ATOM 1 N ARG A 1 13.942 -1.314 3.925 1.00 0.94 N ATOM 2 CA ARG A 1 12.806 -2.200 3.594 1.00 0.76 C ATOM 3 C ARG A 1 11.798 -1.461 2.721 1.00 0.57 C ATOM 4 O ARG A 1 11.504 -0.291 2.964 1.00 0.60 O ATOM 5 CB ARG A 1 12.113 -2.690 4.874 1.00 0.96 C ATOM 6 CG ARG A 1 11.492 -1.573 5.705 1.00 1.90 C ATOM 7 CD ARG A 1 10.628 -2.118 6.834 1.00 2.39 C ATOM 8 NE ARG A 1 9.969 -1.045 7.579 1.00 2.87 N ATOM 9 CZ ARG A 1 8.735 -1.127 8.081 1.00 3.54 C ATOM 10 NH1 ARG A 1 8.004 -2.222 7.904 1.00 3.82 N1+ ATOM 11 NH2 ARG A 1 8.227 -0.104 8.755 1.00 4.30 N ATOM 12 H1 ARG A 1 14.438 -1.031 3.055 1.00 1.46 H ATOM 13 H2 ARG A 1 14.614 -1.805 4.545 1.00 1.52 H ATOM 14 H3 ARG A 1 13.601 -0.459 4.405 1.00 1.16 H ATOM 15 HA ARG A 1 13.187 -3.050 3.047 1.00 0.83 H ATOM 16 HB2 ARG A 1 11.331 -3.383 4.603 1.00 1.28 H ATOM 17 HB3 ARG A 1 12.839 -3.205 5.488 1.00 1.25 H ATOM 18 HG2 ARG A 1 12.284 -0.977 6.133 1.00 2.21 H ATOM 19 HG3 ARG A 1 10.883 -0.954 5.060 1.00 2.47 H ATOM 20 HD2 ARG A 1 9.875 -2.771 6.418 1.00 2.73 H ATOM 21 HD3 ARG A 1 11.254 -2.679 7.511 1.00 2.75 H ATOM 22 HE ARG A 1 10.479 -0.215 7.714 1.00 3.05 H ATOM 23 HH11 ARG A 1 7.078 -2.275 8.288 1.00 4.43 H ATOM 24 HH12 ARG A 1 8.368 -2.996 7.381 1.00 3.69 H ATOM 25 HH21 ARG A 1 8.768 0.733 8.888 1.00 4.52 H ATOM 26 HH22 ARG A 1 7.301 -0.162 9.136 1.00 4.84 H ATOM 27 N PRO A 2 11.273 -2.118 1.678 1.00 0.48 N ATOM 28 CA PRO A 2 10.217 -1.547 0.851 1.00 0.37 C ATOM 29 C PRO A 2 8.857 -1.686 1.517 1.00 0.31 C ATOM 30 O PRO A 2 8.598 -2.662 2.224 1.00 0.43 O ATOM 31 CB PRO A 2 10.273 -2.388 -0.420 1.00 0.45 C ATOM 32 CG PRO A 2 10.763 -3.719 0.033 1.00 0.58 C ATOM 33 CD PRO A 2 11.673 -3.459 1.210 1.00 0.63 C ATOM 34 HA PRO A 2 10.404 -0.510 0.618 1.00 0.40 H ATOM 35 HB2 PRO A 2 9.283 -2.454 -0.854 1.00 0.46 H ATOM 36 HB3 PRO A 2 10.952 -1.936 -1.127 1.00 0.51 H ATOM 37 HG2 PRO A 2 9.925 -4.332 0.336 1.00 0.60 H ATOM 38 HG3 PRO A 2 11.309 -4.200 -0.764 1.00 0.69 H ATOM 39 HD2 PRO A 2 11.513 -4.197 1.981 1.00 0.74 H ATOM 40 HD3 PRO A 2 12.707 -3.462 0.894 1.00 0.73 H ATOM 41 N PHE A 3 7.993 -0.719 1.290 1.00 0.19 N ATOM 42 CA PHE A 3 6.656 -0.744 1.852 1.00 0.16 C ATOM 43 C PHE A 3 5.769 -1.633 0.995 1.00 0.15 C ATOM 44 O PHE A 3 5.154 -1.180 0.034 1.00 0.18 O ATOM 45 CB PHE A 3 6.100 0.677 1.940 1.00 0.14 C ATOM 46 CG PHE A 3 6.899 1.561 2.853 1.00 0.15 C ATOM 47 CD1 PHE A 3 7.880 2.401 2.349 1.00 0.14 C ATOM 48 CD2 PHE A 3 6.675 1.545 4.219 1.00 0.22 C ATOM 49 CE1 PHE A 3 8.622 3.206 3.192 1.00 0.17 C ATOM 50 CE2 PHE A 3 7.413 2.349 5.066 1.00 0.25 C ATOM 51 CZ PHE A 3 8.388 3.180 4.551 1.00 0.21 C ATOM 52 H PHE A 3 8.252 0.028 0.707 1.00 0.19 H ATOM 53 HA PHE A 3 6.719 -1.164 2.845 1.00 0.22 H ATOM 54 HB2 PHE A 3 6.103 1.121 0.957 1.00 0.13 H ATOM 55 HB3 PHE A 3 5.090 0.641 2.312 1.00 0.19 H ATOM 56 HD1 PHE A 3 8.064 2.423 1.284 1.00 0.16 H ATOM 57 HD2 PHE A 3 5.912 0.896 4.621 1.00 0.26 H ATOM 58 HE1 PHE A 3 9.383 3.857 2.787 1.00 0.19 H ATOM 59 HE2 PHE A 3 7.228 2.326 6.128 1.00 0.31 H ATOM 60 HZ PHE A 3 8.966 3.808 5.211 1.00 0.24 H HETATM 61 N NLE A 4 5.737 -2.906 1.343 1.00 0.15 N HETATM 62 CA NLE A 4 5.080 -3.912 0.524 1.00 0.15 C HETATM 63 C NLE A 4 3.679 -4.211 1.031 1.00 0.15 C HETATM 64 O NLE A 4 3.467 -4.402 2.229 1.00 0.21 O HETATM 65 CB NLE A 4 5.916 -5.196 0.517 1.00 0.21 C HETATM 66 CG NLE A 4 5.362 -6.294 -0.373 1.00 0.26 C HETATM 67 CD NLE A 4 6.239 -7.533 -0.335 1.00 0.33 C HETATM 68 CE NLE A 4 5.678 -8.601 -1.246 1.00 0.85 C HETATM 69 H NLE A 4 6.160 -3.179 2.183 1.00 0.20 H HETATM 70 HA NLE A 4 5.011 -3.530 -0.481 1.00 0.15 H HETATM 71 HB2 NLE A 4 5.971 -5.576 1.525 1.00 0.25 H HETATM 72 HB3 NLE A 4 6.915 -4.959 0.179 1.00 0.22 H HETATM 73 HG2 NLE A 4 5.310 -5.931 -1.390 1.00 0.26 H HETATM 74 HG3 NLE A 4 4.371 -6.557 -0.032 1.00 0.27 H HETATM 75 HD2 NLE A 4 6.274 -7.919 0.673 1.00 0.80 H HETATM 76 HD3 NLE A 4 7.235 -7.280 -0.670 1.00 0.79 H HETATM 77 HE1 NLE A 4 6.318 -9.470 -1.220 1.00 1.36 H HETATM 78 HE2 NLE A 4 5.628 -8.221 -2.257 1.00 1.52 H HETATM 79 HE3 NLE A 4 4.687 -8.873 -0.914 1.00 1.43 H ATOM 80 N CYS A 5 2.726 -4.237 0.111 1.00 0.13 N ATOM 81 CA CYS A 5 1.369 -4.632 0.432 1.00 0.18 C ATOM 82 C CYS A 5 1.322 -6.134 0.696 1.00 0.29 C ATOM 83 O CYS A 5 1.962 -6.917 -0.009 1.00 0.33 O ATOM 84 CB CYS A 5 0.417 -4.259 -0.709 1.00 0.13 C ATOM 85 SG CYS A 5 -1.296 -4.769 -0.436 1.00 0.20 S ATOM 86 H CYS A 5 2.946 -3.986 -0.813 1.00 0.11 H ATOM 87 HA CYS A 5 1.071 -4.109 1.327 1.00 0.26 H ATOM 88 HB2 CYS A 5 0.422 -3.186 -0.838 1.00 0.17 H ATOM 89 HB3 CYS A 5 0.759 -4.725 -1.619 1.00 0.13 H ATOM 90 N THR A 6 0.587 -6.527 1.724 1.00 0.42 N ATOM 91 CA THR A 6 0.472 -7.928 2.094 1.00 0.57 C ATOM 92 C THR A 6 -0.989 -8.346 2.200 1.00 0.46 C ATOM 93 O THR A 6 -1.398 -9.000 3.162 1.00 0.49 O ATOM 94 CB THR A 6 1.194 -8.203 3.425 1.00 0.85 C ATOM 95 OG1 THR A 6 0.886 -7.165 4.368 1.00 1.31 O ATOM 96 CG2 THR A 6 2.699 -8.281 3.222 1.00 1.22 C ATOM 97 H THR A 6 0.116 -5.857 2.258 1.00 0.45 H ATOM 98 HA THR A 6 0.945 -8.516 1.324 1.00 0.64 H ATOM 99 HB THR A 6 0.849 -9.149 3.817 1.00 0.76 H ATOM 100 HG1 THR A 6 0.257 -7.501 5.017 1.00 1.76 H ATOM 101 HG21 THR A 6 3.056 -7.345 2.819 1.00 1.66 H ATOM 102 HG22 THR A 6 2.929 -9.080 2.533 1.00 1.79 H ATOM 103 HG23 THR A 6 3.180 -8.473 4.169 1.00 1.53 H ATOM 104 N TRP A 7 -1.775 -7.971 1.202 1.00 0.44 N ATOM 105 CA TRP A 7 -3.196 -8.263 1.207 1.00 0.38 C ATOM 106 C TRP A 7 -3.471 -9.580 0.491 1.00 0.51 C ATOM 107 O TRP A 7 -3.854 -9.596 -0.682 1.00 0.61 O ATOM 108 CB TRP A 7 -3.973 -7.129 0.541 1.00 0.39 C ATOM 109 CG TRP A 7 -5.433 -7.128 0.868 1.00 0.42 C ATOM 110 CD1 TRP A 7 -6.398 -7.920 0.320 1.00 0.49 C ATOM 111 CD2 TRP A 7 -6.094 -6.282 1.810 1.00 0.51 C ATOM 112 NE1 TRP A 7 -7.621 -7.623 0.871 1.00 0.57 N ATOM 113 CE2 TRP A 7 -7.460 -6.617 1.788 1.00 0.59 C ATOM 114 CE3 TRP A 7 -5.660 -5.273 2.672 1.00 0.62 C ATOM 115 CZ2 TRP A 7 -8.396 -5.977 2.596 1.00 0.73 C ATOM 116 CZ3 TRP A 7 -6.588 -4.637 3.472 1.00 0.78 C ATOM 117 CH2 TRP A 7 -7.943 -4.991 3.430 1.00 0.82 C ATOM 118 H TRP A 7 -1.386 -7.493 0.438 1.00 0.52 H ATOM 119 HA TRP A 7 -3.515 -8.352 2.234 1.00 0.36 H ATOM 120 HB2 TRP A 7 -3.562 -6.182 0.856 1.00 0.42 H ATOM 121 HB3 TRP A 7 -3.873 -7.219 -0.529 1.00 0.45 H ATOM 122 HD1 TRP A 7 -6.211 -8.672 -0.431 1.00 0.55 H ATOM 123 HE1 TRP A 7 -8.470 -8.058 0.640 1.00 0.66 H ATOM 124 HE3 TRP A 7 -4.619 -4.988 2.716 1.00 0.64 H ATOM 125 HZ2 TRP A 7 -9.443 -6.239 2.575 1.00 0.80 H ATOM 126 HZ3 TRP A 7 -6.271 -3.852 4.143 1.00 0.91 H ATOM 127 HH2 TRP A 7 -8.634 -4.464 4.071 1.00 0.95 H HETATM 128 N ORN A 8 -1.689 -13.377 -2.739 1.00 0.96 N HETATM 129 CA ORN A 8 -1.936 -12.072 -2.082 1.00 0.74 C HETATM 130 CB ORN A 8 -1.312 -12.046 -0.683 1.00 0.85 C HETATM 131 CG ORN A 8 -2.131 -12.764 0.378 1.00 0.95 C HETATM 132 CD ORN A 8 -3.440 -12.035 0.667 1.00 0.76 C HETATM 133 NE ORN A 8 -3.227 -10.683 1.184 1.00 0.57 N HETATM 134 C ORN A 8 -1.369 -10.926 -2.908 1.00 0.57 C HETATM 135 O ORN A 8 -0.373 -11.083 -3.617 1.00 0.62 O HETATM 136 H ORN A 8 -2.147 -13.399 -3.672 1.00 1.31 H HETATM 137 HA ORN A 8 -3.003 -11.937 -1.993 1.00 0.68 H HETATM 138 HB2 ORN A 8 -1.196 -11.017 -0.378 1.00 1.41 H HETATM 139 HB3 ORN A 8 -0.338 -12.509 -0.729 1.00 1.23 H HETATM 140 HG2 ORN A 8 -1.552 -12.822 1.288 1.00 1.68 H HETATM 141 HG3 ORN A 8 -2.356 -13.762 0.031 1.00 1.12 H HETATM 142 HD2 ORN A 8 -3.998 -12.604 1.397 1.00 0.81 H HETATM 143 HD3 ORN A 8 -4.010 -11.970 -0.246 1.00 0.75 H HETATM 144 HE1 ORN A 8 -2.877 -10.593 2.096 1.00 0.53 H HETATM 145 HT3 ORN A 8 -0.667 -13.527 -2.865 1.00 1.21 H ATOM 146 N CYS A 9 -2.022 -9.776 -2.810 1.00 0.41 N ATOM 147 CA CYS A 9 -1.556 -8.559 -3.449 1.00 0.30 C ATOM 148 C CYS A 9 -0.270 -8.094 -2.779 1.00 0.26 C ATOM 149 O CYS A 9 -0.271 -7.764 -1.593 1.00 0.34 O ATOM 150 CB CYS A 9 -2.636 -7.482 -3.341 1.00 0.29 C ATOM 151 SG CYS A 9 -2.142 -5.854 -3.945 1.00 0.23 S ATOM 152 H CYS A 9 -2.848 -9.744 -2.278 1.00 0.39 H ATOM 153 HA CYS A 9 -1.363 -8.772 -4.489 1.00 0.32 H ATOM 154 HB2 CYS A 9 -3.500 -7.791 -3.909 1.00 0.33 H ATOM 155 HB3 CYS A 9 -2.916 -7.374 -2.305 1.00 0.30 H ATOM 156 N GLY A 10 0.821 -8.074 -3.533 1.00 0.25 N ATOM 157 CA GLY A 10 2.106 -7.750 -2.961 1.00 0.27 C ATOM 158 C GLY A 10 2.861 -6.720 -3.770 1.00 0.21 C ATOM 159 O GLY A 10 3.944 -6.995 -4.287 1.00 0.30 O ATOM 160 H GLY A 10 0.752 -8.269 -4.492 1.00 0.32 H ATOM 161 HA2 GLY A 10 1.957 -7.369 -1.962 1.00 0.31 H ATOM 162 HA3 GLY A 10 2.696 -8.650 -2.907 1.00 0.34 H ATOM 163 N LYS A 11 2.278 -5.539 -3.890 1.00 0.17 N ATOM 164 CA LYS A 11 2.908 -4.433 -4.596 1.00 0.16 C ATOM 165 C LYS A 11 3.834 -3.679 -3.644 1.00 0.16 C ATOM 166 O LYS A 11 3.460 -3.389 -2.507 1.00 0.21 O ATOM 167 CB LYS A 11 1.825 -3.510 -5.164 1.00 0.24 C ATOM 168 CG LYS A 11 2.322 -2.499 -6.186 1.00 0.75 C ATOM 169 CD LYS A 11 1.167 -1.970 -7.021 1.00 0.58 C ATOM 170 CE LYS A 11 1.634 -1.027 -8.119 1.00 1.49 C ATOM 171 NZ LYS A 11 2.095 0.282 -7.589 1.00 2.05 N1+ ATOM 172 H LYS A 11 1.394 -5.408 -3.496 1.00 0.24 H ATOM 173 HA LYS A 11 3.493 -4.841 -5.408 1.00 0.18 H ATOM 174 HB2 LYS A 11 1.068 -4.115 -5.638 1.00 0.71 H ATOM 175 HB3 LYS A 11 1.372 -2.967 -4.347 1.00 0.81 H ATOM 176 HG2 LYS A 11 2.792 -1.676 -5.667 1.00 1.30 H ATOM 177 HG3 LYS A 11 3.038 -2.978 -6.837 1.00 1.24 H ATOM 178 HD2 LYS A 11 0.658 -2.805 -7.476 1.00 0.70 H ATOM 179 HD3 LYS A 11 0.482 -1.442 -6.374 1.00 0.86 H ATOM 180 HE2 LYS A 11 2.450 -1.494 -8.649 1.00 2.21 H ATOM 181 HE3 LYS A 11 0.814 -0.860 -8.802 1.00 1.86 H ATOM 182 HZ1 LYS A 11 1.328 0.749 -7.067 1.00 2.40 H ATOM 183 HZ2 LYS A 11 2.387 0.901 -8.374 1.00 2.57 H ATOM 184 HZ3 LYS A 11 2.905 0.149 -6.953 1.00 2.43 H ATOM 185 N ARG A 12 5.045 -3.389 -4.100 1.00 0.14 N ATOM 186 CA ARG A 12 6.051 -2.757 -3.252 1.00 0.17 C ATOM 187 C ARG A 12 6.150 -1.267 -3.528 1.00 0.15 C ATOM 188 O ARG A 12 6.177 -0.843 -4.684 1.00 0.24 O ATOM 189 CB ARG A 12 7.418 -3.413 -3.464 1.00 0.26 C ATOM 190 CG ARG A 12 7.481 -4.850 -2.981 1.00 0.83 C ATOM 191 CD ARG A 12 8.828 -5.487 -3.287 1.00 0.78 C ATOM 192 NE ARG A 12 8.939 -6.823 -2.706 1.00 1.85 N ATOM 193 CZ ARG A 12 8.881 -7.955 -3.406 1.00 2.32 C ATOM 194 NH1 ARG A 12 8.699 -7.926 -4.722 1.00 2.15 N1+ ATOM 195 NH2 ARG A 12 9.010 -9.121 -2.787 1.00 3.36 N ATOM 196 H ARG A 12 5.264 -3.590 -5.035 1.00 0.14 H ATOM 197 HA ARG A 12 5.750 -2.898 -2.224 1.00 0.21 H ATOM 198 HB2 ARG A 12 7.651 -3.398 -4.518 1.00 0.90 H ATOM 199 HB3 ARG A 12 8.163 -2.842 -2.930 1.00 0.85 H ATOM 200 HG2 ARG A 12 7.321 -4.867 -1.913 1.00 1.33 H ATOM 201 HG3 ARG A 12 6.703 -5.417 -3.471 1.00 1.38 H ATOM 202 HD2 ARG A 12 8.947 -5.558 -4.358 1.00 0.99 H ATOM 203 HD3 ARG A 12 9.608 -4.862 -2.880 1.00 0.93 H ATOM 204 HE ARG A 12 9.075 -6.877 -1.732 1.00 2.49 H ATOM 205 HH11 ARG A 12 8.604 -7.048 -5.202 1.00 1.82 H ATOM 206 HH12 ARG A 12 8.654 -8.782 -5.244 1.00 2.73 H ATOM 207 HH21 ARG A 12 8.965 -9.976 -3.311 1.00 3.75 H ATOM 208 HH22 ARG A 12 9.159 -9.155 -1.796 1.00 3.87 H ATOM 209 N PHE A 13 6.207 -0.479 -2.466 1.00 0.10 N ATOM 210 CA PHE A 13 6.272 0.969 -2.579 1.00 0.10 C ATOM 211 C PHE A 13 7.513 1.505 -1.885 1.00 0.12 C ATOM 212 O PHE A 13 8.011 0.911 -0.930 1.00 0.18 O ATOM 213 CB PHE A 13 5.018 1.593 -1.971 1.00 0.12 C ATOM 214 CG PHE A 13 3.764 1.088 -2.610 1.00 0.14 C ATOM 215 CD1 PHE A 13 3.249 1.713 -3.729 1.00 0.19 C ATOM 216 CD2 PHE A 13 3.093 0.005 -2.078 1.00 0.16 C ATOM 217 CE1 PHE A 13 2.085 1.266 -4.310 1.00 0.22 C ATOM 218 CE2 PHE A 13 1.928 -0.450 -2.655 1.00 0.20 C ATOM 219 CZ PHE A 13 1.466 0.127 -3.811 1.00 0.21 C ATOM 220 H PHE A 13 6.193 -0.882 -1.568 1.00 0.14 H ATOM 221 HA PHE A 13 6.316 1.220 -3.627 1.00 0.13 H ATOM 222 HB2 PHE A 13 4.974 1.359 -0.917 1.00 0.12 H ATOM 223 HB3 PHE A 13 5.053 2.663 -2.100 1.00 0.14 H ATOM 224 HD1 PHE A 13 3.768 2.561 -4.147 1.00 0.21 H ATOM 225 HD2 PHE A 13 3.491 -0.489 -1.205 1.00 0.16 H ATOM 226 HE1 PHE A 13 1.692 1.762 -5.185 1.00 0.27 H ATOM 227 HE2 PHE A 13 1.410 -1.295 -2.233 1.00 0.22 H ATOM 228 HZ PHE A 13 0.568 -0.246 -4.277 1.00 0.25 H ATOM 229 N THR A 14 8.013 2.621 -2.382 1.00 0.15 N ATOM 230 CA THR A 14 9.188 3.256 -1.817 1.00 0.17 C ATOM 231 C THR A 14 8.785 4.239 -0.718 1.00 0.13 C ATOM 232 O THR A 14 9.614 4.683 0.077 1.00 0.24 O ATOM 233 CB THR A 14 9.966 4.002 -2.920 1.00 0.28 C ATOM 234 OG1 THR A 14 10.042 3.176 -4.090 1.00 0.85 O ATOM 235 CG2 THR A 14 11.374 4.355 -2.461 1.00 0.95 C ATOM 236 H THR A 14 7.584 3.028 -3.165 1.00 0.20 H ATOM 237 HA THR A 14 9.824 2.491 -1.398 1.00 0.23 H ATOM 238 HB THR A 14 9.438 4.915 -3.160 1.00 0.82 H ATOM 239 HG1 THR A 14 10.476 2.345 -3.864 1.00 1.26 H ATOM 240 HG21 THR A 14 11.885 4.890 -3.247 1.00 1.58 H ATOM 241 HG22 THR A 14 11.915 3.450 -2.232 1.00 1.36 H ATOM 242 HG23 THR A 14 11.321 4.976 -1.578 1.00 1.65 H ATOM 243 N ARG A 15 7.498 4.568 -0.675 1.00 0.13 N ATOM 244 CA ARG A 15 6.989 5.530 0.292 1.00 0.18 C ATOM 245 C ARG A 15 5.749 4.989 0.999 1.00 0.14 C ATOM 246 O ARG A 15 4.844 4.426 0.373 1.00 0.13 O ATOM 247 CB ARG A 15 6.669 6.859 -0.400 1.00 0.31 C ATOM 248 CG ARG A 15 7.900 7.578 -0.934 1.00 0.38 C ATOM 249 CD ARG A 15 7.544 8.910 -1.577 1.00 0.91 C ATOM 250 NE ARG A 15 6.740 8.742 -2.786 1.00 1.61 N ATOM 251 CZ ARG A 15 6.094 9.735 -3.396 1.00 2.07 C ATOM 252 NH1 ARG A 15 6.119 10.962 -2.888 1.00 1.87 N1+ ATOM 253 NH2 ARG A 15 5.428 9.499 -4.519 1.00 3.12 N ATOM 254 H ARG A 15 6.875 4.141 -1.301 1.00 0.20 H ATOM 255 HA ARG A 15 7.762 5.693 1.025 1.00 0.22 H ATOM 256 HB2 ARG A 15 6.003 6.671 -1.230 1.00 0.37 H ATOM 257 HB3 ARG A 15 6.175 7.510 0.305 1.00 0.40 H ATOM 258 HG2 ARG A 15 8.581 7.757 -0.115 1.00 0.69 H ATOM 259 HG3 ARG A 15 8.378 6.949 -1.671 1.00 0.59 H ATOM 260 HD2 ARG A 15 6.988 9.504 -0.868 1.00 1.32 H ATOM 261 HD3 ARG A 15 8.458 9.423 -1.836 1.00 1.67 H ATOM 262 HE ARG A 15 6.698 7.838 -3.176 1.00 2.18 H ATOM 263 HH11 ARG A 15 6.624 11.149 -2.041 1.00 1.78 H ATOM 264 HH12 ARG A 15 5.631 11.710 -3.348 1.00 2.28 H ATOM 265 HH21 ARG A 15 5.409 8.576 -4.911 1.00 3.70 H ATOM 266 HH22 ARG A 15 4.943 10.245 -4.983 1.00 3.46 H ATOM 267 N SER A 16 5.724 5.172 2.318 1.00 0.15 N ATOM 268 CA SER A 16 4.644 4.666 3.160 1.00 0.14 C ATOM 269 C SER A 16 3.315 5.339 2.817 1.00 0.12 C ATOM 270 O SER A 16 2.250 4.726 2.927 1.00 0.15 O ATOM 271 CB SER A 16 4.984 4.884 4.639 1.00 0.22 C ATOM 272 OG SER A 16 3.982 4.352 5.489 1.00 1.22 O ATOM 273 H SER A 16 6.463 5.666 2.739 1.00 0.19 H ATOM 274 HA SER A 16 4.556 3.605 2.976 1.00 0.16 H ATOM 275 HB2 SER A 16 5.922 4.397 4.867 1.00 0.90 H ATOM 276 HB3 SER A 16 5.076 5.941 4.832 1.00 1.04 H ATOM 277 HG SER A 16 3.903 4.910 6.271 1.00 1.52 H ATOM 278 N ASP A 17 3.383 6.600 2.396 1.00 0.14 N ATOM 279 CA ASP A 17 2.193 7.334 1.975 1.00 0.19 C ATOM 280 C ASP A 17 1.586 6.695 0.739 1.00 0.16 C ATOM 281 O ASP A 17 0.367 6.684 0.569 1.00 0.18 O ATOM 282 CB ASP A 17 2.518 8.803 1.687 1.00 0.28 C ATOM 283 CG ASP A 17 2.813 9.603 2.938 1.00 1.40 C ATOM 284 OD1 ASP A 17 1.870 10.182 3.519 1.00 2.04 O ATOM 285 OD2 ASP A 17 3.985 9.653 3.357 1.00 2.15 O1- ATOM 286 H ASP A 17 4.254 7.050 2.376 1.00 0.15 H ATOM 287 HA ASP A 17 1.473 7.283 2.777 1.00 0.24 H ATOM 288 HB2 ASP A 17 3.380 8.852 1.043 1.00 1.06 H ATOM 289 HB3 ASP A 17 1.678 9.254 1.184 1.00 0.95 H ATOM 290 N GLU A 18 2.444 6.153 -0.115 1.00 0.15 N ATOM 291 CA GLU A 18 1.999 5.487 -1.328 1.00 0.16 C ATOM 292 C GLU A 18 1.428 4.116 -1.010 1.00 0.11 C ATOM 293 O GLU A 18 0.482 3.672 -1.653 1.00 0.13 O ATOM 294 CB GLU A 18 3.141 5.373 -2.334 1.00 0.25 C ATOM 295 CG GLU A 18 3.511 6.698 -2.974 1.00 0.40 C ATOM 296 CD GLU A 18 2.353 7.312 -3.738 1.00 1.31 C ATOM 297 OE1 GLU A 18 1.751 8.284 -3.236 1.00 2.28 O ATOM 298 OE2 GLU A 18 2.038 6.827 -4.842 1.00 1.61 O1- ATOM 299 H GLU A 18 3.401 6.192 0.080 1.00 0.16 H ATOM 300 HA GLU A 18 1.216 6.090 -1.761 1.00 0.24 H ATOM 301 HB2 GLU A 18 4.014 4.984 -1.832 1.00 0.27 H ATOM 302 HB3 GLU A 18 2.851 4.689 -3.117 1.00 0.28 H ATOM 303 HG2 GLU A 18 3.815 7.387 -2.198 1.00 0.80 H ATOM 304 HG3 GLU A 18 4.330 6.536 -3.658 1.00 0.93 H ATOM 305 N LEU A 19 2.000 3.447 -0.013 1.00 0.11 N ATOM 306 CA LEU A 19 1.447 2.180 0.449 1.00 0.12 C ATOM 307 C LEU A 19 0.053 2.392 1.030 1.00 0.12 C ATOM 308 O LEU A 19 -0.877 1.659 0.705 1.00 0.14 O ATOM 309 CB LEU A 19 2.359 1.526 1.490 1.00 0.14 C ATOM 310 CG LEU A 19 1.789 0.262 2.143 1.00 0.15 C ATOM 311 CD1 LEU A 19 1.566 -0.831 1.107 1.00 0.17 C ATOM 312 CD2 LEU A 19 2.706 -0.233 3.251 1.00 0.17 C ATOM 313 H LEU A 19 2.814 3.805 0.407 1.00 0.12 H ATOM 314 HA LEU A 19 1.366 1.527 -0.407 1.00 0.14 H ATOM 315 HB2 LEU A 19 3.294 1.272 1.009 1.00 0.15 H ATOM 316 HB3 LEU A 19 2.559 2.245 2.266 1.00 0.15 H ATOM 317 HG LEU A 19 0.831 0.499 2.585 1.00 0.15 H ATOM 318 HD11 LEU A 19 2.502 -1.062 0.621 1.00 0.93 H ATOM 319 HD12 LEU A 19 0.850 -0.491 0.372 1.00 0.92 H ATOM 320 HD13 LEU A 19 1.187 -1.717 1.595 1.00 0.94 H ATOM 321 HD21 LEU A 19 2.941 0.585 3.917 1.00 0.94 H ATOM 322 HD22 LEU A 19 3.615 -0.623 2.820 1.00 1.07 H ATOM 323 HD23 LEU A 19 2.209 -1.015 3.805 1.00 1.03 H ATOM 324 N GLN A 20 -0.090 3.409 1.878 1.00 0.15 N ATOM 325 CA GLN A 20 -1.387 3.741 2.466 1.00 0.19 C ATOM 326 C GLN A 20 -2.378 4.137 1.373 1.00 0.15 C ATOM 327 O GLN A 20 -3.540 3.711 1.378 1.00 0.16 O ATOM 328 CB GLN A 20 -1.237 4.872 3.486 1.00 0.27 C ATOM 329 CG GLN A 20 -2.562 5.367 4.045 1.00 1.15 C ATOM 330 CD GLN A 20 -2.391 6.384 5.155 1.00 1.67 C ATOM 331 OE1 GLN A 20 -1.415 6.344 5.904 1.00 2.11 O ATOM 332 NE2 GLN A 20 -3.332 7.309 5.263 1.00 2.50 N ATOM 333 H GLN A 20 0.698 3.945 2.120 1.00 0.17 H ATOM 334 HA GLN A 20 -1.755 2.858 2.967 1.00 0.23 H ATOM 335 HB2 GLN A 20 -0.635 4.520 4.311 1.00 0.82 H ATOM 336 HB3 GLN A 20 -0.735 5.705 3.015 1.00 0.82 H ATOM 337 HG2 GLN A 20 -3.126 5.823 3.245 1.00 1.84 H ATOM 338 HG3 GLN A 20 -3.110 4.523 4.433 1.00 1.71 H ATOM 339 HE21 GLN A 20 -4.079 7.289 4.624 1.00 2.87 H ATOM 340 HE22 GLN A 20 -3.247 7.973 5.977 1.00 3.01 H ATOM 341 N ARG A 21 -1.895 4.954 0.441 1.00 0.15 N ATOM 342 CA ARG A 21 -2.663 5.340 -0.737 1.00 0.19 C ATOM 343 C ARG A 21 -3.206 4.098 -1.428 1.00 0.14 C ATOM 344 O ARG A 21 -4.413 3.963 -1.644 1.00 0.16 O ATOM 345 CB ARG A 21 -1.757 6.119 -1.694 1.00 0.28 C ATOM 346 CG ARG A 21 -2.442 6.624 -2.951 1.00 0.90 C ATOM 347 CD ARG A 21 -1.442 7.323 -3.859 1.00 0.92 C ATOM 348 NE ARG A 21 -2.079 7.906 -5.037 1.00 1.52 N ATOM 349 CZ ARG A 21 -1.417 8.346 -6.104 1.00 1.91 C ATOM 350 NH1 ARG A 21 -0.092 8.238 -6.169 1.00 1.87 N1+ ATOM 351 NH2 ARG A 21 -2.085 8.896 -7.112 1.00 2.78 N ATOM 352 H ARG A 21 -0.985 5.312 0.554 1.00 0.17 H ATOM 353 HA ARG A 21 -3.483 5.967 -0.425 1.00 0.24 H ATOM 354 HB2 ARG A 21 -1.354 6.972 -1.171 1.00 0.71 H ATOM 355 HB3 ARG A 21 -0.942 5.480 -1.993 1.00 0.85 H ATOM 356 HG2 ARG A 21 -2.874 5.787 -3.479 1.00 1.39 H ATOM 357 HG3 ARG A 21 -3.218 7.321 -2.675 1.00 1.31 H ATOM 358 HD2 ARG A 21 -0.957 8.109 -3.301 1.00 1.26 H ATOM 359 HD3 ARG A 21 -0.705 6.603 -4.180 1.00 1.23 H ATOM 360 HE ARG A 21 -3.058 7.986 -5.021 1.00 2.02 H ATOM 361 HH11 ARG A 21 0.425 7.821 -5.409 1.00 1.76 H ATOM 362 HH12 ARG A 21 0.400 8.567 -6.976 1.00 2.33 H ATOM 363 HH21 ARG A 21 -3.084 8.980 -7.071 1.00 3.23 H ATOM 364 HH22 ARG A 21 -1.593 9.233 -7.920 1.00 3.13 H ATOM 365 N HIS A 22 -2.299 3.182 -1.737 1.00 0.11 N ATOM 366 CA HIS A 22 -2.642 1.923 -2.370 1.00 0.09 C ATOM 367 C HIS A 22 -3.658 1.145 -1.534 1.00 0.11 C ATOM 368 O HIS A 22 -4.628 0.623 -2.065 1.00 0.15 O ATOM 369 CB HIS A 22 -1.370 1.096 -2.584 1.00 0.11 C ATOM 370 CG HIS A 22 -1.629 -0.327 -2.960 1.00 0.11 C ATOM 371 ND1 HIS A 22 -1.743 -0.788 -4.266 1.00 0.18 N ATOM 372 CD2 HIS A 22 -1.847 -1.399 -2.159 1.00 0.11 C ATOM 373 CE1 HIS A 22 -2.042 -2.098 -4.211 1.00 0.21 C ATOM 374 NE2 HIS A 22 -2.110 -2.481 -2.961 1.00 0.15 N ATOM 375 H HIS A 22 -1.353 3.360 -1.531 1.00 0.13 H ATOM 376 HA HIS A 22 -3.081 2.144 -3.331 1.00 0.11 H ATOM 377 HB2 HIS A 22 -0.787 1.547 -3.372 1.00 0.14 H ATOM 378 HB3 HIS A 22 -0.791 1.099 -1.670 1.00 0.12 H ATOM 379 HD1 HIS A 22 -1.627 -0.251 -5.082 1.00 0.24 H ATOM 380 HD2 HIS A 22 -1.790 -1.417 -1.082 1.00 0.14 H ATOM 381 HE1 HIS A 22 -2.192 -2.738 -5.065 1.00 0.28 H ATOM 382 N LYS A 23 -3.430 1.085 -0.226 1.00 0.13 N ATOM 383 CA LYS A 23 -4.317 0.358 0.680 1.00 0.18 C ATOM 384 C LYS A 23 -5.752 0.859 0.577 1.00 0.17 C ATOM 385 O LYS A 23 -6.700 0.097 0.789 1.00 0.21 O ATOM 386 CB LYS A 23 -3.836 0.480 2.125 1.00 0.26 C ATOM 387 CG LYS A 23 -2.568 -0.299 2.427 1.00 0.57 C ATOM 388 CD LYS A 23 -2.787 -1.798 2.304 1.00 0.99 C ATOM 389 CE LYS A 23 -1.547 -2.572 2.712 1.00 1.50 C ATOM 390 NZ LYS A 23 -1.204 -2.348 4.140 1.00 1.93 N1+ ATOM 391 H LYS A 23 -2.637 1.534 0.139 1.00 0.13 H ATOM 392 HA LYS A 23 -4.297 -0.680 0.393 1.00 0.24 H ATOM 393 HB2 LYS A 23 -3.649 1.522 2.339 1.00 0.56 H ATOM 394 HB3 LYS A 23 -4.615 0.122 2.779 1.00 0.66 H ATOM 395 HG2 LYS A 23 -1.797 -0.003 1.731 1.00 1.21 H ATOM 396 HG3 LYS A 23 -2.251 -0.073 3.434 1.00 1.27 H ATOM 397 HD2 LYS A 23 -3.606 -2.085 2.947 1.00 1.75 H ATOM 398 HD3 LYS A 23 -3.030 -2.034 1.281 1.00 1.44 H ATOM 399 HE2 LYS A 23 -1.723 -3.625 2.552 1.00 1.79 H ATOM 400 HE3 LYS A 23 -0.719 -2.248 2.097 1.00 2.05 H ATOM 401 HZ1 LYS A 23 -1.058 -1.335 4.324 1.00 2.29 H ATOM 402 HZ2 LYS A 23 -0.337 -2.862 4.387 1.00 2.36 H ATOM 403 HZ3 LYS A 23 -1.977 -2.689 4.750 1.00 2.11 H ATOM 404 N ARG A 24 -5.912 2.134 0.228 1.00 0.17 N ATOM 405 CA ARG A 24 -7.244 2.714 0.086 1.00 0.23 C ATOM 406 C ARG A 24 -8.013 2.088 -1.080 1.00 0.22 C ATOM 407 O ARG A 24 -9.204 2.353 -1.255 1.00 0.33 O ATOM 408 CB ARG A 24 -7.167 4.231 -0.085 1.00 0.34 C ATOM 409 CG ARG A 24 -6.815 4.970 1.194 1.00 0.92 C ATOM 410 CD ARG A 24 -6.819 6.477 0.982 1.00 0.92 C ATOM 411 NE ARG A 24 -8.110 6.957 0.488 1.00 1.57 N ATOM 412 CZ ARG A 24 -8.666 8.114 0.842 1.00 1.89 C ATOM 413 NH1 ARG A 24 -8.070 8.902 1.731 1.00 1.57 N1+ ATOM 414 NH2 ARG A 24 -9.827 8.476 0.312 1.00 2.84 N ATOM 415 H ARG A 24 -5.114 2.699 0.066 1.00 0.18 H ATOM 416 HA ARG A 24 -7.783 2.500 0.997 1.00 0.28 H ATOM 417 HB2 ARG A 24 -6.415 4.460 -0.825 1.00 0.81 H ATOM 418 HB3 ARG A 24 -8.123 4.592 -0.432 1.00 0.82 H ATOM 419 HG2 ARG A 24 -7.541 4.721 1.953 1.00 1.39 H ATOM 420 HG3 ARG A 24 -5.832 4.662 1.518 1.00 1.39 H ATOM 421 HD2 ARG A 24 -6.599 6.962 1.921 1.00 1.14 H ATOM 422 HD3 ARG A 24 -6.054 6.729 0.262 1.00 1.40 H ATOM 423 HE ARG A 24 -8.584 6.386 -0.160 1.00 2.11 H ATOM 424 HH11 ARG A 24 -8.488 9.774 1.994 1.00 1.94 H ATOM 425 HH12 ARG A 24 -7.199 8.627 2.150 1.00 1.49 H ATOM 426 HH21 ARG A 24 -10.253 9.346 0.572 1.00 3.18 H ATOM 427 HH22 ARG A 24 -10.284 7.879 -0.356 1.00 3.39 H ATOM 428 N THR A 25 -7.339 1.266 -1.879 1.00 0.21 N ATOM 429 CA THR A 25 -8.007 0.541 -2.948 1.00 0.27 C ATOM 430 C THR A 25 -8.634 -0.738 -2.389 1.00 0.26 C ATOM 431 O THR A 25 -9.649 -1.220 -2.895 1.00 0.34 O ATOM 432 CB THR A 25 -7.048 0.205 -4.125 1.00 0.37 C ATOM 433 OG1 THR A 25 -7.797 0.036 -5.336 1.00 1.28 O ATOM 434 CG2 THR A 25 -6.251 -1.067 -3.864 1.00 1.04 C ATOM 435 H THR A 25 -6.372 1.147 -1.746 1.00 0.23 H ATOM 436 HA THR A 25 -8.796 1.173 -3.326 1.00 0.29 H ATOM 437 HB THR A 25 -6.356 1.025 -4.252 1.00 0.93 H ATOM 438 HG1 THR A 25 -8.146 0.893 -5.613 1.00 1.45 H ATOM 439 HG21 THR A 25 -5.627 -1.283 -4.719 1.00 1.50 H ATOM 440 HG22 THR A 25 -6.931 -1.888 -3.697 1.00 1.73 H ATOM 441 HG23 THR A 25 -5.631 -0.930 -2.991 1.00 1.63 H ATOM 442 N HIS A 26 -8.041 -1.266 -1.320 1.00 0.22 N ATOM 443 CA HIS A 26 -8.560 -2.460 -0.672 1.00 0.25 C ATOM 444 C HIS A 26 -9.678 -2.075 0.282 1.00 0.32 C ATOM 445 O HIS A 26 -10.734 -2.709 0.316 1.00 0.40 O ATOM 446 CB HIS A 26 -7.458 -3.201 0.093 1.00 0.27 C ATOM 447 CG HIS A 26 -6.386 -3.791 -0.773 1.00 0.23 C ATOM 448 ND1 HIS A 26 -6.587 -4.849 -1.654 1.00 0.26 N ATOM 449 CD2 HIS A 26 -5.069 -3.474 -0.863 1.00 0.20 C ATOM 450 CE1 HIS A 26 -5.406 -5.132 -2.236 1.00 0.26 C ATOM 451 NE2 HIS A 26 -4.485 -4.324 -1.780 1.00 0.21 N ATOM 452 H HIS A 26 -7.240 -0.831 -0.950 1.00 0.22 H ATOM 453 HA HIS A 26 -8.959 -3.107 -1.437 1.00 0.30 H ATOM 454 HB2 HIS A 26 -6.981 -2.512 0.775 1.00 0.30 H ATOM 455 HB3 HIS A 26 -7.905 -4.003 0.661 1.00 0.34 H ATOM 456 HD1 HIS A 26 -7.439 -5.311 -1.817 1.00 0.30 H ATOM 457 HD2 HIS A 26 -4.556 -2.700 -0.314 1.00 0.20 H ATOM 458 HE1 HIS A 26 -5.241 -5.913 -2.962 1.00 0.32 H ATOM 459 N THR A 27 -9.442 -1.023 1.050 1.00 0.46 N ATOM 460 CA THR A 27 -10.438 -0.510 1.967 1.00 0.61 C ATOM 461 C THR A 27 -10.109 0.937 2.329 1.00 1.09 C ATOM 462 O THR A 27 -8.938 1.322 2.381 1.00 1.74 O ATOM 463 CB THR A 27 -10.542 -1.386 3.241 1.00 1.38 C ATOM 464 OG1 THR A 27 -11.690 -1.009 4.013 1.00 2.22 O ATOM 465 CG2 THR A 27 -9.290 -1.276 4.101 1.00 2.01 C ATOM 466 H THR A 27 -8.567 -0.572 0.993 1.00 0.53 H ATOM 467 HA THR A 27 -11.392 -0.533 1.462 1.00 1.04 H ATOM 468 HB THR A 27 -10.656 -2.415 2.934 1.00 1.93 H ATOM 469 HG1 THR A 27 -12.485 -1.369 3.599 1.00 2.59 H ATOM 470 HG21 THR A 27 -9.397 -1.902 4.976 1.00 2.64 H ATOM 471 HG22 THR A 27 -9.155 -0.250 4.409 1.00 2.34 H ATOM 472 HG23 THR A 27 -8.431 -1.596 3.530 1.00 2.33 H ATOM 473 N GLY A 28 -11.140 1.733 2.556 1.00 1.76 N ATOM 474 CA GLY A 28 -10.948 3.144 2.810 1.00 2.63 C ATOM 475 C GLY A 28 -11.942 3.982 2.042 1.00 2.96 C ATOM 476 O GLY A 28 -11.571 4.942 1.364 1.00 3.50 O ATOM 477 H GLY A 28 -12.046 1.357 2.559 1.00 2.05 H ATOM 478 HA2 GLY A 28 -11.067 3.331 3.867 1.00 3.01 H ATOM 479 HA3 GLY A 28 -9.950 3.423 2.512 1.00 3.11 H ATOM 480 N GLU A 29 -13.209 3.615 2.150 1.00 3.27 N ATOM 481 CA GLU A 29 -14.274 4.289 1.423 1.00 3.97 C ATOM 482 C GLU A 29 -14.705 5.553 2.160 1.00 4.68 C ATOM 483 O GLU A 29 -15.797 5.613 2.726 1.00 5.51 O ATOM 484 CB GLU A 29 -15.469 3.347 1.244 1.00 4.55 C ATOM 485 CG GLU A 29 -15.156 2.106 0.424 1.00 5.26 C ATOM 486 CD GLU A 29 -16.330 1.155 0.346 1.00 6.09 C ATOM 487 OE1 GLU A 29 -16.494 0.328 1.266 1.00 6.58 O ATOM 488 OE2 GLU A 29 -17.097 1.231 -0.636 1.00 6.49 O1- ATOM 489 H GLU A 29 -13.439 2.877 2.752 1.00 3.40 H ATOM 490 HA GLU A 29 -13.891 4.563 0.452 1.00 4.05 H ATOM 491 HB2 GLU A 29 -15.813 3.032 2.218 1.00 4.68 H ATOM 492 HB3 GLU A 29 -16.265 3.885 0.752 1.00 4.82 H ATOM 493 HG2 GLU A 29 -14.893 2.409 -0.578 1.00 5.48 H ATOM 494 HG3 GLU A 29 -14.321 1.589 0.872 1.00 5.34 H ATOM 495 N LYS A 30 -13.838 6.556 2.142 1.00 4.75 N ATOM 496 CA LYS A 30 -14.084 7.809 2.843 1.00 5.79 C ATOM 497 C LYS A 30 -15.133 8.638 2.116 1.00 6.33 C ATOM 498 O LYS A 30 -14.815 9.421 1.222 1.00 7.00 O ATOM 499 CB LYS A 30 -12.783 8.609 2.973 1.00 6.19 C ATOM 500 CG LYS A 30 -11.669 7.864 3.697 1.00 6.60 C ATOM 501 CD LYS A 30 -12.074 7.464 5.109 1.00 7.40 C ATOM 502 CE LYS A 30 -12.381 8.675 5.976 1.00 8.28 C ATOM 503 NZ LYS A 30 -12.750 8.285 7.362 1.00 8.46 N1+ ATOM 504 H LYS A 30 -13.005 6.452 1.635 1.00 4.36 H ATOM 505 HA LYS A 30 -14.451 7.570 3.830 1.00 6.29 H ATOM 506 HB2 LYS A 30 -12.431 8.860 1.984 1.00 5.94 H ATOM 507 HB3 LYS A 30 -12.987 9.521 3.513 1.00 6.82 H ATOM 508 HG2 LYS A 30 -11.426 6.972 3.139 1.00 6.55 H ATOM 509 HG3 LYS A 30 -10.799 8.503 3.749 1.00 6.72 H ATOM 510 HD2 LYS A 30 -12.954 6.842 5.058 1.00 7.64 H ATOM 511 HD3 LYS A 30 -11.266 6.907 5.560 1.00 7.39 H ATOM 512 HE2 LYS A 30 -11.508 9.309 6.008 1.00 8.70 H ATOM 513 HE3 LYS A 30 -13.204 9.218 5.533 1.00 8.65 H ATOM 514 HZ1 LYS A 30 -13.559 7.635 7.347 1.00 8.39 H ATOM 515 HZ2 LYS A 30 -13.011 9.128 7.911 1.00 8.58 H ATOM 516 HZ3 LYS A 30 -11.947 7.815 7.830 1.00 8.79 H HETATM 517 N NH2 A 31 -16.384 8.456 2.491 1.00 6.36 N HETATM 518 HN1 NH2 A 31 -16.558 7.814 3.213 1.00 6.02 H HETATM 519 HN2 NH2 A 31 -17.086 8.968 2.035 1.00 6.91 H TER 520 NH2 A 31 HETATM 521 ZN ZN A 101 -2.557 -4.304 -2.301 1.00 0.19 ZN