ATOM 1 N ARG A 1 -13.987 1.083 -5.185 1.00 1.49 N ATOM 2 CA ARG A 1 -13.112 -0.111 -5.136 1.00 1.23 C ATOM 3 C ARG A 1 -12.307 -0.130 -3.844 1.00 0.92 C ATOM 4 O ARG A 1 -11.722 0.885 -3.463 1.00 0.87 O ATOM 5 CB ARG A 1 -12.136 -0.115 -6.317 1.00 1.39 C ATOM 6 CG ARG A 1 -12.787 -0.284 -7.678 1.00 1.72 C ATOM 7 CD ARG A 1 -11.740 -0.261 -8.779 1.00 2.08 C ATOM 8 NE ARG A 1 -12.324 -0.375 -10.114 1.00 2.72 N ATOM 9 CZ ARG A 1 -11.758 0.122 -11.213 1.00 3.37 C ATOM 10 NH1 ARG A 1 -10.608 0.778 -11.130 1.00 3.46 N1+ ATOM 11 NH2 ARG A 1 -12.343 -0.029 -12.393 1.00 4.31 N ATOM 12 H1 ARG A 1 -13.411 1.949 -5.178 1.00 1.99 H ATOM 13 H2 ARG A 1 -14.616 1.097 -4.359 1.00 1.49 H ATOM 14 H3 ARG A 1 -14.568 1.072 -6.047 1.00 1.87 H ATOM 15 HA ARG A 1 -13.735 -0.991 -5.183 1.00 1.29 H ATOM 16 HB2 ARG A 1 -11.594 0.819 -6.317 1.00 1.85 H ATOM 17 HB3 ARG A 1 -11.433 -0.923 -6.178 1.00 1.75 H ATOM 18 HG2 ARG A 1 -13.305 -1.230 -7.708 1.00 2.24 H ATOM 19 HG3 ARG A 1 -13.488 0.522 -7.840 1.00 2.16 H ATOM 20 HD2 ARG A 1 -11.196 0.668 -8.716 1.00 2.13 H ATOM 21 HD3 ARG A 1 -11.059 -1.085 -8.625 1.00 2.66 H ATOM 22 HE ARG A 1 -13.181 -0.851 -10.192 1.00 3.08 H ATOM 23 HH11 ARG A 1 -10.179 1.153 -11.956 1.00 4.09 H ATOM 24 HH12 ARG A 1 -10.164 0.911 -10.240 1.00 3.21 H ATOM 25 HH21 ARG A 1 -11.916 0.345 -13.220 1.00 4.86 H ATOM 26 HH22 ARG A 1 -13.217 -0.517 -12.465 1.00 4.66 H ATOM 27 N PRO A 2 -12.266 -1.275 -3.143 1.00 0.80 N ATOM 28 CA PRO A 2 -11.403 -1.438 -1.977 1.00 0.58 C ATOM 29 C PRO A 2 -9.940 -1.537 -2.396 1.00 0.50 C ATOM 30 O PRO A 2 -9.617 -2.176 -3.400 1.00 0.76 O ATOM 31 CB PRO A 2 -11.880 -2.750 -1.354 1.00 0.73 C ATOM 32 CG PRO A 2 -12.471 -3.514 -2.485 1.00 1.00 C ATOM 33 CD PRO A 2 -13.060 -2.489 -3.419 1.00 1.00 C ATOM 34 HA PRO A 2 -11.527 -0.626 -1.274 1.00 0.51 H ATOM 35 HB2 PRO A 2 -11.038 -3.270 -0.921 1.00 0.85 H ATOM 36 HB3 PRO A 2 -12.614 -2.545 -0.590 1.00 0.80 H ATOM 37 HG2 PRO A 2 -11.701 -4.082 -2.987 1.00 1.32 H ATOM 38 HG3 PRO A 2 -13.244 -4.175 -2.118 1.00 1.20 H ATOM 39 HD2 PRO A 2 -12.942 -2.802 -4.444 1.00 1.18 H ATOM 40 HD3 PRO A 2 -14.102 -2.326 -3.191 1.00 1.09 H ATOM 41 N PHE A 3 -9.059 -0.900 -1.642 1.00 0.23 N ATOM 42 CA PHE A 3 -7.653 -0.861 -2.001 1.00 0.22 C ATOM 43 C PHE A 3 -6.886 -1.937 -1.258 1.00 0.33 C ATOM 44 O PHE A 3 -6.991 -2.060 -0.041 1.00 0.73 O ATOM 45 CB PHE A 3 -7.066 0.522 -1.716 1.00 0.20 C ATOM 46 CG PHE A 3 -7.738 1.603 -2.506 1.00 0.20 C ATOM 47 CD1 PHE A 3 -7.417 1.798 -3.837 1.00 0.30 C ATOM 48 CD2 PHE A 3 -8.701 2.410 -1.926 1.00 0.21 C ATOM 49 CE1 PHE A 3 -8.044 2.778 -4.579 1.00 0.41 C ATOM 50 CE2 PHE A 3 -9.331 3.396 -2.660 1.00 0.33 C ATOM 51 CZ PHE A 3 -9.003 3.580 -3.989 1.00 0.43 C ATOM 52 H PHE A 3 -9.357 -0.464 -0.814 1.00 0.23 H ATOM 53 HA PHE A 3 -7.580 -1.056 -3.059 1.00 0.22 H ATOM 54 HB2 PHE A 3 -7.181 0.751 -0.666 1.00 0.22 H ATOM 55 HB3 PHE A 3 -6.019 0.523 -1.970 1.00 0.30 H ATOM 56 HD1 PHE A 3 -6.667 1.172 -4.297 1.00 0.34 H ATOM 57 HD2 PHE A 3 -8.957 2.267 -0.885 1.00 0.19 H ATOM 58 HE1 PHE A 3 -7.784 2.920 -5.617 1.00 0.51 H ATOM 59 HE2 PHE A 3 -10.079 4.019 -2.195 1.00 0.39 H ATOM 60 HZ PHE A 3 -9.496 4.347 -4.567 1.00 0.54 H HETATM 61 N NLE A 4 -6.127 -2.724 -1.995 1.00 0.09 N HETATM 62 CA NLE A 4 -5.384 -3.821 -1.407 1.00 0.10 C HETATM 63 C NLE A 4 -3.990 -3.897 -2.000 1.00 0.11 C HETATM 64 O NLE A 4 -3.820 -3.957 -3.219 1.00 0.17 O HETATM 65 CB NLE A 4 -6.114 -5.146 -1.634 1.00 0.16 C HETATM 66 CG NLE A 4 -5.374 -6.351 -1.073 1.00 0.22 C HETATM 67 CD NLE A 4 -6.069 -7.651 -1.436 1.00 0.36 C HETATM 68 CE NLE A 4 -5.265 -8.828 -0.931 1.00 0.47 C HETATM 69 H NLE A 4 -6.054 -2.558 -2.961 1.00 0.33 H HETATM 70 HA NLE A 4 -5.305 -3.637 -0.346 1.00 0.11 H HETATM 71 HB2 NLE A 4 -6.245 -5.292 -2.694 1.00 0.16 H HETATM 72 HB3 NLE A 4 -7.085 -5.094 -1.164 1.00 0.18 H HETATM 73 HG2 NLE A 4 -5.328 -6.267 0.003 1.00 0.24 H HETATM 74 HG3 NLE A 4 -4.373 -6.366 -1.478 1.00 0.21 H HETATM 75 HD2 NLE A 4 -6.159 -7.725 -2.510 1.00 0.37 H HETATM 76 HD3 NLE A 4 -7.047 -7.676 -0.979 1.00 0.39 H HETATM 77 HE1 NLE A 4 -5.175 -8.768 0.143 1.00 0.99 H HETATM 78 HE2 NLE A 4 -4.281 -8.806 -1.374 1.00 1.13 H HETATM 79 HE3 NLE A 4 -5.759 -9.748 -1.201 1.00 1.17 H ATOM 80 N CYS A 5 -2.999 -3.874 -1.132 1.00 0.10 N ATOM 81 CA CYS A 5 -1.620 -4.036 -1.540 1.00 0.12 C ATOM 82 C CYS A 5 -1.391 -5.458 -2.029 1.00 0.17 C ATOM 83 O CYS A 5 -1.331 -6.399 -1.232 1.00 0.19 O ATOM 84 CB CYS A 5 -0.686 -3.720 -0.379 1.00 0.12 C ATOM 85 SG CYS A 5 1.055 -3.955 -0.769 1.00 0.17 S ATOM 86 H CYS A 5 -3.204 -3.747 -0.178 1.00 0.12 H ATOM 87 HA CYS A 5 -1.427 -3.350 -2.348 1.00 0.16 H ATOM 88 HB2 CYS A 5 -0.819 -2.689 -0.083 1.00 0.16 H ATOM 89 HB3 CYS A 5 -0.928 -4.361 0.450 1.00 0.16 H ATOM 90 N THR A 6 -1.249 -5.607 -3.337 1.00 0.27 N ATOM 91 CA THR A 6 -1.156 -6.919 -3.953 1.00 0.35 C ATOM 92 C THR A 6 0.293 -7.420 -3.958 1.00 0.37 C ATOM 93 O THR A 6 0.652 -8.334 -4.704 1.00 0.47 O ATOM 94 CB THR A 6 -1.716 -6.870 -5.390 1.00 0.47 C ATOM 95 OG1 THR A 6 -2.865 -6.008 -5.420 1.00 0.91 O ATOM 96 CG2 THR A 6 -2.118 -8.254 -5.878 1.00 1.03 C ATOM 97 H THR A 6 -1.197 -4.808 -3.909 1.00 0.34 H ATOM 98 HA THR A 6 -1.759 -7.602 -3.375 1.00 0.38 H ATOM 99 HB THR A 6 -0.957 -6.473 -6.048 1.00 0.95 H ATOM 100 HG1 THR A 6 -3.002 -5.627 -4.543 1.00 1.67 H ATOM 101 HG21 THR A 6 -2.463 -8.190 -6.900 1.00 1.85 H ATOM 102 HG22 THR A 6 -2.913 -8.639 -5.256 1.00 1.24 H ATOM 103 HG23 THR A 6 -1.267 -8.916 -5.825 1.00 1.51 H ATOM 104 N TRP A 7 1.122 -6.818 -3.109 1.00 0.31 N ATOM 105 CA TRP A 7 2.503 -7.241 -2.962 1.00 0.37 C ATOM 106 C TRP A 7 2.542 -8.644 -2.376 1.00 0.40 C ATOM 107 O TRP A 7 1.801 -8.950 -1.438 1.00 0.54 O ATOM 108 CB TRP A 7 3.268 -6.275 -2.058 1.00 0.39 C ATOM 109 CG TRP A 7 4.754 -6.468 -2.085 1.00 0.49 C ATOM 110 CD1 TRP A 7 5.483 -7.354 -1.347 1.00 0.60 C ATOM 111 CD2 TRP A 7 5.693 -5.744 -2.884 1.00 0.51 C ATOM 112 NE1 TRP A 7 6.818 -7.224 -1.642 1.00 0.66 N ATOM 113 CE2 TRP A 7 6.973 -6.242 -2.582 1.00 0.61 C ATOM 114 CE3 TRP A 7 5.575 -4.724 -3.827 1.00 0.51 C ATOM 115 CZ2 TRP A 7 8.127 -5.749 -3.189 1.00 0.68 C ATOM 116 CZ3 TRP A 7 6.718 -4.235 -4.431 1.00 0.61 C ATOM 117 CH2 TRP A 7 7.979 -4.748 -4.110 1.00 0.67 C ATOM 118 H TRP A 7 0.793 -6.076 -2.566 1.00 0.30 H ATOM 119 HA TRP A 7 2.959 -7.253 -3.939 1.00 0.41 H ATOM 120 HB2 TRP A 7 3.061 -5.263 -2.364 1.00 0.39 H ATOM 121 HB3 TRP A 7 2.935 -6.411 -1.042 1.00 0.37 H ATOM 122 HD1 TRP A 7 5.059 -8.050 -0.641 1.00 0.65 H ATOM 123 HE1 TRP A 7 7.545 -7.751 -1.242 1.00 0.75 H ATOM 124 HE3 TRP A 7 4.610 -4.320 -4.087 1.00 0.47 H ATOM 125 HZ2 TRP A 7 9.107 -6.136 -2.951 1.00 0.76 H ATOM 126 HZ3 TRP A 7 6.645 -3.445 -5.160 1.00 0.66 H ATOM 127 HH2 TRP A 7 8.844 -4.334 -4.605 1.00 0.75 H HETATM 128 N AIB A 8 3.403 -9.477 -2.938 1.00 0.61 N HETATM 129 CA AIB A 8 3.523 -10.882 -2.542 1.00 0.65 C HETATM 130 C AIB A 8 3.715 -10.997 -1.019 1.00 0.65 C HETATM 131 O AIB A 8 4.730 -10.550 -0.478 1.00 0.76 O HETATM 132 CB1 AIB A 8 4.716 -11.493 -3.247 1.00 0.73 C HETATM 133 CB2 AIB A 8 2.293 -11.651 -2.996 1.00 0.78 C HETATM 134 H AIB A 8 3.986 -9.135 -3.648 1.00 0.87 H HETATM 135 HB11 AIB A 8 4.599 -11.385 -4.314 1.00 1.23 H HETATM 136 HB12 AIB A 8 4.783 -12.541 -2.997 1.00 1.43 H HETATM 137 HB13 AIB A 8 5.618 -10.989 -2.931 1.00 1.05 H HETATM 138 HB21 AIB A 8 1.411 -11.218 -2.545 1.00 1.15 H HETATM 139 HB22 AIB A 8 2.382 -12.683 -2.694 1.00 1.41 H HETATM 140 HB23 AIB A 8 2.212 -11.594 -4.070 1.00 1.29 H ATOM 141 N GLY A 9 2.731 -11.573 -0.335 1.00 0.71 N ATOM 142 CA GLY A 9 2.859 -11.836 1.084 1.00 0.81 C ATOM 143 C GLY A 9 2.414 -10.679 1.956 1.00 0.65 C ATOM 144 O GLY A 9 2.582 -10.721 3.174 1.00 0.80 O ATOM 145 H GLY A 9 1.906 -11.821 -0.799 1.00 0.78 H ATOM 146 HA2 GLY A 9 2.266 -12.702 1.330 1.00 0.97 H ATOM 147 HA3 GLY A 9 3.895 -12.054 1.301 1.00 0.92 H ATOM 148 N CYS A 10 1.849 -9.644 1.351 1.00 0.45 N ATOM 149 CA CYS A 10 1.409 -8.486 2.109 1.00 0.31 C ATOM 150 C CYS A 10 -0.113 -8.495 2.282 1.00 0.19 C ATOM 151 O CYS A 10 -0.620 -8.942 3.314 1.00 0.27 O ATOM 152 CB CYS A 10 1.873 -7.207 1.421 1.00 0.28 C ATOM 153 SG CYS A 10 1.767 -5.729 2.452 1.00 0.24 S ATOM 154 H CYS A 10 1.736 -9.652 0.375 1.00 0.46 H ATOM 155 HA CYS A 10 1.866 -8.541 3.083 1.00 0.39 H ATOM 156 HB2 CYS A 10 2.902 -7.323 1.120 1.00 0.39 H ATOM 157 HB3 CYS A 10 1.266 -7.043 0.546 1.00 0.28 H ATOM 158 N GLY A 11 -0.842 -8.023 1.276 1.00 0.15 N ATOM 159 CA GLY A 11 -2.291 -7.999 1.363 1.00 0.16 C ATOM 160 C GLY A 11 -2.814 -6.953 2.332 1.00 0.15 C ATOM 161 O GLY A 11 -3.879 -7.125 2.926 1.00 0.28 O ATOM 162 H GLY A 11 -0.400 -7.703 0.460 1.00 0.22 H ATOM 163 HA2 GLY A 11 -2.691 -7.792 0.383 1.00 0.25 H ATOM 164 HA3 GLY A 11 -2.634 -8.971 1.681 1.00 0.22 H ATOM 165 N LYS A 12 -2.062 -5.874 2.497 1.00 0.11 N ATOM 166 CA LYS A 12 -2.482 -4.771 3.351 1.00 0.15 C ATOM 167 C LYS A 12 -3.619 -4.008 2.675 1.00 0.12 C ATOM 168 O LYS A 12 -3.481 -3.570 1.537 1.00 0.17 O ATOM 169 CB LYS A 12 -1.303 -3.832 3.610 1.00 0.24 C ATOM 170 CG LYS A 12 -1.335 -3.164 4.972 1.00 0.75 C ATOM 171 CD LYS A 12 -0.901 -4.127 6.064 1.00 1.23 C ATOM 172 CE LYS A 12 -0.943 -3.477 7.435 1.00 1.80 C ATOM 173 NZ LYS A 12 -2.333 -3.195 7.872 1.00 2.23 N1+ ATOM 174 H LYS A 12 -1.201 -5.821 2.040 1.00 0.15 H ATOM 175 HA LYS A 12 -2.833 -5.178 4.286 1.00 0.21 H ATOM 176 HB2 LYS A 12 -0.384 -4.394 3.533 1.00 0.68 H ATOM 177 HB3 LYS A 12 -1.305 -3.060 2.857 1.00 0.68 H ATOM 178 HG2 LYS A 12 -0.666 -2.318 4.965 1.00 1.34 H ATOM 179 HG3 LYS A 12 -2.341 -2.830 5.174 1.00 1.16 H ATOM 180 HD2 LYS A 12 -1.561 -4.980 6.061 1.00 1.41 H ATOM 181 HD3 LYS A 12 0.109 -4.452 5.860 1.00 1.66 H ATOM 182 HE2 LYS A 12 -0.479 -4.140 8.147 1.00 2.19 H ATOM 183 HE3 LYS A 12 -0.392 -2.550 7.396 1.00 2.31 H ATOM 184 HZ1 LYS A 12 -2.332 -2.767 8.819 1.00 2.62 H ATOM 185 HZ2 LYS A 12 -2.885 -4.076 7.904 1.00 2.55 H ATOM 186 HZ3 LYS A 12 -2.790 -2.538 7.211 1.00 2.63 H ATOM 187 N ARG A 13 -4.735 -3.853 3.369 1.00 0.13 N ATOM 188 CA ARG A 13 -5.923 -3.256 2.772 1.00 0.13 C ATOM 189 C ARG A 13 -6.166 -1.844 3.302 1.00 0.12 C ATOM 190 O ARG A 13 -5.979 -1.574 4.489 1.00 0.16 O ATOM 191 CB ARG A 13 -7.137 -4.145 3.036 1.00 0.18 C ATOM 192 CG ARG A 13 -8.396 -3.684 2.326 1.00 0.84 C ATOM 193 CD ARG A 13 -9.492 -4.727 2.406 1.00 0.77 C ATOM 194 NE ARG A 13 -9.072 -5.997 1.810 1.00 1.57 N ATOM 195 CZ ARG A 13 -9.746 -6.637 0.858 1.00 2.12 C ATOM 196 NH1 ARG A 13 -10.894 -6.150 0.403 1.00 1.97 N1+ ATOM 197 NH2 ARG A 13 -9.273 -7.778 0.369 1.00 3.21 N ATOM 198 H ARG A 13 -4.762 -4.141 4.305 1.00 0.18 H ATOM 199 HA ARG A 13 -5.758 -3.197 1.706 1.00 0.13 H ATOM 200 HB2 ARG A 13 -6.911 -5.148 2.709 1.00 0.71 H ATOM 201 HB3 ARG A 13 -7.334 -4.159 4.098 1.00 0.73 H ATOM 202 HG2 ARG A 13 -8.743 -2.772 2.788 1.00 1.32 H ATOM 203 HG3 ARG A 13 -8.162 -3.496 1.288 1.00 1.33 H ATOM 204 HD2 ARG A 13 -9.743 -4.890 3.444 1.00 0.97 H ATOM 205 HD3 ARG A 13 -10.360 -4.359 1.880 1.00 1.41 H ATOM 206 HE ARG A 13 -8.229 -6.392 2.139 1.00 2.13 H ATOM 207 HH11 ARG A 13 -11.401 -6.634 -0.316 1.00 2.51 H ATOM 208 HH12 ARG A 13 -11.270 -5.302 0.785 1.00 1.72 H ATOM 209 HH21 ARG A 13 -8.409 -8.158 0.718 1.00 3.71 H ATOM 210 HH22 ARG A 13 -9.773 -8.265 -0.352 1.00 3.66 H ATOM 211 N PHE A 14 -6.581 -0.953 2.408 1.00 0.11 N ATOM 212 CA PHE A 14 -6.810 0.447 2.744 1.00 0.12 C ATOM 213 C PHE A 14 -8.113 0.943 2.121 1.00 0.14 C ATOM 214 O PHE A 14 -8.607 0.369 1.146 1.00 0.23 O ATOM 215 CB PHE A 14 -5.647 1.303 2.235 1.00 0.15 C ATOM 216 CG PHE A 14 -4.310 0.831 2.713 1.00 0.14 C ATOM 217 CD1 PHE A 14 -3.802 1.269 3.922 1.00 0.22 C ATOM 218 CD2 PHE A 14 -3.557 -0.038 1.947 1.00 0.13 C ATOM 219 CE1 PHE A 14 -2.567 0.846 4.360 1.00 0.25 C ATOM 220 CE2 PHE A 14 -2.321 -0.466 2.379 1.00 0.13 C ATOM 221 CZ PHE A 14 -1.847 -0.060 3.609 1.00 0.19 C ATOM 222 H PHE A 14 -6.741 -1.248 1.482 1.00 0.15 H ATOM 223 HA PHE A 14 -6.871 0.533 3.818 1.00 0.12 H ATOM 224 HB2 PHE A 14 -5.640 1.287 1.157 1.00 0.16 H ATOM 225 HB3 PHE A 14 -5.781 2.318 2.573 1.00 0.19 H ATOM 226 HD1 PHE A 14 -4.384 1.953 4.524 1.00 0.28 H ATOM 227 HD2 PHE A 14 -3.946 -0.384 1.001 1.00 0.17 H ATOM 228 HE1 PHE A 14 -2.182 1.192 5.307 1.00 0.34 H ATOM 229 HE2 PHE A 14 -1.741 -1.146 1.773 1.00 0.16 H ATOM 230 HZ PHE A 14 -0.886 -0.409 3.959 1.00 0.22 H ATOM 231 N THR A 15 -8.666 2.003 2.695 1.00 0.13 N ATOM 232 CA THR A 15 -9.889 2.603 2.185 1.00 0.16 C ATOM 233 C THR A 15 -9.572 3.751 1.223 1.00 0.14 C ATOM 234 O THR A 15 -10.420 4.174 0.437 1.00 0.28 O ATOM 235 CB THR A 15 -10.762 3.124 3.347 1.00 0.25 C ATOM 236 OG1 THR A 15 -10.896 2.104 4.347 1.00 1.03 O ATOM 237 CG2 THR A 15 -12.145 3.536 2.862 1.00 1.16 C ATOM 238 H THR A 15 -8.245 2.389 3.495 1.00 0.17 H ATOM 239 HA THR A 15 -10.442 1.842 1.655 1.00 0.21 H ATOM 240 HB THR A 15 -10.277 3.986 3.783 1.00 0.94 H ATOM 241 HG1 THR A 15 -10.020 1.811 4.621 1.00 1.65 H ATOM 242 HG21 THR A 15 -12.643 2.682 2.425 1.00 1.64 H ATOM 243 HG22 THR A 15 -12.050 4.315 2.121 1.00 1.79 H ATOM 244 HG23 THR A 15 -12.726 3.901 3.697 1.00 1.78 H ATOM 245 N ARG A 16 -8.341 4.248 1.279 1.00 0.12 N ATOM 246 CA ARG A 16 -7.929 5.345 0.415 1.00 0.14 C ATOM 247 C ARG A 16 -6.711 4.950 -0.411 1.00 0.12 C ATOM 248 O ARG A 16 -5.833 4.218 0.056 1.00 0.13 O ATOM 249 CB ARG A 16 -7.591 6.587 1.234 1.00 0.24 C ATOM 250 CG ARG A 16 -8.699 7.051 2.164 1.00 0.36 C ATOM 251 CD ARG A 16 -8.373 8.411 2.759 1.00 1.34 C ATOM 252 NE ARG A 16 -6.928 8.606 2.884 1.00 2.17 N ATOM 253 CZ ARG A 16 -6.210 8.236 3.941 1.00 3.16 C ATOM 254 NH1 ARG A 16 -6.802 7.700 5.004 1.00 3.58 N1+ ATOM 255 NH2 ARG A 16 -4.896 8.406 3.929 1.00 4.11 N ATOM 256 H ARG A 16 -7.696 3.865 1.909 1.00 0.20 H ATOM 257 HA ARG A 16 -8.748 5.568 -0.250 1.00 0.21 H ATOM 258 HB2 ARG A 16 -6.720 6.379 1.836 1.00 0.30 H ATOM 259 HB3 ARG A 16 -7.362 7.397 0.558 1.00 0.30 H ATOM 260 HG2 ARG A 16 -9.620 7.119 1.607 1.00 0.83 H ATOM 261 HG3 ARG A 16 -8.810 6.334 2.964 1.00 0.87 H ATOM 262 HD2 ARG A 16 -8.779 9.182 2.119 1.00 1.89 H ATOM 263 HD3 ARG A 16 -8.825 8.480 3.736 1.00 1.81 H ATOM 264 HE ARG A 16 -6.462 9.018 2.113 1.00 2.42 H ATOM 265 HH11 ARG A 16 -7.799 7.575 5.018 1.00 3.48 H ATOM 266 HH12 ARG A 16 -6.257 7.415 5.795 1.00 4.31 H ATOM 267 HH21 ARG A 16 -4.444 8.821 3.122 1.00 4.27 H ATOM 268 HH22 ARG A 16 -4.337 8.094 4.709 1.00 4.85 H ATOM 269 N SER A 17 -6.664 5.462 -1.634 1.00 0.15 N ATOM 270 CA SER A 17 -5.591 5.151 -2.563 1.00 0.18 C ATOM 271 C SER A 17 -4.291 5.831 -2.148 1.00 0.15 C ATOM 272 O SER A 17 -3.206 5.295 -2.364 1.00 0.17 O ATOM 273 CB SER A 17 -5.998 5.589 -3.970 1.00 0.27 C ATOM 274 OG SER A 17 -6.538 6.899 -3.949 1.00 0.75 O ATOM 275 H SER A 17 -7.374 6.075 -1.923 1.00 0.18 H ATOM 276 HA SER A 17 -5.445 4.081 -2.556 1.00 0.21 H ATOM 277 HB2 SER A 17 -5.133 5.577 -4.614 1.00 0.72 H ATOM 278 HB3 SER A 17 -6.744 4.911 -4.356 1.00 0.59 H ATOM 279 HG SER A 17 -5.855 7.531 -4.219 1.00 1.36 H ATOM 280 N ASP A 18 -4.409 7.007 -1.538 1.00 0.14 N ATOM 281 CA ASP A 18 -3.238 7.753 -1.083 1.00 0.16 C ATOM 282 C ASP A 18 -2.595 7.055 0.108 1.00 0.11 C ATOM 283 O ASP A 18 -1.384 7.145 0.317 1.00 0.12 O ATOM 284 CB ASP A 18 -3.609 9.193 -0.708 1.00 0.25 C ATOM 285 CG ASP A 18 -4.483 9.287 0.532 1.00 1.21 C ATOM 286 OD1 ASP A 18 -5.722 9.183 0.402 1.00 1.91 O ATOM 287 OD2 ASP A 18 -3.943 9.456 1.641 1.00 1.79 O1- ATOM 288 H ASP A 18 -5.304 7.388 -1.401 1.00 0.15 H ATOM 289 HA ASP A 18 -2.526 7.773 -1.895 1.00 0.20 H ATOM 290 HB2 ASP A 18 -2.705 9.749 -0.522 1.00 0.97 H ATOM 291 HB3 ASP A 18 -4.138 9.647 -1.533 1.00 1.05 H ATOM 292 N GLU A 19 -3.415 6.354 0.879 1.00 0.10 N ATOM 293 CA GLU A 19 -2.931 5.594 2.021 1.00 0.10 C ATOM 294 C GLU A 19 -2.174 4.365 1.528 1.00 0.08 C ATOM 295 O GLU A 19 -1.110 4.022 2.049 1.00 0.10 O ATOM 296 CB GLU A 19 -4.100 5.181 2.918 1.00 0.16 C ATOM 297 CG GLU A 19 -3.678 4.742 4.307 1.00 0.63 C ATOM 298 CD GLU A 19 -2.978 5.842 5.080 1.00 0.72 C ATOM 299 OE1 GLU A 19 -3.667 6.728 5.624 1.00 0.94 O ATOM 300 OE2 GLU A 19 -1.731 5.824 5.156 1.00 1.38 O1- ATOM 301 H GLU A 19 -4.369 6.352 0.674 1.00 0.12 H ATOM 302 HA GLU A 19 -2.256 6.221 2.580 1.00 0.13 H ATOM 303 HB2 GLU A 19 -4.777 6.016 3.018 1.00 0.63 H ATOM 304 HB3 GLU A 19 -4.624 4.362 2.450 1.00 0.62 H ATOM 305 HG2 GLU A 19 -4.558 4.443 4.857 1.00 1.27 H ATOM 306 HG3 GLU A 19 -3.008 3.902 4.215 1.00 1.19 H ATOM 307 N LEU A 20 -2.731 3.711 0.510 1.00 0.07 N ATOM 308 CA LEU A 20 -2.064 2.593 -0.147 1.00 0.08 C ATOM 309 C LEU A 20 -0.752 3.048 -0.776 1.00 0.08 C ATOM 310 O LEU A 20 0.270 2.374 -0.653 1.00 0.09 O ATOM 311 CB LEU A 20 -2.981 1.987 -1.215 1.00 0.10 C ATOM 312 CG LEU A 20 -2.331 0.940 -2.125 1.00 0.10 C ATOM 313 CD1 LEU A 20 -1.835 -0.250 -1.321 1.00 0.13 C ATOM 314 CD2 LEU A 20 -3.311 0.483 -3.193 1.00 0.17 C ATOM 315 H LEU A 20 -3.622 3.980 0.201 1.00 0.08 H ATOM 316 HA LEU A 20 -1.849 1.845 0.602 1.00 0.10 H ATOM 317 HB2 LEU A 20 -3.823 1.528 -0.717 1.00 0.12 H ATOM 318 HB3 LEU A 20 -3.348 2.790 -1.835 1.00 0.11 H ATOM 319 HG LEU A 20 -1.480 1.385 -2.620 1.00 0.09 H ATOM 320 HD11 LEU A 20 -2.667 -0.715 -0.817 1.00 0.84 H ATOM 321 HD12 LEU A 20 -1.111 0.084 -0.592 1.00 0.94 H ATOM 322 HD13 LEU A 20 -1.372 -0.964 -1.985 1.00 0.89 H ATOM 323 HD21 LEU A 20 -3.673 1.340 -3.741 1.00 1.00 H ATOM 324 HD22 LEU A 20 -4.142 -0.023 -2.726 1.00 1.07 H ATOM 325 HD23 LEU A 20 -2.814 -0.193 -3.871 1.00 0.98 H ATOM 326 N GLN A 21 -0.789 4.192 -1.447 1.00 0.10 N ATOM 327 CA GLN A 21 0.404 4.766 -2.060 1.00 0.12 C ATOM 328 C GLN A 21 1.477 5.022 -1.002 1.00 0.09 C ATOM 329 O GLN A 21 2.643 4.658 -1.178 1.00 0.11 O ATOM 330 CB GLN A 21 0.043 6.067 -2.784 1.00 0.19 C ATOM 331 CG GLN A 21 1.206 6.705 -3.527 1.00 1.06 C ATOM 332 CD GLN A 21 1.800 5.793 -4.581 1.00 1.66 C ATOM 333 OE1 GLN A 21 1.112 4.943 -5.150 1.00 2.34 O ATOM 334 NE2 GLN A 21 3.080 5.970 -4.857 1.00 2.22 N ATOM 335 H GLN A 21 -1.650 4.659 -1.546 1.00 0.11 H ATOM 336 HA GLN A 21 0.784 4.056 -2.777 1.00 0.14 H ATOM 337 HB2 GLN A 21 -0.739 5.860 -3.499 1.00 0.71 H ATOM 338 HB3 GLN A 21 -0.325 6.777 -2.058 1.00 0.89 H ATOM 339 HG2 GLN A 21 0.855 7.605 -4.008 1.00 1.72 H ATOM 340 HG3 GLN A 21 1.976 6.957 -2.813 1.00 1.75 H ATOM 341 HE21 GLN A 21 3.566 6.673 -4.372 1.00 2.35 H ATOM 342 HE22 GLN A 21 3.492 5.399 -5.538 1.00 2.82 H ATOM 343 N ARG A 22 1.065 5.637 0.104 1.00 0.11 N ATOM 344 CA ARG A 22 1.949 5.876 1.239 1.00 0.15 C ATOM 345 C ARG A 22 2.558 4.565 1.719 1.00 0.11 C ATOM 346 O ARG A 22 3.763 4.473 1.958 1.00 0.15 O ATOM 347 CB ARG A 22 1.168 6.538 2.378 1.00 0.25 C ATOM 348 CG ARG A 22 1.955 6.671 3.673 1.00 0.37 C ATOM 349 CD ARG A 22 1.069 7.157 4.809 1.00 0.51 C ATOM 350 NE ARG A 22 1.761 7.134 6.096 1.00 1.09 N ATOM 351 CZ ARG A 22 1.197 6.746 7.240 1.00 1.51 C ATOM 352 NH1 ARG A 22 -0.068 6.337 7.262 1.00 1.42 N1+ ATOM 353 NH2 ARG A 22 1.903 6.766 8.362 1.00 2.47 N ATOM 354 H ARG A 22 0.133 5.945 0.156 1.00 0.13 H ATOM 355 HA ARG A 22 2.737 6.536 0.917 1.00 0.19 H ATOM 356 HB2 ARG A 22 0.867 7.525 2.064 1.00 0.29 H ATOM 357 HB3 ARG A 22 0.286 5.950 2.578 1.00 0.25 H ATOM 358 HG2 ARG A 22 2.366 5.707 3.936 1.00 0.34 H ATOM 359 HG3 ARG A 22 2.757 7.378 3.525 1.00 0.44 H ATOM 360 HD2 ARG A 22 0.758 8.169 4.598 1.00 1.09 H ATOM 361 HD3 ARG A 22 0.198 6.520 4.867 1.00 1.23 H ATOM 362 HE ARG A 22 2.699 7.433 6.110 1.00 1.66 H ATOM 363 HH11 ARG A 22 -0.491 6.047 8.126 1.00 1.85 H ATOM 364 HH12 ARG A 22 -0.614 6.312 6.411 1.00 1.43 H ATOM 365 HH21 ARG A 22 1.488 6.475 9.227 1.00 2.80 H ATOM 366 HH22 ARG A 22 2.862 7.071 8.350 1.00 2.99 H ATOM 367 N HIS A 23 1.713 3.555 1.844 1.00 0.10 N ATOM 368 CA HIS A 23 2.140 2.241 2.289 1.00 0.10 C ATOM 369 C HIS A 23 3.173 1.637 1.338 1.00 0.11 C ATOM 370 O HIS A 23 4.199 1.128 1.781 1.00 0.17 O ATOM 371 CB HIS A 23 0.923 1.317 2.421 1.00 0.12 C ATOM 372 CG HIS A 23 1.276 -0.130 2.544 1.00 0.12 C ATOM 373 ND1 HIS A 23 1.529 -0.783 3.746 1.00 0.17 N ATOM 374 CD2 HIS A 23 1.461 -1.048 1.568 1.00 0.12 C ATOM 375 CE1 HIS A 23 1.869 -2.052 3.454 1.00 0.19 C ATOM 376 NE2 HIS A 23 1.834 -2.227 2.158 1.00 0.15 N ATOM 377 H HIS A 23 0.764 3.697 1.624 1.00 0.14 H ATOM 378 HA HIS A 23 2.594 2.356 3.261 1.00 0.13 H ATOM 379 HB2 HIS A 23 0.358 1.598 3.293 1.00 0.14 H ATOM 380 HB3 HIS A 23 0.302 1.433 1.544 1.00 0.12 H ATOM 381 HD1 HIS A 23 1.475 -0.389 4.646 1.00 0.21 H ATOM 382 HD2 HIS A 23 1.322 -0.894 0.508 1.00 0.12 H ATOM 383 HE1 HIS A 23 2.117 -2.812 4.179 1.00 0.24 H ATOM 384 N LYS A 24 2.904 1.712 0.037 1.00 0.10 N ATOM 385 CA LYS A 24 3.774 1.102 -0.973 1.00 0.14 C ATOM 386 C LYS A 24 5.206 1.613 -0.876 1.00 0.15 C ATOM 387 O LYS A 24 6.150 0.923 -1.275 1.00 0.17 O ATOM 388 CB LYS A 24 3.241 1.358 -2.382 1.00 0.22 C ATOM 389 CG LYS A 24 1.987 0.573 -2.717 1.00 0.28 C ATOM 390 CD LYS A 24 1.592 0.763 -4.170 1.00 1.08 C ATOM 391 CE LYS A 24 0.478 -0.187 -4.567 1.00 1.23 C ATOM 392 NZ LYS A 24 0.910 -1.607 -4.495 1.00 1.43 N1+ ATOM 393 H LYS A 24 2.092 2.187 -0.255 1.00 0.09 H ATOM 394 HA LYS A 24 3.781 0.039 -0.794 1.00 0.17 H ATOM 395 HB2 LYS A 24 3.018 2.409 -2.484 1.00 0.23 H ATOM 396 HB3 LYS A 24 4.008 1.092 -3.095 1.00 0.26 H ATOM 397 HG2 LYS A 24 2.166 -0.475 -2.538 1.00 0.94 H ATOM 398 HG3 LYS A 24 1.179 0.916 -2.088 1.00 0.90 H ATOM 399 HD2 LYS A 24 1.253 1.779 -4.311 1.00 1.64 H ATOM 400 HD3 LYS A 24 2.453 0.578 -4.795 1.00 1.77 H ATOM 401 HE2 LYS A 24 -0.358 -0.041 -3.899 1.00 1.51 H ATOM 402 HE3 LYS A 24 0.172 0.038 -5.577 1.00 1.51 H ATOM 403 HZ1 LYS A 24 1.274 -1.828 -3.546 1.00 2.01 H ATOM 404 HZ2 LYS A 24 1.660 -1.790 -5.191 1.00 1.71 H ATOM 405 HZ3 LYS A 24 0.106 -2.237 -4.698 1.00 1.73 H ATOM 406 N ARG A 25 5.366 2.811 -0.329 1.00 0.17 N ATOM 407 CA ARG A 25 6.684 3.410 -0.169 1.00 0.22 C ATOM 408 C ARG A 25 7.579 2.552 0.725 1.00 0.25 C ATOM 409 O ARG A 25 8.804 2.653 0.662 1.00 0.39 O ATOM 410 CB ARG A 25 6.560 4.813 0.417 1.00 0.33 C ATOM 411 CG ARG A 25 5.690 5.739 -0.411 1.00 0.46 C ATOM 412 CD ARG A 25 5.510 7.085 0.266 1.00 0.63 C ATOM 413 NE ARG A 25 4.524 7.909 -0.426 1.00 1.40 N ATOM 414 CZ ARG A 25 3.738 8.797 0.176 1.00 2.00 C ATOM 415 NH1 ARG A 25 3.836 9.001 1.485 1.00 1.85 N1+ ATOM 416 NH2 ARG A 25 2.852 9.481 -0.533 1.00 2.90 N ATOM 417 H ARG A 25 4.572 3.310 -0.027 1.00 0.16 H ATOM 418 HA ARG A 25 7.135 3.477 -1.147 1.00 0.26 H ATOM 419 HB2 ARG A 25 6.130 4.739 1.405 1.00 0.40 H ATOM 420 HB3 ARG A 25 7.545 5.249 0.493 1.00 0.34 H ATOM 421 HG2 ARG A 25 6.156 5.889 -1.373 1.00 0.50 H ATOM 422 HG3 ARG A 25 4.722 5.284 -0.546 1.00 0.50 H ATOM 423 HD2 ARG A 25 5.182 6.921 1.282 1.00 0.84 H ATOM 424 HD3 ARG A 25 6.458 7.602 0.274 1.00 1.09 H ATOM 425 HE ARG A 25 4.441 7.782 -1.399 1.00 1.71 H ATOM 426 HH11 ARG A 25 3.241 9.672 1.938 1.00 2.34 H ATOM 427 HH12 ARG A 25 4.509 8.490 2.027 1.00 1.42 H ATOM 428 HH21 ARG A 25 2.774 9.333 -1.524 1.00 3.18 H ATOM 429 HH22 ARG A 25 2.254 10.153 -0.085 1.00 3.37 H ATOM 430 N THR A 26 6.968 1.699 1.538 1.00 0.25 N ATOM 431 CA THR A 26 7.721 0.852 2.453 1.00 0.32 C ATOM 432 C THR A 26 8.304 -0.361 1.730 1.00 0.33 C ATOM 433 O THR A 26 9.249 -0.983 2.208 1.00 0.47 O ATOM 434 CB THR A 26 6.852 0.370 3.634 1.00 0.41 C ATOM 435 OG1 THR A 26 5.759 -0.422 3.153 1.00 0.83 O ATOM 436 CG2 THR A 26 6.316 1.549 4.432 1.00 0.59 C ATOM 437 H THR A 26 5.988 1.638 1.522 1.00 0.26 H ATOM 438 HA THR A 26 8.533 1.440 2.851 1.00 0.36 H ATOM 439 HB THR A 26 7.464 -0.238 4.284 1.00 0.80 H ATOM 440 HG1 THR A 26 5.055 0.162 2.832 1.00 0.87 H ATOM 441 HG21 THR A 26 5.739 1.185 5.269 1.00 1.25 H ATOM 442 HG22 THR A 26 5.686 2.157 3.798 1.00 1.23 H ATOM 443 HG23 THR A 26 7.142 2.143 4.796 1.00 1.11 H ATOM 444 N HIS A 27 7.731 -0.707 0.581 1.00 0.28 N ATOM 445 CA HIS A 27 8.260 -1.802 -0.222 1.00 0.30 C ATOM 446 C HIS A 27 9.321 -1.278 -1.177 1.00 0.34 C ATOM 447 O HIS A 27 10.351 -1.915 -1.391 1.00 0.38 O ATOM 448 CB HIS A 27 7.163 -2.496 -1.036 1.00 0.30 C ATOM 449 CG HIS A 27 6.109 -3.189 -0.231 1.00 0.27 C ATOM 450 ND1 HIS A 27 6.312 -4.353 0.511 1.00 0.36 N ATOM 451 CD2 HIS A 27 4.794 -2.891 -0.106 1.00 0.21 C ATOM 452 CE1 HIS A 27 5.126 -4.714 1.040 1.00 0.34 C ATOM 453 NE2 HIS A 27 4.209 -3.853 0.685 1.00 0.24 N ATOM 454 H HIS A 27 6.943 -0.215 0.267 1.00 0.30 H ATOM 455 HA HIS A 27 8.712 -2.519 0.448 1.00 0.32 H ATOM 456 HB2 HIS A 27 6.667 -1.758 -1.647 1.00 0.29 H ATOM 457 HB3 HIS A 27 7.623 -3.234 -1.680 1.00 0.36 H ATOM 458 HD1 HIS A 27 7.167 -4.826 0.629 1.00 0.43 H ATOM 459 HD2 HIS A 27 4.282 -2.058 -0.559 1.00 0.20 H ATOM 460 HE1 HIS A 27 4.955 -5.586 1.653 1.00 0.42 H ATOM 461 N THR A 28 9.058 -0.110 -1.753 1.00 0.39 N ATOM 462 CA THR A 28 9.971 0.488 -2.711 1.00 0.51 C ATOM 463 C THR A 28 11.203 1.062 -2.015 1.00 1.07 C ATOM 464 O THR A 28 12.283 1.136 -2.602 1.00 1.59 O ATOM 465 CB THR A 28 9.269 1.585 -3.531 1.00 1.07 C ATOM 466 OG1 THR A 28 8.609 2.512 -2.654 1.00 1.78 O ATOM 467 CG2 THR A 28 8.255 0.972 -4.491 1.00 0.82 C ATOM 468 H THR A 28 8.221 0.358 -1.536 1.00 0.38 H ATOM 469 HA THR A 28 10.290 -0.289 -3.390 1.00 0.60 H ATOM 470 HB THR A 28 10.012 2.115 -4.107 1.00 1.63 H ATOM 471 HG1 THR A 28 9.223 3.217 -2.413 1.00 2.28 H ATOM 472 HG21 THR A 28 7.776 1.755 -5.060 1.00 1.19 H ATOM 473 HG22 THR A 28 7.509 0.429 -3.930 1.00 1.47 H ATOM 474 HG23 THR A 28 8.758 0.295 -5.164 1.00 1.14 H ATOM 475 N GLY A 29 11.037 1.464 -0.764 1.00 1.75 N ATOM 476 CA GLY A 29 12.155 1.955 0.010 1.00 2.45 C ATOM 477 C GLY A 29 12.698 0.885 0.928 1.00 3.23 C ATOM 478 O GLY A 29 11.961 0.334 1.744 1.00 3.94 O ATOM 479 H GLY A 29 10.144 1.420 -0.356 1.00 2.06 H ATOM 480 HA2 GLY A 29 12.935 2.277 -0.664 1.00 2.79 H ATOM 481 HA3 GLY A 29 11.831 2.796 0.603 1.00 2.66 H ATOM 482 N GLU A 30 13.978 0.577 0.791 1.00 3.65 N ATOM 483 CA GLU A 30 14.590 -0.476 1.587 1.00 4.77 C ATOM 484 C GLU A 30 14.856 0.022 3.003 1.00 5.13 C ATOM 485 O GLU A 30 14.595 -0.684 3.978 1.00 5.68 O ATOM 486 CB GLU A 30 15.882 -0.952 0.929 1.00 5.63 C ATOM 487 CG GLU A 30 16.522 -2.141 1.617 1.00 6.09 C ATOM 488 CD GLU A 30 17.789 -2.579 0.925 1.00 6.97 C ATOM 489 OE1 GLU A 30 18.860 -2.008 1.220 1.00 7.32 O ATOM 490 OE2 GLU A 30 17.724 -3.486 0.071 1.00 7.52 O1- ATOM 491 H GLU A 30 14.528 1.074 0.149 1.00 3.53 H ATOM 492 HA GLU A 30 13.896 -1.300 1.634 1.00 5.14 H ATOM 493 HB2 GLU A 30 15.669 -1.232 -0.093 1.00 5.73 H ATOM 494 HB3 GLU A 30 16.593 -0.140 0.928 1.00 6.23 H ATOM 495 HG2 GLU A 30 16.758 -1.869 2.636 1.00 6.31 H ATOM 496 HG3 GLU A 30 15.823 -2.963 1.616 1.00 5.97 H ATOM 497 N LYS A 31 15.363 1.242 3.112 1.00 5.24 N ATOM 498 CA LYS A 31 15.593 1.859 4.410 1.00 5.99 C ATOM 499 C LYS A 31 14.610 3.007 4.636 1.00 6.17 C ATOM 500 O LYS A 31 14.984 4.181 4.673 1.00 6.59 O ATOM 501 CB LYS A 31 17.045 2.348 4.534 1.00 6.33 C ATOM 502 CG LYS A 31 17.529 3.176 3.349 1.00 6.99 C ATOM 503 CD LYS A 31 18.871 3.841 3.628 1.00 7.69 C ATOM 504 CE LYS A 31 19.970 2.826 3.909 1.00 8.59 C ATOM 505 NZ LYS A 31 20.230 1.942 2.744 1.00 8.93 N1+ ATOM 506 H LYS A 31 15.584 1.744 2.297 1.00 5.09 H ATOM 507 HA LYS A 31 15.414 1.105 5.164 1.00 6.56 H ATOM 508 HB2 LYS A 31 17.134 2.953 5.423 1.00 6.29 H ATOM 509 HB3 LYS A 31 17.693 1.489 4.631 1.00 6.50 H ATOM 510 HG2 LYS A 31 17.632 2.529 2.492 1.00 7.20 H ATOM 511 HG3 LYS A 31 16.795 3.940 3.136 1.00 7.03 H ATOM 512 HD2 LYS A 31 19.155 4.426 2.765 1.00 7.74 H ATOM 513 HD3 LYS A 31 18.766 4.490 4.485 1.00 7.76 H ATOM 514 HE2 LYS A 31 20.878 3.356 4.151 1.00 8.72 H ATOM 515 HE3 LYS A 31 19.675 2.219 4.753 1.00 9.11 H ATOM 516 HZ1 LYS A 31 21.002 1.280 2.961 1.00 9.20 H ATOM 517 HZ2 LYS A 31 20.496 2.507 1.915 1.00 8.97 H ATOM 518 HZ3 LYS A 31 19.378 1.392 2.513 1.00 9.13 H HETATM 519 N NH2 A 32 13.342 2.665 4.790 1.00 6.25 N HETATM 520 HN1 NH2 A 32 13.111 1.710 4.749 1.00 6.15 H HETATM 521 HN2 NH2 A 32 12.684 3.377 4.939 1.00 6.63 H TER 522 NH2 A 32 HETATM 523 ZN ZN A 101 2.273 -3.896 1.171 1.00 0.19 ZN