ATOM 1 N ARG A 1 -13.851 2.870 -2.992 1.00 1.49 N ATOM 2 CA ARG A 1 -13.174 1.751 -3.679 1.00 1.23 C ATOM 3 C ARG A 1 -12.252 1.019 -2.710 1.00 0.92 C ATOM 4 O ARG A 1 -11.443 1.648 -2.034 1.00 0.87 O ATOM 5 CB ARG A 1 -12.356 2.262 -4.867 1.00 1.39 C ATOM 6 CG ARG A 1 -13.190 2.938 -5.942 1.00 1.72 C ATOM 7 CD ARG A 1 -12.351 3.286 -7.162 1.00 2.08 C ATOM 8 NE ARG A 1 -11.332 4.298 -6.879 1.00 2.72 N ATOM 9 CZ ARG A 1 -10.228 4.458 -7.612 1.00 3.37 C ATOM 10 NH1 ARG A 1 -9.976 3.633 -8.621 1.00 3.46 N1+ ATOM 11 NH2 ARG A 1 -9.373 5.436 -7.333 1.00 4.31 N ATOM 12 H1 ARG A 1 -13.147 3.538 -2.617 1.00 1.99 H ATOM 13 H2 ARG A 1 -14.422 2.509 -2.203 1.00 1.49 H ATOM 14 H3 ARG A 1 -14.476 3.374 -3.651 1.00 1.87 H ATOM 15 HA ARG A 1 -13.929 1.068 -4.035 1.00 1.29 H ATOM 16 HB2 ARG A 1 -11.626 2.972 -4.508 1.00 1.85 H ATOM 17 HB3 ARG A 1 -11.839 1.427 -5.317 1.00 1.75 H ATOM 18 HG2 ARG A 1 -13.984 2.271 -6.241 1.00 2.24 H ATOM 19 HG3 ARG A 1 -13.613 3.845 -5.538 1.00 2.16 H ATOM 20 HD2 ARG A 1 -11.863 2.390 -7.508 1.00 2.13 H ATOM 21 HD3 ARG A 1 -13.007 3.656 -7.936 1.00 2.66 H ATOM 22 HE ARG A 1 -11.490 4.901 -6.117 1.00 3.08 H ATOM 23 HH11 ARG A 1 -9.147 3.750 -9.173 1.00 4.09 H ATOM 24 HH12 ARG A 1 -10.612 2.886 -8.836 1.00 3.21 H ATOM 25 HH21 ARG A 1 -8.542 5.553 -7.887 1.00 4.86 H ATOM 26 HH22 ARG A 1 -9.556 6.068 -6.575 1.00 4.66 H ATOM 27 N PRO A 2 -12.368 -0.316 -2.610 1.00 0.80 N ATOM 28 CA PRO A 2 -11.472 -1.117 -1.776 1.00 0.58 C ATOM 29 C PRO A 2 -10.077 -1.226 -2.386 1.00 0.50 C ATOM 30 O PRO A 2 -9.922 -1.651 -3.536 1.00 0.76 O ATOM 31 CB PRO A 2 -12.132 -2.502 -1.730 1.00 0.73 C ATOM 32 CG PRO A 2 -13.480 -2.337 -2.353 1.00 1.00 C ATOM 33 CD PRO A 2 -13.381 -1.151 -3.269 1.00 1.00 C ATOM 34 HA PRO A 2 -11.396 -0.715 -0.777 1.00 0.51 H ATOM 35 HB2 PRO A 2 -11.527 -3.202 -2.286 1.00 0.85 H ATOM 36 HB3 PRO A 2 -12.211 -2.827 -0.705 1.00 0.80 H ATOM 37 HG2 PRO A 2 -13.733 -3.224 -2.916 1.00 1.32 H ATOM 38 HG3 PRO A 2 -14.217 -2.157 -1.585 1.00 1.20 H ATOM 39 HD2 PRO A 2 -13.051 -1.455 -4.252 1.00 1.18 H ATOM 40 HD3 PRO A 2 -14.329 -0.642 -3.325 1.00 1.09 H ATOM 41 N PHE A 3 -9.069 -0.844 -1.619 1.00 0.23 N ATOM 42 CA PHE A 3 -7.687 -0.913 -2.072 1.00 0.22 C ATOM 43 C PHE A 3 -6.956 -2.035 -1.351 1.00 0.33 C ATOM 44 O PHE A 3 -7.245 -2.324 -0.191 1.00 0.73 O ATOM 45 CB PHE A 3 -6.983 0.424 -1.829 1.00 0.20 C ATOM 46 CG PHE A 3 -7.588 1.558 -2.601 1.00 0.20 C ATOM 47 CD1 PHE A 3 -7.321 1.712 -3.951 1.00 0.30 C ATOM 48 CD2 PHE A 3 -8.430 2.464 -1.980 1.00 0.21 C ATOM 49 CE1 PHE A 3 -7.884 2.749 -4.669 1.00 0.41 C ATOM 50 CE2 PHE A 3 -8.995 3.505 -2.691 1.00 0.33 C ATOM 51 CZ PHE A 3 -8.721 3.647 -4.038 1.00 0.43 C ATOM 52 H PHE A 3 -9.257 -0.510 -0.714 1.00 0.23 H ATOM 53 HA PHE A 3 -7.693 -1.121 -3.132 1.00 0.22 H ATOM 54 HB2 PHE A 3 -7.038 0.669 -0.780 1.00 0.22 H ATOM 55 HB3 PHE A 3 -5.949 0.337 -2.118 1.00 0.30 H ATOM 56 HD1 PHE A 3 -6.666 1.009 -4.443 1.00 0.34 H ATOM 57 HD2 PHE A 3 -8.645 2.353 -0.928 1.00 0.19 H ATOM 58 HE1 PHE A 3 -7.665 2.858 -5.720 1.00 0.51 H ATOM 59 HE2 PHE A 3 -9.649 4.205 -2.196 1.00 0.39 H ATOM 60 HZ PHE A 3 -9.162 4.460 -4.596 1.00 0.54 H HETATM 61 N NLE A 4 -6.022 -2.672 -2.037 1.00 0.09 N HETATM 62 CA NLE A 4 -5.285 -3.783 -1.460 1.00 0.10 C HETATM 63 C NLE A 4 -3.865 -3.826 -2.003 1.00 0.11 C HETATM 64 O NLE A 4 -3.647 -3.750 -3.215 1.00 0.17 O HETATM 65 CB NLE A 4 -5.997 -5.103 -1.759 1.00 0.16 C HETATM 66 CG NLE A 4 -5.314 -6.322 -1.158 1.00 0.22 C HETATM 67 CD NLE A 4 -6.040 -7.604 -1.527 1.00 0.36 C HETATM 68 CE NLE A 4 -5.322 -8.800 -0.938 1.00 0.47 C HETATM 69 H NLE A 4 -5.820 -2.387 -2.955 1.00 0.33 H HETATM 70 HA NLE A 4 -5.247 -3.637 -0.391 1.00 0.11 H HETATM 71 HB2 NLE A 4 -6.042 -5.235 -2.829 1.00 0.16 H HETATM 72 HB3 NLE A 4 -7.002 -5.051 -1.370 1.00 0.18 H HETATM 73 HG2 NLE A 4 -5.300 -6.223 -0.082 1.00 0.24 H HETATM 74 HG3 NLE A 4 -4.301 -6.376 -1.529 1.00 0.21 H HETATM 75 HD2 NLE A 4 -6.064 -7.707 -2.602 1.00 0.37 H HETATM 76 HD3 NLE A 4 -7.045 -7.575 -1.133 1.00 0.39 H HETATM 77 HE1 NLE A 4 -4.316 -8.843 -1.328 1.00 0.99 H HETATM 78 HE2 NLE A 4 -5.849 -9.703 -1.204 1.00 1.13 H HETATM 79 HE3 NLE A 4 -5.288 -8.706 0.138 1.00 1.17 H ATOM 80 N CYS A 5 -2.906 -3.934 -1.098 1.00 0.10 N ATOM 81 CA CYS A 5 -1.508 -4.054 -1.470 1.00 0.12 C ATOM 82 C CYS A 5 -1.170 -5.499 -1.809 1.00 0.17 C ATOM 83 O CYS A 5 -1.044 -6.346 -0.919 1.00 0.19 O ATOM 84 CB CYS A 5 -0.613 -3.566 -0.338 1.00 0.12 C ATOM 85 SG CYS A 5 1.147 -3.821 -0.636 1.00 0.17 S ATOM 86 H CYS A 5 -3.148 -3.936 -0.144 1.00 0.12 H ATOM 87 HA CYS A 5 -1.340 -3.442 -2.341 1.00 0.16 H ATOM 88 HB2 CYS A 5 -0.771 -2.508 -0.189 1.00 0.16 H ATOM 89 HB3 CYS A 5 -0.872 -4.094 0.567 1.00 0.16 H ATOM 90 N THR A 6 -1.003 -5.773 -3.091 1.00 0.27 N ATOM 91 CA THR A 6 -0.731 -7.122 -3.554 1.00 0.35 C ATOM 92 C THR A 6 0.769 -7.421 -3.580 1.00 0.37 C ATOM 93 O THR A 6 1.252 -8.158 -4.441 1.00 0.47 O ATOM 94 CB THR A 6 -1.332 -7.345 -4.954 1.00 0.47 C ATOM 95 OG1 THR A 6 -1.031 -6.223 -5.796 1.00 0.91 O ATOM 96 CG2 THR A 6 -2.840 -7.534 -4.875 1.00 1.03 C ATOM 97 H THR A 6 -1.066 -5.048 -3.750 1.00 0.34 H ATOM 98 HA THR A 6 -1.207 -7.808 -2.870 1.00 0.38 H ATOM 99 HB THR A 6 -0.893 -8.234 -5.382 1.00 0.95 H ATOM 100 HG1 THR A 6 -0.108 -6.272 -6.071 1.00 1.67 H ATOM 101 HG21 THR A 6 -3.233 -7.694 -5.867 1.00 1.85 H ATOM 102 HG22 THR A 6 -3.293 -6.650 -4.447 1.00 1.24 H ATOM 103 HG23 THR A 6 -3.064 -8.389 -4.256 1.00 1.51 H ATOM 104 N TRP A 7 1.503 -6.833 -2.641 1.00 0.31 N ATOM 105 CA TRP A 7 2.922 -7.112 -2.499 1.00 0.37 C ATOM 106 C TRP A 7 3.105 -8.508 -1.920 1.00 0.40 C ATOM 107 O TRP A 7 2.252 -8.979 -1.166 1.00 0.54 O ATOM 108 CB TRP A 7 3.581 -6.072 -1.588 1.00 0.39 C ATOM 109 CG TRP A 7 5.078 -6.112 -1.607 1.00 0.49 C ATOM 110 CD1 TRP A 7 5.889 -6.882 -0.827 1.00 0.60 C ATOM 111 CD2 TRP A 7 5.940 -5.337 -2.442 1.00 0.51 C ATOM 112 NE1 TRP A 7 7.205 -6.637 -1.133 1.00 0.66 N ATOM 113 CE2 TRP A 7 7.262 -5.693 -2.122 1.00 0.61 C ATOM 114 CE3 TRP A 7 5.723 -4.379 -3.431 1.00 0.51 C ATOM 115 CZ2 TRP A 7 8.361 -5.123 -2.758 1.00 0.68 C ATOM 116 CZ3 TRP A 7 6.812 -3.812 -4.062 1.00 0.61 C ATOM 117 CH2 TRP A 7 8.118 -4.186 -3.724 1.00 0.67 C ATOM 118 H TRP A 7 1.078 -6.203 -2.027 1.00 0.30 H ATOM 119 HA TRP A 7 3.377 -7.070 -3.476 1.00 0.41 H ATOM 120 HB2 TRP A 7 3.273 -5.086 -1.895 1.00 0.39 H ATOM 121 HB3 TRP A 7 3.255 -6.241 -0.574 1.00 0.37 H ATOM 122 HD1 TRP A 7 5.535 -7.579 -0.083 1.00 0.65 H ATOM 123 HE1 TRP A 7 7.978 -7.068 -0.711 1.00 0.75 H ATOM 124 HE3 TRP A 7 4.723 -4.080 -3.703 1.00 0.47 H ATOM 125 HZ2 TRP A 7 9.375 -5.402 -2.507 1.00 0.76 H ATOM 126 HZ3 TRP A 7 6.665 -3.069 -4.829 1.00 0.66 H ATOM 127 HH2 TRP A 7 8.938 -3.715 -4.242 1.00 0.75 H HETATM 128 N AIB A 8 4.208 -9.154 -2.285 1.00 0.61 N HETATM 129 CA AIB A 8 4.512 -10.524 -1.849 1.00 0.65 C HETATM 130 C AIB A 8 4.356 -10.656 -0.322 1.00 0.65 C HETATM 131 O AIB A 8 5.198 -10.171 0.441 1.00 0.76 O HETATM 132 CB1 AIB A 8 5.937 -10.870 -2.232 1.00 0.73 C HETATM 133 CB2 AIB A 8 3.604 -11.503 -2.574 1.00 0.78 C HETATM 134 H AIB A 8 4.848 -8.694 -2.872 1.00 0.87 H HETATM 135 HB11 AIB A 8 6.167 -11.870 -1.892 1.00 1.23 H HETATM 136 HB12 AIB A 8 6.614 -10.168 -1.769 1.00 1.43 H HETATM 137 HB13 AIB A 8 6.045 -10.821 -3.304 1.00 1.05 H HETATM 138 HB21 AIB A 8 2.573 -11.253 -2.375 1.00 1.15 H HETATM 139 HB22 AIB A 8 3.806 -12.504 -2.226 1.00 1.41 H HETATM 140 HB23 AIB A 8 3.789 -11.446 -3.635 1.00 1.29 H ATOM 141 N GLY A 9 3.273 -11.296 0.111 1.00 0.71 N ATOM 142 CA GLY A 9 3.078 -11.580 1.520 1.00 0.81 C ATOM 143 C GLY A 9 2.636 -10.375 2.325 1.00 0.65 C ATOM 144 O GLY A 9 2.922 -10.287 3.519 1.00 0.80 O ATOM 145 H GLY A 9 2.591 -11.580 -0.535 1.00 0.78 H ATOM 146 HA2 GLY A 9 2.329 -12.350 1.615 1.00 0.97 H ATOM 147 HA3 GLY A 9 4.007 -11.949 1.928 1.00 0.92 H ATOM 148 N CYS A 10 1.949 -9.438 1.686 1.00 0.45 N ATOM 149 CA CYS A 10 1.457 -8.268 2.392 1.00 0.31 C ATOM 150 C CYS A 10 -0.064 -8.332 2.526 1.00 0.19 C ATOM 151 O CYS A 10 -0.576 -8.715 3.581 1.00 0.27 O ATOM 152 CB CYS A 10 1.892 -6.996 1.670 1.00 0.28 C ATOM 153 SG CYS A 10 1.745 -5.499 2.667 1.00 0.24 S ATOM 154 H CYS A 10 1.774 -9.531 0.723 1.00 0.46 H ATOM 155 HA CYS A 10 1.892 -8.275 3.378 1.00 0.39 H ATOM 156 HB2 CYS A 10 2.925 -7.094 1.377 1.00 0.39 H ATOM 157 HB3 CYS A 10 1.284 -6.866 0.790 1.00 0.28 H ATOM 158 N GLY A 11 -0.784 -7.974 1.467 1.00 0.15 N ATOM 159 CA GLY A 11 -2.232 -8.067 1.490 1.00 0.16 C ATOM 160 C GLY A 11 -2.877 -7.105 2.470 1.00 0.15 C ATOM 161 O GLY A 11 -3.941 -7.391 3.022 1.00 0.28 O ATOM 162 H GLY A 11 -0.333 -7.649 0.657 1.00 0.22 H ATOM 163 HA2 GLY A 11 -2.608 -7.855 0.500 1.00 0.25 H ATOM 164 HA3 GLY A 11 -2.511 -9.075 1.758 1.00 0.22 H ATOM 165 N LYS A 12 -2.230 -5.969 2.699 1.00 0.11 N ATOM 166 CA LYS A 12 -2.794 -4.944 3.561 1.00 0.15 C ATOM 167 C LYS A 12 -3.825 -4.137 2.782 1.00 0.12 C ATOM 168 O LYS A 12 -3.558 -3.682 1.668 1.00 0.17 O ATOM 169 CB LYS A 12 -1.691 -4.039 4.120 1.00 0.24 C ATOM 170 CG LYS A 12 -2.191 -3.055 5.161 1.00 0.75 C ATOM 171 CD LYS A 12 -1.043 -2.340 5.852 1.00 1.23 C ATOM 172 CE LYS A 12 -1.539 -1.242 6.777 1.00 1.80 C ATOM 173 NZ LYS A 12 -2.382 -1.772 7.880 1.00 2.23 N1+ ATOM 174 H LYS A 12 -1.358 -5.822 2.282 1.00 0.15 H ATOM 175 HA LYS A 12 -3.293 -5.438 4.381 1.00 0.21 H ATOM 176 HB2 LYS A 12 -0.927 -4.654 4.573 1.00 0.68 H ATOM 177 HB3 LYS A 12 -1.252 -3.476 3.307 1.00 0.68 H ATOM 178 HG2 LYS A 12 -2.817 -2.323 4.676 1.00 1.34 H ATOM 179 HG3 LYS A 12 -2.765 -3.591 5.900 1.00 1.16 H ATOM 180 HD2 LYS A 12 -0.484 -3.059 6.431 1.00 1.41 H ATOM 181 HD3 LYS A 12 -0.402 -1.905 5.102 1.00 1.66 H ATOM 182 HE2 LYS A 12 -0.685 -0.738 7.202 1.00 2.19 H ATOM 183 HE3 LYS A 12 -2.119 -0.539 6.199 1.00 2.31 H ATOM 184 HZ1 LYS A 12 -3.212 -2.261 7.493 1.00 2.62 H ATOM 185 HZ2 LYS A 12 -2.708 -0.994 8.485 1.00 2.55 H ATOM 186 HZ3 LYS A 12 -1.837 -2.440 8.459 1.00 2.63 H ATOM 187 N ARG A 13 -5.003 -3.983 3.363 1.00 0.13 N ATOM 188 CA ARG A 13 -6.122 -3.353 2.677 1.00 0.13 C ATOM 189 C ARG A 13 -6.362 -1.935 3.181 1.00 0.12 C ATOM 190 O ARG A 13 -6.196 -1.648 4.368 1.00 0.16 O ATOM 191 CB ARG A 13 -7.380 -4.200 2.857 1.00 0.18 C ATOM 192 CG ARG A 13 -7.293 -5.559 2.185 1.00 0.84 C ATOM 193 CD ARG A 13 -8.340 -6.513 2.732 1.00 0.77 C ATOM 194 NE ARG A 13 -8.087 -6.832 4.136 1.00 1.57 N ATOM 195 CZ ARG A 13 -9.004 -7.292 4.983 1.00 2.12 C ATOM 196 NH1 ARG A 13 -10.252 -7.491 4.580 1.00 1.97 N1+ ATOM 197 NH2 ARG A 13 -8.668 -7.548 6.239 1.00 3.21 N ATOM 198 H ARG A 13 -5.126 -4.300 4.284 1.00 0.18 H ATOM 199 HA ARG A 13 -5.879 -3.309 1.625 1.00 0.13 H ATOM 200 HB2 ARG A 13 -7.552 -4.353 3.912 1.00 0.71 H ATOM 201 HB3 ARG A 13 -8.221 -3.668 2.437 1.00 0.73 H ATOM 202 HG2 ARG A 13 -7.450 -5.435 1.124 1.00 1.32 H ATOM 203 HG3 ARG A 13 -6.312 -5.974 2.361 1.00 1.33 H ATOM 204 HD2 ARG A 13 -9.313 -6.050 2.645 1.00 0.97 H ATOM 205 HD3 ARG A 13 -8.321 -7.425 2.153 1.00 1.41 H ATOM 206 HE ARG A 13 -7.167 -6.694 4.469 1.00 2.13 H ATOM 207 HH11 ARG A 13 -10.938 -7.836 5.223 1.00 2.51 H ATOM 208 HH12 ARG A 13 -10.513 -7.294 3.633 1.00 1.72 H ATOM 209 HH21 ARG A 13 -7.725 -7.397 6.549 1.00 3.71 H ATOM 210 HH22 ARG A 13 -9.351 -7.896 6.886 1.00 3.66 H ATOM 211 N PHE A 14 -6.755 -1.060 2.264 1.00 0.11 N ATOM 212 CA PHE A 14 -6.984 0.346 2.572 1.00 0.12 C ATOM 213 C PHE A 14 -8.301 0.812 1.969 1.00 0.14 C ATOM 214 O PHE A 14 -8.836 0.179 1.054 1.00 0.23 O ATOM 215 CB PHE A 14 -5.853 1.210 2.005 1.00 0.15 C ATOM 216 CG PHE A 14 -4.491 0.801 2.465 1.00 0.14 C ATOM 217 CD1 PHE A 14 -3.921 1.394 3.574 1.00 0.22 C ATOM 218 CD2 PHE A 14 -3.782 -0.178 1.790 1.00 0.13 C ATOM 219 CE1 PHE A 14 -2.669 1.020 4.003 1.00 0.25 C ATOM 220 CE2 PHE A 14 -2.529 -0.556 2.214 1.00 0.13 C ATOM 221 CZ PHE A 14 -1.973 0.043 3.324 1.00 0.19 C ATOM 222 H PHE A 14 -6.901 -1.372 1.344 1.00 0.15 H ATOM 223 HA PHE A 14 -7.019 0.459 3.644 1.00 0.12 H ATOM 224 HB2 PHE A 14 -5.867 1.152 0.928 1.00 0.16 H ATOM 225 HB3 PHE A 14 -6.009 2.234 2.304 1.00 0.19 H ATOM 226 HD1 PHE A 14 -4.467 2.159 4.106 1.00 0.28 H ATOM 227 HD2 PHE A 14 -4.221 -0.648 0.921 1.00 0.17 H ATOM 228 HE1 PHE A 14 -2.233 1.490 4.870 1.00 0.34 H ATOM 229 HE2 PHE A 14 -1.982 -1.321 1.682 1.00 0.16 H ATOM 230 HZ PHE A 14 -0.991 -0.250 3.657 1.00 0.22 H ATOM 231 N THR A 15 -8.823 1.907 2.491 1.00 0.13 N ATOM 232 CA THR A 15 -9.987 2.556 1.919 1.00 0.16 C ATOM 233 C THR A 15 -9.576 3.837 1.206 1.00 0.14 C ATOM 234 O THR A 15 -10.381 4.489 0.542 1.00 0.28 O ATOM 235 CB THR A 15 -11.027 2.876 3.006 1.00 0.25 C ATOM 236 OG1 THR A 15 -10.359 3.209 4.233 1.00 1.03 O ATOM 237 CG2 THR A 15 -11.961 1.699 3.233 1.00 1.16 C ATOM 238 H THR A 15 -8.420 2.291 3.301 1.00 0.17 H ATOM 239 HA THR A 15 -10.432 1.880 1.203 1.00 0.21 H ATOM 240 HB THR A 15 -11.611 3.726 2.683 1.00 0.94 H ATOM 241 HG1 THR A 15 -10.465 4.151 4.412 1.00 1.65 H ATOM 242 HG21 THR A 15 -12.513 1.498 2.328 1.00 1.64 H ATOM 243 HG22 THR A 15 -12.649 1.934 4.031 1.00 1.79 H ATOM 244 HG23 THR A 15 -11.382 0.829 3.500 1.00 1.78 H ATOM 245 N ARG A 16 -8.309 4.189 1.360 1.00 0.12 N ATOM 246 CA ARG A 16 -7.757 5.377 0.739 1.00 0.14 C ATOM 247 C ARG A 16 -6.579 5.024 -0.159 1.00 0.12 C ATOM 248 O ARG A 16 -5.644 4.327 0.250 1.00 0.13 O ATOM 249 CB ARG A 16 -7.319 6.367 1.812 1.00 0.24 C ATOM 250 CG ARG A 16 -8.479 7.012 2.543 1.00 0.36 C ATOM 251 CD ARG A 16 -9.300 7.889 1.611 1.00 1.34 C ATOM 252 NE ARG A 16 -8.473 8.882 0.925 1.00 2.17 N ATOM 253 CZ ARG A 16 -8.959 9.882 0.196 1.00 3.16 C ATOM 254 NH1 ARG A 16 -10.269 10.026 0.047 1.00 3.58 N1+ ATOM 255 NH2 ARG A 16 -8.129 10.731 -0.391 1.00 4.11 N ATOM 256 H ARG A 16 -7.731 3.636 1.921 1.00 0.20 H ATOM 257 HA ARG A 16 -8.532 5.828 0.140 1.00 0.21 H ATOM 258 HB2 ARG A 16 -6.708 5.848 2.537 1.00 0.30 H ATOM 259 HB3 ARG A 16 -6.734 7.147 1.353 1.00 0.30 H ATOM 260 HG2 ARG A 16 -9.114 6.234 2.939 1.00 0.83 H ATOM 261 HG3 ARG A 16 -8.095 7.615 3.350 1.00 0.87 H ATOM 262 HD2 ARG A 16 -9.777 7.262 0.873 1.00 1.89 H ATOM 263 HD3 ARG A 16 -10.053 8.401 2.189 1.00 1.81 H ATOM 264 HE ARG A 16 -7.488 8.798 1.016 1.00 2.42 H ATOM 265 HH11 ARG A 16 -10.901 9.382 0.484 1.00 3.48 H ATOM 266 HH12 ARG A 16 -10.635 10.785 -0.499 1.00 4.31 H ATOM 267 HH21 ARG A 16 -7.138 10.618 -0.284 1.00 4.27 H ATOM 268 HH22 ARG A 16 -8.488 11.490 -0.939 1.00 4.85 H ATOM 269 N SER A 17 -6.635 5.518 -1.389 1.00 0.15 N ATOM 270 CA SER A 17 -5.596 5.263 -2.370 1.00 0.18 C ATOM 271 C SER A 17 -4.295 5.937 -1.967 1.00 0.15 C ATOM 272 O SER A 17 -3.212 5.423 -2.236 1.00 0.17 O ATOM 273 CB SER A 17 -6.052 5.756 -3.740 1.00 0.27 C ATOM 274 OG SER A 17 -6.625 7.051 -3.644 1.00 0.75 O ATOM 275 H SER A 17 -7.400 6.078 -1.645 1.00 0.18 H ATOM 276 HA SER A 17 -5.438 4.197 -2.415 1.00 0.21 H ATOM 277 HB2 SER A 17 -5.203 5.799 -4.408 1.00 0.72 H ATOM 278 HB3 SER A 17 -6.791 5.077 -4.139 1.00 0.59 H ATOM 279 HG SER A 17 -6.189 7.640 -4.275 1.00 1.36 H ATOM 280 N ASP A 18 -4.411 7.084 -1.307 1.00 0.14 N ATOM 281 CA ASP A 18 -3.243 7.806 -0.822 1.00 0.16 C ATOM 282 C ASP A 18 -2.555 7.012 0.281 1.00 0.11 C ATOM 283 O ASP A 18 -1.326 7.002 0.379 1.00 0.12 O ATOM 284 CB ASP A 18 -3.628 9.206 -0.321 1.00 0.25 C ATOM 285 CG ASP A 18 -4.567 9.182 0.870 1.00 1.21 C ATOM 286 OD1 ASP A 18 -5.783 8.974 0.674 1.00 1.91 O ATOM 287 OD2 ASP A 18 -4.092 9.381 2.008 1.00 1.79 O1- ATOM 288 H ASP A 18 -5.306 7.455 -1.149 1.00 0.15 H ATOM 289 HA ASP A 18 -2.555 7.908 -1.649 1.00 0.20 H ATOM 290 HB2 ASP A 18 -2.732 9.731 -0.029 1.00 0.97 H ATOM 291 HB3 ASP A 18 -4.108 9.745 -1.122 1.00 1.05 H ATOM 292 N GLU A 19 -3.357 6.335 1.098 1.00 0.10 N ATOM 293 CA GLU A 19 -2.829 5.440 2.118 1.00 0.10 C ATOM 294 C GLU A 19 -2.070 4.296 1.471 1.00 0.08 C ATOM 295 O GLU A 19 -0.958 3.978 1.881 1.00 0.10 O ATOM 296 CB GLU A 19 -3.946 4.880 3.000 1.00 0.16 C ATOM 297 CG GLU A 19 -4.427 5.839 4.071 1.00 0.63 C ATOM 298 CD GLU A 19 -3.356 6.150 5.101 1.00 0.72 C ATOM 299 OE1 GLU A 19 -2.668 7.184 4.961 1.00 0.94 O ATOM 300 OE2 GLU A 19 -3.194 5.363 6.057 1.00 1.38 O1- ATOM 301 H GLU A 19 -4.323 6.444 1.010 1.00 0.12 H ATOM 302 HA GLU A 19 -2.147 6.006 2.732 1.00 0.13 H ATOM 303 HB2 GLU A 19 -4.788 4.622 2.376 1.00 0.63 H ATOM 304 HB3 GLU A 19 -3.587 3.987 3.486 1.00 0.62 H ATOM 305 HG2 GLU A 19 -4.732 6.759 3.599 1.00 1.27 H ATOM 306 HG3 GLU A 19 -5.271 5.394 4.575 1.00 1.19 H ATOM 307 N LEU A 20 -2.678 3.687 0.458 1.00 0.07 N ATOM 308 CA LEU A 20 -2.044 2.600 -0.279 1.00 0.08 C ATOM 309 C LEU A 20 -0.733 3.055 -0.914 1.00 0.08 C ATOM 310 O LEU A 20 0.274 2.357 -0.834 1.00 0.09 O ATOM 311 CB LEU A 20 -2.987 2.066 -1.360 1.00 0.10 C ATOM 312 CG LEU A 20 -2.371 1.030 -2.306 1.00 0.10 C ATOM 313 CD1 LEU A 20 -1.984 -0.229 -1.547 1.00 0.13 C ATOM 314 CD2 LEU A 20 -3.329 0.697 -3.442 1.00 0.17 C ATOM 315 H LEU A 20 -3.587 3.970 0.208 1.00 0.08 H ATOM 316 HA LEU A 20 -1.829 1.808 0.422 1.00 0.10 H ATOM 317 HB2 LEU A 20 -3.841 1.617 -0.873 1.00 0.12 H ATOM 318 HB3 LEU A 20 -3.329 2.901 -1.950 1.00 0.11 H ATOM 319 HG LEU A 20 -1.470 1.445 -2.739 1.00 0.09 H ATOM 320 HD11 LEU A 20 -1.243 0.016 -0.801 1.00 0.84 H ATOM 321 HD12 LEU A 20 -1.576 -0.953 -2.235 1.00 0.94 H ATOM 322 HD13 LEU A 20 -2.857 -0.642 -1.066 1.00 0.89 H ATOM 323 HD21 LEU A 20 -3.621 1.606 -3.948 1.00 1.00 H ATOM 324 HD22 LEU A 20 -4.204 0.209 -3.043 1.00 1.07 H ATOM 325 HD23 LEU A 20 -2.839 0.039 -4.144 1.00 0.98 H ATOM 326 N GLN A 21 -0.750 4.224 -1.542 1.00 0.10 N ATOM 327 CA GLN A 21 0.443 4.760 -2.194 1.00 0.12 C ATOM 328 C GLN A 21 1.557 5.010 -1.183 1.00 0.09 C ATOM 329 O GLN A 21 2.694 4.554 -1.366 1.00 0.11 O ATOM 330 CB GLN A 21 0.113 6.051 -2.942 1.00 0.19 C ATOM 331 CG GLN A 21 -0.744 5.835 -4.177 1.00 1.06 C ATOM 332 CD GLN A 21 -1.109 7.132 -4.864 1.00 1.66 C ATOM 333 OE1 GLN A 21 -0.372 8.115 -4.798 1.00 2.34 O ATOM 334 NE2 GLN A 21 -2.248 7.144 -5.531 1.00 2.22 N ATOM 335 H GLN A 21 -1.589 4.738 -1.574 1.00 0.11 H ATOM 336 HA GLN A 21 0.785 4.024 -2.903 1.00 0.14 H ATOM 337 HB2 GLN A 21 -0.418 6.714 -2.274 1.00 0.71 H ATOM 338 HB3 GLN A 21 1.034 6.524 -3.246 1.00 0.89 H ATOM 339 HG2 GLN A 21 -0.200 5.217 -4.875 1.00 1.72 H ATOM 340 HG3 GLN A 21 -1.654 5.331 -3.885 1.00 1.75 H ATOM 341 HE21 GLN A 21 -2.787 6.323 -5.542 1.00 2.35 H ATOM 342 HE22 GLN A 21 -2.507 7.968 -5.994 1.00 2.82 H ATOM 343 N ARG A 22 1.226 5.717 -0.108 1.00 0.11 N ATOM 344 CA ARG A 22 2.191 5.983 0.948 1.00 0.15 C ATOM 345 C ARG A 22 2.708 4.671 1.519 1.00 0.11 C ATOM 346 O ARG A 22 3.905 4.509 1.753 1.00 0.15 O ATOM 347 CB ARG A 22 1.565 6.836 2.052 1.00 0.25 C ATOM 348 CG ARG A 22 2.522 7.141 3.193 1.00 0.37 C ATOM 349 CD ARG A 22 1.887 8.048 4.233 1.00 0.51 C ATOM 350 NE ARG A 22 0.758 7.416 4.914 1.00 1.09 N ATOM 351 CZ ARG A 22 0.591 7.425 6.236 1.00 1.51 C ATOM 352 NH1 ARG A 22 1.516 7.961 7.026 1.00 1.42 N1+ ATOM 353 NH2 ARG A 22 -0.497 6.885 6.769 1.00 2.47 N ATOM 354 H ARG A 22 0.311 6.065 -0.023 1.00 0.13 H ATOM 355 HA ARG A 22 3.015 6.521 0.511 1.00 0.19 H ATOM 356 HB2 ARG A 22 1.238 7.771 1.624 1.00 0.29 H ATOM 357 HB3 ARG A 22 0.709 6.315 2.455 1.00 0.25 H ATOM 358 HG2 ARG A 22 2.806 6.214 3.669 1.00 0.34 H ATOM 359 HG3 ARG A 22 3.401 7.625 2.794 1.00 0.44 H ATOM 360 HD2 ARG A 22 2.634 8.312 4.964 1.00 1.09 H ATOM 361 HD3 ARG A 22 1.538 8.944 3.741 1.00 1.23 H ATOM 362 HE ARG A 22 0.077 6.979 4.354 1.00 1.66 H ATOM 363 HH11 ARG A 22 1.388 7.966 8.021 1.00 1.85 H ATOM 364 HH12 ARG A 22 2.348 8.359 6.634 1.00 1.43 H ATOM 365 HH21 ARG A 22 -0.628 6.888 7.765 1.00 2.80 H ATOM 366 HH22 ARG A 22 -1.205 6.482 6.176 1.00 2.99 H ATOM 367 N HIS A 23 1.796 3.730 1.703 1.00 0.10 N ATOM 368 CA HIS A 23 2.137 2.410 2.197 1.00 0.10 C ATOM 369 C HIS A 23 3.139 1.727 1.265 1.00 0.11 C ATOM 370 O HIS A 23 4.128 1.162 1.719 1.00 0.17 O ATOM 371 CB HIS A 23 0.870 1.558 2.342 1.00 0.12 C ATOM 372 CG HIS A 23 1.151 0.107 2.542 1.00 0.12 C ATOM 373 ND1 HIS A 23 1.245 -0.521 3.780 1.00 0.17 N ATOM 374 CD2 HIS A 23 1.433 -0.834 1.617 1.00 0.12 C ATOM 375 CE1 HIS A 23 1.598 -1.801 3.557 1.00 0.19 C ATOM 376 NE2 HIS A 23 1.718 -2.000 2.271 1.00 0.15 N ATOM 377 H HIS A 23 0.857 3.928 1.494 1.00 0.14 H ATOM 378 HA HIS A 23 2.593 2.528 3.168 1.00 0.13 H ATOM 379 HB2 HIS A 23 0.300 1.907 3.188 1.00 0.14 H ATOM 380 HB3 HIS A 23 0.276 1.660 1.446 1.00 0.12 H ATOM 381 HD1 HIS A 23 1.081 -0.104 4.659 1.00 0.21 H ATOM 382 HD2 HIS A 23 1.413 -0.705 0.547 1.00 0.12 H ATOM 383 HE1 HIS A 23 1.747 -2.548 4.319 1.00 0.24 H ATOM 384 N LYS A 24 2.874 1.787 -0.035 1.00 0.10 N ATOM 385 CA LYS A 24 3.758 1.184 -1.032 1.00 0.14 C ATOM 386 C LYS A 24 5.171 1.743 -0.919 1.00 0.15 C ATOM 387 O LYS A 24 6.153 1.059 -1.234 1.00 0.17 O ATOM 388 CB LYS A 24 3.223 1.420 -2.445 1.00 0.22 C ATOM 389 CG LYS A 24 2.015 0.571 -2.808 1.00 0.28 C ATOM 390 CD LYS A 24 1.431 0.999 -4.145 1.00 1.08 C ATOM 391 CE LYS A 24 0.402 0.005 -4.658 1.00 1.23 C ATOM 392 NZ LYS A 24 1.029 -1.259 -5.123 1.00 1.43 N1+ ATOM 393 H LYS A 24 2.055 2.245 -0.335 1.00 0.09 H ATOM 394 HA LYS A 24 3.792 0.123 -0.841 1.00 0.17 H ATOM 395 HB2 LYS A 24 2.946 2.458 -2.540 1.00 0.23 H ATOM 396 HB3 LYS A 24 4.011 1.203 -3.150 1.00 0.26 H ATOM 397 HG2 LYS A 24 2.315 -0.464 -2.870 1.00 0.94 H ATOM 398 HG3 LYS A 24 1.262 0.687 -2.044 1.00 0.90 H ATOM 399 HD2 LYS A 24 0.957 1.960 -4.027 1.00 1.64 H ATOM 400 HD3 LYS A 24 2.232 1.078 -4.865 1.00 1.77 H ATOM 401 HE2 LYS A 24 -0.291 -0.219 -3.862 1.00 1.51 H ATOM 402 HE3 LYS A 24 -0.132 0.455 -5.481 1.00 1.51 H ATOM 403 HZ1 LYS A 24 0.295 -1.956 -5.362 1.00 2.01 H ATOM 404 HZ2 LYS A 24 1.641 -1.655 -4.383 1.00 1.71 H ATOM 405 HZ3 LYS A 24 1.606 -1.078 -5.970 1.00 1.73 H ATOM 406 N ARG A 25 5.274 2.979 -0.443 1.00 0.17 N ATOM 407 CA ARG A 25 6.570 3.622 -0.278 1.00 0.22 C ATOM 408 C ARG A 25 7.410 2.913 0.785 1.00 0.25 C ATOM 409 O ARG A 25 8.620 3.113 0.853 1.00 0.39 O ATOM 410 CB ARG A 25 6.398 5.098 0.083 1.00 0.33 C ATOM 411 CG ARG A 25 5.619 5.887 -0.955 1.00 0.46 C ATOM 412 CD ARG A 25 5.459 7.342 -0.552 1.00 0.63 C ATOM 413 NE ARG A 25 4.554 8.052 -1.454 1.00 1.40 N ATOM 414 CZ ARG A 25 3.851 9.135 -1.120 1.00 2.00 C ATOM 415 NH1 ARG A 25 3.971 9.667 0.088 1.00 1.85 N1+ ATOM 416 NH2 ARG A 25 3.037 9.691 -2.005 1.00 2.90 N ATOM 417 H ARG A 25 4.453 3.475 -0.198 1.00 0.16 H ATOM 418 HA ARG A 25 7.085 3.554 -1.223 1.00 0.26 H ATOM 419 HB2 ARG A 25 5.874 5.165 1.025 1.00 0.40 H ATOM 420 HB3 ARG A 25 7.373 5.547 0.189 1.00 0.34 H ATOM 421 HG2 ARG A 25 6.145 5.839 -1.895 1.00 0.50 H ATOM 422 HG3 ARG A 25 4.640 5.445 -1.067 1.00 0.50 H ATOM 423 HD2 ARG A 25 5.066 7.388 0.451 1.00 0.84 H ATOM 424 HD3 ARG A 25 6.427 7.820 -0.580 1.00 1.09 H ATOM 425 HE ARG A 25 4.456 7.689 -2.364 1.00 1.71 H ATOM 426 HH11 ARG A 25 3.437 10.483 0.334 1.00 2.34 H ATOM 427 HH12 ARG A 25 4.602 9.268 0.757 1.00 1.42 H ATOM 428 HH21 ARG A 25 2.946 9.298 -2.927 1.00 3.18 H ATOM 429 HH22 ARG A 25 2.503 10.503 -1.756 1.00 3.37 H ATOM 430 N THR A 26 6.775 2.077 1.606 1.00 0.25 N ATOM 431 CA THR A 26 7.500 1.333 2.632 1.00 0.32 C ATOM 432 C THR A 26 8.076 0.037 2.065 1.00 0.33 C ATOM 433 O THR A 26 8.859 -0.646 2.724 1.00 0.47 O ATOM 434 CB THR A 26 6.624 1.004 3.864 1.00 0.41 C ATOM 435 OG1 THR A 26 5.588 0.074 3.516 1.00 0.83 O ATOM 436 CG2 THR A 26 6.005 2.267 4.441 1.00 0.59 C ATOM 437 H THR A 26 5.802 1.964 1.523 1.00 0.26 H ATOM 438 HA THR A 26 8.320 1.954 2.961 1.00 0.36 H ATOM 439 HB THR A 26 7.253 0.557 4.618 1.00 0.80 H ATOM 440 HG1 THR A 26 5.006 0.475 2.852 1.00 0.87 H ATOM 441 HG21 THR A 26 5.353 2.717 3.706 1.00 1.25 H ATOM 442 HG22 THR A 26 6.787 2.964 4.701 1.00 1.23 H ATOM 443 HG23 THR A 26 5.435 2.018 5.324 1.00 1.11 H ATOM 444 N HIS A 27 7.667 -0.310 0.848 1.00 0.28 N ATOM 445 CA HIS A 27 8.252 -1.447 0.145 1.00 0.30 C ATOM 446 C HIS A 27 9.322 -0.956 -0.816 1.00 0.34 C ATOM 447 O HIS A 27 10.427 -1.495 -0.873 1.00 0.38 O ATOM 448 CB HIS A 27 7.205 -2.226 -0.656 1.00 0.30 C ATOM 449 CG HIS A 27 6.135 -2.893 0.150 1.00 0.27 C ATOM 450 ND1 HIS A 27 6.348 -3.950 1.032 1.00 0.36 N ATOM 451 CD2 HIS A 27 4.801 -2.670 0.149 1.00 0.21 C ATOM 452 CE1 HIS A 27 5.149 -4.327 1.518 1.00 0.34 C ATOM 453 NE2 HIS A 27 4.214 -3.574 1.003 1.00 0.24 N ATOM 454 H HIS A 27 6.957 0.210 0.411 1.00 0.30 H ATOM 455 HA HIS A 27 8.705 -2.100 0.876 1.00 0.32 H ATOM 456 HB2 HIS A 27 6.715 -1.547 -1.337 1.00 0.29 H ATOM 457 HB3 HIS A 27 7.707 -2.994 -1.230 1.00 0.36 H ATOM 458 HD1 HIS A 27 7.217 -4.355 1.254 1.00 0.43 H ATOM 459 HD2 HIS A 27 4.278 -1.925 -0.432 1.00 0.20 H ATOM 460 HE1 HIS A 27 4.983 -5.136 2.213 1.00 0.42 H ATOM 461 N THR A 28 8.979 0.073 -1.574 1.00 0.39 N ATOM 462 CA THR A 28 9.868 0.608 -2.587 1.00 0.51 C ATOM 463 C THR A 28 11.001 1.427 -1.972 1.00 1.07 C ATOM 464 O THR A 28 12.132 1.394 -2.453 1.00 1.59 O ATOM 465 CB THR A 28 9.081 1.472 -3.587 1.00 1.07 C ATOM 466 OG1 THR A 28 8.237 2.387 -2.874 1.00 1.78 O ATOM 467 CG2 THR A 28 8.233 0.603 -4.507 1.00 0.82 C ATOM 468 H THR A 28 8.094 0.484 -1.457 1.00 0.38 H ATOM 469 HA THR A 28 10.295 -0.225 -3.126 1.00 0.60 H ATOM 470 HB THR A 28 9.782 2.033 -4.187 1.00 1.63 H ATOM 471 HG1 THR A 28 7.312 2.219 -3.106 1.00 2.28 H ATOM 472 HG21 THR A 28 7.689 1.233 -5.194 1.00 1.19 H ATOM 473 HG22 THR A 28 7.534 0.029 -3.917 1.00 1.47 H ATOM 474 HG23 THR A 28 8.872 -0.068 -5.062 1.00 1.14 H ATOM 475 N GLY A 29 10.697 2.152 -0.903 1.00 1.75 N ATOM 476 CA GLY A 29 11.694 2.995 -0.276 1.00 2.45 C ATOM 477 C GLY A 29 11.851 2.703 1.202 1.00 3.23 C ATOM 478 O GLY A 29 11.393 3.474 2.048 1.00 3.94 O ATOM 479 H GLY A 29 9.788 2.115 -0.533 1.00 2.06 H ATOM 480 HA2 GLY A 29 12.642 2.839 -0.768 1.00 2.79 H ATOM 481 HA3 GLY A 29 11.403 4.028 -0.398 1.00 2.66 H ATOM 482 N GLU A 30 12.495 1.588 1.515 1.00 3.65 N ATOM 483 CA GLU A 30 12.750 1.220 2.902 1.00 4.77 C ATOM 484 C GLU A 30 13.943 2.001 3.429 1.00 5.13 C ATOM 485 O GLU A 30 13.874 2.643 4.479 1.00 5.68 O ATOM 486 CB GLU A 30 13.020 -0.282 3.027 1.00 5.63 C ATOM 487 CG GLU A 30 11.858 -1.157 2.591 1.00 6.09 C ATOM 488 CD GLU A 30 12.175 -2.632 2.696 1.00 6.97 C ATOM 489 OE1 GLU A 30 12.650 -3.214 1.702 1.00 7.32 O ATOM 490 OE2 GLU A 30 11.954 -3.215 3.775 1.00 7.52 O1- ATOM 491 H GLU A 30 12.818 1.005 0.796 1.00 3.53 H ATOM 492 HA GLU A 30 11.877 1.476 3.484 1.00 5.14 H ATOM 493 HB2 GLU A 30 13.879 -0.535 2.424 1.00 5.73 H ATOM 494 HB3 GLU A 30 13.241 -0.507 4.059 1.00 6.23 H ATOM 495 HG2 GLU A 30 11.007 -0.942 3.218 1.00 6.31 H ATOM 496 HG3 GLU A 30 11.614 -0.928 1.565 1.00 5.97 H ATOM 497 N LYS A 31 15.035 1.945 2.684 1.00 5.24 N ATOM 498 CA LYS A 31 16.241 2.666 3.036 1.00 5.99 C ATOM 499 C LYS A 31 17.022 2.998 1.774 1.00 6.17 C ATOM 500 O LYS A 31 17.889 2.237 1.342 1.00 6.59 O ATOM 501 CB LYS A 31 17.105 1.839 3.991 1.00 6.33 C ATOM 502 CG LYS A 31 18.237 2.631 4.625 1.00 6.99 C ATOM 503 CD LYS A 31 19.145 1.741 5.452 1.00 7.69 C ATOM 504 CE LYS A 31 20.186 2.554 6.206 1.00 8.59 C ATOM 505 NZ LYS A 31 20.986 3.422 5.304 1.00 8.93 N1+ ATOM 506 H LYS A 31 15.028 1.399 1.866 1.00 5.09 H ATOM 507 HA LYS A 31 15.953 3.586 3.524 1.00 6.56 H ATOM 508 HB2 LYS A 31 16.478 1.450 4.780 1.00 6.29 H ATOM 509 HB3 LYS A 31 17.533 1.013 3.444 1.00 6.50 H ATOM 510 HG2 LYS A 31 18.820 3.094 3.843 1.00 7.20 H ATOM 511 HG3 LYS A 31 17.817 3.394 5.263 1.00 7.03 H ATOM 512 HD2 LYS A 31 18.546 1.195 6.163 1.00 7.74 H ATOM 513 HD3 LYS A 31 19.650 1.047 4.796 1.00 7.76 H ATOM 514 HE2 LYS A 31 19.681 3.176 6.930 1.00 8.72 H ATOM 515 HE3 LYS A 31 20.850 1.876 6.719 1.00 9.11 H ATOM 516 HZ1 LYS A 31 21.727 3.913 5.847 1.00 9.20 H ATOM 517 HZ2 LYS A 31 20.376 4.135 4.857 1.00 8.97 H ATOM 518 HZ3 LYS A 31 21.436 2.854 4.563 1.00 9.13 H HETATM 519 N NH2 A 32 16.693 4.121 1.165 1.00 6.25 N HETATM 520 HN1 NH2 A 32 15.991 4.679 1.570 1.00 6.15 H HETATM 521 HN2 NH2 A 32 17.161 4.355 0.337 1.00 6.63 H TER 522 NH2 A 32 HETATM 523 ZN ZN A 101 2.257 -3.683 1.366 1.00 0.19 ZN