ATOM 165 N VAL A 12 -15.016 1.056 -1.703 1.00 0.00 N ATOM 166 CA VAL A 12 -13.606 0.659 -1.427 1.00 0.00 C ATOM 167 C VAL A 12 -13.594 -0.742 -0.813 1.00 0.00 C ATOM 168 O VAL A 12 -13.772 -0.909 0.378 1.00 0.00 O ATOM 169 CB VAL A 12 -12.967 1.652 -0.449 1.00 0.00 C ATOM 170 CG1 VAL A 12 -11.476 1.786 -0.759 1.00 0.00 C ATOM 171 CG2 VAL A 12 -13.636 3.022 -0.591 1.00 0.00 C ATOM 172 H VAL A 12 -15.567 1.437 -0.987 1.00 0.00 H ATOM 173 HA VAL A 12 -13.046 0.651 -2.352 1.00 0.00 H ATOM 174 HB VAL A 12 -13.093 1.291 0.562 1.00 0.00 H ATOM 175 HG11 VAL A 12 -11.170 0.981 -1.412 1.00 0.00 H ATOM 176 HG12 VAL A 12 -11.293 2.732 -1.246 1.00 0.00 H ATOM 177 HG13 VAL A 12 -10.910 1.739 0.160 1.00 0.00 H ATOM 178 HG21 VAL A 12 -14.108 3.094 -1.560 1.00 0.00 H ATOM 179 HG22 VAL A 12 -14.379 3.141 0.182 1.00 0.00 H ATOM 180 HG23 VAL A 12 -12.889 3.797 -0.496 1.00 0.00 H ATOM 181 N GLU A 13 -13.396 -1.753 -1.615 1.00 0.00 N ATOM 182 CA GLU A 13 -13.388 -3.142 -1.074 1.00 0.00 C ATOM 183 C GLU A 13 -12.160 -3.896 -1.593 1.00 0.00 C ATOM 184 O GLU A 13 -11.983 -4.064 -2.783 1.00 0.00 O ATOM 185 CB GLU A 13 -14.656 -3.868 -1.526 1.00 0.00 C ATOM 186 CG GLU A 13 -15.395 -4.422 -0.307 1.00 0.00 C ATOM 187 CD GLU A 13 -16.901 -4.412 -0.577 1.00 0.00 C ATOM 188 OE1 GLU A 13 -17.358 -5.277 -1.305 1.00 0.00 O ATOM 189 OE2 GLU A 13 -17.572 -3.538 -0.053 1.00 0.00 O ATOM 190 H GLU A 13 -13.263 -1.600 -2.573 1.00 0.00 H ATOM 191 HA GLU A 13 -13.359 -3.109 0.005 1.00 0.00 H ATOM 192 HB2 GLU A 13 -15.298 -3.175 -2.051 1.00 0.00 H ATOM 193 HB3 GLU A 13 -14.391 -4.683 -2.184 1.00 0.00 H ATOM 194 HG2 GLU A 13 -15.068 -5.434 -0.117 1.00 0.00 H ATOM 195 HG3 GLU A 13 -15.182 -3.806 0.554 1.00 0.00 H ATOM 196 N CYS A 14 -11.317 -4.360 -0.708 1.00 0.00 N ATOM 197 CA CYS A 14 -10.109 -5.110 -1.152 1.00 0.00 C ATOM 198 C CYS A 14 -10.511 -6.102 -2.251 1.00 0.00 C ATOM 199 O CYS A 14 -11.094 -7.126 -1.967 1.00 0.00 O ATOM 200 CB CYS A 14 -9.523 -5.880 0.034 1.00 0.00 C ATOM 201 SG CYS A 14 -7.768 -6.207 -0.266 1.00 0.00 S ATOM 202 H CYS A 14 -11.483 -4.218 0.247 1.00 0.00 H ATOM 203 HA CYS A 14 -9.373 -4.418 -1.532 1.00 0.00 H ATOM 204 HB2 CYS A 14 -9.631 -5.292 0.934 1.00 0.00 H ATOM 205 HB3 CYS A 14 -10.048 -6.815 0.152 1.00 0.00 H ATOM 206 N PRO A 15 -10.193 -5.765 -3.476 1.00 0.00 N ATOM 207 CA PRO A 15 -10.516 -6.611 -4.639 1.00 0.00 C ATOM 208 C PRO A 15 -9.505 -7.755 -4.763 1.00 0.00 C ATOM 209 O PRO A 15 -9.605 -8.593 -5.638 1.00 0.00 O ATOM 210 CB PRO A 15 -10.395 -5.652 -5.824 1.00 0.00 C ATOM 211 CG PRO A 15 -9.473 -4.499 -5.358 1.00 0.00 C ATOM 212 CD PRO A 15 -9.487 -4.514 -3.818 1.00 0.00 C ATOM 213 HA PRO A 15 -11.521 -6.992 -4.570 1.00 0.00 H ATOM 214 HB2 PRO A 15 -9.958 -6.163 -6.671 1.00 0.00 H ATOM 215 HB3 PRO A 15 -11.364 -5.259 -6.085 1.00 0.00 H ATOM 216 HG2 PRO A 15 -8.467 -4.660 -5.723 1.00 0.00 H ATOM 217 HG3 PRO A 15 -9.851 -3.553 -5.716 1.00 0.00 H ATOM 218 HD2 PRO A 15 -8.478 -4.528 -3.431 1.00 0.00 H ATOM 219 HD3 PRO A 15 -10.030 -3.665 -3.435 1.00 0.00 H ATOM 220 N LEU A 16 -8.528 -7.789 -3.900 1.00 0.00 N ATOM 221 CA LEU A 16 -7.507 -8.870 -3.970 1.00 0.00 C ATOM 222 C LEU A 16 -7.897 -10.010 -3.025 1.00 0.00 C ATOM 223 O LEU A 16 -7.514 -11.147 -3.218 1.00 0.00 O ATOM 224 CB LEU A 16 -6.148 -8.303 -3.560 1.00 0.00 C ATOM 225 CG LEU A 16 -5.901 -6.994 -4.312 1.00 0.00 C ATOM 226 CD1 LEU A 16 -5.774 -5.845 -3.312 1.00 0.00 C ATOM 227 CD2 LEU A 16 -4.609 -7.109 -5.120 1.00 0.00 C ATOM 228 H LEU A 16 -8.464 -7.099 -3.206 1.00 0.00 H ATOM 229 HA LEU A 16 -7.448 -9.245 -4.982 1.00 0.00 H ATOM 230 HB2 LEU A 16 -6.143 -8.115 -2.495 1.00 0.00 H ATOM 231 HB3 LEU A 16 -5.371 -9.010 -3.806 1.00 0.00 H ATOM 232 HG LEU A 16 -6.729 -6.801 -4.979 1.00 0.00 H ATOM 233 HD11 LEU A 16 -6.336 -6.080 -2.420 1.00 0.00 H ATOM 234 HD12 LEU A 16 -4.736 -5.703 -3.058 1.00 0.00 H ATOM 235 HD13 LEU A 16 -6.163 -4.939 -3.754 1.00 0.00 H ATOM 236 HD21 LEU A 16 -3.802 -7.406 -4.468 1.00 0.00 H ATOM 237 HD22 LEU A 16 -4.737 -7.849 -5.896 1.00 0.00 H ATOM 238 HD23 LEU A 16 -4.377 -6.151 -5.568 1.00 0.00 H ATOM 239 N CYS A 17 -8.658 -9.716 -2.006 1.00 0.00 N ATOM 240 CA CYS A 17 -9.072 -10.788 -1.054 1.00 0.00 C ATOM 241 C CYS A 17 -10.564 -10.639 -0.736 1.00 0.00 C ATOM 242 O CYS A 17 -11.106 -11.340 0.095 1.00 0.00 O ATOM 243 CB CYS A 17 -8.241 -10.678 0.235 1.00 0.00 C ATOM 244 SG CYS A 17 -8.925 -9.395 1.323 1.00 0.00 S ATOM 245 H CYS A 17 -8.961 -8.794 -1.869 1.00 0.00 H ATOM 246 HA CYS A 17 -8.901 -11.753 -1.508 1.00 0.00 H ATOM 247 HB2 CYS A 17 -8.256 -11.627 0.750 1.00 0.00 H ATOM 248 HB3 CYS A 17 -7.221 -10.426 -0.019 1.00 0.00 H ATOM 249 N MET A 18 -11.226 -9.724 -1.386 1.00 0.00 N ATOM 250 CA MET A 18 -12.675 -9.519 -1.123 1.00 0.00 C ATOM 251 C MET A 18 -12.886 -9.189 0.357 1.00 0.00 C ATOM 252 O MET A 18 -12.852 -10.056 1.207 1.00 0.00 O ATOM 253 CB MET A 18 -13.445 -10.792 -1.478 1.00 0.00 C ATOM 254 CG MET A 18 -14.421 -10.497 -2.619 1.00 0.00 C ATOM 255 SD MET A 18 -14.771 -12.025 -3.526 1.00 0.00 S ATOM 256 CE MET A 18 -15.737 -12.843 -2.231 1.00 0.00 C ATOM 257 H MET A 18 -10.768 -9.169 -2.049 1.00 0.00 H ATOM 258 HA MET A 18 -13.031 -8.700 -1.729 1.00 0.00 H ATOM 259 HB2 MET A 18 -12.749 -11.558 -1.788 1.00 0.00 H ATOM 260 HB3 MET A 18 -13.996 -11.132 -0.615 1.00 0.00 H ATOM 261 HG2 MET A 18 -15.340 -10.101 -2.213 1.00 0.00 H ATOM 262 HG3 MET A 18 -13.982 -9.773 -3.290 1.00 0.00 H ATOM 263 HE1 MET A 18 -16.595 -12.240 -1.985 1.00 0.00 H ATOM 264 HE2 MET A 18 -16.068 -13.809 -2.586 1.00 0.00 H ATOM 265 HE3 MET A 18 -15.123 -12.968 -1.350 1.00 0.00 H ATOM 266 N GLU A 19 -13.105 -7.940 0.673 1.00 0.00 N ATOM 267 CA GLU A 19 -13.318 -7.556 2.097 1.00 0.00 C ATOM 268 C GLU A 19 -13.677 -6.068 2.172 1.00 0.00 C ATOM 269 O GLU A 19 -13.269 -5.292 1.330 1.00 0.00 O ATOM 270 CB GLU A 19 -12.036 -7.812 2.891 1.00 0.00 C ATOM 271 CG GLU A 19 -12.299 -8.879 3.956 1.00 0.00 C ATOM 272 CD GLU A 19 -11.587 -8.493 5.254 1.00 0.00 C ATOM 273 OE1 GLU A 19 -10.489 -7.967 5.171 1.00 0.00 O ATOM 274 OE2 GLU A 19 -12.152 -8.729 6.309 1.00 0.00 O ATOM 275 H GLU A 19 -13.128 -7.256 -0.028 1.00 0.00 H ATOM 276 HA GLU A 19 -14.123 -8.143 2.512 1.00 0.00 H ATOM 277 HB2 GLU A 19 -11.261 -8.155 2.222 1.00 0.00 H ATOM 278 HB3 GLU A 19 -11.720 -6.898 3.370 1.00 0.00 H ATOM 279 HG2 GLU A 19 -13.361 -8.953 4.136 1.00 0.00 H ATOM 280 HG3 GLU A 19 -11.924 -9.831 3.613 1.00 0.00 H ATOM 281 N PRO A 20 -14.435 -5.717 3.180 1.00 0.00 N ATOM 282 CA PRO A 20 -14.872 -4.327 3.398 1.00 0.00 C ATOM 283 C PRO A 20 -13.743 -3.500 4.020 1.00 0.00 C ATOM 284 O PRO A 20 -13.346 -3.722 5.146 1.00 0.00 O ATOM 285 CB PRO A 20 -16.045 -4.467 4.370 1.00 0.00 C ATOM 286 CG PRO A 20 -15.855 -5.826 5.088 1.00 0.00 C ATOM 287 CD PRO A 20 -14.926 -6.671 4.195 1.00 0.00 C ATOM 288 HA PRO A 20 -15.208 -3.883 2.475 1.00 0.00 H ATOM 289 HB2 PRO A 20 -16.028 -3.658 5.087 1.00 0.00 H ATOM 290 HB3 PRO A 20 -16.977 -4.468 3.830 1.00 0.00 H ATOM 291 HG2 PRO A 20 -15.403 -5.670 6.058 1.00 0.00 H ATOM 292 HG3 PRO A 20 -16.807 -6.322 5.197 1.00 0.00 H ATOM 293 HD2 PRO A 20 -14.105 -7.067 4.775 1.00 0.00 H ATOM 294 HD3 PRO A 20 -15.477 -7.467 3.722 1.00 0.00 H ATOM 295 N LEU A 21 -13.225 -2.549 3.295 1.00 0.00 N ATOM 296 CA LEU A 21 -12.126 -1.706 3.839 1.00 0.00 C ATOM 297 C LEU A 21 -12.641 -0.895 5.030 1.00 0.00 C ATOM 298 O LEU A 21 -13.776 -0.462 5.054 1.00 0.00 O ATOM 299 CB LEU A 21 -11.639 -0.754 2.748 1.00 0.00 C ATOM 300 CG LEU A 21 -10.655 -1.486 1.839 1.00 0.00 C ATOM 301 CD1 LEU A 21 -10.794 -0.967 0.406 1.00 0.00 C ATOM 302 CD2 LEU A 21 -9.231 -1.238 2.335 1.00 0.00 C ATOM 303 H LEU A 21 -13.560 -2.388 2.389 1.00 0.00 H ATOM 304 HA LEU A 21 -11.309 -2.338 4.157 1.00 0.00 H ATOM 305 HB2 LEU A 21 -12.483 -0.412 2.166 1.00 0.00 H ATOM 306 HB3 LEU A 21 -11.146 0.094 3.201 1.00 0.00 H ATOM 307 HG LEU A 21 -10.865 -2.546 1.859 1.00 0.00 H ATOM 308 HD11 LEU A 21 -11.613 -0.265 0.356 1.00 0.00 H ATOM 309 HD12 LEU A 21 -9.878 -0.476 0.111 1.00 0.00 H ATOM 310 HD13 LEU A 21 -10.989 -1.795 -0.259 1.00 0.00 H ATOM 311 HD21 LEU A 21 -9.150 -1.565 3.362 1.00 0.00 H ATOM 312 HD22 LEU A 21 -8.536 -1.792 1.724 1.00 0.00 H ATOM 313 HD23 LEU A 21 -9.008 -0.183 2.275 1.00 0.00 H ATOM 314 N GLU A 22 -11.814 -0.683 6.019 1.00 0.00 N ATOM 315 CA GLU A 22 -12.258 0.103 7.204 1.00 0.00 C ATOM 316 C GLU A 22 -12.117 1.596 6.903 1.00 0.00 C ATOM 317 O GLU A 22 -12.220 2.022 5.769 1.00 0.00 O ATOM 318 CB GLU A 22 -11.391 -0.261 8.413 1.00 0.00 C ATOM 319 CG GLU A 22 -11.249 -1.782 8.503 1.00 0.00 C ATOM 320 CD GLU A 22 -12.196 -2.321 9.577 1.00 0.00 C ATOM 321 OE1 GLU A 22 -13.332 -1.881 9.612 1.00 0.00 O ATOM 322 OE2 GLU A 22 -11.767 -3.165 10.347 1.00 0.00 O ATOM 323 H GLU A 22 -10.902 -1.040 5.980 1.00 0.00 H ATOM 324 HA GLU A 22 -13.291 -0.125 7.420 1.00 0.00 H ATOM 325 HB2 GLU A 22 -10.414 0.187 8.303 1.00 0.00 H ATOM 326 HB3 GLU A 22 -11.856 0.109 9.314 1.00 0.00 H ATOM 327 HG2 GLU A 22 -11.497 -2.224 7.549 1.00 0.00 H ATOM 328 HG3 GLU A 22 -10.232 -2.034 8.763 1.00 0.00 H ATOM 329 N ILE A 23 -11.884 2.397 7.906 1.00 0.00 N ATOM 330 CA ILE A 23 -11.739 3.862 7.672 1.00 0.00 C ATOM 331 C ILE A 23 -10.279 4.185 7.353 1.00 0.00 C ATOM 332 O ILE A 23 -9.968 4.749 6.322 1.00 0.00 O ATOM 333 CB ILE A 23 -12.166 4.624 8.928 1.00 0.00 C ATOM 334 CG1 ILE A 23 -13.668 4.436 9.154 1.00 0.00 C ATOM 335 CG2 ILE A 23 -11.860 6.112 8.751 1.00 0.00 C ATOM 336 CD1 ILE A 23 -14.430 4.836 7.889 1.00 0.00 C ATOM 337 H ILE A 23 -11.805 2.035 8.813 1.00 0.00 H ATOM 338 HA ILE A 23 -12.363 4.158 6.842 1.00 0.00 H ATOM 339 HB ILE A 23 -11.621 4.245 9.781 1.00 0.00 H ATOM 340 HG12 ILE A 23 -13.870 3.400 9.385 1.00 0.00 H ATOM 341 HG13 ILE A 23 -13.989 5.058 9.977 1.00 0.00 H ATOM 342 HG21 ILE A 23 -11.821 6.349 7.697 1.00 0.00 H ATOM 343 HG22 ILE A 23 -12.635 6.698 9.223 1.00 0.00 H ATOM 344 HG23 ILE A 23 -10.908 6.340 9.207 1.00 0.00 H ATOM 345 HD11 ILE A 23 -14.032 5.762 7.506 1.00 0.00 H ATOM 346 HD12 ILE A 23 -14.321 4.061 7.144 1.00 0.00 H ATOM 347 HD13 ILE A 23 -15.477 4.963 8.125 1.00 0.00 H ATOM 348 N ASP A 24 -9.380 3.837 8.232 1.00 0.00 N ATOM 349 CA ASP A 24 -7.940 4.127 7.981 1.00 0.00 C ATOM 350 C ASP A 24 -7.418 3.217 6.865 1.00 0.00 C ATOM 351 O ASP A 24 -6.326 3.400 6.365 1.00 0.00 O ATOM 352 CB ASP A 24 -7.139 3.874 9.259 1.00 0.00 C ATOM 353 CG ASP A 24 -7.111 5.148 10.104 1.00 0.00 C ATOM 354 OD1 ASP A 24 -6.324 6.026 9.791 1.00 0.00 O ATOM 355 OD2 ASP A 24 -7.876 5.225 11.052 1.00 0.00 O ATOM 356 H ASP A 24 -9.653 3.387 9.058 1.00 0.00 H ATOM 357 HA ASP A 24 -7.828 5.160 7.685 1.00 0.00 H ATOM 358 HB2 ASP A 24 -7.603 3.077 9.822 1.00 0.00 H ATOM 359 HB3 ASP A 24 -6.130 3.592 9.002 1.00 0.00 H ATOM 360 N ASP A 25 -8.187 2.239 6.472 1.00 0.00 N ATOM 361 CA ASP A 25 -7.731 1.320 5.391 1.00 0.00 C ATOM 362 C ASP A 25 -8.097 1.907 4.026 1.00 0.00 C ATOM 363 O ASP A 25 -7.728 1.380 2.996 1.00 0.00 O ATOM 364 CB ASP A 25 -8.411 -0.040 5.556 1.00 0.00 C ATOM 365 CG ASP A 25 -7.978 -0.674 6.880 1.00 0.00 C ATOM 366 OD1 ASP A 25 -7.941 0.039 7.871 1.00 0.00 O ATOM 367 OD2 ASP A 25 -7.691 -1.859 6.881 1.00 0.00 O ATOM 368 H ASP A 25 -9.064 2.107 6.889 1.00 0.00 H ATOM 369 HA ASP A 25 -6.659 1.195 5.453 1.00 0.00 H ATOM 370 HB2 ASP A 25 -9.483 0.093 5.554 1.00 0.00 H ATOM 371 HB3 ASP A 25 -8.126 -0.687 4.741 1.00 0.00 H ATOM 372 N ILE A 26 -8.822 2.991 4.008 1.00 0.00 N ATOM 373 CA ILE A 26 -9.210 3.605 2.705 1.00 0.00 C ATOM 374 C ILE A 26 -7.971 4.196 2.028 1.00 0.00 C ATOM 375 O ILE A 26 -7.573 3.774 0.962 1.00 0.00 O ATOM 376 CB ILE A 26 -10.235 4.711 2.949 1.00 0.00 C ATOM 377 CG1 ILE A 26 -11.438 4.137 3.702 1.00 0.00 C ATOM 378 CG2 ILE A 26 -10.699 5.282 1.607 1.00 0.00 C ATOM 379 CD1 ILE A 26 -12.206 3.184 2.784 1.00 0.00 C ATOM 380 H ILE A 26 -9.112 3.402 4.849 1.00 0.00 H ATOM 381 HA ILE A 26 -9.642 2.846 2.067 1.00 0.00 H ATOM 382 HB ILE A 26 -9.783 5.498 3.536 1.00 0.00 H ATOM 383 HG12 ILE A 26 -11.093 3.599 4.573 1.00 0.00 H ATOM 384 HG13 ILE A 26 -12.088 4.940 4.009 1.00 0.00 H ATOM 385 HG21 ILE A 26 -9.842 5.627 1.047 1.00 0.00 H ATOM 386 HG22 ILE A 26 -11.210 4.512 1.046 1.00 0.00 H ATOM 387 HG23 ILE A 26 -11.372 6.107 1.781 1.00 0.00 H ATOM 388 HD11 ILE A 26 -11.506 2.607 2.197 1.00 0.00 H ATOM 389 HD12 ILE A 26 -12.809 2.517 3.383 1.00 0.00 H ATOM 390 HD13 ILE A 26 -12.844 3.754 2.127 1.00 0.00 H ATOM 391 N ASN A 27 -7.359 5.172 2.642 1.00 0.00 N ATOM 392 CA ASN A 27 -6.144 5.792 2.036 1.00 0.00 C ATOM 393 C ASN A 27 -4.901 5.037 2.512 1.00 0.00 C ATOM 394 O ASN A 27 -3.813 5.575 2.555 1.00 0.00 O ATOM 395 CB ASN A 27 -6.046 7.258 2.468 1.00 0.00 C ATOM 396 CG ASN A 27 -6.399 7.383 3.952 1.00 0.00 C ATOM 397 OD1 ASN A 27 -7.337 8.068 4.309 1.00 0.00 O ATOM 398 ND2 ASN A 27 -5.685 6.744 4.837 1.00 0.00 N ATOM 399 H ASN A 27 -7.696 5.497 3.502 1.00 0.00 H ATOM 400 HA ASN A 27 -6.206 5.737 0.959 1.00 0.00 H ATOM 401 HB2 ASN A 27 -5.039 7.615 2.306 1.00 0.00 H ATOM 402 HB3 ASN A 27 -6.735 7.851 1.886 1.00 0.00 H ATOM 403 HD21 ASN A 27 -4.929 6.192 4.550 1.00 0.00 H ATOM 404 HD22 ASN A 27 -5.906 6.817 5.789 1.00 0.00 H ATOM 405 N PHE A 28 -5.056 3.792 2.871 1.00 0.00 N ATOM 406 CA PHE A 28 -3.886 3.004 3.345 1.00 0.00 C ATOM 407 C PHE A 28 -3.386 2.097 2.217 1.00 0.00 C ATOM 408 O PHE A 28 -4.065 1.182 1.795 1.00 0.00 O ATOM 409 CB PHE A 28 -4.298 2.144 4.544 1.00 0.00 C ATOM 410 CG PHE A 28 -3.224 1.118 4.821 1.00 0.00 C ATOM 411 CD1 PHE A 28 -1.992 1.520 5.346 1.00 0.00 C ATOM 412 CD2 PHE A 28 -3.461 -0.234 4.545 1.00 0.00 C ATOM 413 CE1 PHE A 28 -0.995 0.570 5.597 1.00 0.00 C ATOM 414 CE2 PHE A 28 -2.463 -1.184 4.794 1.00 0.00 C ATOM 415 CZ PHE A 28 -1.231 -0.782 5.321 1.00 0.00 C ATOM 416 H PHE A 28 -5.942 3.376 2.831 1.00 0.00 H ATOM 417 HA PHE A 28 -3.095 3.677 3.641 1.00 0.00 H ATOM 418 HB2 PHE A 28 -4.427 2.775 5.412 1.00 0.00 H ATOM 419 HB3 PHE A 28 -5.228 1.641 4.323 1.00 0.00 H ATOM 420 HD1 PHE A 28 -1.810 2.563 5.560 1.00 0.00 H ATOM 421 HD2 PHE A 28 -4.412 -0.544 4.139 1.00 0.00 H ATOM 422 HE1 PHE A 28 -0.043 0.880 6.004 1.00 0.00 H ATOM 423 HE2 PHE A 28 -2.646 -2.227 4.580 1.00 0.00 H ATOM 424 HZ PHE A 28 -0.461 -1.515 5.513 1.00 0.00 H ATOM 425 N PHE A 29 -2.199 2.338 1.736 1.00 0.00 N ATOM 426 CA PHE A 29 -1.648 1.484 0.646 1.00 0.00 C ATOM 427 C PHE A 29 -0.170 1.214 0.919 1.00 0.00 C ATOM 428 O PHE A 29 0.523 2.059 1.450 1.00 0.00 O ATOM 429 CB PHE A 29 -1.779 2.198 -0.703 1.00 0.00 C ATOM 430 CG PHE A 29 -1.697 3.688 -0.497 1.00 0.00 C ATOM 431 CD1 PHE A 29 -0.477 4.284 -0.149 1.00 0.00 C ATOM 432 CD2 PHE A 29 -2.845 4.475 -0.647 1.00 0.00 C ATOM 433 CE1 PHE A 29 -0.408 5.668 0.047 1.00 0.00 C ATOM 434 CE2 PHE A 29 -2.778 5.857 -0.450 1.00 0.00 C ATOM 435 CZ PHE A 29 -1.559 6.455 -0.103 1.00 0.00 C ATOM 436 H PHE A 29 -1.664 3.076 2.097 1.00 0.00 H ATOM 437 HA PHE A 29 -2.187 0.549 0.614 1.00 0.00 H ATOM 438 HB2 PHE A 29 -0.980 1.881 -1.357 1.00 0.00 H ATOM 439 HB3 PHE A 29 -2.728 1.950 -1.150 1.00 0.00 H ATOM 440 HD1 PHE A 29 0.413 3.675 -0.035 1.00 0.00 H ATOM 441 HD2 PHE A 29 -3.784 4.014 -0.919 1.00 0.00 H ATOM 442 HE1 PHE A 29 0.530 6.130 0.314 1.00 0.00 H ATOM 443 HE2 PHE A 29 -3.666 6.463 -0.564 1.00 0.00 H ATOM 444 HZ PHE A 29 -1.505 7.523 0.049 1.00 0.00 H ATOM 445 N PRO A 30 0.272 0.047 0.537 1.00 0.00 N ATOM 446 CA PRO A 30 1.673 -0.356 0.715 1.00 0.00 C ATOM 447 C PRO A 30 2.536 0.320 -0.348 1.00 0.00 C ATOM 448 O PRO A 30 3.745 0.320 -0.271 1.00 0.00 O ATOM 449 CB PRO A 30 1.640 -1.874 0.518 1.00 0.00 C ATOM 450 CG PRO A 30 0.366 -2.179 -0.302 1.00 0.00 C ATOM 451 CD PRO A 30 -0.576 -0.975 -0.111 1.00 0.00 C ATOM 452 HA PRO A 30 2.019 -0.114 1.707 1.00 0.00 H ATOM 453 HB2 PRO A 30 2.521 -2.195 -0.023 1.00 0.00 H ATOM 454 HB3 PRO A 30 1.586 -2.371 1.473 1.00 0.00 H ATOM 455 HG2 PRO A 30 0.618 -2.293 -1.347 1.00 0.00 H ATOM 456 HG3 PRO A 30 -0.109 -3.075 0.067 1.00 0.00 H ATOM 457 HD2 PRO A 30 -0.936 -0.622 -1.068 1.00 0.00 H ATOM 458 HD3 PRO A 30 -1.402 -1.237 0.533 1.00 0.00 H ATOM 459 N CYS A 31 1.917 0.902 -1.340 1.00 0.00 N ATOM 460 CA CYS A 31 2.696 1.581 -2.412 1.00 0.00 C ATOM 461 C CYS A 31 1.923 2.811 -2.898 1.00 0.00 C ATOM 462 O CYS A 31 0.719 2.897 -2.752 1.00 0.00 O ATOM 463 CB CYS A 31 2.900 0.606 -3.574 1.00 0.00 C ATOM 464 SG CYS A 31 3.548 1.495 -5.010 1.00 0.00 S ATOM 465 H CYS A 31 0.938 0.892 -1.379 1.00 0.00 H ATOM 466 HA CYS A 31 3.656 1.887 -2.024 1.00 0.00 H ATOM 467 HB2 CYS A 31 3.602 -0.161 -3.280 1.00 0.00 H ATOM 468 HB3 CYS A 31 1.955 0.150 -3.829 1.00 0.00 H ATOM 469 N THR A 32 2.604 3.766 -3.472 1.00 0.00 N ATOM 470 CA THR A 32 1.905 4.989 -3.961 1.00 0.00 C ATOM 471 C THR A 32 1.469 4.795 -5.416 1.00 0.00 C ATOM 472 O THR A 32 2.017 5.391 -6.322 1.00 0.00 O ATOM 473 CB THR A 32 2.853 6.189 -3.874 1.00 0.00 C ATOM 474 OG1 THR A 32 4.125 5.825 -4.398 1.00 0.00 O ATOM 475 CG2 THR A 32 2.997 6.622 -2.413 1.00 0.00 C ATOM 476 H THR A 32 3.574 3.681 -3.578 1.00 0.00 H ATOM 477 HA THR A 32 1.036 5.176 -3.348 1.00 0.00 H ATOM 478 HB THR A 32 2.449 7.008 -4.449 1.00 0.00 H ATOM 479 HG1 THR A 32 4.732 5.718 -3.662 1.00 0.00 H ATOM 480 HG21 THR A 32 2.212 6.171 -1.825 1.00 0.00 H ATOM 481 HG22 THR A 32 3.958 6.302 -2.037 1.00 0.00 H ATOM 482 HG23 THR A 32 2.924 7.698 -2.348 1.00 0.00 H ATOM 483 N CYS A 33 0.480 3.975 -5.650 1.00 0.00 N ATOM 484 CA CYS A 33 0.011 3.759 -7.048 1.00 0.00 C ATOM 485 C CYS A 33 -1.466 3.350 -7.042 1.00 0.00 C ATOM 486 O CYS A 33 -1.981 2.833 -8.013 1.00 0.00 O ATOM 487 CB CYS A 33 0.853 2.666 -7.712 1.00 0.00 C ATOM 488 SG CYS A 33 0.423 1.052 -7.019 1.00 0.00 S ATOM 489 H CYS A 33 0.044 3.507 -4.907 1.00 0.00 H ATOM 490 HA CYS A 33 0.121 4.679 -7.603 1.00 0.00 H ATOM 491 HB2 CYS A 33 0.663 2.662 -8.775 1.00 0.00 H ATOM 492 HB3 CYS A 33 1.900 2.866 -7.537 1.00 0.00 H ATOM 493 N GLY A 34 -2.153 3.590 -5.958 1.00 0.00 N ATOM 494 CA GLY A 34 -3.600 3.230 -5.894 1.00 0.00 C ATOM 495 C GLY A 34 -3.764 1.724 -5.669 1.00 0.00 C ATOM 496 O GLY A 34 -4.846 1.186 -5.791 1.00 0.00 O ATOM 497 H GLY A 34 -1.721 4.017 -5.189 1.00 0.00 H ATOM 498 HA2 GLY A 34 -4.081 3.507 -6.819 1.00 0.00 H ATOM 499 HA3 GLY A 34 -4.063 3.765 -5.074 1.00 0.00 H ATOM 500 N TYR A 35 -2.706 1.040 -5.328 1.00 0.00 N ATOM 501 CA TYR A 35 -2.816 -0.428 -5.080 1.00 0.00 C ATOM 502 C TYR A 35 -3.134 -0.645 -3.589 1.00 0.00 C ATOM 503 O TYR A 35 -2.770 -1.634 -2.988 1.00 0.00 O ATOM 504 CB TYR A 35 -1.486 -1.101 -5.476 1.00 0.00 C ATOM 505 CG TYR A 35 -1.362 -2.470 -4.842 1.00 0.00 C ATOM 506 CD1 TYR A 35 -2.192 -3.523 -5.253 1.00 0.00 C ATOM 507 CD2 TYR A 35 -0.411 -2.682 -3.836 1.00 0.00 C ATOM 508 CE1 TYR A 35 -2.068 -4.784 -4.655 1.00 0.00 C ATOM 509 CE2 TYR A 35 -0.290 -3.941 -3.240 1.00 0.00 C ATOM 510 CZ TYR A 35 -1.117 -4.992 -3.649 1.00 0.00 C ATOM 511 OH TYR A 35 -0.997 -6.234 -3.060 1.00 0.00 O ATOM 512 H TYR A 35 -1.844 1.492 -5.223 1.00 0.00 H ATOM 513 HA TYR A 35 -3.619 -0.833 -5.680 1.00 0.00 H ATOM 514 HB2 TYR A 35 -1.449 -1.205 -6.550 1.00 0.00 H ATOM 515 HB3 TYR A 35 -0.664 -0.482 -5.152 1.00 0.00 H ATOM 516 HD1 TYR A 35 -2.926 -3.365 -6.029 1.00 0.00 H ATOM 517 HD2 TYR A 35 0.229 -1.872 -3.522 1.00 0.00 H ATOM 518 HE1 TYR A 35 -2.705 -5.595 -4.971 1.00 0.00 H ATOM 519 HE2 TYR A 35 0.443 -4.103 -2.463 1.00 0.00 H ATOM 520 HH TYR A 35 -0.840 -6.103 -2.122 1.00 0.00 H ATOM 521 N GLN A 36 -3.828 0.287 -2.988 1.00 0.00 N ATOM 522 CA GLN A 36 -4.176 0.147 -1.547 1.00 0.00 C ATOM 523 C GLN A 36 -4.879 -1.190 -1.314 1.00 0.00 C ATOM 524 O GLN A 36 -5.714 -1.610 -2.090 1.00 0.00 O ATOM 525 CB GLN A 36 -5.110 1.287 -1.129 1.00 0.00 C ATOM 526 CG GLN A 36 -6.182 1.493 -2.200 1.00 0.00 C ATOM 527 CD GLN A 36 -7.506 1.866 -1.529 1.00 0.00 C ATOM 528 OE1 GLN A 36 -8.263 1.004 -1.129 1.00 0.00 O ATOM 529 NE2 GLN A 36 -7.819 3.126 -1.389 1.00 0.00 N ATOM 530 H GLN A 36 -4.119 1.077 -3.484 1.00 0.00 H ATOM 531 HA GLN A 36 -3.275 0.185 -0.954 1.00 0.00 H ATOM 532 HB2 GLN A 36 -5.581 1.039 -0.189 1.00 0.00 H ATOM 533 HB3 GLN A 36 -4.541 2.198 -1.016 1.00 0.00 H ATOM 534 HG2 GLN A 36 -5.878 2.289 -2.865 1.00 0.00 H ATOM 535 HG3 GLN A 36 -6.310 0.580 -2.763 1.00 0.00 H ATOM 536 HE21 GLN A 36 -7.209 3.821 -1.712 1.00 0.00 H ATOM 537 HE22 GLN A 36 -8.664 3.376 -0.960 1.00 0.00 H ATOM 538 N ILE A 37 -4.549 -1.858 -0.246 1.00 0.00 N ATOM 539 CA ILE A 37 -5.198 -3.162 0.048 1.00 0.00 C ATOM 540 C ILE A 37 -5.688 -3.160 1.495 1.00 0.00 C ATOM 541 O ILE A 37 -5.570 -2.175 2.198 1.00 0.00 O ATOM 542 CB ILE A 37 -4.189 -4.295 -0.155 1.00 0.00 C ATOM 543 CG1 ILE A 37 -3.028 -4.129 0.828 1.00 0.00 C ATOM 544 CG2 ILE A 37 -3.650 -4.251 -1.585 1.00 0.00 C ATOM 545 CD1 ILE A 37 -1.967 -5.193 0.543 1.00 0.00 C ATOM 546 H ILE A 37 -3.875 -1.498 0.368 1.00 0.00 H ATOM 547 HA ILE A 37 -6.037 -3.304 -0.617 1.00 0.00 H ATOM 548 HB ILE A 37 -4.675 -5.245 0.017 1.00 0.00 H ATOM 549 HG12 ILE A 37 -2.595 -3.146 0.712 1.00 0.00 H ATOM 550 HG13 ILE A 37 -3.390 -4.246 1.838 1.00 0.00 H ATOM 551 HG21 ILE A 37 -4.449 -3.983 -2.261 1.00 0.00 H ATOM 552 HG22 ILE A 37 -2.861 -3.516 -1.652 1.00 0.00 H ATOM 553 HG23 ILE A 37 -3.262 -5.222 -1.854 1.00 0.00 H ATOM 554 HD11 ILE A 37 -2.170 -5.656 -0.412 1.00 0.00 H ATOM 555 HD12 ILE A 37 -0.991 -4.733 0.518 1.00 0.00 H ATOM 556 HD13 ILE A 37 -1.992 -5.945 1.318 1.00 0.00 H ATOM 557 N CYS A 38 -6.237 -4.252 1.950 1.00 0.00 N ATOM 558 CA CYS A 38 -6.732 -4.302 3.352 1.00 0.00 C ATOM 559 C CYS A 38 -5.561 -4.631 4.284 1.00 0.00 C ATOM 560 O CYS A 38 -4.519 -5.081 3.850 1.00 0.00 O ATOM 561 CB CYS A 38 -7.829 -5.370 3.471 1.00 0.00 C ATOM 562 SG CYS A 38 -7.091 -7.025 3.475 1.00 0.00 S ATOM 563 H CYS A 38 -6.321 -5.035 1.371 1.00 0.00 H ATOM 564 HA CYS A 38 -7.140 -3.339 3.621 1.00 0.00 H ATOM 565 HB2 CYS A 38 -8.374 -5.222 4.391 1.00 0.00 H ATOM 566 HB3 CYS A 38 -8.507 -5.282 2.635 1.00 0.00 H ATOM 567 N ARG A 39 -5.715 -4.400 5.559 1.00 0.00 N ATOM 568 CA ARG A 39 -4.600 -4.693 6.503 1.00 0.00 C ATOM 569 C ARG A 39 -4.335 -6.199 6.537 1.00 0.00 C ATOM 570 O ARG A 39 -3.258 -6.641 6.887 1.00 0.00 O ATOM 571 CB ARG A 39 -4.971 -4.205 7.905 1.00 0.00 C ATOM 572 CG ARG A 39 -4.133 -2.973 8.251 1.00 0.00 C ATOM 573 CD ARG A 39 -5.048 -1.857 8.758 1.00 0.00 C ATOM 574 NE ARG A 39 -4.583 -1.405 10.100 1.00 0.00 N ATOM 575 CZ ARG A 39 -5.450 -1.010 10.992 1.00 0.00 C ATOM 576 NH1 ARG A 39 -5.768 -1.796 11.984 1.00 0.00 N ATOM 577 NH2 ARG A 39 -5.998 0.170 10.894 1.00 0.00 N ATOM 578 H ARG A 39 -6.559 -4.031 5.893 1.00 0.00 H ATOM 579 HA ARG A 39 -3.709 -4.181 6.171 1.00 0.00 H ATOM 580 HB2 ARG A 39 -6.020 -3.947 7.930 1.00 0.00 H ATOM 581 HB3 ARG A 39 -4.775 -4.985 8.624 1.00 0.00 H ATOM 582 HG2 ARG A 39 -3.417 -3.229 9.019 1.00 0.00 H ATOM 583 HG3 ARG A 39 -3.609 -2.634 7.370 1.00 0.00 H ATOM 584 HD2 ARG A 39 -5.020 -1.027 8.068 1.00 0.00 H ATOM 585 HD3 ARG A 39 -6.060 -2.229 8.834 1.00 0.00 H ATOM 586 HE ARG A 39 -3.628 -1.405 10.312 1.00 0.00 H ATOM 587 HH11 ARG A 39 -5.347 -2.701 12.061 1.00 0.00 H ATOM 588 HH12 ARG A 39 -6.433 -1.495 12.668 1.00 0.00 H ATOM 589 HH21 ARG A 39 -5.752 0.774 10.135 1.00 0.00 H ATOM 590 HH22 ARG A 39 -6.663 0.472 11.577 1.00 0.00 H ATOM 591 N PHE A 40 -5.305 -6.993 6.173 1.00 0.00 N ATOM 592 CA PHE A 40 -5.101 -8.469 6.184 1.00 0.00 C ATOM 593 C PHE A 40 -4.280 -8.880 4.957 1.00 0.00 C ATOM 594 O PHE A 40 -3.710 -9.952 4.910 1.00 0.00 O ATOM 595 CB PHE A 40 -6.462 -9.170 6.148 1.00 0.00 C ATOM 596 CG PHE A 40 -6.482 -10.277 7.174 1.00 0.00 C ATOM 597 CD1 PHE A 40 -5.347 -11.072 7.364 1.00 0.00 C ATOM 598 CD2 PHE A 40 -7.634 -10.507 7.935 1.00 0.00 C ATOM 599 CE1 PHE A 40 -5.362 -12.099 8.314 1.00 0.00 C ATOM 600 CE2 PHE A 40 -7.650 -11.535 8.886 1.00 0.00 C ATOM 601 CZ PHE A 40 -6.514 -12.330 9.075 1.00 0.00 C ATOM 602 H PHE A 40 -6.165 -6.618 5.891 1.00 0.00 H ATOM 603 HA PHE A 40 -4.572 -8.753 7.082 1.00 0.00 H ATOM 604 HB2 PHE A 40 -7.241 -8.456 6.372 1.00 0.00 H ATOM 605 HB3 PHE A 40 -6.627 -9.588 5.166 1.00 0.00 H ATOM 606 HD1 PHE A 40 -4.459 -10.893 6.777 1.00 0.00 H ATOM 607 HD2 PHE A 40 -8.511 -9.893 7.789 1.00 0.00 H ATOM 608 HE1 PHE A 40 -4.486 -12.712 8.461 1.00 0.00 H ATOM 609 HE2 PHE A 40 -8.539 -11.714 9.473 1.00 0.00 H ATOM 610 HZ PHE A 40 -6.526 -13.123 9.809 1.00 0.00 H ATOM 611 N CYS A 41 -4.212 -8.033 3.965 1.00 0.00 N ATOM 612 CA CYS A 41 -3.425 -8.371 2.744 1.00 0.00 C ATOM 613 C CYS A 41 -1.989 -7.869 2.905 1.00 0.00 C ATOM 614 O CYS A 41 -1.041 -8.537 2.542 1.00 0.00 O ATOM 615 CB CYS A 41 -4.065 -7.704 1.521 1.00 0.00 C ATOM 616 SG CYS A 41 -5.276 -8.827 0.781 1.00 0.00 S ATOM 617 H CYS A 41 -4.674 -7.172 4.025 1.00 0.00 H ATOM 618 HA CYS A 41 -3.419 -9.442 2.606 1.00 0.00 H ATOM 619 HB2 CYS A 41 -4.557 -6.792 1.825 1.00 0.00 H ATOM 620 HB3 CYS A 41 -3.297 -7.474 0.797 1.00 0.00 H ATOM 621 N TRP A 42 -1.824 -6.690 3.441 1.00 0.00 N ATOM 622 CA TRP A 42 -0.453 -6.131 3.623 1.00 0.00 C ATOM 623 C TRP A 42 0.292 -6.926 4.697 1.00 0.00 C ATOM 624 O TRP A 42 1.495 -7.089 4.639 1.00 0.00 O ATOM 625 CB TRP A 42 -0.559 -4.667 4.056 1.00 0.00 C ATOM 626 CG TRP A 42 0.813 -4.099 4.240 1.00 0.00 C ATOM 627 CD1 TRP A 42 1.707 -3.891 3.247 1.00 0.00 C ATOM 628 CD2 TRP A 42 1.459 -3.664 5.471 1.00 0.00 C ATOM 629 NE1 TRP A 42 2.860 -3.355 3.789 1.00 0.00 N ATOM 630 CE2 TRP A 42 2.757 -3.197 5.157 1.00 0.00 C ATOM 631 CE3 TRP A 42 1.050 -3.630 6.817 1.00 0.00 C ATOM 632 CZ2 TRP A 42 3.619 -2.713 6.142 1.00 0.00 C ATOM 633 CZ3 TRP A 42 1.915 -3.143 7.811 1.00 0.00 C ATOM 634 CH2 TRP A 42 3.197 -2.685 7.474 1.00 0.00 C ATOM 635 H TRP A 42 -2.605 -6.169 3.721 1.00 0.00 H ATOM 636 HA TRP A 42 0.088 -6.193 2.690 1.00 0.00 H ATOM 637 HB2 TRP A 42 -1.081 -4.104 3.296 1.00 0.00 H ATOM 638 HB3 TRP A 42 -1.101 -4.604 4.987 1.00 0.00 H ATOM 639 HD1 TRP A 42 1.545 -4.107 2.201 1.00 0.00 H ATOM 640 HE1 TRP A 42 3.663 -3.111 3.282 1.00 0.00 H ATOM 641 HE3 TRP A 42 0.065 -3.980 7.088 1.00 0.00 H ATOM 642 HZ2 TRP A 42 4.605 -2.361 5.877 1.00 0.00 H ATOM 643 HZ3 TRP A 42 1.592 -3.121 8.842 1.00 0.00 H ATOM 644 HH2 TRP A 42 3.858 -2.313 8.244 1.00 0.00 H ATOM 645 N HIS A 43 -0.409 -7.417 5.681 1.00 0.00 N ATOM 646 CA HIS A 43 0.261 -8.193 6.762 1.00 0.00 C ATOM 647 C HIS A 43 0.844 -9.488 6.189 1.00 0.00 C ATOM 648 O HIS A 43 1.580 -10.192 6.852 1.00 0.00 O ATOM 649 CB HIS A 43 -0.760 -8.532 7.850 1.00 0.00 C ATOM 650 CG HIS A 43 -0.465 -7.722 9.080 1.00 0.00 C ATOM 651 ND1 HIS A 43 -0.318 -8.301 10.331 1.00 0.00 N ATOM 652 CD2 HIS A 43 -0.284 -6.374 9.268 1.00 0.00 C ATOM 653 CE1 HIS A 43 -0.060 -7.312 11.208 1.00 0.00 C ATOM 654 NE2 HIS A 43 -0.029 -6.118 10.613 1.00 0.00 N ATOM 655 H HIS A 43 -1.378 -7.271 5.712 1.00 0.00 H ATOM 656 HA HIS A 43 1.056 -7.601 7.190 1.00 0.00 H ATOM 657 HB2 HIS A 43 -1.754 -8.301 7.494 1.00 0.00 H ATOM 658 HB3 HIS A 43 -0.698 -9.584 8.087 1.00 0.00 H ATOM 659 HD1 HIS A 43 -0.389 -9.256 10.539 1.00 0.00 H ATOM 660 HD2 HIS A 43 -0.332 -5.625 8.491 1.00 0.00 H ATOM 661 HE1 HIS A 43 0.103 -7.467 12.264 1.00 0.00 H ATOM 662 N ARG A 44 0.518 -9.812 4.968 1.00 0.00 N ATOM 663 CA ARG A 44 1.052 -11.066 4.364 1.00 0.00 C ATOM 664 C ARG A 44 2.238 -10.739 3.451 1.00 0.00 C ATOM 665 O ARG A 44 3.287 -11.344 3.539 1.00 0.00 O ATOM 666 CB ARG A 44 -0.048 -11.744 3.547 1.00 0.00 C ATOM 667 CG ARG A 44 0.305 -13.219 3.341 1.00 0.00 C ATOM 668 CD ARG A 44 -0.306 -13.711 2.028 1.00 0.00 C ATOM 669 NE ARG A 44 0.271 -15.039 1.680 1.00 0.00 N ATOM 670 CZ ARG A 44 -0.334 -15.806 0.815 1.00 0.00 C ATOM 671 NH1 ARG A 44 -0.855 -15.287 -0.263 1.00 0.00 N ATOM 672 NH2 ARG A 44 -0.417 -17.091 1.026 1.00 0.00 N ATOM 673 H ARG A 44 -0.081 -9.234 4.449 1.00 0.00 H ATOM 674 HA ARG A 44 1.378 -11.733 5.150 1.00 0.00 H ATOM 675 HB2 ARG A 44 -0.987 -11.669 4.077 1.00 0.00 H ATOM 676 HB3 ARG A 44 -0.134 -11.259 2.587 1.00 0.00 H ATOM 677 HG2 ARG A 44 1.379 -13.330 3.303 1.00 0.00 H ATOM 678 HG3 ARG A 44 -0.090 -13.801 4.160 1.00 0.00 H ATOM 679 HD2 ARG A 44 -1.377 -13.802 2.140 1.00 0.00 H ATOM 680 HD3 ARG A 44 -0.085 -13.004 1.241 1.00 0.00 H ATOM 681 HE ARG A 44 1.105 -15.336 2.099 1.00 0.00 H ATOM 682 HH11 ARG A 44 -0.793 -14.303 -0.425 1.00 0.00 H ATOM 683 HH12 ARG A 44 -1.319 -15.874 -0.927 1.00 0.00 H ATOM 684 HH21 ARG A 44 -0.018 -17.489 1.851 1.00 0.00 H ATOM 685 HH22 ARG A 44 -0.881 -17.677 0.362 1.00 0.00 H ATOM 686 N ILE A 45 2.077 -9.789 2.569 1.00 0.00 N ATOM 687 CA ILE A 45 3.191 -9.427 1.646 1.00 0.00 C ATOM 688 C ILE A 45 4.415 -8.984 2.455 1.00 0.00 C ATOM 689 O ILE A 45 5.538 -9.311 2.126 1.00 0.00 O ATOM 690 CB ILE A 45 2.740 -8.284 0.734 1.00 0.00 C ATOM 691 CG1 ILE A 45 1.752 -8.820 -0.305 1.00 0.00 C ATOM 692 CG2 ILE A 45 3.953 -7.685 0.019 1.00 0.00 C ATOM 693 CD1 ILE A 45 0.909 -7.667 -0.854 1.00 0.00 C ATOM 694 H ILE A 45 1.221 -9.316 2.511 1.00 0.00 H ATOM 695 HA ILE A 45 3.451 -10.285 1.042 1.00 0.00 H ATOM 696 HB ILE A 45 2.260 -7.518 1.327 1.00 0.00 H ATOM 697 HG12 ILE A 45 2.297 -9.285 -1.114 1.00 0.00 H ATOM 698 HG13 ILE A 45 1.104 -9.549 0.158 1.00 0.00 H ATOM 699 HG21 ILE A 45 4.780 -8.379 0.070 1.00 0.00 H ATOM 700 HG22 ILE A 45 3.706 -7.495 -1.015 1.00 0.00 H ATOM 701 HG23 ILE A 45 4.232 -6.758 0.498 1.00 0.00 H ATOM 702 HD11 ILE A 45 0.785 -6.915 -0.089 1.00 0.00 H ATOM 703 HD12 ILE A 45 1.406 -7.233 -1.709 1.00 0.00 H ATOM 704 HD13 ILE A 45 -0.061 -8.039 -1.152 1.00 0.00 H ATOM 705 N ARG A 46 4.208 -8.235 3.503 1.00 0.00 N ATOM 706 CA ARG A 46 5.363 -7.764 4.322 1.00 0.00 C ATOM 707 C ARG A 46 5.868 -8.898 5.220 1.00 0.00 C ATOM 708 O ARG A 46 6.927 -8.807 5.808 1.00 0.00 O ATOM 709 CB ARG A 46 4.922 -6.584 5.190 1.00 0.00 C ATOM 710 CG ARG A 46 5.402 -5.277 4.556 1.00 0.00 C ATOM 711 CD ARG A 46 6.230 -4.488 5.571 1.00 0.00 C ATOM 712 NE ARG A 46 7.149 -5.414 6.291 1.00 0.00 N ATOM 713 CZ ARG A 46 7.318 -5.293 7.578 1.00 0.00 C ATOM 714 NH1 ARG A 46 7.607 -4.128 8.092 1.00 0.00 N ATOM 715 NH2 ARG A 46 7.197 -6.337 8.353 1.00 0.00 N ATOM 716 H ARG A 46 3.296 -7.976 3.748 1.00 0.00 H ATOM 717 HA ARG A 46 6.160 -7.447 3.666 1.00 0.00 H ATOM 718 HB2 ARG A 46 3.845 -6.576 5.266 1.00 0.00 H ATOM 719 HB3 ARG A 46 5.352 -6.682 6.176 1.00 0.00 H ATOM 720 HG2 ARG A 46 6.008 -5.499 3.689 1.00 0.00 H ATOM 721 HG3 ARG A 46 4.547 -4.688 4.255 1.00 0.00 H ATOM 722 HD2 ARG A 46 6.808 -3.734 5.056 1.00 0.00 H ATOM 723 HD3 ARG A 46 5.570 -4.011 6.282 1.00 0.00 H ATOM 724 HE ARG A 46 7.627 -6.112 5.796 1.00 0.00 H ATOM 725 HH11 ARG A 46 7.700 -3.329 7.496 1.00 0.00 H ATOM 726 HH12 ARG A 46 7.737 -4.035 9.078 1.00 0.00 H ATOM 727 HH21 ARG A 46 6.976 -7.228 7.959 1.00 0.00 H ATOM 728 HH22 ARG A 46 7.326 -6.244 9.341 1.00 0.00 H ATOM 729 N THR A 47 5.124 -9.965 5.332 1.00 0.00 N ATOM 730 CA THR A 47 5.578 -11.093 6.195 1.00 0.00 C ATOM 731 C THR A 47 5.612 -12.386 5.375 1.00 0.00 C ATOM 732 O THR A 47 5.707 -13.471 5.914 1.00 0.00 O ATOM 733 CB THR A 47 4.620 -11.249 7.386 1.00 0.00 C ATOM 734 OG1 THR A 47 5.281 -11.944 8.433 1.00 0.00 O ATOM 735 CG2 THR A 47 3.372 -12.029 6.964 1.00 0.00 C ATOM 736 H THR A 47 4.274 -10.025 4.851 1.00 0.00 H ATOM 737 HA THR A 47 6.571 -10.880 6.564 1.00 0.00 H ATOM 738 HB THR A 47 4.324 -10.271 7.736 1.00 0.00 H ATOM 739 HG1 THR A 47 4.975 -11.583 9.268 1.00 0.00 H ATOM 740 HG21 THR A 47 3.054 -11.700 5.986 1.00 0.00 H ATOM 741 HG22 THR A 47 3.603 -13.084 6.930 1.00 0.00 H ATOM 742 HG23 THR A 47 2.580 -11.856 7.677 1.00 0.00 H ATOM 743 N ASP A 48 5.538 -12.279 4.076 1.00 0.00 N ATOM 744 CA ASP A 48 5.570 -13.502 3.226 1.00 0.00 C ATOM 745 C ASP A 48 5.916 -13.115 1.786 1.00 0.00 C ATOM 746 O ASP A 48 5.559 -13.800 0.848 1.00 0.00 O ATOM 747 CB ASP A 48 4.199 -14.181 3.257 1.00 0.00 C ATOM 748 CG ASP A 48 4.383 -15.695 3.394 1.00 0.00 C ATOM 749 OD1 ASP A 48 4.832 -16.306 2.437 1.00 0.00 O ATOM 750 OD2 ASP A 48 4.070 -16.217 4.452 1.00 0.00 O ATOM 751 H ASP A 48 5.464 -11.394 3.661 1.00 0.00 H ATOM 752 HA ASP A 48 6.318 -14.184 3.604 1.00 0.00 H ATOM 753 HB2 ASP A 48 3.632 -13.809 4.100 1.00 0.00 H ATOM 754 HB3 ASP A 48 3.668 -13.966 2.343 1.00 0.00 H ATOM 755 N GLU A 49 6.608 -12.024 1.602 1.00 0.00 N ATOM 756 CA GLU A 49 6.975 -11.599 0.221 1.00 0.00 C ATOM 757 C GLU A 49 8.194 -10.677 0.274 1.00 0.00 C ATOM 758 O GLU A 49 8.984 -10.728 1.196 1.00 0.00 O ATOM 759 CB GLU A 49 5.802 -10.853 -0.414 1.00 0.00 C ATOM 760 CG GLU A 49 5.643 -11.296 -1.869 1.00 0.00 C ATOM 761 CD GLU A 49 4.977 -12.672 -1.914 1.00 0.00 C ATOM 762 OE1 GLU A 49 5.694 -13.657 -1.871 1.00 0.00 O ATOM 763 OE2 GLU A 49 3.760 -12.716 -1.988 1.00 0.00 O ATOM 764 H GLU A 49 6.888 -11.485 2.372 1.00 0.00 H ATOM 765 HA GLU A 49 7.209 -12.472 -0.371 1.00 0.00 H ATOM 766 HB2 GLU A 49 4.896 -11.075 0.132 1.00 0.00 H ATOM 767 HB3 GLU A 49 5.990 -9.791 -0.382 1.00 0.00 H ATOM 768 HG2 GLU A 49 5.031 -10.580 -2.399 1.00 0.00 H ATOM 769 HG3 GLU A 49 6.615 -11.353 -2.337 1.00 0.00 H ATOM 770 N ASN A 50 8.355 -9.835 -0.711 1.00 0.00 N ATOM 771 CA ASN A 50 9.524 -8.911 -0.719 1.00 0.00 C ATOM 772 C ASN A 50 9.061 -7.494 -0.376 1.00 0.00 C ATOM 773 O ASN A 50 9.718 -6.522 -0.692 1.00 0.00 O ATOM 774 CB ASN A 50 10.166 -8.914 -2.108 1.00 0.00 C ATOM 775 CG ASN A 50 11.064 -10.143 -2.254 1.00 0.00 C ATOM 776 OD1 ASN A 50 11.498 -10.714 -1.273 1.00 0.00 O ATOM 777 ND2 ASN A 50 11.363 -10.579 -3.447 1.00 0.00 N ATOM 778 H ASN A 50 7.707 -9.812 -1.446 1.00 0.00 H ATOM 779 HA ASN A 50 10.248 -9.241 0.012 1.00 0.00 H ATOM 780 HB2 ASN A 50 9.391 -8.943 -2.861 1.00 0.00 H ATOM 781 HB3 ASN A 50 10.757 -8.021 -2.233 1.00 0.00 H ATOM 782 HD21 ASN A 50 11.013 -10.120 -4.238 1.00 0.00 H ATOM 783 HD22 ASN A 50 11.939 -11.366 -3.553 1.00 0.00 H ATOM 784 N GLY A 51 7.934 -7.368 0.270 1.00 0.00 N ATOM 785 CA GLY A 51 7.429 -6.014 0.635 1.00 0.00 C ATOM 786 C GLY A 51 7.393 -5.124 -0.610 1.00 0.00 C ATOM 787 O GLY A 51 7.443 -3.913 -0.521 1.00 0.00 O ATOM 788 H GLY A 51 7.420 -8.166 0.516 1.00 0.00 H ATOM 789 HA2 GLY A 51 8.086 -5.572 1.369 1.00 0.00 H ATOM 790 HA3 GLY A 51 6.434 -6.101 1.047 1.00 0.00 H ATOM 791 N LEU A 52 7.307 -5.714 -1.772 1.00 0.00 N ATOM 792 CA LEU A 52 7.267 -4.899 -3.019 1.00 0.00 C ATOM 793 C LEU A 52 5.820 -4.739 -3.489 1.00 0.00 C ATOM 794 O LEU A 52 4.909 -5.328 -2.943 1.00 0.00 O ATOM 795 CB LEU A 52 8.077 -5.598 -4.113 1.00 0.00 C ATOM 796 CG LEU A 52 9.569 -5.330 -3.912 1.00 0.00 C ATOM 797 CD1 LEU A 52 10.341 -5.816 -5.140 1.00 0.00 C ATOM 798 CD2 LEU A 52 9.805 -3.828 -3.734 1.00 0.00 C ATOM 799 H LEU A 52 7.270 -6.691 -1.824 1.00 0.00 H ATOM 800 HA LEU A 52 7.688 -3.923 -2.823 1.00 0.00 H ATOM 801 HB2 LEU A 52 7.895 -6.662 -4.068 1.00 0.00 H ATOM 802 HB3 LEU A 52 7.774 -5.222 -5.079 1.00 0.00 H ATOM 803 HG LEU A 52 9.914 -5.859 -3.035 1.00 0.00 H ATOM 804 HD11 LEU A 52 9.691 -5.793 -6.005 1.00 0.00 H ATOM 805 HD12 LEU A 52 11.189 -5.171 -5.311 1.00 0.00 H ATOM 806 HD13 LEU A 52 10.683 -6.827 -4.975 1.00 0.00 H ATOM 807 HD21 LEU A 52 9.152 -3.281 -4.397 1.00 0.00 H ATOM 808 HD22 LEU A 52 9.597 -3.549 -2.712 1.00 0.00 H ATOM 809 HD23 LEU A 52 10.833 -3.596 -3.969 1.00 0.00 H ATOM 810 N CYS A 53 5.607 -3.945 -4.503 1.00 0.00 N ATOM 811 CA CYS A 53 4.224 -3.734 -5.022 1.00 0.00 C ATOM 812 C CYS A 53 3.924 -4.750 -6.130 1.00 0.00 C ATOM 813 O CYS A 53 4.603 -4.777 -7.136 1.00 0.00 O ATOM 814 CB CYS A 53 4.108 -2.318 -5.593 1.00 0.00 C ATOM 815 SG CYS A 53 2.374 -1.949 -5.951 1.00 0.00 S ATOM 816 H CYS A 53 6.361 -3.486 -4.926 1.00 0.00 H ATOM 817 HA CYS A 53 3.519 -3.853 -4.217 1.00 0.00 H ATOM 818 HB2 CYS A 53 4.487 -1.608 -4.873 1.00 0.00 H ATOM 819 HB3 CYS A 53 4.684 -2.249 -6.504 1.00 0.00 H ATOM 820 N PRO A 54 2.911 -5.554 -5.922 1.00 0.00 N ATOM 821 CA PRO A 54 2.499 -6.570 -6.902 1.00 0.00 C ATOM 822 C PRO A 54 1.639 -5.929 -7.998 1.00 0.00 C ATOM 823 O PRO A 54 1.269 -6.571 -8.961 1.00 0.00 O ATOM 824 CB PRO A 54 1.666 -7.550 -6.072 1.00 0.00 C ATOM 825 CG PRO A 54 1.169 -6.764 -4.835 1.00 0.00 C ATOM 826 CD PRO A 54 2.090 -5.535 -4.693 1.00 0.00 C ATOM 827 HA PRO A 54 3.355 -7.071 -7.323 1.00 0.00 H ATOM 828 HB2 PRO A 54 0.826 -7.905 -6.654 1.00 0.00 H ATOM 829 HB3 PRO A 54 2.276 -8.380 -5.754 1.00 0.00 H ATOM 830 HG2 PRO A 54 0.146 -6.447 -4.986 1.00 0.00 H ATOM 831 HG3 PRO A 54 1.242 -7.377 -3.952 1.00 0.00 H ATOM 832 HD2 PRO A 54 1.503 -4.629 -4.640 1.00 0.00 H ATOM 833 HD3 PRO A 54 2.719 -5.633 -3.823 1.00 0.00 H ATOM 834 N ALA A 55 1.302 -4.673 -7.850 1.00 0.00 N ATOM 835 CA ALA A 55 0.450 -4.007 -8.877 1.00 0.00 C ATOM 836 C ALA A 55 1.297 -3.114 -9.792 1.00 0.00 C ATOM 837 O ALA A 55 0.964 -2.912 -10.943 1.00 0.00 O ATOM 838 CB ALA A 55 -0.614 -3.154 -8.181 1.00 0.00 C ATOM 839 H ALA A 55 1.597 -4.173 -7.059 1.00 0.00 H ATOM 840 HA ALA A 55 -0.039 -4.762 -9.475 1.00 0.00 H ATOM 841 HB1 ALA A 55 -0.307 -2.953 -7.165 1.00 0.00 H ATOM 842 HB2 ALA A 55 -0.731 -2.220 -8.712 1.00 0.00 H ATOM 843 HB3 ALA A 55 -1.554 -3.684 -8.176 1.00 0.00 H ATOM 844 N CYS A 56 2.378 -2.565 -9.305 1.00 0.00 N ATOM 845 CA CYS A 56 3.204 -1.683 -10.181 1.00 0.00 C ATOM 846 C CYS A 56 4.699 -1.956 -9.963 1.00 0.00 C ATOM 847 O CYS A 56 5.547 -1.292 -10.525 1.00 0.00 O ATOM 848 CB CYS A 56 2.870 -0.210 -9.878 1.00 0.00 C ATOM 849 SG CYS A 56 3.884 0.417 -8.509 1.00 0.00 S ATOM 850 H CYS A 56 2.639 -2.724 -8.374 1.00 0.00 H ATOM 851 HA CYS A 56 2.960 -1.891 -11.213 1.00 0.00 H ATOM 852 HB2 CYS A 56 3.058 0.385 -10.758 1.00 0.00 H ATOM 853 HB3 CYS A 56 1.825 -0.131 -9.613 1.00 0.00 H ATOM 854 N ARG A 57 5.030 -2.923 -9.153 1.00 0.00 N ATOM 855 CA ARG A 57 6.470 -3.228 -8.907 1.00 0.00 C ATOM 856 C ARG A 57 7.159 -2.005 -8.292 1.00 0.00 C ATOM 857 O ARG A 57 7.802 -1.235 -8.976 1.00 0.00 O ATOM 858 CB ARG A 57 7.154 -3.576 -10.231 1.00 0.00 C ATOM 859 CG ARG A 57 6.643 -4.928 -10.731 1.00 0.00 C ATOM 860 CD ARG A 57 7.648 -5.515 -11.725 1.00 0.00 C ATOM 861 NE ARG A 57 6.993 -6.595 -12.513 1.00 0.00 N ATOM 862 CZ ARG A 57 6.188 -7.435 -11.924 1.00 0.00 C ATOM 863 NH1 ARG A 57 4.916 -7.434 -12.216 1.00 0.00 N ATOM 864 NH2 ARG A 57 6.654 -8.278 -11.043 1.00 0.00 N ATOM 865 H ARG A 57 4.333 -3.448 -8.708 1.00 0.00 H ATOM 866 HA ARG A 57 6.552 -4.067 -8.229 1.00 0.00 H ATOM 867 HB2 ARG A 57 6.930 -2.813 -10.962 1.00 0.00 H ATOM 868 HB3 ARG A 57 8.222 -3.630 -10.080 1.00 0.00 H ATOM 869 HG2 ARG A 57 6.528 -5.603 -9.894 1.00 0.00 H ATOM 870 HG3 ARG A 57 5.692 -4.795 -11.221 1.00 0.00 H ATOM 871 HD2 ARG A 57 7.989 -4.737 -12.393 1.00 0.00 H ATOM 872 HD3 ARG A 57 8.492 -5.921 -11.186 1.00 0.00 H ATOM 873 HE ARG A 57 7.166 -6.674 -13.475 1.00 0.00 H ATOM 874 HH11 ARG A 57 4.558 -6.789 -12.891 1.00 0.00 H ATOM 875 HH12 ARG A 57 4.299 -8.078 -11.764 1.00 0.00 H ATOM 876 HH21 ARG A 57 7.630 -8.280 -10.820 1.00 0.00 H ATOM 877 HH22 ARG A 57 6.038 -8.923 -10.591 1.00 0.00 H ATOM 878 N LYS A 58 7.034 -1.827 -7.006 1.00 0.00 N ATOM 879 CA LYS A 58 7.684 -0.662 -6.344 1.00 0.00 C ATOM 880 C LYS A 58 7.841 -0.963 -4.851 1.00 0.00 C ATOM 881 O LYS A 58 7.038 -1.666 -4.276 1.00 0.00 O ATOM 882 CB LYS A 58 6.820 0.588 -6.533 1.00 0.00 C ATOM 883 CG LYS A 58 7.546 1.571 -7.455 1.00 0.00 C ATOM 884 CD LYS A 58 6.736 2.864 -7.571 1.00 0.00 C ATOM 885 CE LYS A 58 6.989 3.738 -6.341 1.00 0.00 C ATOM 886 NZ LYS A 58 7.390 5.105 -6.777 1.00 0.00 N ATOM 887 H LYS A 58 6.515 -2.464 -6.474 1.00 0.00 H ATOM 888 HA LYS A 58 8.658 -0.497 -6.782 1.00 0.00 H ATOM 889 HB2 LYS A 58 5.874 0.308 -6.974 1.00 0.00 H ATOM 890 HB3 LYS A 58 6.647 1.056 -5.576 1.00 0.00 H ATOM 891 HG2 LYS A 58 8.522 1.792 -7.047 1.00 0.00 H ATOM 892 HG3 LYS A 58 7.657 1.130 -8.434 1.00 0.00 H ATOM 893 HD2 LYS A 58 7.037 3.399 -8.461 1.00 0.00 H ATOM 894 HD3 LYS A 58 5.685 2.627 -7.632 1.00 0.00 H ATOM 895 HE2 LYS A 58 6.086 3.798 -5.751 1.00 0.00 H ATOM 896 HE3 LYS A 58 7.778 3.303 -5.746 1.00 0.00 H ATOM 897 HZ1 LYS A 58 6.715 5.458 -7.484 1.00 0.00 H ATOM 898 HZ2 LYS A 58 7.395 5.744 -5.957 1.00 0.00 H ATOM 899 HZ3 LYS A 58 8.343 5.069 -7.194 1.00 0.00 H ATOM 900 N PRO A 59 8.877 -0.426 -4.268 1.00 0.00 N ATOM 901 CA PRO A 59 9.170 -0.632 -2.839 1.00 0.00 C ATOM 902 C PRO A 59 8.213 0.183 -1.966 1.00 0.00 C ATOM 903 O PRO A 59 8.139 1.391 -2.066 1.00 0.00 O ATOM 904 CB PRO A 59 10.613 -0.142 -2.694 1.00 0.00 C ATOM 905 CG PRO A 59 10.871 0.812 -3.884 1.00 0.00 C ATOM 906 CD PRO A 59 9.843 0.444 -4.970 1.00 0.00 C ATOM 907 HA PRO A 59 9.112 -1.680 -2.591 1.00 0.00 H ATOM 908 HB2 PRO A 59 10.731 0.387 -1.758 1.00 0.00 H ATOM 909 HB3 PRO A 59 11.297 -0.975 -2.741 1.00 0.00 H ATOM 910 HG2 PRO A 59 10.733 1.839 -3.571 1.00 0.00 H ATOM 911 HG3 PRO A 59 11.871 0.671 -4.265 1.00 0.00 H ATOM 912 HD2 PRO A 59 9.355 1.333 -5.346 1.00 0.00 H ATOM 913 HD3 PRO A 59 10.317 -0.099 -5.774 1.00 0.00 H ATOM 914 N TYR A 60 7.476 -0.474 -1.109 1.00 0.00 N ATOM 915 CA TYR A 60 6.518 0.257 -0.230 1.00 0.00 C ATOM 916 C TYR A 60 7.228 1.435 0.445 1.00 0.00 C ATOM 917 O TYR A 60 8.408 1.367 0.724 1.00 0.00 O ATOM 918 CB TYR A 60 5.984 -0.692 0.849 1.00 0.00 C ATOM 919 CG TYR A 60 5.225 -1.839 0.215 1.00 0.00 C ATOM 920 CD1 TYR A 60 4.883 -1.799 -1.144 1.00 0.00 C ATOM 921 CD2 TYR A 60 4.858 -2.942 0.994 1.00 0.00 C ATOM 922 CE1 TYR A 60 4.176 -2.859 -1.719 1.00 0.00 C ATOM 923 CE2 TYR A 60 4.153 -4.004 0.418 1.00 0.00 C ATOM 924 CZ TYR A 60 3.811 -3.962 -0.939 1.00 0.00 C ATOM 925 OH TYR A 60 3.112 -5.010 -1.505 1.00 0.00 O ATOM 926 H TYR A 60 7.550 -1.453 -1.048 1.00 0.00 H ATOM 927 HA TYR A 60 5.699 0.627 -0.825 1.00 0.00 H ATOM 928 HB2 TYR A 60 6.811 -1.085 1.420 1.00 0.00 H ATOM 929 HB3 TYR A 60 5.322 -0.148 1.507 1.00 0.00 H ATOM 930 HD1 TYR A 60 5.165 -0.948 -1.747 1.00 0.00 H ATOM 931 HD2 TYR A 60 5.122 -2.975 2.040 1.00 0.00 H ATOM 932 HE1 TYR A 60 3.912 -2.826 -2.763 1.00 0.00 H ATOM 933 HE2 TYR A 60 3.871 -4.856 1.019 1.00 0.00 H ATOM 934 HH TYR A 60 2.439 -4.639 -2.082 1.00 0.00 H ATOM 935 N PRO A 61 6.480 2.484 0.691 1.00 0.00 N ATOM 936 CA PRO A 61 7.006 3.699 1.338 1.00 0.00 C ATOM 937 C PRO A 61 7.095 3.501 2.856 1.00 0.00 C ATOM 938 O PRO A 61 6.168 3.796 3.583 1.00 0.00 O ATOM 939 CB PRO A 61 5.967 4.768 0.994 1.00 0.00 C ATOM 940 CG PRO A 61 4.653 4.015 0.675 1.00 0.00 C ATOM 941 CD PRO A 61 5.043 2.562 0.342 1.00 0.00 C ATOM 942 HA PRO A 61 7.966 3.968 0.928 1.00 0.00 H ATOM 943 HB2 PRO A 61 5.824 5.429 1.839 1.00 0.00 H ATOM 944 HB3 PRO A 61 6.283 5.331 0.130 1.00 0.00 H ATOM 945 HG2 PRO A 61 3.996 4.038 1.533 1.00 0.00 H ATOM 946 HG3 PRO A 61 4.165 4.465 -0.177 1.00 0.00 H ATOM 947 HD2 PRO A 61 4.464 1.873 0.942 1.00 0.00 H ATOM 948 HD3 PRO A 61 4.901 2.363 -0.709 1.00 0.00 H