X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=examples%2FUNRES-Dock%2Foutput%2Fwham_T300K_0003.pdb;fp=examples%2FUNRES-Dock%2Foutput%2Fwham_T300K_0003.pdb;h=0f251b53350996339d7dad7b6ffafba667fcc30b;hb=86a7a0fff3fb6d1c18791c4d2723ee3173d2cf65;hp=8adb1b7ab8c0181537a6fa6630a983eb9c0b00cc;hpb=018446aca1e32faf80f41e818acbfc61e5d872c9;p=unres.git diff --git a/examples/UNRES-Dock/output/wham_T300K_0003.pdb b/examples/UNRES-Dock/output/wham_T300K_0003.pdb index 8adb1b7..0f251b5 100644 --- a/examples/UNRES-Dock/output/wham_T300K_0003.pdb +++ b/examples/UNRES-Dock/output/wham_T300K_0003.pdb @@ -1,611 +1,611 @@ -REMARK CLUSTER 3 FREE ENERGY -1.29513E+01 AVE RMSD 0.00 -REMARK clustering ENERGY -1.20417E+01 RMS 0.00 -ATOM 1 CA ASP A 1 19.522 13.287 -5.633 1.00 5.00 -ATOM 2 CB ASP A 1 18.391 13.109 -7.222 1.00 5.00 -ATOM 3 CA TRP A 2 18.142 11.551 -2.555 1.00 5.00 -ATOM 4 CB TRP A 2 17.280 10.332 0.405 1.00 5.00 -ATOM 5 CA THR A 3 14.994 10.976 -4.773 1.00 5.00 -ATOM 6 CB THR A 3 13.823 11.792 -4.985 1.00 5.00 -ATOM 7 CA THR A 4 17.425 8.852 -6.676 1.00 5.00 -ATOM 8 CB THR A 4 17.647 8.369 -8.065 1.00 5.00 -ATOM 9 CA PHE A 5 19.521 7.385 -3.863 1.00 5.00 -ATOM 10 CB PHE A 5 21.461 7.161 -1.568 1.00 5.00 -ATOM 11 CA ARG A 6 16.528 6.770 -1.764 1.00 5.00 -ATOM 12 CB ARG A 6 13.763 8.316 -0.670 1.00 5.00 -ATOM 13 CA ARG A 7 14.960 4.571 -4.509 1.00 5.00 -ATOM 14 CB ARG A 7 14.119 5.950 -7.598 1.00 5.00 -ATOM 15 CA VAL A 8 18.176 2.742 -5.341 1.00 5.00 -ATOM 16 CB VAL A 8 19.641 2.947 -5.279 1.00 5.00 -ATOM 17 CA PHE A 9 18.668 1.652 -1.597 1.00 5.00 -ATOM 18 CB PHE A 9 21.428 2.261 -0.782 1.00 5.00 -ATOM 19 CA LEU A 10 14.835 1.709 -0.873 1.00 5.00 -ATOM 20 CB LEU A 10 13.119 1.518 -1.699 1.00 5.00 -ATOM 21 CA ILE A 11 15.521 4.073 1.954 1.00 5.00 -ATOM 22 CB ILE A 11 17.340 4.619 2.049 1.00 5.00 -ATOM 23 CA ASP A 12 12.400 5.303 4.182 1.00 5.00 -ATOM 24 CB ASP A 12 12.034 4.368 5.922 1.00 5.00 -ATOM 25 CA ASP A 13 11.886 8.959 4.297 1.00 5.00 -ATOM 26 CB ASP A 13 10.456 8.788 3.040 1.00 5.00 -ATOM 27 CA ALA A 14 12.389 9.265 8.118 1.00 5.00 -ATOM 28 CB ALA A 14 12.584 8.767 8.584 1.00 5.00 -ATOM 29 CA TRP A 15 16.245 9.318 8.030 1.00 5.00 -ATOM 30 CB TRP A 15 19.041 7.904 9.984 1.00 5.00 -ATOM 31 CA ARG A 16 16.267 12.224 5.393 1.00 5.00 -ATOM 32 CB ARG A 16 14.369 11.720 3.719 1.00 5.00 -ATOM 33 CA PRO A 17 17.431 14.817 7.874 1.00 5.00 -ATOM 34 CB PRO A 17 16.407 14.342 8.666 1.00 5.00 -ATOM 35 CA LEU A 18 20.854 13.370 8.072 1.00 5.00 -ATOM 36 CB LEU A 18 20.286 12.358 9.871 1.00 5.00 -ATOM 37 CA MET A 19 21.220 11.234 4.822 1.00 5.00 -ATOM 38 CB MET A 19 22.093 9.224 5.570 1.00 5.00 -ATOM 39 CA GLU A 20 21.386 13.722 2.201 1.00 5.00 -ATOM 40 CB GLU A 20 19.410 15.106 2.138 1.00 5.00 -ATOM 41 CA PRO A 21 23.752 15.954 4.365 1.00 5.00 -ATOM 42 CB PRO A 21 22.807 15.847 5.375 1.00 5.00 -ATOM 43 CA GLU A 22 26.177 13.227 3.525 1.00 5.00 -ATOM 44 CB GLU A 22 25.811 12.035 5.909 1.00 5.00 -ATOM 45 CA LEU A 23 25.332 12.848 -0.059 1.00 5.00 -ATOM 46 CB LEU A 23 23.344 12.008 -0.520 1.00 5.00 -ATOM 47 CA ALA A 24 26.405 16.523 -0.421 1.00 5.00 -ATOM 48 CB ALA A 24 26.005 17.000 0.028 1.00 5.00 -ATOM 49 CA ASN A 25 30.032 15.601 -0.055 1.00 5.00 -ATOM 50 CB ASN A 25 30.948 14.440 1.466 1.00 5.00 -ATOM 51 CA PRO A 26 32.618 14.489 -2.520 1.00 5.00 -ATOM 52 CB PRO A 26 33.037 15.654 -1.952 1.00 5.00 -ATOM 53 CA LEU A 27 33.790 11.044 -0.748 1.00 5.00 -ATOM 54 CB LEU A 27 35.574 11.819 0.233 1.00 5.00 -ATOM 55 CA THR A 28 30.132 9.958 -0.676 1.00 5.00 -ATOM 56 CB THR A 28 29.343 10.393 0.418 1.00 5.00 -ATOM 57 CA ALA A 29 29.623 10.295 -4.493 1.00 5.00 -ATOM 58 CB ALA A 29 29.421 11.070 -4.461 1.00 5.00 -ATOM 59 CA HIS A 30 32.944 8.375 -4.956 1.00 5.00 -ATOM 60 CB HIS A 30 34.915 10.119 -5.301 1.00 5.00 -ATOM 61 CA LEU A 31 32.106 5.933 -2.028 1.00 5.00 -ATOM 62 CB LEU A 31 32.052 6.621 -0.057 1.00 5.00 -ATOM 63 CA LEU A 32 29.179 4.605 -3.952 1.00 5.00 -ATOM 64 CB LEU A 32 27.188 4.296 -4.163 1.00 5.00 -ATOM 65 CA ALA A 33 31.309 4.483 -7.243 1.00 5.00 -ATOM 66 CB ALA A 33 31.539 5.037 -7.644 1.00 5.00 -ATOM 67 CA GLU A 34 33.456 1.904 -5.892 1.00 5.00 -ATOM 68 CB GLU A 34 35.581 1.316 -5.126 1.00 5.00 -ATOM 69 CA TYR A 35 30.330 0.439 -4.168 1.00 5.00 -ATOM 70 CB TYR A 35 27.426 -0.273 -2.697 1.00 5.00 -ATOM 71 CA ASN A 36 28.423 0.086 -7.509 1.00 5.00 -ATOM 72 CB ASN A 36 26.793 1.134 -7.293 1.00 5.00 -ATOM 73 CA ARG A 37 31.558 -1.118 -9.238 1.00 5.00 -ATOM 74 CB ARG A 37 34.627 0.361 -9.126 1.00 5.00 -ATOM 75 CA ARG A 38 32.134 -3.616 -6.466 1.00 5.00 -ATOM 76 CB ARG A 38 32.009 -2.633 -3.231 1.00 5.00 -ATOM 77 CA CYS A 39 28.724 -5.277 -7.154 1.00 5.00 -ATOM 78 CB CYS A 39 27.879 -4.684 -6.332 1.00 5.00 -ATOM 79 CA GLN A 40 29.998 -5.820 -10.744 1.00 5.00 -ATOM 80 CB GLN A 40 31.598 -3.987 -11.685 1.00 5.00 -ATOM 81 CA THR A 41 32.532 -8.164 -9.684 1.00 5.00 -ATOM 82 CB THR A 41 33.933 -8.357 -10.077 1.00 5.00 -ATOM 83 CA GLU A 42 31.295 -9.364 -6.276 1.00 5.00 -ATOM 84 CB GLU A 42 32.958 -8.239 -4.862 1.00 5.00 -ATOM 85 CA GLU A 43 28.657 -11.093 -4.225 1.00 5.00 -ATOM 86 CB GLU A 43 28.203 -13.432 -4.843 1.00 5.00 -ATOM 87 CA VAL A 44 28.315 -7.990 -1.997 1.00 5.00 -ATOM 88 CB VAL A 44 28.215 -6.510 -1.753 1.00 5.00 -ATOM 89 CA LEU A 45 26.278 -9.683 1.021 1.00 5.00 -ATOM 90 CB LEU A 45 27.005 -11.548 1.474 1.00 5.00 -ATOM 91 CA PRO A 46 23.569 -7.278 2.079 1.00 5.00 -ATOM 92 CB PRO A 46 24.603 -6.228 2.178 1.00 5.00 -ATOM 93 CA PRO A 47 21.093 -7.651 -0.564 1.00 5.00 -ATOM 94 CB PRO A 47 20.233 -7.977 0.525 1.00 5.00 -ATOM 95 CA ARG A 48 21.064 -4.049 -1.460 1.00 5.00 -ATOM 96 CB ARG A 48 22.134 -1.853 -3.721 1.00 5.00 -ATOM 97 CA GLU A 49 17.457 -3.521 -0.104 1.00 5.00 -ATOM 98 CB GLU A 49 16.305 -4.454 -2.023 1.00 5.00 -ATOM 99 CA ASP A 50 18.654 -4.712 3.100 1.00 5.00 -ATOM 100 CB ASP A 50 19.498 -6.310 4.172 1.00 5.00 -ATOM 101 CA VAL A 51 21.663 -2.389 3.286 1.00 5.00 -ATOM 102 CB VAL A 51 23.018 -2.286 2.663 1.00 5.00 -ATOM 103 CA PHE A 52 19.616 0.412 4.721 1.00 5.00 -ATOM 104 CB PHE A 52 21.823 2.363 4.443 1.00 5.00 -ATOM 105 CA SER A 53 16.935 -1.619 6.299 1.00 5.00 -ATOM 106 CB SER A 53 17.135 -2.948 6.581 1.00 5.00 -ATOM 107 CA TRP A 54 17.951 0.344 9.464 1.00 5.00 -ATOM 108 CB TRP A 54 21.241 -1.180 8.422 1.00 5.00 -ATOM 109 CA THR A 55 16.466 3.553 8.469 1.00 5.00 -ATOM 110 CB THR A 55 17.364 4.599 7.931 1.00 5.00 -ATOM 111 CA ARG A 56 13.195 1.756 7.725 1.00 5.00 -ATOM 112 CB ARG A 56 14.384 0.958 4.769 1.00 5.00 -ATOM 113 CA TYR A 57 11.608 0.298 11.076 1.00 5.00 -ATOM 114 CB TYR A 57 14.566 -1.243 10.518 1.00 5.00 -ATOM 115 CA CYS A 58 12.326 2.993 13.745 1.00 5.00 -ATOM 116 CB CYS A 58 13.487 2.799 14.546 1.00 5.00 -ATOM 117 CA THR A 59 13.266 6.537 12.778 1.00 5.00 -ATOM 118 CB THR A 59 11.937 6.980 12.534 1.00 5.00 -ATOM 119 CA PRO A 60 15.605 9.589 13.656 1.00 5.00 -ATOM 120 CB PRO A 60 15.568 9.849 12.339 1.00 5.00 -ATOM 121 CA ASP A 61 13.395 11.354 16.270 1.00 5.00 -ATOM 122 CB ASP A 61 12.403 13.152 16.257 1.00 5.00 -ATOM 123 CA GLU A 62 12.422 7.705 17.729 1.00 5.00 -ATOM 124 CB GLU A 62 11.277 5.499 17.819 1.00 5.00 -ATOM 125 CA VAL A 63 15.741 5.947 18.592 1.00 5.00 -ATOM 126 CB VAL A 63 17.084 5.383 18.265 1.00 5.00 -ATOM 127 CA ARG A 64 16.846 5.452 22.226 1.00 5.00 -ATOM 128 CB ARG A 64 17.932 5.091 25.441 1.00 5.00 -ATOM 129 CA VAL A 65 19.846 2.899 21.986 1.00 5.00 -ATOM 130 CB VAL A 65 19.882 1.486 22.044 1.00 5.00 -ATOM 131 CA VAL A 66 22.440 3.268 19.244 1.00 5.00 -ATOM 132 CB VAL A 66 22.883 4.589 18.756 1.00 5.00 -ATOM 133 CA ILE A 67 24.323 -0.300 19.610 1.00 5.00 -ATOM 134 CB ILE A 67 23.427 -1.744 20.512 1.00 5.00 -ATOM 135 CA ILE A 68 27.467 -0.538 16.974 1.00 5.00 -ATOM 136 CB ILE A 68 28.948 0.838 16.874 1.00 5.00 -ATOM 137 CA GLY A 69 29.109 -3.189 15.107 1.00 5.00 -ATOM 138 CA GLN A 70 31.953 -4.137 12.871 1.00 5.00 -ATOM 139 CB GLN A 70 34.308 -3.224 12.873 1.00 5.00 -ATOM 140 CA ASP A 71 30.384 -5.427 9.467 1.00 5.00 -ATOM 141 CB ASP A 71 31.446 -7.039 10.024 1.00 5.00 -ATOM 142 CA PRO A 72 27.325 -7.355 8.104 1.00 5.00 -ATOM 143 CB PRO A 72 27.541 -6.390 7.075 1.00 5.00 -ATOM 144 CA TYR A 73 27.876 -10.935 8.423 1.00 5.00 -ATOM 145 CB TYR A 73 25.857 -10.836 11.005 1.00 5.00 -ATOM 146 CA HIS A 74 29.344 -12.559 5.314 1.00 5.00 -ATOM 147 CB HIS A 74 31.911 -13.440 5.370 1.00 5.00 -ATOM 148 CA HIS A 75 27.529 -15.677 4.355 1.00 5.00 -ATOM 149 CB HIS A 75 26.692 -17.958 5.562 1.00 5.00 -ATOM 150 CA PRO A 76 24.714 -15.823 1.912 1.00 5.00 -ATOM 151 CB PRO A 76 25.613 -16.916 1.549 1.00 5.00 -ATOM 152 CA GLY A 77 21.513 -15.117 3.977 1.00 5.00 -ATOM 153 CA GLN A 78 23.680 -14.314 6.976 1.00 5.00 -ATOM 154 CB GLN A 78 25.554 -15.066 8.370 1.00 5.00 -ATOM 155 CA ALA A 79 22.992 -10.506 7.349 1.00 5.00 -ATOM 156 CB ALA A 79 23.558 -10.334 6.886 1.00 5.00 -ATOM 157 CA HIS A 80 19.670 -8.637 7.222 1.00 5.00 -ATOM 158 CB HIS A 80 18.122 -8.276 9.534 1.00 5.00 -ATOM 159 CA GLY A 81 21.465 -5.172 7.656 1.00 5.00 -ATOM 160 CA LEU A 82 21.093 -4.799 11.338 1.00 5.00 -ATOM 161 CB LEU A 82 19.205 -4.743 12.297 1.00 5.00 -ATOM 162 CA ALA A 83 24.693 -5.047 12.899 1.00 5.00 -ATOM 163 CB ALA A 83 25.212 -4.527 12.686 1.00 5.00 -ATOM 164 CA PHE A 84 24.099 -8.032 15.475 1.00 5.00 -ATOM 165 CB PHE A 84 25.602 -6.022 16.992 1.00 5.00 -ATOM 166 CA SER A 85 21.279 -9.916 13.815 1.00 5.00 -ATOM 167 CB SER A 85 20.661 -9.061 12.931 1.00 5.00 -ATOM 168 CA VAL A 86 20.530 -12.958 11.521 1.00 5.00 -ATOM 169 CB VAL A 86 20.867 -14.165 12.422 1.00 5.00 -ATOM 170 CA ARG A 87 17.178 -13.496 9.733 1.00 5.00 -ATOM 171 CB ARG A 87 18.695 -12.016 7.011 1.00 5.00 -ATOM 172 CA ALA A 88 15.038 -15.889 11.836 1.00 5.00 -ATOM 173 CB ALA A 88 14.309 -15.666 11.560 1.00 5.00 -ATOM 174 CA ASN A 89 16.086 -19.070 9.559 1.00 5.00 -ATOM 175 CB ASN A 89 16.227 -19.124 7.512 1.00 5.00 -ATOM 176 CA VAL A 90 19.786 -18.834 10.375 1.00 5.00 -ATOM 177 CB VAL A 90 20.640 -18.152 9.391 1.00 5.00 -ATOM 178 CA PRO A 91 21.475 -19.821 13.864 1.00 5.00 -ATOM 179 CB PRO A 91 22.430 -20.184 12.881 1.00 5.00 -ATOM 180 CA PRO A 92 22.497 -17.046 16.486 1.00 5.00 -ATOM 181 CB PRO A 92 21.698 -17.960 17.309 1.00 5.00 -ATOM 182 CA PRO A 93 26.145 -16.767 15.330 1.00 5.00 -ATOM 183 CB PRO A 93 26.038 -15.550 14.542 1.00 5.00 -ATOM 184 CA PRO A 94 28.225 -17.036 18.465 1.00 5.00 -ATOM 185 CB PRO A 94 29.243 -17.325 17.507 1.00 5.00 -ATOM 186 CA SER A 95 28.540 -13.363 19.428 1.00 5.00 -ATOM 187 CB SER A 95 28.970 -12.688 18.398 1.00 5.00 -ATOM 188 CA LEU A 96 24.802 -13.015 18.964 1.00 5.00 -ATOM 189 CB LEU A 96 23.547 -12.593 17.448 1.00 5.00 -ATOM 190 CA ARG A 97 24.374 -16.087 21.411 1.00 5.00 -ATOM 191 CB ARG A 97 22.598 -18.898 21.246 1.00 5.00 -ATOM 192 CA ASN A 98 26.226 -14.366 24.238 1.00 5.00 -ATOM 193 CB ASN A 98 28.002 -14.170 24.848 1.00 5.00 -ATOM 194 CA VAL A 99 24.445 -11.180 23.849 1.00 5.00 -ATOM 195 CB VAL A 99 25.189 -9.969 23.319 1.00 5.00 -ATOM 196 CA LEU A 100 21.156 -13.376 24.062 1.00 5.00 -ATOM 197 CB LEU A 100 20.823 -14.055 21.995 1.00 5.00 -ATOM 198 CA ALA A 101 22.405 -14.843 27.300 1.00 5.00 -ATOM 199 CB ALA A 101 22.963 -15.228 27.727 1.00 5.00 -ATOM 200 CA ALA A 102 23.224 -11.244 28.585 1.00 5.00 -ATOM 201 CB ALA A 102 23.332 -10.749 28.037 1.00 5.00 -ATOM 202 CA VAL A 103 19.628 -10.055 27.901 1.00 5.00 -ATOM 203 CB VAL A 103 19.335 -9.418 26.601 1.00 5.00 -ATOM 204 CA LYS A 104 18.386 -12.845 30.031 1.00 5.00 -ATOM 205 CB LYS A 104 18.618 -15.471 29.095 1.00 5.00 -ATOM 206 CA ASN A 105 21.161 -12.668 32.751 1.00 5.00 -ATOM 207 CB ASN A 105 23.168 -13.380 32.578 1.00 5.00 -ATOM 208 CA CYS A 106 19.973 -9.080 32.877 1.00 5.00 -ATOM 209 CB CYS A 106 20.414 -7.921 32.289 1.00 5.00 -ATOM 210 CA TYR A 107 16.269 -9.901 32.665 1.00 5.00 -ATOM 211 CB TYR A 107 15.496 -7.439 30.543 1.00 5.00 -ATOM 212 CA PRO A 108 15.420 -13.069 34.324 1.00 5.00 -ATOM 213 CB PRO A 108 16.098 -12.615 35.552 1.00 5.00 -ATOM 214 CA GLU A 109 11.752 -12.605 33.440 1.00 5.00 -ATOM 215 CB GLU A 109 12.117 -11.154 35.261 1.00 5.00 -ATOM 216 CA ALA A 110 11.939 -12.713 29.824 1.00 5.00 -ATOM 217 CB ALA A 110 12.575 -12.904 29.512 1.00 5.00 -ATOM 218 CA ARG A 111 10.616 -15.024 26.928 1.00 5.00 -ATOM 219 CB ARG A 111 9.125 -13.004 26.391 1.00 5.00 -ATOM 220 CA MET A 112 13.754 -15.541 24.961 1.00 5.00 -ATOM 221 CB MET A 112 15.607 -14.314 25.182 1.00 5.00 -ATOM 222 CA SER A 113 12.633 -16.612 21.348 1.00 5.00 -ATOM 223 CB SER A 113 11.920 -16.317 20.425 1.00 5.00 -ATOM 224 CA GLY A 114 15.548 -18.883 20.206 1.00 5.00 -ATOM 225 CA HIS A 115 16.690 -17.641 16.705 1.00 5.00 -ATOM 226 CB HIS A 115 14.557 -16.177 15.620 1.00 5.00 -ATOM 227 CA GLY A 116 18.953 -14.473 16.333 1.00 5.00 -ATOM 228 CA CYS A 117 16.094 -12.052 14.754 1.00 5.00 -ATOM 229 CB CYS A 117 15.509 -11.990 13.469 1.00 5.00 -ATOM 230 CA LEU A 118 16.779 -8.466 16.370 1.00 5.00 -ATOM 231 CB LEU A 118 18.643 -8.316 16.978 1.00 5.00 -ATOM 232 CA GLU A 119 14.251 -6.775 13.850 1.00 5.00 -ATOM 233 CB GLU A 119 13.606 -5.604 11.755 1.00 5.00 -ATOM 234 CA LYS A 120 12.137 -6.725 17.147 1.00 5.00 -ATOM 235 CB LYS A 120 9.594 -7.100 17.947 1.00 5.00 -ATOM 236 CA TRP A 121 14.490 -4.514 18.866 1.00 5.00 -ATOM 237 CB TRP A 121 15.437 -6.915 21.003 1.00 5.00 -ATOM 238 CA ALA A 122 14.554 -2.385 15.803 1.00 5.00 -ATOM 239 CB ALA A 122 14.331 -3.006 15.389 1.00 5.00 -ATOM 240 CA ARG A 123 11.008 -1.043 16.342 1.00 5.00 -ATOM 241 CB ARG A 123 8.413 -1.004 15.777 1.00 5.00 -ATOM 242 CA ASP A 124 11.780 -0.736 20.213 1.00 5.00 -ATOM 243 CB ASP A 124 13.209 -1.937 20.992 1.00 5.00 -ATOM 244 CA GLY A 125 14.049 2.232 19.370 1.00 5.00 -ATOM 245 CA VAL A 126 17.349 0.227 19.151 1.00 5.00 -ATOM 246 CB VAL A 126 17.250 -1.260 18.816 1.00 5.00 -ATOM 247 CA LEU A 127 19.539 1.215 16.229 1.00 5.00 -ATOM 248 CB LEU A 127 19.863 2.396 14.597 1.00 5.00 -ATOM 249 CA LEU A 128 22.106 -1.724 15.782 1.00 5.00 -ATOM 250 CB LEU A 128 21.565 -3.355 16.940 1.00 5.00 -ATOM 251 CA LEU A 129 24.383 -0.135 13.340 1.00 5.00 -ATOM 252 CB LEU A 129 24.228 1.876 12.527 1.00 5.00 -ATOM 253 CA ASN A 130 27.230 -1.543 11.433 1.00 5.00 -ATOM 254 CB ASN A 130 27.913 -2.396 9.776 1.00 5.00 -ATOM 255 CA THR A 131 29.837 1.024 10.435 1.00 5.00 -ATOM 256 CB THR A 131 30.594 0.652 11.716 1.00 5.00 -ATOM 257 CA THR A 132 30.896 -1.211 7.528 1.00 5.00 -ATOM 258 CB THR A 132 31.571 -2.523 7.479 1.00 5.00 -ATOM 259 CA LEU A 133 27.547 -1.485 5.545 1.00 5.00 -ATOM 260 CB LEU A 133 26.527 0.332 6.167 1.00 5.00 -ATOM 261 CA THR A 134 28.740 -3.822 2.786 1.00 5.00 -ATOM 262 CB THR A 134 29.063 -2.615 1.915 1.00 5.00 -ATOM 263 CA VAL A 135 30.790 -7.183 2.488 1.00 5.00 -ATOM 264 CB VAL A 135 30.810 -7.969 3.762 1.00 5.00 -ATOM 265 CA LYS A 136 32.306 -9.676 -0.027 1.00 5.00 -ATOM 266 CB LYS A 136 35.186 -9.178 -0.819 1.00 5.00 -ATOM 267 CA ARG A 137 30.690 -13.061 -0.046 1.00 5.00 -ATOM 268 CB ARG A 137 30.507 -15.483 -2.457 1.00 5.00 -ATOM 269 CA GLY A 138 33.222 -15.008 1.545 1.00 5.00 -ATOM 270 CA ALA A 139 35.692 -11.805 2.004 1.00 5.00 -ATOM 271 CB ALA A 139 36.277 -11.417 1.744 1.00 5.00 -ATOM 272 CA ALA A 140 35.299 -10.094 5.423 1.00 5.00 -ATOM 273 CB ALA A 140 35.259 -10.517 6.047 1.00 5.00 -ATOM 274 CA ALA A 141 36.883 -6.909 5.629 1.00 5.00 -ATOM 275 CB ALA A 141 37.476 -7.344 5.327 1.00 5.00 -ATOM 276 CA SER A 142 36.151 -6.311 1.840 1.00 5.00 -ATOM 277 CB SER A 142 35.092 -6.359 1.242 1.00 5.00 -ATOM 278 CA HIS A 143 34.571 -3.041 1.980 1.00 5.00 -ATOM 279 CB HIS A 143 32.633 -1.432 3.342 1.00 5.00 -ATOM 280 CA SER A 144 36.592 -2.018 4.928 1.00 5.00 -ATOM 281 CB SER A 144 37.412 -2.953 4.415 1.00 5.00 -ATOM 282 CA ARG A 145 38.284 0.888 3.106 1.00 5.00 -ATOM 283 CB ARG A 145 41.609 0.371 4.428 1.00 5.00 -ATOM 284 CA ILE A 146 35.606 2.209 0.866 1.00 5.00 -ATOM 285 CB ILE A 146 34.211 2.090 -0.106 1.00 5.00 -ATOM 286 CA GLY A 147 34.425 5.179 3.229 1.00 5.00 -ATOM 287 CA TRP A 148 31.277 3.954 4.759 1.00 5.00 -ATOM 288 CB TRP A 148 29.170 3.304 1.812 1.00 5.00 -ATOM 289 CA ASP A 149 32.757 4.551 8.227 1.00 5.00 -ATOM 290 CB ASP A 149 34.495 4.090 9.203 1.00 5.00 -ATOM 291 CA ARG A 150 32.962 8.133 7.251 1.00 5.00 -ATOM 292 CB ARG A 150 35.088 10.278 5.756 1.00 5.00 -ATOM 293 CA PHE A 151 29.438 8.362 5.968 1.00 5.00 -ATOM 294 CB PHE A 151 27.592 7.241 3.779 1.00 5.00 -ATOM 295 CA VAL A 152 28.312 6.178 8.841 1.00 5.00 -ATOM 296 CB VAL A 152 28.826 4.970 8.199 1.00 5.00 -ATOM 297 CA GLY A 153 29.659 8.337 11.644 1.00 5.00 -ATOM 298 CA GLY A 154 28.251 11.135 9.719 1.00 5.00 -ATOM 299 CA VAL A 155 24.576 10.250 10.275 1.00 5.00 -ATOM 300 CB VAL A 155 24.637 8.778 9.811 1.00 5.00 -ATOM 301 CA ILE A 156 25.803 9.252 13.917 1.00 5.00 -ATOM 302 CB ILE A 156 25.819 7.620 14.540 1.00 5.00 -ATOM 303 CA ARG A 157 27.274 12.752 14.366 1.00 5.00 -ATOM 304 CB ARG A 157 29.994 12.657 12.434 1.00 5.00 -ATOM 305 CA ARG A 158 24.097 14.262 13.115 1.00 5.00 -ATOM 306 CB ARG A 158 22.616 16.403 10.674 1.00 5.00 -ATOM 307 CA LEU A 159 21.965 12.205 15.623 1.00 5.00 -ATOM 308 CB LEU A 159 21.785 10.307 15.249 1.00 5.00 -ATOM 309 CA ALA A 160 23.974 12.706 18.800 1.00 5.00 -ATOM 310 CB ALA A 160 24.432 12.376 19.297 1.00 5.00 -ATOM 311 CA ALA A 161 23.770 16.468 18.125 1.00 5.00 -ATOM 312 CB ALA A 161 24.185 17.032 17.681 1.00 5.00 -ATOM 313 CA ARG A 162 20.217 16.468 16.685 1.00 5.00 -ATOM 314 CB ARG A 162 18.352 14.820 14.201 1.00 5.00 -ATOM 315 CA ARG A 163 19.318 14.420 19.897 1.00 5.00 -ATOM 316 CB ARG A 163 16.926 12.627 21.431 1.00 5.00 -ATOM 317 CA PRO A 164 20.049 15.247 23.465 1.00 5.00 -ATOM 318 CB PRO A 164 19.077 16.311 23.516 1.00 5.00 -ATOM 319 CA GLY A 165 19.718 12.087 25.411 1.00 5.00 -ATOM 320 CA LEU A 166 20.627 8.722 23.806 1.00 5.00 -ATOM 321 CB LEU A 166 19.774 9.107 21.854 1.00 5.00 -ATOM 322 CA VAL A 167 22.397 5.595 25.084 1.00 5.00 -ATOM 323 CB VAL A 167 21.901 4.250 25.444 1.00 5.00 -ATOM 324 CA PHE A 168 25.469 4.629 22.833 1.00 5.00 -ATOM 325 CB PHE A 168 26.867 4.786 20.194 1.00 5.00 -ATOM 326 CA MET A 169 26.548 0.990 23.520 1.00 5.00 -ATOM 327 CB MET A 169 24.446 0.084 24.640 1.00 5.00 -ATOM 328 CA LEU A 170 30.220 0.121 22.400 1.00 5.00 -ATOM 329 CB LEU A 170 30.618 2.063 21.733 1.00 5.00 -ATOM 330 CA TRP A 171 30.935 -3.200 22.548 1.00 5.00 -ATOM 331 CB TRP A 171 27.418 -3.391 23.439 1.00 5.00 -ATOM 332 CA GLY A 172 34.509 -3.395 21.565 1.00 5.00 -ATOM 333 CA THR A 173 38.016 -1.719 21.427 1.00 5.00 -ATOM 334 CB THR A 173 39.172 -2.328 22.224 1.00 5.00 -ATOM 335 CA HIS A 174 37.833 -0.801 17.777 1.00 5.00 -ATOM 336 CB HIS A 174 40.020 0.005 16.361 1.00 5.00 -ATOM 337 CA ALA A 175 34.005 0.005 17.967 1.00 5.00 -ATOM 338 CB ALA A 175 33.648 -0.618 17.625 1.00 5.00 -ATOM 339 CA GLN A 176 34.500 2.367 21.006 1.00 5.00 -ATOM 340 CB GLN A 176 36.587 1.852 22.302 1.00 5.00 -ATOM 341 CA ASN A 177 37.695 3.766 19.179 1.00 5.00 -ATOM 342 CB ASN A 177 39.660 4.303 19.672 1.00 5.00 -ATOM 343 CA ALA A 178 35.807 4.992 16.395 1.00 5.00 -ATOM 344 CB ALA A 178 35.526 4.312 16.268 1.00 5.00 -ATOM 345 CA ILE A 179 32.882 6.871 17.951 1.00 5.00 -ATOM 346 CB ILE A 179 31.655 6.643 16.510 1.00 5.00 -ATOM 347 CA ARG A 180 32.703 9.897 20.376 1.00 5.00 -ATOM 348 CB ARG A 180 34.657 12.143 21.174 1.00 5.00 -ATOM 349 CA PRO A 181 29.358 10.731 21.672 1.00 5.00 -ATOM 350 CB PRO A 181 29.267 9.281 21.669 1.00 5.00 -ATOM 351 CA ASP A 182 29.012 13.534 24.297 1.00 5.00 -ATOM 352 CB ASP A 182 27.633 14.370 23.118 1.00 5.00 -ATOM 353 CA PRO A 183 29.657 12.113 27.728 1.00 5.00 -ATOM 354 CB PRO A 183 30.762 11.568 27.075 1.00 5.00 -ATOM 355 CA ARG A 184 28.013 14.893 29.255 1.00 5.00 -ATOM 356 CB ARG A 184 27.937 18.380 29.133 1.00 5.00 -ATOM 357 CA VAL A 185 24.724 14.643 27.120 1.00 5.00 -ATOM 358 CB VAL A 185 24.198 14.799 25.716 1.00 5.00 -ATOM 359 CA HIS A 186 24.917 10.734 26.764 1.00 5.00 -ATOM 360 CB HIS A 186 25.256 9.825 24.306 1.00 5.00 -ATOM 361 CA CYS A 187 25.276 7.305 28.464 1.00 5.00 -ATOM 362 CB CYS A 187 24.404 6.355 29.059 1.00 5.00 -ATOM 363 CA VAL A 188 28.238 5.992 26.453 1.00 5.00 -ATOM 364 CB VAL A 188 29.503 6.569 26.891 1.00 5.00 -ATOM 365 CA LEU A 189 28.327 2.450 27.757 1.00 5.00 -ATOM 366 CB LEU A 189 26.511 1.779 28.368 1.00 5.00 -ATOM 367 CA LYS A 190 31.757 0.854 26.554 1.00 5.00 -ATOM 368 CB LYS A 190 32.778 2.506 25.370 1.00 5.00 -ATOM 369 CA PHE A 191 32.521 -2.797 27.504 1.00 5.00 -ATOM 370 CB PHE A 191 31.221 -4.314 29.638 1.00 5.00 -ATOM 371 CA SER A 192 34.583 -5.857 26.438 1.00 5.00 -ATOM 372 CB SER A 192 34.535 -6.992 26.856 1.00 5.00 -ATOM 373 CA HIS A 193 33.476 -7.579 23.441 1.00 5.00 -ATOM 374 CB HIS A 193 36.087 -6.820 22.220 1.00 5.00 -ATOM 375 CA PRO A 194 30.794 -10.139 22.873 1.00 5.00 -ATOM 376 CB PRO A 194 30.461 -8.912 22.242 1.00 5.00 -ATOM 377 CA SER A 195 33.421 -12.319 21.311 1.00 5.00 -ATOM 378 CB SER A 195 34.619 -12.025 21.406 1.00 5.00 -ATOM 379 CA PRO A 196 33.836 -15.719 22.891 1.00 5.00 -ATOM 380 CB PRO A 196 32.877 -15.902 21.860 1.00 5.00 -ATOM 381 CA LEU A 197 37.685 -15.586 23.905 1.00 5.00 -ATOM 382 CB LEU A 197 39.686 -16.477 24.107 1.00 5.00 -ATOM 383 CA SER A 198 37.168 -11.830 25.165 1.00 5.00 -ATOM 384 CB SER A 198 36.240 -10.985 25.238 1.00 5.00 -ATOM 385 CA LYS A 199 39.021 -11.756 28.412 1.00 5.00 -ATOM 386 CB LYS A 199 39.587 -9.149 28.036 1.00 5.00 -ATOM 387 CA VAL A 200 35.751 -10.898 30.143 1.00 5.00 -ATOM 388 CB VAL A 200 35.011 -9.634 30.422 1.00 5.00 -ATOM 389 CA PRO A 201 32.419 -13.011 29.932 1.00 5.00 -ATOM 390 CB PRO A 201 32.637 -13.511 31.193 1.00 5.00 -ATOM 391 CA PHE A 202 30.045 -11.119 27.886 1.00 5.00 -ATOM 392 CB PHE A 202 30.090 -8.485 26.580 1.00 5.00 -ATOM 393 CA GLY A 203 27.517 -12.968 29.933 1.00 5.00 -ATOM 394 CA THR A 204 27.569 -10.124 32.581 1.00 5.00 -ATOM 395 CB THR A 204 29.008 -9.693 32.643 1.00 5.00 -ATOM 396 CA CYS A 205 26.474 -6.965 30.799 1.00 5.00 -ATOM 397 CB CYS A 205 26.161 -7.106 29.435 1.00 5.00 -ATOM 398 CA GLN A 206 23.489 -5.198 32.469 1.00 5.00 -ATOM 399 CB GLN A 206 24.047 -6.607 34.463 1.00 5.00 -ATOM 400 CA HIS A 207 24.045 -2.679 29.447 1.00 5.00 -ATOM 401 CB HIS A 207 26.362 -3.232 28.171 1.00 5.00 -ATOM 402 CA PHE A 208 20.278 -2.826 28.718 1.00 5.00 -ATOM 403 CB PHE A 208 21.442 -4.967 27.073 1.00 5.00 -ATOM 404 CA LEU A 209 19.113 -2.783 32.069 1.00 5.00 -ATOM 405 CB LEU A 209 18.177 -3.981 33.383 1.00 5.00 -ATOM 406 CA VAL A 210 21.430 0.171 33.011 1.00 5.00 -ATOM 407 CB VAL A 210 22.503 -0.931 32.876 1.00 5.00 -ATOM 408 CA ALA A 211 20.105 1.942 30.003 1.00 5.00 -ATOM 409 CB ALA A 211 19.986 1.425 29.415 1.00 5.00 -ATOM 410 CA ASN A 212 16.693 1.024 30.935 1.00 5.00 -ATOM 411 CB ASN A 212 15.550 -0.569 30.560 1.00 5.00 -ATOM 412 CA ARG A 213 17.262 2.908 34.105 1.00 5.00 -ATOM 413 CB ARG A 213 20.147 3.036 35.887 1.00 5.00 -ATOM 414 CA TYR A 214 19.101 5.861 32.572 1.00 5.00 -ATOM 415 CB TYR A 214 20.005 7.458 29.807 1.00 5.00 -ATOM 416 CA LEU A 215 15.886 5.775 30.376 1.00 5.00 -ATOM 417 CB LEU A 215 15.444 4.108 29.430 1.00 5.00 -ATOM 418 CA GLU A 216 13.677 6.127 33.501 1.00 5.00 -ATOM 419 CB GLU A 216 13.398 3.513 32.891 1.00 5.00 -ATOM 420 CA THR A 217 15.693 9.200 34.361 1.00 5.00 -ATOM 421 CB THR A 217 16.824 8.304 34.600 1.00 5.00 -ATOM 422 CA ARG A 218 14.842 10.792 31.015 1.00 5.00 -ATOM 423 CB ARG A 218 16.226 10.159 28.124 1.00 5.00 -ATOM 424 CA SER A 219 10.979 10.615 30.792 1.00 5.00 -ATOM 425 CB SER A 219 9.825 11.227 31.310 1.00 5.00 -ATOM 426 CA ILE A 220 10.962 7.654 28.207 1.00 5.00 -ATOM 427 CB ILE A 220 12.317 7.881 26.816 1.00 5.00 -ATOM 428 CA SER A 221 10.093 4.011 27.585 1.00 5.00 -ATOM 429 CB SER A 221 9.951 4.225 26.214 1.00 5.00 -ATOM 430 CA PRO A 222 11.755 0.954 29.229 1.00 5.00 -ATOM 431 CB PRO A 222 10.452 0.902 29.667 1.00 5.00 -ATOM 432 CA ILE A 223 13.245 -1.292 26.395 1.00 5.00 -ATOM 433 CB ILE A 223 14.362 -0.385 25.129 1.00 5.00 -ATOM 434 CA ASP A 224 11.551 -4.701 26.376 1.00 5.00 -ATOM 435 CB ASP A 224 9.894 -4.855 25.279 1.00 5.00 -ATOM 436 CA TRP A 225 14.588 -7.063 25.475 1.00 5.00 -ATOM 437 CB TRP A 225 16.752 -4.020 25.919 1.00 5.00 -ATOM 438 CA SER A 226 12.398 -9.958 24.602 1.00 5.00 -ATOM 439 CB SER A 226 11.156 -9.505 24.651 1.00 5.00 -ATOM 440 CA VAL A 227 13.959 -11.907 21.682 1.00 5.00 -ATOM 441 CB VAL A 227 15.012 -12.224 20.649 1.00 5.00 +REMARK CLUSTER 3 FREE ENERGY -1.39727E+01 AVE RMSD 0.00 +REMARK clustering ENERGY -1.13294E+01 RMS 0.00 +ATOM 1 CA ASP A 1 -14.432 5.466 15.357 1.00 5.00 +ATOM 2 CB ASP A 1 -15.071 3.532 15.568 1.00 5.00 +ATOM 3 CA TRP A 2 -10.871 6.033 16.917 1.00 5.00 +ATOM 4 CB TRP A 2 -7.344 5.235 16.377 1.00 5.00 +ATOM 5 CA THR A 3 -12.580 6.336 20.391 1.00 5.00 +ATOM 6 CB THR A 3 -13.589 7.403 20.661 1.00 5.00 +ATOM 7 CA THR A 4 -13.153 2.655 20.313 1.00 5.00 +ATOM 8 CB THR A 4 -14.587 2.413 20.048 1.00 5.00 +ATOM 9 CA PHE A 5 -9.721 1.870 19.081 1.00 5.00 +ATOM 10 CB PHE A 5 -7.098 0.624 18.194 1.00 5.00 +ATOM 11 CA ARG A 6 -8.501 4.512 21.832 1.00 5.00 +ATOM 12 CB ARG A 6 -9.411 7.829 20.269 1.00 5.00 +ATOM 13 CA ARG A 7 -10.649 3.107 24.781 1.00 5.00 +ATOM 14 CB ARG A 7 -14.396 1.398 24.765 1.00 5.00 +ATOM 15 CA VAL A 8 -9.224 -0.507 24.012 1.00 5.00 +ATOM 16 CB VAL A 8 -9.696 -0.951 22.745 1.00 5.00 +ATOM 17 CA PHE A 9 -5.632 0.531 23.970 1.00 5.00 +ATOM 18 CB PHE A 9 -4.648 -1.602 22.123 1.00 5.00 +ATOM 19 CA LEU A 10 -5.871 3.133 26.439 1.00 5.00 +ATOM 20 CB LEU A 10 -6.765 3.539 28.100 1.00 5.00 +ATOM 21 CA ILE A 11 -4.222 5.736 24.028 1.00 5.00 +ATOM 22 CB ILE A 11 -4.357 5.251 22.504 1.00 5.00 +ATOM 23 CA ASP A 12 -2.140 8.777 25.287 1.00 5.00 +ATOM 24 CB ASP A 12 -0.804 9.719 26.426 1.00 5.00 +ATOM 25 CA ASP A 13 -4.140 11.266 23.605 1.00 5.00 +ATOM 26 CB ASP A 13 -5.282 12.762 24.139 1.00 5.00 +ATOM 27 CA ALA A 14 -0.948 13.039 22.781 1.00 5.00 +ATOM 28 CB ALA A 14 -0.290 13.483 23.024 1.00 5.00 +ATOM 29 CA TRP A 15 -0.458 9.999 20.193 1.00 5.00 +ATOM 30 CB TRP A 15 2.509 8.274 20.389 1.00 5.00 +ATOM 31 CA ARG A 16 -3.644 10.204 18.231 1.00 5.00 +ATOM 32 CB ARG A 16 -5.898 9.502 20.788 1.00 5.00 +ATOM 33 CA PRO A 17 -2.411 12.522 15.440 1.00 5.00 +ATOM 34 CB PRO A 17 -2.321 13.319 16.562 1.00 5.00 +ATOM 35 CA LEU A 18 -0.188 9.776 14.539 1.00 5.00 +ATOM 36 CB LEU A 18 1.586 9.014 15.510 1.00 5.00 +ATOM 37 CA MET A 19 -2.176 6.768 15.452 1.00 5.00 +ATOM 38 CB MET A 19 -1.042 5.945 17.431 1.00 5.00 +ATOM 39 CA GLU A 20 -5.519 7.584 13.333 1.00 5.00 +ATOM 40 CB GLU A 20 -7.752 7.920 12.834 1.00 5.00 +ATOM 41 CA PRO A 21 -3.813 8.158 10.144 1.00 5.00 +ATOM 42 CB PRO A 21 -2.963 9.011 10.904 1.00 5.00 +ATOM 43 CA GLU A 22 -3.187 4.204 10.169 1.00 5.00 +ATOM 44 CB GLU A 22 -1.031 3.092 9.379 1.00 5.00 +ATOM 45 CA LEU A 23 -6.953 3.749 11.132 1.00 5.00 +ATOM 46 CB LEU A 23 -7.962 2.626 12.442 1.00 5.00 +ATOM 47 CA ALA A 24 -7.900 5.350 7.749 1.00 5.00 +ATOM 48 CB ALA A 24 -7.475 5.957 7.356 1.00 5.00 +ATOM 49 CA ASN A 25 -6.183 2.336 5.840 1.00 5.00 +ATOM 50 CB ASN A 25 -4.865 3.376 4.867 1.00 5.00 +ATOM 51 CA PRO A 26 -6.980 -1.352 4.724 1.00 5.00 +ATOM 52 CB PRO A 26 -6.544 -0.890 3.428 1.00 5.00 +ATOM 53 CA LEU A 27 -4.560 -3.486 6.574 1.00 5.00 +ATOM 54 CB LEU A 27 -2.578 -3.245 7.069 1.00 5.00 +ATOM 55 CA THR A 28 -4.836 -1.822 9.972 1.00 5.00 +ATOM 56 CB THR A 28 -4.608 -0.415 10.298 1.00 5.00 +ATOM 57 CA ALA A 29 -8.346 -2.961 10.379 1.00 5.00 +ATOM 58 CB ALA A 29 -8.627 -2.336 10.035 1.00 5.00 +ATOM 59 CA HIS A 30 -7.658 -6.527 9.192 1.00 5.00 +ATOM 60 CB HIS A 30 -8.429 -6.205 6.574 1.00 5.00 +ATOM 61 CA LEU A 31 -4.438 -6.528 11.242 1.00 5.00 +ATOM 62 CB LEU A 31 -2.885 -5.249 11.768 1.00 5.00 +ATOM 63 CA LEU A 32 -6.376 -5.603 14.313 1.00 5.00 +ATOM 64 CB LEU A 32 -7.589 -4.003 14.651 1.00 5.00 +ATOM 65 CA ALA A 33 -9.301 -8.097 14.270 1.00 5.00 +ATOM 66 CB ALA A 33 -9.975 -7.911 14.266 1.00 5.00 +ATOM 67 CA GLU A 34 -6.716 -10.549 13.654 1.00 5.00 +ATOM 68 CB GLU A 34 -5.290 -11.586 11.484 1.00 5.00 +ATOM 69 CA TYR A 35 -5.011 -9.678 16.802 1.00 5.00 +ATOM 70 CB TYR A 35 -4.244 -6.450 16.847 1.00 5.00 +ATOM 71 CA ASN A 36 -8.173 -10.200 18.630 1.00 5.00 +ATOM 72 CB ASN A 36 -9.861 -9.313 17.914 1.00 5.00 +ATOM 73 CA ARG A 37 -9.201 -13.465 17.489 1.00 5.00 +ATOM 74 CB ARG A 37 -10.783 -11.940 15.120 1.00 5.00 +ATOM 75 CA ARG A 38 -5.721 -14.761 18.187 1.00 5.00 +ATOM 76 CB ARG A 38 -4.038 -12.901 15.766 1.00 5.00 +ATOM 77 CA CYS A 39 -6.175 -13.298 21.847 1.00 5.00 +ATOM 78 CB CYS A 39 -5.968 -11.916 21.986 1.00 5.00 +ATOM 79 CA GLN A 40 -8.967 -16.087 22.142 1.00 5.00 +ATOM 80 CB GLN A 40 -10.266 -14.989 24.110 1.00 5.00 +ATOM 81 CA THR A 41 -6.943 -19.016 20.866 1.00 5.00 +ATOM 82 CB THR A 41 -7.935 -19.302 19.798 1.00 5.00 +ATOM 83 CA GLU A 42 -4.021 -17.813 23.001 1.00 5.00 +ATOM 84 CB GLU A 42 -3.342 -15.992 21.543 1.00 5.00 +ATOM 85 CA GLU A 43 -2.849 -15.697 26.048 1.00 5.00 +ATOM 86 CB GLU A 43 -0.566 -16.212 27.623 1.00 5.00 +ATOM 87 CA VAL A 44 -0.939 -12.868 24.055 1.00 5.00 +ATOM 88 CB VAL A 44 -1.538 -11.894 22.994 1.00 5.00 +ATOM 89 CA LEU A 45 1.891 -11.590 26.185 1.00 5.00 +ATOM 90 CB LEU A 45 3.028 -12.886 27.313 1.00 5.00 +ATOM 91 CA PRO A 46 1.442 -7.725 26.310 1.00 5.00 +ATOM 92 CB PRO A 46 1.910 -8.054 24.950 1.00 5.00 +ATOM 93 CA PRO A 47 -1.668 -7.580 28.367 1.00 5.00 +ATOM 94 CB PRO A 47 -0.826 -7.644 29.477 1.00 5.00 +ATOM 95 CA ARG A 48 -4.149 -5.706 26.070 1.00 5.00 +ATOM 96 CB ARG A 48 -6.374 -9.029 25.640 1.00 5.00 +ATOM 97 CA GLU A 49 -3.672 -2.547 28.307 1.00 5.00 +ATOM 98 CB GLU A 49 -3.362 -2.739 30.427 1.00 5.00 +ATOM 99 CA ASP A 50 0.124 -2.812 28.016 1.00 5.00 +ATOM 100 CB ASP A 50 1.138 -4.523 28.522 1.00 5.00 +ATOM 101 CA VAL A 51 0.087 -3.185 24.412 1.00 5.00 +ATOM 102 CB VAL A 51 -0.557 -4.397 23.786 1.00 5.00 +ATOM 103 CA PHE A 52 -0.081 0.392 24.022 1.00 5.00 +ATOM 104 CB PHE A 52 -0.234 0.879 21.078 1.00 5.00 +ATOM 105 CA SER A 53 1.999 1.389 27.175 1.00 5.00 +ATOM 106 CB SER A 53 3.027 0.685 27.508 1.00 5.00 +ATOM 107 CA TRP A 54 4.760 3.050 25.040 1.00 5.00 +ATOM 108 CB TRP A 54 5.103 3.376 21.382 1.00 5.00 +ATOM 109 CA THR A 55 2.403 6.183 24.297 1.00 5.00 +ATOM 110 CB THR A 55 1.271 5.461 23.700 1.00 5.00 +ATOM 111 CA ARG A 56 1.520 6.688 27.958 1.00 5.00 +ATOM 112 CB ARG A 56 -0.810 4.425 26.456 1.00 5.00 +ATOM 113 CA TYR A 57 5.155 7.595 28.844 1.00 5.00 +ATOM 114 CB TYR A 57 7.035 5.831 26.695 1.00 5.00 +ATOM 115 CA CYS A 58 5.786 10.722 26.911 1.00 5.00 +ATOM 116 CB CYS A 58 6.959 10.171 26.370 1.00 5.00 +ATOM 117 CA THR A 59 4.459 13.380 24.493 1.00 5.00 +ATOM 118 CB THR A 59 3.710 14.453 25.216 1.00 5.00 +ATOM 119 CA PRO A 60 5.664 13.180 20.922 1.00 5.00 +ATOM 120 CB PRO A 60 4.359 12.711 20.693 1.00 5.00 +ATOM 121 CA ASP A 61 7.684 16.296 21.591 1.00 5.00 +ATOM 122 CB ASP A 61 8.137 18.253 21.387 1.00 5.00 +ATOM 123 CA GLU A 62 9.113 15.221 24.715 1.00 5.00 +ATOM 124 CB GLU A 62 7.736 14.994 26.656 1.00 5.00 +ATOM 125 CA VAL A 63 10.792 12.215 22.652 1.00 5.00 +ATOM 126 CB VAL A 63 9.691 11.683 21.752 1.00 5.00 +ATOM 127 CA ARG A 64 14.566 13.022 22.022 1.00 5.00 +ATOM 128 CB ARG A 64 16.265 14.690 24.355 1.00 5.00 +ATOM 129 CA VAL A 65 15.534 9.384 21.138 1.00 5.00 +ATOM 130 CB VAL A 65 16.676 9.479 22.035 1.00 5.00 +ATOM 131 CA VAL A 66 14.095 6.122 19.433 1.00 5.00 +ATOM 132 CB VAL A 66 12.933 6.448 18.401 1.00 5.00 +ATOM 133 CA ILE A 67 15.249 2.688 20.479 1.00 5.00 +ATOM 134 CB ILE A 67 16.035 2.592 22.193 1.00 5.00 +ATOM 135 CA ILE A 68 13.831 -0.148 18.365 1.00 5.00 +ATOM 136 CB ILE A 68 13.806 -0.430 16.458 1.00 5.00 +ATOM 137 CA GLY A 69 12.871 -3.822 19.363 1.00 5.00 +ATOM 138 CA GLN A 70 11.979 -6.872 17.163 1.00 5.00 +ATOM 139 CB GLN A 70 14.199 -5.601 16.027 1.00 5.00 +ATOM 140 CA ASP A 71 9.233 -8.062 19.678 1.00 5.00 +ATOM 141 CB ASP A 71 9.782 -9.773 20.708 1.00 5.00 +ATOM 142 CA PRO A 72 8.032 -8.403 23.320 1.00 5.00 +ATOM 143 CB PRO A 72 7.052 -8.057 22.298 1.00 5.00 +ATOM 144 CA TYR A 73 9.487 -10.963 25.860 1.00 5.00 +ATOM 145 CB TYR A 73 10.983 -8.316 26.967 1.00 5.00 +ATOM 146 CA HIS A 74 7.313 -14.104 26.255 1.00 5.00 +ATOM 147 CB HIS A 74 8.693 -16.430 26.188 1.00 5.00 +ATOM 148 CA HIS A 75 7.249 -15.625 29.576 1.00 5.00 +ATOM 149 CB HIS A 75 9.821 -14.965 29.835 1.00 5.00 +ATOM 150 CA PRO A 76 4.509 -13.961 31.868 1.00 5.00 +ATOM 151 CB PRO A 76 3.963 -15.241 32.220 1.00 5.00 +ATOM 152 CA GLY A 77 6.275 -10.819 33.256 1.00 5.00 +ATOM 153 CA GLN A 78 9.018 -10.040 30.844 1.00 5.00 +ATOM 154 CB GLN A 78 7.808 -11.388 29.294 1.00 5.00 +ATOM 155 CA ALA A 79 6.728 -7.296 29.059 1.00 5.00 +ATOM 156 CB ALA A 79 6.286 -7.486 28.377 1.00 5.00 +ATOM 157 CA HIS A 80 5.112 -4.236 29.578 1.00 5.00 +ATOM 158 CB HIS A 80 7.211 -2.763 30.757 1.00 5.00 +ATOM 159 CA GLY A 81 5.353 -3.192 26.009 1.00 5.00 +ATOM 160 CA LEU A 82 8.550 -0.924 25.918 1.00 5.00 +ATOM 161 CB LEU A 82 7.663 0.625 26.918 1.00 5.00 +ATOM 162 CA ALA A 83 11.309 -2.916 23.892 1.00 5.00 +ATOM 163 CB ALA A 83 11.655 -2.601 23.320 1.00 5.00 +ATOM 164 CA PHE A 84 14.173 -4.199 25.850 1.00 5.00 +ATOM 165 CB PHE A 84 15.798 -3.809 23.447 1.00 5.00 +ATOM 166 CA SER A 85 12.384 -2.888 29.203 1.00 5.00 +ATOM 167 CB SER A 85 11.164 -2.525 28.833 1.00 5.00 +ATOM 168 CA VAL A 86 11.646 -5.307 32.012 1.00 5.00 +ATOM 169 CB VAL A 86 12.540 -6.546 32.212 1.00 5.00 +ATOM 170 CA ARG A 87 9.105 -5.792 34.903 1.00 5.00 +ATOM 171 CB ARG A 87 7.007 -5.617 33.535 1.00 5.00 +ATOM 172 CA ALA A 88 11.293 -4.705 37.604 1.00 5.00 +ATOM 173 CB ALA A 88 11.162 -4.095 38.062 1.00 5.00 +ATOM 174 CA ASN A 89 10.776 -8.155 39.327 1.00 5.00 +ATOM 175 CB ASN A 89 8.948 -8.462 38.978 1.00 5.00 +ATOM 176 CA VAL A 90 12.929 -9.878 36.603 1.00 5.00 +ATOM 177 CB VAL A 90 11.736 -9.902 35.703 1.00 5.00 +ATOM 178 CA PRO A 91 16.913 -9.899 35.597 1.00 5.00 +ATOM 179 CB PRO A 91 16.688 -11.281 35.839 1.00 5.00 +ATOM 180 CA PRO A 92 17.157 -7.888 32.308 1.00 5.00 +ATOM 181 CB PRO A 92 18.078 -7.057 33.026 1.00 5.00 +ATOM 182 CA PRO A 93 17.282 -10.527 29.640 1.00 5.00 +ATOM 183 CB PRO A 93 16.382 -9.732 28.808 1.00 5.00 +ATOM 184 CA PRO A 94 20.898 -10.660 28.510 1.00 5.00 +ATOM 185 CB PRO A 94 20.436 -11.993 28.429 1.00 5.00 +ATOM 186 CA SER A 95 20.657 -7.999 25.769 1.00 5.00 +ATOM 187 CB SER A 95 19.669 -8.558 25.217 1.00 5.00 +ATOM 188 CA LEU A 96 19.411 -5.486 28.377 1.00 5.00 +ATOM 189 CB LEU A 96 17.675 -4.284 28.611 1.00 5.00 +ATOM 190 CA ARG A 97 22.394 -6.032 30.451 1.00 5.00 +ATOM 191 CB ARG A 97 24.385 -8.141 32.332 1.00 5.00 +ATOM 192 CA ASN A 98 24.585 -5.608 27.431 1.00 5.00 +ATOM 193 CB ASN A 98 25.627 -7.126 27.128 1.00 5.00 +ATOM 194 CA VAL A 99 22.726 -2.448 26.655 1.00 5.00 +ATOM 195 CB VAL A 99 21.246 -2.138 26.274 1.00 5.00 +ATOM 196 CA LEU A 100 22.730 -1.207 30.379 1.00 5.00 +ATOM 197 CB LEU A 100 20.948 -0.479 31.162 1.00 5.00 +ATOM 198 CA ALA A 101 26.395 -2.363 30.414 1.00 5.00 +ATOM 199 CB ALA A 101 26.916 -2.833 30.695 1.00 5.00 +ATOM 200 CA ALA A 102 27.108 -0.400 27.381 1.00 5.00 +ATOM 201 CB ALA A 102 26.584 -0.804 26.943 1.00 5.00 +ATOM 202 CA VAL A 103 25.397 2.599 29.183 1.00 5.00 +ATOM 203 CB VAL A 103 23.992 3.155 29.230 1.00 5.00 +ATOM 204 CA LYS A 104 27.620 1.584 32.363 1.00 5.00 +ATOM 205 CB LYS A 104 27.937 -0.544 34.651 1.00 5.00 +ATOM 206 CA ASN A 105 30.800 1.568 30.154 1.00 5.00 +ATOM 207 CB ASN A 105 30.660 -0.069 28.962 1.00 5.00 +ATOM 208 CA CYS A 106 30.097 4.873 28.647 1.00 5.00 +ATOM 209 CB CYS A 106 29.205 4.303 27.705 1.00 5.00 +ATOM 210 CA TYR A 107 29.004 6.412 31.946 1.00 5.00 +ATOM 211 CB TYR A 107 26.347 8.148 31.806 1.00 5.00 +ATOM 212 CA PRO A 108 31.451 5.657 34.569 1.00 5.00 +ATOM 213 CB PRO A 108 32.352 5.996 33.511 1.00 5.00 +ATOM 214 CA GLU A 109 29.878 7.379 37.511 1.00 5.00 +ATOM 215 CB GLU A 109 31.764 8.968 37.373 1.00 5.00 +ATOM 216 CA ALA A 110 26.267 5.955 37.034 1.00 5.00 +ATOM 217 CB ALA A 110 26.556 5.210 37.006 1.00 5.00 +ATOM 218 CA ARG A 111 24.151 4.301 39.928 1.00 5.00 +ATOM 219 CB ARG A 111 24.254 3.163 43.165 1.00 5.00 +ATOM 220 CA MET A 112 23.387 1.018 38.000 1.00 5.00 +ATOM 221 CB MET A 112 23.514 1.107 36.008 1.00 5.00 +ATOM 222 CA SER A 113 20.741 -0.551 40.176 1.00 5.00 +ATOM 223 CB SER A 113 19.777 0.373 40.319 1.00 5.00 +ATOM 224 CA GLY A 114 21.161 -4.224 38.748 1.00 5.00 +ATOM 225 CA HIS A 115 17.930 -4.261 36.674 1.00 5.00 +ATOM 226 CB HIS A 115 16.716 -6.128 38.291 1.00 5.00 +ATOM 227 CA GLY A 116 15.850 -3.248 33.456 1.00 5.00 +ATOM 228 CA CYS A 117 12.859 -0.957 34.294 1.00 5.00 +ATOM 229 CB CYS A 117 13.115 -0.399 35.437 1.00 5.00 +ATOM 230 CA LEU A 118 13.280 1.448 31.427 1.00 5.00 +ATOM 231 CB LEU A 118 14.763 1.288 30.109 1.00 5.00 +ATOM 232 CA GLU A 119 10.262 3.360 32.876 1.00 5.00 +ATOM 233 CB GLU A 119 10.141 2.318 34.940 1.00 5.00 +ATOM 234 CA LYS A 120 12.445 6.293 33.979 1.00 5.00 +ATOM 235 CB LYS A 120 13.292 5.589 36.478 1.00 5.00 +ATOM 236 CA TRP A 121 14.311 6.116 30.764 1.00 5.00 +ATOM 237 CB TRP A 121 17.434 5.165 31.350 1.00 5.00 +ATOM 238 CA ALA A 122 10.580 6.234 29.426 1.00 5.00 +ATOM 239 CB ALA A 122 10.475 5.575 28.962 1.00 5.00 +ATOM 240 CA ARG A 123 9.916 9.323 31.202 1.00 5.00 +ATOM 241 CB ARG A 123 6.872 7.939 31.467 1.00 5.00 +ATOM 242 CA ASP A 124 13.008 11.088 30.089 1.00 5.00 +ATOM 243 CB ASP A 124 14.008 9.604 29.546 1.00 5.00 +ATOM 244 CA GLY A 125 11.821 11.262 26.526 1.00 5.00 +ATOM 245 CA VAL A 126 13.487 7.982 25.130 1.00 5.00 +ATOM 246 CB VAL A 126 14.766 7.194 25.357 1.00 5.00 +ATOM 247 CA LEU A 127 10.938 6.147 22.942 1.00 5.00 +ATOM 248 CB LEU A 127 9.719 6.719 21.429 1.00 5.00 +ATOM 249 CA LEU A 128 11.960 2.431 23.251 1.00 5.00 +ATOM 250 CB LEU A 128 12.465 2.656 25.087 1.00 5.00 +ATOM 251 CA LEU A 129 9.851 0.797 20.688 1.00 5.00 +ATOM 252 CB LEU A 129 9.502 1.948 19.313 1.00 5.00 +ATOM 253 CA ASN A 130 8.865 -2.715 19.624 1.00 5.00 +ATOM 254 CB ASN A 130 8.167 -3.245 21.349 1.00 5.00 +ATOM 255 CA THR A 131 8.272 -3.173 15.946 1.00 5.00 +ATOM 256 CB THR A 131 9.055 -3.151 14.697 1.00 5.00 +ATOM 257 CA THR A 132 6.343 -6.687 16.206 1.00 5.00 +ATOM 258 CB THR A 132 7.116 -7.945 16.485 1.00 5.00 +ATOM 259 CA LEU A 133 4.027 -5.404 19.280 1.00 5.00 +ATOM 260 CB LEU A 133 4.309 -3.326 19.885 1.00 5.00 +ATOM 261 CA THR A 134 2.326 -8.712 20.014 1.00 5.00 +ATOM 262 CB THR A 134 0.861 -8.332 20.037 1.00 5.00 +ATOM 263 CA VAL A 135 3.648 -12.047 21.077 1.00 5.00 +ATOM 264 CB VAL A 135 4.508 -11.874 22.185 1.00 5.00 +ATOM 265 CA LYS A 136 1.857 -15.615 21.462 1.00 5.00 +ATOM 266 CB LYS A 136 0.350 -17.200 19.200 1.00 5.00 +ATOM 267 CA ARG A 137 2.631 -16.660 25.119 1.00 5.00 +ATOM 268 CB ARG A 137 0.425 -18.835 24.353 1.00 5.00 +ATOM 269 CA GLY A 138 5.907 -18.958 24.639 1.00 5.00 +ATOM 270 CA ALA A 139 6.886 -18.285 20.989 1.00 5.00 +ATOM 271 CB ALA A 139 6.443 -18.743 20.467 1.00 5.00 +ATOM 272 CA ALA A 140 9.126 -15.502 19.861 1.00 5.00 +ATOM 273 CB ALA A 140 9.898 -15.596 20.111 1.00 5.00 +ATOM 274 CA ALA A 141 8.609 -13.982 16.594 1.00 5.00 +ATOM 275 CB ALA A 141 9.236 -13.857 16.157 1.00 5.00 +ATOM 276 CA SER A 142 5.365 -15.719 16.110 1.00 5.00 +ATOM 277 CB SER A 142 4.878 -16.726 16.892 1.00 5.00 +ATOM 278 CA HIS A 143 3.292 -12.351 15.506 1.00 5.00 +ATOM 279 CB HIS A 143 3.123 -9.771 16.368 1.00 5.00 +ATOM 280 CA SER A 144 5.814 -11.331 13.225 1.00 5.00 +ATOM 281 CB SER A 144 6.417 -12.482 13.540 1.00 5.00 +ATOM 282 CA ARG A 145 3.688 -12.797 10.536 1.00 5.00 +ATOM 283 CB ARG A 145 5.289 -15.842 11.572 1.00 5.00 +ATOM 284 CA ILE A 146 0.875 -10.165 11.128 1.00 5.00 +ATOM 285 CB ILE A 146 0.421 -9.297 12.852 1.00 5.00 +ATOM 286 CA GLY A 147 0.950 -6.552 9.730 1.00 5.00 +ATOM 287 CA TRP A 148 1.843 -4.765 12.716 1.00 5.00 +ATOM 288 CB TRP A 148 0.669 -4.565 16.238 1.00 5.00 +ATOM 289 CA ASP A 149 5.196 -3.711 11.215 1.00 5.00 +ATOM 290 CB ASP A 149 5.537 -5.218 10.007 1.00 5.00 +ATOM 291 CA ARG A 150 3.741 -1.655 8.416 1.00 5.00 +ATOM 292 CB ARG A 150 1.475 -0.080 6.521 1.00 5.00 +ATOM 293 CA PHE A 151 1.799 0.104 11.189 1.00 5.00 +ATOM 294 CB PHE A 151 -0.427 0.357 13.330 1.00 5.00 +ATOM 295 CA VAL A 152 4.737 0.546 13.541 1.00 5.00 +ATOM 296 CB VAL A 152 4.871 -0.887 13.995 1.00 5.00 +ATOM 297 CA GLY A 153 6.612 1.890 10.447 1.00 5.00 +ATOM 298 CA GLY A 154 4.045 4.430 9.484 1.00 5.00 +ATOM 299 CA VAL A 155 3.773 5.888 13.162 1.00 5.00 +ATOM 300 CB VAL A 155 2.947 5.029 14.079 1.00 5.00 +ATOM 301 CA ILE A 156 7.584 6.420 13.122 1.00 5.00 +ATOM 302 CB ILE A 156 8.728 5.019 13.671 1.00 5.00 +ATOM 303 CA ARG A 157 7.630 7.786 9.680 1.00 5.00 +ATOM 304 CB ARG A 157 5.520 7.665 6.836 1.00 5.00 +ATOM 305 CA ARG A 158 5.194 10.397 10.791 1.00 5.00 +ATOM 306 CB ARG A 158 2.408 8.520 10.389 1.00 5.00 +ATOM 307 CA LEU A 159 6.981 11.107 14.035 1.00 5.00 +ATOM 308 CB LEU A 159 7.865 10.142 15.677 1.00 5.00 +ATOM 309 CA ALA A 160 10.149 12.023 12.132 1.00 5.00 +ATOM 310 CB ALA A 160 10.416 11.608 11.554 1.00 5.00 +ATOM 311 CA ALA A 161 8.028 14.751 10.218 1.00 5.00 +ATOM 312 CB ALA A 161 7.340 14.378 10.038 1.00 5.00 +ATOM 313 CA ARG A 162 6.895 16.042 13.477 1.00 5.00 +ATOM 314 CB ARG A 162 4.209 14.137 13.590 1.00 5.00 +ATOM 315 CA ARG A 163 10.374 16.203 14.919 1.00 5.00 +ATOM 316 CB ARG A 163 10.337 15.851 18.651 1.00 5.00 +ATOM 317 CA PRO A 164 13.554 17.422 13.069 1.00 5.00 +ATOM 318 CB PRO A 164 12.978 18.693 13.459 1.00 5.00 +ATOM 319 CA GLY A 165 15.936 16.521 15.740 1.00 5.00 +ATOM 320 CA LEU A 166 15.669 12.601 16.513 1.00 5.00 +ATOM 321 CB LEU A 166 13.877 12.006 17.310 1.00 5.00 +ATOM 322 CA VAL A 167 18.709 10.025 17.295 1.00 5.00 +ATOM 323 CB VAL A 167 19.363 9.652 18.495 1.00 5.00 +ATOM 324 CA PHE A 168 17.277 6.556 16.085 1.00 5.00 +ATOM 325 CB PHE A 168 14.906 7.664 14.626 1.00 5.00 +ATOM 326 CA MET A 169 19.113 4.050 17.938 1.00 5.00 +ATOM 327 CB MET A 169 19.352 5.125 20.299 1.00 5.00 +ATOM 328 CA LEU A 170 19.325 1.533 14.957 1.00 5.00 +ATOM 329 CB LEU A 170 18.952 2.285 13.066 1.00 5.00 +ATOM 330 CA TRP A 171 19.972 -1.788 16.418 1.00 5.00 +ATOM 331 CB TRP A 171 19.799 -0.499 19.989 1.00 5.00 +ATOM 332 CA GLY A 172 21.126 -4.076 13.554 1.00 5.00 +ATOM 333 CA THR A 173 20.827 -5.188 9.860 1.00 5.00 +ATOM 334 CB THR A 173 21.719 -5.514 8.757 1.00 5.00 +ATOM 335 CA HIS A 174 16.769 -5.733 10.398 1.00 5.00 +ATOM 336 CB HIS A 174 14.527 -6.231 11.755 1.00 5.00 +ATOM 337 CA ALA A 175 16.319 -2.648 12.664 1.00 5.00 +ATOM 338 CB ALA A 175 16.912 -2.409 13.060 1.00 5.00 +ATOM 339 CA GLN A 176 18.521 -0.561 10.543 1.00 5.00 +ATOM 340 CB GLN A 176 21.161 -1.511 10.551 1.00 5.00 +ATOM 341 CA ASN A 177 16.605 -1.780 7.277 1.00 5.00 +ATOM 342 CB ASN A 177 17.792 -3.420 7.168 1.00 5.00 +ATOM 343 CA ALA A 178 13.221 -1.397 8.923 1.00 5.00 +ATOM 344 CB ALA A 178 13.360 -1.908 9.442 1.00 5.00 +ATOM 345 CA ILE A 179 13.885 2.202 10.037 1.00 5.00 +ATOM 346 CB ILE A 179 13.848 2.766 11.798 1.00 5.00 +ATOM 347 CA ARG A 180 14.728 4.897 7.549 1.00 5.00 +ATOM 348 CB ARG A 180 12.236 4.142 5.451 1.00 5.00 +ATOM 349 CA PRO A 181 14.271 8.532 8.501 1.00 5.00 +ATOM 350 CB PRO A 181 15.292 8.112 9.366 1.00 5.00 +ATOM 351 CA ASP A 182 15.567 11.075 6.270 1.00 5.00 +ATOM 352 CB ASP A 182 14.037 12.241 5.363 1.00 5.00 +ATOM 353 CA PRO A 183 19.236 11.073 7.418 1.00 5.00 +ATOM 354 CB PRO A 183 19.254 9.956 6.493 1.00 5.00 +ATOM 355 CA ARG A 184 19.535 14.881 7.080 1.00 5.00 +ATOM 356 CB ARG A 184 20.709 15.024 4.662 1.00 5.00 +ATOM 357 CA VAL A 185 17.184 16.204 9.741 1.00 5.00 +ATOM 358 CB VAL A 185 16.059 16.931 9.117 1.00 5.00 +ATOM 359 CA HIS A 186 18.210 13.436 12.259 1.00 5.00 +ATOM 360 CB HIS A 186 15.615 13.152 12.993 1.00 5.00 +ATOM 361 CA CYS A 187 21.050 11.320 13.952 1.00 5.00 +ATOM 362 CB CYS A 187 21.970 11.133 15.024 1.00 5.00 +ATOM 363 CA VAL A 188 20.873 7.469 12.836 1.00 5.00 +ATOM 364 CB VAL A 188 20.422 7.072 11.406 1.00 5.00 +ATOM 365 CA LEU A 189 23.324 5.473 15.008 1.00 5.00 +ATOM 366 CB LEU A 189 23.281 6.047 16.996 1.00 5.00 +ATOM 367 CA LYS A 190 23.536 1.845 13.525 1.00 5.00 +ATOM 368 CB LYS A 190 23.160 2.062 10.481 1.00 5.00 +ATOM 369 CA PHE A 191 25.785 -0.601 15.218 1.00 5.00 +ATOM 370 CB PHE A 191 27.962 0.096 17.088 1.00 5.00 +ATOM 371 CA SER A 192 25.503 -4.058 16.580 1.00 5.00 +ATOM 372 CB SER A 192 26.297 -4.919 17.249 1.00 5.00 +ATOM 373 CA HIS A 193 23.004 -6.670 17.524 1.00 5.00 +ATOM 374 CB HIS A 193 21.133 -8.726 17.042 1.00 5.00 +ATOM 375 CA PRO A 194 22.598 -6.666 21.216 1.00 5.00 +ATOM 376 CB PRO A 194 21.641 -5.560 21.058 1.00 5.00 +ATOM 377 CA SER A 195 22.656 -10.344 21.449 1.00 5.00 +ATOM 378 CB SER A 195 22.560 -10.686 20.104 1.00 5.00 +ATOM 379 CA PRO A 196 25.819 -11.823 22.610 1.00 5.00 +ATOM 380 CB PRO A 196 25.033 -12.096 23.736 1.00 5.00 +ATOM 381 CA LEU A 197 26.462 -13.470 19.312 1.00 5.00 +ATOM 382 CB LEU A 197 25.965 -14.221 17.520 1.00 5.00 +ATOM 383 CA SER A 198 27.534 -10.029 18.110 1.00 5.00 +ATOM 384 CB SER A 198 27.899 -9.764 19.389 1.00 5.00 +ATOM 385 CA LYS A 199 30.800 -9.374 16.049 1.00 5.00 +ATOM 386 CB LYS A 199 33.816 -9.931 15.612 1.00 5.00 +ATOM 387 CA VAL A 200 31.600 -6.605 18.379 1.00 5.00 +ATOM 388 CB VAL A 200 31.325 -5.436 17.480 1.00 5.00 +ATOM 389 CA PRO A 201 31.196 -6.105 22.221 1.00 5.00 +ATOM 390 CB PRO A 201 32.566 -6.050 22.106 1.00 5.00 +ATOM 391 CA PHE A 202 27.718 -4.544 22.476 1.00 5.00 +ATOM 392 CB PHE A 202 25.548 -3.095 20.898 1.00 5.00 +ATOM 393 CA GLY A 203 28.989 -2.584 25.316 1.00 5.00 +ATOM 394 CA THR A 204 31.905 -1.601 22.840 1.00 5.00 +ATOM 395 CB THR A 204 32.494 -2.165 21.533 1.00 5.00 +ATOM 396 CA CYS A 205 29.355 1.163 21.843 1.00 5.00 +ATOM 397 CB CYS A 205 28.036 1.289 22.223 1.00 5.00 +ATOM 398 CA GLN A 206 28.682 4.536 23.104 1.00 5.00 +ATOM 399 CB GLN A 206 31.302 4.570 24.106 1.00 5.00 +ATOM 400 CA HIS A 207 26.048 5.803 20.766 1.00 5.00 +ATOM 401 CB HIS A 207 25.219 3.555 19.677 1.00 5.00 +ATOM 402 CA PHE A 208 25.070 6.698 24.522 1.00 5.00 +ATOM 403 CB PHE A 208 23.198 4.339 24.594 1.00 5.00 +ATOM 404 CA LEU A 209 27.858 8.993 24.853 1.00 5.00 +ATOM 405 CB LEU A 209 29.406 10.117 25.743 1.00 5.00 +ATOM 406 CA VAL A 210 27.090 10.281 21.108 1.00 5.00 +ATOM 407 CB VAL A 210 27.220 9.631 19.712 1.00 5.00 +ATOM 408 CA ALA A 211 23.494 10.903 21.539 1.00 5.00 +ATOM 409 CB ALA A 211 23.294 10.306 22.028 1.00 5.00 +ATOM 410 CA ASN A 212 24.317 13.418 24.265 1.00 5.00 +ATOM 411 CB ASN A 212 24.302 12.272 25.936 1.00 5.00 +ATOM 412 CA ARG A 213 26.692 15.112 21.935 1.00 5.00 +ATOM 413 CB ARG A 213 30.537 13.906 20.963 1.00 5.00 +ATOM 414 CA TYR A 214 24.384 15.463 19.110 1.00 5.00 +ATOM 415 CB TYR A 214 21.635 14.384 17.750 1.00 5.00 +ATOM 416 CA LEU A 215 21.883 16.800 21.735 1.00 5.00 +ATOM 417 CB LEU A 215 21.695 14.858 22.451 1.00 5.00 +ATOM 418 CA GLU A 216 24.633 19.176 22.997 1.00 5.00 +ATOM 419 CB GLU A 216 26.233 17.996 21.711 1.00 5.00 +ATOM 420 CA THR A 217 24.345 20.496 19.573 1.00 5.00 +ATOM 421 CB THR A 217 24.963 19.759 18.457 1.00 5.00 +ATOM 422 CA ARG A 218 20.362 20.892 19.214 1.00 5.00 +ATOM 423 CB ARG A 218 19.680 18.354 17.386 1.00 5.00 +ATOM 424 CA SER A 219 20.255 22.951 22.417 1.00 5.00 +ATOM 425 CB SER A 219 19.379 23.876 22.448 1.00 5.00 +ATOM 426 CA ILE A 220 19.092 19.955 24.778 1.00 5.00 +ATOM 427 CB ILE A 220 18.584 18.950 23.672 1.00 5.00 +ATOM 428 CA SER A 221 20.074 18.361 28.032 1.00 5.00 +ATOM 429 CB SER A 221 19.358 18.678 29.035 1.00 5.00 +ATOM 430 CA PRO A 222 21.512 14.965 27.535 1.00 5.00 +ATOM 431 CB PRO A 222 22.770 15.416 28.014 1.00 5.00 +ATOM 432 CA ILE A 223 19.149 12.009 28.785 1.00 5.00 +ATOM 433 CB ILE A 223 17.749 11.543 27.566 1.00 5.00 +ATOM 434 CA ASP A 224 20.858 10.700 32.133 1.00 5.00 +ATOM 435 CB ASP A 224 20.625 11.633 33.764 1.00 5.00 +ATOM 436 CA TRP A 225 21.614 6.932 31.094 1.00 5.00 +ATOM 437 CB TRP A 225 21.374 8.065 27.918 1.00 5.00 +ATOM 438 CA SER A 226 21.424 5.775 34.742 1.00 5.00 +ATOM 439 CB SER A 226 21.783 7.014 35.143 1.00 5.00 +ATOM 440 CA VAL A 227 19.288 2.959 36.205 1.00 5.00 +ATOM 441 CB VAL A 227 18.047 2.695 35.619 1.00 5.00 TER TER -ATOM 442 CA THR C 1 39.974 -3.119 33.032 1.00 5.00 -ATOM 443 CB THR C 1 39.940 -2.319 34.311 1.00 5.00 -ATOM 444 CA ASN C 2 38.745 -1.524 29.984 1.00 5.00 -ATOM 445 CB ASN C 2 38.143 -2.601 28.420 1.00 5.00 -ATOM 446 CA LEU C 3 39.110 1.514 32.192 1.00 5.00 -ATOM 447 CB LEU C 3 37.437 1.874 33.499 1.00 5.00 -ATOM 448 CA SER C 4 42.912 1.391 32.654 1.00 5.00 -ATOM 449 CB SER C 4 43.674 0.457 33.114 1.00 5.00 -ATOM 450 CA ASP C 5 43.139 2.156 28.966 1.00 5.00 -ATOM 451 CB ASP C 5 41.924 1.459 27.530 1.00 5.00 -ATOM 452 CA ILE C 6 40.206 4.707 29.227 1.00 5.00 -ATOM 453 CB ILE C 6 38.374 5.340 29.297 1.00 5.00 -ATOM 454 CA ILE C 7 42.539 6.660 31.735 1.00 5.00 -ATOM 455 CB ILE C 7 42.667 6.428 33.655 1.00 5.00 -ATOM 456 CA GLU C 8 45.550 6.016 29.102 1.00 5.00 -ATOM 457 CB GLU C 8 46.897 4.146 29.698 1.00 5.00 -ATOM 458 CA LYS C 9 43.426 7.850 26.588 1.00 5.00 -ATOM 459 CB LYS C 9 40.474 8.569 26.418 1.00 5.00 -ATOM 460 CA GLU C 10 42.535 10.826 28.552 1.00 5.00 -ATOM 461 CB GLU C 10 40.887 10.754 29.861 1.00 5.00 -ATOM 462 CA THR C 11 45.976 11.196 29.743 1.00 5.00 -ATOM 463 CB THR C 11 46.015 10.848 31.102 1.00 5.00 -ATOM 464 CA GLY C 12 48.929 9.960 27.679 1.00 5.00 -ATOM 465 CA LYS C 13 49.798 7.816 30.633 1.00 5.00 -ATOM 466 CB LYS C 13 50.933 9.829 32.444 1.00 5.00 -ATOM 467 CA GLN C 14 50.522 4.024 31.847 1.00 5.00 -ATOM 468 CB GLN C 14 52.348 5.543 32.237 1.00 5.00 -ATOM 469 CA LEU C 15 48.304 3.852 34.861 1.00 5.00 -ATOM 470 CB LEU C 15 47.316 5.499 34.297 1.00 5.00 -ATOM 471 CA VAL C 16 48.108 1.076 37.680 1.00 5.00 -ATOM 472 CB VAL C 16 49.120 0.109 38.178 1.00 5.00 -ATOM 473 CA ILE C 17 44.494 1.419 39.276 1.00 5.00 -ATOM 474 CB ILE C 17 43.102 1.707 38.062 1.00 5.00 -ATOM 475 CA GLN C 18 45.344 0.971 43.042 1.00 5.00 -ATOM 476 CB GLN C 18 46.237 3.594 43.505 1.00 5.00 -ATOM 477 CA GLU C 19 41.884 0.215 44.527 1.00 5.00 -ATOM 478 CB GLU C 19 41.013 0.918 46.708 1.00 5.00 -ATOM 479 CA SER C 20 38.375 -0.308 43.209 1.00 5.00 -ATOM 480 CB SER C 20 38.122 -1.481 42.786 1.00 5.00 -ATOM 481 CA ILE C 21 36.746 1.861 45.672 1.00 5.00 -ATOM 482 CB ILE C 21 37.468 3.171 46.369 1.00 5.00 -ATOM 483 CA LEU C 22 32.934 1.386 46.157 1.00 5.00 -ATOM 484 CB LEU C 22 31.044 0.525 46.304 1.00 5.00 -ATOM 485 CA MET C 23 31.214 4.931 46.604 1.00 5.00 -ATOM 486 CB MET C 23 33.360 6.205 47.293 1.00 5.00 -ATOM 487 CA LEU C 24 27.406 5.764 46.824 1.00 5.00 -ATOM 488 CB LEU C 24 26.122 5.495 48.403 1.00 5.00 -ATOM 489 CA PRO C 25 25.852 8.615 44.622 1.00 5.00 -ATOM 490 CB PRO C 25 25.049 7.791 43.862 1.00 5.00 -ATOM 491 CA GLU C 26 25.433 10.602 47.819 1.00 5.00 -ATOM 492 CB GLU C 26 23.384 9.903 48.889 1.00 5.00 -ATOM 493 CA GLU C 27 29.252 10.109 48.789 1.00 5.00 -ATOM 494 CB GLU C 27 31.712 10.186 48.980 1.00 5.00 -ATOM 495 CA VAL C 28 30.387 11.580 45.579 1.00 5.00 -ATOM 496 CB VAL C 28 30.776 10.459 44.661 1.00 5.00 -ATOM 497 CA GLU C 29 27.925 14.392 45.056 1.00 5.00 -ATOM 498 CB GLU C 29 26.171 15.068 46.233 1.00 5.00 -ATOM 499 CA GLU C 30 30.124 16.528 47.564 1.00 5.00 -ATOM 500 CB GLU C 30 31.498 17.096 49.424 1.00 5.00 -ATOM 501 CA VAL C 31 33.246 15.443 45.734 1.00 5.00 -ATOM 502 CB VAL C 31 33.869 14.112 45.706 1.00 5.00 -ATOM 503 CA ILE C 32 32.304 15.420 41.963 1.00 5.00 -ATOM 504 CB ILE C 32 31.665 13.793 41.219 1.00 5.00 -ATOM 505 CA GLY C 33 29.600 18.002 41.281 1.00 5.00 -ATOM 506 CA ASN C 34 26.532 16.096 39.625 1.00 5.00 -ATOM 507 CB ASN C 34 26.070 17.589 38.439 1.00 5.00 -ATOM 508 CA LYS C 35 24.632 13.093 40.082 1.00 5.00 -ATOM 509 CB LYS C 35 22.275 14.292 40.752 1.00 5.00 -ATOM 510 CA PRO C 36 25.704 9.607 38.351 1.00 5.00 -ATOM 511 CB PRO C 36 26.860 9.584 39.242 1.00 5.00 -ATOM 512 CA GLU C 37 22.346 8.170 39.126 1.00 5.00 -ATOM 513 CB GLU C 37 20.922 6.715 39.566 1.00 5.00 -ATOM 514 CA SER C 38 24.251 5.097 40.532 1.00 5.00 -ATOM 515 CB SER C 38 25.419 5.286 39.885 1.00 5.00 -ATOM 516 CA ASP C 39 26.317 3.435 43.501 1.00 5.00 -ATOM 517 CB ASP C 39 26.228 2.549 45.288 1.00 5.00 -ATOM 518 CA ILE C 40 30.057 4.245 42.274 1.00 5.00 -ATOM 519 CB ILE C 40 30.113 5.571 40.938 1.00 5.00 -ATOM 520 CA LEU C 41 33.536 2.525 42.054 1.00 5.00 -ATOM 521 CB LEU C 41 33.906 0.541 41.670 1.00 5.00 -ATOM 522 CA VAL C 42 36.320 5.090 42.367 1.00 5.00 -ATOM 523 CB VAL C 42 36.508 6.367 43.098 1.00 5.00 -ATOM 524 CA HIS C 43 39.123 3.274 40.356 1.00 5.00 -ATOM 525 CB HIS C 43 37.299 1.682 39.053 1.00 5.00 -ATOM 526 CA THR C 44 42.137 5.428 41.771 1.00 5.00 -ATOM 527 CB THR C 44 41.395 5.747 43.030 1.00 5.00 -ATOM 528 CA ALA C 45 45.555 5.628 39.877 1.00 5.00 -ATOM 529 CB ALA C 45 45.692 5.645 39.065 1.00 5.00 -ATOM 530 CA TYR C 46 48.266 6.744 42.209 1.00 5.00 -ATOM 531 CB TYR C 46 50.274 8.304 44.501 1.00 5.00 -ATOM 532 CA ASP C 47 50.769 8.056 39.529 1.00 5.00 -ATOM 533 CB ASP C 47 51.486 8.037 37.684 1.00 5.00 -ATOM 534 CA GLU C 48 53.948 9.431 41.525 1.00 5.00 -ATOM 535 CB GLU C 48 54.483 9.068 43.810 1.00 5.00 -ATOM 536 CA SER C 49 55.844 10.903 38.631 1.00 5.00 -ATOM 537 CB SER C 49 54.939 10.357 37.934 1.00 5.00 -ATOM 538 CA THR C 50 53.813 13.983 39.498 1.00 5.00 -ATOM 539 CB THR C 50 53.154 15.001 38.658 1.00 5.00 -ATOM 540 CA ASP C 51 51.849 13.152 42.690 1.00 5.00 -ATOM 541 CB ASP C 51 51.425 13.156 44.703 1.00 5.00 -ATOM 542 CA GLU C 52 48.492 12.670 40.796 1.00 5.00 -ATOM 543 CB GLU C 52 47.654 13.522 38.617 1.00 5.00 -ATOM 544 CA ASN C 53 45.318 10.986 42.262 1.00 5.00 -ATOM 545 CB ASN C 53 44.769 12.590 43.241 1.00 5.00 -ATOM 546 CA VAL C 54 43.661 9.862 39.093 1.00 5.00 -ATOM 547 CB VAL C 54 43.773 10.023 37.560 1.00 5.00 -ATOM 548 CA MET C 55 40.143 8.968 39.937 1.00 5.00 -ATOM 549 CB MET C 55 40.155 10.000 42.161 1.00 5.00 -ATOM 550 CA LEU C 56 38.504 7.156 37.099 1.00 5.00 -ATOM 551 CB LEU C 56 38.396 6.673 35.249 1.00 5.00 -ATOM 552 CA LEU C 57 35.030 7.220 38.805 1.00 5.00 -ATOM 553 CB LEU C 57 34.507 8.591 39.887 1.00 5.00 -ATOM 554 CA THR C 58 32.527 4.345 37.347 1.00 5.00 -ATOM 555 CB THR C 58 32.744 2.912 37.163 1.00 5.00 -ATOM 556 CA SER C 59 29.106 2.565 37.888 1.00 5.00 -ATOM 557 CB SER C 59 27.998 3.260 37.615 1.00 5.00 -ATOM 558 CA ASP C 60 29.871 -0.903 39.330 1.00 5.00 -ATOM 559 CB ASP C 60 30.112 -0.383 41.229 1.00 5.00 -ATOM 560 CA ALA C 61 30.791 -4.338 38.069 1.00 5.00 -ATOM 561 CB ALA C 61 31.277 -4.845 38.295 1.00 5.00 -ATOM 562 CA PRO C 62 28.957 -5.678 35.460 1.00 5.00 -ATOM 563 CB PRO C 62 28.135 -6.458 36.276 1.00 5.00 -ATOM 564 CA GLU C 63 28.271 -2.487 33.739 1.00 5.00 -ATOM 565 CB GLU C 63 27.722 -0.237 33.028 1.00 5.00 -ATOM 566 CA TYR C 64 31.678 -0.915 34.387 1.00 5.00 -ATOM 567 CB TYR C 64 33.595 -3.288 32.961 1.00 5.00 -ATOM 568 CA LYS C 65 30.706 2.353 32.866 1.00 5.00 -ATOM 569 CB LYS C 65 28.415 4.335 32.537 1.00 5.00 -ATOM 570 CA PRO C 66 33.002 5.507 32.603 1.00 5.00 -ATOM 571 CB PRO C 66 32.731 4.961 31.319 1.00 5.00 -ATOM 572 CA TRP C 67 31.392 8.535 34.029 1.00 5.00 -ATOM 573 CB TRP C 67 29.045 10.058 31.842 1.00 5.00 -ATOM 574 CA ALA C 68 33.736 10.531 35.737 1.00 5.00 -ATOM 575 CB ALA C 68 33.167 10.739 36.281 1.00 5.00 -ATOM 576 CA LEU C 69 37.510 11.396 35.495 1.00 5.00 -ATOM 577 CB LEU C 69 39.325 11.365 34.646 1.00 5.00 -ATOM 578 CA VAL C 70 38.517 12.927 38.840 1.00 5.00 -ATOM 579 CB VAL C 70 37.642 12.755 40.016 1.00 5.00 -ATOM 580 CA ILE C 71 42.303 13.850 38.194 1.00 5.00 -ATOM 581 CB ILE C 71 42.562 14.325 36.437 1.00 5.00 -ATOM 582 CA GLN C 72 43.369 15.287 41.459 1.00 5.00 -ATOM 583 CB GLN C 72 41.269 14.590 43.076 1.00 5.00 -ATOM 584 CA ASP C 73 47.027 16.379 41.908 1.00 5.00 -ATOM 585 CB ASP C 73 48.319 17.651 40.918 1.00 5.00 -ATOM 586 CA SER C 74 49.528 17.293 44.619 1.00 5.00 -ATOM 587 CB SER C 74 50.345 18.261 44.092 1.00 5.00 -ATOM 588 CA ASN C 75 48.099 21.066 45.076 1.00 5.00 -ATOM 589 CB ASN C 75 48.261 22.620 43.915 1.00 5.00 -ATOM 590 CA GLY C 76 44.535 19.945 45.810 1.00 5.00 -ATOM 591 CA GLU C 77 43.407 20.772 42.292 1.00 5.00 -ATOM 592 CB GLU C 77 44.763 22.590 41.720 1.00 5.00 -ATOM 593 CA ASN C 78 40.244 18.853 41.056 1.00 5.00 -ATOM 594 CB ASN C 78 38.770 18.099 42.103 1.00 5.00 -ATOM 595 CA LYS C 79 40.526 19.078 37.138 1.00 5.00 -ATOM 596 CB LYS C 79 43.102 18.854 36.496 1.00 5.00 -ATOM 597 CA ILE C 80 37.728 17.088 35.805 1.00 5.00 -ATOM 598 CB ILE C 80 36.198 17.124 37.097 1.00 5.00 -ATOM 599 CA LYS C 81 36.290 15.188 32.654 1.00 5.00 -ATOM 600 CB LYS C 81 36.929 16.004 30.029 1.00 5.00 -ATOM 601 CA MET C 82 32.715 14.178 32.755 1.00 5.00 -ATOM 602 CB MET C 82 31.904 14.805 35.039 1.00 5.00 -ATOM 603 CA LEU C 83 32.915 11.180 30.274 1.00 5.00 -ATOM 604 CB LEU C 83 34.521 10.245 31.391 1.00 5.00 +ATOM 442 CA THR C 1 45.280 -3.009 18.090 1.00 5.00 +ATOM 443 CB THR C 1 44.352 -2.363 19.152 1.00 5.00 +ATOM 444 CA ASN C 2 46.772 -1.030 15.138 1.00 5.00 +ATOM 445 CB ASN C 2 45.844 -1.297 13.455 1.00 5.00 +ATOM 446 CA LEU C 3 44.846 1.958 16.497 1.00 5.00 +ATOM 447 CB LEU C 3 43.197 1.623 15.756 1.00 5.00 +ATOM 448 CA SER C 4 46.634 2.010 19.731 1.00 5.00 +ATOM 449 CB SER C 4 46.661 1.918 21.026 1.00 5.00 +ATOM 450 CA ASP C 5 49.769 2.013 17.576 1.00 5.00 +ATOM 451 CB ASP C 5 49.371 0.149 16.755 1.00 5.00 +ATOM 452 CA ILE C 6 48.435 4.964 15.770 1.00 5.00 +ATOM 453 CB ILE C 6 47.184 5.123 14.759 1.00 5.00 +ATOM 454 CA ILE C 7 47.910 7.133 18.778 1.00 5.00 +ATOM 455 CB ILE C 7 46.553 6.228 19.691 1.00 5.00 +ATOM 456 CA GLU C 8 51.630 6.086 19.595 1.00 5.00 +ATOM 457 CB GLU C 8 50.436 4.660 21.247 1.00 5.00 +ATOM 458 CA LYS C 9 53.244 6.929 16.484 1.00 5.00 +ATOM 459 CB LYS C 9 52.002 6.873 13.751 1.00 5.00 +ATOM 460 CA GLU C 10 50.812 9.844 15.743 1.00 5.00 +ATOM 461 CB GLU C 10 48.763 9.406 14.488 1.00 5.00 +ATOM 462 CA THR C 11 51.506 11.947 18.946 1.00 5.00 +ATOM 463 CB THR C 11 50.352 11.228 19.568 1.00 5.00 +ATOM 464 CA GLY C 12 54.138 9.951 20.975 1.00 5.00 +ATOM 465 CA LYS C 13 51.777 8.502 23.413 1.00 5.00 +ATOM 466 CB LYS C 13 51.469 11.444 23.750 1.00 5.00 +ATOM 467 CA GLN C 14 50.044 5.262 24.584 1.00 5.00 +ATOM 468 CB GLN C 14 50.886 4.721 26.802 1.00 5.00 +ATOM 469 CA LEU C 15 46.323 6.125 24.804 1.00 5.00 +ATOM 470 CB LEU C 15 46.535 8.154 24.174 1.00 5.00 +ATOM 471 CA VAL C 16 43.517 4.168 25.933 1.00 5.00 +ATOM 472 CB VAL C 16 43.359 3.921 27.373 1.00 5.00 +ATOM 473 CA ILE C 17 40.201 4.185 23.573 1.00 5.00 +ATOM 474 CB ILE C 17 40.176 2.772 22.329 1.00 5.00 +ATOM 475 CA GLN C 18 37.533 4.281 26.288 1.00 5.00 +ATOM 476 CB GLN C 18 39.094 4.143 28.714 1.00 5.00 +ATOM 477 CA GLU C 19 34.435 4.523 23.904 1.00 5.00 +ATOM 478 CB GLU C 19 35.047 5.602 21.726 1.00 5.00 +ATOM 479 CA SER C 20 33.706 3.666 20.610 1.00 5.00 +ATOM 480 CB SER C 20 33.770 2.410 20.149 1.00 5.00 +ATOM 481 CA ILE C 21 31.177 6.120 19.377 1.00 5.00 +ATOM 482 CB ILE C 21 31.118 7.530 20.624 1.00 5.00 +ATOM 483 CA LEU C 22 29.263 5.731 16.092 1.00 5.00 +ATOM 484 CB LEU C 22 28.456 4.541 14.753 1.00 5.00 +ATOM 485 CA MET C 23 28.767 8.895 13.749 1.00 5.00 +ATOM 486 CB MET C 23 29.514 10.676 14.753 1.00 5.00 +ATOM 487 CA LEU C 24 26.903 8.773 10.444 1.00 5.00 +ATOM 488 CB LEU C 24 24.972 9.862 10.448 1.00 5.00 +ATOM 489 CA PRO C 25 29.010 11.131 8.149 1.00 5.00 +ATOM 490 CB PRO C 25 29.142 9.822 7.669 1.00 5.00 +ATOM 491 CA GLU C 26 26.278 13.809 8.197 1.00 5.00 +ATOM 492 CB GLU C 26 24.823 12.489 6.864 1.00 5.00 +ATOM 493 CA GLU C 27 26.744 14.716 11.745 1.00 5.00 +ATOM 494 CB GLU C 27 26.521 13.160 13.119 1.00 5.00 +ATOM 495 CA VAL C 28 30.588 14.176 11.413 1.00 5.00 +ATOM 496 CB VAL C 28 31.634 13.087 11.364 1.00 5.00 +ATOM 497 CA GLU C 29 30.521 16.387 8.398 1.00 5.00 +ATOM 498 CB GLU C 29 31.195 16.833 6.107 1.00 5.00 +ATOM 499 CA GLU C 30 29.240 19.113 10.698 1.00 5.00 +ATOM 500 CB GLU C 30 28.404 20.589 12.477 1.00 5.00 +ATOM 501 CA VAL C 31 32.568 19.255 12.763 1.00 5.00 +ATOM 502 CB VAL C 31 32.547 18.101 13.687 1.00 5.00 +ATOM 503 CA ILE C 32 35.384 18.254 10.160 1.00 5.00 +ATOM 504 CB ILE C 32 35.863 16.391 9.752 1.00 5.00 +ATOM 505 CA GLY C 33 35.404 19.658 6.520 1.00 5.00 +ATOM 506 CA ASN C 34 34.963 16.253 4.625 1.00 5.00 +ATOM 507 CB ASN C 34 35.819 15.766 2.807 1.00 5.00 +ATOM 508 CA LYS C 35 32.194 13.682 4.320 1.00 5.00 +ATOM 509 CB LYS C 35 29.900 13.366 2.307 1.00 5.00 +ATOM 510 CA PRO C 36 33.819 10.508 4.643 1.00 5.00 +ATOM 511 CB PRO C 36 33.929 10.641 6.067 1.00 5.00 +ATOM 512 CA GLU C 37 31.345 8.758 2.394 1.00 5.00 +ATOM 513 CB GLU C 37 30.313 7.070 1.119 1.00 5.00 +ATOM 514 CA SER C 38 30.491 6.110 5.194 1.00 5.00 +ATOM 515 CB SER C 38 31.778 5.909 5.471 1.00 5.00 +ATOM 516 CA ASP C 39 29.032 5.490 8.737 1.00 5.00 +ATOM 517 CB ASP C 39 27.407 4.344 8.339 1.00 5.00 +ATOM 518 CA ILE C 40 32.174 6.224 10.945 1.00 5.00 +ATOM 519 CB ILE C 40 33.291 7.246 10.548 1.00 5.00 +ATOM 520 CA LEU C 41 33.427 5.108 14.170 1.00 5.00 +ATOM 521 CB LEU C 41 33.206 3.166 14.888 1.00 5.00 +ATOM 522 CA VAL C 42 35.156 7.537 16.714 1.00 5.00 +ATOM 523 CB VAL C 42 34.489 8.866 16.949 1.00 5.00 +ATOM 524 CA HIS C 43 37.796 6.184 19.148 1.00 5.00 +ATOM 525 CB HIS C 43 38.169 3.544 18.142 1.00 5.00 +ATOM 526 CA THR C 44 38.104 8.688 22.009 1.00 5.00 +ATOM 527 CB THR C 44 36.772 9.223 22.421 1.00 5.00 +ATOM 528 CA ALA C 45 41.378 8.655 24.007 1.00 5.00 +ATOM 529 CB ALA C 45 41.992 8.263 23.648 1.00 5.00 +ATOM 530 CA TYR C 46 41.208 11.280 26.626 1.00 5.00 +ATOM 531 CB TYR C 46 38.109 10.316 26.481 1.00 5.00 +ATOM 532 CA ASP C 47 44.745 12.255 27.677 1.00 5.00 +ATOM 533 CB ASP C 47 46.461 12.129 26.433 1.00 5.00 +ATOM 534 CA GLU C 48 44.391 14.412 30.874 1.00 5.00 +ATOM 535 CB GLU C 48 43.384 14.038 33.104 1.00 5.00 +ATOM 536 CA SER C 49 48.096 14.654 31.651 1.00 5.00 +ATOM 537 CB SER C 49 48.684 13.919 30.763 1.00 5.00 +ATOM 538 CA THR C 50 48.578 16.417 28.198 1.00 5.00 +ATOM 539 CB THR C 50 48.780 15.770 26.889 1.00 5.00 +ATOM 540 CA ASP C 51 45.056 18.051 28.414 1.00 5.00 +ATOM 541 CB ASP C 51 43.764 19.171 29.479 1.00 5.00 +ATOM 542 CA GLU C 52 43.642 16.572 25.090 1.00 5.00 +ATOM 543 CB GLU C 52 44.614 15.131 23.425 1.00 5.00 +ATOM 544 CA ASN C 53 40.683 14.525 23.846 1.00 5.00 +ATOM 545 CB ASN C 53 39.248 14.944 25.137 1.00 5.00 +ATOM 546 CA VAL C 54 42.196 11.997 21.011 1.00 5.00 +ATOM 547 CB VAL C 54 43.593 11.527 20.516 1.00 5.00 +ATOM 548 CA MET C 55 39.347 11.365 18.811 1.00 5.00 +ATOM 549 CB MET C 55 37.361 12.601 18.087 1.00 5.00 +ATOM 550 CA LEU C 56 40.339 8.477 16.253 1.00 5.00 +ATOM 551 CB LEU C 56 41.476 7.041 17.201 1.00 5.00 +ATOM 552 CA LEU C 57 37.634 8.403 13.610 1.00 5.00 +ATOM 553 CB LEU C 57 37.156 10.399 13.139 1.00 5.00 +ATOM 554 CA THR C 58 37.264 4.958 12.066 1.00 5.00 +ATOM 555 CB THR C 58 37.449 3.909 13.052 1.00 5.00 +ATOM 556 CA SER C 59 35.425 3.584 9.277 1.00 5.00 +ATOM 557 CB SER C 59 36.211 3.870 8.222 1.00 5.00 +ATOM 558 CA ASP C 60 33.230 0.543 10.173 1.00 5.00 +ATOM 559 CB ASP C 60 31.466 -0.397 9.655 1.00 5.00 +ATOM 560 CA ALA C 61 32.808 -2.335 12.525 1.00 5.00 +ATOM 561 CB ALA C 61 32.276 -2.806 12.651 1.00 5.00 +ATOM 562 CA PRO C 62 35.459 -4.950 11.878 1.00 5.00 +ATOM 563 CB PRO C 62 34.291 -5.718 11.719 1.00 5.00 +ATOM 564 CA GLU C 63 36.774 -3.233 8.833 1.00 5.00 +ATOM 565 CB GLU C 63 35.635 -3.875 6.710 1.00 5.00 +ATOM 566 CA TYR C 64 38.392 -0.600 11.384 1.00 5.00 +ATOM 567 CB TYR C 64 36.750 -1.459 14.164 1.00 5.00 +ATOM 568 CA LYS C 65 40.590 1.737 9.394 1.00 5.00 +ATOM 569 CB LYS C 65 40.154 2.968 7.314 1.00 5.00 +ATOM 570 CA PRO C 66 42.124 5.030 10.165 1.00 5.00 +ATOM 571 CB PRO C 66 43.299 4.381 9.586 1.00 5.00 +ATOM 572 CA TRP C 67 40.746 7.443 7.897 1.00 5.00 +ATOM 573 CB TRP C 67 41.721 9.520 4.918 1.00 5.00 +ATOM 574 CA ALA C 68 40.683 10.220 10.666 1.00 5.00 +ATOM 575 CB ALA C 68 39.990 10.254 10.276 1.00 5.00 +ATOM 576 CA LEU C 69 42.565 11.833 13.487 1.00 5.00 +ATOM 577 CB LEU C 69 43.957 10.769 14.776 1.00 5.00 +ATOM 578 CA VAL C 70 40.971 14.601 15.631 1.00 5.00 +ATOM 579 CB VAL C 70 39.650 15.208 15.319 1.00 5.00 +ATOM 580 CA ILE C 71 43.449 15.827 18.535 1.00 5.00 +ATOM 581 CB ILE C 71 45.248 15.729 18.013 1.00 5.00 +ATOM 582 CA GLN C 72 41.037 17.738 20.822 1.00 5.00 +ATOM 583 CB GLN C 72 39.145 17.870 22.811 1.00 5.00 +ATOM 584 CA ASP C 73 42.019 20.214 23.458 1.00 5.00 +ATOM 585 CB ASP C 73 43.252 20.749 21.890 1.00 5.00 +ATOM 586 CA SER C 74 40.521 21.897 26.725 1.00 5.00 +ATOM 587 CB SER C 74 40.558 21.616 28.062 1.00 5.00 +ATOM 588 CA ASN C 75 39.374 25.345 25.527 1.00 5.00 +ATOM 589 CB ASN C 75 40.907 25.155 24.260 1.00 5.00 +ATOM 590 CA GLY C 76 37.279 23.556 22.937 1.00 5.00 +ATOM 591 CA GLU C 77 39.657 23.594 20.036 1.00 5.00 +ATOM 592 CB GLU C 77 40.096 25.043 18.059 1.00 5.00 +ATOM 593 CA ASN C 78 40.427 20.888 17.560 1.00 5.00 +ATOM 594 CB ASN C 78 40.043 20.888 15.557 1.00 5.00 +ATOM 595 CA LYS C 79 43.613 19.819 15.669 1.00 5.00 +ATOM 596 CB LYS C 79 46.461 20.827 15.165 1.00 5.00 +ATOM 597 CA ILE C 80 42.246 17.315 12.928 1.00 5.00 +ATOM 598 CB ILE C 80 41.104 18.431 11.801 1.00 5.00 +ATOM 599 CA LYS C 81 44.934 15.167 11.157 1.00 5.00 +ATOM 600 CB LYS C 81 47.313 13.985 11.916 1.00 5.00 +ATOM 601 CA MET C 82 43.541 13.474 8.119 1.00 5.00 +ATOM 602 CB MET C 82 41.434 13.632 7.516 1.00 5.00 +ATOM 603 CA LEU C 83 45.221 10.115 7.150 1.00 5.00 +ATOM 604 CB LEU C 83 45.446 9.642 9.188 1.00 5.00 TER CONECT 1 3 2 CONECT 3 5 4