239 0.174 17.484 1.00 5.00 -ATOM 159 CA GLY A 81 9.146 2.482 12.179 1.00 5.00 -ATOM 160 CA LEU A 82 12.424 1.405 14.067 1.00 5.00 -ATOM 161 CB LEU A 82 12.494 2.993 15.429 1.00 5.00 -ATOM 162 CA ALA A 83 15.235 -1.027 13.635 1.00 5.00 -ATOM 163 CB ALA A 83 15.729 -0.587 13.275 1.00 5.00 -ATOM 164 CA PHE A 84 15.057 -4.106 16.261 1.00 5.00 -ATOM 165 CB PHE A 84 17.904 -3.529 15.911 1.00 5.00 -ATOM 166 CA SER A 85 12.449 -3.271 18.750 1.00 5.00 -ATOM 167 CB SER A 85 12.041 -2.054 19.123 1.00 5.00 -ATOM 168 CA VAL A 86 8.845 -4.381 18.731 1.00 5.00 -ATOM 169 CB VAL A 86 8.949 -5.875 18.657 1.00 5.00 -ATOM 170 CA ARG A 87 5.739 -3.152 19.755 1.00 5.00 -ATOM 171 CB ARG A 87 4.787 -2.380 16.405 1.00 5.00 -ATOM 172 CA ALA A 88 5.117 -4.461 23.031 1.00 5.00 -ATOM 173 CB ALA A 88 5.164 -3.911 23.572 1.00 5.00 -ATOM 174 CA ASN A 89 2.230 -6.382 22.137 1.00 5.00 -ATOM 175 CB ASN A 89 0.296 -6.532 22.174 1.00 5.00 -ATOM 176 CA VAL A 90 4.597 -8.707 20.072 1.00 5.00 -ATOM 177 CB VAL A 90 4.749 -7.811 18.869 1.00 5.00 -ATOM 178 CA PRO A 91 7.444 -11.057 21.066 1.00 5.00 -ATOM 179 CB PRO A 91 7.143 -11.724 19.847 1.00 5.00 -ATOM 180 CA PRO A 92 11.251 -10.137 20.962 1.00 5.00 -ATOM 181 CB PRO A 92 11.067 -10.683 22.285 1.00 5.00 -ATOM 182 CA PRO A 93 12.727 -11.582 17.685 1.00 5.00 -ATOM 183 CB PRO A 93 12.512 -10.255 17.304 1.00 5.00 -ATOM 184 CA PRO A 94 15.621 -13.397 19.033 1.00 5.00 -ATOM 185 CB PRO A 94 15.011 -14.498 18.428 1.00 5.00 -ATOM 186 CA SER A 95 17.845 -10.966 17.892 1.00 5.00 -ATOM 187 CB SER A 95 18.224 -10.605 16.753 1.00 5.00 -ATOM 188 CA LEU A 96 16.330 -8.348 19.909 1.00 5.00 -ATOM 189 CB LEU A 96 15.055 -7.208 20.387 1.00 5.00 -ATOM 190 CA ARG A 97 16.353 -10.779 22.946 1.00 5.00 -ATOM 191 CB ARG A 97 16.221 -13.787 24.301 1.00 5.00 -ATOM 192 CA ASN A 98 20.022 -11.315 22.121 1.00 5.00 -ATOM 193 CB ASN A 98 21.412 -11.226 20.643 1.00 5.00 -ATOM 194 CA VAL A 99 20.575 -7.514 22.111 1.00 5.00 -ATOM 195 CB VAL A 99 20.067 -6.685 21.129 1.00 5.00 -ATOM 196 CA LEU A 100 18.670 -6.895 25.180 1.00 5.00 -ATOM 197 CB LEU A 100 16.685 -6.534 24.884 1.00 5.00 -ATOM 198 CA ALA A 101 21.143 -9.530 26.659 1.00 5.00 -ATOM 199 CB ALA A 101 21.175 -10.244 26.354 1.00 5.00 -ATOM 200 CA ALA A 102 24.285 -7.412 26.373 1.00 5.00 -ATOM 201 CB ALA A 102 25.104 -7.138 26.343 1.00 5.00 -ATOM 202 CA VAL A 103 22.541 -4.679 28.128 1.00 5.00 -ATOM 203 CB VAL A 103 21.597 -4.119 27.158 1.00 5.00 -ATOM 204 CA LYS A 104 21.859 -7.088 31.210 1.00 5.00 -ATOM 205 CB LYS A 104 19.323 -7.910 31.398 1.00 5.00 -ATOM 206 CA ASN A 105 25.399 -7.834 31.318 1.00 5.00 -ATOM 207 CB ASN A 105 25.303 -8.996 29.710 1.00 5.00 -ATOM 208 CA CYS A 106 26.452 -4.306 31.185 1.00 5.00 -ATOM 209 CB CYS A 106 26.914 -4.024 29.946 1.00 5.00 -ATOM 210 CA TYR A 107 23.813 -3.361 33.673 1.00 5.00 -ATOM 211 CB TYR A 107 23.160 -0.566 31.700 1.00 5.00 -ATOM 212 CA PRO A 108 23.570 -6.120 36.269 1.00 5.00 -ATOM 213 CB PRO A 108 24.845 -6.672 36.028 1.00 5.00 -ATOM 214 CA GLU A 109 21.341 -4.036 38.649 1.00 5.00 -ATOM 215 CB GLU A 109 23.391 -2.403 39.640 1.00 5.00 -ATOM 216 CA ALA A 110 19.242 -3.010 35.657 1.00 5.00 -ATOM 217 CB ALA A 110 19.623 -3.363 35.083 1.00 5.00 -ATOM 218 CA ARG A 111 15.578 -3.736 36.441 1.00 5.00 -ATOM 219 CB ARG A 111 15.911 -0.293 37.253 1.00 5.00 -ATOM 220 CA MET A 112 15.284 -4.771 32.815 1.00 5.00 -ATOM 221 CB MET A 112 16.054 -4.520 30.924 1.00 5.00 -ATOM 222 CA SER A 113 11.491 -5.704 32.648 1.00 5.00 -ATOM 223 CB SER A 113 10.674 -5.244 31.666 1.00 5.00 -ATOM 224 CA GLY A 114 10.983 -8.294 30.028 1.00 5.00 -ATOM 225 CA HIS A 115 9.403 -7.291 26.845 1.00 5.00 -ATOM 226 CB HIS A 115 6.758 -7.449 26.105 1.00 5.00 -ATOM 227 CA GLY A 116 10.752 -5.504 23.659 1.00 5.00 -ATOM 228 CA CYS A 117 9.600 -1.956 23.219 1.00 5.00 -ATOM 229 CB CYS A 117 9.517 -1.777 24.706 1.00 5.00 -ATOM 230 CA LEU A 118 12.835 0.085 22.670 1.00 5.00 -ATOM 231 CB LEU A 118 14.522 -0.841 22.098 1.00 5.00 -ATOM 232 CA GLU A 119 10.676 3.087 22.453 1.00 5.00 -ATOM 233 CB GLU A 119 10.454 3.086 20.116 1.00 5.00 -ATOM 234 CA LYS A 120 12.220 4.229 25.738 1.00 5.00 -ATOM 235 CB LYS A 120 10.839 3.639 28.401 1.00 5.00 -ATOM 236 CA TRP A 121 15.713 4.531 24.275 1.00 5.00 -ATOM 237 CB TRP A 121 16.612 1.398 24.954 1.00 5.00 -ATOM 238 CA ALA A 122 14.274 5.927 21.189 1.00 5.00 -ATOM 239 CB ALA A 122 13.788 5.811 20.688 1.00 5.00 -ATOM 240 CA ARG A 123 12.507 8.807 23.340 1.00 5.00 -ATOM 241 CB ARG A 123 9.191 8.460 21.925 1.00 5.00 -ATOM 242 CA ASP A 124 15.919 9.152 25.274 1.00 5.00 -ATOM 243 CB ASP A 124 16.064 7.508 26.511 1.00 5.00 -ATOM 244 CA GLY A 125 18.034 9.254 22.106 1.00 5.00 -ATOM 245 CA VAL A 126 18.865 5.907 20.271 1.00 5.00 -ATOM 246 CB VAL A 126 18.564 4.576 20.888 1.00 5.00 -ATOM 247 CA LEU A 127 18.285 6.903 16.621 1.00 5.00 -ATOM 248 CB LEU A 127 17.694 8.359 15.235 1.00 5.00 -ATOM 249 CA LEU A 128 17.352 3.462 15.543 1.00 5.00 -ATOM 250 CB LEU A 128 16.573 1.693 16.615 1.00 5.00 -ATOM 251 CA LEU A 129 17.715 3.329 11.680 1.00 5.00 -ATOM 252 CB LEU A 129 18.797 5.147 11.385 1.00 5.00 -ATOM 253 CA ASN A 130 16.254 0.841 9.271 1.00 5.00 -ATOM 254 CB ASN A 130 14.486 1.884 9.478 1.00 5.00 -ATOM 255 CA THR A 131 18.467 0.805 6.169 1.00 5.00 -ATOM 256 CB THR A 131 19.777 -0.013 5.898 1.00 5.00 -ATOM 257 CA THR A 132 15.432 -0.307 4.188 1.00 5.00 -ATOM 258 CB THR A 132 15.886 -1.646 4.403 1.00 5.00 -ATOM 259 CA LEU A 133 12.223 1.389 5.460 1.00 5.00 -ATOM 260 CB LEU A 133 11.890 3.359 5.871 1.00 5.00 -ATOM 261 CA THR A 134 9.998 -0.604 3.344 1.00 5.00 -ATOM 262 CB THR A 134 9.780 0.001 1.936 1.00 5.00 -ATOM 263 CA VAL A 135 9.318 -4.357 3.500 1.00 5.00 -ATOM 264 CB VAL A 135 9.209 -5.019 4.831 1.00 5.00 -ATOM 265 CA LYS A 136 6.773 -6.668 1.649 1.00 5.00 -ATOM 266 CB LYS A 136 5.501 -6.220 -1.071 1.00 5.00 -ATOM 267 CA ARG A 137 4.361 -8.401 4.410 1.00 5.00 -ATOM 268 CB ARG A 137 1.981 -6.638 6.099 1.00 5.00 -ATOM 269 CA GLY A 138 6.109 -11.665 3.606 1.00 5.00 -ATOM 270 CA ALA A 139 9.207 -10.672 1.474 1.00 5.00 -ATOM 271 CB ALA A 139 8.774 -10.395 0.954 1.00 5.00 -ATOM 272 CA ALA A 140 12.458 -10.012 3.661 1.00 5.00 -ATOM 273 CB ALA A 140 13.005 -10.060 4.225 1.00 5.00 -ATOM 274 CA ALA A 141 14.608 -7.609 1.659 1.00 5.00 -ATOM 275 CB ALA A 141 15.357 -7.349 1.731 1.00 5.00 -ATOM 276 CA SER A 142 11.647 -7.100 -0.738 1.00 5.00 -ATOM 277 CB SER A 142 10.506 -7.135 -0.067 1.00 5.00 -ATOM 278 CA HIS A 143 11.766 -3.561 -1.545 1.00 5.00 -ATOM 279 CB HIS A 143 9.119 -2.749 -1.655 1.00 5.00 -ATOM 280 CA SER A 144 15.237 -3.241 -0.228 1.00 5.00 -ATOM 281 CB SER A 144 16.340 -3.840 0.074 1.00 5.00 -ATOM 282 CA ARG A 145 16.663 -2.698 -3.882 1.00 5.00 -ATOM 283 CB ARG A 145 14.205 -4.768 -3.781 1.00 5.00 -ATOM 284 CA ILE A 146 14.514 0.399 -4.248 1.00 5.00 -ATOM 285 CB ILE A 146 13.045 1.232 -3.565 1.00 5.00 -ATOM 286 CA GLY A 147 17.035 2.968 -2.914 1.00 5.00 -ATOM 287 CA TRP A 148 15.620 3.884 0.507 1.00 5.00 -ATOM 288 CB TRP A 148 12.515 4.520 1.367 1.00 5.00 -ATOM 289 CA ASP A 149 19.013 3.571 1.946 1.00 5.00 -ATOM 290 CB ASP A 149 20.049 2.692 0.428 1.00 5.00 -ATOM 291 CA ARG A 150 20.529 6.349 -0.304 1.00 5.00 -ATOM 292 CB ARG A 150 19.484 5.802 -3.580 1.00 5.00 -ATOM 293 CA PHE A 151 17.671 8.443 1.467 1.00 5.00 -ATOM 294 CB PHE A 151 14.712 9.154 2.254 1.00 5.00 -ATOM 295 CA VAL A 152 18.667 7.071 4.940 1.00 5.00 -ATOM 296 CB VAL A 152 18.044 6.179 5.709 1.00 5.00 -ATOM 297 CA GLY A 153 22.553 7.811 4.201 1.00 5.00 -ATOM 298 CA GLY A 154 21.922 11.284 2.886 1.00 5.00 -ATOM 299 CA VAL A 155 19.630 12.047 5.916 1.00 5.00 -ATOM 300 CB VAL A 155 18.192 11.571 5.750 1.00 5.00 -ATOM 301 CA ILE A 156 22.296 10.497 8.382 1.00 5.00 -ATOM 302 CB ILE A 156 22.204 8.586 7.986 1.00 5.00 -ATOM 303 CA ARG A 157 25.198 12.480 6.635 1.00 5.00 -ATOM 304 CB ARG A 157 26.871 9.689 5.256 1.00 5.00 -ATOM 305 CA ARG A 158 23.566 15.899 7.334 1.00 5.00 -ATOM 306 CB ARG A 158 21.534 15.783 4.439 1.00 5.00 -ATOM 307 CA LEU A 159 23.157 14.684 10.936 1.00 5.00 -ATOM 308 CB LEU A 159 22.285 14.348 12.431 1.00 5.00 -ATOM 309 CA ALA A 160 26.685 13.295 10.728 1.00 5.00 -ATOM 310 CB ALA A 160 26.856 13.057 9.949 1.00 5.00 -ATOM 311 CA ALA A 161 27.717 16.868 9.636 1.00 5.00 -ATOM 312 CB ALA A 161 28.085 17.072 8.995 1.00 5.00 -ATOM 313 CA ARG A 162 25.896 18.542 12.467 1.00 5.00 -ATOM 314 CB ARG A 162 22.512 19.392 13.036 1.00 5.00 -ATOM 315 CA ARG A 163 26.960 16.779 15.511 1.00 5.00 -ATOM 316 CB ARG A 163 24.758 16.290 18.088 1.00 5.00 -ATOM 317 CA PRO A 164 30.732 16.066 15.618 1.00 5.00 -ATOM 318 CB PRO A 164 31.052 17.395 15.224 1.00 5.00 -ATOM 319 CA GLY A 165 30.232 13.643 18.667 1.00 5.00 -ATOM 320 CA LEU A 166 27.254 11.272 18.048 1.00 5.00 -ATOM 321 CB LEU A 166 25.951 11.350 16.827 1.00 5.00 -ATOM 322 CA VAL A 167 27.743 7.409 18.841 1.00 5.00 -ATOM 323 CB VAL A 167 27.546 6.865 20.206 1.00 5.00 -ATOM 324 CA PHE A 168 27.039 5.248 15.689 1.00 5.00 -ATOM 325 CB PHE A 168 27.588 7.653 13.901 1.00 5.00 -ATOM 326 CA MET A 169 26.632 1.553 16.344 1.00 5.00 -ATOM 327 CB MET A 169 26.124 1.770 18.868 1.00 5.00 -ATOM 328 CA LEU A 170 27.674 -0.810 13.397 1.00 5.00 -ATOM 329 CB LEU A 170 28.683 -0.079 12.136 1.00 5.00 -ATOM 330 CA TRP A 171 26.363 -4.397 14.348 1.00 5.00 -ATOM 331 CB TRP A 171 24.703 -3.112 17.039 1.00 5.00 -ATOM 332 CA GLY A 172 27.133 -6.386 11.045 1.00 5.00 -ATOM 333 CA THR A 173 29.505 -5.863 8.139 1.00 5.00 -ATOM 334 CB THR A 173 30.293 -6.607 7.217 1.00 5.00 -ATOM 335 CA HIS A 174 26.369 -5.308 6.042 1.00 5.00 -ATOM 336 CB HIS A 174 23.781 -6.063 5.681 1.00 5.00 -ATOM 337 CA ALA A 175 25.609 -2.443 8.194 1.00 5.00 -ATOM 338 CB ALA A 175 24.942 -2.123 8.606 1.00 5.00 -ATOM 339 CA GLN A 176 29.302 -1.326 8.455 1.00 5.00 -ATOM 340 CB GLN A 176 31.418 -2.382 8.896 1.00 5.00 -ATOM 341 CA ASN A 177 29.511 -1.035 4.508 1.00 5.00 -ATOM 342 CB ASN A 177 29.593 -2.286 3.013 1.00 5.00 -ATOM 343 CA ALA A 178 25.926 0.593 4.561 1.00 5.00 -ATOM 344 CB ALA A 178 25.459 0.174 4.986 1.00 5.00 -ATOM 345 CA ILE A 179 27.606 3.256 6.797 1.00 5.00 -ATOM 346 CB ILE A 179 27.059 3.980 8.233 1.00 5.00 -ATOM 347 CA ARG A 180 30.910 5.141 7.351 1.00 5.00 -ATOM 348 CB ARG A 180 33.436 4.675 4.950 1.00 5.00 -ATOM 349 CA PRO A 181 30.336 8.137 9.399 1.00 5.00 -ATOM 350 CB PRO A 181 30.094 6.901 10.113 1.00 5.00 -ATOM 351 CA ASP A 182 33.280 10.542 9.919 1.00 5.00 -ATOM 352 CB ASP A 182 34.665 12.076 9.396 1.00 5.00 -ATOM 353 CA PRO A 183 35.461 8.592 12.313 1.00 5.00 -ATOM 354 CB PRO A 183 35.833 7.841 11.251 1.00 5.00 -ATOM 355 CA ARG A 184 37.818 11.090 13.686 1.00 5.00 -ATOM 356 CB ARG A 184 38.541 12.005 10.581 1.00 5.00 -ATOM 357 CA VAL A 185 34.732 13.129 14.666 1.00 5.00 -ATOM 358 CB VAL A 185 33.989 13.976 13.702 1.00 5.00 -ATOM 359 CA HIS A 186 32.276 10.327 15.886 1.00 5.00 -ATOM 360 CB HIS A 186 30.183 11.840 14.992 1.00 5.00 -ATOM 361 CA CYS A 187 32.323 7.041 18.073 1.00 5.00 -ATOM 362 CB CYS A 187 31.782 6.363 19.149 1.00 5.00 -ATOM 363 CA VAL A 188 31.249 4.563 15.097 1.00 5.00 -ATOM 364 CB VAL A 188 32.127 4.166 13.862 1.00 5.00 -ATOM 365 CA LEU A 189 31.420 1.182 17.046 1.00 5.00 -ATOM 366 CB LEU A 189 30.849 1.537 19.029 1.00 5.00 -ATOM 367 CA LYS A 190 31.555 -2.011 14.798 1.00 5.00 -ATOM 368 CB LYS A 190 34.138 -0.875 13.155 1.00 5.00 -ATOM 369 CA PHE A 191 30.753 -5.639 16.075 1.00 5.00 -ATOM 370 CB PHE A 191 31.626 -4.487 18.807 1.00 5.00 -ATOM 371 CA SER A 192 29.668 -8.938 14.950 1.00 5.00 -ATOM 372 CB SER A 192 29.410 -9.939 15.785 1.00 5.00 -ATOM 373 CA HIS A 193 25.749 -9.223 14.469 1.00 5.00 -ATOM 374 CB HIS A 193 27.290 -10.247 12.664 1.00 5.00 -ATOM 375 CA PRO A 194 22.853 -9.371 16.750 1.00 5.00 -ATOM 376 CB PRO A 194 22.355 -8.092 16.556 1.00 5.00 -ATOM 377 CA SER A 195 21.647 -12.674 15.617 1.00 5.00 -ATOM 378 CB SER A 195 22.219 -12.859 14.471 1.00 5.00 -ATOM 379 CA PRO A 196 22.155 -16.358 16.918 1.00 5.00 -ATOM 380 CB PRO A 196 20.796 -16.378 17.031 1.00 5.00 -ATOM 381 CA LEU A 197 24.324 -17.726 14.271 1.00 5.00 -ATOM 382 CB LEU A 197 23.407 -18.687 12.734 1.00 5.00 -ATOM 383 CA SER A 198 27.123 -15.345 14.230 1.00 5.00 -ATOM 384 CB SER A 198 26.940 -14.669 15.365 1.00 5.00 -ATOM 385 CA LYS A 199 30.234 -16.948 15.694 1.00 5.00 -ATOM 386 CB LYS A 199 31.003 -14.283 14.411 1.00 5.00 -ATOM 387 CA VAL A 200 30.434 -14.800 18.942 1.00 5.00 -ATOM 388 CB VAL A 200 31.457 -13.781 19.542 1.00 5.00 -ATOM 389 CA PRO A 201 27.434 -15.049 21.328 1.00 5.00 -ATOM 390 CB PRO A 201 28.330 -15.189 22.451 1.00 5.00 -ATOM 391 CA PHE A 202 26.282 -11.410 21.152 1.00 5.00 -ATOM 392 CB PHE A 202 25.345 -8.621 20.603 1.00 5.00 -ATOM 393 CA GLY A 203 25.943 -11.287 24.744 1.00 5.00 -ATOM 394 CA THR A 204 29.695 -10.484 24.941 1.00 5.00 -ATOM 395 CB THR A 204 30.576 -11.623 24.695 1.00 5.00 -ATOM 396 CA CYS A 205 29.325 -6.788 23.429 1.00 5.00 -ATOM 397 CB CYS A 205 29.272 -7.144 22.050 1.00 5.00 -ATOM 398 CA GLN A 206 29.811 -4.042 25.937 1.00 5.00 -ATOM 399 CB GLN A 206 31.671 -3.482 27.353 1.00 5.00 -ATOM 400 CA HIS A 207 28.945 -1.393 23.464 1.00 5.00 -ATOM 401 CB HIS A 207 27.872 -2.931 21.428 1.00 5.00 -ATOM 402 CA PHE A 208 26.096 -0.412 25.491 1.00 5.00 -ATOM 403 CB PHE A 208 24.618 -2.379 23.897 1.00 5.00 -ATOM 404 CA LEU A 209 28.572 0.818 28.506 1.00 5.00 -ATOM 405 CB LEU A 209 27.718 1.420 30.254 1.00 5.00 -ATOM 406 CA VAL A 210 31.586 1.780 26.201 1.00 5.00 -ATOM 407 CB VAL A 210 32.160 0.865 25.187 1.00 5.00 -ATOM 408 CA ALA A 211 29.234 4.109 24.322 1.00 5.00 -ATOM 409 CB ALA A 211 28.713 3.582 24.236 1.00 5.00 -ATOM 410 CA ASN A 212 28.138 5.630 27.783 1.00 5.00 -ATOM 411 CB ASN A 212 28.065 5.436 29.888 1.00 5.00 -ATOM 412 CA ARG A 213 32.008 5.990 28.177 1.00 5.00 -ATOM 413 CB ARG A 213 35.170 5.734 27.869 1.00 5.00 -ATOM 414 CA TYR A 214 31.924 7.927 25.224 1.00 5.00 -ATOM 415 CB TYR A 214 31.262 9.040 22.237 1.00 5.00 -ATOM 416 CA LEU A 215 28.888 10.089 26.265 1.00 5.00 -ATOM 417 CB LEU A 215 27.400 8.747 25.608 1.00 5.00 -ATOM 418 CA GLU A 216 30.853 10.508 29.601 1.00 5.00 -ATOM 419 CB GLU A 216 31.942 10.885 31.742 1.00 5.00 -ATOM 420 CA THR A 217 33.933 12.099 28.120 1.00 5.00 -ATOM 421 CB THR A 217 34.100 11.306 26.927 1.00 5.00 -ATOM 422 CA ARG A 218 31.679 14.638 26.401 1.00 5.00 -ATOM 423 CB ARG A 218 29.683 13.788 23.875 1.00 5.00 -ATOM 424 CA SER A 219 29.513 15.788 29.382 1.00 5.00 -ATOM 425 CB SER A 219 29.392 17.051 29.644 1.00 5.00 -ATOM 426 CA ILE A 220 26.269 14.220 28.058 1.00 5.00 -ATOM 427 CB ILE A 220 25.657 14.009 26.514 1.00 5.00 -ATOM 428 CA SER A 221 23.762 12.046 29.928 1.00 5.00 -ATOM 429 CB SER A 221 22.867 11.690 29.031 1.00 5.00 -ATOM 430 CA PRO A 222 24.921 8.485 30.215 1.00 5.00 -ATOM 431 CB PRO A 222 24.658 8.659 31.578 1.00 5.00 -ATOM 432 CA ILE A 223 22.381 5.967 28.440 1.00 5.00 -ATOM 433 CB ILE A 223 23.163 4.736 27.236 1.00 5.00 -ATOM 434 CA ASP A 224 19.644 4.222 30.488 1.00 5.00 -ATOM 435 CB ASP A 224 17.865 3.915 31.390 1.00 5.00 -ATOM 436 CA TRP A 225 19.487 0.677 29.005 1.00 5.00 -ATOM 437 CB TRP A 225 20.822 1.365 25.529 1.00 5.00 -ATOM 438 CA SER A 226 16.527 -0.890 30.729 1.00 5.00 -ATOM 439 CB SER A 226 16.043 0.400 30.735 1.00 5.00 -ATOM 440 CA VAL A 227 13.448 -1.317 28.747 1.00 5.00 -ATOM 441 CB VAL A 227 13.826 -1.872 27.499 1.00 5.00 +REMARK CLUSTER 9 FREE ENERGY -1.35974E+01 AVE RMSD 0.00 +REMARK clustering ENERGY -1.13156E+01 RMS 0.00 +ATOM 1 CA ASP A 1 24.556 -0.042 -17.249 1.00 5.00 +ATOM 2 CB ASP A 1 24.210 -1.659 -18.466 1.00 5.00 +ATOM 3 CA TRP A 2 22.458 1.059 -14.342 1.00 5.00 +ATOM 4 CB TRP A 2 24.104 -0.315 -11.569 1.00 5.00 +ATOM 5 CA THR A 3 19.232 1.775 -15.745 1.00 5.00 +ATOM 6 CB THR A 3 19.591 2.647 -16.793 1.00 5.00 +ATOM 7 CA THR A 4 19.098 -1.660 -17.343 1.00 5.00 +ATOM 8 CB THR A 4 19.267 -1.242 -18.700 1.00 5.00 +ATOM 9 CA PHE A 5 20.672 -3.464 -14.237 1.00 5.00 +ATOM 10 CB PHE A 5 22.459 -4.164 -12.039 1.00 5.00 +ATOM 11 CA ARG A 6 18.702 -1.106 -12.102 1.00 5.00 +ATOM 12 CB ARG A 6 16.804 1.276 -10.275 1.00 5.00 +ATOM 13 CA ARG A 7 15.521 -2.202 -13.620 1.00 5.00 +ATOM 14 CB ARG A 7 14.245 -1.929 -16.406 1.00 5.00 +ATOM 15 CA VAL A 8 16.554 -5.876 -13.557 1.00 5.00 +ATOM 16 CB VAL A 8 17.646 -6.459 -14.527 1.00 5.00 +ATOM 17 CA PHE A 9 17.240 -6.040 -9.927 1.00 5.00 +ATOM 18 CB PHE A 9 19.899 -7.353 -9.292 1.00 5.00 +ATOM 19 CA LEU A 10 14.599 -3.296 -9.163 1.00 5.00 +ATOM 20 CB LEU A 10 13.167 -4.643 -9.678 1.00 5.00 +ATOM 21 CA ILE A 11 16.937 -1.179 -6.987 1.00 5.00 +ATOM 22 CB ILE A 11 18.886 -1.156 -7.375 1.00 5.00 +ATOM 23 CA ASP A 12 16.636 2.312 -5.696 1.00 5.00 +ATOM 24 CB ASP A 12 16.405 2.173 -3.747 1.00 5.00 +ATOM 25 CA ASP A 13 17.937 5.719 -6.837 1.00 5.00 +ATOM 26 CB ASP A 13 18.315 6.546 -8.689 1.00 5.00 +ATOM 27 CA ALA A 14 19.410 6.661 -3.369 1.00 5.00 +ATOM 28 CB ALA A 14 19.256 7.164 -2.831 1.00 5.00 +ATOM 29 CA TRP A 15 21.403 3.510 -3.605 1.00 5.00 +ATOM 30 CB TRP A 15 23.773 2.025 -1.245 1.00 5.00 +ATOM 31 CA ARG A 16 22.747 4.694 -6.987 1.00 5.00 +ATOM 32 CB ARG A 16 22.350 4.151 -10.535 1.00 5.00 +ATOM 33 CA PRO A 17 25.123 6.669 -5.401 1.00 5.00 +ATOM 34 CB PRO A 17 23.975 7.465 -5.374 1.00 5.00 +ATOM 35 CA LEU A 18 27.415 3.910 -3.968 1.00 5.00 +ATOM 36 CB LEU A 18 28.014 3.357 -2.099 1.00 5.00 +ATOM 37 CA MET A 19 26.228 1.152 -6.078 1.00 5.00 +ATOM 38 CB MET A 19 24.801 -0.590 -4.963 1.00 5.00 +ATOM 39 CA GLU A 20 27.262 2.064 -9.567 1.00 5.00 +ATOM 40 CB GLU A 20 26.834 4.287 -10.422 1.00 5.00 +ATOM 41 CA PRO A 21 31.211 2.227 -8.366 1.00 5.00 +ATOM 42 CB PRO A 21 30.524 3.045 -7.450 1.00 5.00 +ATOM 43 CA GLU A 22 31.168 -1.454 -8.313 1.00 5.00 +ATOM 44 CB GLU A 22 30.334 -1.797 -5.597 1.00 5.00 +ATOM 45 CA LEU A 23 29.340 -1.973 -11.615 1.00 5.00 +ATOM 46 CB LEU A 23 28.009 -3.333 -12.269 1.00 5.00 +ATOM 47 CA ALA A 24 32.520 -0.584 -13.040 1.00 5.00 +ATOM 48 CB ALA A 24 32.880 -0.127 -12.494 1.00 5.00 +ATOM 49 CA ASN A 25 34.540 -3.528 -11.745 1.00 5.00 +ATOM 50 CB ASN A 25 35.562 -4.223 -10.047 1.00 5.00 +ATOM 51 CA PRO A 26 34.302 -6.671 -13.727 1.00 5.00 +ATOM 52 CB PRO A 26 35.177 -5.760 -14.496 1.00 5.00 +ATOM 53 CA LEU A 27 33.726 -9.264 -11.163 1.00 5.00 +ATOM 54 CB LEU A 27 33.699 -10.450 -9.494 1.00 5.00 +ATOM 55 CA THR A 28 30.355 -7.559 -10.713 1.00 5.00 +ATOM 56 CB THR A 28 31.119 -6.184 -10.646 1.00 5.00 +ATOM 57 CA ALA A 29 29.672 -8.508 -14.283 1.00 5.00 +ATOM 58 CB ALA A 29 30.118 -7.984 -14.152 1.00 5.00 +ATOM 59 CA HIS A 30 31.099 -12.164 -13.724 1.00 5.00 +ATOM 60 CB HIS A 30 33.300 -12.215 -15.343 1.00 5.00 +ATOM 61 CA LEU A 31 29.155 -12.384 -10.679 1.00 5.00 +ATOM 62 CB LEU A 31 29.149 -11.701 -8.992 1.00 5.00 +ATOM 63 CA LEU A 32 26.127 -10.996 -12.537 1.00 5.00 +ATOM 64 CB LEU A 32 24.481 -10.279 -12.383 1.00 5.00 +ATOM 65 CA ALA A 33 26.614 -13.762 -15.177 1.00 5.00 +ATOM 66 CB ALA A 33 27.300 -13.560 -15.649 1.00 5.00 +ATOM 67 CA GLU A 34 27.252 -16.111 -12.259 1.00 5.00 +ATOM 68 CB GLU A 34 29.377 -15.613 -12.153 1.00 5.00 +ATOM 69 CA TYR A 35 23.607 -15.250 -11.292 1.00 5.00 +ATOM 70 CB TYR A 35 22.393 -13.783 -8.599 1.00 5.00 +ATOM 71 CA ASN A 36 22.367 -15.603 -14.949 1.00 5.00 +ATOM 72 CB ASN A 36 21.420 -14.247 -16.074 1.00 5.00 +ATOM 73 CA ARG A 37 23.928 -18.952 -15.363 1.00 5.00 +ATOM 74 CB ARG A 37 26.057 -17.790 -16.381 1.00 5.00 +ATOM 75 CA ARG A 38 22.787 -20.225 -11.898 1.00 5.00 +ATOM 76 CB ARG A 38 24.646 -19.606 -9.264 1.00 5.00 +ATOM 77 CA CYS A 39 19.336 -18.820 -12.903 1.00 5.00 +ATOM 78 CB CYS A 39 19.297 -17.395 -12.953 1.00 5.00 +ATOM 79 CA GLN A 40 18.510 -20.658 -16.236 1.00 5.00 +ATOM 80 CB GLN A 40 21.096 -20.196 -17.132 1.00 5.00 +ATOM 81 CA THR A 41 19.241 -24.067 -14.710 1.00 5.00 +ATOM 82 CB THR A 41 19.448 -25.406 -15.287 1.00 5.00 +ATOM 83 CA GLU A 42 18.982 -23.920 -10.912 1.00 5.00 +ATOM 84 CB GLU A 42 21.225 -23.380 -11.318 1.00 5.00 +ATOM 85 CA GLU A 43 16.272 -22.609 -8.293 1.00 5.00 +ATOM 86 CB GLU A 43 14.844 -23.524 -6.684 1.00 5.00 +ATOM 87 CA VAL A 44 17.913 -19.605 -6.633 1.00 5.00 +ATOM 88 CB VAL A 44 18.752 -18.630 -7.447 1.00 5.00 +ATOM 89 CA LEU A 45 15.916 -18.896 -3.340 1.00 5.00 +ATOM 90 CB LEU A 45 15.033 -19.858 -1.611 1.00 5.00 +ATOM 91 CA PRO A 46 15.656 -14.875 -3.167 1.00 5.00 +ATOM 92 CB PRO A 46 17.052 -15.146 -3.503 1.00 5.00 +ATOM 93 CA PRO A 47 13.047 -14.359 -5.929 1.00 5.00 +ATOM 94 CB PRO A 47 12.248 -14.221 -4.754 1.00 5.00 +ATOM 95 CA ARG A 48 15.055 -11.813 -8.220 1.00 5.00 +ATOM 96 CB ARG A 48 17.061 -10.607 -10.924 1.00 5.00 +ATOM 97 CA GLU A 49 12.853 -8.857 -6.986 1.00 5.00 +ATOM 98 CB GLU A 49 11.060 -7.773 -6.934 1.00 5.00 +ATOM 99 CA ASP A 50 13.279 -9.724 -3.174 1.00 5.00 +ATOM 100 CB ASP A 50 13.072 -9.405 -1.226 1.00 5.00 +ATOM 101 CA VAL A 51 16.925 -10.007 -4.042 1.00 5.00 +ATOM 102 CB VAL A 51 17.679 -10.128 -5.243 1.00 5.00 +ATOM 103 CA PHE A 52 17.395 -6.320 -3.539 1.00 5.00 +ATOM 104 CB PHE A 52 19.812 -5.506 -5.065 1.00 5.00 +ATOM 105 CA SER A 53 14.134 -5.388 -1.728 1.00 5.00 +ATOM 106 CB SER A 53 12.934 -5.894 -1.802 1.00 5.00 +ATOM 107 CA TRP A 54 16.392 -4.195 1.380 1.00 5.00 +ATOM 108 CB TRP A 54 19.547 -5.660 0.316 1.00 5.00 +ATOM 109 CA THR A 55 17.508 -1.258 -1.032 1.00 5.00 +ATOM 110 CB THR A 55 18.464 -1.082 -2.121 1.00 5.00 +ATOM 111 CA ARG A 56 13.804 -0.438 -0.819 1.00 5.00 +ATOM 112 CB ARG A 56 13.992 -2.599 -3.558 1.00 5.00 +ATOM 113 CA TYR A 57 13.142 0.311 2.814 1.00 5.00 +ATOM 114 CB TYR A 57 15.251 -1.673 4.369 1.00 5.00 +ATOM 115 CA CYS A 58 14.827 3.728 3.364 1.00 5.00 +ATOM 116 CB CYS A 58 15.662 3.033 4.373 1.00 5.00 +ATOM 117 CA THR A 59 17.820 5.408 1.645 1.00 5.00 +ATOM 118 CB THR A 59 17.385 6.799 1.457 1.00 5.00 +ATOM 119 CA PRO A 60 21.420 5.634 2.627 1.00 5.00 +ATOM 120 CB PRO A 60 21.727 6.213 1.313 1.00 5.00 +ATOM 121 CA ASP A 61 20.845 8.854 4.755 1.00 5.00 +ATOM 122 CB ASP A 61 20.862 10.155 3.361 1.00 5.00 +ATOM 123 CA GLU A 62 17.992 7.274 6.687 1.00 5.00 +ATOM 124 CB GLU A 62 15.410 7.113 6.749 1.00 5.00 +ATOM 125 CA VAL A 63 19.844 4.231 8.036 1.00 5.00 +ATOM 126 CB VAL A 63 21.144 3.551 7.702 1.00 5.00 +ATOM 127 CA ARG A 64 21.021 3.763 11.682 1.00 5.00 +ATOM 128 CB ARG A 64 18.386 4.763 13.383 1.00 5.00 +ATOM 129 CA VAL A 65 21.217 0.156 12.772 1.00 5.00 +ATOM 130 CB VAL A 65 20.463 -0.743 13.715 1.00 5.00 +ATOM 131 CA VAL A 66 23.373 -2.103 10.219 1.00 5.00 +ATOM 132 CB VAL A 66 24.227 -1.749 9.120 1.00 5.00 +ATOM 133 CA ILE A 67 22.460 -5.771 11.295 1.00 5.00 +ATOM 134 CB ILE A 67 21.048 -5.950 12.520 1.00 5.00 +ATOM 135 CA ILE A 68 24.335 -8.489 9.134 1.00 5.00 +ATOM 136 CB ILE A 68 26.067 -8.306 8.473 1.00 5.00 +ATOM 137 CA GLY A 69 23.844 -12.091 7.949 1.00 5.00 +ATOM 138 CA GLN A 70 25.048 -15.088 6.268 1.00 5.00 +ATOM 139 CB GLN A 70 26.390 -16.990 6.476 1.00 5.00 +ATOM 140 CA ASP A 71 22.862 -16.371 3.191 1.00 5.00 +ATOM 141 CB ASP A 71 22.842 -18.253 4.003 1.00 5.00 +ATOM 142 CA PRO A 72 18.938 -16.288 2.621 1.00 5.00 +ATOM 143 CB PRO A 72 19.543 -15.604 1.548 1.00 5.00 +ATOM 144 CA TYR A 73 17.541 -19.392 4.542 1.00 5.00 +ATOM 145 CB TYR A 73 16.889 -17.256 6.986 1.00 5.00 +ATOM 146 CA HIS A 74 16.957 -21.896 1.815 1.00 5.00 +ATOM 147 CB HIS A 74 16.167 -24.319 2.669 1.00 5.00 +ATOM 148 CA HIS A 75 13.123 -22.362 2.151 1.00 5.00 +ATOM 149 CB HIS A 75 11.515 -22.320 4.170 1.00 5.00 +ATOM 150 CA PRO A 76 10.218 -21.351 -0.572 1.00 5.00 +ATOM 151 CB PRO A 76 9.805 -22.637 -0.086 1.00 5.00 +ATOM 152 CA GLY A 77 8.556 -18.524 1.277 1.00 5.00 +ATOM 153 CA GLN A 78 11.448 -18.043 3.923 1.00 5.00 +ATOM 154 CB GLN A 78 13.584 -19.162 3.758 1.00 5.00 +ATOM 155 CA ALA A 79 12.901 -14.926 2.541 1.00 5.00 +ATOM 156 CB ALA A 79 13.457 -15.365 2.121 1.00 5.00 +ATOM 157 CA HIS A 80 12.424 -11.496 1.355 1.00 5.00 +ATOM 158 CB HIS A 80 12.035 -10.724 3.864 1.00 5.00 +ATOM 159 CA GLY A 81 15.804 -10.481 1.538 1.00 5.00 +ATOM 160 CA LEU A 82 16.642 -8.413 4.779 1.00 5.00 +ATOM 161 CB LEU A 82 15.251 -6.905 4.296 1.00 5.00 +ATOM 162 CA ALA A 83 18.860 -10.954 6.555 1.00 5.00 +ATOM 163 CB ALA A 83 19.690 -10.920 6.557 1.00 5.00 +ATOM 164 CA PHE A 84 17.119 -12.228 9.448 1.00 5.00 +ATOM 165 CB PHE A 84 19.443 -11.576 11.341 1.00 5.00 +ATOM 166 CA SER A 85 13.678 -11.414 7.982 1.00 5.00 +ATOM 167 CB SER A 85 14.111 -10.165 7.798 1.00 5.00 +ATOM 168 CA VAL A 86 10.852 -13.727 7.232 1.00 5.00 +ATOM 169 CB VAL A 86 10.982 -14.292 8.666 1.00 5.00 +ATOM 170 CA ARG A 87 7.546 -13.066 5.712 1.00 5.00 +ATOM 171 CB ARG A 87 8.582 -11.475 2.840 1.00 5.00 +ATOM 172 CA ALA A 88 4.247 -12.585 7.380 1.00 5.00 +ATOM 173 CB ALA A 88 3.745 -12.219 7.735 1.00 5.00 +ATOM 174 CA ASN A 89 3.237 -16.458 6.140 1.00 5.00 +ATOM 175 CB ASN A 89 3.185 -17.376 4.392 1.00 5.00 +ATOM 176 CA VAL A 90 6.274 -18.176 7.689 1.00 5.00 +ATOM 177 CB VAL A 90 7.493 -18.419 6.866 1.00 5.00 +ATOM 178 CA PRO A 91 7.235 -19.144 11.067 1.00 5.00 +ATOM 179 CB PRO A 91 6.694 -20.431 10.611 1.00 5.00 +ATOM 180 CA PRO A 92 10.228 -17.414 12.872 1.00 5.00 +ATOM 181 CB PRO A 92 9.129 -17.421 13.695 1.00 5.00 +ATOM 182 CA PRO A 93 13.551 -19.637 12.415 1.00 5.00 +ATOM 183 CB PRO A 93 13.926 -18.323 11.907 1.00 5.00 +ATOM 184 CA PRO A 94 15.173 -20.264 15.726 1.00 5.00 +ATOM 185 CB PRO A 94 15.958 -21.237 15.033 1.00 5.00 +ATOM 186 CA SER A 95 17.528 -17.447 15.103 1.00 5.00 +ATOM 187 CB SER A 95 17.875 -16.922 13.971 1.00 5.00 +ATOM 188 CA LEU A 96 14.503 -15.086 14.650 1.00 5.00 +ATOM 189 CB LEU A 96 14.539 -13.592 13.208 1.00 5.00 +ATOM 190 CA ARG A 97 13.082 -16.257 17.979 1.00 5.00 +ATOM 191 CB ARG A 97 9.689 -16.094 17.869 1.00 5.00 +ATOM 192 CA ASN A 98 16.210 -15.933 19.715 1.00 5.00 +ATOM 193 CB ASN A 98 16.852 -16.493 21.560 1.00 5.00 +ATOM 194 CA VAL A 99 16.984 -12.322 18.722 1.00 5.00 +ATOM 195 CB VAL A 99 17.775 -11.775 17.594 1.00 5.00 +ATOM 196 CA LEU A 100 13.298 -11.372 18.943 1.00 5.00 +ATOM 197 CB LEU A 100 12.267 -11.667 17.198 1.00 5.00 +ATOM 198 CA ALA A 101 13.577 -12.550 22.577 1.00 5.00 +ATOM 199 CB ALA A 101 13.654 -13.303 22.828 1.00 5.00 +ATOM 200 CA ALA A 102 16.722 -10.571 22.785 1.00 5.00 +ATOM 201 CB ALA A 102 17.303 -10.716 22.410 1.00 5.00 +ATOM 202 CA VAL A 103 14.665 -7.277 21.867 1.00 5.00 +ATOM 203 CB VAL A 103 14.446 -6.306 20.742 1.00 5.00 +ATOM 204 CA LYS A 104 12.350 -8.702 24.560 1.00 5.00 +ATOM 205 CB LYS A 104 10.825 -10.528 22.661 1.00 5.00 +ATOM 206 CA ASN A 105 14.794 -9.055 27.303 1.00 5.00 +ATOM 207 CB ASN A 105 16.554 -8.965 26.203 1.00 5.00 +ATOM 208 CA CYS A 106 15.606 -5.214 26.741 1.00 5.00 +ATOM 209 CB CYS A 106 16.510 -5.163 25.630 1.00 5.00 +ATOM 210 CA TYR A 107 12.091 -3.959 26.167 1.00 5.00 +ATOM 211 CB TYR A 107 14.186 -2.663 23.798 1.00 5.00 +ATOM 212 CA PRO A 108 9.682 -4.705 29.119 1.00 5.00 +ATOM 213 CB PRO A 108 10.983 -4.424 29.627 1.00 5.00 +ATOM 214 CA GLU A 109 6.986 -2.968 27.277 1.00 5.00 +ATOM 215 CB GLU A 109 7.876 -0.998 28.585 1.00 5.00 +ATOM 216 CA ALA A 110 7.009 -4.504 23.801 1.00 5.00 +ATOM 217 CB ALA A 110 7.323 -4.944 23.273 1.00 5.00 +ATOM 218 CA ARG A 111 3.743 -5.842 22.207 1.00 5.00 +ATOM 219 CB ARG A 111 3.084 -2.952 20.498 1.00 5.00 +ATOM 220 CA MET A 112 6.137 -8.076 20.104 1.00 5.00 +ATOM 221 CB MET A 112 8.167 -8.185 20.081 1.00 5.00 +ATOM 222 CA SER A 113 3.478 -10.172 18.290 1.00 5.00 +ATOM 223 CB SER A 113 2.916 -9.956 17.155 1.00 5.00 +ATOM 224 CA GLY A 114 4.421 -13.405 17.378 1.00 5.00 +ATOM 225 CA HIS A 115 5.564 -12.612 13.716 1.00 5.00 +ATOM 226 CB HIS A 115 2.878 -12.785 12.905 1.00 5.00 +ATOM 227 CA GLY A 116 9.178 -12.509 12.415 1.00 5.00 +ATOM 228 CA CYS A 117 8.982 -9.657 9.764 1.00 5.00 +ATOM 229 CB CYS A 117 7.983 -8.953 9.242 1.00 5.00 +ATOM 230 CA LEU A 118 11.827 -7.282 10.488 1.00 5.00 +ATOM 231 CB LEU A 118 13.212 -8.046 11.844 1.00 5.00 +ATOM 232 CA GLU A 119 10.240 -5.086 7.714 1.00 5.00 +ATOM 233 CB GLU A 119 10.113 -6.517 6.237 1.00 5.00 +ATOM 234 CA LYS A 120 9.298 -2.450 10.249 1.00 5.00 +ATOM 235 CB LYS A 120 6.607 -0.967 10.754 1.00 5.00 +ATOM 236 CA TRP A 121 12.822 -2.204 11.479 1.00 5.00 +ATOM 237 CB TRP A 121 12.393 -3.792 14.445 1.00 5.00 +ATOM 238 CA ALA A 122 13.860 -1.898 7.824 1.00 5.00 +ATOM 239 CB ALA A 122 13.196 -2.150 7.467 1.00 5.00 +ATOM 240 CA ARG A 123 11.554 0.904 7.361 1.00 5.00 +ATOM 241 CB ARG A 123 9.922 0.486 4.398 1.00 5.00 +ATOM 242 CA ASP A 124 12.439 2.846 10.297 1.00 5.00 +ATOM 243 CB ASP A 124 11.625 1.387 11.581 1.00 5.00 +ATOM 244 CA GLY A 125 16.092 2.439 9.506 1.00 5.00 +ATOM 245 CA VAL A 126 17.706 -0.995 10.625 1.00 5.00 +ATOM 246 CB VAL A 126 17.018 -2.116 11.420 1.00 5.00 +ATOM 247 CA LEU A 127 19.735 -2.134 7.515 1.00 5.00 +ATOM 248 CB LEU A 127 20.793 -1.439 5.805 1.00 5.00 +ATOM 249 CA LEU A 128 19.525 -5.858 7.614 1.00 5.00 +ATOM 250 CB LEU A 128 18.059 -7.240 8.633 1.00 5.00 +ATOM 251 CA LEU A 129 22.124 -6.983 5.232 1.00 5.00 +ATOM 252 CB LEU A 129 23.603 -5.554 4.921 1.00 5.00 +ATOM 253 CA ASN A 130 22.735 -10.806 3.856 1.00 5.00 +ATOM 254 CB ASN A 130 21.271 -9.922 2.887 1.00 5.00 +ATOM 255 CA THR A 131 26.383 -11.610 3.095 1.00 5.00 +ATOM 256 CB THR A 131 27.165 -11.797 4.257 1.00 5.00 +ATOM 257 CA THR A 132 25.457 -13.846 0.362 1.00 5.00 +ATOM 258 CB THR A 132 25.155 -15.183 0.488 1.00 5.00 +ATOM 259 CA LEU A 133 22.371 -12.708 -1.817 1.00 5.00 +ATOM 260 CB LEU A 133 21.307 -10.903 -1.730 1.00 5.00 +ATOM 261 CA THR A 134 21.648 -16.108 -3.520 1.00 5.00 +ATOM 262 CB THR A 134 22.060 -16.394 -4.964 1.00 5.00 +ATOM 263 CA VAL A 135 20.928 -19.565 -2.429 1.00 5.00 +ATOM 264 CB VAL A 135 20.019 -19.657 -1.249 1.00 5.00 +ATOM 265 CA LYS A 136 19.932 -22.973 -4.266 1.00 5.00 +ATOM 266 CB LYS A 136 22.080 -24.590 -5.692 1.00 5.00 +ATOM 267 CA ARG A 137 16.341 -23.671 -3.102 1.00 5.00 +ATOM 268 CB ARG A 137 13.739 -25.243 -1.970 1.00 5.00 +ATOM 269 CA GLY A 138 17.173 -26.557 -0.650 1.00 5.00 +ATOM 270 CA ALA A 139 20.848 -26.069 -0.017 1.00 5.00 +ATOM 271 CB ALA A 139 21.255 -26.002 -0.743 1.00 5.00 +ATOM 272 CA ALA A 140 22.528 -23.667 2.403 1.00 5.00 +ATOM 273 CB ALA A 140 22.382 -23.808 3.167 1.00 5.00 +ATOM 274 CA ALA A 141 25.995 -22.267 1.330 1.00 5.00 +ATOM 275 CB ALA A 141 26.561 -22.784 1.453 1.00 5.00 +ATOM 276 CA SER A 142 26.363 -22.724 -2.616 1.00 5.00 +ATOM 277 CB SER A 142 25.160 -22.792 -3.107 1.00 5.00 +ATOM 278 CA HIS A 143 26.142 -19.387 -3.941 1.00 5.00 +ATOM 279 CB HIS A 143 25.448 -16.731 -3.470 1.00 5.00 +ATOM 280 CA SER A 144 29.118 -18.313 -1.506 1.00 5.00 +ATOM 281 CB SER A 144 28.533 -17.804 -0.304 1.00 5.00 +ATOM 282 CA ARG A 145 32.457 -17.995 -3.022 1.00 5.00 +ATOM 283 CB ARG A 145 33.403 -20.773 -2.810 1.00 5.00 +ATOM 284 CA ILE A 146 30.743 -16.864 -6.237 1.00 5.00 +ATOM 285 CB ILE A 146 29.285 -16.538 -7.365 1.00 5.00 +ATOM 286 CA GLY A 147 31.217 -13.186 -5.055 1.00 5.00 +ATOM 287 CA TRP A 148 28.111 -11.542 -3.393 1.00 5.00 +ATOM 288 CB TRP A 148 24.881 -10.107 -4.481 1.00 5.00 +ATOM 289 CA ASP A 149 30.379 -10.884 -0.493 1.00 5.00 +ATOM 290 CB ASP A 149 31.527 -12.223 -1.317 1.00 5.00 +ATOM 291 CA ARG A 150 32.738 -8.710 -2.276 1.00 5.00 +ATOM 292 CB ARG A 150 33.609 -7.657 -5.139 1.00 5.00 +ATOM 293 CA PHE A 151 29.999 -6.681 -3.850 1.00 5.00 +ATOM 294 CB PHE A 151 27.855 -5.251 -5.563 1.00 5.00 +ATOM 295 CA VAL A 152 28.250 -6.480 -0.613 1.00 5.00 +ATOM 296 CB VAL A 152 27.031 -6.674 0.176 1.00 5.00 +ATOM 297 CA GLY A 153 31.818 -5.420 0.904 1.00 5.00 +ATOM 298 CA GLY A 154 31.761 -2.633 -1.688 1.00 5.00 +ATOM 299 CA VAL A 155 28.296 -1.118 -0.614 1.00 5.00 +ATOM 300 CB VAL A 155 27.155 -2.120 -0.917 1.00 5.00 +ATOM 301 CA ILE A 156 29.003 -1.499 3.139 1.00 5.00 +ATOM 302 CB ILE A 156 28.875 -3.354 3.763 1.00 5.00 +ATOM 303 CA ARG A 157 32.431 0.226 2.941 1.00 5.00 +ATOM 304 CB ARG A 157 35.893 -0.561 3.107 1.00 5.00 +ATOM 305 CA ARG A 158 31.287 2.985 1.017 1.00 5.00 +ATOM 306 CB ARG A 158 32.866 3.919 -1.824 1.00 5.00 +ATOM 307 CA LEU A 159 28.314 3.365 3.150 1.00 5.00 +ATOM 308 CB LEU A 159 26.797 2.314 4.220 1.00 5.00 +ATOM 309 CA ALA A 160 30.615 3.279 6.276 1.00 5.00 +ATOM 310 CB ALA A 160 31.223 3.009 6.535 1.00 5.00 +ATOM 311 CA ALA A 161 31.990 6.508 5.169 1.00 5.00 +ATOM 312 CB ALA A 161 32.465 7.038 4.881 1.00 5.00 +ATOM 313 CA ARG A 162 28.601 7.555 3.942 1.00 5.00 +ATOM 314 CB ARG A 162 26.786 6.266 1.602 1.00 5.00 +ATOM 315 CA ARG A 163 26.739 8.387 7.174 1.00 5.00 +ATOM 316 CB ARG A 163 23.702 7.293 8.796 1.00 5.00 +ATOM 317 CA PRO A 164 29.456 9.302 9.703 1.00 5.00 +ATOM 318 CB PRO A 164 29.490 10.662 9.287 1.00 5.00 +ATOM 319 CA GLY A 165 27.532 7.557 12.615 1.00 5.00 +ATOM 320 CA LEU A 166 25.830 4.015 12.759 1.00 5.00 +ATOM 321 CB LEU A 166 26.099 3.525 10.819 1.00 5.00 +ATOM 322 CA VAL A 167 25.361 0.887 15.160 1.00 5.00 +ATOM 323 CB VAL A 167 24.178 1.408 15.953 1.00 5.00 +ATOM 324 CA PHE A 168 27.051 -2.411 13.276 1.00 5.00 +ATOM 325 CB PHE A 168 28.752 -1.062 11.117 1.00 5.00 +ATOM 326 CA MET A 169 25.347 -5.370 15.103 1.00 5.00 +ATOM 327 CB MET A 169 23.832 -3.780 16.370 1.00 5.00 +ATOM 328 CA LEU A 170 27.729 -8.266 13.889 1.00 5.00 +ATOM 329 CB LEU A 170 29.020 -8.198 12.354 1.00 5.00 +ATOM 330 CA TRP A 171 26.904 -11.588 15.374 1.00 5.00 +ATOM 331 CB TRP A 171 23.731 -9.891 16.045 1.00 5.00 +ATOM 332 CA GLY A 172 29.369 -14.418 14.918 1.00 5.00 +ATOM 333 CA THR A 173 33.172 -15.002 14.198 1.00 5.00 +ATOM 334 CB THR A 173 34.374 -15.872 14.529 1.00 5.00 +ATOM 335 CA HIS A 174 32.692 -15.048 10.569 1.00 5.00 +ATOM 336 CB HIS A 174 30.856 -14.900 8.634 1.00 5.00 +ATOM 337 CA ALA A 175 30.379 -12.002 10.335 1.00 5.00 +ATOM 338 CB ALA A 175 29.855 -11.542 9.893 1.00 5.00 +ATOM 339 CA GLN A 176 32.661 -10.141 12.463 1.00 5.00 +ATOM 340 CB GLN A 176 31.700 -10.743 14.227 1.00 5.00 +ATOM 341 CA ASN A 177 35.551 -11.054 10.011 1.00 5.00 +ATOM 342 CB ASN A 177 35.664 -12.789 9.135 1.00 5.00 +ATOM 343 CA ALA A 178 33.664 -10.109 6.843 1.00 5.00 +ATOM 344 CB ALA A 178 33.365 -10.785 6.712 1.00 5.00 +ATOM 345 CA ILE A 179 33.414 -6.657 8.319 1.00 5.00 +ATOM 346 CB ILE A 179 31.901 -5.361 8.047 1.00 5.00 +ATOM 347 CA ARG A 180 35.769 -4.410 10.274 1.00 5.00 +ATOM 348 CB ARG A 180 36.857 -7.653 11.577 1.00 5.00 +ATOM 349 CA PRO A 181 33.884 -0.878 10.365 1.00 5.00 +ATOM 350 CB PRO A 181 33.188 -1.769 11.168 1.00 5.00 +ATOM 351 CA ASP A 182 36.339 1.903 11.274 1.00 5.00 +ATOM 352 CB ASP A 182 37.074 2.651 9.489 1.00 5.00 +ATOM 353 CA PRO A 183 35.444 1.170 15.040 1.00 5.00 +ATOM 354 CB PRO A 183 36.182 -0.060 14.973 1.00 5.00 +ATOM 355 CA ARG A 184 36.451 4.925 16.065 1.00 5.00 +ATOM 356 CB ARG A 184 38.221 6.698 13.597 1.00 5.00 +ATOM 357 CA VAL A 185 33.707 6.321 13.522 1.00 5.00 +ATOM 358 CB VAL A 185 34.268 6.414 12.163 1.00 5.00 +ATOM 359 CA HIS A 186 31.342 3.531 14.154 1.00 5.00 +ATOM 360 CB HIS A 186 32.209 2.784 11.666 1.00 5.00 +ATOM 361 CA CYS A 187 29.652 1.871 17.345 1.00 5.00 +ATOM 362 CB CYS A 187 28.564 1.816 18.133 1.00 5.00 +ATOM 363 CA VAL A 188 30.349 -1.763 16.057 1.00 5.00 +ATOM 364 CB VAL A 188 31.686 -2.413 16.078 1.00 5.00 +ATOM 365 CA LEU A 189 28.348 -4.274 18.123 1.00 5.00 +ATOM 366 CB LEU A 189 26.893 -3.026 19.132 1.00 5.00 +ATOM 367 CA LYS A 190 30.149 -7.720 18.265 1.00 5.00 +ATOM 368 CB LYS A 190 33.133 -7.689 17.672 1.00 5.00 +ATOM 369 CA PHE A 191 28.313 -10.556 19.979 1.00 5.00 +ATOM 370 CB PHE A 191 26.622 -11.340 22.300 1.00 5.00 +ATOM 371 CA SER A 192 28.129 -14.528 19.689 1.00 5.00 +ATOM 372 CB SER A 192 28.093 -15.488 20.450 1.00 5.00 +ATOM 373 CA HIS A 193 25.594 -16.359 17.633 1.00 5.00 +ATOM 374 CB HIS A 193 26.707 -18.466 16.272 1.00 5.00 +ATOM 375 CA PRO A 194 21.840 -15.952 17.920 1.00 5.00 +ATOM 376 CB PRO A 194 22.016 -14.858 17.106 1.00 5.00 +ATOM 377 CA SER A 195 21.621 -19.557 16.966 1.00 5.00 +ATOM 378 CB SER A 195 22.900 -19.969 17.373 1.00 5.00 +ATOM 379 CA PRO A 196 20.980 -21.497 20.179 1.00 5.00 +ATOM 380 CB PRO A 196 19.862 -22.060 19.385 1.00 5.00 +ATOM 381 CA LEU A 197 23.971 -23.813 19.498 1.00 5.00 +ATOM 382 CB LEU A 197 24.745 -24.773 17.957 1.00 5.00 +ATOM 383 CA SER A 198 26.100 -20.752 20.891 1.00 5.00 +ATOM 384 CB SER A 198 25.261 -19.983 21.541 1.00 5.00 +ATOM 385 CA LYS A 199 27.747 -21.201 24.383 1.00 5.00 +ATOM 386 CB LYS A 199 29.289 -19.900 23.150 1.00 5.00 +ATOM 387 CA VAL A 200 26.116 -17.889 25.628 1.00 5.00 +ATOM 388 CB VAL A 200 26.760 -16.566 26.004 1.00 5.00 +ATOM 389 CA PRO A 201 22.139 -17.752 25.547 1.00 5.00 +ATOM 390 CB PRO A 201 22.331 -18.090 26.883 1.00 5.00 +ATOM 391 CA PHE A 202 21.321 -15.124 22.811 1.00 5.00 +ATOM 392 CB PHE A 202 22.105 -12.840 21.256 1.00 5.00 +ATOM 393 CA GLY A 203 18.666 -13.606 25.293 1.00 5.00 +ATOM 394 CA THR A 204 21.004 -11.765 27.515 1.00 5.00 +ATOM 395 CB THR A 204 21.962 -12.653 28.316 1.00 5.00 +ATOM 396 CA CYS A 205 22.045 -9.120 24.834 1.00 5.00 +ATOM 397 CB CYS A 205 21.339 -8.660 23.756 1.00 5.00 +ATOM 398 CA GLN A 206 22.030 -5.401 25.310 1.00 5.00 +ATOM 399 CB GLN A 206 22.723 -5.340 27.711 1.00 5.00 +ATOM 400 CA HIS A 207 23.197 -4.311 21.742 1.00 5.00 +ATOM 401 CB HIS A 207 24.299 -6.112 19.978 1.00 5.00 +ATOM 402 CA PHE A 208 19.718 -2.856 21.309 1.00 5.00 +ATOM 403 CB PHE A 208 18.491 -4.376 19.174 1.00 5.00 +ATOM 404 CA LEU A 209 19.861 -0.930 24.701 1.00 5.00 +ATOM 405 CB LEU A 209 18.915 -1.133 26.435 1.00 5.00 +ATOM 406 CA VAL A 210 23.350 0.204 23.960 1.00 5.00 +ATOM 407 CB VAL A 210 24.726 -0.293 23.566 1.00 5.00 +ATOM 408 CA ALA A 211 22.612 1.044 20.299 1.00 5.00 +ATOM 409 CB ALA A 211 21.948 0.709 20.117 1.00 5.00 +ATOM 410 CA ASN A 212 19.940 3.315 21.741 1.00 5.00 +ATOM 411 CB ASN A 212 18.281 2.244 21.802 1.00 5.00 +ATOM 412 CA ARG A 213 22.354 5.076 24.230 1.00 5.00 +ATOM 413 CB ARG A 213 21.255 4.829 27.174 1.00 5.00 +ATOM 414 CA TYR A 214 24.814 5.986 21.401 1.00 5.00 +ATOM 415 CB TYR A 214 26.059 5.425 18.330 1.00 5.00 +ATOM 416 CA LEU A 215 21.839 6.939 19.390 1.00 5.00 +ATOM 417 CB LEU A 215 20.322 5.987 18.191 1.00 5.00 +ATOM 418 CA GLU A 216 21.177 9.467 22.220 1.00 5.00 +ATOM 419 CB GLU A 216 20.141 7.608 23.306 1.00 5.00 +ATOM 420 CA THR A 217 24.596 10.917 22.109 1.00 5.00 +ATOM 421 CB THR A 217 25.106 11.246 23.457 1.00 5.00 +ATOM 422 CA ARG A 218 24.696 11.019 18.307 1.00 5.00 +ATOM 423 CB ARG A 218 24.230 8.222 16.424 1.00 5.00 +ATOM 424 CA SER A 219 21.383 12.911 18.824 1.00 5.00 +ATOM 425 CB SER A 219 22.134 13.889 19.540 1.00 5.00 +ATOM 426 CA ILE A 220 18.936 10.928 16.752 1.00 5.00 +ATOM 427 CB ILE A 220 19.237 9.913 15.125 1.00 5.00 +ATOM 428 CA SER A 221 16.588 8.895 18.959 1.00 5.00 +ATOM 429 CB SER A 221 15.661 8.670 18.076 1.00 5.00 +ATOM 430 CA PRO A 222 15.789 5.034 19.804 1.00 5.00 +ATOM 431 CB PRO A 222 15.363 5.850 20.956 1.00 5.00 +ATOM 432 CA ILE A 223 14.192 2.809 17.404 1.00 5.00 +ATOM 433 CB ILE A 223 14.497 2.136 15.625 1.00 5.00 +ATOM 434 CA ASP A 224 10.838 1.055 18.105 1.00 5.00 +ATOM 435 CB ASP A 224 9.602 0.519 16.628 1.00 5.00 +ATOM 436 CA TRP A 225 12.571 -2.148 18.618 1.00 5.00 +ATOM 437 CB TRP A 225 15.780 -0.958 17.956 1.00 5.00 +ATOM 438 CA SER A 226 9.369 -4.168 18.679 1.00 5.00 +ATOM 439 CB SER A 226 8.671 -3.548 19.544 1.00 5.00 +ATOM 440 CA VAL A 227 8.122 -5.950 15.510 1.00 5.00 +ATOM 441 CB VAL A 227 8.449 -6.237 14.166 1.00 5.00 TER TER -ATOM 442 CA THR C 1 45.094 20.713 29.315 1.00 5.00 -ATOM 443 CB THR C 1 44.486 20.952 27.983 1.00 5.00 -ATOM 444 CA ASN C 2 48.505 19.880 28.170 1.00 5.00 -ATOM 445 CB ASN C 2 50.338 19.169 27.739 1.00 5.00 -ATOM 446 CA LEU C 3 46.909 18.498 25.157 1.00 5.00 -ATOM 447 CB LEU C 3 45.838 16.776 25.925 1.00 5.00 -ATOM 448 CA SER C 4 45.975 21.827 24.010 1.00 5.00 -ATOM 449 CB SER C 4 44.897 22.567 23.545 1.00 5.00 -ATOM 450 CA ASP C 5 49.518 23.190 24.432 1.00 5.00 -ATOM 451 CB ASP C 5 50.833 23.217 26.129 1.00 5.00 -ATOM 452 CA ILE C 6 50.668 20.103 22.529 1.00 5.00 -ATOM 453 CB ILE C 6 50.534 18.255 22.975 1.00 5.00 -ATOM 454 CA ILE C 7 48.257 21.479 19.767 1.00 5.00 -ATOM 455 CB ILE C 7 46.562 20.759 19.904 1.00 5.00 -ATOM 456 CA GLU C 8 49.990 24.913 20.237 1.00 5.00 -ATOM 457 CB GLU C 8 51.608 26.597 21.259 1.00 5.00 -ATOM 458 CA LYS C 9 53.120 22.658 18.982 1.00 5.00 -ATOM 459 CB LYS C 9 53.833 19.602 19.319 1.00 5.00 -ATOM 460 CA GLU C 10 51.265 21.586 16.102 1.00 5.00 -ATOM 461 CB GLU C 10 50.844 19.329 16.826 1.00 5.00 -ATOM 462 CA THR C 11 49.540 24.196 14.102 1.00 5.00 -ATOM 463 CB THR C 11 48.173 23.980 14.061 1.00 5.00 -ATOM 464 CA GLY C 12 49.799 27.507 15.766 1.00 5.00 -ATOM 465 CA LYS C 13 46.648 28.611 17.826 1.00 5.00 -ATOM 466 CB LYS C 13 45.700 30.895 16.225 1.00 5.00 -ATOM 467 CA GLN C 14 44.610 28.735 21.172 1.00 5.00 -ATOM 468 CB GLN C 14 45.650 30.742 22.734 1.00 5.00 -ATOM 469 CA LEU C 15 42.542 25.650 20.372 1.00 5.00 -ATOM 470 CB LEU C 15 44.034 25.199 19.172 1.00 5.00 -ATOM 471 CA VAL C 16 39.578 24.459 22.455 1.00 5.00 -ATOM 472 CB VAL C 16 38.608 25.186 23.321 1.00 5.00 -ATOM 473 CA ILE C 17 39.475 20.921 23.771 1.00 5.00 -ATOM 474 CB ILE C 17 40.967 19.569 23.428 1.00 5.00 -ATOM 475 CA GLN C 18 35.747 20.433 23.360 1.00 5.00 -ATOM 476 CB GLN C 18 33.564 21.120 23.861 1.00 5.00 -ATOM 477 CA GLU C 19 35.040 16.890 22.579 1.00 5.00 -ATOM 478 CB GLU C 19 33.251 17.626 21.085 1.00 5.00 -ATOM 479 CA SER C 20 36.601 13.659 24.075 1.00 5.00 -ATOM 480 CB SER C 20 36.919 13.372 25.379 1.00 5.00 -ATOM 481 CA ILE C 21 35.142 10.988 21.667 1.00 5.00 -ATOM 482 CB ILE C 21 34.405 11.606 20.281 1.00 5.00 -ATOM 483 CA LEU C 22 35.880 7.297 22.521 1.00 5.00 -ATOM 484 CB LEU C 22 34.497 5.879 23.252 1.00 5.00 -ATOM 485 CA MET C 23 37.104 5.298 19.517 1.00 5.00 -ATOM 486 CB MET C 23 36.588 6.877 17.950 1.00 5.00 -ATOM 487 CA LEU C 24 38.104 1.605 19.050 1.00 5.00 -ATOM 488 CB LEU C 24 36.674 0.352 19.592 1.00 5.00 -ATOM 489 CA PRO C 25 41.110 0.206 17.178 1.00 5.00 -ATOM 490 CB PRO C 25 41.696 0.015 18.422 1.00 5.00 -ATOM 491 CA GLU C 26 39.478 -1.062 14.149 1.00 5.00 -ATOM 492 CB GLU C 26 39.838 -3.345 13.284 1.00 5.00 -ATOM 493 CA GLU C 27 37.306 2.109 14.119 1.00 5.00 -ATOM 494 CB GLU C 27 35.367 2.467 15.638 1.00 5.00 -ATOM 495 CA VAL C 28 40.174 4.466 13.714 1.00 5.00 -ATOM 496 CB VAL C 28 40.239 5.643 14.800 1.00 5.00 -ATOM 497 CA GLU C 29 41.750 1.779 11.406 1.00 5.00 -ATOM 498 CB GLU C 29 42.403 -0.087 10.519 1.00 5.00 -ATOM 499 CA GLU C 30 39.493 3.128 8.314 1.00 5.00 -ATOM 500 CB GLU C 30 37.195 3.758 7.469 1.00 5.00 -ATOM 501 CA VAL C 31 40.625 6.965 8.830 1.00 5.00 -ATOM 502 CB VAL C 31 40.237 7.688 10.058 1.00 5.00 -ATOM 503 CA ILE C 32 44.464 6.924 9.724 1.00 5.00 -ATOM 504 CB ILE C 32 44.262 7.096 11.420 1.00 5.00 -ATOM 505 CA GLY C 33 46.455 3.905 8.472 1.00 5.00 -ATOM 506 CA ASN C 34 48.234 2.783 11.732 1.00 5.00 -ATOM 507 CB ASN C 34 49.925 3.724 11.805 1.00 5.00 -ATOM 508 CA LYS C 35 46.538 0.326 13.913 1.00 5.00 -ATOM 509 CB LYS C 35 49.157 -1.366 14.521 1.00 5.00 -ATOM 510 CA PRO C 36 46.760 1.887 17.386 1.00 5.00 -ATOM 511 CB PRO C 36 46.142 2.855 16.605 1.00 5.00 -ATOM 512 CA GLU C 37 46.051 -1.427 19.505 1.00 5.00 -ATOM 513 CB GLU C 37 45.403 -3.177 20.678 1.00 5.00 -ATOM 514 CA SER C 38 44.257 0.326 22.287 1.00 5.00 -ATOM 515 CB SER C 38 45.063 1.245 22.195 1.00 5.00 -ATOM 516 CA ASP C 39 40.938 2.207 22.944 1.00 5.00 -ATOM 517 CB ASP C 39 40.029 1.642 24.699 1.00 5.00 -ATOM 518 CA ILE C 40 41.716 5.686 21.302 1.00 5.00 -ATOM 519 CB ILE C 40 42.943 6.208 19.980 1.00 5.00 -ATOM 520 CA LEU C 41 40.108 8.590 23.181 1.00 5.00 -ATOM 521 CB LEU C 41 39.134 8.929 25.057 1.00 5.00 -ATOM 522 CA VAL C 42 39.693 11.357 20.113 1.00 5.00 -ATOM 523 CB VAL C 42 39.265 11.084 18.723 1.00 5.00 -ATOM 524 CA HIS C 43 40.394 14.664 21.710 1.00 5.00 -ATOM 525 CB HIS C 43 41.635 13.461 23.794 1.00 5.00 -ATOM 526 CA THR C 44 38.639 17.000 19.215 1.00 5.00 -ATOM 527 CB THR C 44 37.456 17.048 18.398 1.00 5.00 -ATOM 528 CA ALA C 45 39.305 20.776 18.942 1.00 5.00 -ATOM 529 CB ALA C 45 39.944 21.021 19.065 1.00 5.00 -ATOM 530 CA TYR C 46 37.818 23.045 16.124 1.00 5.00 -ATOM 531 CB TYR C 46 35.961 24.090 13.713 1.00 5.00 -ATOM 532 CA ASP C 47 39.216 26.221 14.611 1.00 5.00 -ATOM 533 CB ASP C 47 41.021 26.767 15.160 1.00 5.00 -ATOM 534 CA GLU C 48 36.781 28.505 12.654 1.00 5.00 -ATOM 535 CB GLU C 48 34.204 28.449 11.828 1.00 5.00 -ATOM 536 CA SER C 49 38.864 31.172 10.935 1.00 5.00 -ATOM 537 CB SER C 49 39.410 32.197 11.526 1.00 5.00 -ATOM 538 CA THR C 50 40.695 29.130 8.384 1.00 5.00 -ATOM 539 CB THR C 50 41.917 28.362 8.843 1.00 5.00 -ATOM 540 CA ASP C 51 37.919 26.278 8.698 1.00 5.00 -ATOM 541 CB ASP C 51 36.225 26.269 7.656 1.00 5.00 -ATOM 542 CA GLU C 52 39.995 23.510 10.762 1.00 5.00 -ATOM 543 CB GLU C 52 42.462 23.463 10.503 1.00 5.00 -ATOM 544 CA ASN C 53 38.693 20.557 12.743 1.00 5.00 -ATOM 545 CB ASN C 53 36.750 20.076 12.735 1.00 5.00 -ATOM 546 CA VAL C 54 41.785 19.743 14.892 1.00 5.00 -ATOM 547 CB VAL C 54 42.919 20.487 15.456 1.00 5.00 -ATOM 548 CA MET C 55 41.192 16.112 16.523 1.00 5.00 -ATOM 549 CB MET C 55 39.896 15.510 14.812 1.00 5.00 -ATOM 550 CA LEU C 56 44.020 14.922 18.940 1.00 5.00 -ATOM 551 CB LEU C 56 45.433 14.945 20.554 1.00 5.00 -ATOM 552 CA LEU C 57 44.168 11.170 18.992 1.00 5.00 -ATOM 553 CB LEU C 57 43.739 10.827 17.225 1.00 5.00 -ATOM 554 CA THR C 58 45.171 9.961 22.460 1.00 5.00 -ATOM 555 CB THR C 58 45.530 10.705 23.670 1.00 5.00 -ATOM 556 CA SER C 59 45.303 6.554 24.311 1.00 5.00 -ATOM 557 CB SER C 59 45.932 5.859 23.444 1.00 5.00 -ATOM 558 CA ASP C 60 42.878 6.550 27.077 1.00 5.00 -ATOM 559 CB ASP C 60 42.300 5.483 28.589 1.00 5.00 -ATOM 560 CA ALA C 61 42.053 8.847 29.839 1.00 5.00 -ATOM 561 CB ALA C 61 41.235 8.910 29.843 1.00 5.00 -ATOM 562 CA PRO C 62 44.446 8.639 32.812 1.00 5.00 -ATOM 563 CB PRO C 62 43.523 7.670 33.147 1.00 5.00 -ATOM 564 CA GLU C 63 47.408 7.693 30.522 1.00 5.00 -ATOM 565 CB GLU C 63 47.790 6.223 28.664 1.00 5.00 -ATOM 566 CA TYR C 64 46.532 10.078 27.870 1.00 5.00 -ATOM 567 CB TYR C 64 44.054 11.573 29.846 1.00 5.00 -ATOM 568 CA LYS C 65 49.645 9.140 25.708 1.00 5.00 -ATOM 569 CB LYS C 65 51.234 6.773 25.002 1.00 5.00 -ATOM 570 CA PRO C 66 49.808 11.206 22.548 1.00 5.00 -ATOM 571 CB PRO C 66 50.964 11.599 23.288 1.00 5.00 -ATOM 572 CA TRP C 67 49.613 8.887 19.526 1.00 5.00 -ATOM 573 CB TRP C 67 49.560 6.259 17.489 1.00 5.00 -ATOM 574 CA ALA C 68 47.851 10.820 16.476 1.00 5.00 -ATOM 575 CB ALA C 68 47.509 10.346 15.900 1.00 5.00 -ATOM 576 CA LEU C 69 47.028 14.561 15.760 1.00 5.00 -ATOM 577 CB LEU C 69 47.146 16.569 16.172 1.00 5.00 -ATOM 578 CA VAL C 70 44.314 14.472 12.863 1.00 5.00 -ATOM 579 CB VAL C 70 43.292 13.341 12.618 1.00 5.00 -ATOM 580 CA ILE C 71 43.710 17.930 11.084 1.00 5.00 -ATOM 581 CB ILE C 71 45.411 18.748 11.551 1.00 5.00 -ATOM 582 CA GLN C 72 40.305 18.226 9.262 1.00 5.00 -ATOM 583 CB GLN C 72 38.233 17.145 10.203 1.00 5.00 -ATOM 584 CA ASP C 73 40.220 20.675 6.304 1.00 5.00 -ATOM 585 CB ASP C 73 41.472 22.288 5.772 1.00 5.00 -ATOM 586 CA SER C 74 37.092 21.991 4.876 1.00 5.00 -ATOM 587 CB SER C 74 37.309 23.236 4.534 1.00 5.00 -ATOM 588 CA ASN C 75 36.442 18.951 2.389 1.00 5.00 -ATOM 589 CB ASN C 75 36.692 18.148 0.571 1.00 5.00 -ATOM 590 CA GLY C 76 35.994 16.478 5.183 1.00 5.00 -ATOM 591 CA GLU C 77 39.699 15.505 4.275 1.00 5.00 -ATOM 592 CB GLU C 77 40.501 14.918 2.116 1.00 5.00 -ATOM 593 CA ASN C 78 42.182 14.555 7.075 1.00 5.00 -ATOM 594 CB ASN C 78 42.263 12.546 7.005 1.00 5.00 -ATOM 595 CA LYS C 79 45.761 15.970 7.376 1.00 5.00 -ATOM 596 CB LYS C 79 46.426 19.014 6.883 1.00 5.00 -ATOM 597 CA ILE C 80 46.924 13.145 9.762 1.00 5.00 -ATOM 598 CB ILE C 80 47.059 11.435 8.837 1.00 5.00 -ATOM 599 CA LYS C 81 50.196 14.076 11.556 1.00 5.00 -ATOM 600 CB LYS C 81 50.810 17.064 12.492 1.00 5.00 -ATOM 601 CA MET C 82 51.482 11.192 13.761 1.00 5.00 -ATOM 602 CB MET C 82 50.377 9.557 13.401 1.00 5.00 -ATOM 603 CA LEU C 83 52.871 12.421 17.101 1.00 5.00 -ATOM 604 CB LEU C 83 51.405 12.920 18.401 1.00 5.00 +ATOM 442 CA THR C 1 3.685 3.519 8.765 1.00 5.00 +ATOM 443 CB THR C 1 4.221 2.950 7.548 1.00 5.00 +ATOM 444 CA ASN C 2 1.594 6.361 7.190 1.00 5.00 +ATOM 445 CB ASN C 2 0.641 8.007 7.724 1.00 5.00 +ATOM 446 CA LEU C 3 1.222 3.809 4.473 1.00 5.00 +ATOM 447 CB LEU C 3 2.865 4.364 3.603 1.00 5.00 +ATOM 448 CA SER C 4 -0.244 1.510 7.335 1.00 5.00 +ATOM 449 CB SER C 4 -0.456 0.402 7.853 1.00 5.00 +ATOM 450 CA ASP C 5 -2.276 4.793 8.260 1.00 5.00 +ATOM 451 CB ASP C 5 -1.781 6.243 9.538 1.00 5.00 +ATOM 452 CA ILE C 6 -3.696 4.851 4.803 1.00 5.00 +ATOM 453 CB ILE C 6 -2.873 4.801 3.124 1.00 5.00 +ATOM 454 CA ILE C 7 -4.634 1.068 4.656 1.00 5.00 +ATOM 455 CB ILE C 7 -3.271 -0.174 4.171 1.00 5.00 +ATOM 456 CA GLU C 8 -6.106 1.601 8.110 1.00 5.00 +ATOM 457 CB GLU C 8 -4.004 1.647 9.963 1.00 5.00 +ATOM 458 CA LYS C 9 -8.681 4.142 6.642 1.00 5.00 +ATOM 459 CB LYS C 9 -9.345 6.339 4.552 1.00 5.00 +ATOM 460 CA GLU C 10 -9.112 2.317 3.290 1.00 5.00 +ATOM 461 CB GLU C 10 -7.206 2.921 1.826 1.00 5.00 +ATOM 462 CA THR C 11 -9.837 -1.237 4.857 1.00 5.00 +ATOM 463 CB THR C 11 -8.871 -2.241 5.432 1.00 5.00 +ATOM 464 CA GLY C 12 -9.995 -0.791 8.582 1.00 5.00 +ATOM 465 CA LYS C 13 -7.139 -3.247 9.855 1.00 5.00 +ATOM 466 CB LYS C 13 -9.059 -5.588 9.610 1.00 5.00 +ATOM 467 CA GLN C 14 -3.974 -2.938 11.972 1.00 5.00 +ATOM 468 CB GLN C 14 -3.805 -3.467 14.308 1.00 5.00 +ATOM 469 CA LEU C 15 -1.824 -4.858 9.373 1.00 5.00 +ATOM 470 CB LEU C 15 -3.240 -4.256 7.863 1.00 5.00 +ATOM 471 CA VAL C 16 1.951 -4.658 9.485 1.00 5.00 +ATOM 472 CB VAL C 16 3.124 -5.268 10.305 1.00 5.00 +ATOM 473 CA ILE C 17 3.872 -4.356 6.053 1.00 5.00 +ATOM 474 CB ILE C 17 3.080 -2.698 5.638 1.00 5.00 +ATOM 475 CA GLN C 18 5.260 -7.748 5.448 1.00 5.00 +ATOM 476 CB GLN C 18 3.272 -9.304 5.013 1.00 5.00 +ATOM 477 CA GLU C 19 7.583 -7.766 2.323 1.00 5.00 +ATOM 478 CB GLU C 19 6.105 -7.689 0.373 1.00 5.00 +ATOM 479 CA SER C 20 8.239 -4.603 0.218 1.00 5.00 +ATOM 480 CB SER C 20 9.326 -3.988 0.587 1.00 5.00 +ATOM 481 CA ILE C 21 8.564 -5.766 -3.563 1.00 5.00 +ATOM 482 CB ILE C 21 7.477 -7.041 -3.667 1.00 5.00 +ATOM 483 CA LEU C 22 10.015 -3.066 -5.973 1.00 5.00 +ATOM 484 CB LEU C 22 11.062 -1.423 -6.704 1.00 5.00 +ATOM 485 CA MET C 23 8.051 -3.878 -9.205 1.00 5.00 +ATOM 486 CB MET C 23 6.901 -6.042 -9.174 1.00 5.00 +ATOM 487 CA LEU C 24 8.090 -3.076 -12.915 1.00 5.00 +ATOM 488 CB LEU C 24 8.864 -4.037 -14.605 1.00 5.00 +ATOM 489 CA PRO C 25 5.796 -0.600 -14.368 1.00 5.00 +ATOM 490 CB PRO C 25 6.614 0.367 -13.692 1.00 5.00 +ATOM 491 CA GLU C 26 5.844 -3.021 -17.409 1.00 5.00 +ATOM 492 CB GLU C 26 7.208 -1.141 -18.090 1.00 5.00 +ATOM 493 CA GLU C 27 5.297 -5.922 -15.041 1.00 5.00 +ATOM 494 CB GLU C 27 7.418 -7.503 -14.206 1.00 5.00 +ATOM 495 CA VAL C 28 2.789 -4.250 -12.721 1.00 5.00 +ATOM 496 CB VAL C 28 3.713 -3.387 -12.051 1.00 5.00 +ATOM 497 CA GLU C 29 1.035 -3.256 -15.846 1.00 5.00 +ATOM 498 CB GLU C 29 2.053 -3.180 -18.043 1.00 5.00 +ATOM 499 CA GLU C 30 -0.546 -6.673 -16.580 1.00 5.00 +ATOM 500 CB GLU C 30 -0.555 -8.725 -18.122 1.00 5.00 +ATOM 501 CA VAL C 31 -1.843 -7.289 -13.132 1.00 5.00 +ATOM 502 CB VAL C 31 -1.286 -7.340 -11.787 1.00 5.00 +ATOM 503 CA ILE C 32 -3.183 -3.542 -12.680 1.00 5.00 +ATOM 504 CB ILE C 32 -1.626 -2.589 -13.252 1.00 5.00 +ATOM 505 CA GLY C 33 -4.381 -2.645 -16.325 1.00 5.00 +ATOM 506 CA ASN C 34 -3.382 1.031 -15.624 1.00 5.00 +ATOM 507 CB ASN C 34 -2.439 1.777 -13.982 1.00 5.00 +ATOM 508 CA LYS C 35 -0.233 3.145 -16.229 1.00 5.00 +ATOM 509 CB LYS C 35 1.060 1.833 -18.264 1.00 5.00 +ATOM 510 CA PRO C 36 1.457 4.978 -13.168 1.00 5.00 +ATOM 511 CB PRO C 36 1.626 3.603 -12.879 1.00 5.00 +ATOM 512 CA GLU C 37 4.560 6.330 -14.699 1.00 5.00 +ATOM 513 CB GLU C 37 5.365 8.340 -13.694 1.00 5.00 +ATOM 514 CA SER C 38 7.476 4.813 -12.296 1.00 5.00 +ATOM 515 CB SER C 38 7.372 5.728 -11.384 1.00 5.00 +ATOM 516 CA ASP C 39 8.922 1.734 -10.404 1.00 5.00 +ATOM 517 CB ASP C 39 10.397 0.615 -11.233 1.00 5.00 +ATOM 518 CA ILE C 40 6.077 0.506 -8.173 1.00 5.00 +ATOM 519 CB ILE C 40 4.436 0.587 -8.687 1.00 5.00 +ATOM 520 CA LEU C 41 7.226 -0.349 -4.666 1.00 5.00 +ATOM 521 CB LEU C 41 8.270 0.858 -3.376 1.00 5.00 +ATOM 522 CA VAL C 42 4.699 -3.148 -3.825 1.00 5.00 +ATOM 523 CB VAL C 42 4.325 -4.277 -4.724 1.00 5.00 +ATOM 524 CA HIS C 43 4.103 -2.717 -0.034 1.00 5.00 +ATOM 525 CB HIS C 43 5.066 -0.324 0.866 1.00 5.00 +ATOM 526 CA THR C 44 2.168 -6.097 0.673 1.00 5.00 +ATOM 527 CB THR C 44 2.397 -7.056 -0.480 1.00 5.00 +ATOM 528 CA ALA C 45 -0.010 -6.550 3.781 1.00 5.00 +ATOM 529 CB ALA C 45 -0.045 -5.891 4.161 1.00 5.00 +ATOM 530 CA TYR C 46 -1.540 -9.850 5.225 1.00 5.00 +ATOM 531 CB TYR C 46 -1.081 -10.098 8.532 1.00 5.00 +ATOM 532 CA ASP C 47 -4.912 -10.066 6.663 1.00 5.00 +ATOM 533 CB ASP C 47 -6.499 -9.157 5.621 1.00 5.00 +ATOM 534 CA GLU C 48 -4.703 -13.470 8.580 1.00 5.00 +ATOM 535 CB GLU C 48 -2.522 -14.464 9.147 1.00 5.00 +ATOM 536 CA SER C 49 -8.490 -13.901 9.628 1.00 5.00 +ATOM 537 CB SER C 49 -8.911 -13.185 10.613 1.00 5.00 +ATOM 538 CA THR C 50 -9.582 -12.912 6.204 1.00 5.00 +ATOM 539 CB THR C 50 -10.370 -11.708 6.138 1.00 5.00 +ATOM 540 CA ASP C 51 -7.116 -14.978 4.259 1.00 5.00 +ATOM 541 CB ASP C 51 -6.447 -16.924 4.019 1.00 5.00 +ATOM 542 CA GLU C 52 -5.597 -12.397 2.074 1.00 5.00 +ATOM 543 CB GLU C 52 -6.154 -9.926 0.982 1.00 5.00 +ATOM 544 CA ASN C 53 -3.181 -9.910 0.767 1.00 5.00 +ATOM 545 CB ASN C 53 -1.286 -9.518 0.404 1.00 5.00 +ATOM 546 CA VAL C 54 -3.377 -5.977 0.740 1.00 5.00 +ATOM 547 CB VAL C 54 -4.251 -5.287 1.762 1.00 5.00 +ATOM 548 CA MET C 55 -0.862 -5.068 -2.078 1.00 5.00 +ATOM 549 CB MET C 55 -0.374 -6.560 -3.160 1.00 5.00 +ATOM 550 CA LEU C 56 -0.180 -1.412 -1.382 1.00 5.00 +ATOM 551 CB LEU C 56 0.155 0.208 -0.125 1.00 5.00 +ATOM 552 CA LEU C 57 1.228 -0.674 -4.817 1.00 5.00 +ATOM 553 CB LEU C 57 0.650 -1.919 -6.449 1.00 5.00 +ATOM 554 CA THR C 58 3.226 2.669 -4.127 1.00 5.00 +ATOM 555 CB THR C 58 3.792 3.101 -2.791 1.00 5.00 +ATOM 556 CA SER C 59 5.883 4.785 -6.055 1.00 5.00 +ATOM 557 CB SER C 59 6.176 5.787 -5.366 1.00 5.00 +ATOM 558 CA ASP C 60 9.393 4.689 -4.745 1.00 5.00 +ATOM 559 CB ASP C 60 11.164 4.740 -5.746 1.00 5.00 +ATOM 560 CA ALA C 61 12.067 4.381 -2.106 1.00 5.00 +ATOM 561 CB ALA C 61 12.686 4.086 -1.858 1.00 5.00 +ATOM 562 CA PRO C 62 11.782 7.529 0.206 1.00 5.00 +ATOM 563 CB PRO C 62 13.021 8.134 -0.258 1.00 5.00 +ATOM 564 CA GLU C 63 9.285 9.141 -2.398 1.00 5.00 +ATOM 565 CB GLU C 63 9.546 9.533 -4.694 1.00 5.00 +ATOM 566 CA TYR C 64 6.632 7.046 -0.924 1.00 5.00 +ATOM 567 CB TYR C 64 8.793 4.859 0.727 1.00 5.00 +ATOM 568 CA LYS C 65 3.582 8.194 -3.034 1.00 5.00 +ATOM 569 CB LYS C 65 3.761 9.132 -6.048 1.00 5.00 +ATOM 570 CA PRO C 66 0.745 6.023 -2.291 1.00 5.00 +ATOM 571 CB PRO C 66 0.360 7.176 -1.559 1.00 5.00 +ATOM 572 CA TRP C 67 -1.100 5.385 -5.493 1.00 5.00 +ATOM 573 CB TRP C 67 1.300 4.838 -7.836 1.00 5.00 +ATOM 574 CA ALA C 68 -2.686 1.829 -5.252 1.00 5.00 +ATOM 575 CB ALA C 68 -2.552 1.234 -5.767 1.00 5.00 +ATOM 576 CA LEU C 69 -4.550 -0.572 -2.717 1.00 5.00 +ATOM 577 CB LEU C 69 -5.435 -0.636 -0.745 1.00 5.00 +ATOM 578 CA VAL C 70 -4.762 -4.057 -4.463 1.00 5.00 +ATOM 579 CB VAL C 70 -3.953 -4.656 -5.569 1.00 5.00 +ATOM 580 CA ILE C 71 -7.065 -6.245 -2.132 1.00 5.00 +ATOM 581 CB ILE C 71 -8.213 -4.832 -1.452 1.00 5.00 +ATOM 582 CA GLN C 72 -6.358 -9.780 -2.841 1.00 5.00 +ATOM 583 CB GLN C 72 -4.158 -10.403 -4.365 1.00 5.00 +ATOM 584 CA ASP C 73 -8.294 -12.641 -1.627 1.00 5.00 +ATOM 585 CB ASP C 73 -10.044 -13.676 -1.561 1.00 5.00 +ATOM 586 CA SER C 74 -8.107 -16.465 -0.614 1.00 5.00 +ATOM 587 CB SER C 74 -8.483 -16.756 0.641 1.00 5.00 +ATOM 588 CA ASN C 75 -8.362 -17.498 -4.053 1.00 5.00 +ATOM 589 CB ASN C 75 -9.469 -18.365 -5.382 1.00 5.00 +ATOM 590 CA GLY C 76 -6.492 -14.685 -5.782 1.00 5.00 +ATOM 591 CA GLU C 77 -9.260 -12.462 -7.374 1.00 5.00 +ATOM 592 CB GLU C 77 -11.489 -13.359 -7.750 1.00 5.00 +ATOM 593 CA ASN C 78 -7.473 -8.956 -7.339 1.00 5.00 +ATOM 594 CB ASN C 78 -6.903 -7.452 -8.701 1.00 5.00 +ATOM 595 CA LYS C 79 -10.147 -6.452 -5.945 1.00 5.00 +ATOM 596 CB LYS C 79 -12.769 -8.068 -5.715 1.00 5.00 +ATOM 597 CA ILE C 80 -8.736 -3.097 -7.031 1.00 5.00 +ATOM 598 CB ILE C 80 -8.481 -3.360 -8.872 1.00 5.00 +ATOM 599 CA LYS C 81 -8.750 0.484 -5.771 1.00 5.00 +ATOM 600 CB LYS C 81 -9.778 1.015 -2.943 1.00 5.00 +ATOM 601 CA MET C 82 -6.480 3.151 -7.561 1.00 5.00 +ATOM 602 CB MET C 82 -4.200 3.329 -8.673 1.00 5.00 +ATOM 603 CA LEU C 83 -6.399 6.103 -5.077 1.00 5.00 +ATOM 604 CB LEU C 83 -5.642 4.890 -3.635 1.00 5.00 TER CONECT 1 3 2 CONECT 3 5 4