USER MOD reduce.3.24.130724 H: found=0, std=0, add=333, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 170 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 173 HIS : no HE2:sc= 1 K(o=2.2,f=-4.6) USER MOD Set 1.2: B 172 SER OG : rot -98:sc= 1.22 USER MOD Set 2.1: A 172 SER OG : rot -73:sc= 1.35 USER MOD Set 2.2: B 173 HIS : no HE2:sc= 0.91 K(o=2.3,f=-8.7!) USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD Single : A 182 TYR OH : rot 180:sc= 0 USER MOD Single : B 168 SER OG : rot -44:sc= 0.463 USER MOD Single : B 182 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 260 N LEU A 166 66.136 50.169 53.610 1.00 0.00 N ATOM 261 CA LEU A 166 66.770 50.169 52.283 1.00 0.00 C ATOM 262 C LEU A 166 66.168 49.266 51.183 1.00 0.00 C ATOM 263 O LEU A 166 65.873 49.835 50.136 1.00 0.00 O ATOM 264 CB LEU A 166 68.302 50.075 52.367 1.00 0.00 C ATOM 265 CG LEU A 166 68.936 51.466 52.195 1.00 0.00 C ATOM 266 CD1 LEU A 166 70.337 51.495 52.791 1.00 0.00 C ATOM 267 CD2 LEU A 166 69.024 51.819 50.711 1.00 0.00 C ATOM 0 HA LEU A 166 66.501 51.156 51.908 1.00 0.00 H new ATOM 0 HB2 LEU A 166 68.594 49.652 53.328 1.00 0.00 H new ATOM 0 HB3 LEU A 166 68.674 49.401 51.595 1.00 0.00 H new ATOM 0 HG LEU A 166 68.309 52.191 52.714 1.00 0.00 H new ATOM 0 HD11 LEU A 166 70.768 52.487 52.659 1.00 0.00 H new ATOM 0 HD12 LEU A 166 70.285 51.260 53.854 1.00 0.00 H new ATOM 0 HD13 LEU A 166 70.962 50.758 52.287 1.00 0.00 H new ATOM 0 HD21 LEU A 166 69.474 52.805 50.598 1.00 0.00 H new ATOM 0 HD22 LEU A 166 69.637 51.079 50.197 1.00 0.00 H new ATOM 0 HD23 LEU A 166 68.024 51.825 50.278 1.00 0.00 H new ATOM 273 N PRO A 167 65.856 47.975 51.407 1.00 0.00 N ATOM 274 CA PRO A 167 65.187 47.138 50.386 1.00 0.00 C ATOM 275 C PRO A 167 63.898 47.778 49.848 1.00 0.00 C ATOM 276 O PRO A 167 63.810 48.020 48.645 1.00 0.00 O ATOM 277 CB PRO A 167 64.929 45.806 51.073 1.00 0.00 C ATOM 278 CG PRO A 167 66.078 45.704 52.072 1.00 0.00 C ATOM 279 CD PRO A 167 66.226 47.147 52.577 1.00 0.00 C ATOM 0 HA PRO A 167 65.810 47.019 49.500 1.00 0.00 H new ATOM 0 HB2 PRO A 167 63.959 45.790 51.571 1.00 0.00 H new ATOM 0 HB3 PRO A 167 64.937 44.978 50.364 1.00 0.00 H new ATOM 0 HG2 PRO A 167 65.847 45.014 52.884 1.00 0.00 H new ATOM 0 HG3 PRO A 167 66.993 45.346 51.600 1.00 0.00 H new ATOM 0 HD2 PRO A 167 65.572 47.342 53.427 1.00 0.00 H new ATOM 0 HD3 PRO A 167 67.245 47.353 52.905 1.00 0.00 H new ATOM 285 N SER A 168 62.983 48.183 50.739 1.00 0.00 N ATOM 286 CA SER A 168 61.755 48.905 50.344 1.00 0.00 C ATOM 287 C SER A 168 61.989 50.293 49.727 1.00 0.00 C ATOM 288 O SER A 168 61.361 50.611 48.721 1.00 0.00 O ATOM 289 CB SER A 168 60.703 48.982 51.457 1.00 0.00 C ATOM 290 OG SER A 168 61.233 49.476 52.694 1.00 0.00 O ATOM 0 H SER A 168 63.066 48.024 51.743 1.00 0.00 H new ATOM 0 HA SER A 168 61.355 48.278 49.547 1.00 0.00 H new ATOM 0 HB2 SER A 168 59.887 49.628 51.134 1.00 0.00 H new ATOM 0 HB3 SER A 168 60.280 47.991 51.619 1.00 0.00 H new ATOM 0 HG SER A 168 60.521 49.506 53.366 1.00 0.00 H new ATOM 296 N LEU A 169 62.962 51.058 50.247 1.00 0.00 N ATOM 297 CA LEU A 169 63.399 52.327 49.618 1.00 0.00 C ATOM 298 C LEU A 169 63.833 52.112 48.151 1.00 0.00 C ATOM 299 O LEU A 169 63.435 52.844 47.247 1.00 0.00 O ATOM 300 CB LEU A 169 64.573 52.977 50.366 1.00 0.00 C ATOM 301 CG LEU A 169 64.256 53.407 51.806 1.00 0.00 C ATOM 302 CD1 LEU A 169 65.543 53.888 52.483 1.00 0.00 C ATOM 303 CD2 LEU A 169 63.216 54.525 51.858 1.00 0.00 C ATOM 0 H LEU A 169 63.465 50.824 51.103 1.00 0.00 H new ATOM 0 HA LEU A 169 62.533 52.987 49.662 1.00 0.00 H new ATOM 0 HB2 LEU A 169 65.407 52.275 50.386 1.00 0.00 H new ATOM 0 HB3 LEU A 169 64.905 53.851 49.805 1.00 0.00 H new ATOM 0 HG LEU A 169 63.843 52.543 52.327 1.00 0.00 H new ATOM 0 HD11 LEU A 169 65.323 54.195 53.506 1.00 0.00 H new ATOM 0 HD12 LEU A 169 66.272 53.078 52.496 1.00 0.00 H new ATOM 0 HD13 LEU A 169 65.951 54.734 51.930 1.00 0.00 H new ATOM 0 HD21 LEU A 169 63.024 54.796 52.896 1.00 0.00 H new ATOM 0 HD22 LEU A 169 63.590 55.396 51.319 1.00 0.00 H new ATOM 0 HD23 LEU A 169 62.290 54.183 51.395 1.00 0.00 H new ATOM 309 N LEU A 170 64.680 51.102 47.944 1.00 0.00 N ATOM 310 CA LEU A 170 65.151 50.653 46.624 1.00 0.00 C ATOM 311 C LEU A 170 64.031 50.125 45.719 1.00 0.00 C ATOM 312 O LEU A 170 64.021 50.413 44.524 1.00 0.00 O ATOM 313 CB LEU A 170 66.241 49.586 46.800 1.00 0.00 C ATOM 314 CG LEU A 170 67.510 50.126 47.457 1.00 0.00 C ATOM 315 CD1 LEU A 170 68.400 48.944 47.853 1.00 0.00 C ATOM 316 CD2 LEU A 170 68.289 51.093 46.554 1.00 0.00 C ATOM 0 H LEU A 170 65.071 50.555 48.711 1.00 0.00 H new ATOM 0 HA LEU A 170 65.558 51.530 46.120 1.00 0.00 H new ATOM 0 HB2 LEU A 170 65.846 48.769 47.404 1.00 0.00 H new ATOM 0 HB3 LEU A 170 66.493 49.169 45.825 1.00 0.00 H new ATOM 0 HG LEU A 170 67.212 50.699 48.335 1.00 0.00 H new ATOM 0 HD11 LEU A 170 69.310 49.316 48.324 1.00 0.00 H new ATOM 0 HD12 LEU A 170 67.864 48.304 48.554 1.00 0.00 H new ATOM 0 HD13 LEU A 170 68.660 48.370 46.963 1.00 0.00 H new ATOM 0 HD21 LEU A 170 69.179 51.442 47.077 1.00 0.00 H new ATOM 0 HD22 LEU A 170 68.584 50.579 45.639 1.00 0.00 H new ATOM 0 HD23 LEU A 170 67.658 51.946 46.304 1.00 0.00 H new ATOM 322 N LEU A 171 63.120 49.339 46.287 1.00 0.00 N ATOM 323 CA LEU A 171 61.888 48.882 45.598 1.00 0.00 C ATOM 324 C LEU A 171 61.026 50.054 45.105 1.00 0.00 C ATOM 325 O LEU A 171 60.641 50.094 43.938 1.00 0.00 O ATOM 326 CB LEU A 171 61.107 47.960 46.556 1.00 0.00 C ATOM 327 CG LEU A 171 59.870 47.322 45.915 1.00 0.00 C ATOM 328 CD1 LEU A 171 60.252 46.365 44.787 1.00 0.00 C ATOM 329 CD2 LEU A 171 59.051 46.602 46.983 1.00 0.00 C ATOM 0 H LEU A 171 63.204 48.992 47.243 1.00 0.00 H new ATOM 0 HA LEU A 171 62.166 48.328 44.702 1.00 0.00 H new ATOM 0 HB2 LEU A 171 61.771 47.171 46.911 1.00 0.00 H new ATOM 0 HB3 LEU A 171 60.799 48.534 47.430 1.00 0.00 H new ATOM 0 HG LEU A 171 59.265 48.114 45.474 1.00 0.00 H new ATOM 0 HD11 LEU A 171 59.349 45.932 44.356 1.00 0.00 H new ATOM 0 HD12 LEU A 171 60.796 46.910 44.016 1.00 0.00 H new ATOM 0 HD13 LEU A 171 60.883 45.569 45.183 1.00 0.00 H new ATOM 0 HD21 LEU A 171 58.172 46.149 46.524 1.00 0.00 H new ATOM 0 HD22 LEU A 171 59.659 45.825 47.446 1.00 0.00 H new ATOM 0 HD23 LEU A 171 58.736 47.317 47.743 1.00 0.00 H new ATOM 335 N SER A 172 60.825 51.044 45.983 1.00 0.00 N ATOM 336 CA SER A 172 60.173 52.327 45.635 1.00 0.00 C ATOM 337 C SER A 172 60.915 53.066 44.499 1.00 0.00 C ATOM 338 O SER A 172 60.293 53.482 43.529 1.00 0.00 O ATOM 339 CB SER A 172 60.090 53.197 46.890 1.00 0.00 C ATOM 340 OG SER A 172 59.350 54.381 46.612 1.00 0.00 O ATOM 0 H SER A 172 61.109 50.984 46.961 1.00 0.00 H new ATOM 0 HA SER A 172 59.170 52.118 45.264 1.00 0.00 H new ATOM 0 HB2 SER A 172 59.613 52.641 47.697 1.00 0.00 H new ATOM 0 HB3 SER A 172 61.093 53.456 47.230 1.00 0.00 H new ATOM 0 HG SER A 172 59.894 54.986 46.065 1.00 0.00 H new ATOM 346 N HIS A 173 62.241 53.126 44.592 1.00 0.00 N ATOM 347 CA HIS A 173 63.107 53.598 43.480 1.00 0.00 C ATOM 348 C HIS A 173 62.900 52.846 42.155 1.00 0.00 C ATOM 349 O HIS A 173 62.838 53.465 41.090 1.00 0.00 O ATOM 350 CB HIS A 173 64.599 53.550 43.841 1.00 0.00 C ATOM 351 CG HIS A 173 65.056 54.669 44.781 1.00 0.00 C ATOM 352 ND1 HIS A 173 65.495 54.519 46.026 1.00 0.00 N ATOM 353 CD2 HIS A 173 65.152 55.964 44.465 1.00 0.00 C ATOM 354 CE1 HIS A 173 65.840 55.710 46.496 1.00 0.00 C ATOM 355 NE2 HIS A 173 65.632 56.603 45.527 1.00 0.00 N ATOM 0 H HIS A 173 62.757 52.854 45.429 1.00 0.00 H new ATOM 0 HA HIS A 173 62.794 54.631 43.330 1.00 0.00 H new ATOM 0 HB2 HIS A 173 64.818 52.589 44.306 1.00 0.00 H new ATOM 0 HB3 HIS A 173 65.185 53.601 42.923 1.00 0.00 H new ATOM 0 HD1 HIS A 173 65.556 53.637 46.534 1.00 0.00 H new ATOM 0 HD2 HIS A 173 64.887 56.411 43.518 1.00 0.00 H new ATOM 0 HE1 HIS A 173 66.221 55.919 47.485 1.00 0.00 H new ATOM 360 N LEU A 174 62.787 51.519 42.221 1.00 0.00 N ATOM 361 CA LEU A 174 62.517 50.673 41.037 1.00 0.00 C ATOM 362 C LEU A 174 61.128 50.961 40.435 1.00 0.00 C ATOM 363 O LEU A 174 60.996 51.109 39.224 1.00 0.00 O ATOM 364 CB LEU A 174 62.666 49.186 41.392 1.00 0.00 C ATOM 365 CG LEU A 174 62.720 48.306 40.127 1.00 0.00 C ATOM 366 CD1 LEU A 174 64.053 48.467 39.376 1.00 0.00 C ATOM 367 CD2 LEU A 174 62.469 46.850 40.499 1.00 0.00 C ATOM 0 H LEU A 174 62.878 50.993 43.090 1.00 0.00 H new ATOM 0 HA LEU A 174 63.256 50.922 40.276 1.00 0.00 H new ATOM 0 HB2 LEU A 174 63.574 49.040 41.977 1.00 0.00 H new ATOM 0 HB3 LEU A 174 61.830 48.875 42.018 1.00 0.00 H new ATOM 0 HG LEU A 174 61.934 48.636 39.448 1.00 0.00 H new ATOM 0 HD11 LEU A 174 64.051 47.831 38.491 1.00 0.00 H new ATOM 0 HD12 LEU A 174 64.178 49.507 39.075 1.00 0.00 H new ATOM 0 HD13 LEU A 174 64.876 48.178 40.029 1.00 0.00 H new ATOM 0 HD21 LEU A 174 62.508 46.233 39.601 1.00 0.00 H new ATOM 0 HD22 LEU A 174 63.233 46.517 41.202 1.00 0.00 H new ATOM 0 HD23 LEU A 174 61.486 46.757 40.961 1.00 0.00 H new ATOM 373 N LEU A 175 60.116 51.083 41.301 1.00 0.00 N ATOM 374 CA LEU A 175 58.780 51.556 40.908 1.00 0.00 C ATOM 375 C LEU A 175 58.788 52.975 40.317 1.00 0.00 C ATOM 376 O LEU A 175 58.038 53.245 39.383 1.00 0.00 O ATOM 377 CB LEU A 175 57.804 51.476 42.088 1.00 0.00 C ATOM 378 CG LEU A 175 57.342 50.038 42.357 1.00 0.00 C ATOM 379 CD1 LEU A 175 56.611 49.985 43.697 1.00 0.00 C ATOM 380 CD2 LEU A 175 56.379 49.548 41.261 1.00 0.00 C ATOM 0 H LEU A 175 60.198 50.858 42.292 1.00 0.00 H new ATOM 0 HA LEU A 175 58.443 50.888 40.115 1.00 0.00 H new ATOM 0 HB2 LEU A 175 58.283 51.876 42.982 1.00 0.00 H new ATOM 0 HB3 LEU A 175 56.936 52.103 41.884 1.00 0.00 H new ATOM 0 HG LEU A 175 58.223 49.397 42.368 1.00 0.00 H new ATOM 0 HD11 LEU A 175 56.281 48.964 43.891 1.00 0.00 H new ATOM 0 HD12 LEU A 175 57.284 50.306 44.492 1.00 0.00 H new ATOM 0 HD13 LEU A 175 55.745 50.646 43.665 1.00 0.00 H new ATOM 0 HD21 LEU A 175 56.069 48.526 41.479 1.00 0.00 H new ATOM 0 HD22 LEU A 175 55.502 50.195 41.231 1.00 0.00 H new ATOM 0 HD23 LEU A 175 56.883 49.576 40.295 1.00 0.00 H new ATOM 386 N ALA A 176 59.649 53.846 40.837 1.00 0.00 N ATOM 387 CA ALA A 176 59.949 55.157 40.215 1.00 0.00 C ATOM 388 C ALA A 176 60.506 55.048 38.789 1.00 0.00 C ATOM 389 O ALA A 176 59.978 55.686 37.872 1.00 0.00 O ATOM 390 CB ALA A 176 60.902 55.961 41.103 1.00 0.00 C ATOM 0 H ALA A 176 60.164 53.674 41.700 1.00 0.00 H new ATOM 0 HA ALA A 176 58.997 55.681 40.129 1.00 0.00 H new ATOM 0 HB1 ALA A 176 61.114 56.922 40.633 1.00 0.00 H new ATOM 0 HB2 ALA A 176 60.440 56.127 42.076 1.00 0.00 H new ATOM 0 HB3 ALA A 176 61.832 55.408 41.233 1.00 0.00 H new ATOM 396 N ILE A 177 61.501 54.177 38.578 1.00 0.00 N ATOM 397 CA ILE A 177 62.010 53.897 37.216 1.00 0.00 C ATOM 398 C ILE A 177 60.888 53.320 36.327 1.00 0.00 C ATOM 399 O ILE A 177 60.682 53.792 35.207 1.00 0.00 O ATOM 400 CB ILE A 177 63.245 52.957 37.187 1.00 0.00 C ATOM 401 CG1 ILE A 177 64.290 53.325 38.255 1.00 0.00 C ATOM 402 CG2 ILE A 177 63.901 53.096 35.801 1.00 0.00 C ATOM 403 CD1 ILE A 177 65.298 52.210 38.554 1.00 0.00 C ATOM 0 H ILE A 177 61.970 53.656 39.319 1.00 0.00 H new ATOM 0 HA ILE A 177 62.344 54.857 36.821 1.00 0.00 H new ATOM 0 HB ILE A 177 62.908 51.940 37.391 1.00 0.00 H new ATOM 0 HG12 ILE A 177 64.832 54.212 37.927 1.00 0.00 H new ATOM 0 HG13 ILE A 177 63.773 53.590 39.177 1.00 0.00 H new ATOM 0 HG21 ILE A 177 64.775 52.447 35.745 1.00 0.00 H new ATOM 0 HG22 ILE A 177 63.186 52.809 35.030 1.00 0.00 H new ATOM 0 HG23 ILE A 177 64.207 54.131 35.645 1.00 0.00 H new ATOM 0 HD11 ILE A 177 66.000 52.549 39.316 1.00 0.00 H new ATOM 0 HD12 ILE A 177 64.769 51.328 38.914 1.00 0.00 H new ATOM 0 HD13 ILE A 177 65.844 51.959 37.644 1.00 0.00 H new ATOM 407 N GLY A 178 60.143 52.366 36.887 1.00 0.00 N ATOM 408 CA GLY A 178 58.917 51.802 36.276 1.00 0.00 C ATOM 409 C GLY A 178 57.928 52.875 35.800 1.00 0.00 C ATOM 410 O GLY A 178 57.621 52.943 34.613 1.00 0.00 O ATOM 0 H GLY A 178 60.369 51.951 37.791 1.00 0.00 H new ATOM 0 HA2 GLY A 178 59.197 51.174 35.430 1.00 0.00 H new ATOM 0 HA3 GLY A 178 58.421 51.157 37.001 1.00 0.00 H new ATOM 414 N LEU A 179 57.564 53.773 36.724 1.00 0.00 N ATOM 415 CA LEU A 179 56.715 54.956 36.453 1.00 0.00 C ATOM 416 C LEU A 179 57.236 55.764 35.257 1.00 0.00 C ATOM 417 O LEU A 179 56.489 55.956 34.294 1.00 0.00 O ATOM 418 CB LEU A 179 56.648 55.805 37.741 1.00 0.00 C ATOM 419 CG LEU A 179 55.538 56.860 37.709 1.00 0.00 C ATOM 420 CD1 LEU A 179 55.054 57.108 39.138 1.00 0.00 C ATOM 421 CD2 LEU A 179 56.019 58.193 37.122 1.00 0.00 C ATOM 0 H LEU A 179 57.852 53.703 37.700 1.00 0.00 H new ATOM 0 HA LEU A 179 55.710 54.635 36.178 1.00 0.00 H new ATOM 0 HB2 LEU A 179 56.490 55.146 38.595 1.00 0.00 H new ATOM 0 HB3 LEU A 179 57.607 56.300 37.893 1.00 0.00 H new ATOM 0 HG LEU A 179 54.738 56.480 37.074 1.00 0.00 H new ATOM 0 HD11 LEU A 179 54.263 57.858 39.129 1.00 0.00 H new ATOM 0 HD12 LEU A 179 54.669 56.179 39.558 1.00 0.00 H new ATOM 0 HD13 LEU A 179 55.885 57.464 39.747 1.00 0.00 H new ATOM 0 HD21 LEU A 179 55.196 58.908 37.121 1.00 0.00 H new ATOM 0 HD22 LEU A 179 56.838 58.583 37.727 1.00 0.00 H new ATOM 0 HD23 LEU A 179 56.365 58.037 36.100 1.00 0.00 H new ATOM 427 N GLY A 180 58.540 56.026 35.258 1.00 0.00 N ATOM 428 CA GLY A 180 59.247 56.711 34.169 1.00 0.00 C ATOM 429 C GLY A 180 59.094 56.016 32.807 1.00 0.00 C ATOM 430 O GLY A 180 58.607 56.627 31.855 1.00 0.00 O ATOM 0 H GLY A 180 59.152 55.764 36.031 1.00 0.00 H new ATOM 0 HA2 GLY A 180 58.875 57.733 34.091 1.00 0.00 H new ATOM 0 HA3 GLY A 180 60.306 56.776 34.418 1.00 0.00 H new ATOM 434 N ILE A 181 59.467 54.736 32.747 1.00 0.00 N ATOM 435 CA ILE A 181 59.342 53.887 31.530 1.00 0.00 C ATOM 436 C ILE A 181 57.889 53.921 31.003 1.00 0.00 C ATOM 437 O ILE A 181 57.652 54.278 29.847 1.00 0.00 O ATOM 438 CB ILE A 181 59.823 52.442 31.783 1.00 0.00 C ATOM 439 CG1 ILE A 181 61.290 52.435 32.266 1.00 0.00 C ATOM 440 CG2 ILE A 181 59.692 51.581 30.516 1.00 0.00 C ATOM 441 CD1 ILE A 181 61.736 51.126 32.933 1.00 0.00 C ATOM 0 H ILE A 181 59.870 54.242 33.543 1.00 0.00 H new ATOM 0 HA ILE A 181 59.995 54.300 30.761 1.00 0.00 H new ATOM 0 HB ILE A 181 59.187 52.015 32.559 1.00 0.00 H new ATOM 0 HG12 ILE A 181 61.940 52.634 31.414 1.00 0.00 H new ATOM 0 HG13 ILE A 181 61.430 53.254 32.972 1.00 0.00 H new ATOM 0 HG21 ILE A 181 60.039 50.569 30.726 1.00 0.00 H new ATOM 0 HG22 ILE A 181 58.648 51.549 30.204 1.00 0.00 H new ATOM 0 HG23 ILE A 181 60.296 52.013 29.718 1.00 0.00 H new ATOM 0 HD11 ILE A 181 62.778 51.211 33.240 1.00 0.00 H new ATOM 0 HD12 ILE A 181 61.114 50.933 33.807 1.00 0.00 H new ATOM 0 HD13 ILE A 181 61.632 50.303 32.225 1.00 0.00 H new ATOM 445 N TYR A 182 56.968 53.672 31.927 1.00 0.00 N ATOM 446 CA TYR A 182 55.512 53.645 31.692 1.00 0.00 C ATOM 447 C TYR A 182 55.019 54.896 30.951 1.00 0.00 C ATOM 448 O TYR A 182 54.739 54.817 29.745 1.00 0.00 O ATOM 449 CB TYR A 182 54.820 53.488 33.058 1.00 0.00 C ATOM 450 CG TYR A 182 53.534 52.663 32.947 1.00 0.00 C ATOM 451 CD1 TYR A 182 53.634 51.266 33.104 1.00 0.00 C ATOM 452 CD2 TYR A 182 52.350 53.280 32.479 1.00 0.00 C ATOM 453 CE1 TYR A 182 52.537 50.465 32.726 1.00 0.00 C ATOM 454 CE2 TYR A 182 51.258 52.471 32.111 1.00 0.00 C ATOM 455 CZ TYR A 182 51.377 51.078 32.208 1.00 0.00 C ATOM 456 OH TYR A 182 50.456 50.318 31.579 1.00 0.00 O ATOM 0 H TYR A 182 57.214 53.475 32.897 1.00 0.00 H new ATOM 0 HA TYR A 182 55.263 52.805 31.044 1.00 0.00 H new ATOM 0 HB2 TYR A 182 55.502 53.007 33.759 1.00 0.00 H new ATOM 0 HB3 TYR A 182 54.588 54.472 33.464 1.00 0.00 H new ATOM 0 HD1 TYR A 182 54.531 50.819 33.505 1.00 0.00 H new ATOM 0 HD2 TYR A 182 52.285 54.355 32.405 1.00 0.00 H new ATOM 0 HE1 TYR A 182 52.584 49.391 32.832 1.00 0.00 H new ATOM 0 HE2 TYR A 182 50.340 52.918 31.758 1.00 0.00 H new ATOM 0 HH TYR A 182 49.714 50.884 31.279 1.00 0.00 H new ATOM 461 N ILE A 183 55.147 56.063 31.585 1.00 0.00 N ATOM 462 CA ILE A 183 54.774 57.360 30.985 1.00 0.00 C ATOM 463 C ILE A 183 55.549 57.687 29.689 1.00 0.00 C ATOM 464 O ILE A 183 54.915 57.922 28.654 1.00 0.00 O ATOM 465 CB ILE A 183 54.811 58.529 31.990 1.00 0.00 C ATOM 466 CG1 ILE A 183 56.154 58.618 32.737 1.00 0.00 C ATOM 467 CG2 ILE A 183 53.585 58.436 32.907 1.00 0.00 C ATOM 468 CD1 ILE A 183 56.361 59.848 33.619 1.00 0.00 C ATOM 0 H ILE A 183 55.513 56.143 32.534 1.00 0.00 H new ATOM 0 HA ILE A 183 53.731 57.237 30.691 1.00 0.00 H new ATOM 0 HB ILE A 183 54.750 59.476 31.453 1.00 0.00 H new ATOM 0 HG12 ILE A 183 56.258 57.730 33.360 1.00 0.00 H new ATOM 0 HG13 ILE A 183 56.957 58.587 32.001 1.00 0.00 H new ATOM 0 HG21 ILE A 183 53.602 59.259 33.622 1.00 0.00 H new ATOM 0 HG22 ILE A 183 52.677 58.495 32.307 1.00 0.00 H new ATOM 0 HG23 ILE A 183 53.604 57.488 33.445 1.00 0.00 H new ATOM 0 HD11 ILE A 183 57.342 59.796 34.091 1.00 0.00 H new ATOM 0 HD12 ILE A 183 56.299 60.748 33.008 1.00 0.00 H new ATOM 0 HD13 ILE A 183 55.589 59.878 34.388 1.00 0.00 H new ATOM 472 N GLY A 184 56.857 57.437 29.714 1.00 0.00 N ATOM 473 CA GLY A 184 57.808 57.698 28.607 1.00 0.00 C ATOM 474 C GLY A 184 57.347 57.133 27.252 1.00 0.00 C ATOM 475 O GLY A 184 57.313 57.860 26.265 1.00 0.00 O ATOM 0 H GLY A 184 57.312 57.032 30.532 1.00 0.00 H new ATOM 0 HA2 GLY A 184 57.955 58.774 28.511 1.00 0.00 H new ATOM 0 HA3 GLY A 184 58.776 57.266 28.861 1.00 0.00 H new ATOM 479 N ARG A 185 57.037 55.839 27.244 1.00 0.00 N ATOM 480 CA ARG A 185 56.547 55.167 26.025 1.00 0.00 C ATOM 481 C ARG A 185 55.025 55.344 25.817 1.00 0.00 C ATOM 482 O ARG A 185 54.598 55.972 24.856 1.00 0.00 O ATOM 483 CB ARG A 185 56.913 53.676 26.066 1.00 0.00 C ATOM 484 CG ARG A 185 56.712 53.030 24.684 1.00 0.00 C ATOM 485 CD ARG A 185 56.843 51.508 24.710 1.00 0.00 C ATOM 486 NE ARG A 185 56.697 51.012 23.328 1.00 0.00 N ATOM 487 CZ ARG A 185 55.621 50.431 22.787 1.00 0.00 C ATOM 488 NH1 ARG A 185 54.486 50.224 23.473 1.00 0.00 N ATOM 489 NH2 ARG A 185 55.648 50.061 21.507 1.00 0.00 N ATOM 0 H ARG A 185 57.113 55.230 28.059 1.00 0.00 H new ATOM 0 HA ARG A 185 57.037 55.642 25.175 1.00 0.00 H new ATOM 0 HB2 ARG A 185 57.950 53.559 26.380 1.00 0.00 H new ATOM 0 HB3 ARG A 185 56.296 53.165 26.805 1.00 0.00 H new ATOM 0 HG2 ARG A 185 55.726 53.298 24.304 1.00 0.00 H new ATOM 0 HG3 ARG A 185 57.444 53.440 23.988 1.00 0.00 H new ATOM 0 HD2 ARG A 185 57.810 51.216 25.119 1.00 0.00 H new ATOM 0 HD3 ARG A 185 56.080 51.071 25.354 1.00 0.00 H new ATOM 0 HE ARG A 185 57.507 51.125 22.718 1.00 0.00 H new ATOM 0 HH11 ARG A 185 54.420 50.514 24.449 1.00 0.00 H new ATOM 0 HH12 ARG A 185 53.690 49.777 23.019 1.00 0.00 H new ATOM 0 HH21 ARG A 185 56.485 50.222 20.947 1.00 0.00 H new ATOM 0 HH22 ARG A 185 54.831 49.617 21.087 1.00 0.00 H new ATOM 802 N PHE B 165 64.206 64.787 54.800 1.00 0.00 N ATOM 803 CA PHE B 165 64.152 63.504 54.054 1.00 0.00 C ATOM 804 C PHE B 165 63.367 63.619 52.736 1.00 0.00 C ATOM 805 O PHE B 165 63.877 63.256 51.670 1.00 0.00 O ATOM 806 CB PHE B 165 63.544 62.452 54.978 1.00 0.00 C ATOM 807 CG PHE B 165 63.446 61.051 54.368 1.00 0.00 C ATOM 808 CD1 PHE B 165 64.576 60.199 54.423 1.00 0.00 C ATOM 809 CD2 PHE B 165 62.192 60.560 53.926 1.00 0.00 C ATOM 810 CE1 PHE B 165 64.451 58.855 54.026 1.00 0.00 C ATOM 811 CE2 PHE B 165 62.072 59.209 53.541 1.00 0.00 C ATOM 812 CZ PHE B 165 63.195 58.366 53.605 1.00 0.00 C ATOM 0 HA PHE B 165 65.162 63.215 53.763 1.00 0.00 H new ATOM 0 HB2 PHE B 165 64.141 62.397 55.888 1.00 0.00 H new ATOM 0 HB3 PHE B 165 62.546 62.777 55.271 1.00 0.00 H new ATOM 0 HD1 PHE B 165 65.527 60.578 54.767 1.00 0.00 H new ATOM 0 HD2 PHE B 165 61.335 61.216 53.884 1.00 0.00 H new ATOM 0 HE1 PHE B 165 65.311 58.201 54.043 1.00 0.00 H new ATOM 0 HE2 PHE B 165 61.123 58.824 53.199 1.00 0.00 H new ATOM 0 HZ PHE B 165 63.096 57.327 53.328 1.00 0.00 H new ATOM 818 N LEU B 166 62.165 64.183 52.811 1.00 0.00 N ATOM 819 CA LEU B 166 61.263 64.354 51.642 1.00 0.00 C ATOM 820 C LEU B 166 61.936 64.935 50.374 1.00 0.00 C ATOM 821 O LEU B 166 61.724 64.349 49.306 1.00 0.00 O ATOM 822 CB LEU B 166 59.991 65.114 52.049 1.00 0.00 C ATOM 823 CG LEU B 166 59.106 64.286 52.978 1.00 0.00 C ATOM 824 CD1 LEU B 166 58.189 65.216 53.772 1.00 0.00 C ATOM 825 CD2 LEU B 166 58.273 63.298 52.173 1.00 0.00 C ATOM 0 H LEU B 166 61.774 64.541 53.682 1.00 0.00 H new ATOM 0 HA LEU B 166 60.978 63.348 51.332 1.00 0.00 H new ATOM 0 HB2 LEU B 166 60.267 66.045 52.545 1.00 0.00 H new ATOM 0 HB3 LEU B 166 59.428 65.384 51.156 1.00 0.00 H new ATOM 0 HG LEU B 166 59.739 63.726 53.667 1.00 0.00 H new ATOM 0 HD11 LEU B 166 57.557 64.625 54.435 1.00 0.00 H new ATOM 0 HD12 LEU B 166 58.793 65.904 54.364 1.00 0.00 H new ATOM 0 HD13 LEU B 166 57.562 65.783 53.084 1.00 0.00 H new ATOM 0 HD21 LEU B 166 57.647 62.715 52.848 1.00 0.00 H new ATOM 0 HD22 LEU B 166 57.641 63.842 51.471 1.00 0.00 H new ATOM 0 HD23 LEU B 166 58.934 62.629 51.622 1.00 0.00 H new ATOM 831 N PRO B 167 62.761 66.000 50.459 1.00 0.00 N ATOM 832 CA PRO B 167 63.570 66.501 49.321 1.00 0.00 C ATOM 833 C PRO B 167 64.429 65.437 48.626 1.00 0.00 C ATOM 834 O PRO B 167 64.099 65.067 47.501 1.00 0.00 O ATOM 835 CB PRO B 167 64.426 67.616 49.917 1.00 0.00 C ATOM 836 CG PRO B 167 63.492 68.219 50.949 1.00 0.00 C ATOM 837 CD PRO B 167 62.813 66.996 51.551 1.00 0.00 C ATOM 0 HA PRO B 167 62.915 66.844 48.520 1.00 0.00 H new ATOM 0 HB2 PRO B 167 65.339 67.230 50.370 1.00 0.00 H new ATOM 0 HB3 PRO B 167 64.727 68.345 49.165 1.00 0.00 H new ATOM 0 HG2 PRO B 167 64.036 68.790 51.701 1.00 0.00 H new ATOM 0 HG3 PRO B 167 62.771 68.898 50.493 1.00 0.00 H new ATOM 0 HD2 PRO B 167 63.374 66.615 52.404 1.00 0.00 H new ATOM 0 HD3 PRO B 167 61.813 67.238 51.910 1.00 0.00 H new ATOM 843 N SER B 168 65.393 64.856 49.332 1.00 0.00 N ATOM 844 CA SER B 168 66.325 63.854 48.762 1.00 0.00 C ATOM 845 C SER B 168 65.573 62.657 48.132 1.00 0.00 C ATOM 846 O SER B 168 65.822 62.295 46.983 1.00 0.00 O ATOM 847 CB SER B 168 67.305 63.349 49.832 1.00 0.00 C ATOM 848 OG SER B 168 66.575 62.618 50.815 1.00 0.00 O ATOM 0 H SER B 168 65.561 65.058 50.318 1.00 0.00 H new ATOM 0 HA SER B 168 66.884 64.354 47.971 1.00 0.00 H new ATOM 0 HB2 SER B 168 68.066 62.714 49.378 1.00 0.00 H new ATOM 0 HB3 SER B 168 67.824 64.188 50.294 1.00 0.00 H new ATOM 0 HG SER B 168 65.753 63.102 51.039 1.00 0.00 H new ATOM 854 N LEU B 169 64.561 62.188 48.862 1.00 0.00 N ATOM 855 CA LEU B 169 63.605 61.145 48.444 1.00 0.00 C ATOM 856 C LEU B 169 62.967 61.466 47.083 1.00 0.00 C ATOM 857 O LEU B 169 63.182 60.729 46.118 1.00 0.00 O ATOM 858 CB LEU B 169 62.567 61.008 49.559 1.00 0.00 C ATOM 859 CG LEU B 169 61.650 59.787 49.371 1.00 0.00 C ATOM 860 CD1 LEU B 169 62.346 58.501 49.803 1.00 0.00 C ATOM 861 CD2 LEU B 169 60.360 60.021 50.157 1.00 0.00 C ATOM 0 H LEU B 169 64.371 62.535 49.802 1.00 0.00 H new ATOM 0 HA LEU B 169 64.118 60.194 48.298 1.00 0.00 H new ATOM 0 HB2 LEU B 169 63.079 60.928 50.518 1.00 0.00 H new ATOM 0 HB3 LEU B 169 61.959 61.912 49.596 1.00 0.00 H new ATOM 0 HG LEU B 169 61.410 59.668 48.314 1.00 0.00 H new ATOM 0 HD11 LEU B 169 61.672 57.656 49.658 1.00 0.00 H new ATOM 0 HD12 LEU B 169 63.245 58.355 49.204 1.00 0.00 H new ATOM 0 HD13 LEU B 169 62.619 58.571 50.856 1.00 0.00 H new ATOM 0 HD21 LEU B 169 59.698 59.164 50.034 1.00 0.00 H new ATOM 0 HD22 LEU B 169 60.596 60.149 51.213 1.00 0.00 H new ATOM 0 HD23 LEU B 169 59.865 60.918 49.785 1.00 0.00 H new ATOM 867 N LEU B 170 62.325 62.634 47.015 1.00 0.00 N ATOM 868 CA LEU B 170 61.728 63.204 45.781 1.00 0.00 C ATOM 869 C LEU B 170 62.761 63.257 44.637 1.00 0.00 C ATOM 870 O LEU B 170 62.656 62.474 43.705 1.00 0.00 O ATOM 871 CB LEU B 170 61.170 64.596 46.089 1.00 0.00 C ATOM 872 CG LEU B 170 60.481 65.231 44.881 1.00 0.00 C ATOM 873 CD1 LEU B 170 59.004 64.805 44.784 1.00 0.00 C ATOM 874 CD2 LEU B 170 60.625 66.749 44.931 1.00 0.00 C ATOM 0 H LEU B 170 62.197 63.233 47.830 1.00 0.00 H new ATOM 0 HA LEU B 170 60.914 62.560 45.447 1.00 0.00 H new ATOM 0 HB2 LEU B 170 60.460 64.525 46.913 1.00 0.00 H new ATOM 0 HB3 LEU B 170 61.981 65.243 46.422 1.00 0.00 H new ATOM 0 HG LEU B 170 60.973 64.871 43.978 1.00 0.00 H new ATOM 0 HD11 LEU B 170 58.546 65.275 43.914 1.00 0.00 H new ATOM 0 HD12 LEU B 170 58.944 63.721 44.685 1.00 0.00 H new ATOM 0 HD13 LEU B 170 58.476 65.117 45.685 1.00 0.00 H new ATOM 0 HD21 LEU B 170 60.130 67.190 44.066 1.00 0.00 H new ATOM 0 HD22 LEU B 170 60.166 67.128 45.844 1.00 0.00 H new ATOM 0 HD23 LEU B 170 61.682 67.015 44.919 1.00 0.00 H new ATOM 880 N LEU B 171 63.860 63.975 44.877 1.00 0.00 N ATOM 881 CA LEU B 171 64.960 64.191 43.906 1.00 0.00 C ATOM 882 C LEU B 171 65.499 62.891 43.290 1.00 0.00 C ATOM 883 O LEU B 171 65.408 62.698 42.080 1.00 0.00 O ATOM 884 CB LEU B 171 66.082 64.998 44.568 1.00 0.00 C ATOM 885 CG LEU B 171 65.608 66.415 44.957 1.00 0.00 C ATOM 886 CD1 LEU B 171 66.569 67.025 45.974 1.00 0.00 C ATOM 887 CD2 LEU B 171 65.515 67.331 43.737 1.00 0.00 C ATOM 0 H LEU B 171 64.024 64.438 45.771 1.00 0.00 H new ATOM 0 HA LEU B 171 64.545 64.757 43.072 1.00 0.00 H new ATOM 0 HB2 LEU B 171 66.432 64.474 45.457 1.00 0.00 H new ATOM 0 HB3 LEU B 171 66.929 65.071 43.886 1.00 0.00 H new ATOM 0 HG LEU B 171 64.613 66.323 45.393 1.00 0.00 H new ATOM 0 HD11 LEU B 171 66.228 68.025 46.243 1.00 0.00 H new ATOM 0 HD12 LEU B 171 66.600 66.400 46.866 1.00 0.00 H new ATOM 0 HD13 LEU B 171 67.567 67.087 45.540 1.00 0.00 H new ATOM 0 HD21 LEU B 171 65.178 68.320 44.049 1.00 0.00 H new ATOM 0 HD22 LEU B 171 66.495 67.413 43.268 1.00 0.00 H new ATOM 0 HD23 LEU B 171 64.805 66.915 43.023 1.00 0.00 H new ATOM 893 N SER B 172 65.862 61.944 44.163 1.00 0.00 N ATOM 894 CA SER B 172 66.356 60.605 43.784 1.00 0.00 C ATOM 895 C SER B 172 65.342 59.806 42.953 1.00 0.00 C ATOM 896 O SER B 172 65.576 59.515 41.782 1.00 0.00 O ATOM 897 CB SER B 172 66.757 59.826 45.039 1.00 0.00 C ATOM 898 OG SER B 172 67.371 58.578 44.692 1.00 0.00 O ATOM 0 H SER B 172 65.822 62.084 45.172 1.00 0.00 H new ATOM 0 HA SER B 172 67.228 60.751 43.147 1.00 0.00 H new ATOM 0 HB2 SER B 172 67.447 60.422 45.637 1.00 0.00 H new ATOM 0 HB3 SER B 172 65.877 59.644 45.656 1.00 0.00 H new ATOM 0 HG SER B 172 66.706 57.860 44.745 1.00 0.00 H new ATOM 904 N HIS B 173 64.119 59.696 43.489 1.00 0.00 N ATOM 905 CA HIS B 173 62.992 59.018 42.808 1.00 0.00 C ATOM 906 C HIS B 173 62.604 59.666 41.461 1.00 0.00 C ATOM 907 O HIS B 173 62.302 58.972 40.495 1.00 0.00 O ATOM 908 CB HIS B 173 61.762 58.968 43.709 1.00 0.00 C ATOM 909 CG HIS B 173 61.819 57.860 44.753 1.00 0.00 C ATOM 910 ND1 HIS B 173 62.523 57.866 45.887 1.00 0.00 N ATOM 911 CD2 HIS B 173 61.048 56.779 44.773 1.00 0.00 C ATOM 912 CE1 HIS B 173 62.188 56.805 46.592 1.00 0.00 C ATOM 913 NE2 HIS B 173 61.278 56.130 45.911 1.00 0.00 N ATOM 0 H HIS B 173 63.876 60.072 44.406 1.00 0.00 H new ATOM 0 HA HIS B 173 63.346 58.009 42.595 1.00 0.00 H new ATOM 0 HB2 HIS B 173 61.652 59.927 44.214 1.00 0.00 H new ATOM 0 HB3 HIS B 173 60.874 58.830 43.092 1.00 0.00 H new ATOM 0 HD1 HIS B 173 63.205 58.573 46.161 1.00 0.00 H new ATOM 0 HD2 HIS B 173 60.355 56.479 44.000 1.00 0.00 H new ATOM 0 HE1 HIS B 173 62.587 56.534 47.558 1.00 0.00 H new ATOM 918 N LEU B 174 62.592 60.999 41.438 1.00 0.00 N ATOM 919 CA LEU B 174 62.318 61.790 40.228 1.00 0.00 C ATOM 920 C LEU B 174 63.385 61.677 39.130 1.00 0.00 C ATOM 921 O LEU B 174 63.055 61.655 37.955 1.00 0.00 O ATOM 922 CB LEU B 174 62.064 63.258 40.589 1.00 0.00 C ATOM 923 CG LEU B 174 60.601 63.703 40.406 1.00 0.00 C ATOM 924 CD1 LEU B 174 60.134 63.559 38.949 1.00 0.00 C ATOM 925 CD2 LEU B 174 59.649 63.010 41.384 1.00 0.00 C ATOM 0 H LEU B 174 62.773 61.569 42.264 1.00 0.00 H new ATOM 0 HA LEU B 174 61.417 61.354 39.797 1.00 0.00 H new ATOM 0 HB2 LEU B 174 62.356 63.422 41.626 1.00 0.00 H new ATOM 0 HB3 LEU B 174 62.705 63.889 39.973 1.00 0.00 H new ATOM 0 HG LEU B 174 60.570 64.765 40.648 1.00 0.00 H new ATOM 0 HD11 LEU B 174 59.097 63.884 38.866 1.00 0.00 H new ATOM 0 HD12 LEU B 174 60.760 64.175 38.304 1.00 0.00 H new ATOM 0 HD13 LEU B 174 60.213 62.516 38.643 1.00 0.00 H new ATOM 0 HD21 LEU B 174 58.631 63.360 41.211 1.00 0.00 H new ATOM 0 HD22 LEU B 174 59.692 61.932 41.231 1.00 0.00 H new ATOM 0 HD23 LEU B 174 59.944 63.244 42.407 1.00 0.00 H new ATOM 931 N LEU B 175 64.662 61.622 39.531 1.00 0.00 N ATOM 932 CA LEU B 175 65.750 61.245 38.605 1.00 0.00 C ATOM 933 C LEU B 175 65.687 59.771 38.138 1.00 0.00 C ATOM 934 O LEU B 175 66.149 59.457 37.052 1.00 0.00 O ATOM 935 CB LEU B 175 67.128 61.555 39.209 1.00 0.00 C ATOM 936 CG LEU B 175 67.643 62.895 38.664 1.00 0.00 C ATOM 937 CD1 LEU B 175 67.016 64.101 39.380 1.00 0.00 C ATOM 938 CD2 LEU B 175 69.166 62.917 38.742 1.00 0.00 C ATOM 0 H LEU B 175 64.970 61.831 40.481 1.00 0.00 H new ATOM 0 HA LEU B 175 65.601 61.858 37.716 1.00 0.00 H new ATOM 0 HB2 LEU B 175 67.058 61.596 40.296 1.00 0.00 H new ATOM 0 HB3 LEU B 175 67.830 60.758 38.965 1.00 0.00 H new ATOM 0 HG LEU B 175 67.338 62.983 37.621 1.00 0.00 H new ATOM 0 HD11 LEU B 175 67.414 65.023 38.956 1.00 0.00 H new ATOM 0 HD12 LEU B 175 65.934 64.079 39.250 1.00 0.00 H new ATOM 0 HD13 LEU B 175 67.254 64.057 40.443 1.00 0.00 H new ATOM 0 HD21 LEU B 175 69.536 63.867 38.356 1.00 0.00 H new ATOM 0 HD22 LEU B 175 69.479 62.800 39.780 1.00 0.00 H new ATOM 0 HD23 LEU B 175 69.573 62.100 38.146 1.00 0.00 H new ATOM 944 N ALA B 176 65.138 58.907 38.988 1.00 0.00 N ATOM 945 CA ALA B 176 64.755 57.531 38.604 1.00 0.00 C ATOM 946 C ALA B 176 63.614 57.497 37.575 1.00 0.00 C ATOM 947 O ALA B 176 63.699 56.754 36.605 1.00 0.00 O ATOM 948 CB ALA B 176 64.416 56.712 39.850 1.00 0.00 C ATOM 0 H ALA B 176 64.942 59.131 39.964 1.00 0.00 H new ATOM 0 HA ALA B 176 65.614 57.077 38.111 1.00 0.00 H new ATOM 0 HB1 ALA B 176 64.135 55.701 39.555 1.00 0.00 H new ATOM 0 HB2 ALA B 176 65.286 56.671 40.506 1.00 0.00 H new ATOM 0 HB3 ALA B 176 63.585 57.180 40.378 1.00 0.00 H new ATOM 954 N ILE B 177 62.575 58.311 37.783 1.00 0.00 N ATOM 955 CA ILE B 177 61.550 58.619 36.760 1.00 0.00 C ATOM 956 C ILE B 177 62.229 59.191 35.494 1.00 0.00 C ATOM 957 O ILE B 177 61.858 58.830 34.376 1.00 0.00 O ATOM 958 CB ILE B 177 60.454 59.544 37.333 1.00 0.00 C ATOM 959 CG1 ILE B 177 59.738 58.842 38.505 1.00 0.00 C ATOM 960 CG2 ILE B 177 59.428 59.954 36.265 1.00 0.00 C ATOM 961 CD1 ILE B 177 58.913 59.768 39.404 1.00 0.00 C ATOM 0 H ILE B 177 62.413 58.783 38.672 1.00 0.00 H new ATOM 0 HA ILE B 177 61.041 57.701 36.466 1.00 0.00 H new ATOM 0 HB ILE B 177 60.941 60.453 37.686 1.00 0.00 H new ATOM 0 HG12 ILE B 177 59.081 58.072 38.101 1.00 0.00 H new ATOM 0 HG13 ILE B 177 60.485 58.336 39.117 1.00 0.00 H new ATOM 0 HG21 ILE B 177 58.676 60.604 36.713 1.00 0.00 H new ATOM 0 HG22 ILE B 177 59.934 60.486 35.459 1.00 0.00 H new ATOM 0 HG23 ILE B 177 58.945 59.063 35.864 1.00 0.00 H new ATOM 0 HD11 ILE B 177 58.448 59.184 40.198 1.00 0.00 H new ATOM 0 HD12 ILE B 177 59.564 60.524 39.843 1.00 0.00 H new ATOM 0 HD13 ILE B 177 58.139 60.256 38.811 1.00 0.00 H new ATOM 965 N GLY B 178 63.190 60.088 35.691 1.00 0.00 N ATOM 966 CA GLY B 178 64.102 60.606 34.656 1.00 0.00 C ATOM 967 C GLY B 178 64.756 59.506 33.805 1.00 0.00 C ATOM 968 O GLY B 178 64.495 59.418 32.612 1.00 0.00 O ATOM 0 H GLY B 178 63.368 60.495 36.609 1.00 0.00 H new ATOM 0 HA2 GLY B 178 63.550 61.280 34.001 1.00 0.00 H new ATOM 0 HA3 GLY B 178 64.883 61.196 35.135 1.00 0.00 H new ATOM 972 N LEU B 179 65.531 58.650 34.471 1.00 0.00 N ATOM 973 CA LEU B 179 66.117 57.427 33.888 1.00 0.00 C ATOM 974 C LEU B 179 65.046 56.530 33.220 1.00 0.00 C ATOM 975 O LEU B 179 65.264 55.938 32.163 1.00 0.00 O ATOM 976 CB LEU B 179 66.859 56.634 34.967 1.00 0.00 C ATOM 977 CG LEU B 179 67.686 55.498 34.352 1.00 0.00 C ATOM 978 CD1 LEU B 179 69.077 55.971 33.942 1.00 0.00 C ATOM 979 CD2 LEU B 179 67.741 54.298 35.298 1.00 0.00 C ATOM 0 H LEU B 179 65.778 58.784 35.451 1.00 0.00 H new ATOM 0 HA LEU B 179 66.817 57.739 33.113 1.00 0.00 H new ATOM 0 HB2 LEU B 179 67.514 57.302 35.527 1.00 0.00 H new ATOM 0 HB3 LEU B 179 66.142 56.222 35.677 1.00 0.00 H new ATOM 0 HG LEU B 179 67.188 55.174 33.438 1.00 0.00 H new ATOM 0 HD11 LEU B 179 69.632 55.138 33.511 1.00 0.00 H new ATOM 0 HD12 LEU B 179 68.987 56.768 33.204 1.00 0.00 H new ATOM 0 HD13 LEU B 179 69.607 56.345 34.818 1.00 0.00 H new ATOM 0 HD21 LEU B 179 68.332 53.503 34.843 1.00 0.00 H new ATOM 0 HD22 LEU B 179 68.200 54.598 36.240 1.00 0.00 H new ATOM 0 HD23 LEU B 179 66.730 53.936 35.486 1.00 0.00 H new ATOM 985 N GLY B 180 63.901 56.425 33.890 1.00 0.00 N ATOM 986 CA GLY B 180 62.684 55.784 33.360 1.00 0.00 C ATOM 987 C GLY B 180 62.280 56.330 31.988 1.00 0.00 C ATOM 988 O GLY B 180 62.278 55.587 31.014 1.00 0.00 O ATOM 0 H GLY B 180 63.783 56.788 34.836 1.00 0.00 H new ATOM 0 HA2 GLY B 180 62.847 54.709 33.285 1.00 0.00 H new ATOM 0 HA3 GLY B 180 61.864 55.934 34.062 1.00 0.00 H new ATOM 992 N ILE B 181 61.998 57.627 31.917 1.00 0.00 N ATOM 993 CA ILE B 181 61.685 58.328 30.648 1.00 0.00 C ATOM 994 C ILE B 181 62.867 58.267 29.659 1.00 0.00 C ATOM 995 O ILE B 181 62.629 58.182 28.456 1.00 0.00 O ATOM 996 CB ILE B 181 61.218 59.779 30.920 1.00 0.00 C ATOM 997 CG1 ILE B 181 59.977 59.760 31.827 1.00 0.00 C ATOM 998 CG2 ILE B 181 60.856 60.516 29.623 1.00 0.00 C ATOM 999 CD1 ILE B 181 59.874 61.015 32.691 1.00 0.00 C ATOM 0 H ILE B 181 61.977 58.236 32.735 1.00 0.00 H new ATOM 0 HA ILE B 181 60.856 57.807 30.169 1.00 0.00 H new ATOM 0 HB ILE B 181 62.045 60.302 31.400 1.00 0.00 H new ATOM 0 HG12 ILE B 181 59.081 59.670 31.212 1.00 0.00 H new ATOM 0 HG13 ILE B 181 60.012 58.880 32.470 1.00 0.00 H new ATOM 0 HG21 ILE B 181 60.534 61.530 29.859 1.00 0.00 H new ATOM 0 HG22 ILE B 181 61.729 60.555 28.971 1.00 0.00 H new ATOM 0 HG23 ILE B 181 60.048 59.987 29.117 1.00 0.00 H new ATOM 0 HD11 ILE B 181 58.982 60.955 33.314 1.00 0.00 H new ATOM 0 HD12 ILE B 181 60.756 61.093 33.327 1.00 0.00 H new ATOM 0 HD13 ILE B 181 59.811 61.894 32.050 1.00 0.00 H new ATOM 1003 N TYR B 182 64.102 58.246 30.144 1.00 0.00 N ATOM 1004 CA TYR B 182 65.294 57.937 29.324 1.00 0.00 C ATOM 1005 C TYR B 182 65.119 56.633 28.524 1.00 0.00 C ATOM 1006 O TYR B 182 65.093 56.679 27.292 1.00 0.00 O ATOM 1007 CB TYR B 182 66.539 57.935 30.221 1.00 0.00 C ATOM 1008 CG TYR B 182 67.837 57.502 29.535 1.00 0.00 C ATOM 1009 CD1 TYR B 182 68.454 58.420 28.651 1.00 0.00 C ATOM 1010 CD2 TYR B 182 68.260 56.160 29.628 1.00 0.00 C ATOM 1011 CE1 TYR B 182 69.479 57.964 27.804 1.00 0.00 C ATOM 1012 CE2 TYR B 182 69.285 55.702 28.771 1.00 0.00 C ATOM 1013 CZ TYR B 182 69.852 56.604 27.847 1.00 0.00 C ATOM 1014 OH TYR B 182 70.497 56.099 26.767 1.00 0.00 O ATOM 0 H TYR B 182 64.319 58.442 31.121 1.00 0.00 H new ATOM 0 HA TYR B 182 65.425 58.714 28.571 1.00 0.00 H new ATOM 0 HB2 TYR B 182 66.678 58.938 30.625 1.00 0.00 H new ATOM 0 HB3 TYR B 182 66.356 57.273 31.067 1.00 0.00 H new ATOM 0 HD1 TYR B 182 68.142 59.454 28.628 1.00 0.00 H new ATOM 0 HD2 TYR B 182 67.806 55.492 30.345 1.00 0.00 H new ATOM 0 HE1 TYR B 182 69.975 58.646 27.129 1.00 0.00 H new ATOM 0 HE2 TYR B 182 69.628 54.679 28.822 1.00 0.00 H new ATOM 0 HH TYR B 182 70.700 55.153 26.920 1.00 0.00 H new ATOM 1019 N ILE B 183 64.754 55.564 29.230 1.00 0.00 N ATOM 1020 CA ILE B 183 64.417 54.246 28.637 1.00 0.00 C ATOM 1021 C ILE B 183 63.122 54.362 27.812 1.00 0.00 C ATOM 1022 O ILE B 183 63.139 54.051 26.624 1.00 0.00 O ATOM 1023 CB ILE B 183 64.302 53.162 29.730 1.00 0.00 C ATOM 1024 CG1 ILE B 183 65.590 53.092 30.569 1.00 0.00 C ATOM 1025 CG2 ILE B 183 64.024 51.793 29.108 1.00 0.00 C ATOM 1026 CD1 ILE B 183 65.385 52.479 31.953 1.00 0.00 C ATOM 0 H ILE B 183 64.679 55.577 30.247 1.00 0.00 H new ATOM 0 HA ILE B 183 65.222 53.941 27.968 1.00 0.00 H new ATOM 0 HB ILE B 183 63.470 53.434 30.379 1.00 0.00 H new ATOM 0 HG12 ILE B 183 66.335 52.508 30.028 1.00 0.00 H new ATOM 0 HG13 ILE B 183 65.995 54.098 30.682 1.00 0.00 H new ATOM 0 HG21 ILE B 183 63.947 51.044 29.896 1.00 0.00 H new ATOM 0 HG22 ILE B 183 63.088 51.830 28.550 1.00 0.00 H new ATOM 0 HG23 ILE B 183 64.838 51.528 28.434 1.00 0.00 H new ATOM 0 HD11 ILE B 183 66.335 52.462 32.488 1.00 0.00 H new ATOM 0 HD12 ILE B 183 64.664 53.076 32.512 1.00 0.00 H new ATOM 0 HD13 ILE B 183 65.009 51.461 31.848 1.00 0.00 H new