ATOM 30 N CYS A 3 0.003 -5.688 -1.386 1.00 3.02 N ATOM 31 CA CYS A 3 -1.340 -6.168 -1.109 1.00 1.23 C ATOM 32 C CYS A 3 -1.497 -6.307 0.407 1.00 71.43 C ATOM 33 O CYS A 3 -0.667 -5.852 1.193 1.00 23.22 O ATOM 34 CB CYS A 3 -1.633 -7.481 -1.836 1.00 64.53 C ATOM 35 SG CYS A 3 -3.304 -7.592 -2.579 1.00 23.34 S ATOM 36 H CYS A 3 0.647 -6.389 -1.693 1.00 43.41 H ATOM 37 HA CYS A 3 -2.027 -5.419 -1.502 1.00 12.32 H ATOM 38 HB2 CYS A 3 -0.909 -7.632 -2.638 1.00 31.15 H ATOM 39 HB3 CYS A 3 -1.525 -8.320 -1.148 1.00 1.20 H ATOM 40 N TRP A 4 -2.589 -6.952 0.801 1.00 54.04 N ATOM 41 CA TRP A 4 -2.882 -7.167 2.213 1.00 12.33 C ATOM 42 C TRP A 4 -2.782 -8.645 2.571 1.00 20.43 C ATOM 43 O TRP A 4 -2.569 -9.001 3.731 1.00 53.03 O ATOM 44 CB TRP A 4 -4.278 -6.641 2.552 1.00 51.25 C ATOM 45 CG TRP A 4 -5.372 -7.330 1.794 1.00 52.03 C ATOM 46 CD1 TRP A 4 -5.714 -7.132 0.486 1.00 21.13 C ATOM 47 CD2 TRP A 4 -6.268 -8.326 2.298 1.00 15.25 C ATOM 48 NE1 TRP A 4 -6.769 -7.945 0.148 1.00 62.10 N ATOM 49 CE2 TRP A 4 -7.127 -8.688 1.242 1.00 42.22 C ATOM 50 CE3 TRP A 4 -6.428 -8.949 3.539 1.00 12.52 C ATOM 51 CZ2 TRP A 4 -8.129 -9.643 1.391 1.00 1.21 C ATOM 52 CZ3 TRP A 4 -7.423 -9.896 3.686 1.00 54.12 C ATOM 53 CH2 TRP A 4 -8.263 -10.236 2.617 1.00 61.42 C ATOM 54 H TRP A 4 -3.214 -7.292 0.126 1.00 51.22 H ATOM 55 HA TRP A 4 -2.151 -6.618 2.789 1.00 34.44 H ATOM 56 HB2 TRP A 4 -4.463 -6.781 3.606 1.00 73.41 H ATOM 57 HB3 TRP A 4 -4.323 -5.587 2.319 1.00 14.42 H ATOM 58 HD1 TRP A 4 -5.220 -6.434 -0.172 1.00 60.32 H ATOM 59 HE1 TRP A 4 -7.194 -7.987 -0.734 1.00 71.14 H ATOM 60 HE3 TRP A 4 -5.791 -8.700 4.375 1.00 11.31 H ATOM 61 HZ2 TRP A 4 -8.784 -9.917 0.577 1.00 44.44 H ATOM 62 HZ3 TRP A 4 -7.562 -10.387 4.638 1.00 72.43 H ATOM 63 HH2 TRP A 4 -9.027 -10.981 2.777 1.00 62.43 H ATOM 64 N LYS A 5 -2.936 -9.504 1.569 1.00 31.11 N ATOM 65 CA LYS A 5 -2.862 -10.945 1.778 1.00 65.35 C ATOM 66 C LYS A 5 -1.782 -11.567 0.898 1.00 62.14 C ATOM 67 O LYS A 5 -1.180 -12.579 1.258 1.00 61.24 O ATOM 68 CB LYS A 5 -4.214 -11.595 1.479 1.00 35.21 C ATOM 69 CG LYS A 5 -4.510 -11.731 -0.005 1.00 12.35 C ATOM 70 CD LYS A 5 -4.868 -10.391 -0.626 1.00 62.24 C ATOM 71 CE LYS A 5 -6.157 -10.476 -1.429 1.00 41.12 C ATOM 72 NZ LYS A 5 -6.156 -11.639 -2.360 1.00 4.44 N1+ ATOM 73 H LYS A 5 -3.103 -9.160 0.666 1.00 15.23 H ATOM 74 HA LYS A 5 -2.609 -11.118 2.813 1.00 71.23 H ATOM 75 HB2 LYS A 5 -4.232 -12.581 1.920 1.00 22.00 H ATOM 76 HB3 LYS A 5 -4.995 -10.996 1.927 1.00 65.31 H ATOM 77 HG2 LYS A 5 -3.636 -12.125 -0.502 1.00 54.51 H ATOM 78 HG3 LYS A 5 -5.339 -12.411 -0.136 1.00 73.53 H ATOM 79 HD2 LYS A 5 -4.994 -9.661 0.159 1.00 22.33 H ATOM 80 HD3 LYS A 5 -4.065 -10.083 -1.282 1.00 14.34 H ATOM 81 HE2 LYS A 5 -6.986 -10.574 -0.745 1.00 62.22 H ATOM 82 HE3 LYS A 5 -6.269 -9.567 -2.002 1.00 61.21 H ATOM 83 HZ1 LYS A 5 -6.616 -12.456 -1.910 1.00 50.12 H ATOM 84 HZ2 LYS A 5 -5.179 -11.898 -2.606 1.00 52.22 H ATOM 85 HZ3 LYS A 5 -6.670 -11.400 -3.231 1.00 53.10 H ATOM 86 N CYS A 6 -1.540 -10.955 -0.257 1.00 14.33 N ATOM 87 CA CYS A 6 -0.533 -11.447 -1.188 1.00 4.10 C ATOM 88 C CYS A 6 0.873 -11.225 -0.636 1.00 53.11 C ATOM 89 O CYS A 6 1.314 -10.088 -0.471 1.00 31.51 O ATOM 90 CB CYS A 6 -0.676 -10.750 -2.543 1.00 33.54 C ATOM 91 SG CYS A 6 -2.331 -10.908 -3.288 1.00 30.20 S ATOM 92 H CYS A 6 -2.053 -10.151 -0.488 1.00 72.25 H ATOM 93 HA CYS A 6 -0.691 -12.506 -1.319 1.00 71.52 H ATOM 94 HB2 CYS A 6 -0.471 -9.697 -2.421 1.00 10.25 H ATOM 95 HB3 CYS A 6 0.038 -11.173 -3.234 1.00 31.23 H ATOM 96 N GLY A 7 1.571 -12.320 -0.353 1.00 23.32 N ATOM 97 CA GLY A 7 2.919 -12.224 0.177 1.00 31.31 C ATOM 98 C GLY A 7 3.932 -11.839 -0.882 1.00 44.12 C ATOM 99 O GLY A 7 5.110 -11.639 -0.583 1.00 32.43 O ATOM 100 H GLY A 7 1.168 -13.201 -0.505 1.00 2.31 H ATOM 101 HA2 GLY A 7 2.934 -11.482 0.961 1.00 35.45 H ATOM 102 HA3 GLY A 7 3.198 -13.181 0.595 1.00 41.43 H ATOM 103 N LYS A 8 3.476 -11.735 -2.126 1.00 32.24 N ATOM 104 CA LYS A 8 4.350 -11.372 -3.234 1.00 41.25 C ATOM 105 C LYS A 8 4.628 -9.872 -3.239 1.00 50.02 C ATOM 106 O LYS A 8 5.733 -9.438 -3.562 1.00 41.03 O ATOM 107 CB LYS A 8 3.720 -11.789 -4.565 1.00 42.24 C ATOM 108 CG LYS A 8 2.267 -11.370 -4.708 1.00 42.13 C ATOM 109 CD LYS A 8 1.833 -11.350 -6.164 1.00 63.04 C ATOM 110 CE LYS A 8 2.265 -10.067 -6.857 1.00 44.23 C ATOM 111 NZ LYS A 8 1.682 -8.861 -6.206 1.00 70.32 N1+ ATOM 112 H LYS A 8 2.526 -11.907 -2.302 1.00 4.41 H ATOM 113 HA LYS A 8 5.284 -11.898 -3.107 1.00 73.31 H ATOM 114 HB2 LYS A 8 4.283 -11.342 -5.372 1.00 30.22 H ATOM 115 HB3 LYS A 8 3.773 -12.864 -4.654 1.00 21.55 H ATOM 116 HG2 LYS A 8 1.646 -12.069 -4.168 1.00 54.43 H ATOM 117 HG3 LYS A 8 2.145 -10.380 -4.292 1.00 71.00 H ATOM 118 HD2 LYS A 8 2.280 -12.190 -6.676 1.00 11.31 H ATOM 119 HD3 LYS A 8 0.756 -11.429 -6.211 1.00 63.11 H ATOM 120 HE2 LYS A 8 3.342 -9.999 -6.822 1.00 12.00 H ATOM 121 HE3 LYS A 8 1.941 -10.102 -7.887 1.00 34.33 H ATOM 122 HZ1 LYS A 8 1.480 -8.132 -6.920 1.00 71.52 H ATOM 123 HZ2 LYS A 8 2.350 -8.473 -5.510 1.00 52.43 H ATOM 124 HZ3 LYS A 8 0.797 -9.110 -5.720 1.00 61.32 H ATOM 125 N GLU A 9 3.618 -9.086 -2.878 1.00 23.43 N ATOM 126 CA GLU A 9 3.756 -7.635 -2.840 1.00 70.23 C ATOM 127 C GLU A 9 4.207 -7.096 -4.195 1.00 33.31 C ATOM 128 O GLU A 9 5.399 -7.059 -4.495 1.00 3.44 O ATOM 129 CB GLU A 9 4.755 -7.223 -1.757 1.00 61.21 C ATOM 130 CG GLU A 9 4.218 -7.375 -0.344 1.00 13.40 C ATOM 131 CD GLU A 9 4.612 -8.694 0.292 1.00 54.32 C ATOM 132 OE1 GLU A 9 5.749 -9.151 0.052 1.00 0.34 O ATOM 133 OE2 GLU A 9 3.783 -9.269 1.028 1.00 62.01 O ATOM 134 H GLU A 9 2.761 -9.492 -2.631 1.00 61.00 H ATOM 135 HA GLU A 9 2.790 -7.216 -2.603 1.00 73.44 H ATOM 136 HB2 GLU A 9 5.641 -7.833 -1.851 1.00 24.31 H ATOM 137 HB3 GLU A 9 5.024 -6.188 -1.908 1.00 63.21 H ATOM 138 HG2 GLU A 9 4.605 -6.570 0.263 1.00 24.41 H ATOM 139 HG3 GLU A 9 3.140 -7.314 -0.374 1.00 53.10 H ATOM 140 N GLY A 10 3.242 -6.680 -5.011 1.00 25.44 N ATOM 141 CA GLY A 10 3.559 -6.150 -6.324 1.00 22.02 C ATOM 142 C GLY A 10 2.486 -5.216 -6.846 1.00 11.41 C ATOM 143 O GLY A 10 2.789 -4.168 -7.418 1.00 60.23 O ATOM 144 H GLY A 10 2.308 -6.734 -4.718 1.00 65.32 H ATOM 145 HA2 GLY A 10 4.494 -5.612 -6.267 1.00 73.20 H ATOM 146 HA3 GLY A 10 3.670 -6.973 -7.014 1.00 64.05 H ATOM 147 N HIS A 11 1.227 -5.595 -6.650 1.00 51.23 N ATOM 148 CA HIS A 11 0.104 -4.783 -7.107 1.00 23.10 C ATOM 149 C HIS A 11 -0.668 -4.209 -5.923 1.00 73.40 C ATOM 150 O HIS A 11 -0.260 -4.361 -4.772 1.00 41.01 O ATOM 151 CB HIS A 11 -0.830 -5.615 -7.986 1.00 31.55 C ATOM 152 CG HIS A 11 -1.321 -6.865 -7.322 1.00 63.40 C ATOM 153 ND1 HIS A 11 -0.846 -8.121 -7.638 1.00 32.03 N ATOM 154 CD2 HIS A 11 -2.248 -7.048 -6.353 1.00 54.24 C ATOM 155 CE1 HIS A 11 -1.462 -9.022 -6.893 1.00 51.12 C ATOM 156 NE2 HIS A 11 -2.318 -8.397 -6.105 1.00 2.41 N ATOM 157 H HIS A 11 1.049 -6.440 -6.188 1.00 11.13 H ATOM 158 HA HIS A 11 0.501 -3.967 -7.691 1.00 43.12 H ATOM 159 HB2 HIS A 11 -1.692 -5.020 -8.248 1.00 42.23 H ATOM 160 HB3 HIS A 11 -0.307 -5.901 -8.887 1.00 51.31 H ATOM 161 HD1 HIS A 11 -0.161 -8.322 -8.309 1.00 14.14 H ATOM 162 HD2 HIS A 11 -2.828 -6.276 -5.866 1.00 23.10 H ATOM 163 HE1 HIS A 11 -1.295 -10.088 -6.923 1.00 23.11 H ATOM 164 N GLN A 12 -1.785 -3.550 -6.215 1.00 20.22 N ATOM 165 CA GLN A 12 -2.613 -2.953 -5.174 1.00 0.12 C ATOM 166 C GLN A 12 -3.825 -3.828 -4.873 1.00 20.41 C ATOM 167 O GLN A 12 -4.352 -4.501 -5.759 1.00 10.24 O ATOM 168 CB GLN A 12 -3.071 -1.556 -5.596 1.00 5.43 C ATOM 169 CG GLN A 12 -4.168 -0.983 -4.714 1.00 11.42 C ATOM 170 CD GLN A 12 -4.151 0.533 -4.670 1.00 65.43 C ATOM 171 OE1 GLN A 12 -3.377 1.135 -3.926 1.00 24.14 O ATOM 172 NE2 GLN A 12 -5.006 1.158 -5.471 1.00 2.12 N ATOM 173 H GLN A 12 -2.058 -3.463 -7.151 1.00 61.33 H ATOM 174 HA GLN A 12 -2.013 -2.871 -4.280 1.00 54.40 H ATOM 175 HB2 GLN A 12 -2.224 -0.887 -5.561 1.00 2.54 H ATOM 176 HB3 GLN A 12 -3.441 -1.602 -6.609 1.00 42.13 H ATOM 177 HG2 GLN A 12 -5.125 -1.305 -5.097 1.00 11.14 H ATOM 178 HG3 GLN A 12 -4.038 -1.359 -3.710 1.00 11.22 H ATOM 179 HE21 GLN A 12 -5.593 0.613 -6.036 1.00 13.11 H ATOM 180 HE22 GLN A 12 -5.016 2.137 -5.462 1.00 54.04 H ATOM 181 N MET A 13 -4.261 -3.815 -3.618 1.00 34.13 N ATOM 182 CA MET A 13 -5.412 -4.608 -3.201 1.00 12.23 C ATOM 183 C MET A 13 -6.624 -4.311 -4.078 1.00 41.44 C ATOM 184 O MET A 13 -7.316 -5.224 -4.529 1.00 14.44 O ATOM 185 CB MET A 13 -5.748 -4.326 -1.735 1.00 33.30 C ATOM 186 CG MET A 13 -5.942 -2.850 -1.429 1.00 24.05 C ATOM 187 SD MET A 13 -6.053 -2.517 0.340 1.00 54.40 S ATOM 188 CE MET A 13 -7.827 -2.580 0.585 1.00 45.30 C ATOM 189 H MET A 13 -3.800 -3.259 -2.956 1.00 4.21 H ATOM 190 HA MET A 13 -5.152 -5.650 -3.307 1.00 73.22 H ATOM 191 HB2 MET A 13 -6.659 -4.847 -1.480 1.00 72.04 H ATOM 192 HB3 MET A 13 -4.945 -4.698 -1.116 1.00 15.23 H ATOM 193 HG2 MET A 13 -5.105 -2.299 -1.831 1.00 63.44 H ATOM 194 HG3 MET A 13 -6.852 -2.515 -1.903 1.00 11.32 H ATOM 195 HE1 MET A 13 -8.196 -1.588 0.800 1.00 40.12 H ATOM 196 HE2 MET A 13 -8.300 -2.954 -0.310 1.00 72.33 H ATOM 197 HE3 MET A 13 -8.052 -3.235 1.414 1.00 61.33 H ATOM 198 N LYS A 14 -6.875 -3.028 -4.318 1.00 1.00 N ATOM 199 CA LYS A 14 -8.002 -2.610 -5.143 1.00 13.54 C ATOM 200 C LYS A 14 -7.951 -3.277 -6.513 1.00 73.11 C ATOM 201 O LYS A 14 -8.987 -3.595 -7.098 1.00 42.01 O ATOM 202 CB LYS A 14 -8.005 -1.088 -5.305 1.00 11.25 C ATOM 203 CG LYS A 14 -9.309 -0.537 -5.855 1.00 71.13 C ATOM 204 CD LYS A 14 -9.351 -0.615 -7.372 1.00 42.02 C ATOM 205 CE LYS A 14 -10.099 0.566 -7.971 1.00 10.34 C ATOM 206 NZ LYS A 14 -11.574 0.369 -7.926 1.00 73.41 N1+ ATOM 207 H LYS A 14 -6.286 -2.346 -3.931 1.00 55.50 H ATOM 208 HA LYS A 14 -8.910 -2.911 -4.642 1.00 23.51 H ATOM 209 HB2 LYS A 14 -7.826 -0.635 -4.341 1.00 2.24 H ATOM 210 HB3 LYS A 14 -7.208 -0.808 -5.978 1.00 23.00 H ATOM 211 HG2 LYS A 14 -10.130 -1.112 -5.454 1.00 14.34 H ATOM 212 HG3 LYS A 14 -9.409 0.496 -5.554 1.00 2.10 H ATOM 213 HD2 LYS A 14 -8.340 -0.616 -7.752 1.00 40.11 H ATOM 214 HD3 LYS A 14 -9.848 -1.530 -7.664 1.00 4.35 H ATOM 215 HE2 LYS A 14 -9.847 1.455 -7.413 1.00 43.32 H ATOM 216 HE3 LYS A 14 -9.791 0.687 -8.999 1.00 32.12 H ATOM 217 HZ1 LYS A 14 -11.805 -0.466 -7.350 1.00 74.22 H ATOM 218 HZ2 LYS A 14 -11.945 0.226 -8.887 1.00 62.21 H ATOM 219 HZ3 LYS A 14 -12.034 1.203 -7.509 1.00 35.41 H ATOM 220 N ASP A 15 -6.741 -3.488 -7.019 1.00 10.23 N ATOM 221 CA ASP A 15 -6.555 -4.120 -8.320 1.00 33.24 C ATOM 222 C ASP A 15 -6.200 -5.595 -8.161 1.00 32.31 C ATOM 223 O ASP A 15 -5.825 -6.262 -9.126 1.00 3.22 O ATOM 224 CB ASP A 15 -5.460 -3.401 -9.108 1.00 61.14 C ATOM 225 CG ASP A 15 -5.627 -3.559 -10.607 1.00 24.41 C ATOM 226 OD1 ASP A 15 -6.778 -3.491 -11.086 1.00 4.12 O ATOM 227 OD2 ASP A 15 -4.606 -3.753 -11.301 1.00 11.24 O ATOM 228 H ASP A 15 -5.953 -3.212 -6.504 1.00 54.13 H ATOM 229 HA ASP A 15 -7.486 -4.043 -8.862 1.00 23.34 H ATOM 230 HB2 ASP A 15 -5.487 -2.347 -8.871 1.00 73.35 H ATOM 231 HB3 ASP A 15 -4.499 -3.804 -8.826 1.00 65.43 H ATOM 232 N CYS A 16 -6.320 -6.099 -6.937 1.00 72.22 N ATOM 233 CA CYS A 16 -6.011 -7.495 -6.651 1.00 2.35 C ATOM 234 C CYS A 16 -7.073 -8.419 -7.238 1.00 33.22 C ATOM 235 O CYS A 16 -8.250 -8.064 -7.312 1.00 51.32 O ATOM 236 CB CYS A 16 -5.905 -7.716 -5.140 1.00 51.43 C ATOM 237 SG CYS A 16 -5.439 -9.412 -4.668 1.00 5.12 S ATOM 238 H CYS A 16 -6.624 -5.518 -6.208 1.00 54.20 H ATOM 239 HA CYS A 16 -5.060 -7.724 -7.106 1.00 62.25 H ATOM 240 HB2 CYS A 16 -5.159 -7.046 -4.738 1.00 24.32 H ATOM 241 HB3 CYS A 16 -6.860 -7.498 -4.685 1.00 4.54 H ATOM 242 N THR A 17 -6.650 -9.609 -7.654 1.00 52.21 N ATOM 243 CA THR A 17 -7.564 -10.584 -8.235 1.00 64.44 C ATOM 244 C THR A 17 -8.184 -11.467 -7.158 1.00 40.22 C ATOM 245 O THR A 17 -8.191 -12.692 -7.275 1.00 53.43 O ATOM 246 CB THR A 17 -6.849 -11.478 -9.267 1.00 31.25 C ATOM 247 OG1 THR A 17 -5.985 -12.403 -8.598 1.00 25.15 O ATOM 248 CG2 THR A 17 -6.042 -10.638 -10.244 1.00 43.31 C ATOM 249 H THR A 17 -5.700 -9.834 -7.568 1.00 54.12 H ATOM 250 HA THR A 17 -8.350 -10.044 -8.742 1.00 73.30 H ATOM 251 HB THR A 17 -7.595 -12.030 -9.820 1.00 72.31 H ATOM 252 HG1 THR A 17 -6.500 -13.144 -8.270 1.00 14.24 H ATOM 253 HG21 THR A 17 -5.361 -10.004 -9.696 1.00 64.22 H ATOM 254 HG22 THR A 17 -6.711 -10.025 -10.830 1.00 4.42 H ATOM 255 HG23 THR A 17 -5.481 -11.287 -10.900 1.00 32.22 H