HETATM 1 N FME A 1 -1.797 -1.559 1.454 1.00 3.31 N HETATM 2 CN FME A 1 -2.494 -1.794 0.280 1.00 32.02 C HETATM 3 O1 FME A 1 -2.138 -1.403 -0.806 1.00 61.23 O HETATM 4 CA FME A 1 -0.424 -1.016 1.311 1.00 61.25 C HETATM 5 CB FME A 1 0.053 -0.297 2.594 1.00 72.44 C HETATM 6 CG FME A 1 -0.496 1.131 2.770 1.00 4.23 C HETATM 7 SD FME A 1 -2.272 1.037 3.176 1.00 13.12 S HETATM 8 CE FME A 1 -2.107 0.585 4.926 1.00 14.44 C HETATM 9 C FME A 1 0.564 -2.033 0.741 1.00 72.14 C HETATM 10 O FME A 1 1.154 -2.839 1.459 1.00 15.23 O HETATM 11 HCN FME A 1 -3.434 -2.371 0.395 1.00 51.43 H HETATM 12 HA FME A 1 -0.424 -0.211 0.533 1.00 32.43 H HETATM 13 HB2 FME A 1 1.167 -0.270 2.620 1.00 50.31 H HETATM 14 HB3 FME A 1 -0.285 -0.914 3.463 1.00 33.10 H HETATM 15 HG2 FME A 1 -0.355 1.711 1.827 1.00 25.41 H HETATM 16 HG3 FME A 1 0.051 1.663 3.581 1.00 73.25 H HETATM 17 HE1 FME A 1 -3.082 0.193 5.296 1.00 43.34 H HETATM 18 HE2 FME A 1 -1.827 1.478 5.529 1.00 22.04 H HETATM 19 HE3 FME A 1 -1.333 -0.204 5.048 1.00 61.21 H ATOM 20 N GLY A 2 0.752 -1.964 -0.574 1.00 0.51 N ATOM 21 CA GLY A 2 1.684 -2.856 -1.238 1.00 72.01 C ATOM 22 C GLY A 2 1.212 -3.263 -2.620 1.00 10.01 C ATOM 23 O GLY A 2 2.017 -3.628 -3.476 1.00 5.23 O ATOM 24 H GLY A 2 0.254 -1.301 -1.097 1.00 11.22 H ATOM 25 HA2 GLY A 2 2.639 -2.361 -1.327 1.00 1.54 H ATOM 26 HA3 GLY A 2 1.805 -3.745 -0.636 1.00 11.52 H ATOM 27 N ALA A 3 -0.098 -3.202 -2.838 1.00 64.11 N ATOM 28 CA ALA A 3 -0.675 -3.567 -4.126 1.00 13.04 C ATOM 29 C ALA A 3 -1.152 -2.332 -4.883 1.00 64.33 C ATOM 30 O ALA A 3 -2.216 -2.345 -5.502 1.00 14.54 O ATOM 31 CB ALA A 3 -1.825 -4.545 -3.930 1.00 43.33 C ATOM 32 H ALA A 3 -0.689 -2.903 -2.116 1.00 61.43 H ATOM 33 HA ALA A 3 0.090 -4.061 -4.707 1.00 1.20 H ATOM 34 HB1 ALA A 3 -2.722 -3.998 -3.680 1.00 34.12 H ATOM 35 HB2 ALA A 3 -1.984 -5.100 -4.843 1.00 25.05 H ATOM 36 HB3 ALA A 3 -1.584 -5.228 -3.130 1.00 3.34 H ATOM 37 N ILE A 4 -0.357 -1.269 -4.830 1.00 52.54 N ATOM 38 CA ILE A 4 -0.698 -0.026 -5.512 1.00 74.33 C ATOM 39 C ILE A 4 0.144 0.160 -6.770 1.00 22.04 C ATOM 40 O ILE A 4 -0.381 0.454 -7.843 1.00 2.10 O ATOM 41 CB ILE A 4 -0.504 1.193 -4.592 1.00 5.10 C ATOM 42 CG1 ILE A 4 -1.176 0.951 -3.239 1.00 54.23 C ATOM 43 CG2 ILE A 4 -1.060 2.447 -5.250 1.00 3.34 C ATOM 44 CD1 ILE A 4 -2.680 0.810 -3.329 1.00 23.41 C ATOM 45 H ILE A 4 0.478 -1.321 -4.321 1.00 42.54 H ATOM 46 HA ILE A 4 -1.740 -0.077 -5.794 1.00 53.43 H ATOM 47 HB ILE A 4 0.555 1.335 -4.439 1.00 43.22 H ATOM 48 HG12 ILE A 4 -0.784 0.045 -2.806 1.00 2.02 H ATOM 49 HG13 ILE A 4 -0.959 1.782 -2.584 1.00 0.40 H ATOM 50 HG21 ILE A 4 -1.539 2.183 -6.180 1.00 74.04 H ATOM 51 HG22 ILE A 4 -1.781 2.908 -4.592 1.00 53.10 H ATOM 52 HG23 ILE A 4 -0.255 3.140 -5.443 1.00 65.24 H ATOM 53 HD11 ILE A 4 -2.927 0.047 -4.052 1.00 75.03 H ATOM 54 HD12 ILE A 4 -3.074 0.533 -2.363 1.00 30.21 H ATOM 55 HD13 ILE A 4 -3.112 1.751 -3.637 1.00 61.15 H ATOM 56 N ALA A 5 1.454 -0.015 -6.629 1.00 20.23 N ATOM 57 CA ALA A 5 2.369 0.130 -7.754 1.00 25.33 C ATOM 58 C ALA A 5 2.024 -0.848 -8.872 1.00 22.12 C ATOM 59 O ALA A 5 2.334 -0.608 -10.039 1.00 5.12 O ATOM 60 CB ALA A 5 3.806 -0.076 -7.295 1.00 53.52 C ATOM 61 H ALA A 5 1.813 -0.249 -5.747 1.00 51.34 H ATOM 62 HA ALA A 5 2.278 1.138 -8.130 1.00 44.44 H ATOM 63 HB1 ALA A 5 3.974 -1.125 -7.101 1.00 1.11 H ATOM 64 HB2 ALA A 5 4.481 0.261 -8.067 1.00 43.13 H ATOM 65 HB3 ALA A 5 3.979 0.490 -6.392 1.00 43.43 H ATOM 66 N LYS A 6 1.381 -1.952 -8.508 1.00 70.30 N ATOM 67 CA LYS A 6 0.992 -2.967 -9.480 1.00 25.40 C ATOM 68 C LYS A 6 0.049 -2.385 -10.528 1.00 3.23 C ATOM 69 O LYS A 6 0.228 -2.601 -11.727 1.00 51.22 O ATOM 70 CB LYS A 6 0.321 -4.148 -8.774 1.00 64.15 C ATOM 71 CG LYS A 6 1.080 -4.638 -7.554 1.00 24.53 C ATOM 72 CD LYS A 6 0.667 -6.050 -7.170 1.00 5.51 C ATOM 73 CE LYS A 6 0.923 -6.324 -5.696 1.00 3.31 C ATOM 74 NZ LYS A 6 1.189 -7.766 -5.438 1.00 64.00 N ATOM 75 H LYS A 6 1.161 -2.088 -7.562 1.00 1.51 H ATOM 76 HA LYS A 6 1.888 -3.315 -9.973 1.00 31.05 H ATOM 77 HB2 LYS A 6 -0.668 -3.850 -8.461 1.00 53.45 H ATOM 78 HB3 LYS A 6 0.237 -4.968 -9.473 1.00 34.20 H ATOM 79 HG2 LYS A 6 2.138 -4.631 -7.772 1.00 21.35 H ATOM 80 HG3 LYS A 6 0.877 -3.976 -6.725 1.00 2.54 H ATOM 81 HD2 LYS A 6 -0.386 -6.174 -7.370 1.00 34.11 H ATOM 82 HD3 LYS A 6 1.234 -6.755 -7.762 1.00 51.50 H ATOM 83 HE2 LYS A 6 1.778 -5.747 -5.379 1.00 2.52 H ATOM 84 HE3 LYS A 6 0.054 -6.020 -5.131 1.00 4.11 H ATOM 85 HZ1 LYS A 6 2.167 -7.895 -5.107 1.00 60.02 H ATOM 86 HZ2 LYS A 6 1.056 -8.316 -6.311 1.00 14.44 H ATOM 87 HZ3 LYS A 6 0.538 -8.125 -4.711 1.00 63.42 H ATOM 88 N LEU A 7 -0.953 -1.645 -10.068 1.00 54.30 N ATOM 89 CA LEU A 7 -1.924 -1.029 -10.966 1.00 73.11 C ATOM 90 C LEU A 7 -1.436 0.334 -11.444 1.00 43.52 C ATOM 91 O LEU A 7 -1.681 0.729 -12.584 1.00 54.11 O ATOM 92 CB LEU A 7 -3.276 -0.882 -10.265 1.00 23.13 C ATOM 93 CG LEU A 7 -3.700 -2.050 -9.373 1.00 3.30 C ATOM 94 CD1 LEU A 7 -4.890 -1.659 -8.512 1.00 15.43 C ATOM 95 CD2 LEU A 7 -4.028 -3.273 -10.216 1.00 70.04 C ATOM 96 H LEU A 7 -1.044 -1.508 -9.102 1.00 60.32 H ATOM 97 HA LEU A 7 -2.041 -1.677 -11.822 1.00 42.22 H ATOM 98 HB2 LEU A 7 -3.235 0.005 -9.651 1.00 22.51 H ATOM 99 HB3 LEU A 7 -4.031 -0.755 -11.027 1.00 71.43 H ATOM 100 HG LEU A 7 -2.882 -2.306 -8.714 1.00 23.52 H ATOM 101 HD11 LEU A 7 -5.709 -2.337 -8.699 1.00 65.31 H ATOM 102 HD12 LEU A 7 -5.195 -0.651 -8.755 1.00 32.42 H ATOM 103 HD13 LEU A 7 -4.612 -1.708 -7.469 1.00 71.11 H ATOM 104 HD21 LEU A 7 -4.779 -3.865 -9.714 1.00 23.01 H ATOM 105 HD22 LEU A 7 -3.135 -3.866 -10.354 1.00 10.42 H ATOM 106 HD23 LEU A 7 -4.403 -2.957 -11.178 1.00 43.14 H ATOM 107 N VAL A 8 -0.740 1.050 -10.566 1.00 33.44 N ATOM 108 CA VAL A 8 -0.214 2.368 -10.899 1.00 23.23 C ATOM 109 C VAL A 8 0.875 2.272 -11.962 1.00 12.22 C ATOM 110 O VAL A 8 1.110 3.220 -12.711 1.00 74.42 O ATOM 111 CB VAL A 8 0.359 3.074 -9.655 1.00 50.04 C ATOM 112 CG1 VAL A 8 0.954 4.422 -10.033 1.00 61.24 C ATOM 113 CG2 VAL A 8 -0.717 3.236 -8.592 1.00 51.35 C ATOM 114 H VAL A 8 -0.577 0.682 -9.672 1.00 61.52 H ATOM 115 HA VAL A 8 -1.028 2.965 -11.283 1.00 44.22 H ATOM 116 HB VAL A 8 1.148 2.459 -9.248 1.00 73.32 H ATOM 117 HG11 VAL A 8 0.624 4.695 -11.025 1.00 43.10 H ATOM 118 HG12 VAL A 8 0.630 5.170 -9.325 1.00 54.35 H ATOM 119 HG13 VAL A 8 2.032 4.356 -10.019 1.00 61.31 H ATOM 120 HG21 VAL A 8 -0.265 3.184 -7.613 1.00 74.51 H ATOM 121 HG22 VAL A 8 -1.202 4.194 -8.714 1.00 12.22 H ATOM 122 HG23 VAL A 8 -1.448 2.448 -8.696 1.00 25.14 H ATOM 123 N ALA A 9 1.536 1.121 -12.022 1.00 4.14 N ATOM 124 CA ALA A 9 2.599 0.900 -12.995 1.00 13.22 C ATOM 125 C ALA A 9 2.085 1.081 -14.419 1.00 73.41 C ATOM 126 O ALA A 9 2.859 1.329 -15.343 1.00 64.53 O ATOM 127 CB ALA A 9 3.195 -0.488 -12.819 1.00 23.41 C ATOM 128 H ALA A 9 1.303 0.403 -11.397 1.00 63.11 H ATOM 129 HA ALA A 9 3.378 1.626 -12.809 1.00 74.12 H ATOM 130 HB1 ALA A 9 2.490 -1.119 -12.296 1.00 42.53 H ATOM 131 HB2 ALA A 9 3.409 -0.913 -13.788 1.00 62.51 H ATOM 132 HB3 ALA A 9 4.108 -0.418 -12.247 1.00 2.23 H ATOM 133 N LYS A 10 0.773 0.954 -14.590 1.00 42.12 N ATOM 134 CA LYS A 10 0.154 1.104 -15.902 1.00 23.41 C ATOM 135 C LYS A 10 -0.788 2.303 -15.925 1.00 61.05 C ATOM 136 O LYS A 10 -1.003 2.916 -16.971 1.00 63.25 O ATOM 137 CB LYS A 10 -0.612 -0.168 -16.275 1.00 42.41 C ATOM 138 CG LYS A 10 0.203 -1.439 -16.111 1.00 40.13 C ATOM 139 CD LYS A 10 -0.507 -2.638 -16.717 1.00 62.10 C ATOM 140 CE LYS A 10 -0.126 -3.928 -16.008 1.00 25.34 C ATOM 141 NZ LYS A 10 1.324 -4.236 -16.157 1.00 11.34 N ATOM 142 H LYS A 10 0.207 0.756 -13.814 1.00 50.04 H ATOM 143 HA LYS A 10 0.941 1.265 -16.623 1.00 72.34 H ATOM 144 HB2 LYS A 10 -1.488 -0.243 -15.648 1.00 2.22 H ATOM 145 HB3 LYS A 10 -0.924 -0.095 -17.307 1.00 62.41 H ATOM 146 HG2 LYS A 10 1.155 -1.311 -16.604 1.00 64.41 H ATOM 147 HG3 LYS A 10 0.362 -1.620 -15.058 1.00 21.42 H ATOM 148 HD2 LYS A 10 -1.574 -2.495 -16.631 1.00 62.31 H ATOM 149 HD3 LYS A 10 -0.235 -2.717 -17.760 1.00 72.13 H ATOM 150 HE2 LYS A 10 -0.358 -3.829 -14.958 1.00 64.14 H ATOM 151 HE3 LYS A 10 -0.702 -4.739 -16.429 1.00 0.14 H ATOM 152 HZ1 LYS A 10 1.448 -5.192 -16.548 1.00 13.35 H ATOM 153 HZ2 LYS A 10 1.796 -4.188 -15.231 1.00 62.34 H ATOM 154 HZ3 LYS A 10 1.771 -3.550 -16.798 1.00 11.23 H ATOM 155 N PHE A 11 -1.346 2.634 -14.766 1.00 35.31 N ATOM 156 CA PHE A 11 -2.265 3.760 -14.654 1.00 13.52 C ATOM 157 C PHE A 11 -1.505 5.060 -14.405 1.00 62.21 C ATOM 158 O PHE A 11 -1.560 5.988 -15.210 1.00 54.33 O ATOM 159 CB PHE A 11 -3.267 3.518 -13.523 1.00 12.31 C ATOM 160 CG PHE A 11 -4.197 2.368 -13.782 1.00 72.22 C ATOM 161 CD1 PHE A 11 -4.773 2.193 -15.030 1.00 62.24 C ATOM 162 CD2 PHE A 11 -4.495 1.461 -12.778 1.00 74.10 C ATOM 163 CE1 PHE A 11 -5.630 1.135 -15.271 1.00 45.32 C ATOM 164 CE2 PHE A 11 -5.351 0.401 -13.013 1.00 51.21 C ATOM 165 CZ PHE A 11 -5.918 0.238 -14.262 1.00 31.32 C ATOM 166 H PHE A 11 -1.136 2.107 -13.966 1.00 70.34 H ATOM 167 HA PHE A 11 -2.801 3.844 -15.586 1.00 74.05 H ATOM 168 HB2 PHE A 11 -2.727 3.309 -12.612 1.00 32.11 H ATOM 169 HB3 PHE A 11 -3.866 4.406 -13.386 1.00 3.30 H ATOM 170 HD1 PHE A 11 -4.547 2.893 -15.821 1.00 54.12 H ATOM 171 HD2 PHE A 11 -4.052 1.588 -11.800 1.00 62.13 H ATOM 172 HE1 PHE A 11 -6.071 1.010 -16.248 1.00 73.55 H ATOM 173 HE2 PHE A 11 -5.574 -0.299 -12.221 1.00 54.44 H ATOM 174 HZ PHE A 11 -6.587 -0.589 -14.447 1.00 53.04 H ATOM 175 N GLY A 12 -0.794 5.117 -13.283 1.00 15.45 N ATOM 176 CA GLY A 12 -0.033 6.306 -12.946 1.00 54.45 C ATOM 177 C GLY A 12 -0.565 7.005 -11.711 1.00 20.14 C ATOM 178 O GLY A 12 -1.612 6.633 -11.181 1.00 72.34 O ATOM 179 H GLY A 12 -0.787 4.346 -12.678 1.00 13.13 H ATOM 180 HA2 GLY A 12 0.995 6.026 -12.774 1.00 71.25 H ATOM 181 HA3 GLY A 12 -0.074 6.993 -13.779 1.00 52.22 H ATOM 182 N TRP A 13 0.158 8.018 -11.249 1.00 5.40 N ATOM 183 CA TRP A 13 -0.246 8.769 -10.066 1.00 10.51 C ATOM 184 C TRP A 13 -1.510 9.577 -10.340 1.00 1.14 C ATOM 185 O TRP A 13 -2.497 9.496 -9.608 1.00 52.45 O ATOM 186 CB TRP A 13 0.882 9.700 -9.617 1.00 53.32 C ATOM 187 CG TRP A 13 2.249 9.160 -9.909 1.00 1.14 C ATOM 188 CD1 TRP A 13 3.200 9.725 -10.710 1.00 12.01 C ATOM 189 CD2 TRP A 13 2.817 7.947 -9.403 1.00 10.12 C ATOM 190 NE1 TRP A 13 4.325 8.936 -10.733 1.00 14.13 N ATOM 191 CE2 TRP A 13 4.116 7.840 -9.938 1.00 55.02 C ATOM 192 CE3 TRP A 13 2.356 6.942 -8.548 1.00 41.12 C ATOM 193 CZ2 TRP A 13 4.954 6.768 -9.647 1.00 25.22 C ATOM 194 CZ3 TRP A 13 3.190 5.878 -8.260 1.00 52.42 C ATOM 195 CH2 TRP A 13 4.477 5.798 -8.807 1.00 43.13 C ATOM 196 H TRP A 13 0.984 8.268 -11.714 1.00 44.04 H ATOM 197 HA TRP A 13 -0.450 8.060 -9.278 1.00 21.24 H ATOM 198 HB2 TRP A 13 0.782 10.647 -10.126 1.00 3.42 H ATOM 199 HB3 TRP A 13 0.805 9.858 -8.551 1.00 41.31 H ATOM 200 HD1 TRP A 13 3.072 10.655 -11.243 1.00 35.32 H ATOM 201 HE1 TRP A 13 5.144 9.129 -11.235 1.00 62.43 H ATOM 202 HE3 TRP A 13 1.367 6.986 -8.117 1.00 10.24 H ATOM 203 HZ2 TRP A 13 5.950 6.692 -10.060 1.00 73.21 H ATOM 204 HZ3 TRP A 13 2.851 5.092 -7.602 1.00 74.10 H ATOM 205 HH2 TRP A 13 5.094 4.949 -8.555 1.00 51.31 H ATOM 206 N PRO A 14 -1.482 10.375 -11.417 1.00 41.13 N ATOM 207 CA PRO A 14 -2.619 11.212 -11.812 1.00 45.32 C ATOM 208 C PRO A 14 -3.792 10.389 -12.331 1.00 34.10 C ATOM 209 O PRO A 14 -4.890 10.910 -12.530 1.00 1.44 O ATOM 210 CB PRO A 14 -2.044 12.087 -12.929 1.00 62.13 C ATOM 211 CG PRO A 14 -0.914 11.293 -13.489 1.00 32.13 C ATOM 212 CD PRO A 14 -0.339 10.521 -12.334 1.00 5.12 C ATOM 213 HA PRO A 14 -2.952 11.839 -10.998 1.00 22.33 H ATOM 214 HB2 PRO A 14 -2.805 12.271 -13.674 1.00 35.21 H ATOM 215 HB3 PRO A 14 -1.701 13.024 -12.517 1.00 53.24 H ATOM 216 HG2 PRO A 14 -1.280 10.617 -14.246 1.00 72.13 H ATOM 217 HG3 PRO A 14 -0.170 11.956 -13.904 1.00 2.43 H ATOM 218 HD2 PRO A 14 0.017 9.556 -12.664 1.00 55.22 H ATOM 219 HD3 PRO A 14 0.460 11.079 -11.867 1.00 53.42 H ATOM 220 N PHE A 15 -3.555 9.100 -12.548 1.00 64.44 N ATOM 221 CA PHE A 15 -4.593 8.204 -13.045 1.00 23.22 C ATOM 222 C PHE A 15 -5.204 7.395 -11.904 1.00 60.14 C ATOM 223 O PHE A 15 -6.424 7.260 -11.810 1.00 33.11 O ATOM 224 CB PHE A 15 -4.018 7.260 -14.104 1.00 14.44 C ATOM 225 CG PHE A 15 -5.025 6.828 -15.131 1.00 12.20 C ATOM 226 CD1 PHE A 15 -5.831 5.724 -14.908 1.00 74.42 C ATOM 227 CD2 PHE A 15 -5.166 7.527 -16.319 1.00 61.11 C ATOM 228 CE1 PHE A 15 -6.758 5.323 -15.852 1.00 51.43 C ATOM 229 CE2 PHE A 15 -6.091 7.132 -17.267 1.00 32.31 C ATOM 230 CZ PHE A 15 -6.889 6.029 -17.032 1.00 50.15 C ATOM 231 H PHE A 15 -2.659 8.742 -12.371 1.00 50.22 H ATOM 232 HA PHE A 15 -5.364 8.809 -13.495 1.00 13.23 H ATOM 233 HB2 PHE A 15 -3.212 7.758 -14.620 1.00 5.43 H ATOM 234 HB3 PHE A 15 -3.637 6.375 -13.618 1.00 12.05 H ATOM 235 HD1 PHE A 15 -5.731 5.171 -13.985 1.00 51.34 H ATOM 236 HD2 PHE A 15 -4.542 8.390 -16.503 1.00 50.43 H ATOM 237 HE1 PHE A 15 -7.381 4.461 -15.667 1.00 1.14 H ATOM 238 HE2 PHE A 15 -6.191 7.686 -18.188 1.00 62.14 H ATOM 239 HZ PHE A 15 -7.612 5.718 -17.772 1.00 10.23 H ATOM 240 N ILE A 16 -4.347 6.859 -11.042 1.00 32.12 N ATOM 241 CA ILE A 16 -4.802 6.064 -9.908 1.00 33.00 C ATOM 242 C ILE A 16 -5.599 6.915 -8.924 1.00 64.34 C ATOM 243 O ILE A 16 -6.492 6.418 -8.238 1.00 40.11 O ATOM 244 CB ILE A 16 -3.620 5.413 -9.166 1.00 61.02 C ATOM 245 CG1 ILE A 16 -4.127 4.369 -8.169 1.00 55.31 C ATOM 246 CG2 ILE A 16 -2.792 6.473 -8.456 1.00 1.42 C ATOM 247 CD1 ILE A 16 -3.998 2.946 -8.665 1.00 45.23 C ATOM 248 H ILE A 16 -3.387 7.002 -11.171 1.00 24.05 H ATOM 249 HA ILE A 16 -5.440 5.278 -10.287 1.00 12.43 H ATOM 250 HB ILE A 16 -2.990 4.927 -9.895 1.00 42.44 H ATOM 251 HG12 ILE A 16 -3.565 4.453 -7.252 1.00 74.25 H ATOM 252 HG13 ILE A 16 -5.172 4.556 -7.964 1.00 41.25 H ATOM 253 HG21 ILE A 16 -2.513 7.244 -9.160 1.00 31.42 H ATOM 254 HG22 ILE A 16 -3.374 6.910 -7.658 1.00 73.33 H ATOM 255 HG23 ILE A 16 -1.902 6.021 -8.046 1.00 64.31 H ATOM 256 HD11 ILE A 16 -3.554 2.335 -7.894 1.00 23.42 H ATOM 257 HD12 ILE A 16 -4.974 2.561 -8.915 1.00 35.45 H ATOM 258 HD13 ILE A 16 -3.369 2.928 -9.544 1.00 63.31 H ATOM 259 N LYS A 17 -5.270 8.201 -8.862 1.00 71.31 N ATOM 260 CA LYS A 17 -5.956 9.123 -7.965 1.00 42.43 C ATOM 261 C LYS A 17 -7.338 9.478 -8.503 1.00 54.41 C ATOM 262 O LYS A 17 -8.199 9.959 -7.765 1.00 22.42 O ATOM 263 CB LYS A 17 -5.127 10.396 -7.779 1.00 11.41 C ATOM 264 CG LYS A 17 -5.152 11.320 -8.984 1.00 51.32 C ATOM 265 CD LYS A 17 -4.295 12.554 -8.759 1.00 4.32 C ATOM 266 CE LYS A 17 -4.874 13.444 -7.669 1.00 43.04 C ATOM 267 NZ LYS A 17 -6.225 13.956 -8.031 1.00 65.11 N ATOM 268 H LYS A 17 -4.549 8.538 -9.434 1.00 63.25 H ATOM 269 HA LYS A 17 -6.069 8.635 -7.010 1.00 31.45 H ATOM 270 HB2 LYS A 17 -5.510 10.939 -6.927 1.00 42.32 H ATOM 271 HB3 LYS A 17 -4.101 10.118 -7.586 1.00 41.41 H ATOM 272 HG2 LYS A 17 -4.776 10.786 -9.844 1.00 1.10 H ATOM 273 HG3 LYS A 17 -6.171 11.630 -9.168 1.00 33.21 H ATOM 274 HD2 LYS A 17 -3.303 12.244 -8.465 1.00 2.40 H ATOM 275 HD3 LYS A 17 -4.240 13.117 -9.680 1.00 42.10 H ATOM 276 HE2 LYS A 17 -4.947 12.872 -6.757 1.00 53.32 H ATOM 277 HE3 LYS A 17 -4.209 14.282 -7.516 1.00 75.25 H ATOM 278 HZ1 LYS A 17 -6.910 13.174 -8.048 1.00 30.23 H ATOM 279 HZ2 LYS A 17 -6.199 14.399 -8.972 1.00 23.14 H ATOM 280 HZ3 LYS A 17 -6.537 14.662 -7.335 1.00 53.52 H ATOM 281 N LYS A 18 -7.546 9.238 -9.793 1.00 60.12 N ATOM 282 CA LYS A 18 -8.825 9.529 -10.430 1.00 42.32 C ATOM 283 C LYS A 18 -9.895 8.541 -9.978 1.00 53.14 C ATOM 284 O LYS A 18 -11.087 8.851 -9.995 1.00 62.33 O ATOM 285 CB LYS A 18 -8.682 9.482 -11.953 1.00 61.21 C ATOM 286 CG LYS A 18 -9.920 9.954 -12.695 1.00 73.33 C ATOM 287 CD LYS A 18 -9.690 9.991 -14.197 1.00 33.32 C ATOM 288 CE LYS A 18 -8.936 11.244 -14.614 1.00 71.34 C ATOM 289 NZ LYS A 18 -9.818 12.443 -14.629 1.00 14.33 N ATOM 290 H LYS A 18 -6.821 8.854 -10.330 1.00 61.14 H ATOM 291 HA LYS A 18 -9.123 10.524 -10.136 1.00 10.10 H ATOM 292 HB2 LYS A 18 -7.852 10.109 -12.245 1.00 32.24 H ATOM 293 HB3 LYS A 18 -8.475 8.464 -12.252 1.00 10.14 H ATOM 294 HG2 LYS A 18 -10.735 9.278 -12.483 1.00 74.35 H ATOM 295 HG3 LYS A 18 -10.176 10.947 -12.355 1.00 11.03 H ATOM 296 HD2 LYS A 18 -9.114 9.124 -14.486 1.00 1.44 H ATOM 297 HD3 LYS A 18 -10.647 9.973 -14.699 1.00 72.53 H ATOM 298 HE2 LYS A 18 -8.128 11.410 -13.919 1.00 1.21 H ATOM 299 HE3 LYS A 18 -8.533 11.092 -15.605 1.00 30.11 H ATOM 300 HZ1 LYS A 18 -9.607 13.032 -15.460 1.00 74.30 H ATOM 301 HZ2 LYS A 18 -9.666 13.009 -13.770 1.00 4.41 H ATOM 302 HZ3 LYS A 18 -10.816 12.153 -14.667 1.00 31.12 H ATOM 303 N PHE A 19 -9.463 7.351 -9.574 1.00 0.53 N ATOM 304 CA PHE A 19 -10.385 6.318 -9.117 1.00 3.04 C ATOM 305 C PHE A 19 -9.775 5.512 -7.974 1.00 3.05 C ATOM 306 O PHE A 19 -10.001 4.307 -7.859 1.00 51.20 O ATOM 307 CB PHE A 19 -10.753 5.386 -10.273 1.00 14.12 C ATOM 308 CG PHE A 19 -11.826 5.937 -11.168 1.00 34.21 C ATOM 309 CD1 PHE A 19 -11.504 6.776 -12.223 1.00 31.25 C ATOM 310 CD2 PHE A 19 -13.157 5.615 -10.955 1.00 52.21 C ATOM 311 CE1 PHE A 19 -12.490 7.284 -13.047 1.00 43.51 C ATOM 312 CE2 PHE A 19 -14.147 6.121 -11.777 1.00 32.43 C ATOM 313 CZ PHE A 19 -13.813 6.956 -12.825 1.00 23.43 C ATOM 314 H PHE A 19 -8.501 7.164 -9.583 1.00 63.02 H ATOM 315 HA PHE A 19 -11.278 6.806 -8.760 1.00 54.31 H ATOM 316 HB2 PHE A 19 -9.876 5.209 -10.877 1.00 54.41 H ATOM 317 HB3 PHE A 19 -11.104 4.447 -9.871 1.00 1.40 H ATOM 318 HD1 PHE A 19 -10.470 7.033 -12.398 1.00 40.15 H ATOM 319 HD2 PHE A 19 -13.420 4.961 -10.135 1.00 40.42 H ATOM 320 HE1 PHE A 19 -12.226 7.937 -13.866 1.00 64.10 H ATOM 321 HE2 PHE A 19 -15.180 5.861 -11.600 1.00 15.22 H ATOM 322 HZ PHE A 19 -14.585 7.352 -13.467 1.00 45.04 H ATOM 323 N TYR A 20 -9.000 6.186 -7.131 1.00 21.44 N ATOM 324 CA TYR A 20 -8.354 5.533 -5.998 1.00 73.30 C ATOM 325 C TYR A 20 -9.389 5.033 -4.995 1.00 33.22 C ATOM 326 O TYR A 20 -9.177 4.029 -4.313 1.00 54.53 O ATOM 327 CB TYR A 20 -7.386 6.497 -5.311 1.00 21.02 C ATOM 328 CG TYR A 20 -6.357 5.807 -4.444 1.00 71.31 C ATOM 329 CD1 TYR A 20 -5.537 4.812 -4.963 1.00 14.12 C ATOM 330 CD2 TYR A 20 -6.204 6.150 -3.106 1.00 52.04 C ATOM 331 CE1 TYR A 20 -4.597 4.178 -4.174 1.00 43.33 C ATOM 332 CE2 TYR A 20 -5.265 5.523 -2.311 1.00 31.43 C ATOM 333 CZ TYR A 20 -4.464 4.537 -2.849 1.00 52.21 C ATOM 334 OH TYR A 20 -3.527 3.909 -2.061 1.00 14.23 O ATOM 335 H TYR A 20 -8.857 7.144 -7.274 1.00 52.41 H ATOM 336 HA TYR A 20 -7.798 4.687 -6.375 1.00 43.45 H ATOM 337 HB2 TYR A 20 -6.859 7.064 -6.063 1.00 24.44 H ATOM 338 HB3 TYR A 20 -7.947 7.174 -4.684 1.00 54.41 H ATOM 339 HD1 TYR A 20 -5.644 4.534 -6.001 1.00 65.25 H ATOM 340 HD2 TYR A 20 -6.833 6.922 -2.687 1.00 51.35 H ATOM 341 HE1 TYR A 20 -3.969 3.407 -4.596 1.00 11.02 H ATOM 342 HE2 TYR A 20 -5.161 5.803 -1.273 1.00 11.02 H ATOM 343 HH TYR A 20 -3.803 3.951 -1.142 1.00 3.21 H ATOM 344 N LYS A 21 -10.511 5.740 -4.910 1.00 71.22 N ATOM 345 CA LYS A 21 -11.582 5.369 -3.993 1.00 11.31 C ATOM 346 C LYS A 21 -12.021 3.927 -4.223 1.00 21.30 C ATOM 347 O LYS A 21 -12.253 3.181 -3.272 1.00 71.42 O ATOM 348 CB LYS A 21 -12.777 6.310 -4.164 1.00 43.44 C ATOM 349 CG LYS A 21 -13.698 6.349 -2.958 1.00 14.43 C ATOM 350 CD LYS A 21 -14.579 7.588 -2.969 1.00 31.44 C ATOM 351 CE LYS A 21 -15.799 7.412 -2.077 1.00 71.44 C ATOM 352 NZ LYS A 21 -15.426 7.318 -0.639 1.00 12.43 N ATOM 353 H LYS A 21 -10.622 6.530 -5.480 1.00 3.31 H ATOM 354 HA LYS A 21 -11.204 5.462 -2.986 1.00 64.42 H ATOM 355 HB2 LYS A 21 -12.409 7.310 -4.343 1.00 53.21 H ATOM 356 HB3 LYS A 21 -13.352 5.989 -5.021 1.00 15.35 H ATOM 357 HG2 LYS A 21 -14.329 5.473 -2.969 1.00 24.42 H ATOM 358 HG3 LYS A 21 -13.099 6.353 -2.058 1.00 60.14 H ATOM 359 HD2 LYS A 21 -14.006 8.430 -2.612 1.00 4.11 H ATOM 360 HD3 LYS A 21 -14.908 7.776 -3.981 1.00 3.10 H ATOM 361 HE2 LYS A 21 -16.455 8.257 -2.216 1.00 51.23 H ATOM 362 HE3 LYS A 21 -16.312 6.507 -2.367 1.00 34.50 H ATOM 363 HZ1 LYS A 21 -16.053 6.647 -0.150 1.00 62.03 H ATOM 364 HZ2 LYS A 21 -15.515 8.250 -0.185 1.00 40.15 H ATOM 365 HZ3 LYS A 21 -14.444 6.991 -0.544 1.00 63.04 H ATOM 366 N GLN A 22 -12.131 3.541 -5.490 1.00 43.32 N ATOM 367 CA GLN A 22 -12.541 2.187 -5.844 1.00 2.44 C ATOM 368 C GLN A 22 -11.349 1.236 -5.826 1.00 72.35 C ATOM 369 O GLN A 22 -11.429 0.135 -5.280 1.00 15.20 O ATOM 370 CB GLN A 22 -13.199 2.175 -7.225 1.00 4.24 C ATOM 371 CG GLN A 22 -14.425 3.068 -7.322 1.00 41.33 C ATOM 372 CD GLN A 22 -15.323 2.962 -6.105 1.00 43.04 C ATOM 373 OE1 GLN A 22 -15.631 3.963 -5.458 1.00 30.12 O ATOM 374 NE2 GLN A 22 -15.748 1.745 -5.788 1.00 30.13 N ATOM 375 H GLN A 22 -11.932 4.182 -6.204 1.00 1.13 H ATOM 376 HA GLN A 22 -13.260 1.857 -5.110 1.00 20.24 H ATOM 377 HB2 GLN A 22 -12.478 2.508 -7.956 1.00 61.15 H ATOM 378 HB3 GLN A 22 -13.497 1.164 -7.459 1.00 12.01 H ATOM 379 HG2 GLN A 22 -14.101 4.094 -7.422 1.00 62.45 H ATOM 380 HG3 GLN A 22 -14.992 2.784 -8.196 1.00 51.23 H ATOM 381 HE21 GLN A 22 -15.461 0.994 -6.349 1.00 22.43 H ATOM 382 HE22 GLN A 22 -16.329 1.647 -5.006 1.00 22.04 H ATOM 383 N ILE A 23 -10.246 1.667 -6.428 1.00 63.52 N ATOM 384 CA ILE A 23 -9.038 0.853 -6.481 1.00 64.40 C ATOM 385 C ILE A 23 -8.642 0.366 -5.091 1.00 65.23 C ATOM 386 O ILE A 23 -8.636 -0.835 -4.821 1.00 53.14 O ATOM 387 CB ILE A 23 -7.860 1.633 -7.094 1.00 63.45 C ATOM 388 CG1 ILE A 23 -8.201 2.078 -8.518 1.00 63.21 C ATOM 389 CG2 ILE A 23 -6.599 0.780 -7.088 1.00 14.43 C ATOM 390 CD1 ILE A 23 -7.490 3.344 -8.942 1.00 13.35 C ATOM 391 H ILE A 23 -10.244 2.553 -6.846 1.00 24.23 H ATOM 392 HA ILE A 23 -9.241 -0.005 -7.107 1.00 3.52 H ATOM 393 HB ILE A 23 -7.679 2.505 -6.486 1.00 3.14 H ATOM 394 HG12 ILE A 23 -7.925 1.297 -9.209 1.00 23.33 H ATOM 395 HG13 ILE A 23 -9.264 2.254 -8.587 1.00 15.22 H ATOM 396 HG21 ILE A 23 -6.297 0.593 -6.068 1.00 33.12 H ATOM 397 HG22 ILE A 23 -6.798 -0.159 -7.582 1.00 2.23 H ATOM 398 HG23 ILE A 23 -5.809 1.301 -7.607 1.00 54.33 H ATOM 399 HD11 ILE A 23 -6.739 3.106 -9.680 1.00 41.50 H ATOM 400 HD12 ILE A 23 -8.205 4.035 -9.363 1.00 21.11 H ATOM 401 HD13 ILE A 23 -7.017 3.796 -8.081 1.00 54.43 H ATOM 402 N MET A 24 -8.312 1.307 -4.212 1.00 60.44 N ATOM 403 CA MET A 24 -7.917 0.973 -2.849 1.00 15.35 C ATOM 404 C MET A 24 -8.980 0.115 -2.170 1.00 21.52 C ATOM 405 O MET A 24 -8.673 -0.679 -1.280 1.00 53.33 O ATOM 406 CB MET A 24 -7.681 2.249 -2.037 1.00 61.52 C ATOM 407 CG MET A 24 -8.963 2.955 -1.628 1.00 51.10 C ATOM 408 SD MET A 24 -8.720 4.716 -1.326 1.00 42.02 S ATOM 409 CE MET A 24 -8.813 4.769 0.462 1.00 50.13 C ATOM 410 H MET A 24 -8.335 2.247 -4.486 1.00 52.34 H ATOM 411 HA MET A 24 -6.996 0.413 -2.898 1.00 70.11 H ATOM 412 HB2 MET A 24 -7.134 1.995 -1.142 1.00 25.03 H ATOM 413 HB3 MET A 24 -7.091 2.933 -2.628 1.00 53.43 H ATOM 414 HG2 MET A 24 -9.691 2.837 -2.417 1.00 11.52 H ATOM 415 HG3 MET A 24 -9.337 2.497 -0.725 1.00 33.15 H ATOM 416 HE1 MET A 24 -7.818 4.705 0.876 1.00 1.23 H ATOM 417 HE2 MET A 24 -9.273 5.696 0.771 1.00 50.05 H ATOM 418 HE3 MET A 24 -9.405 3.937 0.816 1.00 43.22 H ATOM 419 N GLN A 25 -10.228 0.279 -2.595 1.00 52.23 N ATOM 420 CA GLN A 25 -11.335 -0.481 -2.027 1.00 10.12 C ATOM 421 C GLN A 25 -11.338 -1.913 -2.551 1.00 22.11 C ATOM 422 O GLN A 25 -11.779 -2.835 -1.865 1.00 30.32 O ATOM 423 CB GLN A 25 -12.667 0.197 -2.353 1.00 32.42 C ATOM 424 CG GLN A 25 -13.108 1.207 -1.306 1.00 42.44 C ATOM 425 CD GLN A 25 -14.454 1.827 -1.624 1.00 53.11 C ATOM 426 OE1 GLN A 25 -15.164 1.372 -2.522 1.00 3.11 O ATOM 427 NE2 GLN A 25 -14.814 2.872 -0.887 1.00 74.53 N ATOM 428 H GLN A 25 -10.409 0.927 -3.307 1.00 61.14 H ATOM 429 HA GLN A 25 -11.206 -0.503 -0.955 1.00 62.24 H ATOM 430 HB2 GLN A 25 -12.576 0.707 -3.300 1.00 4.23 H ATOM 431 HB3 GLN A 25 -13.432 -0.561 -2.434 1.00 74.30 H ATOM 432 HG2 GLN A 25 -13.175 0.711 -0.350 1.00 24.51 H ATOM 433 HG3 GLN A 25 -12.370 1.994 -1.251 1.00 64.14 H ATOM 434 HE21 GLN A 25 -14.198 3.180 -0.190 1.00 43.01 H ATOM 435 HE22 GLN A 25 -15.679 3.292 -1.072 1.00 31.14 H ATOM 436 N PHE A 26 -10.843 -2.092 -3.771 1.00 62.41 N ATOM 437 CA PHE A 26 -10.789 -3.413 -4.388 1.00 54.40 C ATOM 438 C PHE A 26 -9.676 -4.255 -3.774 1.00 24.54 C ATOM 439 O PHE A 26 -9.784 -5.479 -3.688 1.00 71.11 O ATOM 440 CB PHE A 26 -10.574 -3.285 -5.898 1.00 32.25 C ATOM 441 CG PHE A 26 -11.761 -2.723 -6.627 1.00 21.31 C ATOM 442 CD1 PHE A 26 -13.038 -3.195 -6.367 1.00 5.43 C ATOM 443 CD2 PHE A 26 -11.600 -1.724 -7.573 1.00 64.02 C ATOM 444 CE1 PHE A 26 -14.132 -2.680 -7.036 1.00 2.52 C ATOM 445 CE2 PHE A 26 -12.690 -1.205 -8.245 1.00 51.20 C ATOM 446 CZ PHE A 26 -13.958 -1.684 -7.977 1.00 4.00 C ATOM 447 H PHE A 26 -10.506 -1.318 -4.269 1.00 2.22 H ATOM 448 HA PHE A 26 -11.735 -3.900 -4.208 1.00 22.33 H ATOM 449 HB2 PHE A 26 -9.734 -2.633 -6.080 1.00 43.33 H ATOM 450 HB3 PHE A 26 -10.363 -4.261 -6.307 1.00 62.32 H ATOM 451 HD1 PHE A 26 -13.175 -3.974 -5.630 1.00 61.23 H ATOM 452 HD2 PHE A 26 -10.609 -1.349 -7.785 1.00 31.02 H ATOM 453 HE1 PHE A 26 -15.121 -3.057 -6.824 1.00 13.44 H ATOM 454 HE2 PHE A 26 -12.551 -0.427 -8.981 1.00 12.33 H ATOM 455 HZ PHE A 26 -14.811 -1.280 -8.500 1.00 51.33 H ATOM 456 N ILE A 27 -8.606 -3.592 -3.348 1.00 10.00 N ATOM 457 CA ILE A 27 -7.473 -4.279 -2.741 1.00 62.22 C ATOM 458 C ILE A 27 -7.893 -5.021 -1.476 1.00 45.45 C ATOM 459 O ILE A 27 -7.620 -6.210 -1.322 1.00 62.32 O ATOM 460 CB ILE A 27 -6.339 -3.297 -2.394 1.00 44.24 C ATOM 461 CG1 ILE A 27 -5.872 -2.558 -3.651 1.00 33.14 C ATOM 462 CG2 ILE A 27 -5.177 -4.036 -1.746 1.00 55.12 C ATOM 463 CD1 ILE A 27 -5.084 -1.301 -3.355 1.00 30.41 C ATOM 464 H ILE A 27 -8.579 -2.617 -3.444 1.00 24.44 H ATOM 465 HA ILE A 27 -7.096 -4.995 -3.457 1.00 65.31 H ATOM 466 HB ILE A 27 -6.719 -2.579 -1.684 1.00 22.24 H ATOM 467 HG12 ILE A 27 -5.244 -3.213 -4.234 1.00 35.13 H ATOM 468 HG13 ILE A 27 -6.736 -2.279 -4.236 1.00 53.12 H ATOM 469 HG21 ILE A 27 -5.222 -5.081 -2.014 1.00 65.24 H ATOM 470 HG22 ILE A 27 -4.245 -3.615 -2.093 1.00 34.44 H ATOM 471 HG23 ILE A 27 -5.241 -3.937 -0.673 1.00 51.41 H ATOM 472 HD11 ILE A 27 -5.378 -0.910 -2.392 1.00 43.22 H ATOM 473 HD12 ILE A 27 -4.029 -1.531 -3.345 1.00 34.21 H ATOM 474 HD13 ILE A 27 -5.284 -0.563 -4.119 1.00 31.34 H ATOM 475 N GLY A 28 -8.560 -4.309 -0.573 1.00 51.44 N ATOM 476 CA GLY A 28 -9.009 -4.916 0.666 1.00 43.21 C ATOM 477 C GLY A 28 -9.983 -6.054 0.435 1.00 52.44 C ATOM 478 O GLY A 28 -10.185 -6.893 1.311 1.00 32.32 O ATOM 479 H GLY A 28 -8.749 -3.363 -0.750 1.00 73.23 H ATOM 480 HA2 GLY A 28 -8.150 -5.294 1.200 1.00 11.13 H ATOM 481 HA3 GLY A 28 -9.492 -4.161 1.269 1.00 43.10 H ATOM 482 N GLN A 29 -10.589 -6.080 -0.748 1.00 35.21 N ATOM 483 CA GLN A 29 -11.550 -7.123 -1.090 1.00 10.50 C ATOM 484 C GLN A 29 -10.837 -8.400 -1.521 1.00 22.05 C ATOM 485 O GLN A 29 -11.374 -9.499 -1.385 1.00 2.41 O ATOM 486 CB GLN A 29 -12.480 -6.642 -2.206 1.00 24.51 C ATOM 487 CG GLN A 29 -13.367 -7.739 -2.773 1.00 23.23 C ATOM 488 CD GLN A 29 -14.325 -8.305 -1.743 1.00 53.34 C ATOM 489 OE1 GLN A 29 -14.669 -7.639 -0.766 1.00 51.34 O ATOM 490 NE2 GLN A 29 -14.763 -9.540 -1.957 1.00 40.04 N ATOM 491 H GLN A 29 -10.387 -5.383 -1.405 1.00 5.11 H ATOM 492 HA GLN A 29 -12.138 -7.333 -0.210 1.00 12.23 H ATOM 493 HB2 GLN A 29 -13.114 -5.860 -1.818 1.00 13.01 H ATOM 494 HB3 GLN A 29 -11.880 -6.243 -3.011 1.00 11.04 H ATOM 495 HG2 GLN A 29 -13.942 -7.333 -3.592 1.00 5.44 H ATOM 496 HG3 GLN A 29 -12.739 -8.539 -3.137 1.00 73.21 H ATOM 497 HE21 GLN A 29 -14.445 -10.011 -2.757 1.00 34.14 H ATOM 498 HE22 GLN A 29 -15.383 -9.931 -1.308 1.00 3.52 H ATOM 499 N GLY A 30 -9.623 -8.248 -2.041 1.00 3.31 N ATOM 500 CA GLY A 30 -8.856 -9.397 -2.484 1.00 20.51 C ATOM 501 C GLY A 30 -8.789 -9.503 -3.995 1.00 13.34 C ATOM 502 O GLY A 30 -8.636 -10.595 -4.541 1.00 75.11 O ATOM 503 H GLY A 30 -9.245 -7.347 -2.125 1.00 23.33 H ATOM 504 HA2 GLY A 30 -7.852 -9.319 -2.094 1.00 51.22 H ATOM 505 HA3 GLY A 30 -9.314 -10.294 -2.092 1.00 52.23 H ATOM 506 N TRP A 31 -8.906 -8.366 -4.671 1.00 4.43 N ATOM 507 CA TRP A 31 -8.859 -8.335 -6.128 1.00 74.02 C ATOM 508 C TRP A 31 -7.419 -8.356 -6.628 1.00 0.53 C ATOM 509 O TRP A 31 -6.566 -7.624 -6.124 1.00 43.03 O ATOM 510 CB TRP A 31 -9.578 -7.092 -6.656 1.00 5.12 C ATOM 511 CG TRP A 31 -11.067 -7.248 -6.718 1.00 41.20 C ATOM 512 CD1 TRP A 31 -11.836 -8.085 -5.961 1.00 4.12 C ATOM 513 CD2 TRP A 31 -11.966 -6.549 -7.586 1.00 31.12 C ATOM 514 NE1 TRP A 31 -13.159 -7.949 -6.306 1.00 3.34 N ATOM 515 CE2 TRP A 31 -13.265 -7.012 -7.299 1.00 74.04 C ATOM 516 CE3 TRP A 31 -11.801 -5.576 -8.575 1.00 63.21 C ATOM 517 CZ2 TRP A 31 -14.389 -6.535 -7.968 1.00 74.14 C ATOM 518 CZ3 TRP A 31 -12.917 -5.104 -9.238 1.00 73.13 C ATOM 519 CH2 TRP A 31 -14.198 -5.583 -8.932 1.00 52.14 C ATOM 520 H TRP A 31 -9.025 -7.526 -4.178 1.00 75.35 H ATOM 521 HA TRP A 31 -9.367 -9.215 -6.494 1.00 34.45 H ATOM 522 HB2 TRP A 31 -9.357 -6.255 -6.010 1.00 62.03 H ATOM 523 HB3 TRP A 31 -9.222 -6.876 -7.653 1.00 72.21 H ATOM 524 HD1 TRP A 31 -11.447 -8.752 -5.207 1.00 24.01 H ATOM 525 HE1 TRP A 31 -13.905 -8.441 -5.903 1.00 61.44 H ATOM 526 HE3 TRP A 31 -10.822 -5.195 -8.825 1.00 43.40 H ATOM 527 HZ2 TRP A 31 -15.383 -6.894 -7.744 1.00 14.34 H ATOM 528 HZ3 TRP A 31 -12.809 -4.352 -10.006 1.00 60.34 H ATOM 529 HH2 TRP A 31 -15.042 -5.186 -9.476 1.00 4.12 H ATOM 530 N THR A 32 -7.153 -9.198 -7.621 1.00 54.03 N ATOM 531 CA THR A 32 -5.816 -9.314 -8.188 1.00 63.01 C ATOM 532 C THR A 32 -5.496 -8.127 -9.090 1.00 22.32 C ATOM 533 O THR A 32 -6.354 -7.284 -9.349 1.00 15.52 O ATOM 534 CB THR A 32 -5.659 -10.616 -8.997 1.00 12.43 C ATOM 535 OG1 THR A 32 -6.486 -10.569 -10.165 1.00 32.12 O ATOM 536 CG2 THR A 32 -6.032 -11.825 -8.153 1.00 32.11 C ATOM 537 H THR A 32 -7.876 -9.755 -7.980 1.00 45.33 H ATOM 538 HA THR A 32 -5.108 -9.335 -7.372 1.00 13.32 H ATOM 539 HB THR A 32 -4.626 -10.711 -9.300 1.00 33.33 H ATOM 540 HG1 THR A 32 -6.585 -11.455 -10.522 1.00 54.13 H ATOM 541 HG21 THR A 32 -5.496 -11.790 -7.216 1.00 64.13 H ATOM 542 HG22 THR A 32 -5.772 -12.729 -8.684 1.00 3.41 H ATOM 543 HG23 THR A 32 -7.094 -11.815 -7.959 1.00 52.43 H ATOM 544 N ILE A 33 -4.257 -8.069 -9.566 1.00 4.14 N ATOM 545 CA ILE A 33 -3.825 -6.986 -10.440 1.00 41.23 C ATOM 546 C ILE A 33 -4.665 -6.939 -11.712 1.00 44.43 C ATOM 547 O ILE A 33 -4.939 -5.864 -12.248 1.00 22.42 O ATOM 548 CB ILE A 33 -2.340 -7.130 -10.824 1.00 12.43 C ATOM 549 CG1 ILE A 33 -1.466 -7.151 -9.568 1.00 34.21 C ATOM 550 CG2 ILE A 33 -1.920 -5.997 -11.749 1.00 30.04 C ATOM 551 CD1 ILE A 33 -0.077 -7.698 -9.808 1.00 62.31 C ATOM 552 H ILE A 33 -3.618 -8.771 -9.323 1.00 61.23 H ATOM 553 HA ILE A 33 -3.949 -6.056 -9.905 1.00 13.43 H ATOM 554 HB ILE A 33 -2.217 -8.061 -11.355 1.00 53.33 H ATOM 555 HG12 ILE A 33 -1.366 -6.146 -9.190 1.00 23.24 H ATOM 556 HG13 ILE A 33 -1.942 -7.768 -8.818 1.00 43.45 H ATOM 557 HG21 ILE A 33 -1.714 -6.393 -12.732 1.00 23.31 H ATOM 558 HG22 ILE A 33 -2.717 -5.272 -11.814 1.00 10.31 H ATOM 559 HG23 ILE A 33 -1.032 -5.523 -11.358 1.00 33.22 H ATOM 560 HD11 ILE A 33 0.575 -6.899 -10.128 1.00 40.14 H ATOM 561 HD12 ILE A 33 0.303 -8.130 -8.895 1.00 25.32 H ATOM 562 HD13 ILE A 33 -0.117 -8.458 -10.576 1.00 1.12 H ATOM 563 N ASP A 34 -5.071 -8.110 -12.190 1.00 14.53 N ATOM 564 CA ASP A 34 -5.883 -8.202 -13.398 1.00 31.44 C ATOM 565 C ASP A 34 -7.299 -7.697 -13.141 1.00 13.30 C ATOM 566 O ASP A 34 -7.900 -7.047 -13.996 1.00 12.10 O ATOM 567 CB ASP A 34 -5.927 -9.647 -13.898 1.00 51.14 C ATOM 568 CG ASP A 34 -4.685 -10.026 -14.681 1.00 74.32 C ATOM 569 OD1 ASP A 34 -4.296 -9.257 -15.585 1.00 32.44 O ATOM 570 OD2 ASP A 34 -4.103 -11.093 -14.391 1.00 54.31 O ATOM 571 H ASP A 34 -4.820 -8.931 -11.718 1.00 34.42 H ATOM 572 HA ASP A 34 -5.425 -7.583 -14.154 1.00 2.04 H ATOM 573 HB2 ASP A 34 -6.013 -10.312 -13.052 1.00 31.35 H ATOM 574 HB3 ASP A 34 -6.787 -9.773 -14.539 1.00 15.01 H ATOM 575 N GLN A 35 -7.826 -8.001 -11.959 1.00 4.40 N ATOM 576 CA GLN A 35 -9.172 -7.578 -11.591 1.00 42.03 C ATOM 577 C GLN A 35 -9.347 -6.077 -11.799 1.00 21.24 C ATOM 578 O GLN A 35 -10.268 -5.640 -12.489 1.00 43.42 O ATOM 579 CB GLN A 35 -9.463 -7.941 -10.134 1.00 40.02 C ATOM 580 CG GLN A 35 -10.175 -9.274 -9.970 1.00 24.22 C ATOM 581 CD GLN A 35 -9.281 -10.456 -10.289 1.00 64.10 C ATOM 582 OE1 GLN A 35 -8.772 -10.581 -11.403 1.00 65.22 O ATOM 583 NE2 GLN A 35 -9.084 -11.332 -9.310 1.00 55.32 N ATOM 584 H GLN A 35 -7.297 -8.521 -11.320 1.00 23.21 H ATOM 585 HA GLN A 35 -9.869 -8.100 -12.229 1.00 23.41 H ATOM 586 HB2 GLN A 35 -8.530 -7.986 -9.593 1.00 65.24 H ATOM 587 HB3 GLN A 35 -10.084 -7.171 -9.701 1.00 1.30 H ATOM 588 HG2 GLN A 35 -10.512 -9.364 -8.948 1.00 33.10 H ATOM 589 HG3 GLN A 35 -11.027 -9.296 -10.633 1.00 20.43 H ATOM 590 HE21 GLN A 35 -9.523 -11.168 -8.449 1.00 34.23 H ATOM 591 HE22 GLN A 35 -8.512 -12.105 -9.489 1.00 62.41 H ATOM 592 N ILE A 36 -8.458 -5.294 -11.196 1.00 73.23 N ATOM 593 CA ILE A 36 -8.515 -3.843 -11.316 1.00 2.40 C ATOM 594 C ILE A 36 -8.073 -3.388 -12.703 1.00 5.44 C ATOM 595 O ILE A 36 -8.738 -2.572 -13.340 1.00 3.22 O ATOM 596 CB ILE A 36 -7.633 -3.156 -10.257 1.00 5.31 C ATOM 597 CG1 ILE A 36 -8.083 -3.554 -8.850 1.00 10.00 C ATOM 598 CG2 ILE A 36 -7.681 -1.645 -10.427 1.00 1.55 C ATOM 599 CD1 ILE A 36 -7.372 -4.776 -8.311 1.00 55.22 C ATOM 600 H ILE A 36 -7.748 -5.702 -10.660 1.00 25.34 H ATOM 601 HA ILE A 36 -9.538 -3.535 -11.157 1.00 74.03 H ATOM 602 HB ILE A 36 -6.613 -3.478 -10.406 1.00 13.03 H ATOM 603 HG12 ILE A 36 -7.894 -2.736 -8.173 1.00 51.11 H ATOM 604 HG13 ILE A 36 -9.143 -3.765 -8.866 1.00 25.31 H ATOM 605 HG21 ILE A 36 -6.790 -1.311 -10.939 1.00 33.23 H ATOM 606 HG22 ILE A 36 -8.551 -1.376 -11.007 1.00 4.40 H ATOM 607 HG23 ILE A 36 -7.736 -1.175 -9.456 1.00 45.42 H ATOM 608 HD11 ILE A 36 -7.862 -5.667 -8.675 1.00 63.24 H ATOM 609 HD12 ILE A 36 -6.344 -4.769 -8.639 1.00 51.22 H ATOM 610 HD13 ILE A 36 -7.406 -4.764 -7.231 1.00 64.21 H ATOM 611 N GLU A 37 -6.946 -3.923 -13.164 1.00 14.32 N ATOM 612 CA GLU A 37 -6.416 -3.572 -14.476 1.00 52.21 C ATOM 613 C GLU A 37 -7.475 -3.759 -15.559 1.00 13.14 C ATOM 614 O GLU A 37 -7.462 -3.074 -16.582 1.00 12.24 O ATOM 615 CB GLU A 37 -5.186 -4.423 -14.798 1.00 72.01 C ATOM 616 CG GLU A 37 -3.911 -3.924 -14.140 1.00 11.43 C ATOM 617 CD GLU A 37 -3.454 -2.587 -14.692 1.00 34.15 C ATOM 618 OE1 GLU A 37 -4.074 -2.104 -15.663 1.00 25.22 O ATOM 619 OE2 GLU A 37 -2.479 -2.024 -14.153 1.00 25.41 O ATOM 620 H GLU A 37 -6.461 -4.568 -12.609 1.00 3.24 H ATOM 621 HA GLU A 37 -6.126 -2.532 -14.449 1.00 60.44 H ATOM 622 HB2 GLU A 37 -5.366 -5.435 -14.466 1.00 14.20 H ATOM 623 HB3 GLU A 37 -5.036 -4.426 -15.868 1.00 32.53 H ATOM 624 HG2 GLU A 37 -4.086 -3.817 -13.080 1.00 13.13 H ATOM 625 HG3 GLU A 37 -3.129 -4.650 -14.303 1.00 24.24 H ATOM 626 N LYS A 38 -8.392 -4.692 -15.326 1.00 60.20 N ATOM 627 CA LYS A 38 -9.460 -4.971 -16.279 1.00 43.01 C ATOM 628 C LYS A 38 -10.746 -4.255 -15.880 1.00 41.30 C ATOM 629 O LYS A 38 -11.594 -3.966 -16.724 1.00 60.13 O ATOM 630 CB LYS A 38 -9.710 -6.478 -16.370 1.00 23.03 C ATOM 631 CG LYS A 38 -8.523 -7.260 -16.906 1.00 33.31 C ATOM 632 CD LYS A 38 -8.352 -7.058 -18.402 1.00 41.50 C ATOM 633 CE LYS A 38 -9.172 -8.061 -19.198 1.00 63.40 C ATOM 634 NZ LYS A 38 -8.645 -9.447 -19.054 1.00 3.34 N ATOM 635 H LYS A 38 -8.350 -5.206 -14.492 1.00 2.13 H ATOM 636 HA LYS A 38 -9.145 -4.608 -17.246 1.00 23.13 H ATOM 637 HB2 LYS A 38 -9.945 -6.852 -15.384 1.00 50.30 H ATOM 638 HB3 LYS A 38 -10.553 -6.652 -17.022 1.00 74.21 H ATOM 639 HG2 LYS A 38 -7.627 -6.927 -16.404 1.00 33.34 H ATOM 640 HG3 LYS A 38 -8.679 -8.312 -16.710 1.00 2.33 H ATOM 641 HD2 LYS A 38 -8.675 -6.060 -18.661 1.00 31.20 H ATOM 642 HD3 LYS A 38 -7.308 -7.177 -18.655 1.00 41.23 H ATOM 643 HE2 LYS A 38 -10.191 -8.035 -18.845 1.00 11.31 H ATOM 644 HE3 LYS A 38 -9.145 -7.782 -20.241 1.00 3.21 H ATOM 645 HZ1 LYS A 38 -8.489 -9.869 -19.991 1.00 72.04 H ATOM 646 HZ2 LYS A 38 -9.324 -10.035 -18.530 1.00 1.52 H ATOM 647 HZ3 LYS A 38 -7.742 -9.434 -18.537 1.00 14.01 H ATOM 648 N TRP A 39 -10.883 -3.970 -14.590 1.00 50.12 N ATOM 649 CA TRP A 39 -12.066 -3.286 -14.080 1.00 41.53 C ATOM 650 C TRP A 39 -12.042 -1.807 -14.452 1.00 2.03 C ATOM 651 O TRP A 39 -13.085 -1.203 -14.704 1.00 13.13 O ATOM 652 CB TRP A 39 -12.155 -3.441 -12.561 1.00 72.13 C ATOM 653 CG TRP A 39 -13.286 -2.670 -11.951 1.00 33.32 C ATOM 654 CD1 TRP A 39 -14.508 -3.159 -11.585 1.00 22.13 C ATOM 655 CD2 TRP A 39 -13.301 -1.273 -11.637 1.00 64.33 C ATOM 656 NE1 TRP A 39 -15.281 -2.150 -11.063 1.00 23.04 N ATOM 657 CE2 TRP A 39 -14.563 -0.984 -11.083 1.00 3.30 C ATOM 658 CE3 TRP A 39 -12.370 -0.240 -11.769 1.00 4.41 C ATOM 659 CZ2 TRP A 39 -14.915 0.296 -10.663 1.00 50.21 C ATOM 660 CZ3 TRP A 39 -12.721 1.030 -11.352 1.00 41.21 C ATOM 661 CH2 TRP A 39 -13.984 1.289 -10.804 1.00 11.31 C ATOM 662 H TRP A 39 -10.172 -4.226 -13.965 1.00 52.44 H ATOM 663 HA TRP A 39 -12.933 -3.744 -14.532 1.00 33.13 H ATOM 664 HB2 TRP A 39 -12.294 -4.484 -12.320 1.00 73.30 H ATOM 665 HB3 TRP A 39 -11.234 -3.092 -12.117 1.00 35.14 H ATOM 666 HD1 TRP A 39 -14.809 -4.189 -11.697 1.00 61.41 H ATOM 667 HE1 TRP A 39 -16.197 -2.250 -10.728 1.00 61.43 H ATOM 668 HE3 TRP A 39 -11.391 -0.419 -12.189 1.00 21.51 H ATOM 669 HZ2 TRP A 39 -15.884 0.512 -10.238 1.00 74.21 H ATOM 670 HZ3 TRP A 39 -12.014 1.842 -11.446 1.00 75.05 H ATOM 671 HH2 TRP A 39 -14.215 2.296 -10.492 1.00 53.00 H ATOM 672 N LEU A 40 -10.846 -1.229 -14.484 1.00 71.13 N ATOM 673 CA LEU A 40 -10.687 0.180 -14.826 1.00 4.23 C ATOM 674 C LEU A 40 -10.571 0.365 -16.335 1.00 42.14 C ATOM 675 O LEU A 40 -11.189 1.260 -16.912 1.00 11.33 O ATOM 676 CB LEU A 40 -9.450 0.756 -14.134 1.00 10.24 C ATOM 677 CG LEU A 40 -9.071 2.187 -14.518 1.00 32.05 C ATOM 678 CD1 LEU A 40 -10.272 3.110 -14.387 1.00 54.42 C ATOM 679 CD2 LEU A 40 -7.919 2.683 -13.656 1.00 61.02 C ATOM 680 H LEU A 40 -10.051 -1.762 -14.274 1.00 53.40 H ATOM 681 HA LEU A 40 -11.562 0.707 -14.477 1.00 34.21 H ATOM 682 HB2 LEU A 40 -9.627 0.736 -13.069 1.00 72.43 H ATOM 683 HB3 LEU A 40 -8.612 0.116 -14.370 1.00 3.13 H ATOM 684 HG LEU A 40 -8.749 2.203 -15.550 1.00 32.32 H ATOM 685 HD11 LEU A 40 -11.075 2.747 -15.011 1.00 11.02 H ATOM 686 HD12 LEU A 40 -9.996 4.107 -14.700 1.00 32.41 H ATOM 687 HD13 LEU A 40 -10.598 3.134 -13.357 1.00 40.25 H ATOM 688 HD21 LEU A 40 -7.119 3.033 -14.292 1.00 54.14 H ATOM 689 HD22 LEU A 40 -7.558 1.874 -13.037 1.00 52.22 H ATOM 690 HD23 LEU A 40 -8.261 3.492 -13.029 1.00 0.52 H ATOM 691 N LYS A 41 -9.776 -0.489 -16.971 1.00 51.15 N ATOM 692 CA LYS A 41 -9.581 -0.423 -18.415 1.00 30.41 C ATOM 693 C LYS A 41 -10.920 -0.418 -19.145 1.00 52.33 C ATOM 694 O LYS A 41 -11.047 0.161 -20.224 1.00 42.23 O ATOM 695 CB LYS A 41 -8.734 -1.606 -18.890 1.00 61.10 C ATOM 696 CG LYS A 41 -7.241 -1.326 -18.885 1.00 31.14 C ATOM 697 CD LYS A 41 -6.753 -0.879 -20.252 1.00 44.31 C ATOM 698 CE LYS A 41 -6.754 0.637 -20.376 1.00 2.31 C ATOM 699 NZ LYS A 41 -5.718 1.265 -19.510 1.00 11.34 N ATOM 700 H LYS A 41 -9.310 -1.181 -16.457 1.00 63.41 H ATOM 701 HA LYS A 41 -9.059 0.495 -18.638 1.00 31.21 H ATOM 702 HB2 LYS A 41 -8.923 -2.451 -18.245 1.00 31.14 H ATOM 703 HB3 LYS A 41 -9.027 -1.861 -19.898 1.00 73.42 H ATOM 704 HG2 LYS A 41 -7.033 -0.546 -18.167 1.00 63.41 H ATOM 705 HG3 LYS A 41 -6.716 -2.228 -18.602 1.00 11.40 H ATOM 706 HD2 LYS A 41 -5.746 -1.240 -20.401 1.00 41.23 H ATOM 707 HD3 LYS A 41 -7.402 -1.294 -21.010 1.00 41.31 H ATOM 708 HE2 LYS A 41 -6.559 0.902 -21.404 1.00 34.41 H ATOM 709 HE3 LYS A 41 -7.726 1.008 -20.087 1.00 11.04 H ATOM 710 HZ1 LYS A 41 -5.157 1.946 -20.061 1.00 23.14 H ATOM 711 HZ2 LYS A 41 -5.082 0.537 -19.128 1.00 64.23 H ATOM 712 HZ3 LYS A 41 -6.170 1.765 -18.717 1.00 44.35 H ATOM 713 N ARG A 42 -11.917 -1.064 -18.549 1.00 63.34 N ATOM 714 CA ARG A 42 -13.246 -1.133 -19.144 1.00 33.14 C ATOM 715 C ARG A 42 -14.152 -0.044 -18.576 1.00 73.24 C ATOM 716 O ARG A 42 -15.098 0.396 -19.232 1.00 25.51 O ATOM 717 CB ARG A 42 -13.868 -2.509 -18.896 1.00 51.24 C ATOM 718 CG ARG A 42 -15.106 -2.777 -19.737 1.00 21.55 C ATOM 719 CD ARG A 42 -15.922 -3.930 -19.173 1.00 32.10 C ATOM 720 NE ARG A 42 -16.831 -4.495 -20.167 1.00 42.11 N ATOM 721 CZ ARG A 42 -17.476 -5.644 -20.004 1.00 33.31 C ATOM 722 NH1 ARG A 42 -17.314 -6.347 -18.891 1.00 71.34 N ATOM 723 NH2 ARG A 42 -18.286 -6.093 -20.954 1.00 54.54 N ATOM 724 H ARG A 42 -11.754 -1.506 -17.690 1.00 20.41 H ATOM 725 HA ARG A 42 -13.143 -0.981 -20.207 1.00 44.44 H ATOM 726 HB2 ARG A 42 -13.135 -3.269 -19.123 1.00 4.30 H ATOM 727 HB3 ARG A 42 -14.143 -2.584 -17.855 1.00 61.22 H ATOM 728 HG2 ARG A 42 -15.720 -1.889 -19.750 1.00 71.24 H ATOM 729 HG3 ARG A 42 -14.800 -3.022 -20.743 1.00 32.12 H ATOM 730 HD2 ARG A 42 -15.246 -4.702 -18.838 1.00 31.44 H ATOM 731 HD3 ARG A 42 -16.499 -3.569 -18.335 1.00 54.31 H ATOM 732 HE ARG A 42 -16.965 -3.992 -20.997 1.00 13.32 H ATOM 733 HH11 ARG A 42 -16.705 -6.011 -18.173 1.00 71.51 H ATOM 734 HH12 ARG A 42 -17.802 -7.212 -18.770 1.00 53.15 H ATOM 735 HH21 ARG A 42 -18.411 -5.565 -21.794 1.00 73.22 H ATOM 736 HH22 ARG A 42 -18.771 -6.958 -20.831 1.00 15.43 H ATOM 737 N HIS A 43 -13.857 0.386 -17.354 1.00 15.33 N ATOM 738 CA HIS A 43 -14.645 1.424 -16.698 1.00 34.00 C ATOM 739 C HIS A 43 -13.755 2.577 -16.245 1.00 11.23 C ATOM 740 O HIS A 43 -14.183 3.438 -15.475 1.00 44.20 O ATOM 741 CB HIS A 43 -15.397 0.843 -15.500 1.00 25.22 C ATOM 742 CG HIS A 43 -16.646 1.593 -15.155 1.00 75.44 C ATOM 743 ND1 HIS A 43 -16.858 2.179 -13.925 1.00 62.42 N ATOM 744 CD2 HIS A 43 -17.754 1.852 -15.889 1.00 61.02 C ATOM 745 CE1 HIS A 43 -18.042 2.764 -13.917 1.00 1.44 C ATOM 746 NE2 HIS A 43 -18.606 2.581 -15.097 1.00 1.32 N ATOM 747 H HIS A 43 -13.092 -0.003 -16.882 1.00 0.31 H ATOM 748 HA HIS A 43 -15.362 1.798 -17.413 1.00 44.55 H ATOM 749 HB2 HIS A 43 -15.672 -0.179 -15.717 1.00 53.41 H ATOM 750 HB3 HIS A 43 -14.749 0.860 -14.635 1.00 34.34 H ATOM 751 HD1 HIS A 43 -16.234 2.165 -13.170 1.00 43.43 H ATOM 752 HD2 HIS A 43 -17.935 1.543 -16.909 1.00 70.41 H ATOM 753 HE1 HIS A 43 -18.475 3.302 -13.087 1.00 13.13 H TER 754 HIS A 43