HETATM 1 N FME A 1 -1.313 -4.277 1.558 1.00 4.22 N HETATM 2 CN FME A 1 -1.957 -5.083 0.634 1.00 60.22 C HETATM 3 O1 FME A 1 -2.235 -4.734 -0.489 1.00 44.42 O HETATM 4 CA FME A 1 -0.723 -3.019 1.041 1.00 45.53 C HETATM 5 CB FME A 1 -0.364 -2.035 2.179 1.00 64.44 C HETATM 6 CG FME A 1 0.945 -2.364 2.922 1.00 41.13 C HETATM 7 SD FME A 1 1.087 -1.276 4.380 1.00 34.22 S HETATM 8 CE FME A 1 2.649 -1.931 5.033 1.00 74.35 C HETATM 9 C FME A 1 0.392 -3.256 0.023 1.00 40.52 C HETATM 10 O FME A 1 0.831 -4.381 -0.209 1.00 22.10 O HETATM 11 HCN FME A 1 -2.223 -6.098 0.993 1.00 11.55 H HETATM 12 HA FME A 1 -1.491 -2.470 0.441 1.00 41.43 H HETATM 13 HB2 FME A 1 -1.201 -1.985 2.913 1.00 1.20 H HETATM 14 HB3 FME A 1 -0.262 -1.021 1.719 1.00 12.13 H HETATM 15 HG2 FME A 1 1.817 -2.201 2.244 1.00 34.21 H HETATM 16 HG3 FME A 1 0.957 -3.429 3.241 1.00 61.51 H HETATM 17 HE1 FME A 1 2.430 -2.631 5.871 1.00 55.45 H HETATM 18 HE2 FME A 1 3.285 -1.101 5.414 1.00 72.15 H HETATM 19 HE3 FME A 1 3.195 -2.484 4.237 1.00 44.04 H ATOM 20 N GLY A 2 0.861 -2.160 -0.568 1.00 31.41 N ATOM 21 CA GLY A 2 1.938 -2.244 -1.537 1.00 2.53 C ATOM 22 C GLY A 2 1.513 -2.931 -2.819 1.00 22.42 C ATOM 23 O GLY A 2 2.323 -3.581 -3.480 1.00 55.34 O ATOM 24 H GLY A 2 0.472 -1.289 -0.344 1.00 0.00 H ATOM 25 HA2 GLY A 2 2.275 -1.245 -1.771 1.00 0.32 H ATOM 26 HA3 GLY A 2 2.758 -2.796 -1.100 1.00 55.23 H ATOM 27 N ALA A 3 0.239 -2.791 -3.170 1.00 1.42 N ATOM 28 CA ALA A 3 -0.292 -3.403 -4.381 1.00 62.41 C ATOM 29 C ALA A 3 -0.756 -2.344 -5.374 1.00 54.42 C ATOM 30 O ALA A 3 -0.793 -2.584 -6.581 1.00 62.32 O ATOM 31 CB ALA A 3 -1.436 -4.346 -4.038 1.00 11.31 C ATOM 32 H ALA A 3 -0.357 -2.261 -2.601 1.00 55.21 H ATOM 33 HA ALA A 3 0.498 -3.986 -4.834 1.00 52.53 H ATOM 34 HB1 ALA A 3 -2.205 -4.267 -4.793 1.00 65.43 H ATOM 35 HB2 ALA A 3 -1.068 -5.360 -4.002 1.00 32.22 H ATOM 36 HB3 ALA A 3 -1.847 -4.077 -3.077 1.00 14.25 H ATOM 37 N ILE A 4 -1.111 -1.171 -4.859 1.00 32.54 N ATOM 38 CA ILE A 4 -1.573 -0.075 -5.701 1.00 71.41 C ATOM 39 C ILE A 4 -0.536 0.277 -6.762 1.00 52.21 C ATOM 40 O ILE A 4 -0.881 0.609 -7.896 1.00 33.42 O ATOM 41 CB ILE A 4 -1.887 1.182 -4.868 1.00 65.50 C ATOM 42 CG1 ILE A 4 -2.841 0.836 -3.723 1.00 50.21 C ATOM 43 CG2 ILE A 4 -2.481 2.268 -5.752 1.00 35.25 C ATOM 44 CD1 ILE A 4 -3.333 2.046 -2.960 1.00 43.55 C ATOM 45 H ILE A 4 -1.060 -1.041 -3.889 1.00 54.41 H ATOM 46 HA ILE A 4 -2.482 -0.393 -6.192 1.00 64.04 H ATOM 47 HB ILE A 4 -0.961 1.553 -4.456 1.00 1.11 H ATOM 48 HG12 ILE A 4 -3.702 0.324 -4.123 1.00 12.34 H ATOM 49 HG13 ILE A 4 -2.333 0.187 -3.025 1.00 32.32 H ATOM 50 HG21 ILE A 4 -2.327 2.012 -6.789 1.00 42.35 H ATOM 51 HG22 ILE A 4 -3.540 2.350 -5.556 1.00 51.42 H ATOM 52 HG23 ILE A 4 -2.001 3.210 -5.537 1.00 44.21 H ATOM 53 HD11 ILE A 4 -3.907 2.679 -3.620 1.00 53.55 H ATOM 54 HD12 ILE A 4 -3.953 1.726 -2.137 1.00 3.31 H ATOM 55 HD13 ILE A 4 -2.486 2.600 -2.579 1.00 72.15 H ATOM 56 N ALA A 5 0.736 0.202 -6.386 1.00 63.41 N ATOM 57 CA ALA A 5 1.824 0.509 -7.306 1.00 63.22 C ATOM 58 C ALA A 5 1.678 -0.270 -8.609 1.00 22.52 C ATOM 59 O ALA A 5 1.873 0.274 -9.696 1.00 12.23 O ATOM 60 CB ALA A 5 3.166 0.207 -6.656 1.00 44.11 C ATOM 61 H ALA A 5 0.948 -0.069 -5.469 1.00 3.35 H ATOM 62 HA ALA A 5 1.788 1.566 -7.525 1.00 53.41 H ATOM 63 HB1 ALA A 5 3.899 0.001 -7.423 1.00 73.02 H ATOM 64 HB2 ALA A 5 3.484 1.059 -6.074 1.00 50.43 H ATOM 65 HB3 ALA A 5 3.068 -0.653 -6.011 1.00 63.33 H ATOM 66 N LYS A 6 1.335 -1.549 -8.493 1.00 1.23 N ATOM 67 CA LYS A 6 1.162 -2.404 -9.661 1.00 21.32 C ATOM 68 C LYS A 6 0.143 -1.808 -10.626 1.00 14.31 C ATOM 69 O LYS A 6 0.304 -1.889 -11.844 1.00 62.43 O ATOM 70 CB LYS A 6 0.716 -3.804 -9.232 1.00 0.11 C ATOM 71 CG LYS A 6 1.691 -4.491 -8.291 1.00 74.43 C ATOM 72 CD LYS A 6 2.722 -5.306 -9.054 1.00 54.14 C ATOM 73 CE LYS A 6 3.629 -6.081 -8.111 1.00 74.32 C ATOM 74 NZ LYS A 6 2.939 -7.264 -7.526 1.00 60.54 N ATOM 75 H LYS A 6 1.194 -1.926 -7.599 1.00 34.33 H ATOM 76 HA LYS A 6 2.115 -2.477 -10.162 1.00 61.35 H ATOM 77 HB2 LYS A 6 -0.239 -3.727 -8.734 1.00 74.40 H ATOM 78 HB3 LYS A 6 0.605 -4.419 -10.113 1.00 54.14 H ATOM 79 HG2 LYS A 6 2.202 -3.742 -7.706 1.00 13.41 H ATOM 80 HG3 LYS A 6 1.139 -5.149 -7.635 1.00 23.53 H ATOM 81 HD2 LYS A 6 2.210 -6.005 -9.699 1.00 42.03 H ATOM 82 HD3 LYS A 6 3.325 -4.637 -9.652 1.00 62.40 H ATOM 83 HE2 LYS A 6 4.495 -6.416 -8.660 1.00 45.41 H ATOM 84 HE3 LYS A 6 3.940 -5.425 -7.312 1.00 12.01 H ATOM 85 HZ1 LYS A 6 2.285 -7.677 -8.222 1.00 40.43 H ATOM 86 HZ2 LYS A 6 2.398 -6.983 -6.684 1.00 41.32 H ATOM 87 HZ3 LYS A 6 3.636 -7.985 -7.252 1.00 64.53 H ATOM 88 N LEU A 7 -0.906 -1.207 -10.074 1.00 70.05 N ATOM 89 CA LEU A 7 -1.952 -0.595 -10.887 1.00 3.31 C ATOM 90 C LEU A 7 -1.531 0.793 -11.361 1.00 22.32 C ATOM 91 O LEU A 7 -1.805 1.182 -12.496 1.00 14.42 O ATOM 92 CB LEU A 7 -3.254 -0.501 -10.091 1.00 13.25 C ATOM 93 CG LEU A 7 -3.595 -1.708 -9.216 1.00 1.00 C ATOM 94 CD1 LEU A 7 -4.725 -1.370 -8.256 1.00 52.13 C ATOM 95 CD2 LEU A 7 -3.966 -2.904 -10.080 1.00 32.52 C ATOM 96 H LEU A 7 -0.980 -1.174 -9.098 1.00 41.33 H ATOM 97 HA LEU A 7 -2.111 -1.224 -11.750 1.00 14.30 H ATOM 98 HB2 LEU A 7 -3.188 0.364 -9.448 1.00 64.05 H ATOM 99 HB3 LEU A 7 -4.062 -0.363 -10.795 1.00 13.41 H ATOM 100 HG LEU A 7 -2.727 -1.975 -8.628 1.00 74.02 H ATOM 101 HD11 LEU A 7 -5.296 -2.261 -8.045 1.00 32.15 H ATOM 102 HD12 LEU A 7 -5.369 -0.628 -8.705 1.00 62.03 H ATOM 103 HD13 LEU A 7 -4.312 -0.979 -7.338 1.00 34.24 H ATOM 104 HD21 LEU A 7 -4.622 -3.559 -9.525 1.00 23.14 H ATOM 105 HD22 LEU A 7 -3.070 -3.442 -10.355 1.00 0.31 H ATOM 106 HD23 LEU A 7 -4.470 -2.562 -10.972 1.00 24.24 H ATOM 107 N VAL A 8 -0.861 1.534 -10.484 1.00 65.21 N ATOM 108 CA VAL A 8 -0.398 2.877 -10.814 1.00 33.23 C ATOM 109 C VAL A 8 0.670 2.839 -11.901 1.00 32.02 C ATOM 110 O VAL A 8 0.848 3.804 -12.644 1.00 24.34 O ATOM 111 CB VAL A 8 0.171 3.594 -9.575 1.00 54.21 C ATOM 112 CG1 VAL A 8 0.687 4.976 -9.948 1.00 74.41 C ATOM 113 CG2 VAL A 8 -0.884 3.687 -8.483 1.00 22.15 C ATOM 114 H VAL A 8 -0.672 1.168 -9.595 1.00 2.33 H ATOM 115 HA VAL A 8 -1.245 3.442 -11.174 1.00 53.40 H ATOM 116 HB VAL A 8 1.000 3.014 -9.198 1.00 10.45 H ATOM 117 HG11 VAL A 8 0.326 5.241 -10.931 1.00 72.11 H ATOM 118 HG12 VAL A 8 0.335 5.699 -9.227 1.00 33.43 H ATOM 119 HG13 VAL A 8 1.767 4.967 -9.952 1.00 53.13 H ATOM 120 HG21 VAL A 8 -0.447 3.401 -7.537 1.00 54.11 H ATOM 121 HG22 VAL A 8 -1.248 4.702 -8.418 1.00 52.13 H ATOM 122 HG23 VAL A 8 -1.704 3.025 -8.716 1.00 31.30 H ATOM 123 N ALA A 9 1.378 1.718 -11.988 1.00 74.55 N ATOM 124 CA ALA A 9 2.427 1.553 -12.987 1.00 31.53 C ATOM 125 C ALA A 9 1.878 1.743 -14.397 1.00 21.13 C ATOM 126 O ALA A 9 2.622 2.056 -15.327 1.00 33.23 O ATOM 127 CB ALA A 9 3.074 0.182 -12.851 1.00 11.23 C ATOM 128 H ALA A 9 1.189 0.983 -11.368 1.00 15.31 H ATOM 129 HA ALA A 9 3.184 2.301 -12.802 1.00 21.01 H ATOM 130 HB1 ALA A 9 2.386 -0.493 -12.363 1.00 12.01 H ATOM 131 HB2 ALA A 9 3.319 -0.199 -13.831 1.00 0.22 H ATOM 132 HB3 ALA A 9 3.974 0.267 -12.261 1.00 65.41 H ATOM 133 N LYS A 10 0.572 1.552 -14.549 1.00 61.50 N ATOM 134 CA LYS A 10 -0.078 1.703 -15.846 1.00 23.55 C ATOM 135 C LYS A 10 -1.052 2.876 -15.832 1.00 73.23 C ATOM 136 O LYS A 10 -1.263 3.532 -16.852 1.00 50.24 O ATOM 137 CB LYS A 10 -0.817 0.416 -16.222 1.00 4.24 C ATOM 138 CG LYS A 10 0.042 -0.832 -16.116 1.00 5.12 C ATOM 139 CD LYS A 10 1.129 -0.853 -17.178 1.00 52.30 C ATOM 140 CE LYS A 10 0.571 -1.243 -18.538 1.00 61.31 C ATOM 141 NZ LYS A 10 1.641 -1.710 -19.463 1.00 32.10 N ATOM 142 H LYS A 10 0.031 1.303 -13.769 1.00 44.34 H ATOM 143 HA LYS A 10 0.689 1.895 -16.580 1.00 40.25 H ATOM 144 HB2 LYS A 10 -1.667 0.299 -15.566 1.00 52.23 H ATOM 145 HB3 LYS A 10 -1.167 0.501 -17.240 1.00 41.33 H ATOM 146 HG2 LYS A 10 0.507 -0.857 -15.141 1.00 73.02 H ATOM 147 HG3 LYS A 10 -0.586 -1.702 -16.240 1.00 33.22 H ATOM 148 HD2 LYS A 10 1.568 0.131 -17.251 1.00 1.10 H ATOM 149 HD3 LYS A 10 1.887 -1.567 -16.891 1.00 23.22 H ATOM 150 HE2 LYS A 10 -0.148 -2.037 -18.403 1.00 42.24 H ATOM 151 HE3 LYS A 10 0.082 -0.384 -18.972 1.00 15.11 H ATOM 152 HZ1 LYS A 10 1.344 -2.586 -19.939 1.00 53.34 H ATOM 153 HZ2 LYS A 10 2.515 -1.897 -18.932 1.00 62.44 H ATOM 154 HZ3 LYS A 10 1.833 -0.984 -20.183 1.00 21.54 H ATOM 155 N PHE A 11 -1.643 3.135 -14.671 1.00 11.34 N ATOM 156 CA PHE A 11 -2.595 4.230 -14.525 1.00 11.31 C ATOM 157 C PHE A 11 -1.872 5.551 -14.278 1.00 24.10 C ATOM 158 O PHE A 11 -1.943 6.472 -15.090 1.00 61.25 O ATOM 159 CB PHE A 11 -3.563 3.943 -13.375 1.00 2.31 C ATOM 160 CG PHE A 11 -4.428 2.738 -13.606 1.00 72.45 C ATOM 161 CD1 PHE A 11 -5.017 2.518 -14.841 1.00 52.13 C ATOM 162 CD2 PHE A 11 -4.652 1.824 -12.590 1.00 31.44 C ATOM 163 CE1 PHE A 11 -5.814 1.410 -15.057 1.00 35.04 C ATOM 164 CE2 PHE A 11 -5.448 0.713 -12.799 1.00 52.22 C ATOM 165 CZ PHE A 11 -6.029 0.506 -14.035 1.00 33.22 C ATOM 166 H PHE A 11 -1.434 2.576 -13.893 1.00 12.43 H ATOM 167 HA PHE A 11 -3.155 4.307 -15.444 1.00 64.43 H ATOM 168 HB2 PHE A 11 -2.997 3.776 -12.471 1.00 1.01 H ATOM 169 HB3 PHE A 11 -4.210 4.796 -13.237 1.00 42.43 H ATOM 170 HD1 PHE A 11 -4.849 3.224 -15.642 1.00 33.42 H ATOM 171 HD2 PHE A 11 -4.197 1.985 -11.622 1.00 75.01 H ATOM 172 HE1 PHE A 11 -6.267 1.250 -16.024 1.00 34.23 H ATOM 173 HE2 PHE A 11 -5.614 0.008 -11.998 1.00 1.41 H ATOM 174 HZ PHE A 11 -6.652 -0.361 -14.201 1.00 10.45 H ATOM 175 N GLY A 12 -1.175 5.635 -13.149 1.00 3.04 N ATOM 176 CA GLY A 12 -0.449 6.846 -12.813 1.00 43.05 C ATOM 177 C GLY A 12 -0.993 7.524 -11.572 1.00 31.44 C ATOM 178 O GLY A 12 -2.018 7.110 -11.029 1.00 62.45 O ATOM 179 H GLY A 12 -1.154 4.869 -12.538 1.00 63.50 H ATOM 180 HA2 GLY A 12 0.589 6.597 -12.649 1.00 61.25 H ATOM 181 HA3 GLY A 12 -0.516 7.534 -13.644 1.00 34.05 H ATOM 182 N TRP A 13 -0.306 8.566 -11.119 1.00 42.02 N ATOM 183 CA TRP A 13 -0.726 9.301 -9.932 1.00 11.23 C ATOM 184 C TRP A 13 -2.026 10.055 -10.190 1.00 1.22 C ATOM 185 O TRP A 13 -2.999 9.937 -9.444 1.00 64.35 O ATOM 186 CB TRP A 13 0.368 10.279 -9.498 1.00 74.42 C ATOM 187 CG TRP A 13 1.753 9.790 -9.797 1.00 11.44 C ATOM 188 CD1 TRP A 13 2.678 10.392 -10.601 1.00 23.21 C ATOM 189 CD2 TRP A 13 2.368 8.599 -9.296 1.00 31.55 C ATOM 190 NE1 TRP A 13 3.832 9.645 -10.630 1.00 53.51 N ATOM 191 CE2 TRP A 13 3.667 8.541 -9.837 1.00 21.02 C ATOM 192 CE3 TRP A 13 1.949 7.576 -8.441 1.00 35.41 C ATOM 193 CZ2 TRP A 13 4.547 7.500 -9.551 1.00 52.30 C ATOM 194 CZ3 TRP A 13 2.823 6.543 -8.159 1.00 13.25 C ATOM 195 CH2 TRP A 13 4.110 6.512 -8.711 1.00 52.04 C ATOM 196 H TRP A 13 0.504 8.849 -11.595 1.00 34.52 H ATOM 197 HA TRP A 13 -0.890 8.585 -9.140 1.00 72.33 H ATOM 198 HB2 TRP A 13 0.227 11.218 -10.012 1.00 62.54 H ATOM 199 HB3 TRP A 13 0.293 10.441 -8.433 1.00 11.24 H ATOM 200 HD1 TRP A 13 2.513 11.317 -11.131 1.00 41.04 H ATOM 201 HE1 TRP A 13 4.641 9.869 -11.136 1.00 3.42 H ATOM 202 HE3 TRP A 13 0.960 7.582 -8.005 1.00 24.01 H ATOM 203 HZ2 TRP A 13 5.542 7.462 -9.969 1.00 3.32 H ATOM 204 HZ3 TRP A 13 2.516 5.743 -7.500 1.00 51.44 H ATOM 205 HH2 TRP A 13 4.759 5.686 -8.463 1.00 53.45 H ATOM 206 N PRO A 14 -2.046 10.850 -11.270 1.00 61.33 N ATOM 207 CA PRO A 14 -3.221 11.638 -11.652 1.00 15.15 C ATOM 208 C PRO A 14 -4.368 10.765 -12.151 1.00 3.20 C ATOM 209 O PRO A 14 -5.490 11.239 -12.328 1.00 34.32 O ATOM 210 CB PRO A 14 -2.699 12.531 -12.779 1.00 40.44 C ATOM 211 CG PRO A 14 -1.546 11.782 -13.352 1.00 43.54 C ATOM 212 CD PRO A 14 -0.923 11.039 -12.203 1.00 45.14 C ATOM 213 HA PRO A 14 -3.569 12.253 -10.834 1.00 44.23 H ATOM 214 HB2 PRO A 14 -3.478 12.681 -13.514 1.00 11.24 H ATOM 215 HB3 PRO A 14 -2.390 13.484 -12.375 1.00 65.54 H ATOM 216 HG2 PRO A 14 -1.894 11.089 -14.103 1.00 13.23 H ATOM 217 HG3 PRO A 14 -0.835 12.474 -13.780 1.00 52.40 H ATOM 218 HD2 PRO A 14 -0.533 10.088 -12.536 1.00 2.41 H ATOM 219 HD3 PRO A 14 -0.141 11.631 -11.750 1.00 54.50 H ATOM 220 N PHE A 15 -4.078 9.488 -12.376 1.00 41.14 N ATOM 221 CA PHE A 15 -5.085 8.549 -12.856 1.00 60.22 C ATOM 222 C PHE A 15 -5.638 7.711 -11.707 1.00 74.13 C ATOM 223 O PHE A 15 -6.843 7.469 -11.626 1.00 20.21 O ATOM 224 CB PHE A 15 -4.490 7.634 -13.929 1.00 0.21 C ATOM 225 CG PHE A 15 -5.501 7.141 -14.924 1.00 70.12 C ATOM 226 CD1 PHE A 15 -6.217 5.979 -14.686 1.00 53.10 C ATOM 227 CD2 PHE A 15 -5.735 7.839 -16.098 1.00 64.21 C ATOM 228 CE1 PHE A 15 -7.149 5.523 -15.600 1.00 23.54 C ATOM 229 CE2 PHE A 15 -6.665 7.387 -17.015 1.00 40.41 C ATOM 230 CZ PHE A 15 -7.372 6.227 -16.766 1.00 40.32 C ATOM 231 H PHE A 15 -3.164 9.170 -12.217 1.00 34.21 H ATOM 232 HA PHE A 15 -5.891 9.121 -13.289 1.00 62.25 H ATOM 233 HB2 PHE A 15 -3.728 8.175 -14.471 1.00 34.43 H ATOM 234 HB3 PHE A 15 -4.045 6.774 -13.452 1.00 0.22 H ATOM 235 HD1 PHE A 15 -6.043 5.427 -13.773 1.00 70.43 H ATOM 236 HD2 PHE A 15 -5.182 8.746 -16.295 1.00 22.31 H ATOM 237 HE1 PHE A 15 -7.700 4.615 -15.402 1.00 4.04 H ATOM 238 HE2 PHE A 15 -6.837 7.940 -17.927 1.00 15.14 H ATOM 239 HZ PHE A 15 -8.100 5.873 -17.481 1.00 24.21 H ATOM 240 N ILE A 16 -4.750 7.271 -10.823 1.00 31.14 N ATOM 241 CA ILE A 16 -5.149 6.461 -9.678 1.00 70.24 C ATOM 242 C ILE A 16 -5.909 7.295 -8.653 1.00 32.32 C ATOM 243 O ILE A 16 -6.772 6.785 -7.938 1.00 33.30 O ATOM 244 CB ILE A 16 -3.930 5.813 -8.995 1.00 73.10 C ATOM 245 CG1 ILE A 16 -4.385 4.751 -7.992 1.00 14.12 C ATOM 246 CG2 ILE A 16 -3.084 6.873 -8.305 1.00 73.25 C ATOM 247 CD1 ILE A 16 -4.345 3.343 -8.543 1.00 31.25 C ATOM 248 H ILE A 16 -3.804 7.497 -10.942 1.00 13.03 H ATOM 249 HA ILE A 16 -5.796 5.673 -10.037 1.00 51.44 H ATOM 250 HB ILE A 16 -3.326 5.343 -9.756 1.00 52.51 H ATOM 251 HG12 ILE A 16 -3.745 4.786 -7.125 1.00 20.13 H ATOM 252 HG13 ILE A 16 -5.402 4.962 -7.692 1.00 41.12 H ATOM 253 HG21 ILE A 16 -2.902 7.689 -8.989 1.00 64.54 H ATOM 254 HG22 ILE A 16 -3.609 7.243 -7.437 1.00 62.24 H ATOM 255 HG23 ILE A 16 -2.143 6.441 -8.001 1.00 30.40 H ATOM 256 HD11 ILE A 16 -3.595 3.280 -9.317 1.00 51.01 H ATOM 257 HD12 ILE A 16 -4.103 2.652 -7.749 1.00 53.10 H ATOM 258 HD13 ILE A 16 -5.311 3.091 -8.957 1.00 21.21 H ATOM 259 N LYS A 17 -5.584 8.581 -8.587 1.00 12.34 N ATOM 260 CA LYS A 17 -6.238 9.489 -7.651 1.00 63.10 C ATOM 261 C LYS A 17 -7.655 9.817 -8.111 1.00 23.42 C ATOM 262 O LYS A 17 -8.489 10.257 -7.320 1.00 31.23 O ATOM 263 CB LYS A 17 -5.426 10.778 -7.508 1.00 3.13 C ATOM 264 CG LYS A 17 -5.534 11.702 -8.709 1.00 24.43 C ATOM 265 CD LYS A 17 -4.701 12.959 -8.522 1.00 21.20 C ATOM 266 CE LYS A 17 -5.233 13.816 -7.383 1.00 63.52 C ATOM 267 NZ LYS A 17 -4.574 13.488 -6.089 1.00 5.45 N ATOM 268 H LYS A 17 -4.888 8.929 -9.183 1.00 2.53 H ATOM 269 HA LYS A 17 -6.288 8.997 -6.692 1.00 31.33 H ATOM 270 HB2 LYS A 17 -5.773 11.313 -6.636 1.00 61.00 H ATOM 271 HB3 LYS A 17 -4.385 10.521 -7.371 1.00 32.55 H ATOM 272 HG2 LYS A 17 -5.184 11.179 -9.586 1.00 71.54 H ATOM 273 HG3 LYS A 17 -6.569 11.983 -8.843 1.00 65.21 H ATOM 274 HD2 LYS A 17 -3.683 12.676 -8.300 1.00 3.35 H ATOM 275 HD3 LYS A 17 -4.725 13.535 -9.436 1.00 50.11 H ATOM 276 HE2 LYS A 17 -5.053 14.854 -7.617 1.00 23.44 H ATOM 277 HE3 LYS A 17 -6.295 13.647 -7.289 1.00 73.33 H ATOM 278 HZ1 LYS A 17 -5.292 13.313 -5.357 1.00 4.34 H ATOM 279 HZ2 LYS A 17 -3.971 14.279 -5.784 1.00 40.44 H ATOM 280 HZ3 LYS A 17 -3.985 12.638 -6.192 1.00 24.40 H ATOM 281 N LYS A 18 -7.921 9.598 -9.394 1.00 61.10 N ATOM 282 CA LYS A 18 -9.238 9.867 -9.959 1.00 63.04 C ATOM 283 C LYS A 18 -10.273 8.887 -9.417 1.00 13.20 C ATOM 284 O LYS A 18 -11.464 9.196 -9.358 1.00 43.12 O ATOM 285 CB LYS A 18 -9.187 9.779 -11.486 1.00 74.14 C ATOM 286 CG LYS A 18 -10.294 10.556 -12.177 1.00 53.53 C ATOM 287 CD LYS A 18 -9.963 12.037 -12.269 1.00 23.54 C ATOM 288 CE LYS A 18 -9.385 12.395 -13.629 1.00 54.53 C ATOM 289 NZ LYS A 18 -7.912 12.602 -13.570 1.00 22.43 N ATOM 290 H LYS A 18 -7.214 9.246 -9.975 1.00 70.33 H ATOM 291 HA LYS A 18 -9.523 10.868 -9.674 1.00 41.22 H ATOM 292 HB2 LYS A 18 -8.238 10.166 -11.826 1.00 70.43 H ATOM 293 HB3 LYS A 18 -9.269 8.742 -11.778 1.00 30.40 H ATOM 294 HG2 LYS A 18 -10.427 10.166 -13.175 1.00 53.34 H ATOM 295 HG3 LYS A 18 -11.210 10.436 -11.617 1.00 34.15 H ATOM 296 HD2 LYS A 18 -10.864 12.609 -12.111 1.00 15.35 H ATOM 297 HD3 LYS A 18 -9.239 12.282 -11.504 1.00 13.30 H ATOM 298 HE2 LYS A 18 -9.601 11.594 -14.320 1.00 5.43 H ATOM 299 HE3 LYS A 18 -9.854 13.305 -13.976 1.00 30.22 H ATOM 300 HZ1 LYS A 18 -7.568 12.440 -12.602 1.00 24.44 H ATOM 301 HZ2 LYS A 18 -7.675 13.574 -13.851 1.00 15.40 H ATOM 302 HZ3 LYS A 18 -7.432 11.940 -14.212 1.00 61.23 H ATOM 303 N PHE A 19 -9.812 7.706 -9.020 1.00 75.43 N ATOM 304 CA PHE A 19 -10.699 6.681 -8.482 1.00 32.31 C ATOM 305 C PHE A 19 -9.992 5.860 -7.408 1.00 33.44 C ATOM 306 O PHE A 19 -10.191 4.649 -7.305 1.00 63.33 O ATOM 307 CB PHE A 19 -11.190 5.761 -9.602 1.00 50.21 C ATOM 308 CG PHE A 19 -12.245 6.385 -10.471 1.00 23.12 C ATOM 309 CD1 PHE A 19 -11.894 7.234 -11.508 1.00 5.33 C ATOM 310 CD2 PHE A 19 -13.587 6.121 -10.251 1.00 50.41 C ATOM 311 CE1 PHE A 19 -12.862 7.810 -12.308 1.00 11.10 C ATOM 312 CE2 PHE A 19 -14.560 6.694 -11.048 1.00 71.04 C ATOM 313 CZ PHE A 19 -14.197 7.539 -12.079 1.00 21.31 C ATOM 314 H PHE A 19 -8.853 7.518 -9.092 1.00 42.21 H ATOM 315 HA PHE A 19 -11.548 7.178 -8.038 1.00 62.20 H ATOM 316 HB2 PHE A 19 -10.355 5.497 -10.233 1.00 61.11 H ATOM 317 HB3 PHE A 19 -11.605 4.865 -9.166 1.00 64.22 H ATOM 318 HD1 PHE A 19 -10.850 7.447 -11.689 1.00 31.31 H ATOM 319 HD2 PHE A 19 -13.872 5.460 -9.445 1.00 13.12 H ATOM 320 HE1 PHE A 19 -12.576 8.470 -13.113 1.00 65.03 H ATOM 321 HE2 PHE A 19 -15.603 6.479 -10.866 1.00 43.43 H ATOM 322 HZ PHE A 19 -14.955 7.988 -12.703 1.00 34.44 H ATOM 323 N TYR A 20 -9.167 6.527 -6.609 1.00 44.03 N ATOM 324 CA TYR A 20 -8.427 5.860 -5.544 1.00 73.24 C ATOM 325 C TYR A 20 -9.378 5.282 -4.500 1.00 40.32 C ATOM 326 O TYR A 20 -9.049 4.319 -3.808 1.00 62.43 O ATOM 327 CB TYR A 20 -7.455 6.836 -4.880 1.00 52.55 C ATOM 328 CG TYR A 20 -6.802 6.286 -3.633 1.00 10.54 C ATOM 329 CD1 TYR A 20 -5.610 5.575 -3.705 1.00 14.34 C ATOM 330 CD2 TYR A 20 -7.377 6.477 -2.382 1.00 64.01 C ATOM 331 CE1 TYR A 20 -5.010 5.070 -2.567 1.00 52.24 C ATOM 332 CE2 TYR A 20 -6.783 5.977 -1.240 1.00 23.15 C ATOM 333 CZ TYR A 20 -5.600 5.274 -1.337 1.00 41.13 C ATOM 334 OH TYR A 20 -5.006 4.773 -0.202 1.00 10.15 O ATOM 335 H TYR A 20 -9.050 7.491 -6.740 1.00 50.10 H ATOM 336 HA TYR A 20 -7.864 5.052 -5.988 1.00 22.24 H ATOM 337 HB2 TYR A 20 -6.673 7.087 -5.580 1.00 51.04 H ATOM 338 HB3 TYR A 20 -7.989 7.735 -4.607 1.00 42.14 H ATOM 339 HD1 TYR A 20 -5.151 5.417 -4.670 1.00 2.34 H ATOM 340 HD2 TYR A 20 -8.303 7.028 -2.309 1.00 74.42 H ATOM 341 HE1 TYR A 20 -4.084 4.520 -2.643 1.00 41.03 H ATOM 342 HE2 TYR A 20 -7.245 6.136 -0.276 1.00 64.13 H ATOM 343 HH TYR A 20 -5.619 4.836 0.534 1.00 35.34 H ATOM 344 N LYS A 21 -10.561 5.879 -4.392 1.00 65.55 N ATOM 345 CA LYS A 21 -11.562 5.425 -3.435 1.00 74.42 C ATOM 346 C LYS A 21 -12.068 4.032 -3.796 1.00 61.52 C ATOM 347 O LYS A 21 -12.348 3.217 -2.917 1.00 61.24 O ATOM 348 CB LYS A 21 -12.734 6.408 -3.388 1.00 33.43 C ATOM 349 CG LYS A 21 -12.324 7.827 -3.035 1.00 21.22 C ATOM 350 CD LYS A 21 -13.444 8.816 -3.311 1.00 44.13 C ATOM 351 CE LYS A 21 -13.513 9.181 -4.786 1.00 50.32 C ATOM 352 NZ LYS A 21 -14.891 9.568 -5.197 1.00 40.44 N ATOM 353 H LYS A 21 -10.765 6.643 -4.972 1.00 61.42 H ATOM 354 HA LYS A 21 -11.097 5.385 -2.462 1.00 32.20 H ATOM 355 HB2 LYS A 21 -13.214 6.424 -4.355 1.00 35.20 H ATOM 356 HB3 LYS A 21 -13.445 6.066 -2.648 1.00 42.44 H ATOM 357 HG2 LYS A 21 -12.072 7.869 -1.986 1.00 31.25 H ATOM 358 HG3 LYS A 21 -11.461 8.099 -3.625 1.00 43.53 H ATOM 359 HD2 LYS A 21 -14.384 8.374 -3.017 1.00 41.20 H ATOM 360 HD3 LYS A 21 -13.269 9.714 -2.735 1.00 35.22 H ATOM 361 HE2 LYS A 21 -12.846 10.009 -4.970 1.00 42.24 H ATOM 362 HE3 LYS A 21 -13.198 8.329 -5.370 1.00 34.33 H ATOM 363 HZ1 LYS A 21 -14.890 9.898 -6.184 1.00 62.41 H ATOM 364 HZ2 LYS A 21 -15.244 10.334 -4.589 1.00 5.40 H ATOM 365 HZ3 LYS A 21 -15.531 8.753 -5.116 1.00 21.21 H ATOM 366 N GLN A 22 -12.181 3.766 -5.093 1.00 63.55 N ATOM 367 CA GLN A 22 -12.652 2.470 -5.569 1.00 42.21 C ATOM 368 C GLN A 22 -11.494 1.486 -5.705 1.00 53.53 C ATOM 369 O GLN A 22 -11.593 0.334 -5.282 1.00 11.53 O ATOM 370 CB GLN A 22 -13.366 2.625 -6.913 1.00 45.41 C ATOM 371 CG GLN A 22 -14.129 1.383 -7.344 1.00 4.22 C ATOM 372 CD GLN A 22 -15.534 1.336 -6.778 1.00 30.04 C ATOM 373 OE1 GLN A 22 -15.953 2.237 -6.050 1.00 73.13 O ATOM 374 NE2 GLN A 22 -16.271 0.282 -7.109 1.00 1.12 N ATOM 375 H GLN A 22 -11.942 4.456 -5.746 1.00 11.25 H ATOM 376 HA GLN A 22 -13.351 2.085 -4.843 1.00 13.02 H ATOM 377 HB2 GLN A 22 -14.065 3.445 -6.843 1.00 44.34 H ATOM 378 HB3 GLN A 22 -12.632 2.852 -7.673 1.00 21.14 H ATOM 379 HG2 GLN A 22 -14.191 1.370 -8.422 1.00 12.32 H ATOM 380 HG3 GLN A 22 -13.590 0.510 -7.005 1.00 41.52 H ATOM 381 HE21 GLN A 22 -15.870 -0.397 -7.691 1.00 74.44 H ATOM 382 HE22 GLN A 22 -17.183 0.226 -6.756 1.00 64.43 H ATOM 383 N ILE A 23 -10.399 1.948 -6.299 1.00 2.11 N ATOM 384 CA ILE A 23 -9.223 1.109 -6.490 1.00 24.31 C ATOM 385 C ILE A 23 -8.753 0.512 -5.168 1.00 23.43 C ATOM 386 O ILE A 23 -8.759 -0.706 -4.988 1.00 44.20 O ATOM 387 CB ILE A 23 -8.063 1.900 -7.124 1.00 33.22 C ATOM 388 CG1 ILE A 23 -8.482 2.457 -8.486 1.00 61.31 C ATOM 389 CG2 ILE A 23 -6.832 1.016 -7.262 1.00 54.32 C ATOM 390 CD1 ILE A 23 -7.858 3.796 -8.809 1.00 3.21 C ATOM 391 H ILE A 23 -10.381 2.875 -6.615 1.00 41.20 H ATOM 392 HA ILE A 23 -9.492 0.305 -7.160 1.00 34.01 H ATOM 393 HB ILE A 23 -7.816 2.720 -6.468 1.00 2.41 H ATOM 394 HG12 ILE A 23 -8.191 1.761 -9.257 1.00 43.33 H ATOM 395 HG13 ILE A 23 -9.555 2.577 -8.503 1.00 15.44 H ATOM 396 HG21 ILE A 23 -6.419 0.820 -6.284 1.00 45.11 H ATOM 397 HG22 ILE A 23 -7.110 0.083 -7.728 1.00 75.11 H ATOM 398 HG23 ILE A 23 -6.095 1.518 -7.871 1.00 75.11 H ATOM 399 HD11 ILE A 23 -7.124 3.673 -9.592 1.00 74.22 H ATOM 400 HD12 ILE A 23 -8.624 4.482 -9.137 1.00 34.32 H ATOM 401 HD13 ILE A 23 -7.376 4.191 -7.926 1.00 11.04 H ATOM 402 N MET A 24 -8.348 1.378 -4.244 1.00 62.45 N ATOM 403 CA MET A 24 -7.877 0.936 -2.937 1.00 35.33 C ATOM 404 C MET A 24 -8.935 0.089 -2.236 1.00 72.54 C ATOM 405 O MET A 24 -8.614 -0.742 -1.387 1.00 14.24 O ATOM 406 CB MET A 24 -7.515 2.141 -2.067 1.00 40.13 C ATOM 407 CG MET A 24 -7.225 1.781 -0.619 1.00 63.33 C ATOM 408 SD MET A 24 -5.882 0.589 -0.456 1.00 62.31 S ATOM 409 CE MET A 24 -5.717 0.507 1.326 1.00 63.45 C ATOM 410 H MET A 24 -8.366 2.337 -4.446 1.00 71.54 H ATOM 411 HA MET A 24 -6.994 0.334 -3.089 1.00 1.14 H ATOM 412 HB2 MET A 24 -6.638 2.617 -2.480 1.00 11.00 H ATOM 413 HB3 MET A 24 -8.336 2.842 -2.083 1.00 73.11 H ATOM 414 HG2 MET A 24 -6.955 2.680 -0.085 1.00 72.42 H ATOM 415 HG3 MET A 24 -8.118 1.359 -0.182 1.00 43.02 H ATOM 416 HE1 MET A 24 -4.689 0.295 1.583 1.00 53.13 H ATOM 417 HE2 MET A 24 -6.009 1.452 1.758 1.00 42.13 H ATOM 418 HE3 MET A 24 -6.353 -0.278 1.710 1.00 42.41 H ATOM 419 N GLN A 25 -10.195 0.305 -2.599 1.00 35.21 N ATOM 420 CA GLN A 25 -11.299 -0.439 -2.004 1.00 14.14 C ATOM 421 C GLN A 25 -11.289 -1.892 -2.467 1.00 54.11 C ATOM 422 O GLN A 25 -11.783 -2.780 -1.771 1.00 53.44 O ATOM 423 CB GLN A 25 -12.635 0.214 -2.363 1.00 41.44 C ATOM 424 CG GLN A 25 -13.237 1.032 -1.232 1.00 22.43 C ATOM 425 CD GLN A 25 -13.844 0.166 -0.146 1.00 34.13 C ATOM 426 OE1 GLN A 25 -13.133 -0.527 0.582 1.00 31.33 O ATOM 427 NE2 GLN A 25 -15.167 0.201 -0.031 1.00 2.35 N ATOM 428 H GLN A 25 -10.387 0.980 -3.282 1.00 13.12 H ATOM 429 HA GLN A 25 -11.175 -0.415 -0.932 1.00 22.33 H ATOM 430 HB2 GLN A 25 -12.486 0.867 -3.211 1.00 33.13 H ATOM 431 HB3 GLN A 25 -13.339 -0.559 -2.634 1.00 0.24 H ATOM 432 HG2 GLN A 25 -12.461 1.641 -0.792 1.00 62.13 H ATOM 433 HG3 GLN A 25 -14.008 1.670 -1.637 1.00 20.02 H ATOM 434 HE21 GLN A 25 -15.669 0.776 -0.646 1.00 73.11 H ATOM 435 HE22 GLN A 25 -15.586 -0.349 0.662 1.00 10.13 H ATOM 436 N PHE A 26 -10.724 -2.128 -3.646 1.00 53.25 N ATOM 437 CA PHE A 26 -10.651 -3.473 -4.204 1.00 33.32 C ATOM 438 C PHE A 26 -9.623 -4.317 -3.456 1.00 2.31 C ATOM 439 O PHE A 26 -9.817 -5.516 -3.253 1.00 51.42 O ATOM 440 CB PHE A 26 -10.295 -3.414 -5.691 1.00 3.24 C ATOM 441 CG PHE A 26 -11.410 -2.898 -6.554 1.00 41.03 C ATOM 442 CD1 PHE A 26 -12.704 -3.363 -6.388 1.00 74.43 C ATOM 443 CD2 PHE A 26 -11.164 -1.947 -7.532 1.00 20.41 C ATOM 444 CE1 PHE A 26 -13.732 -2.891 -7.182 1.00 52.04 C ATOM 445 CE2 PHE A 26 -12.188 -1.471 -8.329 1.00 0.23 C ATOM 446 CZ PHE A 26 -13.474 -1.943 -8.153 1.00 0.31 C ATOM 447 H PHE A 26 -10.348 -1.378 -4.155 1.00 21.55 H ATOM 448 HA PHE A 26 -11.623 -3.930 -4.093 1.00 64.14 H ATOM 449 HB2 PHE A 26 -9.444 -2.762 -5.824 1.00 32.23 H ATOM 450 HB3 PHE A 26 -10.040 -4.406 -6.032 1.00 51.31 H ATOM 451 HD1 PHE A 26 -12.908 -4.104 -5.629 1.00 73.11 H ATOM 452 HD2 PHE A 26 -10.158 -1.577 -7.670 1.00 63.20 H ATOM 453 HE1 PHE A 26 -14.737 -3.261 -7.043 1.00 21.22 H ATOM 454 HE2 PHE A 26 -11.982 -0.729 -9.086 1.00 72.45 H ATOM 455 HZ PHE A 26 -14.275 -1.572 -8.775 1.00 32.33 H ATOM 456 N ILE A 27 -8.529 -3.682 -3.049 1.00 41.53 N ATOM 457 CA ILE A 27 -7.470 -4.372 -2.324 1.00 32.52 C ATOM 458 C ILE A 27 -8.019 -5.074 -1.086 1.00 12.20 C ATOM 459 O ILE A 27 -7.880 -6.287 -0.934 1.00 3.54 O ATOM 460 CB ILE A 27 -6.354 -3.401 -1.897 1.00 22.21 C ATOM 461 CG1 ILE A 27 -5.766 -2.696 -3.121 1.00 22.01 C ATOM 462 CG2 ILE A 27 -5.267 -4.145 -1.135 1.00 34.13 C ATOM 463 CD1 ILE A 27 -4.709 -1.669 -2.777 1.00 74.42 C ATOM 464 H ILE A 27 -8.432 -2.726 -3.241 1.00 1.31 H ATOM 465 HA ILE A 27 -7.043 -5.113 -2.984 1.00 64.12 H ATOM 466 HB ILE A 27 -6.782 -2.663 -1.236 1.00 74.24 H ATOM 467 HG12 ILE A 27 -5.315 -3.430 -3.770 1.00 31.33 H ATOM 468 HG13 ILE A 27 -6.560 -2.191 -3.652 1.00 61.30 H ATOM 469 HG21 ILE A 27 -5.484 -5.203 -1.140 1.00 60.24 H ATOM 470 HG22 ILE A 27 -4.313 -3.972 -1.608 1.00 42.52 H ATOM 471 HG23 ILE A 27 -5.234 -3.790 -0.116 1.00 14.22 H ATOM 472 HD11 ILE A 27 -4.514 -1.695 -1.715 1.00 51.43 H ATOM 473 HD12 ILE A 27 -3.801 -1.892 -3.317 1.00 13.13 H ATOM 474 HD13 ILE A 27 -5.060 -0.685 -3.054 1.00 73.52 H ATOM 475 N GLY A 28 -8.646 -4.301 -0.204 1.00 34.31 N ATOM 476 CA GLY A 28 -9.209 -4.866 1.009 1.00 50.02 C ATOM 477 C GLY A 28 -10.183 -5.993 0.726 1.00 4.12 C ATOM 478 O GLY A 28 -10.352 -6.895 1.546 1.00 44.00 O ATOM 479 H GLY A 28 -8.728 -3.340 -0.378 1.00 64.11 H ATOM 480 HA2 GLY A 28 -8.406 -5.244 1.623 1.00 4.24 H ATOM 481 HA3 GLY A 28 -9.726 -4.086 1.549 1.00 70.41 H ATOM 482 N GLN A 29 -10.825 -5.940 -0.436 1.00 72.11 N ATOM 483 CA GLN A 29 -11.789 -6.964 -0.823 1.00 0.33 C ATOM 484 C GLN A 29 -11.083 -8.261 -1.203 1.00 5.22 C ATOM 485 O GLN A 29 -11.656 -9.344 -1.103 1.00 33.45 O ATOM 486 CB GLN A 29 -12.644 -6.473 -1.992 1.00 72.22 C ATOM 487 CG GLN A 29 -13.521 -7.556 -2.601 1.00 2.20 C ATOM 488 CD GLN A 29 -14.546 -8.095 -1.623 1.00 52.12 C ATOM 489 OE1 GLN A 29 -14.206 -8.810 -0.681 1.00 20.44 O ATOM 490 NE2 GLN A 29 -15.811 -7.753 -1.843 1.00 25.44 N ATOM 491 H GLN A 29 -10.647 -5.196 -1.047 1.00 55.32 H ATOM 492 HA GLN A 29 -12.430 -7.153 0.025 1.00 4.33 H ATOM 493 HB2 GLN A 29 -13.283 -5.675 -1.646 1.00 12.05 H ATOM 494 HB3 GLN A 29 -11.992 -6.092 -2.764 1.00 72.24 H ATOM 495 HG2 GLN A 29 -14.041 -7.143 -3.453 1.00 20.42 H ATOM 496 HG3 GLN A 29 -12.891 -8.371 -2.925 1.00 44.34 H ATOM 497 HE21 GLN A 29 -16.008 -7.181 -2.614 1.00 63.22 H ATOM 498 HE22 GLN A 29 -16.494 -8.088 -1.227 1.00 30.32 H ATOM 499 N GLY A 30 -9.832 -8.142 -1.640 1.00 75.04 N ATOM 500 CA GLY A 30 -9.068 -9.313 -2.030 1.00 14.25 C ATOM 501 C GLY A 30 -8.991 -9.481 -3.534 1.00 75.20 C ATOM 502 O GLY A 30 -8.726 -10.576 -4.030 1.00 24.13 O ATOM 503 H GLY A 30 -9.426 -7.252 -1.699 1.00 60.15 H ATOM 504 HA2 GLY A 30 -8.067 -9.223 -1.636 1.00 41.20 H ATOM 505 HA3 GLY A 30 -9.534 -10.190 -1.604 1.00 41.14 H ATOM 506 N TRP A 31 -9.226 -8.395 -4.262 1.00 30.43 N ATOM 507 CA TRP A 31 -9.184 -8.428 -5.719 1.00 64.53 C ATOM 508 C TRP A 31 -7.748 -8.551 -6.219 1.00 75.24 C ATOM 509 O TRP A 31 -6.833 -7.942 -5.666 1.00 25.14 O ATOM 510 CB TRP A 31 -9.832 -7.170 -6.298 1.00 14.14 C ATOM 511 CG TRP A 31 -11.318 -7.287 -6.457 1.00 31.14 C ATOM 512 CD1 TRP A 31 -12.164 -8.059 -5.712 1.00 42.11 C ATOM 513 CD2 TRP A 31 -12.132 -6.612 -7.422 1.00 35.52 C ATOM 514 NE1 TRP A 31 -13.455 -7.905 -6.156 1.00 41.24 N ATOM 515 CE2 TRP A 31 -13.463 -7.022 -7.204 1.00 25.12 C ATOM 516 CE3 TRP A 31 -11.868 -5.701 -8.447 1.00 51.15 C ATOM 517 CZ2 TRP A 31 -14.522 -6.551 -7.975 1.00 61.51 C ATOM 518 CZ3 TRP A 31 -12.921 -5.235 -9.212 1.00 65.13 C ATOM 519 CH2 TRP A 31 -14.234 -5.660 -8.973 1.00 11.04 C ATOM 520 H TRP A 31 -9.433 -7.551 -3.809 1.00 3.05 H ATOM 521 HA TRP A 31 -9.742 -9.293 -6.047 1.00 22.24 H ATOM 522 HB2 TRP A 31 -9.632 -6.335 -5.642 1.00 72.53 H ATOM 523 HB3 TRP A 31 -9.407 -6.969 -7.270 1.00 70.33 H ATOM 524 HD1 TRP A 31 -11.849 -8.694 -4.898 1.00 53.20 H ATOM 525 HE1 TRP A 31 -14.242 -8.353 -5.782 1.00 74.23 H ATOM 526 HE3 TRP A 31 -10.862 -5.362 -8.648 1.00 15.45 H ATOM 527 HZ2 TRP A 31 -15.540 -6.869 -7.802 1.00 41.14 H ATOM 528 HZ3 TRP A 31 -12.735 -4.530 -10.010 1.00 34.52 H ATOM 529 HH2 TRP A 31 -15.025 -5.270 -9.595 1.00 22.12 H ATOM 530 N THR A 32 -7.558 -9.343 -7.271 1.00 11.35 N ATOM 531 CA THR A 32 -6.234 -9.546 -7.845 1.00 0.35 C ATOM 532 C THR A 32 -5.761 -8.303 -8.589 1.00 51.44 C ATOM 533 O THR A 32 -6.570 -7.481 -9.021 1.00 75.25 O ATOM 534 CB THR A 32 -6.218 -10.746 -8.810 1.00 11.20 C ATOM 535 OG1 THR A 32 -7.049 -10.473 -9.944 1.00 31.41 O ATOM 536 CG2 THR A 32 -6.702 -12.008 -8.112 1.00 64.11 C ATOM 537 H THR A 32 -8.328 -9.801 -7.668 1.00 3.01 H ATOM 538 HA THR A 32 -5.548 -9.752 -7.036 1.00 1.22 H ATOM 539 HB THR A 32 -5.203 -10.904 -9.146 1.00 75.44 H ATOM 540 HG1 THR A 32 -7.735 -9.849 -9.695 1.00 74.43 H ATOM 541 HG21 THR A 32 -6.488 -11.940 -7.056 1.00 1.14 H ATOM 542 HG22 THR A 32 -6.194 -12.866 -8.528 1.00 13.13 H ATOM 543 HG23 THR A 32 -7.766 -12.114 -8.257 1.00 51.13 H ATOM 544 N ILE A 33 -4.447 -8.171 -8.737 1.00 12.11 N ATOM 545 CA ILE A 33 -3.868 -7.028 -9.432 1.00 23.13 C ATOM 546 C ILE A 33 -4.426 -6.903 -10.845 1.00 72.11 C ATOM 547 O ILE A 33 -4.440 -5.817 -11.425 1.00 4.14 O ATOM 548 CB ILE A 33 -2.333 -7.133 -9.506 1.00 20.33 C ATOM 549 CG1 ILE A 33 -1.739 -7.238 -8.100 1.00 2.04 C ATOM 550 CG2 ILE A 33 -1.755 -5.935 -10.243 1.00 1.40 C ATOM 551 CD1 ILE A 33 -1.994 -6.017 -7.244 1.00 24.25 C ATOM 552 H ILE A 33 -3.854 -8.859 -8.370 1.00 43.24 H ATOM 553 HA ILE A 33 -4.121 -6.137 -8.876 1.00 12.12 H ATOM 554 HB ILE A 33 -2.082 -8.023 -10.062 1.00 62.22 H ATOM 555 HG12 ILE A 33 -2.168 -8.090 -7.597 1.00 23.22 H ATOM 556 HG13 ILE A 33 -0.670 -7.372 -8.178 1.00 45.00 H ATOM 557 HG21 ILE A 33 -2.148 -5.907 -11.249 1.00 12.35 H ATOM 558 HG22 ILE A 33 -2.029 -5.028 -9.725 1.00 43.31 H ATOM 559 HG23 ILE A 33 -0.679 -6.018 -10.279 1.00 72.43 H ATOM 560 HD11 ILE A 33 -1.534 -6.153 -6.276 1.00 23.12 H ATOM 561 HD12 ILE A 33 -1.574 -5.146 -7.724 1.00 30.14 H ATOM 562 HD13 ILE A 33 -3.058 -5.881 -7.119 1.00 35.23 H ATOM 563 N ASP A 34 -4.888 -8.021 -11.394 1.00 21.42 N ATOM 564 CA ASP A 34 -5.451 -8.037 -12.739 1.00 20.31 C ATOM 565 C ASP A 34 -6.902 -7.567 -12.726 1.00 73.50 C ATOM 566 O ASP A 34 -7.356 -6.899 -13.654 1.00 43.52 O ATOM 567 CB ASP A 34 -5.362 -9.443 -13.335 1.00 52.25 C ATOM 568 CG ASP A 34 -3.944 -9.823 -13.713 1.00 21.13 C ATOM 569 OD1 ASP A 34 -3.004 -9.356 -13.035 1.00 60.33 O ATOM 570 OD2 ASP A 34 -3.774 -10.588 -14.685 1.00 22.13 O ATOM 571 H ASP A 34 -4.850 -8.856 -10.881 1.00 63.34 H ATOM 572 HA ASP A 34 -4.872 -7.360 -13.349 1.00 32.23 H ATOM 573 HB2 ASP A 34 -5.726 -10.158 -12.612 1.00 11.32 H ATOM 574 HB3 ASP A 34 -5.977 -9.490 -14.222 1.00 43.24 H ATOM 575 N GLN A 35 -7.625 -7.924 -11.669 1.00 2.52 N ATOM 576 CA GLN A 35 -9.025 -7.540 -11.537 1.00 13.51 C ATOM 577 C GLN A 35 -9.196 -6.034 -11.713 1.00 22.25 C ATOM 578 O GLN A 35 -10.073 -5.581 -12.448 1.00 14.01 O ATOM 579 CB GLN A 35 -9.568 -7.971 -10.173 1.00 41.52 C ATOM 580 CG GLN A 35 -10.336 -9.282 -10.211 1.00 10.21 C ATOM 581 CD GLN A 35 -10.778 -9.739 -8.835 1.00 22.23 C ATOM 582 OE1 GLN A 35 -10.000 -10.329 -8.084 1.00 45.43 O ATOM 583 NE2 GLN A 35 -12.033 -9.469 -8.495 1.00 61.24 N ATOM 584 H GLN A 35 -7.207 -8.457 -10.962 1.00 2.12 H ATOM 585 HA GLN A 35 -9.582 -8.045 -12.311 1.00 42.15 H ATOM 586 HB2 GLN A 35 -8.740 -8.082 -9.489 1.00 34.14 H ATOM 587 HB3 GLN A 35 -10.230 -7.201 -9.803 1.00 62.51 H ATOM 588 HG2 GLN A 35 -11.212 -9.153 -10.829 1.00 35.43 H ATOM 589 HG3 GLN A 35 -9.702 -10.043 -10.641 1.00 51.12 H ATOM 590 HE21 GLN A 35 -12.596 -8.997 -9.145 1.00 31.42 H ATOM 591 HE22 GLN A 35 -12.345 -9.754 -7.612 1.00 71.13 H ATOM 592 N ILE A 36 -8.352 -5.265 -11.033 1.00 12.11 N ATOM 593 CA ILE A 36 -8.410 -3.811 -11.115 1.00 3.31 C ATOM 594 C ILE A 36 -7.968 -3.320 -12.489 1.00 52.24 C ATOM 595 O ILE A 36 -8.695 -2.588 -13.160 1.00 41.52 O ATOM 596 CB ILE A 36 -7.528 -3.151 -10.039 1.00 5.23 C ATOM 597 CG1 ILE A 36 -7.973 -3.591 -8.643 1.00 22.33 C ATOM 598 CG2 ILE A 36 -7.583 -1.636 -10.165 1.00 4.33 C ATOM 599 CD1 ILE A 36 -7.218 -4.793 -8.119 1.00 74.31 C ATOM 600 H ILE A 36 -7.675 -5.685 -10.464 1.00 23.24 H ATOM 601 HA ILE A 36 -9.434 -3.508 -10.948 1.00 25.10 H ATOM 602 HB ILE A 36 -6.507 -3.464 -10.199 1.00 75.52 H ATOM 603 HG12 ILE A 36 -7.822 -2.778 -7.950 1.00 62.32 H ATOM 604 HG13 ILE A 36 -9.023 -3.844 -8.671 1.00 61.12 H ATOM 605 HG21 ILE A 36 -6.699 -1.285 -10.676 1.00 44.25 H ATOM 606 HG22 ILE A 36 -8.459 -1.353 -10.728 1.00 73.40 H ATOM 607 HG23 ILE A 36 -7.628 -1.194 -9.181 1.00 14.31 H ATOM 608 HD11 ILE A 36 -7.804 -5.686 -8.284 1.00 3.14 H ATOM 609 HD12 ILE A 36 -6.275 -4.880 -8.636 1.00 3.01 H ATOM 610 HD13 ILE A 36 -7.039 -4.672 -7.060 1.00 62.13 H ATOM 611 N GLU A 37 -6.773 -3.730 -12.903 1.00 11.14 N ATOM 612 CA GLU A 37 -6.236 -3.332 -14.198 1.00 64.04 C ATOM 613 C GLU A 37 -7.233 -3.628 -15.315 1.00 42.40 C ATOM 614 O GLU A 37 -7.281 -2.922 -16.323 1.00 33.11 O ATOM 615 CB GLU A 37 -4.916 -4.057 -14.473 1.00 34.14 C ATOM 616 CG GLU A 37 -3.730 -3.463 -13.733 1.00 1.33 C ATOM 617 CD GLU A 37 -2.417 -3.694 -14.455 1.00 3.41 C ATOM 618 OE1 GLU A 37 -2.337 -4.653 -15.250 1.00 22.22 O ATOM 619 OE2 GLU A 37 -1.469 -2.914 -14.225 1.00 3.41 O ATOM 620 H GLU A 37 -6.240 -4.313 -12.322 1.00 55.04 H ATOM 621 HA GLU A 37 -6.052 -2.269 -14.169 1.00 4.22 H ATOM 622 HB2 GLU A 37 -5.019 -5.091 -14.176 1.00 1.51 H ATOM 623 HB3 GLU A 37 -4.711 -4.015 -15.532 1.00 65.21 H ATOM 624 HG2 GLU A 37 -3.883 -2.399 -13.628 1.00 71.02 H ATOM 625 HG3 GLU A 37 -3.670 -3.914 -12.753 1.00 65.44 H ATOM 626 N LYS A 38 -8.027 -4.676 -15.129 1.00 20.44 N ATOM 627 CA LYS A 38 -9.024 -5.067 -16.118 1.00 32.00 C ATOM 628 C LYS A 38 -10.346 -4.348 -15.871 1.00 55.20 C ATOM 629 O LYS A 38 -11.131 -4.138 -16.796 1.00 15.13 O ATOM 630 CB LYS A 38 -9.241 -6.582 -16.083 1.00 40.42 C ATOM 631 CG LYS A 38 -9.957 -7.122 -17.309 1.00 11.21 C ATOM 632 CD LYS A 38 -8.988 -7.390 -18.448 1.00 41.31 C ATOM 633 CE LYS A 38 -8.438 -8.807 -18.390 1.00 50.45 C ATOM 634 NZ LYS A 38 -7.947 -9.266 -19.719 1.00 50.54 N ATOM 635 H LYS A 38 -7.941 -5.200 -14.304 1.00 62.42 H ATOM 636 HA LYS A 38 -8.652 -4.787 -17.092 1.00 75.40 H ATOM 637 HB2 LYS A 38 -8.280 -7.069 -16.009 1.00 71.13 H ATOM 638 HB3 LYS A 38 -9.829 -6.829 -15.211 1.00 24.02 H ATOM 639 HG2 LYS A 38 -10.453 -8.045 -17.048 1.00 24.03 H ATOM 640 HG3 LYS A 38 -10.690 -6.397 -17.635 1.00 31.33 H ATOM 641 HD2 LYS A 38 -9.503 -7.254 -19.387 1.00 51.34 H ATOM 642 HD3 LYS A 38 -8.166 -6.691 -18.382 1.00 10.22 H ATOM 643 HE2 LYS A 38 -7.621 -8.833 -17.686 1.00 33.43 H ATOM 644 HE3 LYS A 38 -9.223 -9.470 -18.057 1.00 43.24 H ATOM 645 HZ1 LYS A 38 -6.918 -9.131 -19.785 1.00 63.14 H ATOM 646 HZ2 LYS A 38 -8.405 -8.721 -20.477 1.00 54.22 H ATOM 647 HZ3 LYS A 38 -8.164 -10.274 -19.852 1.00 5.11 H ATOM 648 N TRP A 39 -10.585 -3.972 -14.620 1.00 12.21 N ATOM 649 CA TRP A 39 -11.812 -3.274 -14.253 1.00 34.43 C ATOM 650 C TRP A 39 -11.910 -1.931 -14.967 1.00 60.24 C ATOM 651 O TRP A 39 -12.983 -1.538 -15.428 1.00 64.32 O ATOM 652 CB TRP A 39 -11.871 -3.066 -12.739 1.00 12.25 C ATOM 653 CG TRP A 39 -13.153 -2.443 -12.274 1.00 42.20 C ATOM 654 CD1 TRP A 39 -14.216 -3.083 -11.703 1.00 44.14 C ATOM 655 CD2 TRP A 39 -13.506 -1.057 -12.343 1.00 31.02 C ATOM 656 NE1 TRP A 39 -15.209 -2.178 -11.413 1.00 64.42 N ATOM 657 CE2 TRP A 39 -14.798 -0.929 -11.795 1.00 4.21 C ATOM 658 CE3 TRP A 39 -12.857 0.088 -12.812 1.00 2.03 C ATOM 659 CZ2 TRP A 39 -15.449 0.298 -11.706 1.00 14.32 C ATOM 660 CZ3 TRP A 39 -13.505 1.305 -12.723 1.00 13.12 C ATOM 661 CH2 TRP A 39 -14.790 1.403 -12.173 1.00 33.23 C ATOM 662 H TRP A 39 -9.921 -4.168 -13.926 1.00 43.43 H ATOM 663 HA TRP A 39 -12.646 -3.891 -14.555 1.00 31.14 H ATOM 664 HB2 TRP A 39 -11.767 -4.021 -12.245 1.00 50.35 H ATOM 665 HB3 TRP A 39 -11.058 -2.420 -12.440 1.00 12.11 H ATOM 666 HD1 TRP A 39 -14.256 -4.145 -11.516 1.00 14.13 H ATOM 667 HE1 TRP A 39 -16.070 -2.394 -10.998 1.00 55.25 H ATOM 668 HE3 TRP A 39 -11.866 0.033 -13.239 1.00 14.01 H ATOM 669 HZ2 TRP A 39 -16.440 0.390 -11.284 1.00 3.12 H ATOM 670 HZ3 TRP A 39 -13.019 2.201 -13.081 1.00 33.14 H ATOM 671 HH2 TRP A 39 -15.259 2.374 -12.123 1.00 63.45 H ATOM 672 N LEU A 40 -10.785 -1.231 -15.057 1.00 41.40 N ATOM 673 CA LEU A 40 -10.744 0.070 -15.717 1.00 21.12 C ATOM 674 C LEU A 40 -11.074 -0.062 -17.200 1.00 45.43 C ATOM 675 O LEU A 40 -12.103 0.429 -17.665 1.00 21.13 O ATOM 676 CB LEU A 40 -9.365 0.708 -15.544 1.00 4.32 C ATOM 677 CG LEU A 40 -9.234 1.728 -14.412 1.00 12.01 C ATOM 678 CD1 LEU A 40 -10.197 2.886 -14.623 1.00 33.10 C ATOM 679 CD2 LEU A 40 -9.482 1.064 -13.065 1.00 50.41 C ATOM 680 H LEU A 40 -9.962 -1.595 -14.671 1.00 21.41 H ATOM 681 HA LEU A 40 -11.485 0.702 -15.250 1.00 71.53 H ATOM 682 HB2 LEU A 40 -8.655 -0.083 -15.359 1.00 21.32 H ATOM 683 HB3 LEU A 40 -9.113 1.206 -16.470 1.00 30.03 H ATOM 684 HG LEU A 40 -8.229 2.127 -14.409 1.00 71.13 H ATOM 685 HD11 LEU A 40 -10.866 2.653 -15.437 1.00 55.54 H ATOM 686 HD12 LEU A 40 -9.639 3.780 -14.859 1.00 72.33 H ATOM 687 HD13 LEU A 40 -10.769 3.047 -13.721 1.00 12.22 H ATOM 688 HD21 LEU A 40 -8.719 1.374 -12.366 1.00 62.42 H ATOM 689 HD22 LEU A 40 -9.450 -0.009 -13.182 1.00 24.35 H ATOM 690 HD23 LEU A 40 -10.452 1.358 -12.692 1.00 70.34 H ATOM 691 N LYS A 41 -10.194 -0.729 -17.940 1.00 1.34 N ATOM 692 CA LYS A 41 -10.392 -0.929 -19.370 1.00 42.13 C ATOM 693 C LYS A 41 -11.740 -1.587 -19.646 1.00 61.03 C ATOM 694 O LYS A 41 -12.355 -1.351 -20.686 1.00 52.31 O ATOM 695 CB LYS A 41 -9.265 -1.789 -19.946 1.00 61.15 C ATOM 696 CG LYS A 41 -9.080 -1.626 -21.445 1.00 55.32 C ATOM 697 CD LYS A 41 -8.116 -2.658 -22.004 1.00 45.12 C ATOM 698 CE LYS A 41 -7.509 -2.198 -23.321 1.00 72.42 C ATOM 699 NZ LYS A 41 -8.433 -2.428 -24.467 1.00 4.52 N ATOM 700 H LYS A 41 -9.392 -1.097 -17.512 1.00 2.40 H ATOM 701 HA LYS A 41 -10.373 0.040 -19.846 1.00 73.45 H ATOM 702 HB2 LYS A 41 -8.339 -1.521 -19.459 1.00 62.35 H ATOM 703 HB3 LYS A 41 -9.481 -2.828 -19.743 1.00 33.12 H ATOM 704 HG2 LYS A 41 -10.037 -1.743 -21.932 1.00 34.14 H ATOM 705 HG3 LYS A 41 -8.692 -0.637 -21.645 1.00 63.32 H ATOM 706 HD2 LYS A 41 -7.320 -2.818 -21.291 1.00 53.04 H ATOM 707 HD3 LYS A 41 -8.648 -3.585 -22.167 1.00 2.44 H ATOM 708 HE2 LYS A 41 -7.289 -1.144 -23.253 1.00 31.22 H ATOM 709 HE3 LYS A 41 -6.594 -2.747 -23.492 1.00 15.32 H ATOM 710 HZ1 LYS A 41 -8.980 -1.565 -24.663 1.00 5.35 H ATOM 711 HZ2 LYS A 41 -9.093 -3.200 -24.245 1.00 2.43 H ATOM 712 HZ3 LYS A 41 -7.891 -2.682 -25.317 1.00 71.52 H ATOM 713 N ARG A 42 -12.194 -2.412 -18.708 1.00 64.13 N ATOM 714 CA ARG A 42 -13.469 -3.104 -18.851 1.00 50.31 C ATOM 715 C ARG A 42 -14.455 -2.652 -17.778 1.00 34.21 C ATOM 716 O ARG A 42 -15.001 -3.471 -17.037 1.00 50.13 O ATOM 717 CB ARG A 42 -13.265 -4.617 -18.767 1.00 22.41 C ATOM 718 CG ARG A 42 -12.091 -5.120 -19.591 1.00 23.43 C ATOM 719 CD ARG A 42 -12.202 -6.612 -19.867 1.00 11.42 C ATOM 720 NE ARG A 42 -13.355 -6.928 -20.706 1.00 21.45 N ATOM 721 CZ ARG A 42 -13.877 -8.146 -20.808 1.00 44.33 C ATOM 722 NH1 ARG A 42 -13.351 -9.155 -20.128 1.00 74.31 N ATOM 723 NH2 ARG A 42 -14.926 -8.355 -21.592 1.00 54.24 N ATOM 724 H ARG A 42 -11.657 -2.560 -17.901 1.00 55.03 H ATOM 725 HA ARG A 42 -13.873 -2.857 -19.821 1.00 74.44 H ATOM 726 HB2 ARG A 42 -13.095 -4.889 -17.735 1.00 60.44 H ATOM 727 HB3 ARG A 42 -14.160 -5.109 -19.118 1.00 24.13 H ATOM 728 HG2 ARG A 42 -12.071 -4.592 -20.532 1.00 41.14 H ATOM 729 HG3 ARG A 42 -11.176 -4.930 -19.049 1.00 61.35 H ATOM 730 HD2 ARG A 42 -11.304 -6.940 -20.368 1.00 4.51 H ATOM 731 HD3 ARG A 42 -12.299 -7.132 -18.926 1.00 12.24 H ATOM 732 HE ARG A 42 -13.759 -6.197 -21.217 1.00 23.01 H ATOM 733 HH11 ARG A 42 -12.561 -9.000 -19.536 1.00 30.43 H ATOM 734 HH12 ARG A 42 -13.747 -10.071 -20.206 1.00 40.33 H ATOM 735 HH21 ARG A 42 -15.325 -7.596 -22.107 1.00 33.14 H ATOM 736 HH22 ARG A 42 -15.318 -9.271 -21.669 1.00 72.12 H ATOM 737 N HIS A 43 -14.679 -1.344 -17.700 1.00 30.24 N ATOM 738 CA HIS A 43 -15.600 -0.784 -16.717 1.00 3.40 C ATOM 739 C HIS A 43 -16.996 -1.378 -16.879 1.00 44.23 C ATOM 740 O HIS A 43 -17.503 -1.500 -17.995 1.00 4.20 O ATOM 741 CB HIS A 43 -15.661 0.738 -16.855 1.00 34.14 C ATOM 742 CG HIS A 43 -16.489 1.402 -15.798 1.00 33.13 C ATOM 743 ND1 HIS A 43 -16.919 2.709 -15.889 1.00 74.22 N ATOM 744 CD2 HIS A 43 -16.968 0.931 -14.622 1.00 43.33 C ATOM 745 CE1 HIS A 43 -17.625 3.014 -14.815 1.00 30.01 C ATOM 746 NE2 HIS A 43 -17.670 1.952 -14.030 1.00 42.34 N ATOM 747 H HIS A 43 -14.214 -0.742 -18.317 1.00 73.23 H ATOM 748 HA HIS A 43 -15.228 -1.033 -15.735 1.00 13.44 H ATOM 749 HB2 HIS A 43 -14.661 1.139 -16.792 1.00 4.20 H ATOM 750 HB3 HIS A 43 -16.085 0.989 -17.816 1.00 55.21 H ATOM 751 HD1 HIS A 43 -16.734 3.322 -16.630 1.00 65.23 H ATOM 752 HD2 HIS A 43 -16.824 -0.063 -14.223 1.00 0.13 H ATOM 753 HE1 HIS A 43 -18.087 3.968 -14.612 1.00 53.30 H TER 754 HIS A 43