ATOM 1 N GLY A 1 -11.594 -1.989 -1.599 1.00 54.02 N ATOM 2 CA GLY A 1 -11.534 -2.778 -0.382 1.00 54.33 C ATOM 3 C GLY A 1 -10.401 -3.784 -0.399 1.00 52.52 C ATOM 4 O GLY A 1 -10.613 -4.972 -0.154 1.00 13.43 O ATOM 5 H1 GLY A 1 -10.827 -1.972 -2.208 1.00 1.21 H ATOM 6 HA2 GLY A 1 -11.401 -2.114 0.459 1.00 4.01 H ATOM 7 HA3 GLY A 1 -12.469 -3.308 -0.264 1.00 1.23 H ATOM 8 N ASP A 2 -9.195 -3.310 -0.690 1.00 73.13 N ATOM 9 CA ASP A 2 -8.023 -4.176 -0.738 1.00 74.13 C ATOM 10 C ASP A 2 -6.741 -3.365 -0.583 1.00 21.54 C ATOM 11 O ASP A 2 -6.708 -2.170 -0.882 1.00 44.42 O ATOM 12 CB ASP A 2 -7.992 -4.955 -2.054 1.00 53.35 C ATOM 13 CG ASP A 2 -6.808 -5.896 -2.142 1.00 3.51 C ATOM 14 OD1 ASP A 2 -6.741 -6.844 -1.330 1.00 14.30 O ATOM 15 OD2 ASP A 2 -5.948 -5.687 -3.023 1.00 41.33 O ATOM 16 H ASP A 2 -9.090 -2.352 -0.876 1.00 43.33 H ATOM 17 HA ASP A 2 -8.093 -4.875 0.082 1.00 11.41 H ATOM 18 HB2 ASP A 2 -8.899 -5.537 -2.142 1.00 61.01 H ATOM 19 HB3 ASP A 2 -7.937 -4.257 -2.876 1.00 0.32 H ATOM 20 N CYS A 3 -5.686 -4.021 -0.112 1.00 63.11 N ATOM 21 CA CYS A 3 -4.400 -3.362 0.085 1.00 53.03 C ATOM 22 C CYS A 3 -3.279 -4.140 -0.597 1.00 24.30 C ATOM 23 O CYS A 3 -3.486 -5.255 -1.078 1.00 64.23 O ATOM 24 CB CYS A 3 -4.101 -3.220 1.579 1.00 35.45 C ATOM 25 SG CYS A 3 -5.495 -2.576 2.558 1.00 70.43 S ATOM 26 H CYS A 3 -5.773 -4.973 0.109 1.00 30.14 H ATOM 27 HA CYS A 3 -4.459 -2.379 -0.357 1.00 52.25 H ATOM 28 HB2 CYS A 3 -3.838 -4.187 1.980 1.00 24.03 H ATOM 29 HB3 CYS A 3 -3.268 -2.543 1.708 1.00 21.00 H ATOM 30 N TYR A 4 -2.092 -3.545 -0.635 1.00 42.43 N ATOM 31 CA TYR A 4 -0.938 -4.182 -1.260 1.00 11.15 C ATOM 32 C TYR A 4 0.354 -3.775 -0.559 1.00 61.32 C ATOM 33 O TYR A 4 0.433 -2.710 0.053 1.00 1.11 O ATOM 34 CB TYR A 4 -0.866 -3.811 -2.743 1.00 72.33 C ATOM 35 CG TYR A 4 -1.015 -2.329 -3.004 1.00 74.04 C ATOM 36 CD1 TYR A 4 -2.273 -1.741 -3.082 1.00 10.41 C ATOM 37 CD2 TYR A 4 0.098 -1.517 -3.174 1.00 24.12 C ATOM 38 CE1 TYR A 4 -2.415 -0.388 -3.321 1.00 74.10 C ATOM 39 CE2 TYR A 4 -0.035 -0.163 -3.411 1.00 22.13 C ATOM 40 CZ TYR A 4 -1.293 0.397 -3.485 1.00 22.41 C ATOM 41 OH TYR A 4 -1.430 1.745 -3.723 1.00 23.14 O ATOM 42 H TYR A 4 -1.989 -2.658 -0.235 1.00 32.43 H ATOM 43 HA TYR A 4 -1.061 -5.252 -1.172 1.00 34.25 H ATOM 44 HB2 TYR A 4 0.088 -4.121 -3.139 1.00 64.24 H ATOM 45 HB3 TYR A 4 -1.654 -4.323 -3.274 1.00 55.35 H ATOM 46 HD1 TYR A 4 -3.150 -2.359 -2.953 1.00 60.21 H ATOM 47 HD2 TYR A 4 1.082 -1.959 -3.116 1.00 30.54 H ATOM 48 HE1 TYR A 4 -3.400 0.050 -3.378 1.00 30.22 H ATOM 49 HE2 TYR A 4 0.844 0.452 -3.540 1.00 12.04 H ATOM 50 HH TYR A 4 -2.239 1.903 -4.214 1.00 2.30 H ATOM 51 N TRP A 5 1.365 -4.631 -0.653 1.00 1.44 N ATOM 52 CA TRP A 5 2.656 -4.363 -0.029 1.00 35.24 C ATOM 53 C TRP A 5 3.555 -3.560 -0.963 1.00 74.54 C ATOM 54 O TRP A 5 3.521 -3.738 -2.181 1.00 50.35 O ATOM 55 CB TRP A 5 3.341 -5.674 0.357 1.00 10.22 C ATOM 56 CG TRP A 5 4.815 -5.527 0.589 1.00 13.34 C ATOM 57 CD1 TRP A 5 5.820 -6.032 -0.187 1.00 61.22 C ATOM 58 CD2 TRP A 5 5.448 -4.832 1.668 1.00 41.12 C ATOM 59 NE1 TRP A 5 7.040 -5.692 0.346 1.00 61.34 N ATOM 60 CE2 TRP A 5 6.839 -4.955 1.483 1.00 60.44 C ATOM 61 CE3 TRP A 5 4.976 -4.116 2.771 1.00 43.12 C ATOM 62 CZ2 TRP A 5 7.759 -4.389 2.362 1.00 42.21 C ATOM 63 CZ3 TRP A 5 5.890 -3.555 3.642 1.00 44.54 C ATOM 64 CH2 TRP A 5 7.269 -3.693 3.434 1.00 41.42 C ATOM 65 H TRP A 5 1.241 -5.464 -1.156 1.00 64.13 H ATOM 66 HA TRP A 5 2.476 -3.784 0.865 1.00 70.21 H ATOM 67 HB2 TRP A 5 2.897 -6.051 1.266 1.00 72.51 H ATOM 68 HB3 TRP A 5 3.197 -6.393 -0.435 1.00 1.24 H ATOM 69 HD1 TRP A 5 5.664 -6.613 -1.083 1.00 72.44 H ATOM 70 HE1 TRP A 5 7.913 -5.936 -0.029 1.00 11.32 H ATOM 71 HE3 TRP A 5 3.918 -3.998 2.948 1.00 55.11 H ATOM 72 HZ2 TRP A 5 8.825 -4.486 2.215 1.00 2.52 H ATOM 73 HZ3 TRP A 5 5.544 -2.998 4.501 1.00 1.22 H ATOM 74 HH2 TRP A 5 7.946 -3.239 4.139 1.00 64.53 H ATOM 75 N THR A 6 4.360 -2.673 -0.384 1.00 0.40 N ATOM 76 CA THR A 6 5.269 -1.842 -1.165 1.00 50.44 C ATOM 77 C THR A 6 6.575 -1.604 -0.417 1.00 43.40 C ATOM 78 O THR A 6 6.615 -1.648 0.812 1.00 3.45 O ATOM 79 CB THR A 6 4.631 -0.482 -1.507 1.00 61.12 C ATOM 80 OG1 THR A 6 4.301 0.220 -0.304 1.00 31.41 O ATOM 81 CG2 THR A 6 3.379 -0.668 -2.351 1.00 43.30 C ATOM 82 H THR A 6 4.342 -2.578 0.591 1.00 75.11 H ATOM 83 HA THR A 6 5.482 -2.360 -2.090 1.00 60.52 H ATOM 84 HB THR A 6 5.344 0.101 -2.071 1.00 4.25 H ATOM 85 HG1 THR A 6 3.789 1.004 -0.521 1.00 5.13 H ATOM 86 HG21 THR A 6 2.519 -0.759 -1.705 1.00 12.40 H ATOM 87 HG22 THR A 6 3.477 -1.563 -2.948 1.00 4.20 H ATOM 88 HG23 THR A 6 3.254 0.185 -3.001 1.00 71.42 H ATOM 89 N SER A 7 7.643 -1.352 -1.168 1.00 41.40 N ATOM 90 CA SER A 7 8.954 -1.110 -0.576 1.00 41.12 C ATOM 91 C SER A 7 9.037 0.300 0.001 1.00 1.01 C ATOM 92 O SER A 7 9.210 0.481 1.207 1.00 33.31 O ATOM 93 CB SER A 7 10.053 -1.312 -1.620 1.00 61.31 C ATOM 94 OG SER A 7 11.294 -0.803 -1.159 1.00 14.11 O ATOM 95 H SER A 7 7.548 -1.331 -2.143 1.00 15.23 H ATOM 96 HA SER A 7 9.093 -1.823 0.224 1.00 14.54 H ATOM 97 HB2 SER A 7 10.164 -2.366 -1.823 1.00 42.10 H ATOM 98 HB3 SER A 7 9.781 -0.796 -2.530 1.00 45.20 H ATOM 99 HG SER A 7 11.995 -1.421 -1.380 1.00 73.15 H ATOM 100 N THR A 8 8.914 1.297 -0.869 1.00 44.53 N ATOM 101 CA THR A 8 8.976 2.690 -0.448 1.00 30.45 C ATOM 102 C THR A 8 7.762 3.065 0.394 1.00 70.42 C ATOM 103 O THR A 8 6.685 2.482 0.268 1.00 64.52 O ATOM 104 CB THR A 8 9.059 3.640 -1.659 1.00 44.11 C ATOM 105 OG1 THR A 8 7.909 3.471 -2.494 1.00 41.45 O ATOM 106 CG2 THR A 8 10.321 3.377 -2.467 1.00 44.32 C ATOM 107 H THR A 8 8.778 1.089 -1.817 1.00 4.22 H ATOM 108 HA THR A 8 9.869 2.820 0.146 1.00 51.24 H ATOM 109 HB THR A 8 9.087 4.658 -1.298 1.00 54.53 H ATOM 110 HG1 THR A 8 7.239 4.115 -2.250 1.00 5.51 H ATOM 111 HG21 THR A 8 10.530 2.317 -2.476 1.00 73.35 H ATOM 112 HG22 THR A 8 11.151 3.903 -2.019 1.00 21.54 H ATOM 113 HG23 THR A 8 10.179 3.724 -3.479 1.00 63.11 H ATOM 114 N PRO A 9 7.937 4.063 1.274 1.00 51.23 N ATOM 115 CA PRO A 9 6.866 4.539 2.154 1.00 53.12 C ATOM 116 C PRO A 9 5.770 5.274 1.388 1.00 63.45 C ATOM 117 O PRO A 9 6.036 6.056 0.475 1.00 51.33 O ATOM 118 CB PRO A 9 7.587 5.496 3.106 1.00 5.25 C ATOM 119 CG PRO A 9 8.780 5.960 2.344 1.00 45.03 C ATOM 120 CD PRO A 9 9.194 4.803 1.477 1.00 53.20 C ATOM 121 HA PRO A 9 6.426 3.729 2.718 1.00 62.31 H ATOM 122 HB2 PRO A 9 6.933 6.319 3.358 1.00 0.02 H ATOM 123 HB3 PRO A 9 7.873 4.969 4.004 1.00 1.43 H ATOM 124 HG2 PRO A 9 8.518 6.811 1.734 1.00 41.05 H ATOM 125 HG3 PRO A 9 9.575 6.218 3.028 1.00 45.31 H ATOM 126 HD2 PRO A 9 9.587 5.159 0.537 1.00 22.25 H ATOM 127 HD3 PRO A 9 9.923 4.191 1.986 1.00 74.31 H ATOM 128 N PRO A 10 4.510 5.021 1.769 1.00 14.21 N ATOM 129 CA PRO A 10 4.181 4.092 2.855 1.00 33.34 C ATOM 130 C PRO A 10 4.465 2.641 2.481 1.00 41.35 C ATOM 131 O PRO A 10 4.207 2.217 1.355 1.00 32.10 O ATOM 132 CB PRO A 10 2.680 4.307 3.063 1.00 63.32 C ATOM 133 CG PRO A 10 2.183 4.810 1.752 1.00 74.31 C ATOM 134 CD PRO A 10 3.307 5.620 1.167 1.00 54.34 C ATOM 135 HA PRO A 10 4.712 4.340 3.762 1.00 52.14 H ATOM 136 HB2 PRO A 10 2.214 3.370 3.331 1.00 52.44 H ATOM 137 HB3 PRO A 10 2.522 5.031 3.849 1.00 24.42 H ATOM 138 HG2 PRO A 10 1.944 3.979 1.107 1.00 22.43 H ATOM 139 HG3 PRO A 10 1.313 5.432 1.904 1.00 53.32 H ATOM 140 HD2 PRO A 10 3.323 5.521 0.092 1.00 13.14 H ATOM 141 HD3 PRO A 10 3.211 6.658 1.451 1.00 52.11 H ATOM 142 N PHE A 11 4.996 1.883 3.436 1.00 33.03 N ATOM 143 CA PHE A 11 5.314 0.478 3.207 1.00 31.10 C ATOM 144 C PHE A 11 4.056 -0.317 2.868 1.00 61.03 C ATOM 145 O PHE A 11 4.121 -1.349 2.202 1.00 4.55 O ATOM 146 CB PHE A 11 5.993 -0.120 4.440 1.00 64.24 C ATOM 147 CG PHE A 11 7.087 0.744 5.001 1.00 1.34 C ATOM 148 CD1 PHE A 11 8.010 1.347 4.162 1.00 15.22 C ATOM 149 CD2 PHE A 11 7.192 0.952 6.367 1.00 0.11 C ATOM 150 CE1 PHE A 11 9.017 2.143 4.674 1.00 21.21 C ATOM 151 CE2 PHE A 11 8.197 1.747 6.884 1.00 63.21 C ATOM 152 CZ PHE A 11 9.112 2.343 6.037 1.00 52.51 C ATOM 153 H PHE A 11 5.178 2.278 4.314 1.00 54.13 H ATOM 154 HA PHE A 11 5.995 0.425 2.371 1.00 74.31 H ATOM 155 HB2 PHE A 11 5.255 -0.264 5.215 1.00 21.32 H ATOM 156 HB3 PHE A 11 6.424 -1.074 4.177 1.00 62.31 H ATOM 157 HD1 PHE A 11 7.936 1.192 3.094 1.00 62.40 H ATOM 158 HD2 PHE A 11 6.479 0.486 7.030 1.00 45.11 H ATOM 159 HE1 PHE A 11 9.730 2.608 4.008 1.00 41.21 H ATOM 160 HE2 PHE A 11 8.269 1.900 7.951 1.00 24.40 H ATOM 161 HZ PHE A 11 9.898 2.964 6.440 1.00 14.52 H ATOM 162 N PHE A 12 2.912 0.171 3.335 1.00 22.22 N ATOM 163 CA PHE A 12 1.639 -0.493 3.085 1.00 42.43 C ATOM 164 C PHE A 12 0.582 0.509 2.630 1.00 14.42 C ATOM 165 O PHE A 12 0.356 1.530 3.282 1.00 15.22 O ATOM 166 CB PHE A 12 1.161 -1.218 4.344 1.00 63.05 C ATOM 167 CG PHE A 12 0.152 -2.297 4.070 1.00 13.24 C ATOM 168 CD1 PHE A 12 0.530 -3.472 3.439 1.00 52.42 C ATOM 169 CD2 PHE A 12 -1.173 -2.136 4.442 1.00 45.33 C ATOM 170 CE1 PHE A 12 -0.397 -4.465 3.184 1.00 73.05 C ATOM 171 CE2 PHE A 12 -2.103 -3.127 4.190 1.00 73.12 C ATOM 172 CZ PHE A 12 -1.715 -4.293 3.561 1.00 34.20 C ATOM 173 H PHE A 12 2.925 0.998 3.861 1.00 74.11 H ATOM 174 HA PHE A 12 1.792 -1.217 2.299 1.00 43.25 H ATOM 175 HB2 PHE A 12 2.009 -1.676 4.832 1.00 32.51 H ATOM 176 HB3 PHE A 12 0.709 -0.502 5.014 1.00 53.33 H ATOM 177 HD1 PHE A 12 1.559 -3.608 3.145 1.00 1.42 H ATOM 178 HD2 PHE A 12 -1.477 -1.224 4.934 1.00 74.34 H ATOM 179 HE1 PHE A 12 -0.091 -5.376 2.692 1.00 40.43 H ATOM 180 HE2 PHE A 12 -3.132 -2.989 4.486 1.00 74.43 H ATOM 181 HZ PHE A 12 -2.441 -5.068 3.363 1.00 30.31 H ATOM 182 N THR A 13 -0.064 0.211 1.506 1.00 31.43 N ATOM 183 CA THR A 13 -1.094 1.085 0.963 1.00 34.03 C ATOM 184 C THR A 13 -2.406 0.334 0.767 1.00 42.22 C ATOM 185 O THR A 13 -2.411 -0.846 0.416 1.00 41.21 O ATOM 186 CB THR A 13 -0.661 1.696 -0.384 1.00 53.12 C ATOM 187 OG1 THR A 13 0.527 2.475 -0.208 1.00 31.53 O ATOM 188 CG2 THR A 13 -1.764 2.568 -0.963 1.00 13.10 C ATOM 189 H THR A 13 0.162 -0.616 1.032 1.00 53.34 H ATOM 190 HA THR A 13 -1.253 1.891 1.664 1.00 52.15 H ATOM 191 HB THR A 13 -0.456 0.893 -1.077 1.00 41.14 H ATOM 192 HG1 THR A 13 1.273 2.016 -0.600 1.00 14.35 H ATOM 193 HG21 THR A 13 -2.501 1.943 -1.447 1.00 41.44 H ATOM 194 HG22 THR A 13 -1.343 3.251 -1.685 1.00 44.11 H ATOM 195 HG23 THR A 13 -2.234 3.128 -0.169 1.00 32.50 H ATOM 196 N CYS A 14 -3.518 1.024 0.996 1.00 53.32 N ATOM 197 CA CYS A 14 -4.837 0.422 0.846 1.00 14.11 C ATOM 198 C CYS A 14 -5.669 1.184 -0.182 1.00 32.53 C ATOM 199 O CYS A 14 -5.316 2.294 -0.585 1.00 43.34 O ATOM 200 CB CYS A 14 -5.566 0.397 2.190 1.00 74.12 C ATOM 201 SG CYS A 14 -4.913 -0.829 3.368 1.00 13.31 S ATOM 202 H CYS A 14 -3.450 1.963 1.274 1.00 3.31 H ATOM 203 HA CYS A 14 -4.702 -0.592 0.500 1.00 35.30 H ATOM 204 HB2 CYS A 14 -5.486 1.370 2.652 1.00 61.44 H ATOM 205 HB3 CYS A 14 -6.608 0.170 2.022 1.00 53.45 H ATOM 206 N THR A 15 -6.777 0.581 -0.603 1.00 33.53 N ATOM 207 CA THR A 15 -7.659 1.202 -1.585 1.00 44.23 C ATOM 208 C THR A 15 -9.078 1.331 -1.044 1.00 10.20 C ATOM 209 O THR A 15 -9.513 0.562 -0.186 1.00 55.21 O ATOM 210 CB THR A 15 -7.693 0.397 -2.897 1.00 64.32 C ATOM 211 OG1 THR A 15 -8.162 -0.933 -2.644 1.00 31.14 O ATOM 212 CG2 THR A 15 -6.312 0.340 -3.534 1.00 73.03 C ATOM 213 H THR A 15 -7.004 -0.302 -0.246 1.00 75.13 H ATOM 214 HA THR A 15 -7.275 2.188 -1.802 1.00 73.42 H ATOM 215 HB THR A 15 -8.369 0.885 -3.584 1.00 74.35 H ATOM 216 HG1 THR A 15 -9.018 -1.055 -3.063 1.00 62.22 H ATOM 217 HG21 THR A 15 -5.802 1.278 -3.372 1.00 15.44 H ATOM 218 HG22 THR A 15 -6.412 0.161 -4.594 1.00 71.52 H ATOM 219 HG23 THR A 15 -5.743 -0.460 -3.086 1.00 62.43 H ATOM 220 N PRO A 16 -9.818 2.325 -1.555 1.00 32.20 N ATOM 221 CA PRO A 16 -11.201 2.578 -1.138 1.00 52.32 C ATOM 222 C PRO A 16 -12.157 1.489 -1.614 1.00 75.34 C ATOM 223 O PRO A 16 -13.261 1.346 -1.086 1.00 64.11 O ATOM 224 CB PRO A 16 -11.535 3.913 -1.808 1.00 13.51 C ATOM 225 CG PRO A 16 -10.629 3.982 -2.988 1.00 23.35 C ATOM 226 CD PRO A 16 -9.363 3.280 -2.580 1.00 0.41 C ATOM 227 HA PRO A 16 -11.279 2.682 -0.066 1.00 11.34 H ATOM 228 HB2 PRO A 16 -12.574 3.919 -2.106 1.00 15.15 H ATOM 229 HB3 PRO A 16 -11.348 4.723 -1.119 1.00 24.20 H ATOM 230 HG2 PRO A 16 -11.082 3.480 -3.830 1.00 64.52 H ATOM 231 HG3 PRO A 16 -10.422 5.014 -3.232 1.00 23.22 H ATOM 232 HD2 PRO A 16 -8.930 2.762 -3.424 1.00 61.31 H ATOM 233 HD3 PRO A 16 -8.658 3.984 -2.164 1.00 30.13 H ATOM 234 N ASP A 17 -11.728 0.726 -2.612 1.00 42.21 N ATOM 235 CA ASP A 17 -12.546 -0.351 -3.157 1.00 50.10 C ATOM 236 C ASP A 17 -12.706 -1.480 -2.142 1.00 33.54 C ATOM 237 O ASP A 17 -13.802 -2.010 -1.957 1.00 70.40 O ATOM 238 CB ASP A 17 -11.924 -0.892 -4.445 1.00 34.20 C ATOM 239 CG ASP A 17 -12.809 -1.913 -5.132 1.00 22.51 C ATOM 240 OD1 ASP A 17 -14.011 -1.975 -4.800 1.00 24.41 O ATOM 241 OD2 ASP A 17 -12.299 -2.652 -6.000 1.00 14.34 O ATOM 242 H ASP A 17 -10.839 0.889 -2.991 1.00 32.34 H ATOM 243 HA ASP A 17 -13.521 0.054 -3.381 1.00 54.40 H ATOM 244 HB2 ASP A 17 -11.757 -0.071 -5.129 1.00 22.50 H ATOM 245 HB3 ASP A 17 -10.979 -1.359 -4.213 1.00 24.41 H