ATOM 1 N ARG A 1 13.853 -0.342 3.721 1.00 0.94 N ATOM 2 CA ARG A 1 13.041 -1.503 3.295 1.00 0.76 C ATOM 3 C ARG A 1 11.797 -1.022 2.556 1.00 0.57 C ATOM 4 O ARG A 1 11.243 0.030 2.884 1.00 0.60 O ATOM 5 CB ARG A 1 12.644 -2.360 4.507 1.00 0.96 C ATOM 6 CG ARG A 1 11.724 -1.660 5.494 1.00 1.90 C ATOM 7 CD ARG A 1 11.381 -2.562 6.669 1.00 2.39 C ATOM 8 NE ARG A 1 10.423 -1.937 7.579 1.00 2.87 N ATOM 9 CZ ARG A 1 9.902 -2.544 8.643 1.00 3.54 C ATOM 10 NH1 ARG A 1 10.256 -3.789 8.940 1.00 3.82 N1+ ATOM 11 NH2 ARG A 1 9.034 -1.901 9.415 1.00 4.30 N ATOM 12 H1 ARG A 1 14.187 0.183 2.884 1.00 1.46 H ATOM 13 H2 ARG A 1 14.677 -0.658 4.267 1.00 1.52 H ATOM 14 H3 ARG A 1 13.284 0.298 4.309 1.00 1.16 H ATOM 15 HA ARG A 1 13.636 -2.099 2.619 1.00 0.83 H ATOM 16 HB2 ARG A 1 12.143 -3.248 4.155 1.00 1.28 H ATOM 17 HB3 ARG A 1 13.542 -2.653 5.032 1.00 1.25 H ATOM 18 HG2 ARG A 1 12.219 -0.775 5.865 1.00 2.21 H ATOM 19 HG3 ARG A 1 10.813 -1.379 4.986 1.00 2.47 H ATOM 20 HD2 ARG A 1 10.959 -3.483 6.293 1.00 2.73 H ATOM 21 HD3 ARG A 1 12.289 -2.779 7.214 1.00 2.75 H ATOM 22 HE ARG A 1 10.151 -1.012 7.380 1.00 3.05 H ATOM 23 HH11 ARG A 1 9.865 -4.249 9.741 1.00 4.43 H ATOM 24 HH12 ARG A 1 10.923 -4.274 8.368 1.00 3.69 H ATOM 25 HH21 ARG A 1 8.768 -0.958 9.199 1.00 4.52 H ATOM 26 HH22 ARG A 1 8.635 -2.356 10.216 1.00 4.84 H ATOM 27 N PRO A 2 11.354 -1.768 1.530 1.00 0.48 N ATOM 28 CA PRO A 2 10.190 -1.387 0.734 1.00 0.37 C ATOM 29 C PRO A 2 8.877 -1.601 1.477 1.00 0.31 C ATOM 30 O PRO A 2 8.726 -2.553 2.244 1.00 0.43 O ATOM 31 CB PRO A 2 10.271 -2.309 -0.481 1.00 0.45 C ATOM 32 CG PRO A 2 10.995 -3.515 0.005 1.00 0.58 C ATOM 33 CD PRO A 2 11.959 -3.030 1.056 1.00 0.63 C ATOM 34 HA PRO A 2 10.253 -0.357 0.412 1.00 0.40 H ATOM 35 HB2 PRO A 2 9.272 -2.555 -0.816 1.00 0.46 H ATOM 36 HB3 PRO A 2 10.813 -1.816 -1.275 1.00 0.51 H ATOM 37 HG2 PRO A 2 10.292 -4.215 0.435 1.00 0.60 H ATOM 38 HG3 PRO A 2 11.531 -3.976 -0.812 1.00 0.69 H ATOM 39 HD2 PRO A 2 12.033 -3.749 1.859 1.00 0.74 H ATOM 40 HD3 PRO A 2 12.932 -2.851 0.621 1.00 0.73 H ATOM 41 N PHE A 3 7.934 -0.711 1.233 1.00 0.19 N ATOM 42 CA PHE A 3 6.615 -0.797 1.832 1.00 0.16 C ATOM 43 C PHE A 3 5.728 -1.676 0.965 1.00 0.15 C ATOM 44 O PHE A 3 5.173 -1.220 -0.030 1.00 0.18 O ATOM 45 CB PHE A 3 6.006 0.600 1.975 1.00 0.14 C ATOM 46 CG PHE A 3 6.765 1.497 2.910 1.00 0.15 C ATOM 47 CD1 PHE A 3 7.814 2.278 2.452 1.00 0.14 C ATOM 48 CD2 PHE A 3 6.423 1.559 4.249 1.00 0.22 C ATOM 49 CE1 PHE A 3 8.507 3.105 3.314 1.00 0.17 C ATOM 50 CE2 PHE A 3 7.112 2.383 5.116 1.00 0.25 C ATOM 51 CZ PHE A 3 8.157 3.157 4.649 1.00 0.21 C ATOM 52 H PHE A 3 8.125 0.023 0.610 1.00 0.19 H ATOM 53 HA PHE A 3 6.716 -1.246 2.808 1.00 0.22 H ATOM 54 HB2 PHE A 3 5.979 1.076 1.009 1.00 0.13 H ATOM 55 HB3 PHE A 3 5.001 0.508 2.351 1.00 0.19 H ATOM 56 HD1 PHE A 3 8.088 2.238 1.407 1.00 0.16 H ATOM 57 HD2 PHE A 3 5.607 0.954 4.615 1.00 0.26 H ATOM 58 HE1 PHE A 3 9.322 3.710 2.946 1.00 0.19 H ATOM 59 HE2 PHE A 3 6.833 2.422 6.158 1.00 0.31 H ATOM 60 HZ PHE A 3 8.697 3.802 5.325 1.00 0.24 H HETATM 61 N NLE A 4 5.620 -2.939 1.329 1.00 0.15 N HETATM 62 CA NLE A 4 4.904 -3.900 0.508 1.00 0.15 C HETATM 63 C NLE A 4 3.489 -4.116 1.021 1.00 0.15 C HETATM 64 O NLE A 4 3.257 -4.208 2.228 1.00 0.21 O HETATM 65 CB NLE A 4 5.653 -5.235 0.481 1.00 0.21 C HETATM 66 CG NLE A 4 5.073 -6.235 -0.510 1.00 0.26 C HETATM 67 CD NLE A 4 5.767 -7.585 -0.426 1.00 0.33 C HETATM 68 CE NLE A 4 5.416 -8.275 0.874 1.00 0.85 C HETATM 69 H NLE A 4 6.023 -3.231 2.175 1.00 0.20 H HETATM 70 HA NLE A 4 4.853 -3.505 -0.494 1.00 0.15 H HETATM 71 HB2 NLE A 4 5.614 -5.673 1.466 1.00 0.25 H HETATM 72 HB3 NLE A 4 6.685 -5.053 0.218 1.00 0.22 H HETATM 73 HG2 NLE A 4 5.189 -5.844 -1.510 1.00 0.26 H HETATM 74 HG3 NLE A 4 4.025 -6.371 -0.293 1.00 0.27 H HETATM 75 HD2 NLE A 4 6.836 -7.444 -0.469 1.00 0.80 H HETATM 76 HD3 NLE A 4 5.441 -8.207 -1.246 1.00 0.79 H HETATM 77 HE1 NLE A 4 5.909 -9.234 0.915 1.00 1.36 H HETATM 78 HE2 NLE A 4 4.347 -8.418 0.927 1.00 1.52 H HETATM 79 HE3 NLE A 4 5.740 -7.667 1.705 1.00 1.43 H ATOM 80 N CYS A 5 2.546 -4.177 0.093 1.00 0.13 N ATOM 81 CA CYS A 5 1.171 -4.516 0.414 1.00 0.18 C ATOM 82 C CYS A 5 1.078 -5.985 0.818 1.00 0.29 C ATOM 83 O CYS A 5 1.784 -6.833 0.269 1.00 0.33 O ATOM 84 CB CYS A 5 0.269 -4.236 -0.790 1.00 0.13 C ATOM 85 SG CYS A 5 -1.429 -4.812 -0.590 1.00 0.20 S ATOM 86 H CYS A 5 2.785 -3.985 -0.842 1.00 0.11 H ATOM 87 HA CYS A 5 0.858 -3.901 1.244 1.00 0.26 H ATOM 88 HB2 CYS A 5 0.235 -3.171 -0.964 1.00 0.17 H ATOM 89 HB3 CYS A 5 0.683 -4.723 -1.658 1.00 0.13 H ATOM 90 N THR A 6 0.216 -6.282 1.778 1.00 0.42 N ATOM 91 CA THR A 6 0.052 -7.643 2.261 1.00 0.57 C ATOM 92 C THR A 6 -1.423 -8.026 2.333 1.00 0.46 C ATOM 93 O THR A 6 -1.913 -8.493 3.364 1.00 0.49 O ATOM 94 CB THR A 6 0.711 -7.817 3.643 1.00 0.85 C ATOM 95 OG1 THR A 6 0.382 -6.702 4.486 1.00 1.31 O ATOM 96 CG2 THR A 6 2.221 -7.931 3.512 1.00 1.22 C ATOM 97 H THR A 6 -0.323 -5.568 2.176 1.00 0.45 H ATOM 98 HA THR A 6 0.548 -8.303 1.565 1.00 0.64 H ATOM 99 HB THR A 6 0.334 -8.723 4.094 1.00 0.76 H ATOM 100 HG1 THR A 6 0.933 -6.730 5.278 1.00 1.76 H ATOM 101 HG21 THR A 6 2.661 -8.042 4.491 1.00 1.66 H ATOM 102 HG22 THR A 6 2.609 -7.040 3.042 1.00 1.79 H ATOM 103 HG23 THR A 6 2.467 -8.792 2.906 1.00 1.53 H ATOM 104 N TRP A 7 -2.128 -7.824 1.230 1.00 0.44 N ATOM 105 CA TRP A 7 -3.541 -8.149 1.161 1.00 0.38 C ATOM 106 C TRP A 7 -3.729 -9.510 0.497 1.00 0.51 C ATOM 107 O TRP A 7 -4.021 -9.601 -0.697 1.00 0.61 O ATOM 108 CB TRP A 7 -4.295 -7.066 0.388 1.00 0.39 C ATOM 109 CG TRP A 7 -5.782 -7.135 0.548 1.00 0.42 C ATOM 110 CD1 TRP A 7 -6.657 -7.837 -0.222 1.00 0.49 C ATOM 111 CD2 TRP A 7 -6.566 -6.460 1.536 1.00 0.51 C ATOM 112 NE1 TRP A 7 -7.941 -7.647 0.228 1.00 0.57 N ATOM 113 CE2 TRP A 7 -7.911 -6.804 1.308 1.00 0.59 C ATOM 114 CE3 TRP A 7 -6.259 -5.600 2.592 1.00 0.62 C ATOM 115 CZ2 TRP A 7 -8.948 -6.316 2.099 1.00 0.73 C ATOM 116 CZ3 TRP A 7 -7.288 -5.116 3.377 1.00 0.78 C ATOM 117 CH2 TRP A 7 -8.618 -5.475 3.128 1.00 0.82 C ATOM 118 H TRP A 7 -1.683 -7.452 0.436 1.00 0.52 H ATOM 119 HA TRP A 7 -3.923 -8.195 2.169 1.00 0.36 H ATOM 120 HB2 TRP A 7 -3.969 -6.096 0.729 1.00 0.42 H ATOM 121 HB3 TRP A 7 -4.068 -7.165 -0.661 1.00 0.45 H ATOM 122 HD1 TRP A 7 -6.367 -8.452 -1.060 1.00 0.55 H ATOM 123 HE1 TRP A 7 -8.747 -8.051 -0.162 1.00 0.66 H ATOM 124 HE3 TRP A 7 -5.238 -5.312 2.799 1.00 0.64 H ATOM 125 HZ2 TRP A 7 -9.978 -6.585 1.921 1.00 0.80 H ATOM 126 HZ3 TRP A 7 -7.070 -4.449 4.198 1.00 0.91 H ATOM 127 HH2 TRP A 7 -9.390 -5.071 3.766 1.00 0.95 H HETATM 128 N ORN A 8 -1.941 -13.242 -2.481 1.00 0.96 N HETATM 129 CA ORN A 8 -2.104 -11.910 -1.863 1.00 0.74 C HETATM 130 CB ORN A 8 -1.471 -11.884 -0.469 1.00 0.85 C HETATM 131 CG ORN A 8 -2.282 -12.610 0.591 1.00 0.95 C HETATM 132 CD ORN A 8 -3.637 -11.948 0.812 1.00 0.76 C HETATM 133 NE ORN A 8 -3.509 -10.566 1.266 1.00 0.57 N HETATM 134 C ORN A 8 -1.480 -10.819 -2.721 1.00 0.57 C HETATM 135 O ORN A 8 -0.406 -10.999 -3.300 1.00 0.62 O HETATM 136 H ORN A 8 -0.933 -13.448 -2.618 1.00 1.31 H HETATM 137 HA ORN A 8 -3.159 -11.710 -1.770 1.00 0.68 H HETATM 138 HB2 ORN A 8 -1.358 -10.856 -0.161 1.00 1.41 H HETATM 139 HB3 ORN A 8 -0.495 -12.343 -0.521 1.00 1.23 H HETATM 140 HG2 ORN A 8 -1.731 -12.601 1.520 1.00 1.68 H HETATM 141 HG3 ORN A 8 -2.439 -13.629 0.273 1.00 1.12 H HETATM 142 HD2 ORN A 8 -4.182 -12.512 1.554 1.00 0.81 H HETATM 143 HD3 ORN A 8 -4.187 -11.959 -0.117 1.00 0.75 H HETATM 144 HE1 ORN A 8 -3.241 -10.416 2.198 1.00 0.53 H HETATM 145 HT3 ORN A 8 -2.354 -13.977 -1.872 1.00 1.21 H ATOM 146 N CYS A 9 -2.175 -9.696 -2.809 1.00 0.41 N ATOM 147 CA CYS A 9 -1.656 -8.513 -3.465 1.00 0.30 C ATOM 148 C CYS A 9 -0.473 -7.971 -2.671 1.00 0.26 C ATOM 149 O CYS A 9 -0.587 -7.743 -1.464 1.00 0.34 O ATOM 150 CB CYS A 9 -2.760 -7.460 -3.571 1.00 0.29 C ATOM 151 SG CYS A 9 -2.202 -5.842 -4.138 1.00 0.23 S ATOM 152 H CYS A 9 -3.077 -9.663 -2.413 1.00 0.39 H ATOM 153 HA CYS A 9 -1.327 -8.789 -4.454 1.00 0.32 H ATOM 154 HB2 CYS A 9 -3.512 -7.807 -4.263 1.00 0.33 H ATOM 155 HB3 CYS A 9 -3.210 -7.330 -2.599 1.00 0.30 H ATOM 156 N GLY A 10 0.658 -7.777 -3.338 1.00 0.25 N ATOM 157 CA GLY A 10 1.852 -7.359 -2.642 1.00 0.27 C ATOM 158 C GLY A 10 2.740 -6.456 -3.465 1.00 0.21 C ATOM 159 O GLY A 10 3.910 -6.762 -3.685 1.00 0.30 O ATOM 160 H GLY A 10 0.681 -7.918 -4.310 1.00 0.32 H ATOM 161 HA2 GLY A 10 1.562 -6.834 -1.744 1.00 0.31 H ATOM 162 HA3 GLY A 10 2.415 -8.236 -2.363 1.00 0.34 H ATOM 163 N LYS A 11 2.187 -5.346 -3.927 1.00 0.17 N ATOM 164 CA LYS A 11 2.978 -4.344 -4.627 1.00 0.16 C ATOM 165 C LYS A 11 3.907 -3.644 -3.645 1.00 0.16 C ATOM 166 O LYS A 11 3.530 -3.393 -2.498 1.00 0.21 O ATOM 167 CB LYS A 11 2.070 -3.327 -5.323 1.00 0.24 C ATOM 168 CG LYS A 11 1.246 -3.925 -6.450 1.00 0.75 C ATOM 169 CD LYS A 11 0.428 -2.867 -7.168 1.00 0.58 C ATOM 170 CE LYS A 11 -0.376 -3.471 -8.307 1.00 1.49 C ATOM 171 NZ LYS A 11 -1.123 -2.437 -9.069 1.00 2.05 N1+ ATOM 172 H LYS A 11 1.230 -5.195 -3.793 1.00 0.24 H ATOM 173 HA LYS A 11 3.574 -4.852 -5.370 1.00 0.18 H ATOM 174 HB2 LYS A 11 1.390 -2.909 -4.593 1.00 0.71 H ATOM 175 HB3 LYS A 11 2.678 -2.533 -5.732 1.00 0.81 H ATOM 176 HG2 LYS A 11 1.913 -4.393 -7.158 1.00 1.30 H ATOM 177 HG3 LYS A 11 0.577 -4.667 -6.038 1.00 1.24 H ATOM 178 HD2 LYS A 11 -0.250 -2.414 -6.462 1.00 0.70 H ATOM 179 HD3 LYS A 11 1.094 -2.115 -7.565 1.00 0.86 H ATOM 180 HE2 LYS A 11 0.301 -3.980 -8.978 1.00 2.21 H ATOM 181 HE3 LYS A 11 -1.077 -4.182 -7.897 1.00 1.86 H ATOM 182 HZ1 LYS A 11 -0.464 -1.740 -9.467 1.00 2.40 H ATOM 183 HZ2 LYS A 11 -1.795 -1.947 -8.445 1.00 2.57 H ATOM 184 HZ3 LYS A 11 -1.652 -2.880 -9.846 1.00 2.43 H ATOM 185 N ARG A 12 5.122 -3.354 -4.083 1.00 0.14 N ATOM 186 CA ARG A 12 6.111 -2.731 -3.216 1.00 0.17 C ATOM 187 C ARG A 12 6.233 -1.246 -3.522 1.00 0.15 C ATOM 188 O ARG A 12 6.271 -0.839 -4.685 1.00 0.24 O ATOM 189 CB ARG A 12 7.469 -3.424 -3.366 1.00 0.26 C ATOM 190 CG ARG A 12 7.447 -4.893 -2.971 1.00 0.83 C ATOM 191 CD ARG A 12 8.815 -5.540 -3.125 1.00 0.78 C ATOM 192 NE ARG A 12 8.797 -6.963 -2.784 1.00 1.85 N ATOM 193 CZ ARG A 12 9.891 -7.686 -2.539 1.00 2.32 C ATOM 194 NH1 ARG A 12 11.093 -7.124 -2.603 1.00 2.15 N1+ ATOM 195 NH2 ARG A 12 9.781 -8.971 -2.236 1.00 3.36 N ATOM 196 H ARG A 12 5.359 -3.557 -5.014 1.00 0.14 H ATOM 197 HA ARG A 12 5.769 -2.845 -2.197 1.00 0.21 H ATOM 198 HB2 ARG A 12 7.784 -3.355 -4.397 1.00 0.90 H ATOM 199 HB3 ARG A 12 8.193 -2.916 -2.744 1.00 0.85 H ATOM 200 HG2 ARG A 12 7.136 -4.973 -1.940 1.00 1.33 H ATOM 201 HG3 ARG A 12 6.740 -5.413 -3.601 1.00 1.38 H ATOM 202 HD2 ARG A 12 9.138 -5.431 -4.148 1.00 0.99 H ATOM 203 HD3 ARG A 12 9.512 -5.033 -2.473 1.00 0.93 H ATOM 204 HE ARG A 12 7.918 -7.405 -2.736 1.00 2.49 H ATOM 205 HH11 ARG A 12 11.183 -6.151 -2.833 1.00 1.82 H ATOM 206 HH12 ARG A 12 11.917 -7.669 -2.426 1.00 2.73 H ATOM 207 HH21 ARG A 12 10.599 -9.519 -2.049 1.00 3.75 H ATOM 208 HH22 ARG A 12 8.875 -9.407 -2.196 1.00 3.87 H ATOM 209 N PHE A 13 6.275 -0.441 -2.473 1.00 0.10 N ATOM 210 CA PHE A 13 6.333 1.004 -2.611 1.00 0.10 C ATOM 211 C PHE A 13 7.549 1.558 -1.894 1.00 0.12 C ATOM 212 O PHE A 13 8.021 0.986 -0.911 1.00 0.18 O ATOM 213 CB PHE A 13 5.063 1.625 -2.041 1.00 0.12 C ATOM 214 CG PHE A 13 3.822 1.096 -2.685 1.00 0.14 C ATOM 215 CD1 PHE A 13 3.349 1.652 -3.857 1.00 0.19 C ATOM 216 CD2 PHE A 13 3.140 0.029 -2.127 1.00 0.16 C ATOM 217 CE1 PHE A 13 2.214 1.157 -4.461 1.00 0.22 C ATOM 218 CE2 PHE A 13 2.003 -0.470 -2.724 1.00 0.20 C ATOM 219 CZ PHE A 13 1.540 0.095 -3.895 1.00 0.21 C ATOM 220 H PHE A 13 6.252 -0.830 -1.571 1.00 0.14 H ATOM 221 HA PHE A 13 6.401 1.241 -3.662 1.00 0.13 H ATOM 222 HB2 PHE A 13 5.007 1.413 -0.984 1.00 0.12 H ATOM 223 HB3 PHE A 13 5.091 2.692 -2.193 1.00 0.14 H ATOM 224 HD1 PHE A 13 3.877 2.483 -4.299 1.00 0.21 H ATOM 225 HD2 PHE A 13 3.506 -0.414 -1.212 1.00 0.16 H ATOM 226 HE1 PHE A 13 1.853 1.599 -5.374 1.00 0.27 H ATOM 227 HE2 PHE A 13 1.478 -1.300 -2.277 1.00 0.22 H ATOM 228 HZ PHE A 13 0.649 -0.292 -4.365 1.00 0.25 H ATOM 229 N THR A 14 8.058 2.670 -2.398 1.00 0.15 N ATOM 230 CA THR A 14 9.230 3.299 -1.824 1.00 0.17 C ATOM 231 C THR A 14 8.852 4.133 -0.600 1.00 0.13 C ATOM 232 O THR A 14 9.659 4.322 0.312 1.00 0.24 O ATOM 233 CB THR A 14 9.923 4.203 -2.863 1.00 0.28 C ATOM 234 OG1 THR A 14 9.950 3.543 -4.139 1.00 0.85 O ATOM 235 CG2 THR A 14 11.345 4.532 -2.439 1.00 0.95 C ATOM 236 H THR A 14 7.641 3.072 -3.189 1.00 0.20 H ATOM 237 HA THR A 14 9.920 2.525 -1.524 1.00 0.23 H ATOM 238 HB THR A 14 9.363 5.124 -2.951 1.00 0.82 H ATOM 239 HG1 THR A 14 10.449 4.084 -4.767 1.00 1.26 H ATOM 240 HG21 THR A 14 11.917 3.620 -2.356 1.00 1.58 H ATOM 241 HG22 THR A 14 11.328 5.034 -1.485 1.00 1.36 H ATOM 242 HG23 THR A 14 11.802 5.176 -3.177 1.00 1.65 H ATOM 243 N ARG A 15 7.612 4.611 -0.575 1.00 0.13 N ATOM 244 CA ARG A 15 7.158 5.500 0.485 1.00 0.18 C ATOM 245 C ARG A 15 5.855 4.997 1.106 1.00 0.14 C ATOM 246 O ARG A 15 4.988 4.440 0.426 1.00 0.13 O ATOM 247 CB ARG A 15 6.979 6.913 -0.074 1.00 0.31 C ATOM 248 CG ARG A 15 8.278 7.531 -0.570 1.00 0.38 C ATOM 249 CD ARG A 15 8.037 8.842 -1.301 1.00 0.91 C ATOM 250 NE ARG A 15 7.263 8.647 -2.526 1.00 1.61 N ATOM 251 CZ ARG A 15 6.852 9.639 -3.314 1.00 2.07 C ATOM 252 NH1 ARG A 15 7.137 10.898 -3.007 1.00 1.87 N1+ ATOM 253 NH2 ARG A 15 6.150 9.370 -4.406 1.00 3.12 N ATOM 254 H ARG A 15 6.986 4.357 -1.290 1.00 0.20 H ATOM 255 HA ARG A 15 7.922 5.518 1.249 1.00 0.22 H ATOM 256 HB2 ARG A 15 6.284 6.878 -0.898 1.00 0.37 H ATOM 257 HB3 ARG A 15 6.577 7.549 0.701 1.00 0.40 H ATOM 258 HG2 ARG A 15 8.924 7.715 0.274 1.00 0.69 H ATOM 259 HG3 ARG A 15 8.756 6.837 -1.247 1.00 0.59 H ATOM 260 HD2 ARG A 15 7.495 9.512 -0.648 1.00 1.32 H ATOM 261 HD3 ARG A 15 8.990 9.279 -1.554 1.00 1.67 H ATOM 262 HE ARG A 15 7.043 7.720 -2.779 1.00 2.18 H ATOM 263 HH11 ARG A 15 7.666 11.109 -2.184 1.00 1.78 H ATOM 264 HH12 ARG A 15 6.827 11.646 -3.601 1.00 2.28 H ATOM 265 HH21 ARG A 15 5.929 8.413 -4.644 1.00 3.70 H ATOM 266 HH22 ARG A 15 5.842 10.114 -5.005 1.00 3.46 H ATOM 267 N SER A 16 5.737 5.209 2.415 1.00 0.15 N ATOM 268 CA SER A 16 4.618 4.704 3.203 1.00 0.14 C ATOM 269 C SER A 16 3.292 5.323 2.775 1.00 0.12 C ATOM 270 O SER A 16 2.254 4.663 2.823 1.00 0.15 O ATOM 271 CB SER A 16 4.875 4.984 4.685 1.00 0.22 C ATOM 272 OG SER A 16 5.347 6.308 4.869 1.00 1.22 O ATOM 273 H SER A 16 6.436 5.725 2.875 1.00 0.19 H ATOM 274 HA SER A 16 4.566 3.636 3.056 1.00 0.16 H ATOM 275 HB2 SER A 16 3.959 4.860 5.241 1.00 0.90 H ATOM 276 HB3 SER A 16 5.619 4.296 5.056 1.00 1.04 H ATOM 277 HG SER A 16 4.827 6.743 5.557 1.00 1.52 H ATOM 278 N ASP A 17 3.332 6.588 2.367 1.00 0.14 N ATOM 279 CA ASP A 17 2.135 7.278 1.894 1.00 0.19 C ATOM 280 C ASP A 17 1.605 6.631 0.628 1.00 0.16 C ATOM 281 O ASP A 17 0.396 6.588 0.400 1.00 0.18 O ATOM 282 CB ASP A 17 2.417 8.761 1.637 1.00 0.28 C ATOM 283 CG ASP A 17 2.597 9.555 2.913 1.00 1.40 C ATOM 284 OD1 ASP A 17 1.586 10.014 3.481 1.00 2.04 O ATOM 285 OD2 ASP A 17 3.754 9.732 3.351 1.00 2.15 O1- ATOM 286 H ASP A 17 4.181 7.075 2.400 1.00 0.15 H ATOM 287 HA ASP A 17 1.384 7.194 2.662 1.00 0.24 H ATOM 288 HB2 ASP A 17 3.318 8.852 1.053 1.00 1.06 H ATOM 289 HB3 ASP A 17 1.594 9.185 1.085 1.00 0.95 H ATOM 290 N GLU A 18 2.514 6.110 -0.183 1.00 0.15 N ATOM 291 CA GLU A 18 2.141 5.443 -1.416 1.00 0.16 C ATOM 292 C GLU A 18 1.475 4.113 -1.105 1.00 0.11 C ATOM 293 O GLU A 18 0.486 3.741 -1.739 1.00 0.13 O ATOM 294 CB GLU A 18 3.370 5.227 -2.298 1.00 0.25 C ATOM 295 CG GLU A 18 4.103 6.510 -2.634 1.00 0.40 C ATOM 296 CD GLU A 18 5.262 6.280 -3.575 1.00 1.31 C ATOM 297 OE1 GLU A 18 6.189 5.532 -3.204 1.00 2.28 O ATOM 298 OE2 GLU A 18 5.250 6.841 -4.689 1.00 1.61 O1- ATOM 299 H GLU A 18 3.458 6.166 0.061 1.00 0.16 H ATOM 300 HA GLU A 18 1.438 6.073 -1.937 1.00 0.24 H ATOM 301 HB2 GLU A 18 4.057 4.575 -1.781 1.00 0.27 H ATOM 302 HB3 GLU A 18 3.064 4.758 -3.220 1.00 0.28 H ATOM 303 HG2 GLU A 18 3.409 7.196 -3.099 1.00 0.80 H ATOM 304 HG3 GLU A 18 4.480 6.943 -1.720 1.00 0.93 H ATOM 305 N LEU A 19 2.013 3.407 -0.117 1.00 0.11 N ATOM 306 CA LEU A 19 1.410 2.160 0.335 1.00 0.12 C ATOM 307 C LEU A 19 0.033 2.420 0.930 1.00 0.12 C ATOM 308 O LEU A 19 -0.921 1.713 0.624 1.00 0.14 O ATOM 309 CB LEU A 19 2.300 1.459 1.364 1.00 0.14 C ATOM 310 CG LEU A 19 1.662 0.241 2.043 1.00 0.15 C ATOM 311 CD1 LEU A 19 1.329 -0.832 1.015 1.00 0.17 C ATOM 312 CD2 LEU A 19 2.577 -0.319 3.121 1.00 0.17 C ATOM 313 H LEU A 19 2.837 3.731 0.314 1.00 0.12 H ATOM 314 HA LEU A 19 1.298 1.518 -0.528 1.00 0.14 H ATOM 315 HB2 LEU A 19 3.202 1.138 0.865 1.00 0.15 H ATOM 316 HB3 LEU A 19 2.565 2.173 2.126 1.00 0.15 H ATOM 317 HG LEU A 19 0.735 0.544 2.514 1.00 0.15 H ATOM 318 HD11 LEU A 19 2.236 -1.150 0.522 1.00 0.93 H ATOM 319 HD12 LEU A 19 0.644 -0.430 0.283 1.00 0.92 H ATOM 320 HD13 LEU A 19 0.873 -1.675 1.510 1.00 0.94 H ATOM 321 HD21 LEU A 19 3.458 -0.742 2.660 1.00 0.94 H ATOM 322 HD22 LEU A 19 2.057 -1.087 3.673 1.00 1.07 H ATOM 323 HD23 LEU A 19 2.870 0.474 3.793 1.00 1.03 H ATOM 324 N GLN A 20 -0.063 3.441 1.773 1.00 0.15 N ATOM 325 CA GLN A 20 -1.334 3.812 2.390 1.00 0.19 C ATOM 326 C GLN A 20 -2.363 4.149 1.316 1.00 0.15 C ATOM 327 O GLN A 20 -3.504 3.679 1.357 1.00 0.16 O ATOM 328 CB GLN A 20 -1.140 4.999 3.336 1.00 0.27 C ATOM 329 CG GLN A 20 -2.396 5.395 4.102 1.00 1.15 C ATOM 330 CD GLN A 20 -2.902 4.291 5.012 1.00 1.67 C ATOM 331 OE1 GLN A 20 -2.129 3.469 5.506 1.00 2.11 O ATOM 332 NE2 GLN A 20 -4.200 4.276 5.258 1.00 2.50 N ATOM 333 H GLN A 20 0.745 3.957 1.993 1.00 0.17 H ATOM 334 HA GLN A 20 -1.686 2.963 2.955 1.00 0.23 H ATOM 335 HB2 GLN A 20 -0.375 4.747 4.053 1.00 0.82 H ATOM 336 HB3 GLN A 20 -0.812 5.853 2.760 1.00 0.82 H ATOM 337 HG2 GLN A 20 -2.174 6.263 4.703 1.00 1.84 H ATOM 338 HG3 GLN A 20 -3.170 5.639 3.390 1.00 1.71 H ATOM 339 HE21 GLN A 20 -4.759 4.972 4.845 1.00 2.87 H ATOM 340 HE22 GLN A 20 -4.553 3.574 5.843 1.00 3.01 H ATOM 341 N ARG A 21 -1.940 4.953 0.346 1.00 0.15 N ATOM 342 CA ARG A 21 -2.781 5.300 -0.793 1.00 0.19 C ATOM 343 C ARG A 21 -3.278 4.036 -1.480 1.00 0.14 C ATOM 344 O ARG A 21 -4.476 3.871 -1.717 1.00 0.16 O ATOM 345 CB ARG A 21 -1.989 6.152 -1.786 1.00 0.28 C ATOM 346 CG ARG A 21 -2.752 6.497 -3.052 1.00 0.90 C ATOM 347 CD ARG A 21 -1.882 7.287 -4.012 1.00 0.92 C ATOM 348 NE ARG A 21 -2.531 7.497 -5.304 1.00 1.52 N ATOM 349 CZ ARG A 21 -1.878 7.522 -6.465 1.00 1.91 C ATOM 350 NH1 ARG A 21 -0.558 7.369 -6.493 1.00 1.87 N1+ ATOM 351 NH2 ARG A 21 -2.544 7.711 -7.595 1.00 2.78 N ATOM 352 H ARG A 21 -1.030 5.324 0.398 1.00 0.17 H ATOM 353 HA ARG A 21 -3.629 5.864 -0.432 1.00 0.24 H ATOM 354 HB2 ARG A 21 -1.703 7.073 -1.304 1.00 0.71 H ATOM 355 HB3 ARG A 21 -1.098 5.613 -2.067 1.00 0.85 H ATOM 356 HG2 ARG A 21 -3.066 5.582 -3.532 1.00 1.39 H ATOM 357 HG3 ARG A 21 -3.621 7.087 -2.793 1.00 1.31 H ATOM 358 HD2 ARG A 21 -1.661 8.248 -3.573 1.00 1.26 H ATOM 359 HD3 ARG A 21 -0.961 6.746 -4.168 1.00 1.23 H ATOM 360 HE ARG A 21 -3.506 7.625 -5.304 1.00 2.02 H ATOM 361 HH11 ARG A 21 -0.050 7.235 -5.640 1.00 1.76 H ATOM 362 HH12 ARG A 21 -0.066 7.382 -7.367 1.00 2.33 H ATOM 363 HH21 ARG A 21 -3.540 7.835 -7.579 1.00 3.23 H ATOM 364 HH22 ARG A 21 -2.057 7.730 -8.472 1.00 3.13 H ATOM 365 N HIS A 22 -2.344 3.140 -1.774 1.00 0.11 N ATOM 366 CA HIS A 22 -2.662 1.880 -2.414 1.00 0.09 C ATOM 367 C HIS A 22 -3.654 1.080 -1.573 1.00 0.11 C ATOM 368 O HIS A 22 -4.648 0.579 -2.086 1.00 0.15 O ATOM 369 CB HIS A 22 -1.380 1.072 -2.649 1.00 0.11 C ATOM 370 CG HIS A 22 -1.638 -0.344 -3.053 1.00 0.11 C ATOM 371 ND1 HIS A 22 -1.765 -0.777 -4.368 1.00 0.18 N ATOM 372 CD2 HIS A 22 -1.871 -1.428 -2.274 1.00 0.11 C ATOM 373 CE1 HIS A 22 -2.088 -2.082 -4.337 1.00 0.21 C ATOM 374 NE2 HIS A 22 -2.156 -2.488 -3.097 1.00 0.15 N ATOM 375 H HIS A 22 -1.407 3.333 -1.546 1.00 0.13 H ATOM 376 HA HIS A 22 -3.116 2.101 -3.368 1.00 0.11 H ATOM 377 HB2 HIS A 22 -0.802 1.543 -3.430 1.00 0.14 H ATOM 378 HB3 HIS A 22 -0.800 1.058 -1.738 1.00 0.12 H ATOM 379 HD1 HIS A 22 -1.640 -0.227 -5.175 1.00 0.24 H ATOM 380 HD2 HIS A 22 -1.815 -1.466 -1.196 1.00 0.14 H ATOM 381 HE1 HIS A 22 -2.259 -2.701 -5.202 1.00 0.28 H ATOM 382 N LYS A 23 -3.386 0.976 -0.279 1.00 0.13 N ATOM 383 CA LYS A 23 -4.229 0.200 0.624 1.00 0.18 C ATOM 384 C LYS A 23 -5.665 0.705 0.620 1.00 0.17 C ATOM 385 O LYS A 23 -6.604 -0.069 0.831 1.00 0.21 O ATOM 386 CB LYS A 23 -3.678 0.237 2.049 1.00 0.26 C ATOM 387 CG LYS A 23 -2.387 -0.548 2.242 1.00 0.57 C ATOM 388 CD LYS A 23 -2.560 -2.028 1.922 1.00 0.99 C ATOM 389 CE LYS A 23 -3.671 -2.666 2.747 1.00 1.50 C ATOM 390 NZ LYS A 23 -3.453 -2.492 4.206 1.00 1.93 N1+ ATOM 391 H LYS A 23 -2.592 1.434 0.081 1.00 0.13 H ATOM 392 HA LYS A 23 -4.225 -0.819 0.276 1.00 0.24 H ATOM 393 HB2 LYS A 23 -3.489 1.265 2.318 1.00 0.56 H ATOM 394 HB3 LYS A 23 -4.422 -0.168 2.718 1.00 0.66 H ATOM 395 HG2 LYS A 23 -1.630 -0.141 1.590 1.00 1.21 H ATOM 396 HG3 LYS A 23 -2.068 -0.447 3.270 1.00 1.27 H ATOM 397 HD2 LYS A 23 -2.797 -2.135 0.876 1.00 1.75 H ATOM 398 HD3 LYS A 23 -1.631 -2.539 2.135 1.00 1.44 H ATOM 399 HE2 LYS A 23 -4.612 -2.210 2.475 1.00 1.79 H ATOM 400 HE3 LYS A 23 -3.705 -3.721 2.520 1.00 2.05 H ATOM 401 HZ1 LYS A 23 -3.474 -1.483 4.456 1.00 2.29 H ATOM 402 HZ2 LYS A 23 -2.530 -2.884 4.482 1.00 2.36 H ATOM 403 HZ3 LYS A 23 -4.195 -2.986 4.743 1.00 2.11 H ATOM 404 N ARG A 24 -5.840 1.993 0.345 1.00 0.17 N ATOM 405 CA ARG A 24 -7.169 2.586 0.345 1.00 0.23 C ATOM 406 C ARG A 24 -8.003 2.094 -0.837 1.00 0.22 C ATOM 407 O ARG A 24 -9.193 2.403 -0.936 1.00 0.33 O ATOM 408 CB ARG A 24 -7.086 4.114 0.361 1.00 0.34 C ATOM 409 CG ARG A 24 -6.502 4.663 1.653 1.00 0.92 C ATOM 410 CD ARG A 24 -6.600 6.179 1.727 1.00 0.92 C ATOM 411 NE ARG A 24 -5.890 6.838 0.634 1.00 1.57 N ATOM 412 CZ ARG A 24 -4.963 7.781 0.803 1.00 1.89 C ATOM 413 NH1 ARG A 24 -4.564 8.132 2.020 1.00 1.57 N1+ ATOM 414 NH2 ARG A 24 -4.423 8.367 -0.257 1.00 2.84 N ATOM 415 H ARG A 24 -5.055 2.556 0.139 1.00 0.18 H ATOM 416 HA ARG A 24 -7.656 2.264 1.252 1.00 0.28 H ATOM 417 HB2 ARG A 24 -6.464 4.440 -0.460 1.00 0.81 H ATOM 418 HB3 ARG A 24 -8.078 4.520 0.236 1.00 0.82 H ATOM 419 HG2 ARG A 24 -7.041 4.238 2.487 1.00 1.39 H ATOM 420 HG3 ARG A 24 -5.462 4.376 1.715 1.00 1.39 H ATOM 421 HD2 ARG A 24 -7.642 6.461 1.684 1.00 1.14 H ATOM 422 HD3 ARG A 24 -6.181 6.507 2.665 1.00 1.40 H ATOM 423 HE ARG A 24 -6.140 6.581 -0.283 1.00 2.11 H ATOM 424 HH11 ARG A 24 -3.867 8.844 2.137 1.00 1.94 H ATOM 425 HH12 ARG A 24 -4.955 7.687 2.831 1.00 1.49 H ATOM 426 HH21 ARG A 24 -3.720 9.080 -0.142 1.00 3.18 H ATOM 427 HH22 ARG A 24 -4.720 8.110 -1.180 1.00 3.39 H ATOM 428 N THR A 25 -7.387 1.320 -1.727 1.00 0.21 N ATOM 429 CA THR A 25 -8.128 0.671 -2.794 1.00 0.27 C ATOM 430 C THR A 25 -8.788 -0.599 -2.267 1.00 0.26 C ATOM 431 O THR A 25 -9.891 -0.955 -2.677 1.00 0.34 O ATOM 432 CB THR A 25 -7.239 0.319 -4.007 1.00 0.37 C ATOM 433 OG1 THR A 25 -6.248 -0.649 -3.645 1.00 1.28 O ATOM 434 CG2 THR A 25 -6.557 1.561 -4.559 1.00 1.04 C ATOM 435 H THR A 25 -6.415 1.189 -1.664 1.00 0.23 H ATOM 436 HA THR A 25 -8.897 1.352 -3.123 1.00 0.29 H ATOM 437 HB THR A 25 -7.867 -0.097 -4.780 1.00 0.93 H ATOM 438 HG1 THR A 25 -5.544 -0.219 -3.138 1.00 1.45 H ATOM 439 HG21 THR A 25 -5.947 1.290 -5.408 1.00 1.50 H ATOM 440 HG22 THR A 25 -5.934 2.000 -3.794 1.00 1.73 H ATOM 441 HG23 THR A 25 -7.305 2.276 -4.866 1.00 1.63 H ATOM 442 N HIS A 26 -8.111 -1.268 -1.332 1.00 0.22 N ATOM 443 CA HIS A 26 -8.637 -2.487 -0.732 1.00 0.25 C ATOM 444 C HIS A 26 -9.697 -2.145 0.300 1.00 0.32 C ATOM 445 O HIS A 26 -10.729 -2.810 0.391 1.00 0.40 O ATOM 446 CB HIS A 26 -7.529 -3.298 -0.053 1.00 0.27 C ATOM 447 CG HIS A 26 -6.471 -3.826 -0.970 1.00 0.23 C ATOM 448 ND1 HIS A 26 -6.689 -4.793 -1.948 1.00 0.26 N ATOM 449 CD2 HIS A 26 -5.144 -3.540 -1.015 1.00 0.20 C ATOM 450 CE1 HIS A 26 -5.506 -5.058 -2.536 1.00 0.26 C ATOM 451 NE2 HIS A 26 -4.571 -4.322 -1.994 1.00 0.21 N ATOM 452 H HIS A 26 -7.241 -0.925 -1.034 1.00 0.22 H ATOM 453 HA HIS A 26 -9.084 -3.079 -1.513 1.00 0.30 H ATOM 454 HB2 HIS A 26 -7.038 -2.673 0.677 1.00 0.30 H ATOM 455 HB3 HIS A 26 -7.976 -4.141 0.454 1.00 0.34 H ATOM 456 HD1 HIS A 26 -7.549 -5.214 -2.167 1.00 0.30 H ATOM 457 HD2 HIS A 26 -4.619 -2.833 -0.392 1.00 0.20 H ATOM 458 HE1 HIS A 26 -5.351 -5.775 -3.329 1.00 0.32 H ATOM 459 N THR A 27 -9.436 -1.099 1.073 1.00 0.46 N ATOM 460 CA THR A 27 -10.356 -0.664 2.110 1.00 0.61 C ATOM 461 C THR A 27 -11.417 0.268 1.537 1.00 1.09 C ATOM 462 O THR A 27 -11.646 1.368 2.047 1.00 1.74 O ATOM 463 CB THR A 27 -9.612 0.042 3.259 1.00 1.38 C ATOM 464 OG1 THR A 27 -8.784 1.092 2.739 1.00 2.22 O ATOM 465 CG2 THR A 27 -8.759 -0.946 4.044 1.00 2.01 C ATOM 466 H THR A 27 -8.599 -0.601 0.940 1.00 0.53 H ATOM 467 HA THR A 27 -10.843 -1.543 2.509 1.00 1.04 H ATOM 468 HB THR A 27 -10.345 0.471 3.927 1.00 1.93 H ATOM 469 HG1 THR A 27 -9.341 1.843 2.501 1.00 2.59 H ATOM 470 HG21 THR A 27 -8.045 -1.411 3.381 1.00 2.64 H ATOM 471 HG22 THR A 27 -9.393 -1.706 4.478 1.00 2.34 H ATOM 472 HG23 THR A 27 -8.234 -0.424 4.830 1.00 2.33 H ATOM 473 N GLY A 28 -12.051 -0.176 0.463 1.00 1.76 N ATOM 474 CA GLY A 28 -13.105 0.600 -0.147 1.00 2.63 C ATOM 475 C GLY A 28 -14.405 0.457 0.613 1.00 2.96 C ATOM 476 O GLY A 28 -14.779 -0.654 1.000 1.00 3.50 O ATOM 477 H GLY A 28 -11.803 -1.049 0.090 1.00 2.05 H ATOM 478 HA2 GLY A 28 -12.813 1.639 -0.163 1.00 3.01 H ATOM 479 HA3 GLY A 28 -13.252 0.259 -1.160 1.00 3.11 H ATOM 480 N GLU A 29 -15.086 1.570 0.843 1.00 3.27 N ATOM 481 CA GLU A 29 -16.330 1.560 1.594 1.00 3.97 C ATOM 482 C GLU A 29 -17.418 0.848 0.799 1.00 4.68 C ATOM 483 O GLU A 29 -18.088 -0.053 1.305 1.00 5.51 O ATOM 484 CB GLU A 29 -16.764 2.992 1.920 1.00 4.55 C ATOM 485 CG GLU A 29 -17.818 3.079 3.010 1.00 5.26 C ATOM 486 CD GLU A 29 -17.304 2.581 4.344 1.00 6.09 C ATOM 487 OE1 GLU A 29 -16.459 3.269 4.953 1.00 6.58 O ATOM 488 OE2 GLU A 29 -17.743 1.503 4.796 1.00 6.49 O1- ATOM 489 H GLU A 29 -14.742 2.422 0.498 1.00 3.40 H ATOM 490 HA GLU A 29 -16.160 1.021 2.515 1.00 4.05 H ATOM 491 HB2 GLU A 29 -15.899 3.554 2.241 1.00 4.68 H ATOM 492 HB3 GLU A 29 -17.166 3.447 1.027 1.00 4.82 H ATOM 493 HG2 GLU A 29 -18.123 4.109 3.118 1.00 5.48 H ATOM 494 HG3 GLU A 29 -18.668 2.479 2.721 1.00 5.34 H ATOM 495 N LYS A 30 -17.580 1.249 -0.453 1.00 4.75 N ATOM 496 CA LYS A 30 -18.561 0.636 -1.331 1.00 5.79 C ATOM 497 C LYS A 30 -17.882 0.078 -2.571 1.00 6.33 C ATOM 498 O LYS A 30 -17.843 0.720 -3.620 1.00 7.00 O ATOM 499 CB LYS A 30 -19.636 1.651 -1.725 1.00 6.19 C ATOM 500 CG LYS A 30 -20.534 2.064 -0.570 1.00 6.60 C ATOM 501 CD LYS A 30 -21.544 3.117 -0.994 1.00 7.40 C ATOM 502 CE LYS A 30 -22.487 3.469 0.145 1.00 8.28 C ATOM 503 NZ LYS A 30 -23.410 4.577 -0.213 1.00 8.46 N1+ ATOM 504 H LYS A 30 -17.018 1.976 -0.798 1.00 4.36 H ATOM 505 HA LYS A 30 -19.025 -0.177 -0.792 1.00 6.29 H ATOM 506 HB2 LYS A 30 -19.154 2.538 -2.111 1.00 5.94 H ATOM 507 HB3 LYS A 30 -20.255 1.222 -2.500 1.00 6.82 H ATOM 508 HG2 LYS A 30 -21.064 1.194 -0.210 1.00 6.55 H ATOM 509 HG3 LYS A 30 -19.921 2.466 0.223 1.00 6.72 H ATOM 510 HD2 LYS A 30 -21.015 4.007 -1.299 1.00 7.64 H ATOM 511 HD3 LYS A 30 -22.122 2.736 -1.823 1.00 7.39 H ATOM 512 HE2 LYS A 30 -23.071 2.595 0.393 1.00 8.70 H ATOM 513 HE3 LYS A 30 -21.901 3.762 1.003 1.00 8.65 H ATOM 514 HZ1 LYS A 30 -23.999 4.308 -1.025 1.00 8.39 H ATOM 515 HZ2 LYS A 30 -22.868 5.429 -0.462 1.00 8.58 H ATOM 516 HZ3 LYS A 30 -24.029 4.800 0.591 1.00 8.79 H HETATM 517 N NH2 A 31 -17.334 -1.114 -2.445 1.00 6.36 N HETATM 518 HN1 NH2 A 31 -17.405 -1.569 -1.577 1.00 6.02 H HETATM 519 HN2 NH2 A 31 -16.879 -1.499 -3.221 1.00 6.91 H TER 520 NH2 A 31 HETATM 521 ZN ZN A 101 -2.635 -4.315 -2.479 1.00 0.19 ZN