ATOM 1 N GLY A 1 -11.592 -1.991 -1.579 1.00 5.42 N ATOM 2 CA GLY A 1 -11.528 -2.781 -0.363 1.00 33.15 C ATOM 3 C GLY A 1 -10.394 -3.785 -0.382 1.00 43.03 C ATOM 4 O GLY A 1 -10.599 -4.969 -0.114 1.00 51.52 O ATOM 5 H1 GLY A 1 -10.850 -2.021 -2.220 1.00 60.00 H ATOM 6 HA2 GLY A 1 -11.393 -2.115 0.477 1.00 3.43 H ATOM 7 HA3 GLY A 1 -12.461 -3.311 -0.242 1.00 32.21 H ATOM 8 N ASP A 2 -9.193 -3.313 -0.700 1.00 50.01 N ATOM 9 CA ASP A 2 -8.021 -4.179 -0.754 1.00 65.24 C ATOM 10 C ASP A 2 -6.739 -3.368 -0.597 1.00 62.30 C ATOM 11 O ASP A 2 -6.705 -2.174 -0.899 1.00 5.52 O ATOM 12 CB ASP A 2 -7.992 -4.953 -2.073 1.00 64.01 C ATOM 13 CG ASP A 2 -6.865 -5.965 -2.125 1.00 44.14 C ATOM 14 OD1 ASP A 2 -6.849 -6.880 -1.275 1.00 5.43 O ATOM 15 OD2 ASP A 2 -5.999 -5.844 -3.017 1.00 62.52 O ATOM 16 H ASP A 2 -9.093 -2.359 -0.904 1.00 41.15 H ATOM 17 HA ASP A 2 -8.089 -4.882 0.063 1.00 54.03 H ATOM 18 HB2 ASP A 2 -8.929 -5.478 -2.195 1.00 22.23 H ATOM 19 HB3 ASP A 2 -7.865 -4.256 -2.888 1.00 43.01 H ATOM 20 N CYS A 3 -5.685 -4.024 -0.121 1.00 33.32 N ATOM 21 CA CYS A 3 -4.400 -3.364 0.078 1.00 30.11 C ATOM 22 C CYS A 3 -3.278 -4.141 -0.604 1.00 12.32 C ATOM 23 O CYS A 3 -3.485 -5.255 -1.086 1.00 42.11 O ATOM 24 CB CYS A 3 -4.102 -3.222 1.572 1.00 13.11 C ATOM 25 SG CYS A 3 -5.497 -2.579 2.550 1.00 72.04 S ATOM 26 H CYS A 3 -5.773 -4.974 0.102 1.00 13.01 H ATOM 27 HA CYS A 3 -4.460 -2.381 -0.364 1.00 70.41 H ATOM 28 HB2 CYS A 3 -3.839 -4.191 1.972 1.00 73.40 H ATOM 29 HB3 CYS A 3 -3.269 -2.546 1.702 1.00 62.13 H ATOM 30 N TYR A 4 -2.091 -3.547 -0.640 1.00 12.21 N ATOM 31 CA TYR A 4 -0.936 -4.182 -1.265 1.00 74.20 C ATOM 32 C TYR A 4 0.355 -3.774 -0.562 1.00 5.14 C ATOM 33 O TYR A 4 0.434 -2.708 0.047 1.00 1.41 O ATOM 34 CB TYR A 4 -0.863 -3.810 -2.746 1.00 14.55 C ATOM 35 CG TYR A 4 -1.014 -2.329 -3.009 1.00 64.42 C ATOM 36 CD1 TYR A 4 -2.270 -1.741 -3.087 1.00 41.33 C ATOM 37 CD2 TYR A 4 0.101 -1.516 -3.175 1.00 24.11 C ATOM 38 CE1 TYR A 4 -2.412 -0.388 -3.326 1.00 32.31 C ATOM 39 CE2 TYR A 4 -0.031 -0.162 -3.414 1.00 61.30 C ATOM 40 CZ TYR A 4 -1.290 0.397 -3.489 1.00 62.51 C ATOM 41 OH TYR A 4 -1.427 1.746 -3.725 1.00 13.32 O ATOM 42 H TYR A 4 -1.988 -2.658 -0.239 1.00 55.41 H ATOM 43 HA TYR A 4 -1.058 -5.251 -1.178 1.00 54.44 H ATOM 44 HB2 TYR A 4 0.092 -4.121 -3.142 1.00 13.22 H ATOM 45 HB3 TYR A 4 -1.652 -4.323 -3.278 1.00 0.05 H ATOM 46 HD1 TYR A 4 -3.148 -2.359 -2.959 1.00 23.53 H ATOM 47 HD2 TYR A 4 1.085 -1.958 -3.116 1.00 61.41 H ATOM 48 HE1 TYR A 4 -3.398 0.051 -3.384 1.00 3.13 H ATOM 49 HE2 TYR A 4 0.847 0.453 -3.541 1.00 72.42 H ATOM 50 HH TYR A 4 -2.117 1.888 -4.378 1.00 64.21 H ATOM 51 N TRP A 5 1.366 -4.632 -0.654 1.00 13.31 N ATOM 52 CA TRP A 5 2.655 -4.363 -0.028 1.00 13.13 C ATOM 53 C TRP A 5 3.556 -3.560 -0.961 1.00 74.22 C ATOM 54 O TRP A 5 3.523 -3.740 -2.179 1.00 73.41 O ATOM 55 CB TRP A 5 3.341 -5.673 0.360 1.00 10.33 C ATOM 56 CG TRP A 5 4.814 -5.528 0.592 1.00 33.43 C ATOM 57 CD1 TRP A 5 5.820 -6.032 -0.183 1.00 72.30 C ATOM 58 CD2 TRP A 5 5.447 -4.831 1.671 1.00 45.40 C ATOM 59 NE1 TRP A 5 7.040 -5.692 0.352 1.00 13.12 N ATOM 60 CE2 TRP A 5 6.838 -4.954 1.488 1.00 42.00 C ATOM 61 CE3 TRP A 5 4.973 -4.115 2.774 1.00 2.41 C ATOM 62 CZ2 TRP A 5 7.757 -4.389 2.368 1.00 21.24 C ATOM 63 CZ3 TRP A 5 5.887 -3.554 3.646 1.00 21.00 C ATOM 64 CH2 TRP A 5 7.266 -3.693 3.439 1.00 12.13 C ATOM 65 H TRP A 5 1.242 -5.467 -1.154 1.00 33.43 H ATOM 66 HA TRP A 5 2.475 -3.783 0.865 1.00 51.42 H ATOM 67 HB2 TRP A 5 2.897 -6.051 1.268 1.00 75.13 H ATOM 68 HB3 TRP A 5 3.198 -6.394 -0.433 1.00 13.24 H ATOM 69 HD1 TRP A 5 5.665 -6.613 -1.078 1.00 15.40 H ATOM 70 HE1 TRP A 5 7.912 -5.936 -0.023 1.00 1.12 H ATOM 71 HE3 TRP A 5 3.915 -3.997 2.950 1.00 73.03 H ATOM 72 HZ2 TRP A 5 8.823 -4.486 2.221 1.00 13.43 H ATOM 73 HZ3 TRP A 5 5.540 -2.998 4.504 1.00 34.41 H ATOM 74 HH2 TRP A 5 7.943 -3.238 4.145 1.00 33.42 H ATOM 75 N THR A 6 4.360 -2.674 -0.382 1.00 1.33 N ATOM 76 CA THR A 6 5.269 -1.843 -1.163 1.00 62.35 C ATOM 77 C THR A 6 6.575 -1.606 -0.414 1.00 21.55 C ATOM 78 O THR A 6 6.614 -1.648 0.816 1.00 5.12 O ATOM 79 CB THR A 6 4.633 -0.483 -1.506 1.00 70.12 C ATOM 80 OG1 THR A 6 4.302 0.220 -0.304 1.00 74.33 O ATOM 81 CG2 THR A 6 3.382 -0.670 -2.352 1.00 55.03 C ATOM 82 H THR A 6 4.340 -2.577 0.592 1.00 21.32 H ATOM 83 HA THR A 6 5.484 -2.360 -2.087 1.00 71.10 H ATOM 84 HB THR A 6 5.347 0.099 -2.069 1.00 32.04 H ATOM 85 HG1 THR A 6 3.789 1.002 -0.521 1.00 54.22 H ATOM 86 HG21 THR A 6 3.260 0.180 -3.007 1.00 62.41 H ATOM 87 HG22 THR A 6 2.520 -0.754 -1.707 1.00 62.43 H ATOM 88 HG23 THR A 6 3.478 -1.568 -2.942 1.00 12.11 H ATOM 89 N SER A 7 7.644 -1.354 -1.164 1.00 73.53 N ATOM 90 CA SER A 7 8.954 -1.112 -0.570 1.00 72.32 C ATOM 91 C SER A 7 9.037 0.298 0.006 1.00 24.54 C ATOM 92 O SER A 7 9.208 0.480 1.212 1.00 31.23 O ATOM 93 CB SER A 7 10.055 -1.314 -1.613 1.00 15.24 C ATOM 94 OG SER A 7 11.269 -1.713 -1.002 1.00 2.50 O ATOM 95 H SER A 7 7.549 -1.332 -2.139 1.00 2.52 H ATOM 96 HA SER A 7 9.092 -1.823 0.230 1.00 2.32 H ATOM 97 HB2 SER A 7 9.749 -2.078 -2.312 1.00 70.32 H ATOM 98 HB3 SER A 7 10.220 -0.387 -2.142 1.00 15.13 H ATOM 99 HG SER A 7 11.736 -2.320 -1.582 1.00 41.13 H ATOM 100 N THR A 8 8.915 1.296 -0.864 1.00 15.41 N ATOM 101 CA THR A 8 8.977 2.690 -0.445 1.00 44.11 C ATOM 102 C THR A 8 7.763 3.065 0.397 1.00 54.54 C ATOM 103 O THR A 8 6.686 2.482 0.270 1.00 54.13 O ATOM 104 CB THR A 8 9.062 3.638 -1.655 1.00 62.30 C ATOM 105 OG1 THR A 8 7.912 3.469 -2.491 1.00 13.35 O ATOM 106 CG2 THR A 8 10.324 3.375 -2.462 1.00 62.31 C ATOM 107 H THR A 8 8.780 1.087 -1.812 1.00 11.01 H ATOM 108 HA THR A 8 9.869 2.819 0.151 1.00 2.20 H ATOM 109 HB THR A 8 9.089 4.657 -1.294 1.00 11.24 H ATOM 110 HG1 THR A 8 7.742 4.284 -2.970 1.00 52.51 H ATOM 111 HG21 THR A 8 11.009 2.780 -1.875 1.00 44.41 H ATOM 112 HG22 THR A 8 10.791 4.315 -2.716 1.00 64.31 H ATOM 113 HG23 THR A 8 10.069 2.843 -3.366 1.00 21.31 H ATOM 114 N PRO A 9 7.936 4.063 1.277 1.00 1.13 N ATOM 115 CA PRO A 9 6.864 4.539 2.155 1.00 0.14 C ATOM 116 C PRO A 9 5.770 5.275 1.388 1.00 64.11 C ATOM 117 O PRO A 9 6.036 6.055 0.474 1.00 32.22 O ATOM 118 CB PRO A 9 7.585 5.496 3.107 1.00 71.21 C ATOM 119 CG PRO A 9 8.779 5.960 2.347 1.00 2.03 C ATOM 120 CD PRO A 9 9.193 4.803 1.481 1.00 12.14 C ATOM 121 HA PRO A 9 6.424 3.730 2.720 1.00 24.34 H ATOM 122 HB2 PRO A 9 6.930 6.320 3.358 1.00 23.23 H ATOM 123 HB3 PRO A 9 7.870 4.969 4.006 1.00 13.14 H ATOM 124 HG2 PRO A 9 8.518 6.811 1.736 1.00 11.00 H ATOM 125 HG3 PRO A 9 9.573 6.218 3.032 1.00 44.41 H ATOM 126 HD2 PRO A 9 9.588 5.158 0.540 1.00 50.41 H ATOM 127 HD3 PRO A 9 9.921 4.191 1.990 1.00 61.53 H ATOM 128 N PRO A 10 4.509 5.021 1.767 1.00 14.02 N ATOM 129 CA PRO A 10 4.179 4.093 2.853 1.00 23.01 C ATOM 130 C PRO A 10 4.463 2.642 2.481 1.00 55.31 C ATOM 131 O PRO A 10 4.206 2.218 1.355 1.00 3.33 O ATOM 132 CB PRO A 10 2.678 4.308 3.061 1.00 74.41 C ATOM 133 CG PRO A 10 2.183 4.811 1.749 1.00 13.11 C ATOM 134 CD PRO A 10 3.306 5.621 1.164 1.00 12.32 C ATOM 135 HA PRO A 10 4.710 4.341 3.761 1.00 52.43 H ATOM 136 HB2 PRO A 10 2.211 3.371 3.328 1.00 54.24 H ATOM 137 HB3 PRO A 10 2.519 5.032 3.846 1.00 21.15 H ATOM 138 HG2 PRO A 10 1.943 3.979 1.104 1.00 22.14 H ATOM 139 HG3 PRO A 10 1.312 5.433 1.899 1.00 54.25 H ATOM 140 HD2 PRO A 10 3.324 5.521 0.089 1.00 74.33 H ATOM 141 HD3 PRO A 10 3.211 6.659 1.447 1.00 40.21 H ATOM 142 N PHE A 11 4.993 1.884 3.436 1.00 31.44 N ATOM 143 CA PHE A 11 5.311 0.479 3.208 1.00 22.42 C ATOM 144 C PHE A 11 4.054 -0.315 2.869 1.00 63.14 C ATOM 145 O PHE A 11 4.120 -1.347 2.201 1.00 45.33 O ATOM 146 CB PHE A 11 5.990 -0.118 4.442 1.00 42.03 C ATOM 147 CG PHE A 11 7.083 0.745 5.004 1.00 13.33 C ATOM 148 CD1 PHE A 11 8.007 1.348 4.165 1.00 14.23 C ATOM 149 CD2 PHE A 11 7.187 0.954 6.368 1.00 75.42 C ATOM 150 CE1 PHE A 11 9.014 2.143 4.678 1.00 52.13 C ATOM 151 CE2 PHE A 11 8.192 1.749 6.888 1.00 5.21 C ATOM 152 CZ PHE A 11 9.106 2.344 6.041 1.00 63.30 C ATOM 153 H PHE A 11 5.175 2.279 4.314 1.00 32.42 H ATOM 154 HA PHE A 11 5.992 0.426 2.372 1.00 65.43 H ATOM 155 HB2 PHE A 11 5.251 -0.261 5.216 1.00 75.01 H ATOM 156 HB3 PHE A 11 6.420 -1.073 4.181 1.00 3.13 H ATOM 157 HD1 PHE A 11 7.935 1.193 3.098 1.00 11.30 H ATOM 158 HD2 PHE A 11 6.472 0.489 7.033 1.00 12.34 H ATOM 159 HE1 PHE A 11 9.727 2.608 4.013 1.00 43.15 H ATOM 160 HE2 PHE A 11 8.261 1.904 7.955 1.00 4.42 H ATOM 161 HZ PHE A 11 9.892 2.964 6.445 1.00 24.55 H ATOM 162 N PHE A 12 2.909 0.173 3.335 1.00 43.04 N ATOM 163 CA PHE A 12 1.636 -0.492 3.084 1.00 4.33 C ATOM 164 C PHE A 12 0.580 0.510 2.627 1.00 40.24 C ATOM 165 O PHE A 12 0.355 1.532 3.277 1.00 32.20 O ATOM 166 CB PHE A 12 1.157 -1.217 4.343 1.00 43.15 C ATOM 167 CG PHE A 12 0.163 -2.309 4.066 1.00 23.32 C ATOM 168 CD1 PHE A 12 0.566 -3.497 3.477 1.00 30.43 C ATOM 169 CD2 PHE A 12 -1.173 -2.146 4.393 1.00 2.24 C ATOM 170 CE1 PHE A 12 -0.345 -4.504 3.221 1.00 14.33 C ATOM 171 CE2 PHE A 12 -2.089 -3.150 4.139 1.00 20.31 C ATOM 172 CZ PHE A 12 -1.675 -4.329 3.551 1.00 70.31 C ATOM 173 H PHE A 12 2.921 1.000 3.861 1.00 21.34 H ATOM 174 HA PHE A 12 1.790 -1.217 2.298 1.00 70.31 H ATOM 175 HB2 PHE A 12 2.007 -1.661 4.839 1.00 65.11 H ATOM 176 HB3 PHE A 12 0.691 -0.503 5.006 1.00 23.03 H ATOM 177 HD1 PHE A 12 1.607 -3.634 3.218 1.00 51.54 H ATOM 178 HD2 PHE A 12 -1.498 -1.224 4.851 1.00 50.01 H ATOM 179 HE1 PHE A 12 -0.018 -5.424 2.761 1.00 43.12 H ATOM 180 HE2 PHE A 12 -3.128 -3.011 4.398 1.00 3.10 H ATOM 181 HZ PHE A 12 -2.389 -5.115 3.353 1.00 33.30 H ATOM 182 N THR A 13 -0.066 0.210 1.505 1.00 34.45 N ATOM 183 CA THR A 13 -1.097 1.085 0.959 1.00 63.35 C ATOM 184 C THR A 13 -2.408 0.332 0.763 1.00 72.53 C ATOM 185 O THR A 13 -2.412 -0.847 0.413 1.00 44.21 O ATOM 186 CB THR A 13 -0.662 1.696 -0.386 1.00 23.40 C ATOM 187 OG1 THR A 13 0.526 2.475 -0.209 1.00 75.52 O ATOM 188 CG2 THR A 13 -1.765 2.568 -0.966 1.00 34.11 C ATOM 189 H THR A 13 0.158 -0.617 1.032 1.00 41.34 H ATOM 190 HA THR A 13 -1.257 1.890 1.663 1.00 13.53 H ATOM 191 HB THR A 13 -0.456 0.893 -1.078 1.00 13.23 H ATOM 192 HG1 THR A 13 0.290 3.352 0.105 1.00 11.15 H ATOM 193 HG21 THR A 13 -1.325 3.381 -1.524 1.00 52.20 H ATOM 194 HG22 THR A 13 -2.369 2.967 -0.164 1.00 4.12 H ATOM 195 HG23 THR A 13 -2.384 1.976 -1.622 1.00 50.42 H ATOM 196 N CYS A 14 -3.521 1.023 0.990 1.00 22.23 N ATOM 197 CA CYS A 14 -4.839 0.420 0.837 1.00 70.13 C ATOM 198 C CYS A 14 -5.670 1.183 -0.191 1.00 60.11 C ATOM 199 O CYS A 14 -5.316 2.292 -0.594 1.00 44.01 O ATOM 200 CB CYS A 14 -5.569 0.394 2.182 1.00 54.40 C ATOM 201 SG CYS A 14 -4.916 -0.833 3.359 1.00 52.44 S ATOM 202 H CYS A 14 -3.454 1.962 1.267 1.00 43.12 H ATOM 203 HA CYS A 14 -4.703 -0.593 0.491 1.00 74.41 H ATOM 204 HB2 CYS A 14 -5.491 1.367 2.645 1.00 22.32 H ATOM 205 HB3 CYS A 14 -6.612 0.166 2.012 1.00 42.12 H ATOM 206 N THR A 15 -6.779 0.582 -0.611 1.00 3.00 N ATOM 207 CA THR A 15 -7.660 1.202 -1.592 1.00 75.42 C ATOM 208 C THR A 15 -9.079 1.337 -1.049 1.00 3.32 C ATOM 209 O THR A 15 -9.515 0.571 -0.190 1.00 13.34 O ATOM 210 CB THR A 15 -7.699 0.394 -2.903 1.00 32.45 C ATOM 211 OG1 THR A 15 -8.172 -0.933 -2.648 1.00 30.44 O ATOM 212 CG2 THR A 15 -6.319 0.333 -3.541 1.00 42.21 C ATOM 213 H THR A 15 -7.008 -0.301 -0.253 1.00 51.13 H ATOM 214 HA THR A 15 -7.274 2.187 -1.812 1.00 61.44 H ATOM 215 HB THR A 15 -8.375 0.884 -3.590 1.00 60.44 H ATOM 216 HG1 THR A 15 -9.081 -1.010 -2.944 1.00 13.31 H ATOM 217 HG21 THR A 15 -5.794 1.259 -3.354 1.00 51.42 H ATOM 218 HG22 THR A 15 -6.421 0.185 -4.606 1.00 3.13 H ATOM 219 HG23 THR A 15 -5.763 -0.488 -3.115 1.00 41.11 H ATOM 220 N PRO A 16 -9.817 2.333 -1.562 1.00 41.35 N ATOM 221 CA PRO A 16 -11.199 2.589 -1.144 1.00 62.02 C ATOM 222 C PRO A 16 -12.159 1.503 -1.615 1.00 5.34 C ATOM 223 O PRO A 16 -13.269 1.375 -1.100 1.00 74.30 O ATOM 224 CB PRO A 16 -11.530 3.924 -1.816 1.00 64.20 C ATOM 225 CG PRO A 16 -10.625 3.989 -2.998 1.00 64.13 C ATOM 226 CD PRO A 16 -9.361 3.283 -2.590 1.00 62.12 C ATOM 227 HA PRO A 16 -11.275 2.695 -0.072 1.00 11.11 H ATOM 228 HB2 PRO A 16 -12.569 3.932 -2.112 1.00 11.12 H ATOM 229 HB3 PRO A 16 -11.339 4.734 -1.128 1.00 73.11 H ATOM 230 HG2 PRO A 16 -11.080 3.486 -3.837 1.00 33.53 H ATOM 231 HG3 PRO A 16 -10.415 5.019 -3.243 1.00 52.13 H ATOM 232 HD2 PRO A 16 -8.930 2.763 -3.432 1.00 11.55 H ATOM 233 HD3 PRO A 16 -8.652 3.986 -2.175 1.00 15.21 H ATOM 234 N ASP A 17 -11.724 0.722 -2.598 1.00 44.35 N ATOM 235 CA ASP A 17 -12.544 -0.357 -3.138 1.00 33.31 C ATOM 236 C ASP A 17 -12.704 -1.481 -2.120 1.00 23.14 C ATOM 237 O ASP A 17 -13.801 -2.005 -1.926 1.00 61.54 O ATOM 238 CB ASP A 17 -11.925 -0.901 -4.427 1.00 75.23 C ATOM 239 CG ASP A 17 -12.022 0.083 -5.576 1.00 41.12 C ATOM 240 OD1 ASP A 17 -11.414 1.169 -5.481 1.00 62.25 O ATOM 241 OD2 ASP A 17 -12.706 -0.233 -6.572 1.00 52.41 O ATOM 242 H ASP A 17 -10.829 0.872 -2.968 1.00 31.44 H ATOM 243 HA ASP A 17 -13.519 0.050 -3.362 1.00 14.25 H ATOM 244 HB2 ASP A 17 -10.882 -1.121 -4.253 1.00 72.42 H ATOM 245 HB3 ASP A 17 -12.438 -1.809 -4.708 1.00 13.23 H