ATOM 30 N CYS A 3 0.076 -5.478 -2.413 1.00 12.20 N ATOM 31 CA CYS A 3 -1.180 -5.980 -1.882 1.00 70.00 C ATOM 32 C CYS A 3 -1.087 -5.988 -0.355 1.00 11.21 C ATOM 33 O CYS A 3 -0.154 -5.454 0.244 1.00 0.54 O ATOM 34 CB CYS A 3 -1.517 -7.364 -2.440 1.00 60.13 C ATOM 35 SG CYS A 3 -3.276 -7.602 -2.893 1.00 30.21 S ATOM 36 H CYS A 3 0.668 -6.171 -2.825 1.00 14.50 H ATOM 37 HA CYS A 3 -1.958 -5.296 -2.219 1.00 15.41 H ATOM 38 HB2 CYS A 3 -0.921 -7.561 -3.332 1.00 13.33 H ATOM 39 HB3 CYS A 3 -1.261 -8.132 -1.710 1.00 60.03 H ATOM 40 N TRP A 4 -2.083 -6.610 0.265 1.00 70.42 N ATOM 41 CA TRP A 4 -2.138 -6.704 1.719 1.00 13.13 C ATOM 42 C TRP A 4 -2.011 -8.153 2.177 1.00 42.31 C ATOM 43 O TRP A 4 -1.619 -8.424 3.312 1.00 13.23 O ATOM 44 CB TRP A 4 -3.446 -6.105 2.240 1.00 2.11 C ATOM 45 CG TRP A 4 -4.668 -6.749 1.658 1.00 44.43 C ATOM 46 CD1 TRP A 4 -5.194 -6.535 0.416 1.00 43.42 C ATOM 47 CD2 TRP A 4 -5.516 -7.710 2.295 1.00 13.51 C ATOM 48 NE1 TRP A 4 -6.319 -7.305 0.243 1.00 44.43 N ATOM 49 CE2 TRP A 4 -6.537 -8.035 1.381 1.00 72.03 C ATOM 50 CE3 TRP A 4 -5.512 -8.328 3.548 1.00 32.21 C ATOM 51 CZ2 TRP A 4 -7.542 -8.950 1.682 1.00 33.13 C ATOM 52 CZ3 TRP A 4 -6.511 -9.236 3.846 1.00 4.10 C ATOM 53 CH2 TRP A 4 -7.514 -9.541 2.916 1.00 1.44 C ATOM 54 H TRP A 4 -2.799 -7.017 -0.268 1.00 5.01 H ATOM 55 HA TRP A 4 -1.309 -6.138 2.119 1.00 75.23 H ATOM 56 HB2 TRP A 4 -3.486 -6.222 3.313 1.00 74.24 H ATOM 57 HB3 TRP A 4 -3.474 -5.053 1.995 1.00 5.13 H ATOM 58 HD1 TRP A 4 -4.777 -5.855 -0.312 1.00 72.31 H ATOM 59 HE1 TRP A 4 -6.873 -7.328 -0.566 1.00 0.14 H ATOM 60 HE3 TRP A 4 -4.748 -8.106 4.278 1.00 65.51 H ATOM 61 HZ2 TRP A 4 -8.322 -9.196 0.976 1.00 31.03 H ATOM 62 HZ3 TRP A 4 -6.524 -9.724 4.810 1.00 51.43 H ATOM 63 HH2 TRP A 4 -8.274 -10.255 3.192 1.00 22.31 H ATOM 64 N LYS A 5 -2.343 -9.081 1.287 1.00 73.35 N ATOM 65 CA LYS A 5 -2.265 -10.504 1.598 1.00 44.41 C ATOM 66 C LYS A 5 -1.329 -11.221 0.630 1.00 32.53 C ATOM 67 O LYS A 5 -0.712 -12.228 0.979 1.00 23.04 O ATOM 68 CB LYS A 5 -3.657 -11.137 1.542 1.00 2.44 C ATOM 69 CG LYS A 5 -4.158 -11.380 0.129 1.00 33.05 C ATOM 70 CD LYS A 5 -4.579 -10.084 -0.544 1.00 31.51 C ATOM 71 CE LYS A 5 -5.954 -10.209 -1.183 1.00 23.41 C ATOM 72 NZ LYS A 5 -6.071 -11.443 -2.009 1.00 35.14 N1+ ATOM 73 H LYS A 5 -2.648 -8.803 0.397 1.00 15.11 H ATOM 74 HA LYS A 5 -1.873 -10.603 2.599 1.00 40.11 H ATOM 75 HB2 LYS A 5 -3.629 -12.084 2.061 1.00 54.24 H ATOM 76 HB3 LYS A 5 -4.357 -10.483 2.043 1.00 44.45 H ATOM 77 HG2 LYS A 5 -3.368 -11.834 -0.450 1.00 74.21 H ATOM 78 HG3 LYS A 5 -5.008 -12.047 0.169 1.00 62.22 H ATOM 79 HD2 LYS A 5 -4.609 -9.298 0.195 1.00 5.41 H ATOM 80 HD3 LYS A 5 -3.857 -9.836 -1.309 1.00 11.41 H ATOM 81 HE2 LYS A 5 -6.698 -10.237 -0.402 1.00 51.32 H ATOM 82 HE3 LYS A 5 -6.123 -9.348 -1.812 1.00 12.22 H ATOM 83 HZ1 LYS A 5 -6.709 -11.275 -2.813 1.00 14.22 H ATOM 84 HZ2 LYS A 5 -6.453 -12.222 -1.435 1.00 15.30 H ATOM 85 HZ3 LYS A 5 -5.138 -11.720 -2.372 1.00 63.35 H ATOM 86 N CYS A 6 -1.228 -10.697 -0.586 1.00 70.14 N ATOM 87 CA CYS A 6 -0.367 -11.287 -1.605 1.00 12.34 C ATOM 88 C CYS A 6 1.101 -10.990 -1.314 1.00 42.30 C ATOM 89 O CYS A 6 1.585 -9.888 -1.569 1.00 13.53 O ATOM 90 CB CYS A 6 -0.742 -10.755 -2.989 1.00 70.24 C ATOM 91 SG CYS A 6 -2.489 -11.013 -3.437 1.00 20.10 S ATOM 92 H CYS A 6 -1.746 -9.893 -0.806 1.00 24.24 H ATOM 93 HA CYS A 6 -0.516 -12.356 -1.587 1.00 2.44 H ATOM 94 HB2 CYS A 6 -0.549 -9.693 -3.023 1.00 45.22 H ATOM 95 HB3 CYS A 6 -0.135 -11.250 -3.733 1.00 70.10 H ATOM 96 N GLY A 7 1.806 -11.982 -0.779 1.00 34.51 N ATOM 97 CA GLY A 7 3.211 -11.808 -0.463 1.00 21.24 C ATOM 98 C GLY A 7 4.007 -11.272 -1.636 1.00 3.03 C ATOM 99 O GLY A 7 4.961 -10.515 -1.455 1.00 24.14 O ATOM 100 H GLY A 7 1.367 -12.840 -0.597 1.00 61.15 H ATOM 101 HA2 GLY A 7 3.300 -11.120 0.364 1.00 1.34 H ATOM 102 HA3 GLY A 7 3.623 -12.763 -0.169 1.00 42.43 H ATOM 103 N LYS A 8 3.617 -11.666 -2.843 1.00 54.42 N ATOM 104 CA LYS A 8 4.300 -11.221 -4.052 1.00 1.42 C ATOM 105 C LYS A 8 4.431 -9.701 -4.075 1.00 31.03 C ATOM 106 O LYS A 8 5.470 -9.165 -4.459 1.00 14.20 O ATOM 107 CB LYS A 8 3.544 -11.697 -5.294 1.00 43.24 C ATOM 108 CG LYS A 8 2.040 -11.512 -5.199 1.00 52.14 C ATOM 109 CD LYS A 8 1.368 -11.706 -6.548 1.00 53.33 C ATOM 110 CE LYS A 8 1.745 -10.601 -7.523 1.00 44.10 C ATOM 111 NZ LYS A 8 1.479 -9.249 -6.959 1.00 53.41 N1+ ATOM 112 H LYS A 8 2.849 -12.270 -2.923 1.00 74.04 H ATOM 113 HA LYS A 8 5.288 -11.655 -4.053 1.00 62.13 H ATOM 114 HB2 LYS A 8 3.901 -11.144 -6.151 1.00 74.44 H ATOM 115 HB3 LYS A 8 3.748 -12.747 -5.444 1.00 70.41 H ATOM 116 HG2 LYS A 8 1.640 -12.235 -4.503 1.00 45.53 H ATOM 117 HG3 LYS A 8 1.831 -10.513 -4.843 1.00 51.14 H ATOM 118 HD2 LYS A 8 1.675 -12.655 -6.961 1.00 44.12 H ATOM 119 HD3 LYS A 8 0.296 -11.702 -6.411 1.00 14.55 H ATOM 120 HE2 LYS A 8 2.797 -10.685 -7.752 1.00 54.14 H ATOM 121 HE3 LYS A 8 1.169 -10.725 -8.428 1.00 14.42 H ATOM 122 HZ1 LYS A 8 0.692 -9.294 -6.280 1.00 52.25 H ATOM 123 HZ2 LYS A 8 1.227 -8.587 -7.721 1.00 32.21 H ATOM 124 HZ3 LYS A 8 2.324 -8.892 -6.470 1.00 63.01 H ATOM 125 N GLU A 9 3.371 -9.014 -3.660 1.00 3.14 N ATOM 126 CA GLU A 9 3.370 -7.556 -3.633 1.00 12.04 C ATOM 127 C GLU A 9 3.802 -6.986 -4.981 1.00 31.43 C ATOM 128 O GLU A 9 4.983 -6.730 -5.209 1.00 24.23 O ATOM 129 CB GLU A 9 4.297 -7.043 -2.529 1.00 24.30 C ATOM 130 CG GLU A 9 3.670 -7.070 -1.145 1.00 40.24 C ATOM 131 CD GLU A 9 4.203 -5.975 -0.242 1.00 2.20 C ATOM 132 OE1 GLU A 9 5.223 -6.212 0.438 1.00 24.23 O ATOM 133 OE2 GLU A 9 3.601 -4.881 -0.215 1.00 31.42 O ATOM 134 H GLU A 9 2.572 -9.499 -3.365 1.00 41.43 H ATOM 135 HA GLU A 9 2.362 -7.229 -3.424 1.00 24.23 H ATOM 136 HB2 GLU A 9 5.187 -7.655 -2.510 1.00 45.23 H ATOM 137 HB3 GLU A 9 4.577 -6.025 -2.755 1.00 15.30 H ATOM 138 HG2 GLU A 9 2.602 -6.944 -1.246 1.00 24.13 H ATOM 139 HG3 GLU A 9 3.877 -8.026 -0.688 1.00 63.23 H ATOM 140 N GLY A 10 2.834 -6.791 -5.872 1.00 24.22 N ATOM 141 CA GLY A 10 3.134 -6.254 -7.186 1.00 71.33 C ATOM 142 C GLY A 10 1.999 -5.418 -7.743 1.00 42.32 C ATOM 143 O GLY A 10 2.218 -4.310 -8.234 1.00 11.41 O ATOM 144 H GLY A 10 1.910 -7.014 -5.635 1.00 12.25 H ATOM 145 HA2 GLY A 10 4.020 -5.641 -7.119 1.00 63.34 H ATOM 146 HA3 GLY A 10 3.326 -7.075 -7.862 1.00 50.43 H ATOM 147 N HIS A 11 0.783 -5.949 -7.669 1.00 52.32 N ATOM 148 CA HIS A 11 -0.391 -5.243 -8.171 1.00 71.42 C ATOM 149 C HIS A 11 -1.091 -4.484 -7.048 1.00 23.54 C ATOM 150 O HIS A 11 -0.602 -4.440 -5.919 1.00 41.31 O ATOM 151 CB HIS A 11 -1.364 -6.227 -8.821 1.00 33.52 C ATOM 152 CG HIS A 11 -1.747 -7.369 -7.929 1.00 45.43 C ATOM 153 ND1 HIS A 11 -1.234 -8.641 -8.073 1.00 43.51 N ATOM 154 CD2 HIS A 11 -2.596 -7.424 -6.877 1.00 2.33 C ATOM 155 CE1 HIS A 11 -1.752 -9.429 -7.149 1.00 33.03 C ATOM 156 NE2 HIS A 11 -2.582 -8.715 -6.409 1.00 43.13 N ATOM 157 H HIS A 11 0.672 -6.835 -7.267 1.00 63.32 H ATOM 158 HA HIS A 11 -0.059 -4.535 -8.915 1.00 13.21 H ATOM 159 HB2 HIS A 11 -2.268 -5.703 -9.093 1.00 52.21 H ATOM 160 HB3 HIS A 11 -0.910 -6.638 -9.711 1.00 72.50 H ATOM 161 HD1 HIS A 11 -0.587 -8.923 -8.753 1.00 34.44 H ATOM 162 HD2 HIS A 11 -3.178 -6.604 -6.478 1.00 24.52 H ATOM 163 HE1 HIS A 11 -1.535 -10.479 -7.019 1.00 12.45 H ATOM 164 N GLN A 12 -2.236 -3.890 -7.365 1.00 41.45 N ATOM 165 CA GLN A 12 -3.001 -3.132 -6.382 1.00 40.45 C ATOM 166 C GLN A 12 -4.062 -4.008 -5.725 1.00 54.25 C ATOM 167 O GLN A 12 -4.664 -4.862 -6.375 1.00 33.41 O ATOM 168 CB GLN A 12 -3.660 -1.919 -7.043 1.00 34.53 C ATOM 169 CG GLN A 12 -4.700 -1.240 -6.166 1.00 74.24 C ATOM 170 CD GLN A 12 -4.790 0.252 -6.417 1.00 52.13 C ATOM 171 OE1 GLN A 12 -3.993 0.816 -7.168 1.00 13.23 O ATOM 172 NE2 GLN A 12 -5.764 0.901 -5.789 1.00 61.23 N ATOM 173 H GLN A 12 -2.574 -3.962 -8.282 1.00 3.41 H ATOM 174 HA GLN A 12 -2.316 -2.788 -5.623 1.00 5.41 H ATOM 175 HB2 GLN A 12 -2.896 -1.196 -7.284 1.00 52.04 H ATOM 176 HB3 GLN A 12 -4.143 -2.239 -7.954 1.00 73.42 H ATOM 177 HG2 GLN A 12 -5.665 -1.682 -6.367 1.00 14.31 H ATOM 178 HG3 GLN A 12 -4.440 -1.402 -5.131 1.00 12.43 H ATOM 179 HE21 GLN A 12 -6.361 0.386 -5.206 1.00 2.33 H ATOM 180 HE22 GLN A 12 -5.845 1.866 -5.933 1.00 24.14 H ATOM 181 N MET A 13 -4.286 -3.789 -4.434 1.00 32.52 N ATOM 182 CA MET A 13 -5.276 -4.559 -3.689 1.00 70.33 C ATOM 183 C MET A 13 -6.671 -4.360 -4.273 1.00 71.13 C ATOM 184 O MET A 13 -7.460 -5.302 -4.359 1.00 44.35 O ATOM 185 CB MET A 13 -5.265 -4.153 -2.214 1.00 72.33 C ATOM 186 CG MET A 13 -5.479 -2.665 -1.992 1.00 43.21 C ATOM 187 SD MET A 13 -4.374 -1.984 -0.740 1.00 51.12 S ATOM 188 CE MET A 13 -4.915 -0.277 -0.704 1.00 11.23 C ATOM 189 H MET A 13 -3.775 -3.094 -3.970 1.00 4.11 H ATOM 190 HA MET A 13 -5.011 -5.603 -3.768 1.00 12.00 H ATOM 191 HB2 MET A 13 -6.049 -4.688 -1.700 1.00 75.31 H ATOM 192 HB3 MET A 13 -4.313 -4.426 -1.785 1.00 3.03 H ATOM 193 HG2 MET A 13 -5.306 -2.146 -2.924 1.00 30.55 H ATOM 194 HG3 MET A 13 -6.499 -2.505 -1.678 1.00 35.13 H ATOM 195 HE1 MET A 13 -5.503 -0.066 -1.585 1.00 31.43 H ATOM 196 HE2 MET A 13 -5.515 -0.108 0.178 1.00 21.54 H ATOM 197 HE3 MET A 13 -4.052 0.373 -0.683 1.00 14.42 H ATOM 198 N LYS A 14 -6.970 -3.129 -4.673 1.00 40.30 N ATOM 199 CA LYS A 14 -8.269 -2.805 -5.250 1.00 34.31 C ATOM 200 C LYS A 14 -8.518 -3.615 -6.519 1.00 12.05 C ATOM 201 O LYS A 14 -9.650 -4.008 -6.803 1.00 65.23 O ATOM 202 CB LYS A 14 -8.354 -1.310 -5.562 1.00 42.51 C ATOM 203 CG LYS A 14 -9.777 -0.797 -5.704 1.00 64.23 C ATOM 204 CD LYS A 14 -10.277 -0.932 -7.133 1.00 15.44 C ATOM 205 CE LYS A 14 -10.062 0.351 -7.922 1.00 35.14 C ATOM 206 NZ LYS A 14 -10.441 0.192 -9.353 1.00 34.31 N1+ ATOM 207 H LYS A 14 -6.299 -2.420 -4.578 1.00 52.45 H ATOM 208 HA LYS A 14 -9.027 -3.056 -4.523 1.00 21.11 H ATOM 209 HB2 LYS A 14 -7.873 -0.760 -4.766 1.00 34.21 H ATOM 210 HB3 LYS A 14 -7.830 -1.117 -6.487 1.00 71.15 H ATOM 211 HG2 LYS A 14 -10.422 -1.368 -5.053 1.00 0.30 H ATOM 212 HG3 LYS A 14 -9.804 0.245 -5.419 1.00 74.12 H ATOM 213 HD2 LYS A 14 -9.742 -1.734 -7.619 1.00 14.32 H ATOM 214 HD3 LYS A 14 -11.334 -1.160 -7.114 1.00 62.14 H ATOM 215 HE2 LYS A 14 -10.664 1.133 -7.484 1.00 20.43 H ATOM 216 HE3 LYS A 14 -9.019 0.624 -7.862 1.00 71.32 H ATOM 217 HZ1 LYS A 14 -9.797 0.742 -9.956 1.00 52.40 H ATOM 218 HZ2 LYS A 14 -11.413 0.529 -9.505 1.00 11.01 H ATOM 219 HZ3 LYS A 14 -10.386 -0.809 -9.628 1.00 71.52 H ATOM 220 N ASP A 15 -7.455 -3.861 -7.276 1.00 22.44 N ATOM 221 CA ASP A 15 -7.558 -4.627 -8.513 1.00 3.34 C ATOM 222 C ASP A 15 -7.142 -6.077 -8.290 1.00 65.43 C ATOM 223 O ASP A 15 -7.110 -6.876 -9.227 1.00 70.01 O ATOM 224 CB ASP A 15 -6.689 -3.995 -9.602 1.00 33.22 C ATOM 225 CG ASP A 15 -7.136 -4.385 -10.997 1.00 61.41 C ATOM 226 OD1 ASP A 15 -8.359 -4.506 -11.217 1.00 35.43 O ATOM 227 OD2 ASP A 15 -6.262 -4.569 -11.870 1.00 1.23 O ATOM 228 H ASP A 15 -6.579 -3.521 -6.995 1.00 52.02 H ATOM 229 HA ASP A 15 -8.589 -4.606 -8.831 1.00 31.14 H ATOM 230 HB2 ASP A 15 -6.740 -2.919 -9.515 1.00 74.55 H ATOM 231 HB3 ASP A 15 -5.666 -4.315 -9.468 1.00 13.22 H ATOM 232 N CYS A 16 -6.822 -6.412 -7.045 1.00 4.44 N ATOM 233 CA CYS A 16 -6.406 -7.765 -6.698 1.00 64.23 C ATOM 234 C CYS A 16 -7.500 -8.774 -7.035 1.00 51.34 C ATOM 235 O CYS A 16 -8.689 -8.495 -6.874 1.00 42.22 O ATOM 236 CB CYS A 16 -6.059 -7.850 -5.210 1.00 55.14 C ATOM 237 SG CYS A 16 -5.630 -9.526 -4.641 1.00 65.13 S ATOM 238 H CYS A 16 -6.866 -5.731 -6.340 1.00 51.51 H ATOM 239 HA CYS A 16 -5.526 -8.001 -7.278 1.00 2.45 H ATOM 240 HB2 CYS A 16 -5.214 -7.208 -5.008 1.00 70.34 H ATOM 241 HB3 CYS A 16 -6.907 -7.513 -4.632 1.00 2.12 H ATOM 242 N THR A 17 -7.091 -9.948 -7.505 1.00 22.45 N ATOM 243 CA THR A 17 -8.035 -10.998 -7.865 1.00 70.33 C ATOM 244 C THR A 17 -8.375 -11.869 -6.661 1.00 74.13 C ATOM 245 O THR A 17 -8.173 -13.083 -6.685 1.00 54.33 O ATOM 246 CB THR A 17 -7.479 -11.892 -8.990 1.00 2.11 C ATOM 247 OG1 THR A 17 -8.383 -12.971 -9.250 1.00 60.35 O ATOM 248 CG2 THR A 17 -6.113 -12.447 -8.615 1.00 11.03 C ATOM 249 H THR A 17 -6.130 -10.111 -7.611 1.00 13.03 H ATOM 250 HA THR A 17 -8.938 -10.526 -8.223 1.00 15.02 H ATOM 251 HB THR A 17 -7.375 -11.295 -9.885 1.00 30.20 H ATOM 252 HG1 THR A 17 -8.242 -13.299 -10.142 1.00 25.31 H ATOM 253 HG21 THR A 17 -5.352 -11.717 -8.846 1.00 73.04 H ATOM 254 HG22 THR A 17 -5.926 -13.352 -9.174 1.00 41.42 H ATOM 255 HG23 THR A 17 -6.092 -12.666 -7.558 1.00 21.34 H