ATOM 1 N ARG A 1 13.212 -0.480 4.334 1.00 1.54 N ATOM 2 CA ARG A 1 11.978 -1.109 4.849 1.00 1.34 C ATOM 3 C ARG A 1 11.103 -1.585 3.699 1.00 1.09 C ATOM 4 O ARG A 1 10.436 -0.786 3.047 1.00 1.12 O ATOM 5 CB ARG A 1 11.208 -0.119 5.730 1.00 1.63 C ATOM 6 CG ARG A 1 11.923 0.200 7.030 1.00 1.96 C ATOM 7 CD ARG A 1 11.197 1.263 7.839 1.00 2.20 C ATOM 8 NE ARG A 1 11.855 1.495 9.123 1.00 2.98 N ATOM 9 CZ ARG A 1 11.868 2.664 9.764 1.00 3.58 C ATOM 10 NH1 ARG A 1 11.253 3.723 9.248 1.00 3.70 N1+ ATOM 11 NH2 ARG A 1 12.497 2.774 10.926 1.00 4.45 N ATOM 12 H1 ARG A 1 12.975 0.348 3.754 1.00 1.71 H ATOM 13 H2 ARG A 1 13.736 -1.158 3.747 1.00 1.93 H ATOM 14 H3 ARG A 1 13.820 -0.183 5.121 1.00 1.99 H ATOM 15 HA ARG A 1 12.259 -1.963 5.446 1.00 1.38 H ATOM 16 HB2 ARG A 1 11.067 0.800 5.183 1.00 2.01 H ATOM 17 HB3 ARG A 1 10.243 -0.541 5.968 1.00 2.09 H ATOM 18 HG2 ARG A 1 11.990 -0.701 7.620 1.00 2.29 H ATOM 19 HG3 ARG A 1 12.919 0.554 6.803 1.00 2.52 H ATOM 20 HD2 ARG A 1 11.187 2.185 7.276 1.00 2.77 H ATOM 21 HD3 ARG A 1 10.182 0.937 8.017 1.00 1.89 H ATOM 22 HE ARG A 1 12.319 0.725 9.532 1.00 3.39 H ATOM 23 HH11 ARG A 1 10.773 3.652 8.369 1.00 3.42 H ATOM 24 HH12 ARG A 1 11.267 4.600 9.734 1.00 4.36 H ATOM 25 HH21 ARG A 1 12.509 3.653 11.412 1.00 4.96 H ATOM 26 HH22 ARG A 1 12.960 1.979 11.326 1.00 4.79 H ATOM 27 N PRO A 2 11.128 -2.894 3.411 1.00 0.92 N ATOM 28 CA PRO A 2 10.278 -3.495 2.382 1.00 0.80 C ATOM 29 C PRO A 2 8.800 -3.394 2.754 1.00 0.68 C ATOM 30 O PRO A 2 8.313 -4.140 3.606 1.00 1.00 O ATOM 31 CB PRO A 2 10.720 -4.966 2.344 1.00 0.93 C ATOM 32 CG PRO A 2 12.037 -4.998 3.038 1.00 0.95 C ATOM 33 CD PRO A 2 11.991 -3.895 4.056 1.00 0.99 C ATOM 34 HA PRO A 2 10.439 -3.038 1.416 1.00 0.86 H ATOM 35 HB2 PRO A 2 9.989 -5.574 2.858 1.00 1.03 H ATOM 36 HB3 PRO A 2 10.809 -5.291 1.317 1.00 1.16 H ATOM 37 HG2 PRO A 2 12.175 -5.953 3.522 1.00 1.14 H ATOM 38 HG3 PRO A 2 12.829 -4.819 2.327 1.00 1.10 H ATOM 39 HD2 PRO A 2 11.552 -4.247 4.980 1.00 1.15 H ATOM 40 HD3 PRO A 2 12.981 -3.498 4.229 1.00 1.05 H ATOM 41 N PHE A 3 8.097 -2.464 2.126 1.00 0.35 N ATOM 42 CA PHE A 3 6.688 -2.258 2.413 1.00 0.28 C ATOM 43 C PHE A 3 5.839 -3.205 1.584 1.00 0.33 C ATOM 44 O PHE A 3 6.205 -3.559 0.461 1.00 0.66 O ATOM 45 CB PHE A 3 6.288 -0.811 2.132 1.00 0.20 C ATOM 46 CG PHE A 3 6.945 0.180 3.043 1.00 0.17 C ATOM 47 CD1 PHE A 3 7.946 1.006 2.570 1.00 0.20 C ATOM 48 CD2 PHE A 3 6.563 0.284 4.370 1.00 0.23 C ATOM 49 CE1 PHE A 3 8.558 1.921 3.402 1.00 0.23 C ATOM 50 CE2 PHE A 3 7.171 1.199 5.208 1.00 0.28 C ATOM 51 CZ PHE A 3 8.155 2.014 4.738 1.00 0.27 C ATOM 52 H PHE A 3 8.534 -1.906 1.442 1.00 0.43 H ATOM 53 HA PHE A 3 6.526 -2.469 3.457 1.00 0.34 H ATOM 54 HB2 PHE A 3 6.561 -0.561 1.121 1.00 0.21 H ATOM 55 HB3 PHE A 3 5.221 -0.712 2.248 1.00 0.27 H ATOM 56 HD1 PHE A 3 8.250 0.933 1.538 1.00 0.25 H ATOM 57 HD2 PHE A 3 5.782 -0.358 4.750 1.00 0.29 H ATOM 58 HE1 PHE A 3 9.341 2.559 3.019 1.00 0.30 H ATOM 59 HE2 PHE A 3 6.867 1.270 6.242 1.00 0.37 H ATOM 60 HZ PHE A 3 8.623 2.725 5.399 1.00 0.34 H HETATM 61 N NLE A 4 4.713 -3.622 2.138 1.00 0.15 N HETATM 62 CA NLE A 4 3.836 -4.552 1.458 1.00 0.16 C HETATM 63 C NLE A 4 2.393 -4.366 1.910 1.00 0.17 C HETATM 64 O NLE A 4 2.114 -4.225 3.103 1.00 0.23 O HETATM 65 CB NLE A 4 4.294 -5.984 1.731 1.00 0.23 C HETATM 66 CG NLE A 4 3.490 -7.042 0.997 1.00 0.30 C HETATM 67 CD NLE A 4 3.999 -8.436 1.313 1.00 0.42 C HETATM 68 CE NLE A 4 3.156 -9.471 0.604 1.00 0.52 C HETATM 69 H NLE A 4 4.470 -3.307 3.033 1.00 0.31 H HETATM 70 HA NLE A 4 3.901 -4.357 0.401 1.00 0.18 H HETATM 71 HB2 NLE A 4 4.214 -6.173 2.789 1.00 0.26 H HETATM 72 HB3 NLE A 4 5.328 -6.079 1.438 1.00 0.25 H HETATM 73 HG2 NLE A 4 3.570 -6.871 -0.067 1.00 0.32 H HETATM 74 HG3 NLE A 4 2.456 -6.970 1.300 1.00 0.30 H HETATM 75 HD2 NLE A 4 3.941 -8.609 2.378 1.00 0.44 H HETATM 76 HD3 NLE A 4 5.022 -8.531 0.977 1.00 0.45 H HETATM 77 HE1 NLE A 4 3.542 -10.457 0.816 1.00 1.23 H HETATM 78 HE2 NLE A 4 3.190 -9.292 -0.461 1.00 1.06 H HETATM 79 HE3 NLE A 4 2.136 -9.402 0.949 1.00 1.10 H ATOM 80 N CYS A 5 1.488 -4.338 0.945 1.00 0.16 N ATOM 81 CA CYS A 5 0.069 -4.311 1.226 1.00 0.19 C ATOM 82 C CYS A 5 -0.380 -5.680 1.721 1.00 0.26 C ATOM 83 O CYS A 5 0.017 -6.709 1.173 1.00 0.38 O ATOM 84 CB CYS A 5 -0.710 -3.895 -0.025 1.00 0.25 C ATOM 85 SG CYS A 5 -2.494 -4.148 0.088 1.00 0.26 S ATOM 86 H CYS A 5 1.790 -4.346 0.011 1.00 0.19 H ATOM 87 HA CYS A 5 -0.101 -3.586 2.003 1.00 0.24 H ATOM 88 HB2 CYS A 5 -0.547 -2.842 -0.200 1.00 0.33 H ATOM 89 HB3 CYS A 5 -0.348 -4.455 -0.871 1.00 0.32 H ATOM 90 N THR A 6 -1.181 -5.692 2.772 1.00 0.37 N ATOM 91 CA THR A 6 -1.613 -6.936 3.378 1.00 0.52 C ATOM 92 C THR A 6 -3.128 -7.089 3.318 1.00 0.45 C ATOM 93 O THR A 6 -3.729 -7.775 4.146 1.00 0.57 O ATOM 94 CB THR A 6 -1.132 -7.022 4.838 1.00 0.76 C ATOM 95 OG1 THR A 6 -1.401 -5.784 5.519 1.00 1.70 O ATOM 96 CG2 THR A 6 0.356 -7.323 4.895 1.00 1.00 C ATOM 97 H THR A 6 -1.487 -4.843 3.152 1.00 0.43 H ATOM 98 HA THR A 6 -1.160 -7.747 2.828 1.00 0.61 H ATOM 99 HB THR A 6 -1.666 -7.821 5.333 1.00 1.24 H ATOM 100 HG1 THR A 6 -2.348 -5.592 5.473 1.00 2.12 H ATOM 101 HG21 THR A 6 0.673 -7.382 5.925 1.00 1.62 H ATOM 102 HG22 THR A 6 0.900 -6.535 4.395 1.00 1.60 H ATOM 103 HG23 THR A 6 0.552 -8.264 4.402 1.00 1.48 H ATOM 104 N TRP A 7 -3.743 -6.445 2.339 1.00 0.34 N ATOM 105 CA TRP A 7 -5.179 -6.536 2.162 1.00 0.42 C ATOM 106 C TRP A 7 -5.517 -7.734 1.285 1.00 0.51 C ATOM 107 O TRP A 7 -4.988 -7.866 0.181 1.00 0.54 O ATOM 108 CB TRP A 7 -5.721 -5.254 1.531 1.00 0.47 C ATOM 109 CG TRP A 7 -7.219 -5.176 1.534 1.00 0.68 C ATOM 110 CD1 TRP A 7 -7.998 -4.540 2.456 1.00 0.82 C ATOM 111 CD2 TRP A 7 -8.120 -5.757 0.582 1.00 0.83 C ATOM 112 NE1 TRP A 7 -9.323 -4.682 2.133 1.00 1.02 N ATOM 113 CE2 TRP A 7 -9.425 -5.425 0.988 1.00 1.02 C ATOM 114 CE3 TRP A 7 -7.951 -6.522 -0.577 1.00 0.90 C ATOM 115 CZ2 TRP A 7 -10.552 -5.833 0.280 1.00 1.23 C ATOM 116 CZ3 TRP A 7 -9.069 -6.926 -1.276 1.00 1.12 C ATOM 117 CH2 TRP A 7 -10.354 -6.579 -0.848 1.00 1.26 C ATOM 118 H TRP A 7 -3.217 -5.898 1.716 1.00 0.30 H ATOM 119 HA TRP A 7 -5.629 -6.671 3.133 1.00 0.47 H ATOM 120 HB2 TRP A 7 -5.339 -4.404 2.077 1.00 0.45 H ATOM 121 HB3 TRP A 7 -5.385 -5.195 0.505 1.00 0.45 H ATOM 122 HD1 TRP A 7 -7.614 -4.004 3.309 1.00 0.83 H ATOM 123 HE1 TRP A 7 -10.074 -4.311 2.643 1.00 1.16 H ATOM 124 HE3 TRP A 7 -6.965 -6.801 -0.923 1.00 0.81 H ATOM 125 HZ2 TRP A 7 -11.552 -5.573 0.596 1.00 1.38 H ATOM 126 HZ3 TRP A 7 -8.959 -7.520 -2.170 1.00 1.21 H ATOM 127 HH2 TRP A 7 -11.198 -6.921 -1.428 1.00 1.43 H HETATM 128 N DPR A 8 -6.402 -8.624 1.764 1.00 0.61 N HETATM 129 CA DPR A 8 -6.815 -9.818 1.018 1.00 0.73 C HETATM 130 CB DPR A 8 -7.623 -10.615 2.038 1.00 0.85 C HETATM 131 CG DPR A 8 -8.140 -9.591 2.987 1.00 0.81 C HETATM 132 CD DPR A 8 -7.078 -8.530 3.069 1.00 0.64 C HETATM 133 C DPR A 8 -5.616 -10.624 0.516 1.00 0.75 C HETATM 134 O DPR A 8 -4.742 -11.015 1.296 1.00 0.81 O HETATM 135 HA DPR A 8 -7.451 -9.561 0.185 1.00 0.76 H HETATM 136 HB2 DPR A 8 -8.426 -11.138 1.539 1.00 0.98 H HETATM 137 HB3 DPR A 8 -6.978 -11.324 2.537 1.00 0.87 H HETATM 138 HG2 DPR A 8 -9.061 -9.172 2.606 1.00 0.89 H HETATM 139 HG3 DPR A 8 -8.302 -10.037 3.958 1.00 0.85 H HETATM 140 HD2 DPR A 8 -7.526 -7.554 3.202 1.00 0.67 H HETATM 141 HD3 DPR A 8 -6.393 -8.745 3.874 1.00 0.58 H ATOM 142 N GLY A 9 -5.582 -10.864 -0.787 1.00 0.77 N ATOM 143 CA GLY A 9 -4.444 -11.518 -1.397 1.00 0.83 C ATOM 144 C GLY A 9 -3.625 -10.543 -2.212 1.00 0.70 C ATOM 145 O GLY A 9 -2.765 -10.936 -2.996 1.00 0.78 O ATOM 146 H GLY A 9 -6.348 -10.603 -1.343 1.00 0.78 H ATOM 147 HA2 GLY A 9 -3.822 -11.940 -0.621 1.00 0.89 H ATOM 148 HA3 GLY A 9 -4.793 -12.311 -2.043 1.00 0.94 H ATOM 149 N CYS A 10 -3.903 -9.262 -2.015 1.00 0.55 N ATOM 150 CA CYS A 10 -3.208 -8.199 -2.721 1.00 0.44 C ATOM 151 C CYS A 10 -1.797 -8.035 -2.160 1.00 0.48 C ATOM 152 O CYS A 10 -1.603 -7.405 -1.122 1.00 0.94 O ATOM 153 CB CYS A 10 -4.006 -6.899 -2.584 1.00 0.34 C ATOM 154 SG CYS A 10 -3.255 -5.456 -3.365 1.00 0.33 S ATOM 155 H CYS A 10 -4.591 -9.019 -1.356 1.00 0.55 H ATOM 156 HA CYS A 10 -3.147 -8.471 -3.762 1.00 0.47 H ATOM 157 HB2 CYS A 10 -4.979 -7.039 -3.029 1.00 0.37 H ATOM 158 HB3 CYS A 10 -4.131 -6.675 -1.534 1.00 0.34 H ATOM 159 N GLY A 11 -0.819 -8.621 -2.841 1.00 0.40 N ATOM 160 CA GLY A 11 0.548 -8.591 -2.360 1.00 0.34 C ATOM 161 C GLY A 11 1.388 -7.538 -3.049 1.00 0.30 C ATOM 162 O GLY A 11 2.517 -7.807 -3.467 1.00 0.43 O ATOM 163 H GLY A 11 -1.027 -9.080 -3.682 1.00 0.73 H ATOM 164 HA2 GLY A 11 0.539 -8.390 -1.300 1.00 0.31 H ATOM 165 HA3 GLY A 11 0.995 -9.559 -2.527 1.00 0.41 H ATOM 166 N LYS A 12 0.837 -6.341 -3.172 1.00 0.25 N ATOM 167 CA LYS A 12 1.552 -5.231 -3.785 1.00 0.25 C ATOM 168 C LYS A 12 2.653 -4.736 -2.850 1.00 0.19 C ATOM 169 O LYS A 12 2.402 -4.450 -1.680 1.00 0.20 O ATOM 170 CB LYS A 12 0.583 -4.093 -4.116 1.00 0.32 C ATOM 171 CG LYS A 12 1.215 -2.969 -4.923 1.00 0.37 C ATOM 172 CD LYS A 12 1.605 -3.423 -6.319 1.00 0.63 C ATOM 173 CE LYS A 12 2.318 -2.320 -7.088 1.00 0.95 C ATOM 174 NZ LYS A 12 3.585 -1.902 -6.423 1.00 1.57 N1+ ATOM 175 H LYS A 12 -0.073 -6.202 -2.842 1.00 0.32 H ATOM 176 HA LYS A 12 2.005 -5.588 -4.696 1.00 0.31 H ATOM 177 HB2 LYS A 12 -0.244 -4.492 -4.683 1.00 0.44 H ATOM 178 HB3 LYS A 12 0.207 -3.677 -3.193 1.00 0.32 H ATOM 179 HG2 LYS A 12 0.507 -2.157 -5.006 1.00 0.85 H ATOM 180 HG3 LYS A 12 2.098 -2.627 -4.405 1.00 0.78 H ATOM 181 HD2 LYS A 12 2.261 -4.276 -6.240 1.00 1.25 H ATOM 182 HD3 LYS A 12 0.710 -3.704 -6.857 1.00 1.28 H ATOM 183 HE2 LYS A 12 2.547 -2.680 -8.080 1.00 1.66 H ATOM 184 HE3 LYS A 12 1.660 -1.467 -7.160 1.00 1.47 H ATOM 185 HZ1 LYS A 12 4.078 -1.194 -7.006 1.00 2.26 H ATOM 186 HZ2 LYS A 12 4.213 -2.720 -6.294 1.00 1.93 H ATOM 187 HZ3 LYS A 12 3.384 -1.486 -5.495 1.00 1.96 H ATOM 188 N ARG A 13 3.867 -4.646 -3.368 1.00 0.19 N ATOM 189 CA ARG A 13 5.016 -4.231 -2.574 1.00 0.17 C ATOM 190 C ARG A 13 5.408 -2.795 -2.888 1.00 0.14 C ATOM 191 O ARG A 13 5.156 -2.302 -3.990 1.00 0.22 O ATOM 192 CB ARG A 13 6.192 -5.173 -2.824 1.00 0.25 C ATOM 193 CG ARG A 13 5.959 -6.573 -2.286 1.00 0.35 C ATOM 194 CD ARG A 13 7.035 -7.538 -2.756 1.00 0.46 C ATOM 195 NE ARG A 13 8.369 -7.135 -2.325 1.00 1.40 N ATOM 196 CZ ARG A 13 9.421 -7.949 -2.319 1.00 1.98 C ATOM 197 NH1 ARG A 13 9.286 -9.217 -2.694 1.00 1.93 N1+ ATOM 198 NH2 ARG A 13 10.608 -7.498 -1.938 1.00 3.11 N ATOM 199 H ARG A 13 3.996 -4.856 -4.317 1.00 0.24 H ATOM 200 HA ARG A 13 4.736 -4.292 -1.534 1.00 0.18 H ATOM 201 HB2 ARG A 13 6.364 -5.241 -3.888 1.00 0.30 H ATOM 202 HB3 ARG A 13 7.071 -4.767 -2.349 1.00 0.26 H ATOM 203 HG2 ARG A 13 5.966 -6.538 -1.206 1.00 0.40 H ATOM 204 HG3 ARG A 13 4.997 -6.921 -2.631 1.00 0.41 H ATOM 205 HD2 ARG A 13 6.822 -8.519 -2.356 1.00 1.18 H ATOM 206 HD3 ARG A 13 7.014 -7.581 -3.835 1.00 1.11 H ATOM 207 HE ARG A 13 8.487 -6.202 -2.034 1.00 2.06 H ATOM 208 HH11 ARG A 13 10.078 -9.834 -2.689 1.00 2.53 H ATOM 209 HH12 ARG A 13 8.390 -9.566 -2.985 1.00 1.78 H ATOM 210 HH21 ARG A 13 10.717 -6.540 -1.653 1.00 3.65 H ATOM 211 HH22 ARG A 13 11.404 -8.109 -1.931 1.00 3.57 H ATOM 212 N PHE A 14 6.002 -2.123 -1.906 1.00 0.13 N ATOM 213 CA PHE A 14 6.372 -0.721 -2.037 1.00 0.15 C ATOM 214 C PHE A 14 7.731 -0.460 -1.407 1.00 0.18 C ATOM 215 O PHE A 14 8.168 -1.191 -0.510 1.00 0.32 O ATOM 216 CB PHE A 14 5.332 0.159 -1.349 1.00 0.20 C ATOM 217 CG PHE A 14 3.937 -0.134 -1.784 1.00 0.20 C ATOM 218 CD1 PHE A 14 3.148 -1.002 -1.062 1.00 0.25 C ATOM 219 CD2 PHE A 14 3.413 0.474 -2.909 1.00 0.23 C ATOM 220 CE1 PHE A 14 1.854 -1.261 -1.452 1.00 0.29 C ATOM 221 CE2 PHE A 14 2.120 0.220 -3.305 1.00 0.27 C ATOM 222 CZ PHE A 14 1.362 -0.704 -2.604 1.00 0.29 C ATOM 223 H PHE A 14 6.194 -2.585 -1.061 1.00 0.19 H ATOM 224 HA PHE A 14 6.406 -0.476 -3.087 1.00 0.16 H ATOM 225 HB2 PHE A 14 5.386 0.002 -0.284 1.00 0.23 H ATOM 226 HB3 PHE A 14 5.540 1.197 -1.570 1.00 0.23 H ATOM 227 HD1 PHE A 14 3.553 -1.477 -0.182 1.00 0.28 H ATOM 228 HD2 PHE A 14 4.027 1.157 -3.478 1.00 0.26 H ATOM 229 HE1 PHE A 14 1.244 -1.942 -0.883 1.00 0.35 H ATOM 230 HE2 PHE A 14 1.717 0.702 -4.181 1.00 0.32 H ATOM 231 HZ PHE A 14 0.355 -0.925 -2.925 1.00 0.33 H ATOM 232 N THR A 15 8.389 0.586 -1.875 1.00 0.14 N ATOM 233 CA THR A 15 9.654 1.009 -1.310 1.00 0.17 C ATOM 234 C THR A 15 9.448 2.219 -0.405 1.00 0.17 C ATOM 235 O THR A 15 10.313 2.568 0.402 1.00 0.32 O ATOM 236 CB THR A 15 10.662 1.356 -2.424 1.00 0.27 C ATOM 237 OG1 THR A 15 10.029 2.185 -3.411 1.00 1.05 O ATOM 238 CG2 THR A 15 11.205 0.095 -3.089 1.00 1.06 C ATOM 239 H THR A 15 8.015 1.090 -2.631 1.00 0.21 H ATOM 240 HA THR A 15 10.053 0.195 -0.725 1.00 0.20 H ATOM 241 HB THR A 15 11.486 1.899 -1.986 1.00 0.70 H ATOM 242 HG1 THR A 15 10.592 2.946 -3.596 1.00 1.53 H ATOM 243 HG21 THR A 15 10.393 -0.453 -3.543 1.00 1.71 H ATOM 244 HG22 THR A 15 11.689 -0.524 -2.349 1.00 1.61 H ATOM 245 HG23 THR A 15 11.921 0.371 -3.850 1.00 1.54 H ATOM 246 N ARG A 16 8.285 2.852 -0.540 1.00 0.16 N ATOM 247 CA ARG A 16 7.950 4.021 0.254 1.00 0.19 C ATOM 248 C ARG A 16 6.636 3.825 1.008 1.00 0.12 C ATOM 249 O ARG A 16 5.679 3.239 0.487 1.00 0.13 O ATOM 250 CB ARG A 16 7.839 5.251 -0.647 1.00 0.34 C ATOM 251 CG ARG A 16 9.168 5.742 -1.184 1.00 0.50 C ATOM 252 CD ARG A 16 9.001 7.060 -1.916 1.00 0.95 C ATOM 253 NE ARG A 16 8.390 8.080 -1.062 1.00 1.65 N ATOM 254 CZ ARG A 16 7.885 9.227 -1.515 1.00 2.28 C ATOM 255 NH1 ARG A 16 7.935 9.513 -2.810 1.00 2.39 N1+ ATOM 256 NH2 ARG A 16 7.324 10.084 -0.672 1.00 3.20 N ATOM 257 H ARG A 16 7.639 2.523 -1.200 1.00 0.27 H ATOM 258 HA ARG A 16 8.747 4.175 0.966 1.00 0.24 H ATOM 259 HB2 ARG A 16 7.208 5.007 -1.487 1.00 0.40 H ATOM 260 HB3 ARG A 16 7.382 6.053 -0.088 1.00 0.38 H ATOM 261 HG2 ARG A 16 9.851 5.880 -0.361 1.00 0.72 H ATOM 262 HG3 ARG A 16 9.562 5.005 -1.866 1.00 0.67 H ATOM 263 HD2 ARG A 16 9.971 7.405 -2.240 1.00 1.68 H ATOM 264 HD3 ARG A 16 8.371 6.900 -2.776 1.00 1.23 H ATOM 265 HE ARG A 16 8.349 7.894 -0.096 1.00 2.06 H ATOM 266 HH11 ARG A 16 8.351 8.865 -3.452 1.00 2.26 H ATOM 267 HH12 ARG A 16 7.556 10.378 -3.151 1.00 2.94 H ATOM 268 HH21 ARG A 16 7.276 9.868 0.312 1.00 3.59 H ATOM 269 HH22 ARG A 16 6.949 10.951 -1.006 1.00 3.66 H ATOM 270 N SER A 17 6.593 4.343 2.234 1.00 0.13 N ATOM 271 CA SER A 17 5.418 4.227 3.082 1.00 0.14 C ATOM 272 C SER A 17 4.294 5.107 2.555 1.00 0.13 C ATOM 273 O SER A 17 3.118 4.794 2.725 1.00 0.18 O ATOM 274 CB SER A 17 5.775 4.610 4.519 1.00 0.23 C ATOM 275 OG SER A 17 6.442 5.862 4.562 1.00 1.25 O ATOM 276 H SER A 17 7.375 4.827 2.576 1.00 0.18 H ATOM 277 HA SER A 17 5.095 3.197 3.064 1.00 0.17 H ATOM 278 HB2 SER A 17 4.872 4.678 5.108 1.00 1.01 H ATOM 279 HB3 SER A 17 6.426 3.856 4.940 1.00 0.92 H ATOM 280 HG SER A 17 6.135 6.358 5.332 1.00 1.56 H ATOM 281 N ASP A 18 4.671 6.206 1.901 1.00 0.15 N ATOM 282 CA ASP A 18 3.697 7.092 1.260 1.00 0.23 C ATOM 283 C ASP A 18 2.912 6.332 0.207 1.00 0.19 C ATOM 284 O ASP A 18 1.702 6.501 0.075 1.00 0.21 O ATOM 285 CB ASP A 18 4.382 8.291 0.595 1.00 0.38 C ATOM 286 CG ASP A 18 5.150 9.161 1.565 1.00 1.26 C ATOM 287 OD1 ASP A 18 6.372 8.958 1.711 1.00 1.91 O ATOM 288 OD2 ASP A 18 4.544 10.067 2.169 1.00 2.04 O1- ATOM 289 H ASP A 18 5.627 6.432 1.864 1.00 0.15 H ATOM 290 HA ASP A 18 3.012 7.444 2.018 1.00 0.29 H ATOM 291 HB2 ASP A 18 5.071 7.932 -0.155 1.00 1.26 H ATOM 292 HB3 ASP A 18 3.628 8.900 0.117 1.00 1.08 H ATOM 293 N GLU A 19 3.615 5.490 -0.538 1.00 0.18 N ATOM 294 CA GLU A 19 3.002 4.691 -1.582 1.00 0.20 C ATOM 295 C GLU A 19 2.132 3.595 -0.995 1.00 0.12 C ATOM 296 O GLU A 19 1.073 3.289 -1.537 1.00 0.14 O ATOM 297 CB GLU A 19 4.064 4.089 -2.493 1.00 0.29 C ATOM 298 CG GLU A 19 4.613 5.074 -3.509 1.00 0.49 C ATOM 299 CD GLU A 19 3.570 5.479 -4.530 1.00 1.62 C ATOM 300 OE1 GLU A 19 3.347 4.716 -5.494 1.00 2.45 O ATOM 301 OE2 GLU A 19 2.967 6.560 -4.378 1.00 2.12 O1- ATOM 302 H GLU A 19 4.574 5.403 -0.378 1.00 0.18 H ATOM 303 HA GLU A 19 2.378 5.345 -2.166 1.00 0.28 H ATOM 304 HB2 GLU A 19 4.883 3.725 -1.889 1.00 0.36 H ATOM 305 HB3 GLU A 19 3.629 3.260 -3.025 1.00 0.27 H ATOM 306 HG2 GLU A 19 4.951 5.959 -2.989 1.00 0.80 H ATOM 307 HG3 GLU A 19 5.445 4.618 -4.024 1.00 0.80 H ATOM 308 N LEU A 20 2.581 3.003 0.106 1.00 0.11 N ATOM 309 CA LEU A 20 1.784 1.996 0.796 1.00 0.12 C ATOM 310 C LEU A 20 0.481 2.602 1.310 1.00 0.11 C ATOM 311 O LEU A 20 -0.591 2.031 1.118 1.00 0.14 O ATOM 312 CB LEU A 20 2.573 1.365 1.948 1.00 0.15 C ATOM 313 CG LEU A 20 1.780 0.401 2.841 1.00 0.18 C ATOM 314 CD1 LEU A 20 1.158 -0.717 2.019 1.00 0.22 C ATOM 315 CD2 LEU A 20 2.672 -0.181 3.926 1.00 0.22 C ATOM 316 H LEU A 20 3.473 3.234 0.448 1.00 0.12 H ATOM 317 HA LEU A 20 1.544 1.226 0.078 1.00 0.17 H ATOM 318 HB2 LEU A 20 3.407 0.825 1.525 1.00 0.19 H ATOM 319 HB3 LEU A 20 2.956 2.159 2.567 1.00 0.15 H ATOM 320 HG LEU A 20 0.979 0.944 3.323 1.00 0.17 H ATOM 321 HD11 LEU A 20 1.937 -1.267 1.514 1.00 1.07 H ATOM 322 HD12 LEU A 20 0.483 -0.295 1.288 1.00 0.96 H ATOM 323 HD13 LEU A 20 0.612 -1.382 2.670 1.00 1.05 H ATOM 324 HD21 LEU A 20 3.154 0.621 4.466 1.00 0.98 H ATOM 325 HD22 LEU A 20 3.422 -0.815 3.476 1.00 0.96 H ATOM 326 HD23 LEU A 20 2.073 -0.764 4.609 1.00 0.93 H ATOM 327 N GLN A 21 0.575 3.770 1.945 1.00 0.12 N ATOM 328 CA GLN A 21 -0.607 4.467 2.444 1.00 0.15 C ATOM 329 C GLN A 21 -1.530 4.834 1.287 1.00 0.13 C ATOM 330 O GLN A 21 -2.729 4.544 1.313 1.00 0.14 O ATOM 331 CB GLN A 21 -0.210 5.734 3.208 1.00 0.19 C ATOM 332 CG GLN A 21 0.564 5.472 4.490 1.00 0.24 C ATOM 333 CD GLN A 21 0.917 6.754 5.218 1.00 0.30 C ATOM 334 OE1 GLN A 21 0.183 7.741 5.153 1.00 1.10 O ATOM 335 NE2 GLN A 21 2.035 6.750 5.921 1.00 1.20 N ATOM 336 H GLN A 21 1.463 4.171 2.082 1.00 0.15 H ATOM 337 HA GLN A 21 -1.131 3.801 3.111 1.00 0.17 H ATOM 338 HB2 GLN A 21 0.406 6.348 2.565 1.00 0.21 H ATOM 339 HB3 GLN A 21 -1.107 6.281 3.459 1.00 0.22 H ATOM 340 HG2 GLN A 21 -0.039 4.859 5.142 1.00 0.26 H ATOM 341 HG3 GLN A 21 1.477 4.950 4.248 1.00 0.25 H ATOM 342 HE21 GLN A 21 2.571 5.927 5.934 1.00 1.96 H ATOM 343 HE22 GLN A 21 2.289 7.571 6.395 1.00 1.24 H ATOM 344 N ARG A 22 -0.945 5.462 0.272 1.00 0.13 N ATOM 345 CA ARG A 22 -1.662 5.846 -0.937 1.00 0.15 C ATOM 346 C ARG A 22 -2.425 4.656 -1.508 1.00 0.13 C ATOM 347 O ARG A 22 -3.647 4.695 -1.645 1.00 0.17 O ATOM 348 CB ARG A 22 -0.661 6.384 -1.966 1.00 0.24 C ATOM 349 CG ARG A 22 -1.251 6.689 -3.331 1.00 0.88 C ATOM 350 CD ARG A 22 -0.171 7.184 -4.283 1.00 1.15 C ATOM 351 NE ARG A 22 -0.665 7.352 -5.646 1.00 2.03 N ATOM 352 CZ ARG A 22 0.117 7.317 -6.723 1.00 2.63 C ATOM 353 NH1 ARG A 22 1.418 7.074 -6.600 1.00 2.75 N1+ ATOM 354 NH2 ARG A 22 -0.408 7.510 -7.924 1.00 3.55 N ATOM 355 H ARG A 22 0.012 5.676 0.340 1.00 0.15 H ATOM 356 HA ARG A 22 -2.362 6.625 -0.681 1.00 0.17 H ATOM 357 HB2 ARG A 22 -0.228 7.293 -1.583 1.00 0.82 H ATOM 358 HB3 ARG A 22 0.124 5.653 -2.097 1.00 0.83 H ATOM 359 HG2 ARG A 22 -1.693 5.789 -3.734 1.00 1.42 H ATOM 360 HG3 ARG A 22 -2.009 7.451 -3.227 1.00 1.50 H ATOM 361 HD2 ARG A 22 0.197 8.135 -3.925 1.00 1.56 H ATOM 362 HD3 ARG A 22 0.641 6.469 -4.289 1.00 1.45 H ATOM 363 HE ARG A 22 -1.630 7.510 -5.762 1.00 2.51 H ATOM 364 HH11 ARG A 22 2.005 7.047 -7.413 1.00 3.38 H ATOM 365 HH12 ARG A 22 1.826 6.908 -5.688 1.00 2.55 H ATOM 366 HH21 ARG A 22 -1.391 7.683 -8.023 1.00 3.95 H ATOM 367 HH22 ARG A 22 0.174 7.479 -8.741 1.00 4.02 H ATOM 368 N HIS A 23 -1.694 3.592 -1.804 1.00 0.11 N ATOM 369 CA HIS A 23 -2.278 2.386 -2.367 1.00 0.11 C ATOM 370 C HIS A 23 -3.367 1.832 -1.458 1.00 0.10 C ATOM 371 O HIS A 23 -4.447 1.482 -1.924 1.00 0.11 O ATOM 372 CB HIS A 23 -1.189 1.334 -2.596 1.00 0.15 C ATOM 373 CG HIS A 23 -1.718 -0.041 -2.871 1.00 0.14 C ATOM 374 ND1 HIS A 23 -1.796 -0.622 -4.134 1.00 0.16 N ATOM 375 CD2 HIS A 23 -2.226 -0.952 -2.002 1.00 0.14 C ATOM 376 CE1 HIS A 23 -2.355 -1.839 -3.985 1.00 0.17 C ATOM 377 NE2 HIS A 23 -2.618 -2.051 -2.719 1.00 0.16 N ATOM 378 H HIS A 23 -0.727 3.613 -1.630 1.00 0.14 H ATOM 379 HA HIS A 23 -2.715 2.645 -3.316 1.00 0.12 H ATOM 380 HB2 HIS A 23 -0.586 1.631 -3.440 1.00 0.18 H ATOM 381 HB3 HIS A 23 -0.564 1.279 -1.717 1.00 0.17 H ATOM 382 HD1 HIS A 23 -1.493 -0.219 -4.980 1.00 0.18 H ATOM 383 HD2 HIS A 23 -2.302 -0.843 -0.929 1.00 0.15 H ATOM 384 HE1 HIS A 23 -2.545 -2.539 -4.786 1.00 0.20 H ATOM 385 N LYS A 24 -3.078 1.760 -0.164 1.00 0.12 N ATOM 386 CA LYS A 24 -4.002 1.176 0.801 1.00 0.17 C ATOM 387 C LYS A 24 -5.354 1.874 0.748 1.00 0.16 C ATOM 388 O LYS A 24 -6.394 1.250 0.965 1.00 0.20 O ATOM 389 CB LYS A 24 -3.419 1.265 2.216 1.00 0.25 C ATOM 390 CG LYS A 24 -4.219 0.510 3.268 1.00 0.80 C ATOM 391 CD LYS A 24 -4.049 -0.999 3.144 1.00 1.05 C ATOM 392 CE LYS A 24 -2.636 -1.441 3.508 1.00 1.87 C ATOM 393 NZ LYS A 24 -2.296 -1.128 4.924 1.00 2.20 N1+ ATOM 394 H LYS A 24 -2.215 2.108 0.152 1.00 0.12 H ATOM 395 HA LYS A 24 -4.138 0.140 0.538 1.00 0.20 H ATOM 396 HB2 LYS A 24 -2.416 0.864 2.202 1.00 0.79 H ATOM 397 HB3 LYS A 24 -3.375 2.304 2.507 1.00 0.67 H ATOM 398 HG2 LYS A 24 -3.885 0.817 4.247 1.00 1.45 H ATOM 399 HG3 LYS A 24 -5.265 0.754 3.153 1.00 1.42 H ATOM 400 HD2 LYS A 24 -4.747 -1.483 3.809 1.00 1.31 H ATOM 401 HD3 LYS A 24 -4.259 -1.294 2.127 1.00 1.49 H ATOM 402 HE2 LYS A 24 -2.558 -2.507 3.357 1.00 2.24 H ATOM 403 HE3 LYS A 24 -1.936 -0.936 2.858 1.00 2.55 H ATOM 404 HZ1 LYS A 24 -1.330 -1.452 5.140 1.00 2.53 H ATOM 405 HZ2 LYS A 24 -2.957 -1.604 5.569 1.00 2.71 H ATOM 406 HZ3 LYS A 24 -2.350 -0.103 5.090 1.00 2.34 H ATOM 407 N ARG A 25 -5.333 3.161 0.417 1.00 0.16 N ATOM 408 CA ARG A 25 -6.551 3.955 0.360 1.00 0.21 C ATOM 409 C ARG A 25 -7.496 3.479 -0.741 1.00 0.14 C ATOM 410 O ARG A 25 -8.673 3.832 -0.745 1.00 0.20 O ATOM 411 CB ARG A 25 -6.207 5.428 0.162 1.00 0.35 C ATOM 412 CG ARG A 25 -5.476 6.026 1.349 1.00 0.48 C ATOM 413 CD ARG A 25 -5.023 7.451 1.077 1.00 0.65 C ATOM 414 NE ARG A 25 -4.252 7.992 2.195 1.00 1.61 N ATOM 415 CZ ARG A 25 -3.280 8.891 2.064 1.00 2.01 C ATOM 416 NH1 ARG A 25 -2.982 9.378 0.867 1.00 1.63 N1+ ATOM 417 NH2 ARG A 25 -2.614 9.311 3.132 1.00 3.16 N ATOM 418 H ARG A 25 -4.470 3.591 0.206 1.00 0.15 H ATOM 419 HA ARG A 25 -7.051 3.845 1.309 1.00 0.28 H ATOM 420 HB2 ARG A 25 -5.579 5.524 -0.712 1.00 0.37 H ATOM 421 HB3 ARG A 25 -7.118 5.984 0.007 1.00 0.38 H ATOM 422 HG2 ARG A 25 -6.137 6.023 2.202 1.00 0.49 H ATOM 423 HG3 ARG A 25 -4.608 5.416 1.565 1.00 0.53 H ATOM 424 HD2 ARG A 25 -4.405 7.459 0.191 1.00 1.17 H ATOM 425 HD3 ARG A 25 -5.892 8.072 0.916 1.00 1.13 H ATOM 426 HE ARG A 25 -4.470 7.654 3.096 1.00 2.28 H ATOM 427 HH11 ARG A 25 -2.247 10.057 0.769 1.00 2.09 H ATOM 428 HH12 ARG A 25 -3.489 9.076 0.055 1.00 1.35 H ATOM 429 HH21 ARG A 25 -1.879 9.990 3.034 1.00 3.50 H ATOM 430 HH22 ARG A 25 -2.841 8.955 4.043 1.00 3.78 H ATOM 431 N THR A 26 -6.992 2.672 -1.670 1.00 0.12 N ATOM 432 CA THR A 26 -7.843 2.115 -2.712 1.00 0.19 C ATOM 433 C THR A 26 -8.754 1.045 -2.121 1.00 0.21 C ATOM 434 O THR A 26 -9.883 0.852 -2.573 1.00 0.30 O ATOM 435 CB THR A 26 -7.037 1.511 -3.884 1.00 0.28 C ATOM 436 OG1 THR A 26 -6.243 0.407 -3.431 1.00 0.26 O ATOM 437 CG2 THR A 26 -6.140 2.560 -4.527 1.00 0.35 C ATOM 438 H THR A 26 -6.037 2.447 -1.652 1.00 0.11 H ATOM 439 HA THR A 26 -8.456 2.916 -3.099 1.00 0.22 H ATOM 440 HB THR A 26 -7.734 1.157 -4.627 1.00 0.39 H ATOM 441 HG1 THR A 26 -5.446 0.740 -2.990 1.00 0.19 H ATOM 442 HG21 THR A 26 -5.610 2.119 -5.357 1.00 1.07 H ATOM 443 HG22 THR A 26 -5.431 2.921 -3.798 1.00 1.14 H ATOM 444 HG23 THR A 26 -6.744 3.381 -4.880 1.00 0.93 H ATOM 445 N HIS A 27 -8.256 0.349 -1.102 1.00 0.19 N ATOM 446 CA HIS A 27 -9.057 -0.638 -0.396 1.00 0.26 C ATOM 447 C HIS A 27 -9.845 0.048 0.711 1.00 0.32 C ATOM 448 O HIS A 27 -11.066 -0.073 0.796 1.00 0.43 O ATOM 449 CB HIS A 27 -8.186 -1.726 0.242 1.00 0.26 C ATOM 450 CG HIS A 27 -7.213 -2.408 -0.670 1.00 0.24 C ATOM 451 ND1 HIS A 27 -7.562 -3.239 -1.732 1.00 0.26 N ATOM 452 CD2 HIS A 27 -5.860 -2.429 -0.609 1.00 0.21 C ATOM 453 CE1 HIS A 27 -6.424 -3.734 -2.258 1.00 0.25 C ATOM 454 NE2 HIS A 27 -5.397 -3.263 -1.601 1.00 0.22 N ATOM 455 H HIS A 27 -7.328 0.508 -0.817 1.00 0.16 H ATOM 456 HA HIS A 27 -9.741 -1.088 -1.098 1.00 0.33 H ATOM 457 HB2 HIS A 27 -7.614 -1.280 1.042 1.00 0.25 H ATOM 458 HB3 HIS A 27 -8.833 -2.484 0.661 1.00 0.32 H ATOM 459 HD1 HIS A 27 -8.475 -3.438 -2.038 1.00 0.29 H ATOM 460 HD2 HIS A 27 -5.242 -1.895 0.096 1.00 0.21 H ATOM 461 HE1 HIS A 27 -6.367 -4.425 -3.084 1.00 0.28 H ATOM 462 N THR A 28 -9.126 0.777 1.551 1.00 0.39 N ATOM 463 CA THR A 28 -9.708 1.413 2.713 1.00 0.53 C ATOM 464 C THR A 28 -9.266 2.872 2.807 1.00 1.47 C ATOM 465 O THR A 28 -8.211 3.180 3.364 1.00 2.16 O ATOM 466 CB THR A 28 -9.299 0.667 3.997 1.00 1.31 C ATOM 467 OG1 THR A 28 -9.615 -0.726 3.871 1.00 2.16 O ATOM 468 CG2 THR A 28 -10.009 1.242 5.211 1.00 1.79 C ATOM 469 H THR A 28 -8.165 0.894 1.382 1.00 0.44 H ATOM 470 HA THR A 28 -10.783 1.369 2.620 1.00 0.93 H ATOM 471 HB THR A 28 -8.232 0.777 4.135 1.00 1.87 H ATOM 472 HG1 THR A 28 -10.276 -0.841 3.176 1.00 2.36 H ATOM 473 HG21 THR A 28 -9.674 0.730 6.100 1.00 2.33 H ATOM 474 HG22 THR A 28 -11.075 1.111 5.100 1.00 2.26 H ATOM 475 HG23 THR A 28 -9.783 2.296 5.295 1.00 2.02 H ATOM 476 N GLY A 29 -10.063 3.763 2.241 1.00 2.08 N ATOM 477 CA GLY A 29 -9.762 5.178 2.316 1.00 3.18 C ATOM 478 C GLY A 29 -10.968 5.984 2.736 1.00 3.85 C ATOM 479 O GLY A 29 -10.887 6.836 3.625 1.00 4.55 O ATOM 480 H GLY A 29 -10.861 3.458 1.763 1.00 2.08 H ATOM 481 HA2 GLY A 29 -8.971 5.329 3.031 1.00 3.48 H ATOM 482 HA3 GLY A 29 -9.432 5.519 1.346 1.00 3.63 H ATOM 483 N GLU A 30 -12.089 5.720 2.088 1.00 4.09 N ATOM 484 CA GLU A 30 -13.336 6.384 2.419 1.00 5.05 C ATOM 485 C GLU A 30 -14.096 5.573 3.462 1.00 5.25 C ATOM 486 O GLU A 30 -14.661 6.124 4.405 1.00 6.02 O ATOM 487 CB GLU A 30 -14.191 6.575 1.166 1.00 5.70 C ATOM 488 CG GLU A 30 -15.323 7.567 1.354 1.00 6.61 C ATOM 489 CD GLU A 30 -14.823 8.935 1.764 1.00 7.39 C ATOM 490 OE1 GLU A 30 -14.378 9.701 0.884 1.00 8.01 O ATOM 491 OE2 GLU A 30 -14.879 9.257 2.967 1.00 7.59 O1- ATOM 492 H GLU A 30 -12.076 5.055 1.369 1.00 3.89 H ATOM 493 HA GLU A 30 -13.097 7.351 2.833 1.00 5.55 H ATOM 494 HB2 GLU A 30 -13.562 6.926 0.361 1.00 5.79 H ATOM 495 HB3 GLU A 30 -14.619 5.624 0.889 1.00 5.80 H ATOM 496 HG2 GLU A 30 -15.863 7.662 0.423 1.00 6.99 H ATOM 497 HG3 GLU A 30 -15.988 7.196 2.119 1.00 6.60 H ATOM 498 N LYS A 31 -14.089 4.259 3.293 1.00 4.92 N ATOM 499 CA LYS A 31 -14.766 3.365 4.215 1.00 5.57 C ATOM 500 C LYS A 31 -13.826 2.247 4.649 1.00 5.77 C ATOM 501 O LYS A 31 -13.626 1.271 3.928 1.00 5.91 O ATOM 502 CB LYS A 31 -16.019 2.776 3.562 1.00 5.76 C ATOM 503 CG LYS A 31 -16.853 1.920 4.502 1.00 6.19 C ATOM 504 CD LYS A 31 -18.041 1.307 3.783 1.00 6.83 C ATOM 505 CE LYS A 31 -18.901 0.483 4.729 1.00 7.38 C ATOM 506 NZ LYS A 31 -20.035 -0.174 4.023 1.00 8.09 N1+ ATOM 507 H LYS A 31 -13.611 3.878 2.525 1.00 4.51 H ATOM 508 HA LYS A 31 -15.056 3.936 5.082 1.00 6.21 H ATOM 509 HB2 LYS A 31 -16.638 3.584 3.203 1.00 6.05 H ATOM 510 HB3 LYS A 31 -15.719 2.165 2.724 1.00 5.73 H ATOM 511 HG2 LYS A 31 -16.234 1.126 4.894 1.00 6.05 H ATOM 512 HG3 LYS A 31 -17.212 2.535 5.313 1.00 6.58 H ATOM 513 HD2 LYS A 31 -18.642 2.099 3.363 1.00 7.00 H ATOM 514 HD3 LYS A 31 -17.680 0.667 2.991 1.00 7.08 H ATOM 515 HE2 LYS A 31 -18.284 -0.275 5.185 1.00 7.60 H ATOM 516 HE3 LYS A 31 -19.295 1.135 5.495 1.00 7.36 H ATOM 517 HZ1 LYS A 31 -20.656 0.540 3.593 1.00 8.35 H ATOM 518 HZ2 LYS A 31 -20.593 -0.741 4.691 1.00 8.52 H ATOM 519 HZ3 LYS A 31 -19.676 -0.799 3.274 1.00 8.15 H HETATM 520 N NH2 A 32 -13.239 2.394 5.824 1.00 6.20 N HETATM 521 HN1 NH2 A 32 -13.445 3.200 6.346 1.00 6.33 H HETATM 522 HN2 NH2 A 32 -12.629 1.688 6.130 1.00 6.58 H TER 523 NH2 A 32 HETATM 524 ZN ZN A 101 -3.474 -3.670 -1.936 1.00 0.21 ZN