ATOM 80 N CYS A 5 -3.180 -3.211 -1.823 1.00 0.07 N ATOM 81 CA CYS A 5 -1.810 -3.569 -2.125 1.00 0.08 C ATOM 82 C CYS A 5 -1.725 -5.045 -2.497 1.00 0.13 C ATOM 83 O CYS A 5 -1.899 -5.923 -1.645 1.00 0.17 O ATOM 84 CB CYS A 5 -0.906 -3.277 -0.930 1.00 0.09 C ATOM 85 SG CYS A 5 0.792 -3.837 -1.158 1.00 0.11 S ATOM 86 H CYS A 5 -3.474 -3.188 -0.886 1.00 0.12 H ATOM 87 HA CYS A 5 -1.487 -2.974 -2.965 1.00 0.13 H ATOM 88 HB2 CYS A 5 -0.881 -2.211 -0.756 1.00 0.16 H ATOM 89 HB3 CYS A 5 -1.304 -3.769 -0.057 1.00 0.12 H ATOM 90 N THR A 6 -1.458 -5.309 -3.766 1.00 0.19 N ATOM 91 CA THR A 6 -1.405 -6.671 -4.270 1.00 0.27 C ATOM 92 C THR A 6 0.046 -7.160 -4.357 1.00 0.28 C ATOM 93 O THR A 6 0.390 -8.004 -5.189 1.00 0.55 O ATOM 94 CB THR A 6 -2.106 -6.777 -5.650 1.00 0.36 C ATOM 95 OG1 THR A 6 -2.136 -8.137 -6.104 1.00 1.49 O ATOM 96 CG2 THR A 6 -1.415 -5.906 -6.692 1.00 1.25 C ATOM 97 H THR A 6 -1.287 -4.563 -4.383 1.00 0.23 H ATOM 98 HA THR A 6 -1.940 -7.299 -3.572 1.00 0.28 H ATOM 99 HB THR A 6 -3.122 -6.429 -5.539 1.00 1.07 H ATOM 100 HG1 THR A 6 -1.413 -8.630 -5.691 1.00 2.01 H ATOM 101 HG21 THR A 6 -1.888 -6.049 -7.652 1.00 1.85 H ATOM 102 HG22 THR A 6 -0.374 -6.184 -6.758 1.00 1.90 H ATOM 103 HG23 THR A 6 -1.493 -4.870 -6.402 1.00 1.77 H ATOM 104 N TRP A 7 0.897 -6.623 -3.491 1.00 0.14 N ATOM 105 CA TRP A 7 2.290 -7.037 -3.429 1.00 0.13 C ATOM 106 C TRP A 7 2.394 -8.425 -2.805 1.00 0.14 C ATOM 107 O TRP A 7 2.228 -8.573 -1.594 1.00 0.15 O ATOM 108 CB TRP A 7 3.104 -6.036 -2.606 1.00 0.17 C ATOM 109 CG TRP A 7 4.588 -6.226 -2.719 1.00 0.25 C ATOM 110 CD1 TRP A 7 5.411 -5.641 -3.632 1.00 0.34 C ATOM 111 CD2 TRP A 7 5.426 -7.046 -1.893 1.00 0.30 C ATOM 112 NE1 TRP A 7 6.708 -6.042 -3.427 1.00 0.41 N ATOM 113 CE2 TRP A 7 6.743 -6.904 -2.364 1.00 0.39 C ATOM 114 CE3 TRP A 7 5.192 -7.885 -0.800 1.00 0.33 C ATOM 115 CZ2 TRP A 7 7.819 -7.568 -1.780 1.00 0.48 C ATOM 116 CZ3 TRP A 7 6.261 -8.541 -0.223 1.00 0.43 C ATOM 117 CH2 TRP A 7 7.559 -8.380 -0.713 1.00 0.49 C ATOM 118 H TRP A 7 0.576 -5.932 -2.875 1.00 0.28 H ATOM 119 HA TRP A 7 2.679 -7.068 -4.434 1.00 0.15 H ATOM 120 HB2 TRP A 7 2.871 -5.035 -2.933 1.00 0.19 H ATOM 121 HB3 TRP A 7 2.834 -6.137 -1.566 1.00 0.17 H ATOM 122 HD1 TRP A 7 5.077 -4.964 -4.400 1.00 0.37 H ATOM 123 HE1 TRP A 7 7.487 -5.753 -3.954 1.00 0.48 H ATOM 124 HE3 TRP A 7 4.196 -8.025 -0.407 1.00 0.31 H ATOM 125 HZ2 TRP A 7 8.827 -7.453 -2.146 1.00 0.55 H ATOM 126 HZ3 TRP A 7 6.099 -9.190 0.621 1.00 0.49 H ATOM 127 HH2 TRP A 7 8.364 -8.914 -0.230 1.00 0.57 H ATOM 142 N CYS A 9 1.684 -11.685 -1.097 1.00 0.16 N ATOM 143 CA CYS A 9 0.513 -11.979 -0.268 1.00 0.17 C ATOM 144 C CYS A 9 0.289 -10.927 0.818 1.00 0.17 C ATOM 145 O CYS A 9 -0.147 -11.247 1.927 1.00 0.29 O ATOM 146 CB CYS A 9 0.848 -13.333 0.357 1.00 0.26 C ATOM 147 SG CYS A 9 2.623 -13.482 0.513 1.00 0.34 S ATOM 148 HA CYS A 9 -0.381 -12.068 -0.867 1.00 0.19 H ATOM 149 HB2 CYS A 9 0.403 -13.403 1.338 1.00 0.36 H ATOM 150 HB3 CYS A 9 0.490 -14.130 -0.275 1.00 0.30 H ATOM 151 N CYS A 10 0.594 -9.673 0.497 1.00 0.10 N ATOM 152 CA CYS A 10 0.403 -8.572 1.431 1.00 0.11 C ATOM 153 C CYS A 10 -1.088 -8.344 1.677 1.00 0.16 C ATOM 154 O CYS A 10 -1.579 -8.555 2.787 1.00 0.23 O ATOM 155 CB CYS A 10 1.068 -7.304 0.889 1.00 0.10 C ATOM 156 SG CYS A 10 1.001 -5.880 1.998 1.00 0.12 S ATOM 157 H CYS A 10 0.957 -9.481 -0.397 1.00 0.12 H ATOM 158 HA CYS A 10 0.871 -8.845 2.365 1.00 0.17 H ATOM 159 HB2 CYS A 10 2.109 -7.510 0.693 1.00 0.17 H ATOM 160 HB3 CYS A 10 0.587 -7.024 -0.035 1.00 0.12 H ATOM 161 N GLY A 11 -1.798 -7.937 0.628 1.00 0.18 N ATOM 162 CA GLY A 11 -3.234 -7.756 0.713 1.00 0.26 C ATOM 163 C GLY A 11 -3.654 -6.777 1.791 1.00 0.26 C ATOM 164 O GLY A 11 -4.287 -7.163 2.773 1.00 0.50 O ATOM 165 H GLY A 11 -1.339 -7.766 -0.224 1.00 0.18 H ATOM 166 HA2 GLY A 11 -3.593 -7.396 -0.238 1.00 0.30 H ATOM 167 HA3 GLY A 11 -3.691 -8.712 0.916 1.00 0.32 H ATOM 168 N LYS A 12 -3.299 -5.514 1.619 1.00 0.17 N ATOM 169 CA LYS A 12 -3.712 -4.477 2.554 1.00 0.17 C ATOM 170 C LYS A 12 -4.555 -3.442 1.820 1.00 0.13 C ATOM 171 O LYS A 12 -4.204 -3.018 0.721 1.00 0.12 O ATOM 172 CB LYS A 12 -2.491 -3.826 3.212 1.00 0.22 C ATOM 173 CG LYS A 12 -2.837 -3.002 4.439 1.00 0.80 C ATOM 174 CD LYS A 12 -1.596 -2.631 5.234 1.00 0.90 C ATOM 175 CE LYS A 12 -1.953 -1.885 6.511 1.00 1.54 C ATOM 176 NZ LYS A 12 -2.776 -2.719 7.428 1.00 2.30 N1+ ATOM 177 H LYS A 12 -2.752 -5.273 0.844 1.00 0.34 H ATOM 178 HA LYS A 12 -4.320 -4.941 3.315 1.00 0.20 H ATOM 179 HB2 LYS A 12 -1.796 -4.599 3.507 1.00 0.64 H ATOM 180 HB3 LYS A 12 -2.011 -3.177 2.495 1.00 0.73 H ATOM 181 HG2 LYS A 12 -3.332 -2.095 4.120 1.00 1.38 H ATOM 182 HG3 LYS A 12 -3.501 -3.577 5.072 1.00 1.47 H ATOM 183 HD2 LYS A 12 -1.065 -3.536 5.495 1.00 1.37 H ATOM 184 HD3 LYS A 12 -0.962 -2.004 4.625 1.00 1.09 H ATOM 185 HE2 LYS A 12 -1.040 -1.605 7.014 1.00 1.88 H ATOM 186 HE3 LYS A 12 -2.507 -0.996 6.250 1.00 2.02 H ATOM 187 HZ1 LYS A 12 -2.264 -3.588 7.678 1.00 2.76 H ATOM 188 HZ2 LYS A 12 -3.672 -2.981 6.969 1.00 2.76 H ATOM 189 HZ3 LYS A 12 -2.987 -2.190 8.297 1.00 2.59 H ATOM 190 N ARG A 13 -5.670 -3.048 2.421 1.00 0.15 N ATOM 191 CA ARG A 13 -6.650 -2.213 1.736 1.00 0.13 C ATOM 192 C ARG A 13 -6.713 -0.805 2.320 1.00 0.11 C ATOM 193 O ARG A 13 -6.582 -0.612 3.532 1.00 0.17 O ATOM 194 CB ARG A 13 -8.027 -2.870 1.804 1.00 0.20 C ATOM 195 CG ARG A 13 -8.055 -4.264 1.204 1.00 0.27 C ATOM 196 CD ARG A 13 -9.419 -4.914 1.349 1.00 0.37 C ATOM 197 NE ARG A 13 -9.427 -6.281 0.832 1.00 1.29 N ATOM 198 CZ ARG A 13 -10.499 -6.873 0.309 1.00 1.74 C ATOM 199 NH1 ARG A 13 -11.652 -6.221 0.239 1.00 1.63 N1+ ATOM 200 NH2 ARG A 13 -10.417 -8.122 -0.136 1.00 2.85 N ATOM 201 H ARG A 13 -5.836 -3.319 3.348 1.00 0.20 H ATOM 202 HA ARG A 13 -6.352 -2.143 0.701 1.00 0.12 H ATOM 203 HB2 ARG A 13 -8.328 -2.939 2.839 1.00 0.24 H ATOM 204 HB3 ARG A 13 -8.736 -2.255 1.270 1.00 0.22 H ATOM 205 HG2 ARG A 13 -7.811 -4.197 0.154 1.00 0.29 H ATOM 206 HG3 ARG A 13 -7.318 -4.872 1.708 1.00 0.32 H ATOM 207 HD2 ARG A 13 -9.686 -4.935 2.396 1.00 1.01 H ATOM 208 HD3 ARG A 13 -10.142 -4.328 0.803 1.00 1.17 H ATOM 209 HE ARG A 13 -8.583 -6.786 0.881 1.00 2.02 H ATOM 210 HH11 ARG A 13 -11.719 -5.278 0.579 1.00 1.55 H ATOM 211 HH12 ARG A 13 -12.460 -6.665 -0.151 1.00 2.19 H ATOM 212 HH21 ARG A 13 -9.548 -8.622 -0.081 1.00 3.45 H ATOM 213 HH22 ARG A 13 -11.222 -8.573 -0.529 1.00 3.23 H ATOM 214 N PHE A 14 -6.925 0.167 1.438 1.00 0.08 N ATOM 215 CA PHE A 14 -6.993 1.576 1.806 1.00 0.07 C ATOM 216 C PHE A 14 -8.141 2.241 1.055 1.00 0.11 C ATOM 217 O PHE A 14 -8.598 1.732 0.031 1.00 0.21 O ATOM 218 CB PHE A 14 -5.677 2.281 1.447 1.00 0.09 C ATOM 219 CG PHE A 14 -4.459 1.532 1.885 1.00 0.11 C ATOM 220 CD1 PHE A 14 -3.801 0.686 1.014 1.00 0.13 C ATOM 221 CD2 PHE A 14 -3.968 1.687 3.169 1.00 0.13 C ATOM 222 CE1 PHE A 14 -2.672 0.006 1.415 1.00 0.16 C ATOM 223 CE2 PHE A 14 -2.842 1.008 3.577 1.00 0.17 C ATOM 224 CZ PHE A 14 -2.216 0.127 2.694 1.00 0.17 C ATOM 225 H PHE A 14 -7.046 -0.076 0.491 1.00 0.13 H ATOM 226 HA PHE A 14 -7.164 1.648 2.869 1.00 0.08 H ATOM 227 HB2 PHE A 14 -5.622 2.401 0.376 1.00 0.12 H ATOM 228 HB3 PHE A 14 -5.655 3.254 1.914 1.00 0.11 H ATOM 229 HD1 PHE A 14 -4.179 0.561 0.011 1.00 0.14 H ATOM 230 HD2 PHE A 14 -4.478 2.348 3.856 1.00 0.14 H ATOM 231 HE1 PHE A 14 -2.165 -0.653 0.727 1.00 0.18 H ATOM 232 HE2 PHE A 14 -2.466 1.134 4.583 1.00 0.21 H ATOM 233 HZ PHE A 14 -1.341 -0.420 3.008 1.00 0.20 H ATOM 234 N THR A 15 -8.609 3.367 1.567 1.00 0.11 N ATOM 235 CA THR A 15 -9.668 4.118 0.908 1.00 0.13 C ATOM 236 C THR A 15 -9.073 5.293 0.132 1.00 0.14 C ATOM 237 O THR A 15 -9.723 5.889 -0.729 1.00 0.23 O ATOM 238 CB THR A 15 -10.698 4.628 1.938 1.00 0.15 C ATOM 239 OG1 THR A 15 -11.027 3.569 2.851 1.00 1.04 O ATOM 240 CG2 THR A 15 -11.969 5.114 1.253 1.00 1.14 C ATOM 241 H THR A 15 -8.240 3.702 2.413 1.00 0.16 H ATOM 242 HA THR A 15 -10.171 3.456 0.216 1.00 0.14 H ATOM 243 HB THR A 15 -10.264 5.450 2.490 1.00 0.78 H ATOM 244 HG1 THR A 15 -10.511 3.672 3.659 1.00 1.52 H ATOM 245 HG21 THR A 15 -12.658 5.491 1.995 1.00 1.64 H ATOM 246 HG22 THR A 15 -12.429 4.293 0.723 1.00 1.69 H ATOM 247 HG23 THR A 15 -11.724 5.900 0.555 1.00 1.71 H ATOM 248 N ARG A 16 -7.822 5.612 0.436 1.00 0.12 N ATOM 249 CA ARG A 16 -7.123 6.693 -0.240 1.00 0.15 C ATOM 250 C ARG A 16 -5.865 6.183 -0.931 1.00 0.12 C ATOM 251 O ARG A 16 -5.084 5.416 -0.359 1.00 0.11 O ATOM 252 CB ARG A 16 -6.760 7.804 0.750 1.00 0.24 C ATOM 253 CG ARG A 16 -7.949 8.639 1.195 1.00 0.41 C ATOM 254 CD ARG A 16 -8.654 9.279 0.008 1.00 1.07 C ATOM 255 NE ARG A 16 -7.712 9.927 -0.905 1.00 1.91 N ATOM 256 CZ ARG A 16 -8.020 10.341 -2.132 1.00 2.74 C ATOM 257 NH1 ARG A 16 -9.271 10.273 -2.576 1.00 3.03 N1+ ATOM 258 NH2 ARG A 16 -7.068 10.843 -2.904 1.00 3.72 N ATOM 259 H ARG A 16 -7.357 5.103 1.134 1.00 0.16 H ATOM 260 HA ARG A 16 -7.790 7.095 -0.987 1.00 0.20 H ATOM 261 HB2 ARG A 16 -6.313 7.362 1.628 1.00 0.27 H ATOM 262 HB3 ARG A 16 -6.042 8.464 0.289 1.00 0.26 H ATOM 263 HG2 ARG A 16 -8.646 7.998 1.714 1.00 0.82 H ATOM 264 HG3 ARG A 16 -7.602 9.415 1.861 1.00 0.85 H ATOM 265 HD2 ARG A 16 -9.195 8.516 -0.531 1.00 1.62 H ATOM 266 HD3 ARG A 16 -9.349 10.017 0.375 1.00 1.63 H ATOM 267 HE ARG A 16 -6.780 10.039 -0.591 1.00 2.32 H ATOM 268 HH11 ARG A 16 -9.495 10.585 -3.505 1.00 3.79 H ATOM 269 HH12 ARG A 16 -9.999 9.921 -1.983 1.00 2.82 H ATOM 270 HH21 ARG A 16 -7.282 11.161 -3.832 1.00 4.35 H ATOM 271 HH22 ARG A 16 -6.120 10.898 -2.563 1.00 4.03 H ATOM 272 N SER A 17 -5.678 6.626 -2.169 1.00 0.15 N ATOM 273 CA SER A 17 -4.532 6.241 -2.977 1.00 0.17 C ATOM 274 C SER A 17 -3.249 6.772 -2.360 1.00 0.16 C ATOM 275 O SER A 17 -2.198 6.146 -2.446 1.00 0.20 O ATOM 276 CB SER A 17 -4.708 6.790 -4.390 1.00 0.24 C ATOM 277 OG SER A 17 -5.221 8.110 -4.348 1.00 0.81 O ATOM 278 H SER A 17 -6.333 7.246 -2.557 1.00 0.18 H ATOM 279 HA SER A 17 -4.490 5.162 -3.016 1.00 0.20 H ATOM 280 HB2 SER A 17 -3.752 6.804 -4.891 1.00 0.58 H ATOM 281 HB3 SER A 17 -5.395 6.163 -4.940 1.00 0.65 H ATOM 282 HG SER A 17 -4.923 8.593 -5.128 1.00 1.18 H ATOM 283 N ASP A 18 -3.362 7.934 -1.730 1.00 0.16 N ATOM 284 CA ASP A 18 -2.249 8.563 -1.028 1.00 0.22 C ATOM 285 C ASP A 18 -1.732 7.645 0.074 1.00 0.15 C ATOM 286 O ASP A 18 -0.528 7.561 0.330 1.00 0.16 O ATOM 287 CB ASP A 18 -2.706 9.886 -0.408 1.00 0.34 C ATOM 288 CG ASP A 18 -3.676 10.647 -1.292 1.00 0.98 C ATOM 289 OD1 ASP A 18 -3.226 11.541 -2.040 1.00 1.69 O ATOM 290 OD2 ASP A 18 -4.889 10.358 -1.247 1.00 1.12 O1- ATOM 291 H ASP A 18 -4.227 8.401 -1.757 1.00 0.16 H ATOM 292 HA ASP A 18 -1.459 8.749 -1.738 1.00 0.29 H ATOM 293 HB2 ASP A 18 -3.189 9.687 0.536 1.00 0.91 H ATOM 294 HB3 ASP A 18 -1.842 10.509 -0.236 1.00 0.89 H ATOM 295 N GLU A 19 -2.662 6.942 0.705 1.00 0.11 N ATOM 296 CA GLU A 19 -2.346 6.058 1.811 1.00 0.10 C ATOM 297 C GLU A 19 -1.704 4.781 1.281 1.00 0.08 C ATOM 298 O GLU A 19 -0.764 4.248 1.876 1.00 0.10 O ATOM 299 CB GLU A 19 -3.623 5.743 2.591 1.00 0.12 C ATOM 300 CG GLU A 19 -3.371 5.185 3.976 1.00 0.17 C ATOM 301 CD GLU A 19 -4.646 5.026 4.776 1.00 1.01 C ATOM 302 OE1 GLU A 19 -4.879 3.924 5.315 1.00 1.86 O ATOM 303 OE2 GLU A 19 -5.429 5.995 4.852 1.00 1.13 O1- ATOM 304 H GLU A 19 -3.590 7.012 0.407 1.00 0.11 H ATOM 305 HA GLU A 19 -1.646 6.563 2.457 1.00 0.12 H ATOM 306 HB2 GLU A 19 -4.202 6.648 2.691 1.00 0.16 H ATOM 307 HB3 GLU A 19 -4.199 5.019 2.034 1.00 0.14 H ATOM 308 HG2 GLU A 19 -2.903 4.216 3.878 1.00 0.77 H ATOM 309 HG3 GLU A 19 -2.710 5.852 4.507 1.00 0.77 H ATOM 310 N LEU A 20 -2.215 4.308 0.149 1.00 0.08 N ATOM 311 CA LEU A 20 -1.621 3.174 -0.547 1.00 0.10 C ATOM 312 C LEU A 20 -0.193 3.498 -0.966 1.00 0.10 C ATOM 313 O LEU A 20 0.702 2.679 -0.808 1.00 0.11 O ATOM 314 CB LEU A 20 -2.454 2.796 -1.776 1.00 0.12 C ATOM 315 CG LEU A 20 -1.808 1.758 -2.703 1.00 0.14 C ATOM 316 CD1 LEU A 20 -1.603 0.436 -1.981 1.00 0.15 C ATOM 317 CD2 LEU A 20 -2.648 1.552 -3.949 1.00 0.20 C ATOM 318 H LEU A 20 -3.022 4.729 -0.221 1.00 0.08 H ATOM 319 HA LEU A 20 -1.601 2.337 0.135 1.00 0.11 H ATOM 320 HB2 LEU A 20 -3.402 2.406 -1.434 1.00 0.13 H ATOM 321 HB3 LEU A 20 -2.639 3.693 -2.348 1.00 0.12 H ATOM 322 HG LEU A 20 -0.838 2.120 -3.009 1.00 0.13 H ATOM 323 HD11 LEU A 20 -1.157 -0.277 -2.657 1.00 0.99 H ATOM 324 HD12 LEU A 20 -2.556 0.061 -1.639 1.00 0.94 H ATOM 325 HD13 LEU A 20 -0.948 0.587 -1.135 1.00 1.04 H ATOM 326 HD21 LEU A 20 -2.798 2.499 -4.445 1.00 0.97 H ATOM 327 HD22 LEU A 20 -3.602 1.132 -3.674 1.00 0.98 H ATOM 328 HD23 LEU A 20 -2.137 0.875 -4.616 1.00 1.10 H ATOM 329 N GLN A 21 0.009 4.702 -1.493 1.00 0.12 N ATOM 330 CA GLN A 21 1.340 5.152 -1.889 1.00 0.16 C ATOM 331 C GLN A 21 2.283 5.166 -0.691 1.00 0.13 C ATOM 332 O GLN A 21 3.423 4.702 -0.778 1.00 0.14 O ATOM 333 CB GLN A 21 1.270 6.545 -2.518 1.00 0.21 C ATOM 334 CG GLN A 21 0.548 6.575 -3.854 1.00 1.16 C ATOM 335 CD GLN A 21 0.402 7.978 -4.408 1.00 1.70 C ATOM 336 OE1 GLN A 21 1.230 8.853 -4.149 1.00 2.24 O ATOM 337 NE2 GLN A 21 -0.652 8.204 -5.175 1.00 2.40 N ATOM 338 H GLN A 21 -0.760 5.298 -1.631 1.00 0.13 H ATOM 339 HA GLN A 21 1.716 4.455 -2.624 1.00 0.18 H ATOM 340 HB2 GLN A 21 0.752 7.208 -1.838 1.00 0.90 H ATOM 341 HB3 GLN A 21 2.274 6.911 -2.667 1.00 0.90 H ATOM 342 HG2 GLN A 21 1.106 5.982 -4.563 1.00 1.86 H ATOM 343 HG3 GLN A 21 -0.437 6.149 -3.727 1.00 1.85 H ATOM 344 HE21 GLN A 21 -1.272 7.460 -5.343 1.00 2.64 H ATOM 345 HE22 GLN A 21 -0.770 9.106 -5.547 1.00 2.98 H ATOM 346 N ARG A 22 1.795 5.694 0.431 1.00 0.13 N ATOM 347 CA ARG A 22 2.560 5.696 1.673 1.00 0.14 C ATOM 348 C ARG A 22 2.967 4.273 2.041 1.00 0.09 C ATOM 349 O ARG A 22 4.142 3.991 2.286 1.00 0.11 O ATOM 350 CB ARG A 22 1.739 6.311 2.809 1.00 0.21 C ATOM 351 CG ARG A 22 2.438 6.270 4.158 1.00 0.35 C ATOM 352 CD ARG A 22 1.534 6.780 5.268 1.00 0.50 C ATOM 353 NE ARG A 22 2.149 6.629 6.586 1.00 1.17 N ATOM 354 CZ ARG A 22 1.481 6.716 7.733 1.00 1.79 C ATOM 355 NH1 ARG A 22 0.182 6.987 7.731 1.00 1.82 N1+ ATOM 356 NH2 ARG A 22 2.120 6.541 8.883 1.00 2.56 N ATOM 357 H ARG A 22 0.898 6.097 0.419 1.00 0.14 H ATOM 358 HA ARG A 22 3.450 6.286 1.517 1.00 0.18 H ATOM 359 HB2 ARG A 22 1.526 7.341 2.570 1.00 0.24 H ATOM 360 HB3 ARG A 22 0.809 5.775 2.897 1.00 0.23 H ATOM 361 HG2 ARG A 22 2.718 5.250 4.375 1.00 0.36 H ATOM 362 HG3 ARG A 22 3.325 6.887 4.114 1.00 0.41 H ATOM 363 HD2 ARG A 22 1.328 7.826 5.096 1.00 0.81 H ATOM 364 HD3 ARG A 22 0.609 6.225 5.245 1.00 0.88 H ATOM 365 HE ARG A 22 3.117 6.448 6.616 1.00 1.39 H ATOM 366 HH11 ARG A 22 -0.321 7.053 8.596 1.00 2.35 H ATOM 367 HH12 ARG A 22 -0.301 7.136 6.864 1.00 1.47 H ATOM 368 HH21 ARG A 22 3.105 6.342 8.885 1.00 2.72 H ATOM 369 HH22 ARG A 22 1.626 6.605 9.755 1.00 3.05 H ATOM 370 N HIS A 23 1.987 3.377 2.048 1.00 0.07 N ATOM 371 CA HIS A 23 2.223 1.980 2.371 1.00 0.08 C ATOM 372 C HIS A 23 3.193 1.344 1.378 1.00 0.08 C ATOM 373 O HIS A 23 4.100 0.618 1.770 1.00 0.10 O ATOM 374 CB HIS A 23 0.899 1.208 2.384 1.00 0.12 C ATOM 375 CG HIS A 23 1.083 -0.277 2.431 1.00 0.11 C ATOM 376 ND1 HIS A 23 1.237 -1.015 3.600 1.00 0.14 N ATOM 377 CD2 HIS A 23 1.220 -1.155 1.408 1.00 0.11 C ATOM 378 CE1 HIS A 23 1.479 -2.290 3.246 1.00 0.14 C ATOM 379 NE2 HIS A 23 1.473 -2.392 1.943 1.00 0.11 N ATOM 380 H HIS A 23 1.074 3.666 1.822 1.00 0.10 H ATOM 381 HA HIS A 23 2.663 1.937 3.355 1.00 0.11 H ATOM 382 HB2 HIS A 23 0.325 1.503 3.250 1.00 0.14 H ATOM 383 HB3 HIS A 23 0.342 1.448 1.490 1.00 0.13 H ATOM 384 HD1 HIS A 23 1.191 -0.667 4.519 1.00 0.16 H ATOM 385 HD2 HIS A 23 1.131 -0.933 0.354 1.00 0.11 H ATOM 386 HE1 HIS A 23 1.651 -3.105 3.933 1.00 0.17 H ATOM 387 N LYS A 24 2.987 1.627 0.100 1.00 0.10 N ATOM 388 CA LYS A 24 3.816 1.089 -0.975 1.00 0.18 C ATOM 389 C LYS A 24 5.301 1.314 -0.698 1.00 0.14 C ATOM 390 O LYS A 24 6.143 0.477 -1.039 1.00 0.16 O ATOM 391 CB LYS A 24 3.420 1.752 -2.297 1.00 0.29 C ATOM 392 CG LYS A 24 4.201 1.276 -3.509 1.00 0.43 C ATOM 393 CD LYS A 24 3.830 -0.145 -3.901 1.00 1.11 C ATOM 394 CE LYS A 24 4.490 -0.543 -5.214 1.00 1.80 C ATOM 395 NZ LYS A 24 4.128 -1.922 -5.628 1.00 2.17 N1+ ATOM 396 H LYS A 24 2.233 2.215 -0.134 1.00 0.10 H ATOM 397 HA LYS A 24 3.630 0.027 -1.042 1.00 0.23 H ATOM 398 HB2 LYS A 24 2.373 1.556 -2.478 1.00 0.32 H ATOM 399 HB3 LYS A 24 3.563 2.818 -2.201 1.00 0.32 H ATOM 400 HG2 LYS A 24 3.986 1.933 -4.336 1.00 0.98 H ATOM 401 HG3 LYS A 24 5.256 1.315 -3.281 1.00 0.93 H ATOM 402 HD2 LYS A 24 4.156 -0.821 -3.123 1.00 1.79 H ATOM 403 HD3 LYS A 24 2.758 -0.210 -4.010 1.00 1.66 H ATOM 404 HE2 LYS A 24 4.173 0.144 -5.985 1.00 2.31 H ATOM 405 HE3 LYS A 24 5.563 -0.481 -5.098 1.00 2.44 H ATOM 406 HZ1 LYS A 24 3.097 -2.010 -5.727 1.00 2.32 H ATOM 407 HZ2 LYS A 24 4.459 -2.608 -4.922 1.00 2.51 H ATOM 408 HZ3 LYS A 24 4.573 -2.147 -6.540 1.00 2.71 H ATOM 409 N ARG A 25 5.609 2.429 -0.037 1.00 0.14 N ATOM 410 CA ARG A 25 6.993 2.794 0.253 1.00 0.18 C ATOM 411 C ARG A 25 7.677 1.779 1.172 1.00 0.10 C ATOM 412 O ARG A 25 8.902 1.794 1.310 1.00 0.14 O ATOM 413 CB ARG A 25 7.063 4.187 0.878 1.00 0.33 C ATOM 414 CG ARG A 25 6.577 5.292 -0.047 1.00 0.48 C ATOM 415 CD ARG A 25 6.659 6.655 0.618 1.00 0.65 C ATOM 416 NE ARG A 25 8.032 7.025 0.958 1.00 1.51 N ATOM 417 CZ ARG A 25 8.359 8.126 1.634 1.00 1.93 C ATOM 418 NH1 ARG A 25 7.414 8.951 2.066 1.00 1.52 N1+ ATOM 419 NH2 ARG A 25 9.632 8.400 1.880 1.00 3.06 N ATOM 420 H ARG A 25 4.881 3.025 0.262 1.00 0.13 H ATOM 421 HA ARG A 25 7.524 2.815 -0.685 1.00 0.25 H ATOM 422 HB2 ARG A 25 6.455 4.198 1.770 1.00 0.37 H ATOM 423 HB3 ARG A 25 8.086 4.398 1.147 1.00 0.33 H ATOM 424 HG2 ARG A 25 7.189 5.299 -0.936 1.00 0.53 H ATOM 425 HG3 ARG A 25 5.550 5.096 -0.320 1.00 0.49 H ATOM 426 HD2 ARG A 25 6.257 7.394 -0.058 1.00 1.08 H ATOM 427 HD3 ARG A 25 6.069 6.636 1.520 1.00 1.32 H ATOM 428 HE ARG A 25 8.749 6.423 0.661 1.00 2.12 H ATOM 429 HH11 ARG A 25 6.445 8.750 1.887 1.00 1.26 H ATOM 430 HH12 ARG A 25 7.662 9.778 2.579 1.00 1.93 H ATOM 431 HH21 ARG A 25 9.880 9.232 2.390 1.00 3.40 H ATOM 432 HH22 ARG A 25 10.353 7.781 1.560 1.00 3.64 H ATOM 433 N THR A 26 6.898 0.901 1.798 1.00 0.09 N ATOM 434 CA THR A 26 7.466 -0.125 2.663 1.00 0.14 C ATOM 435 C THR A 26 8.124 -1.225 1.832 1.00 0.15 C ATOM 436 O THR A 26 9.185 -1.739 2.191 1.00 0.24 O ATOM 437 CB THR A 26 6.411 -0.751 3.602 1.00 0.22 C ATOM 438 OG1 THR A 26 5.362 -1.367 2.842 1.00 0.24 O ATOM 439 CG2 THR A 26 5.817 0.296 4.535 1.00 0.26 C ATOM 440 H THR A 26 5.923 0.944 1.673 1.00 0.09 H ATOM 441 HA THR A 26 8.225 0.345 3.272 1.00 0.17 H ATOM 442 HB THR A 26 6.895 -1.507 4.201 1.00 0.28 H ATOM 443 HG1 THR A 26 4.737 -0.689 2.542 1.00 0.18 H ATOM 444 HG21 THR A 26 5.336 1.066 3.951 1.00 0.96 H ATOM 445 HG22 THR A 26 6.601 0.733 5.134 1.00 1.09 H ATOM 446 HG23 THR A 26 5.088 -0.172 5.181 1.00 1.06 H ATOM 447 N HIS A 27 7.501 -1.579 0.711 1.00 0.13 N ATOM 448 CA HIS A 27 8.055 -2.603 -0.168 1.00 0.17 C ATOM 449 C HIS A 27 9.093 -1.984 -1.095 1.00 0.19 C ATOM 450 O HIS A 27 10.109 -2.606 -1.422 1.00 0.29 O ATOM 451 CB HIS A 27 6.967 -3.275 -1.011 1.00 0.18 C ATOM 452 CG HIS A 27 5.794 -3.789 -0.235 1.00 0.16 C ATOM 453 ND1 HIS A 27 5.848 -4.825 0.696 1.00 0.19 N ATOM 454 CD2 HIS A 27 4.498 -3.404 -0.291 1.00 0.13 C ATOM 455 CE1 HIS A 27 4.597 -5.027 1.157 1.00 0.18 C ATOM 456 NE2 HIS A 27 3.779 -4.189 0.581 1.00 0.14 N ATOM 457 H HIS A 27 6.651 -1.147 0.474 1.00 0.14 H ATOM 458 HA HIS A 27 8.536 -3.346 0.450 1.00 0.20 H ATOM 459 HB2 HIS A 27 6.594 -2.563 -1.730 1.00 0.18 H ATOM 460 HB3 HIS A 27 7.403 -4.109 -1.540 1.00 0.20 H ATOM 461 HD1 HIS A 27 6.652 -5.321 0.970 1.00 0.22 H ATOM 462 HD2 HIS A 27 4.087 -2.625 -0.915 1.00 0.13 H ATOM 463 HE1 HIS A 27 4.313 -5.771 1.886 1.00 0.21 H