ATOM 27 N PRO A 2 -12.366 1.658 1.838 1.00 0.46 N ATOM 28 CA PRO A 2 -12.020 0.725 2.909 1.00 0.34 C ATOM 29 C PRO A 2 -10.564 0.847 3.352 1.00 0.26 C ATOM 30 O PRO A 2 -10.273 0.905 4.548 1.00 0.36 O ATOM 31 CB PRO A 2 -12.276 -0.660 2.297 1.00 0.51 C ATOM 32 CG PRO A 2 -13.058 -0.412 1.053 1.00 0.64 C ATOM 33 CD PRO A 2 -12.666 0.957 0.584 1.00 0.62 C ATOM 34 HA PRO A 2 -12.662 0.862 3.764 1.00 0.46 H ATOM 35 HB2 PRO A 2 -11.331 -1.136 2.078 1.00 0.74 H ATOM 36 HB3 PRO A 2 -12.833 -1.266 2.997 1.00 0.61 H ATOM 37 HG2 PRO A 2 -12.804 -1.150 0.307 1.00 0.84 H ATOM 38 HG3 PRO A 2 -14.114 -0.446 1.271 1.00 0.81 H ATOM 39 HD2 PRO A 2 -11.793 0.905 -0.048 1.00 0.66 H ATOM 40 HD3 PRO A 2 -13.486 1.427 0.066 1.00 0.81 H ATOM 41 N PHE A 3 -9.647 0.879 2.391 1.00 0.17 N ATOM 42 CA PHE A 3 -8.225 0.918 2.703 1.00 0.16 C ATOM 43 C PHE A 3 -7.502 1.943 1.843 1.00 0.18 C ATOM 44 O PHE A 3 -7.913 2.222 0.715 1.00 0.22 O ATOM 45 CB PHE A 3 -7.606 -0.470 2.509 1.00 0.16 C ATOM 46 CG PHE A 3 -8.229 -1.512 3.388 1.00 0.19 C ATOM 47 CD1 PHE A 3 -9.246 -2.321 2.912 1.00 0.20 C ATOM 48 CD2 PHE A 3 -7.782 -1.698 4.684 1.00 0.27 C ATOM 49 CE1 PHE A 3 -9.802 -3.298 3.712 1.00 0.27 C ATOM 50 CE2 PHE A 3 -8.335 -2.669 5.491 1.00 0.34 C ATOM 51 CZ PHE A 3 -9.417 -3.412 5.026 1.00 0.33 C ATOM 52 H PHE A 3 -9.930 0.875 1.449 1.00 0.19 H ATOM 53 HA PHE A 3 -8.123 1.203 3.740 1.00 0.20 H ATOM 54 HB2 PHE A 3 -7.736 -0.777 1.482 1.00 0.17 H ATOM 55 HB3 PHE A 3 -6.554 -0.424 2.733 1.00 0.22 H ATOM 56 HD1 PHE A 3 -9.602 -2.186 1.902 1.00 0.22 H ATOM 57 HD2 PHE A 3 -6.990 -1.068 5.065 1.00 0.31 H ATOM 58 HE1 PHE A 3 -10.595 -3.922 3.328 1.00 0.31 H ATOM 59 HE2 PHE A 3 -7.977 -2.803 6.499 1.00 0.42 H ATOM 60 HZ PHE A 3 -9.882 -4.149 5.663 1.00 0.39 H ATOM 80 N CYS A 5 -3.234 3.478 1.369 1.00 0.30 N ATOM 81 CA CYS A 5 -1.845 3.531 1.786 1.00 0.37 C ATOM 82 C CYS A 5 -1.500 4.915 2.308 1.00 0.50 C ATOM 83 O CYS A 5 -1.500 5.893 1.560 1.00 1.46 O ATOM 84 CB CYS A 5 -0.925 3.164 0.625 1.00 0.41 C ATOM 85 SG CYS A 5 0.819 3.476 0.958 1.00 0.53 S ATOM 86 H CYS A 5 -3.443 3.427 0.409 1.00 0.32 H ATOM 87 HA CYS A 5 -1.710 2.814 2.582 1.00 0.39 H ATOM 88 HB2 CYS A 5 -1.033 2.114 0.407 1.00 0.85 H ATOM 89 HB3 CYS A 5 -1.203 3.738 -0.242 1.00 0.86 H ATOM 90 N THR A 6 -1.191 4.988 3.590 1.00 0.57 N ATOM 91 CA THR A 6 -0.920 6.254 4.239 1.00 0.58 C ATOM 92 C THR A 6 0.546 6.662 4.104 1.00 0.51 C ATOM 93 O THR A 6 1.061 7.441 4.905 1.00 0.63 O ATOM 94 CB THR A 6 -1.314 6.187 5.726 1.00 0.71 C ATOM 95 OG1 THR A 6 -0.751 5.011 6.327 1.00 1.08 O ATOM 96 CG2 THR A 6 -2.829 6.163 5.880 1.00 0.85 C ATOM 97 H THR A 6 -1.148 4.164 4.120 1.00 1.32 H ATOM 98 HA THR A 6 -1.534 7.006 3.763 1.00 0.58 H ATOM 99 HB THR A 6 -0.928 7.063 6.230 1.00 0.85 H ATOM 100 HG1 THR A 6 0.001 5.265 6.878 1.00 1.37 H ATOM 101 HG21 THR A 6 -3.246 7.073 5.474 1.00 1.41 H ATOM 102 HG22 THR A 6 -3.085 6.085 6.926 1.00 1.37 H ATOM 103 HG23 THR A 6 -3.230 5.314 5.347 1.00 1.33 H ATOM 104 N TRP A 7 1.219 6.135 3.087 1.00 0.39 N ATOM 105 CA TRP A 7 2.596 6.510 2.820 1.00 0.32 C ATOM 106 C TRP A 7 2.630 7.828 2.056 1.00 0.26 C ATOM 107 O TRP A 7 1.888 8.019 1.081 1.00 0.25 O ATOM 108 CB TRP A 7 3.310 5.419 2.026 1.00 0.27 C ATOM 109 CG TRP A 7 4.803 5.523 2.083 1.00 0.31 C ATOM 110 CD1 TRP A 7 5.607 6.287 1.290 1.00 0.34 C ATOM 111 CD2 TRP A 7 5.670 4.828 2.986 1.00 0.42 C ATOM 112 NE1 TRP A 7 6.922 6.112 1.644 1.00 0.43 N ATOM 113 CE2 TRP A 7 6.988 5.219 2.683 1.00 0.47 C ATOM 114 CE3 TRP A 7 5.459 3.914 4.020 1.00 0.54 C ATOM 115 CZ2 TRP A 7 8.089 4.723 3.379 1.00 0.60 C ATOM 116 CZ3 TRP A 7 6.552 3.424 4.710 1.00 0.67 C ATOM 117 CH2 TRP A 7 7.851 3.829 4.387 1.00 0.69 C ATOM 118 H TRP A 7 0.779 5.477 2.506 1.00 0.39 H ATOM 119 HA TRP A 7 3.096 6.642 3.768 1.00 0.39 H ATOM 120 HB2 TRP A 7 3.028 4.453 2.418 1.00 0.32 H ATOM 121 HB3 TRP A 7 3.011 5.482 0.991 1.00 0.19 H ATOM 122 HD1 TRP A 7 5.247 6.933 0.504 1.00 0.35 H ATOM 123 HE1 TRP A 7 7.691 6.554 1.224 1.00 0.49 H ATOM 124 HE3 TRP A 7 4.462 3.592 4.284 1.00 0.55 H ATOM 125 HZ2 TRP A 7 9.098 5.026 3.143 1.00 0.65 H ATOM 126 HZ3 TRP A 7 6.409 2.717 5.511 1.00 0.78 H ATOM 127 HH2 TRP A 7 8.673 3.418 4.952 1.00 0.80 H ATOM 128 N SER A 8 3.488 8.727 2.514 1.00 0.31 N ATOM 129 CA SER A 8 3.608 10.059 1.945 1.00 0.32 C ATOM 130 C SER A 8 3.979 9.998 0.463 1.00 0.24 C ATOM 131 O SER A 8 4.842 9.213 0.058 1.00 0.25 O ATOM 132 CB SER A 8 4.658 10.854 2.722 1.00 0.44 C ATOM 133 OG SER A 8 4.727 12.195 2.275 1.00 1.21 O ATOM 134 H SER A 8 4.060 8.487 3.275 1.00 0.38 H ATOM 135 HA SER A 8 2.653 10.549 2.046 1.00 0.40 H ATOM 136 HB2 SER A 8 4.402 10.854 3.770 1.00 0.97 H ATOM 137 HB3 SER A 8 5.625 10.392 2.588 1.00 1.05 H ATOM 138 HG SER A 8 5.395 12.668 2.788 1.00 1.57 H ATOM 139 N TYR A 9 3.300 10.828 -0.335 1.00 0.28 N ATOM 140 CA TYR A 9 3.527 10.910 -1.779 1.00 0.33 C ATOM 141 C TYR A 9 3.128 9.620 -2.487 1.00 0.32 C ATOM 142 O TYR A 9 3.497 9.392 -3.637 1.00 0.58 O ATOM 143 CB TYR A 9 4.983 11.268 -2.094 1.00 0.40 C ATOM 144 CG TYR A 9 5.348 12.691 -1.732 1.00 0.89 C ATOM 145 CD1 TYR A 9 6.024 12.970 -0.554 1.00 1.47 C ATOM 146 CD2 TYR A 9 5.017 13.751 -2.566 1.00 1.03 C ATOM 147 CE1 TYR A 9 6.361 14.264 -0.216 1.00 2.14 C ATOM 148 CE2 TYR A 9 5.352 15.049 -2.235 1.00 1.69 C ATOM 149 CZ TYR A 9 6.011 15.307 -1.071 1.00 2.23 C ATOM 150 OH TYR A 9 6.363 16.593 -0.725 1.00 2.92 O ATOM 151 H TYR A 9 2.616 11.407 0.066 1.00 0.36 H ATOM 152 HA TYR A 9 2.895 11.702 -2.153 1.00 0.42 H ATOM 153 HB2 TYR A 9 5.635 10.608 -1.545 1.00 0.61 H ATOM 154 HB3 TYR A 9 5.157 11.140 -3.152 1.00 0.77 H ATOM 155 HD1 TYR A 9 6.287 12.156 0.104 1.00 1.44 H ATOM 156 HD2 TYR A 9 4.489 13.550 -3.486 1.00 0.75 H ATOM 157 HE1 TYR A 9 6.887 14.460 0.706 1.00 2.61 H ATOM 158 HE2 TYR A 9 5.086 15.859 -2.898 1.00 1.81 H ATOM 159 HH TYR A 9 5.613 17.177 -0.898 1.00 3.02 H ATOM 160 N CYS A 10 2.385 8.773 -1.792 1.00 0.23 N ATOM 161 CA CYS A 10 1.826 7.585 -2.403 1.00 0.21 C ATOM 162 C CYS A 10 0.303 7.671 -2.398 1.00 0.16 C ATOM 163 O CYS A 10 -0.308 7.964 -3.427 1.00 0.21 O ATOM 164 CB CYS A 10 2.302 6.331 -1.673 1.00 0.27 C ATOM 165 SG CYS A 10 1.751 4.789 -2.430 1.00 0.27 S ATOM 166 H CYS A 10 2.219 8.946 -0.840 1.00 0.37 H ATOM 167 HA CYS A 10 2.169 7.549 -3.426 1.00 0.27 H ATOM 168 HB2 CYS A 10 3.383 6.320 -1.654 1.00 0.35 H ATOM 169 HB3 CYS A 10 1.931 6.351 -0.661 1.00 0.28 H ATOM 170 N GLY A 11 -0.299 7.445 -1.233 1.00 0.18 N ATOM 171 CA GLY A 11 -1.743 7.552 -1.094 1.00 0.24 C ATOM 172 C GLY A 11 -2.526 6.705 -2.088 1.00 0.24 C ATOM 173 O GLY A 11 -3.516 7.168 -2.656 1.00 0.34 O ATOM 174 H GLY A 11 0.246 7.221 -0.447 1.00 0.22 H ATOM 175 HA2 GLY A 11 -2.015 7.246 -0.096 1.00 0.31 H ATOM 176 HA3 GLY A 11 -2.025 8.585 -1.224 1.00 0.28 H ATOM 177 N LYS A 12 -2.087 5.473 -2.304 1.00 0.19 N ATOM 178 CA LYS A 12 -2.803 4.554 -3.182 1.00 0.20 C ATOM 179 C LYS A 12 -3.922 3.857 -2.408 1.00 0.21 C ATOM 180 O LYS A 12 -3.702 3.356 -1.308 1.00 0.25 O ATOM 181 CB LYS A 12 -1.833 3.528 -3.781 1.00 0.18 C ATOM 182 CG LYS A 12 -2.493 2.564 -4.754 1.00 0.22 C ATOM 183 CD LYS A 12 -1.477 1.700 -5.491 1.00 0.29 C ATOM 184 CE LYS A 12 -0.932 2.382 -6.745 1.00 0.65 C ATOM 185 NZ LYS A 12 -0.113 3.583 -6.437 1.00 1.58 N1+ ATOM 186 H LYS A 12 -1.265 5.178 -1.872 1.00 0.21 H ATOM 187 HA LYS A 12 -3.242 5.133 -3.981 1.00 0.22 H ATOM 188 HB2 LYS A 12 -1.048 4.054 -4.302 1.00 0.23 H ATOM 189 HB3 LYS A 12 -1.398 2.951 -2.978 1.00 0.19 H ATOM 190 HG2 LYS A 12 -3.159 1.919 -4.203 1.00 0.24 H ATOM 191 HG3 LYS A 12 -3.059 3.132 -5.477 1.00 0.25 H ATOM 192 HD2 LYS A 12 -0.653 1.487 -4.825 1.00 0.52 H ATOM 193 HD3 LYS A 12 -1.954 0.774 -5.778 1.00 0.57 H ATOM 194 HE2 LYS A 12 -0.320 1.676 -7.286 1.00 1.14 H ATOM 195 HE3 LYS A 12 -1.765 2.679 -7.365 1.00 1.38 H ATOM 196 HZ1 LYS A 12 0.670 3.333 -5.798 1.00 2.17 H ATOM 197 HZ2 LYS A 12 -0.696 4.315 -5.983 1.00 2.12 H ATOM 198 HZ3 LYS A 12 0.286 3.974 -7.311 1.00 1.99 H ATOM 199 N ARG A 13 -5.117 3.840 -2.982 1.00 0.23 N ATOM 200 CA ARG A 13 -6.290 3.293 -2.298 1.00 0.24 C ATOM 201 C ARG A 13 -6.519 1.825 -2.650 1.00 0.17 C ATOM 202 O ARG A 13 -6.190 1.381 -3.753 1.00 0.20 O ATOM 203 CB ARG A 13 -7.537 4.117 -2.638 1.00 0.36 C ATOM 204 CG ARG A 13 -7.894 4.116 -4.119 1.00 1.04 C ATOM 205 CD ARG A 13 -9.148 4.931 -4.391 1.00 1.28 C ATOM 206 NE ARG A 13 -10.328 4.352 -3.752 1.00 1.98 N ATOM 207 CZ ARG A 13 -11.515 4.950 -3.696 1.00 2.53 C ATOM 208 NH1 ARG A 13 -11.679 6.163 -4.213 1.00 2.60 N1+ ATOM 209 NH2 ARG A 13 -12.535 4.333 -3.115 1.00 3.50 N ATOM 210 H ARG A 13 -5.216 4.201 -3.886 1.00 0.27 H ATOM 211 HA ARG A 13 -6.110 3.363 -1.236 1.00 0.27 H ATOM 212 HB2 ARG A 13 -8.376 3.720 -2.089 1.00 1.10 H ATOM 213 HB3 ARG A 13 -7.370 5.139 -2.333 1.00 0.89 H ATOM 214 HG2 ARG A 13 -7.076 4.538 -4.680 1.00 1.60 H ATOM 215 HG3 ARG A 13 -8.062 3.097 -4.435 1.00 1.80 H ATOM 216 HD2 ARG A 13 -9.002 5.931 -4.010 1.00 1.73 H ATOM 217 HD3 ARG A 13 -9.313 4.973 -5.458 1.00 1.74 H ATOM 218 HE ARG A 13 -10.227 3.459 -3.352 1.00 2.48 H ATOM 219 HH11 ARG A 13 -10.906 6.634 -4.651 1.00 2.46 H ATOM 220 HH12 ARG A 13 -12.575 6.613 -4.177 1.00 3.18 H ATOM 221 HH21 ARG A 13 -12.413 3.418 -2.719 1.00 3.96 H ATOM 222 HH22 ARG A 13 -13.437 4.769 -3.080 1.00 3.94 H ATOM 223 N PHE A 14 -7.085 1.076 -1.701 1.00 0.14 N ATOM 224 CA PHE A 14 -7.356 -0.347 -1.886 1.00 0.12 C ATOM 225 C PHE A 14 -8.703 -0.724 -1.284 1.00 0.13 C ATOM 226 O PHE A 14 -9.260 0.004 -0.455 1.00 0.20 O ATOM 227 CB PHE A 14 -6.257 -1.191 -1.240 1.00 0.15 C ATOM 228 CG PHE A 14 -4.897 -0.903 -1.788 1.00 0.16 C ATOM 229 CD1 PHE A 14 -4.023 -0.085 -1.098 1.00 0.17 C ATOM 230 CD2 PHE A 14 -4.491 -1.458 -2.985 1.00 0.21 C ATOM 231 CE1 PHE A 14 -2.764 0.175 -1.594 1.00 0.19 C ATOM 232 CE2 PHE A 14 -3.234 -1.202 -3.487 1.00 0.25 C ATOM 233 CZ PHE A 14 -2.388 -0.352 -2.815 1.00 0.22 C ATOM 234 H PHE A 14 -7.333 1.496 -0.847 1.00 0.18 H ATOM 235 HA PHE A 14 -7.378 -0.549 -2.947 1.00 0.15 H ATOM 236 HB2 PHE A 14 -6.237 -1.000 -0.177 1.00 0.18 H ATOM 237 HB3 PHE A 14 -6.469 -2.238 -1.410 1.00 0.18 H ATOM 238 HD1 PHE A 14 -4.334 0.352 -0.161 1.00 0.21 H ATOM 239 HD2 PHE A 14 -5.168 -2.101 -3.527 1.00 0.25 H ATOM 240 HE1 PHE A 14 -2.089 0.813 -1.048 1.00 0.23 H ATOM 241 HE2 PHE A 14 -2.925 -1.638 -4.424 1.00 0.31 H ATOM 242 HZ PHE A 14 -1.408 -0.137 -3.213 1.00 0.25 H ATOM 243 N THR A 15 -9.217 -1.865 -1.710 1.00 0.15 N ATOM 244 CA THR A 15 -10.511 -2.344 -1.263 1.00 0.16 C ATOM 245 C THR A 15 -10.376 -3.463 -0.233 1.00 0.15 C ATOM 246 O THR A 15 -11.320 -3.754 0.501 1.00 0.24 O ATOM 247 CB THR A 15 -11.344 -2.848 -2.454 1.00 0.30 C ATOM 248 OG1 THR A 15 -10.563 -3.750 -3.254 1.00 1.39 O ATOM 249 CG2 THR A 15 -11.821 -1.688 -3.317 1.00 1.29 C ATOM 250 H THR A 15 -8.714 -2.401 -2.359 1.00 0.22 H ATOM 251 HA THR A 15 -11.035 -1.515 -0.811 1.00 0.22 H ATOM 252 HB THR A 15 -12.207 -3.373 -2.073 1.00 1.10 H ATOM 253 HG1 THR A 15 -11.141 -4.194 -3.886 1.00 1.76 H ATOM 254 HG21 THR A 15 -12.387 -2.071 -4.153 1.00 1.89 H ATOM 255 HG22 THR A 15 -10.967 -1.137 -3.681 1.00 1.94 H ATOM 256 HG23 THR A 15 -12.446 -1.033 -2.729 1.00 1.79 H ATOM 257 N ARG A 16 -9.199 -4.084 -0.175 1.00 0.17 N ATOM 258 CA ARG A 16 -8.966 -5.183 0.758 1.00 0.27 C ATOM 259 C ARG A 16 -7.620 -5.021 1.465 1.00 0.21 C ATOM 260 O ARG A 16 -6.657 -4.484 0.907 1.00 0.21 O ATOM 261 CB ARG A 16 -9.039 -6.530 0.029 1.00 0.45 C ATOM 262 CG ARG A 16 -7.951 -6.736 -1.010 1.00 0.85 C ATOM 263 CD ARG A 16 -8.213 -7.964 -1.870 1.00 0.79 C ATOM 264 NE ARG A 16 -9.438 -7.822 -2.654 1.00 1.28 N ATOM 265 CZ ARG A 16 -9.525 -8.078 -3.959 1.00 1.66 C ATOM 266 NH1 ARG A 16 -8.461 -8.505 -4.634 1.00 1.39 N1+ ATOM 267 NH2 ARG A 16 -10.680 -7.905 -4.588 1.00 2.76 N ATOM 268 H ARG A 16 -8.475 -3.795 -0.770 1.00 0.19 H ATOM 269 HA ARG A 16 -9.747 -5.145 1.502 1.00 0.36 H ATOM 270 HB2 ARG A 16 -8.961 -7.322 0.757 1.00 1.12 H ATOM 271 HB3 ARG A 16 -9.995 -6.603 -0.465 1.00 1.03 H ATOM 272 HG2 ARG A 16 -7.910 -5.867 -1.648 1.00 1.39 H ATOM 273 HG3 ARG A 16 -7.004 -6.858 -0.505 1.00 1.46 H ATOM 274 HD2 ARG A 16 -7.381 -8.101 -2.543 1.00 1.08 H ATOM 275 HD3 ARG A 16 -8.303 -8.829 -1.230 1.00 1.58 H ATOM 276 HE ARG A 16 -10.246 -7.513 -2.176 1.00 1.89 H ATOM 277 HH11 ARG A 16 -7.583 -8.637 -4.167 1.00 1.31 H ATOM 278 HH12 ARG A 16 -8.533 -8.701 -5.615 1.00 1.83 H ATOM 279 HH21 ARG A 16 -11.485 -7.584 -4.083 1.00 3.33 H ATOM 280 HH22 ARG A 16 -10.751 -8.084 -5.575 1.00 3.11 H ATOM 281 N SER A 17 -7.581 -5.488 2.709 1.00 0.26 N ATOM 282 CA SER A 17 -6.442 -5.285 3.594 1.00 0.28 C ATOM 283 C SER A 17 -5.216 -6.066 3.146 1.00 0.23 C ATOM 284 O SER A 17 -4.092 -5.604 3.320 1.00 0.21 O ATOM 285 CB SER A 17 -6.821 -5.684 5.018 1.00 0.40 C ATOM 286 OG SER A 17 -7.472 -6.944 5.036 1.00 1.27 O ATOM 287 H SER A 17 -8.353 -5.992 3.049 1.00 0.32 H ATOM 288 HA SER A 17 -6.202 -4.233 3.582 1.00 0.29 H ATOM 289 HB2 SER A 17 -5.929 -5.743 5.624 1.00 0.87 H ATOM 290 HB3 SER A 17 -7.487 -4.942 5.433 1.00 0.69 H ATOM 291 HG SER A 17 -7.288 -7.387 5.875 1.00 1.46 H ATOM 292 N ASP A 18 -5.432 -7.247 2.577 1.00 0.25 N ATOM 293 CA ASP A 18 -4.325 -8.074 2.104 1.00 0.22 C ATOM 294 C ASP A 18 -3.613 -7.393 0.948 1.00 0.17 C ATOM 295 O ASP A 18 -2.394 -7.474 0.825 1.00 0.16 O ATOM 296 CB ASP A 18 -4.807 -9.462 1.670 1.00 0.29 C ATOM 297 CG ASP A 18 -5.266 -10.321 2.830 1.00 1.32 C ATOM 298 OD1 ASP A 18 -6.491 -10.391 3.081 1.00 2.08 O ATOM 299 OD2 ASP A 18 -4.407 -10.917 3.511 1.00 1.92 O1- ATOM 300 H ASP A 18 -6.352 -7.573 2.482 1.00 0.30 H ATOM 301 HA ASP A 18 -3.628 -8.185 2.920 1.00 0.23 H ATOM 302 HB2 ASP A 18 -5.631 -9.350 0.985 1.00 1.10 H ATOM 303 HB3 ASP A 18 -3.997 -9.971 1.168 1.00 1.02 H ATOM 304 N GLU A 19 -4.382 -6.706 0.115 1.00 0.17 N ATOM 305 CA GLU A 19 -3.826 -5.984 -1.017 1.00 0.17 C ATOM 306 C GLU A 19 -3.000 -4.808 -0.522 1.00 0.12 C ATOM 307 O GLU A 19 -1.862 -4.618 -0.943 1.00 0.14 O ATOM 308 CB GLU A 19 -4.941 -5.495 -1.937 1.00 0.26 C ATOM 309 CG GLU A 19 -4.441 -4.861 -3.220 1.00 0.35 C ATOM 310 CD GLU A 19 -3.614 -5.808 -4.063 1.00 1.04 C ATOM 311 OE1 GLU A 19 -4.156 -6.834 -4.525 1.00 1.02 O ATOM 312 OE2 GLU A 19 -2.421 -5.520 -4.285 1.00 1.74 O1- ATOM 313 H GLU A 19 -5.347 -6.681 0.268 1.00 0.21 H ATOM 314 HA GLU A 19 -3.185 -6.657 -1.563 1.00 0.19 H ATOM 315 HB2 GLU A 19 -5.573 -6.330 -2.195 1.00 0.27 H ATOM 316 HB3 GLU A 19 -5.531 -4.762 -1.407 1.00 0.35 H ATOM 317 HG2 GLU A 19 -5.291 -4.538 -3.798 1.00 0.53 H ATOM 318 HG3 GLU A 19 -3.834 -4.006 -2.964 1.00 0.50 H ATOM 319 N LEU A 20 -3.576 -4.034 0.395 1.00 0.12 N ATOM 320 CA LEU A 20 -2.864 -2.926 1.011 1.00 0.13 C ATOM 321 C LEU A 20 -1.602 -3.421 1.707 1.00 0.13 C ATOM 322 O LEU A 20 -0.549 -2.806 1.604 1.00 0.16 O ATOM 323 CB LEU A 20 -3.763 -2.200 2.015 1.00 0.16 C ATOM 324 CG LEU A 20 -3.044 -1.193 2.916 1.00 0.20 C ATOM 325 CD1 LEU A 20 -2.439 -0.069 2.094 1.00 0.23 C ATOM 326 CD2 LEU A 20 -3.995 -0.633 3.955 1.00 0.26 C ATOM 327 H LEU A 20 -4.505 -4.212 0.659 1.00 0.14 H ATOM 328 HA LEU A 20 -2.583 -2.237 0.229 1.00 0.14 H ATOM 329 HB2 LEU A 20 -4.532 -1.675 1.465 1.00 0.17 H ATOM 330 HB3 LEU A 20 -4.235 -2.939 2.641 1.00 0.17 H ATOM 331 HG LEU A 20 -2.239 -1.696 3.434 1.00 0.18 H ATOM 332 HD11 LEU A 20 -1.874 0.586 2.740 1.00 0.95 H ATOM 333 HD12 LEU A 20 -3.229 0.492 1.618 1.00 0.97 H ATOM 334 HD13 LEU A 20 -1.786 -0.483 1.340 1.00 0.93 H ATOM 335 HD21 LEU A 20 -4.754 -0.045 3.463 1.00 0.95 H ATOM 336 HD22 LEU A 20 -3.447 -0.010 4.646 1.00 1.12 H ATOM 337 HD23 LEU A 20 -4.461 -1.446 4.492 1.00 1.07 H ATOM 338 N GLN A 21 -1.717 -4.541 2.405 1.00 0.14 N ATOM 339 CA GLN A 21 -0.585 -5.112 3.120 1.00 0.18 C ATOM 340 C GLN A 21 0.516 -5.522 2.149 1.00 0.13 C ATOM 341 O GLN A 21 1.694 -5.233 2.378 1.00 0.14 O ATOM 342 CB GLN A 21 -1.028 -6.311 3.959 1.00 0.26 C ATOM 343 CG GLN A 21 0.063 -6.845 4.871 1.00 1.03 C ATOM 344 CD GLN A 21 0.579 -5.793 5.834 1.00 1.68 C ATOM 345 OE1 GLN A 21 0.050 -5.627 6.933 1.00 2.43 O ATOM 346 NE2 GLN A 21 1.616 -5.077 5.429 1.00 2.23 N ATOM 347 H GLN A 21 -2.589 -4.993 2.447 1.00 0.16 H ATOM 348 HA GLN A 21 -0.195 -4.350 3.778 1.00 0.23 H ATOM 349 HB2 GLN A 21 -1.870 -6.018 4.569 1.00 0.77 H ATOM 350 HB3 GLN A 21 -1.335 -7.106 3.295 1.00 0.88 H ATOM 351 HG2 GLN A 21 -0.335 -7.669 5.442 1.00 1.67 H ATOM 352 HG3 GLN A 21 0.885 -7.191 4.262 1.00 1.69 H ATOM 353 HE21 GLN A 21 1.991 -5.262 4.540 1.00 2.41 H ATOM 354 HE22 GLN A 21 1.976 -4.394 6.037 1.00 2.84 H ATOM 355 N ARG A 22 0.125 -6.184 1.064 1.00 0.13 N ATOM 356 CA ARG A 22 1.069 -6.551 0.016 1.00 0.15 C ATOM 357 C ARG A 22 1.742 -5.304 -0.525 1.00 0.13 C ATOM 358 O ARG A 22 2.961 -5.259 -0.693 1.00 0.17 O ATOM 359 CB ARG A 22 0.370 -7.284 -1.130 1.00 0.25 C ATOM 360 CG ARG A 22 -0.057 -8.703 -0.801 1.00 1.01 C ATOM 361 CD ARG A 22 -0.795 -9.329 -1.974 1.00 1.50 C ATOM 362 NE ARG A 22 -1.205 -10.705 -1.700 1.00 2.22 N ATOM 363 CZ ARG A 22 -1.932 -11.444 -2.538 1.00 3.08 C ATOM 364 NH1 ARG A 22 -2.344 -10.934 -3.696 1.00 3.46 N1+ ATOM 365 NH2 ARG A 22 -2.247 -12.693 -2.219 1.00 3.93 N ATOM 366 H ARG A 22 -0.824 -6.421 0.962 1.00 0.15 H ATOM 367 HA ARG A 22 1.818 -7.195 0.449 1.00 0.18 H ATOM 368 HB2 ARG A 22 -0.511 -6.727 -1.411 1.00 0.87 H ATOM 369 HB3 ARG A 22 1.044 -7.322 -1.974 1.00 0.90 H ATOM 370 HG2 ARG A 22 0.821 -9.293 -0.582 1.00 1.58 H ATOM 371 HG3 ARG A 22 -0.710 -8.687 0.058 1.00 1.67 H ATOM 372 HD2 ARG A 22 -1.673 -8.739 -2.187 1.00 1.87 H ATOM 373 HD3 ARG A 22 -0.142 -9.324 -2.835 1.00 2.00 H ATOM 374 HE ARG A 22 -0.916 -11.100 -0.843 1.00 2.45 H ATOM 375 HH11 ARG A 22 -2.109 -9.992 -3.946 1.00 3.27 H ATOM 376 HH12 ARG A 22 -2.900 -11.488 -4.324 1.00 4.20 H ATOM 377 HH21 ARG A 22 -1.938 -13.086 -1.346 1.00 4.11 H ATOM 378 HH22 ARG A 22 -2.801 -13.249 -2.843 1.00 4.57 H ATOM 379 N HIS A 23 0.932 -4.290 -0.775 1.00 0.13 N ATOM 380 CA HIS A 23 1.419 -3.023 -1.279 1.00 0.16 C ATOM 381 C HIS A 23 2.376 -2.363 -0.284 1.00 0.19 C ATOM 382 O HIS A 23 3.420 -1.863 -0.675 1.00 0.25 O ATOM 383 CB HIS A 23 0.245 -2.092 -1.600 1.00 0.15 C ATOM 384 CG HIS A 23 0.680 -0.695 -1.888 1.00 0.14 C ATOM 385 ND1 HIS A 23 0.970 -0.205 -3.158 1.00 0.14 N ATOM 386 CD2 HIS A 23 0.956 0.303 -1.023 1.00 0.17 C ATOM 387 CE1 HIS A 23 1.429 1.051 -3.009 1.00 0.18 C ATOM 388 NE2 HIS A 23 1.428 1.367 -1.741 1.00 0.19 N ATOM 389 H HIS A 23 -0.034 -4.400 -0.619 1.00 0.14 H ATOM 390 HA HIS A 23 1.963 -3.222 -2.190 1.00 0.19 H ATOM 391 HB2 HIS A 23 -0.281 -2.466 -2.466 1.00 0.15 H ATOM 392 HB3 HIS A 23 -0.430 -2.066 -0.756 1.00 0.17 H ATOM 393 HD1 HIS A 23 0.858 -0.689 -4.007 1.00 0.14 H ATOM 394 HD2 HIS A 23 0.806 0.287 0.046 1.00 0.19 H ATOM 395 HE1 HIS A 23 1.741 1.698 -3.814 1.00 0.21 H ATOM 396 N LYS A 24 2.022 -2.362 0.996 1.00 0.19 N ATOM 397 CA LYS A 24 2.872 -1.759 2.027 1.00 0.25 C ATOM 398 C LYS A 24 4.263 -2.379 2.006 1.00 0.23 C ATOM 399 O LYS A 24 5.262 -1.723 2.328 1.00 0.28 O ATOM 400 CB LYS A 24 2.256 -1.924 3.419 1.00 0.32 C ATOM 401 CG LYS A 24 0.991 -1.103 3.637 1.00 0.37 C ATOM 402 CD LYS A 24 0.446 -1.261 5.049 1.00 0.54 C ATOM 403 CE LYS A 24 1.385 -0.665 6.093 1.00 1.15 C ATOM 404 NZ LYS A 24 1.592 0.795 5.892 1.00 1.57 N1+ ATOM 405 H LYS A 24 1.165 -2.767 1.255 1.00 0.17 H ATOM 406 HA LYS A 24 2.961 -0.707 1.804 1.00 0.30 H ATOM 407 HB2 LYS A 24 2.013 -2.965 3.566 1.00 0.30 H ATOM 408 HB3 LYS A 24 2.985 -1.627 4.159 1.00 0.39 H ATOM 409 HG2 LYS A 24 1.216 -0.061 3.465 1.00 0.47 H ATOM 410 HG3 LYS A 24 0.239 -1.429 2.934 1.00 0.32 H ATOM 411 HD2 LYS A 24 -0.509 -0.758 5.112 1.00 1.19 H ATOM 412 HD3 LYS A 24 0.313 -2.313 5.257 1.00 1.03 H ATOM 413 HE2 LYS A 24 0.964 -0.828 7.074 1.00 1.74 H ATOM 414 HE3 LYS A 24 2.339 -1.168 6.026 1.00 1.81 H ATOM 415 HZ1 LYS A 24 0.681 1.296 5.924 1.00 2.23 H ATOM 416 HZ2 LYS A 24 2.040 0.972 4.971 1.00 2.03 H ATOM 417 HZ3 LYS A 24 2.209 1.175 6.638 1.00 1.65 H ATOM 418 N ARG A 25 4.325 -3.638 1.594 1.00 0.20 N ATOM 419 CA ARG A 25 5.586 -4.355 1.517 1.00 0.22 C ATOM 420 C ARG A 25 6.458 -3.830 0.376 1.00 0.32 C ATOM 421 O ARG A 25 7.605 -4.240 0.230 1.00 0.47 O ATOM 422 CB ARG A 25 5.328 -5.854 1.357 1.00 0.21 C ATOM 423 CG ARG A 25 4.599 -6.451 2.545 1.00 0.26 C ATOM 424 CD ARG A 25 4.297 -7.928 2.355 1.00 0.77 C ATOM 425 NE ARG A 25 3.551 -8.472 3.489 1.00 1.30 N ATOM 426 CZ ARG A 25 2.647 -9.447 3.396 1.00 1.94 C ATOM 427 NH1 ARG A 25 2.391 -10.013 2.225 1.00 2.22 N1+ ATOM 428 NH2 ARG A 25 2.005 -9.860 4.481 1.00 2.76 N ATOM 429 H ARG A 25 3.494 -4.101 1.332 1.00 0.18 H ATOM 430 HA ARG A 25 6.106 -4.192 2.448 1.00 0.26 H ATOM 431 HB2 ARG A 25 4.730 -6.013 0.473 1.00 0.25 H ATOM 432 HB3 ARG A 25 6.272 -6.365 1.244 1.00 0.26 H ATOM 433 HG2 ARG A 25 5.213 -6.333 3.422 1.00 0.61 H ATOM 434 HG3 ARG A 25 3.670 -5.919 2.685 1.00 0.59 H ATOM 435 HD2 ARG A 25 3.715 -8.054 1.457 1.00 1.53 H ATOM 436 HD3 ARG A 25 5.229 -8.463 2.260 1.00 1.23 H ATOM 437 HE ARG A 25 3.735 -8.078 4.375 1.00 1.70 H ATOM 438 HH11 ARG A 25 2.875 -9.712 1.401 1.00 2.19 H ATOM 439 HH12 ARG A 25 1.715 -10.755 2.158 1.00 2.81 H ATOM 440 HH21 ARG A 25 1.323 -10.594 4.415 1.00 3.23 H ATOM 441 HH22 ARG A 25 2.199 -9.443 5.374 1.00 3.09 H ATOM 442 N THR A 26 5.914 -2.922 -0.431 1.00 0.31 N ATOM 443 CA THR A 26 6.688 -2.299 -1.495 1.00 0.41 C ATOM 444 C THR A 26 7.470 -1.106 -0.948 1.00 0.48 C ATOM 445 O THR A 26 8.450 -0.668 -1.550 1.00 0.63 O ATOM 446 CB THR A 26 5.804 -1.845 -2.690 1.00 0.41 C ATOM 447 OG1 THR A 26 6.583 -1.826 -3.896 1.00 1.27 O ATOM 448 CG2 THR A 26 5.215 -0.457 -2.472 1.00 1.04 C ATOM 449 H THR A 26 4.969 -2.674 -0.314 1.00 0.27 H ATOM 450 HA THR A 26 7.393 -3.033 -1.857 1.00 0.51 H ATOM 451 HB THR A 26 4.993 -2.550 -2.806 1.00 0.74 H ATOM 452 HG1 THR A 26 7.470 -1.499 -3.695 1.00 1.71 H ATOM 453 HG21 THR A 26 4.633 -0.174 -3.336 1.00 1.59 H ATOM 454 HG22 THR A 26 6.015 0.253 -2.327 1.00 1.43 H ATOM 455 HG23 THR A 26 4.581 -0.470 -1.598 1.00 1.79 H ATOM 456 N HIS A 27 7.035 -0.580 0.194 1.00 0.44 N ATOM 457 CA HIS A 27 7.737 0.525 0.830 1.00 0.56 C ATOM 458 C HIS A 27 8.724 -0.017 1.855 1.00 0.67 C ATOM 459 O HIS A 27 9.879 0.408 1.908 1.00 0.83 O ATOM 460 CB HIS A 27 6.767 1.492 1.516 1.00 0.55 C ATOM 461 CG HIS A 27 5.783 2.163 0.603 1.00 0.44 C ATOM 462 ND1 HIS A 27 6.113 3.141 -0.336 1.00 0.39 N ATOM 463 CD2 HIS A 27 4.438 2.009 0.526 1.00 0.39 C ATOM 464 CE1 HIS A 27 4.968 3.542 -0.929 1.00 0.30 C ATOM 465 NE2 HIS A 27 3.961 2.878 -0.429 1.00 0.29 N ATOM 466 H HIS A 27 6.226 -0.945 0.617 1.00 0.38 H ATOM 467 HA HIS A 27 8.283 1.054 0.066 1.00 0.62 H ATOM 468 HB2 HIS A 27 6.198 0.949 2.255 1.00 0.52 H ATOM 469 HB3 HIS A 27 7.336 2.264 2.013 1.00 0.67 H ATOM 470 HD1 HIS A 27 7.013 3.486 -0.526 1.00 0.44 H ATOM 471 HD2 HIS A 27 3.837 1.335 1.115 1.00 0.44 H ATOM 472 HE1 HIS A 27 4.894 4.304 -1.689 1.00 0.29 H