USER MOD reduce.3.24.130724 H: found=0, std=0, add=333, rem=0, adj=7 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 172 SER OG : rot -74:sc= 1.57 USER MOD Set 1.2: A 173 HIS : no HD1:sc= -0.539 K(o=4.8,f=-7.4!) USER MOD Set 1.3: B 172 SER OG : rot -49:sc= 1.48 USER MOD Set 1.4: B 173 HIS : +bothHN:sc= 2.24 K(o=4.8,f=-9.8!) USER MOD Single : A 168 SER OG : rot 180:sc= 0.0216 USER MOD Single : A 182 TYR OH : rot 180:sc= 0 USER MOD Single : B 168 SER OG : rot -2:sc= 0.291 USER MOD Single : B 182 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 260 N LEU A 166 65.651 50.911 53.637 1.00 0.00 N ATOM 261 CA LEU A 166 66.362 50.426 52.428 1.00 0.00 C ATOM 262 C LEU A 166 65.583 49.476 51.493 1.00 0.00 C ATOM 263 O LEU A 166 65.644 49.723 50.285 1.00 0.00 O ATOM 264 CB LEU A 166 67.762 49.893 52.746 1.00 0.00 C ATOM 265 CG LEU A 166 68.818 50.997 52.641 1.00 0.00 C ATOM 266 CD1 LEU A 166 70.126 50.531 53.265 1.00 0.00 C ATOM 267 CD2 LEU A 166 69.063 51.360 51.185 1.00 0.00 C ATOM 0 HA LEU A 166 66.461 51.334 51.833 1.00 0.00 H new ATOM 0 HB2 LEU A 166 67.773 49.472 53.751 1.00 0.00 H new ATOM 0 HB3 LEU A 166 68.010 49.084 52.059 1.00 0.00 H new ATOM 0 HG LEU A 166 68.450 51.874 53.174 1.00 0.00 H new ATOM 0 HD11 LEU A 166 70.870 51.324 53.185 1.00 0.00 H new ATOM 0 HD12 LEU A 166 69.963 50.291 54.316 1.00 0.00 H new ATOM 0 HD13 LEU A 166 70.483 49.644 52.742 1.00 0.00 H new ATOM 0 HD21 LEU A 166 69.816 52.146 51.128 1.00 0.00 H new ATOM 0 HD22 LEU A 166 69.414 50.481 50.645 1.00 0.00 H new ATOM 0 HD23 LEU A 166 68.134 51.714 50.737 1.00 0.00 H new ATOM 273 N PRO A 167 64.814 48.484 51.995 1.00 0.00 N ATOM 274 CA PRO A 167 63.880 47.689 51.171 1.00 0.00 C ATOM 275 C PRO A 167 62.934 48.604 50.359 1.00 0.00 C ATOM 276 O PRO A 167 63.153 48.792 49.162 1.00 0.00 O ATOM 277 CB PRO A 167 63.127 46.808 52.153 1.00 0.00 C ATOM 278 CG PRO A 167 64.135 46.589 53.280 1.00 0.00 C ATOM 279 CD PRO A 167 64.873 47.919 53.362 1.00 0.00 C ATOM 0 HA PRO A 167 64.401 47.087 50.427 1.00 0.00 H new ATOM 0 HB2 PRO A 167 62.220 47.293 52.514 1.00 0.00 H new ATOM 0 HB3 PRO A 167 62.824 45.866 51.696 1.00 0.00 H new ATOM 0 HG2 PRO A 167 63.639 46.347 54.220 1.00 0.00 H new ATOM 0 HG3 PRO A 167 64.814 45.766 53.056 1.00 0.00 H new ATOM 0 HD2 PRO A 167 64.402 48.586 54.084 1.00 0.00 H new ATOM 0 HD3 PRO A 167 65.904 47.777 53.685 1.00 0.00 H new ATOM 285 N SER A 168 62.077 49.324 51.076 1.00 0.00 N ATOM 286 CA SER A 168 61.109 50.304 50.534 1.00 0.00 C ATOM 287 C SER A 168 61.760 51.289 49.544 1.00 0.00 C ATOM 288 O SER A 168 61.504 51.177 48.356 1.00 0.00 O ATOM 289 CB SER A 168 60.469 51.096 51.681 1.00 0.00 C ATOM 290 OG SER A 168 60.088 50.201 52.730 1.00 0.00 O ATOM 0 H SER A 168 62.026 49.246 52.092 1.00 0.00 H new ATOM 0 HA SER A 168 60.352 49.737 49.992 1.00 0.00 H new ATOM 0 HB2 SER A 168 61.172 51.838 52.060 1.00 0.00 H new ATOM 0 HB3 SER A 168 59.596 51.639 51.318 1.00 0.00 H new ATOM 0 HG SER A 168 59.681 50.710 53.462 1.00 0.00 H new ATOM 296 N LEU A 169 62.797 51.981 50.025 1.00 0.00 N ATOM 297 CA LEU A 169 63.617 52.962 49.264 1.00 0.00 C ATOM 298 C LEU A 169 63.972 52.515 47.843 1.00 0.00 C ATOM 299 O LEU A 169 63.793 53.250 46.879 1.00 0.00 O ATOM 300 CB LEU A 169 64.920 53.244 50.017 1.00 0.00 C ATOM 301 CG LEU A 169 64.847 54.502 50.868 1.00 0.00 C ATOM 302 CD1 LEU A 169 65.959 54.479 51.917 1.00 0.00 C ATOM 303 CD2 LEU A 169 65.051 55.739 49.985 1.00 0.00 C ATOM 0 H LEU A 169 63.110 51.878 50.990 1.00 0.00 H new ATOM 0 HA LEU A 169 62.998 53.855 49.176 1.00 0.00 H new ATOM 0 HB2 LEU A 169 65.158 52.393 50.655 1.00 0.00 H new ATOM 0 HB3 LEU A 169 65.735 53.342 49.300 1.00 0.00 H new ATOM 0 HG LEU A 169 63.871 54.540 51.351 1.00 0.00 H new ATOM 0 HD11 LEU A 169 65.904 55.382 52.525 1.00 0.00 H new ATOM 0 HD12 LEU A 169 65.839 53.604 52.555 1.00 0.00 H new ATOM 0 HD13 LEU A 169 66.928 54.435 51.419 1.00 0.00 H new ATOM 0 HD21 LEU A 169 64.998 56.638 50.600 1.00 0.00 H new ATOM 0 HD22 LEU A 169 66.028 55.686 49.504 1.00 0.00 H new ATOM 0 HD23 LEU A 169 64.273 55.774 49.223 1.00 0.00 H new ATOM 309 N LEU A 170 64.509 51.306 47.743 1.00 0.00 N ATOM 310 CA LEU A 170 64.992 50.786 46.452 1.00 0.00 C ATOM 311 C LEU A 170 63.953 50.029 45.625 1.00 0.00 C ATOM 312 O LEU A 170 63.979 50.143 44.392 1.00 0.00 O ATOM 313 CB LEU A 170 66.302 50.040 46.668 1.00 0.00 C ATOM 314 CG LEU A 170 67.415 51.036 47.015 1.00 0.00 C ATOM 315 CD1 LEU A 170 68.604 50.297 47.631 1.00 0.00 C ATOM 316 CD2 LEU A 170 67.891 51.812 45.778 1.00 0.00 C ATOM 0 H LEU A 170 64.625 50.665 48.528 1.00 0.00 H new ATOM 0 HA LEU A 170 65.191 51.641 45.806 1.00 0.00 H new ATOM 0 HB2 LEU A 170 66.189 49.312 47.472 1.00 0.00 H new ATOM 0 HB3 LEU A 170 66.567 49.483 45.769 1.00 0.00 H new ATOM 0 HG LEU A 170 67.004 51.749 47.730 1.00 0.00 H new ATOM 0 HD11 LEU A 170 69.390 51.012 47.875 1.00 0.00 H new ATOM 0 HD12 LEU A 170 68.284 49.786 48.539 1.00 0.00 H new ATOM 0 HD13 LEU A 170 68.986 49.566 46.919 1.00 0.00 H new ATOM 0 HD21 LEU A 170 68.680 52.507 46.066 1.00 0.00 H new ATOM 0 HD22 LEU A 170 68.277 51.113 45.036 1.00 0.00 H new ATOM 0 HD23 LEU A 170 67.055 52.368 45.353 1.00 0.00 H new ATOM 322 N LEU A 171 62.957 49.436 46.276 1.00 0.00 N ATOM 323 CA LEU A 171 61.798 48.856 45.576 1.00 0.00 C ATOM 324 C LEU A 171 60.887 49.938 44.957 1.00 0.00 C ATOM 325 O LEU A 171 60.480 49.802 43.803 1.00 0.00 O ATOM 326 CB LEU A 171 61.025 47.875 46.481 1.00 0.00 C ATOM 327 CG LEU A 171 61.643 46.460 46.396 1.00 0.00 C ATOM 328 CD1 LEU A 171 62.994 46.329 47.102 1.00 0.00 C ATOM 329 CD2 LEU A 171 60.655 45.429 46.945 1.00 0.00 C ATOM 0 H LEU A 171 62.922 49.340 47.291 1.00 0.00 H new ATOM 0 HA LEU A 171 62.184 48.275 44.738 1.00 0.00 H new ATOM 0 HB2 LEU A 171 61.048 48.227 47.512 1.00 0.00 H new ATOM 0 HB3 LEU A 171 59.978 47.840 46.179 1.00 0.00 H new ATOM 0 HG LEU A 171 61.839 46.272 45.340 1.00 0.00 H new ATOM 0 HD11 LEU A 171 63.362 45.308 46.998 1.00 0.00 H new ATOM 0 HD12 LEU A 171 63.708 47.020 46.653 1.00 0.00 H new ATOM 0 HD13 LEU A 171 62.876 46.566 48.159 1.00 0.00 H new ATOM 0 HD21 LEU A 171 61.095 44.434 46.883 1.00 0.00 H new ATOM 0 HD22 LEU A 171 60.428 45.661 47.986 1.00 0.00 H new ATOM 0 HD23 LEU A 171 59.737 45.457 46.358 1.00 0.00 H new ATOM 335 N SER A 172 60.748 51.076 45.637 1.00 0.00 N ATOM 336 CA SER A 172 60.123 52.284 45.067 1.00 0.00 C ATOM 337 C SER A 172 60.970 52.931 43.960 1.00 0.00 C ATOM 338 O SER A 172 60.412 53.366 42.953 1.00 0.00 O ATOM 339 CB SER A 172 59.766 53.312 46.138 1.00 0.00 C ATOM 340 OG SER A 172 60.949 53.685 46.867 1.00 0.00 O ATOM 0 H SER A 172 61.064 51.193 46.600 1.00 0.00 H new ATOM 0 HA SER A 172 59.196 51.940 44.607 1.00 0.00 H new ATOM 0 HB2 SER A 172 59.319 54.192 45.676 1.00 0.00 H new ATOM 0 HB3 SER A 172 59.023 52.898 46.819 1.00 0.00 H new ATOM 0 HG SER A 172 61.201 52.959 47.475 1.00 0.00 H new ATOM 346 N HIS A 173 62.295 52.945 44.107 1.00 0.00 N ATOM 347 CA HIS A 173 63.211 53.325 42.991 1.00 0.00 C ATOM 348 C HIS A 173 63.033 52.446 41.737 1.00 0.00 C ATOM 349 O HIS A 173 62.877 52.967 40.635 1.00 0.00 O ATOM 350 CB HIS A 173 64.684 53.333 43.402 1.00 0.00 C ATOM 351 CG HIS A 173 65.090 54.518 44.291 1.00 0.00 C ATOM 352 ND1 HIS A 173 65.849 54.423 45.374 1.00 0.00 N ATOM 353 CD2 HIS A 173 64.885 55.807 44.053 1.00 0.00 C ATOM 354 CE1 HIS A 173 66.119 55.648 45.803 1.00 0.00 C ATOM 355 NE2 HIS A 173 65.517 56.511 44.989 1.00 0.00 N ATOM 0 H HIS A 173 62.772 52.702 44.975 1.00 0.00 H new ATOM 0 HA HIS A 173 62.920 54.345 42.739 1.00 0.00 H new ATOM 0 HB2 HIS A 173 64.906 52.406 43.930 1.00 0.00 H new ATOM 0 HB3 HIS A 173 65.299 53.342 42.502 1.00 0.00 H new ATOM 0 HD2 HIS A 173 64.304 56.215 43.239 1.00 0.00 H new ATOM 0 HE1 HIS A 173 66.722 55.901 46.663 1.00 0.00 H new ATOM 0 HE2 HIS A 173 65.536 57.528 45.068 1.00 0.00 H new ATOM 360 N LEU A 174 62.984 51.124 41.940 1.00 0.00 N ATOM 361 CA LEU A 174 62.644 50.143 40.880 1.00 0.00 C ATOM 362 C LEU A 174 61.315 50.473 40.187 1.00 0.00 C ATOM 363 O LEU A 174 61.274 50.647 38.965 1.00 0.00 O ATOM 364 CB LEU A 174 62.604 48.721 41.451 1.00 0.00 C ATOM 365 CG LEU A 174 64.013 48.143 41.660 1.00 0.00 C ATOM 366 CD1 LEU A 174 63.969 47.037 42.704 1.00 0.00 C ATOM 367 CD2 LEU A 174 64.550 47.571 40.340 1.00 0.00 C ATOM 0 H LEU A 174 63.178 50.694 42.844 1.00 0.00 H new ATOM 0 HA LEU A 174 63.430 50.204 40.127 1.00 0.00 H new ATOM 0 HB2 LEU A 174 62.070 48.727 42.401 1.00 0.00 H new ATOM 0 HB3 LEU A 174 62.044 48.075 40.775 1.00 0.00 H new ATOM 0 HG LEU A 174 64.671 48.942 42.002 1.00 0.00 H new ATOM 0 HD11 LEU A 174 64.971 46.632 42.847 1.00 0.00 H new ATOM 0 HD12 LEU A 174 63.603 47.442 43.648 1.00 0.00 H new ATOM 0 HD13 LEU A 174 63.302 46.244 42.366 1.00 0.00 H new ATOM 0 HD21 LEU A 174 65.549 47.164 40.499 1.00 0.00 H new ATOM 0 HD22 LEU A 174 63.887 46.779 39.990 1.00 0.00 H new ATOM 0 HD23 LEU A 174 64.596 48.363 39.592 1.00 0.00 H new ATOM 373 N LEU A 175 60.291 50.694 41.011 1.00 0.00 N ATOM 374 CA LEU A 175 58.972 51.205 40.569 1.00 0.00 C ATOM 375 C LEU A 175 59.100 52.474 39.705 1.00 0.00 C ATOM 376 O LEU A 175 58.693 52.445 38.549 1.00 0.00 O ATOM 377 CB LEU A 175 58.083 51.448 41.797 1.00 0.00 C ATOM 378 CG LEU A 175 56.690 51.970 41.445 1.00 0.00 C ATOM 379 CD1 LEU A 175 55.813 50.898 40.779 1.00 0.00 C ATOM 380 CD2 LEU A 175 56.019 52.531 42.691 1.00 0.00 C ATOM 0 H LEU A 175 60.343 50.525 42.016 1.00 0.00 H new ATOM 0 HA LEU A 175 58.506 50.452 39.934 1.00 0.00 H new ATOM 0 HB2 LEU A 175 57.984 50.517 42.354 1.00 0.00 H new ATOM 0 HB3 LEU A 175 58.575 52.163 42.456 1.00 0.00 H new ATOM 0 HG LEU A 175 56.809 52.768 40.712 1.00 0.00 H new ATOM 0 HD11 LEU A 175 54.834 51.320 40.549 1.00 0.00 H new ATOM 0 HD12 LEU A 175 56.288 50.560 39.858 1.00 0.00 H new ATOM 0 HD13 LEU A 175 55.694 50.053 41.457 1.00 0.00 H new ATOM 0 HD21 LEU A 175 55.027 52.902 42.434 1.00 0.00 H new ATOM 0 HD22 LEU A 175 55.930 51.745 43.441 1.00 0.00 H new ATOM 0 HD23 LEU A 175 56.619 53.348 43.091 1.00 0.00 H new ATOM 386 N ALA A 176 59.807 53.491 40.220 1.00 0.00 N ATOM 387 CA ALA A 176 60.042 54.776 39.518 1.00 0.00 C ATOM 388 C ALA A 176 60.561 54.612 38.085 1.00 0.00 C ATOM 389 O ALA A 176 59.915 55.053 37.141 1.00 0.00 O ATOM 390 CB ALA A 176 60.974 55.656 40.350 1.00 0.00 C ATOM 0 H ALA A 176 60.238 53.451 41.143 1.00 0.00 H new ATOM 0 HA ALA A 176 59.073 55.264 39.416 1.00 0.00 H new ATOM 0 HB1 ALA A 176 61.144 56.599 39.830 1.00 0.00 H new ATOM 0 HB2 ALA A 176 60.518 55.853 41.320 1.00 0.00 H new ATOM 0 HB3 ALA A 176 61.926 55.144 40.494 1.00 0.00 H new ATOM 396 N ILE A 177 61.631 53.822 37.941 1.00 0.00 N ATOM 397 CA ILE A 177 62.230 53.493 36.629 1.00 0.00 C ATOM 398 C ILE A 177 61.199 52.788 35.722 1.00 0.00 C ATOM 399 O ILE A 177 60.786 53.362 34.715 1.00 0.00 O ATOM 400 CB ILE A 177 63.515 52.667 36.782 1.00 0.00 C ATOM 401 CG1 ILE A 177 64.489 53.313 37.769 1.00 0.00 C ATOM 402 CG2 ILE A 177 64.221 52.532 35.411 1.00 0.00 C ATOM 403 CD1 ILE A 177 65.496 52.316 38.352 1.00 0.00 C ATOM 0 H ILE A 177 62.112 53.388 38.729 1.00 0.00 H new ATOM 0 HA ILE A 177 62.515 54.428 36.146 1.00 0.00 H new ATOM 0 HB ILE A 177 63.228 51.687 37.164 1.00 0.00 H new ATOM 0 HG12 ILE A 177 65.029 54.115 37.266 1.00 0.00 H new ATOM 0 HG13 ILE A 177 63.925 53.769 38.582 1.00 0.00 H new ATOM 0 HG21 ILE A 177 65.132 51.945 35.527 1.00 0.00 H new ATOM 0 HG22 ILE A 177 63.555 52.034 34.706 1.00 0.00 H new ATOM 0 HG23 ILE A 177 64.474 53.523 35.033 1.00 0.00 H new ATOM 0 HD11 ILE A 177 66.160 52.833 39.045 1.00 0.00 H new ATOM 0 HD12 ILE A 177 64.962 51.527 38.881 1.00 0.00 H new ATOM 0 HD13 ILE A 177 66.083 51.878 37.545 1.00 0.00 H new ATOM 407 N GLY A 178 60.645 51.670 36.214 1.00 0.00 N ATOM 408 CA GLY A 178 59.620 50.860 35.503 1.00 0.00 C ATOM 409 C GLY A 178 58.427 51.699 35.021 1.00 0.00 C ATOM 410 O GLY A 178 58.111 51.734 33.829 1.00 0.00 O ATOM 0 H GLY A 178 60.893 51.290 37.128 1.00 0.00 H new ATOM 0 HA2 GLY A 178 60.082 50.368 34.647 1.00 0.00 H new ATOM 0 HA3 GLY A 178 59.261 50.074 36.167 1.00 0.00 H new ATOM 414 N LEU A 179 57.876 52.480 35.950 1.00 0.00 N ATOM 415 CA LEU A 179 56.768 53.433 35.715 1.00 0.00 C ATOM 416 C LEU A 179 57.101 54.448 34.606 1.00 0.00 C ATOM 417 O LEU A 179 56.271 54.698 33.728 1.00 0.00 O ATOM 418 CB LEU A 179 56.495 54.186 37.021 1.00 0.00 C ATOM 419 CG LEU A 179 55.044 54.659 37.080 1.00 0.00 C ATOM 420 CD1 LEU A 179 54.132 53.506 37.518 1.00 0.00 C ATOM 421 CD2 LEU A 179 54.903 55.856 38.024 1.00 0.00 C ATOM 0 H LEU A 179 58.191 52.474 36.920 1.00 0.00 H new ATOM 0 HA LEU A 179 55.893 52.869 35.391 1.00 0.00 H new ATOM 0 HB2 LEU A 179 56.706 53.537 37.871 1.00 0.00 H new ATOM 0 HB3 LEU A 179 57.165 55.042 37.100 1.00 0.00 H new ATOM 0 HG LEU A 179 54.740 54.981 36.084 1.00 0.00 H new ATOM 0 HD11 LEU A 179 53.100 53.853 37.557 1.00 0.00 H new ATOM 0 HD12 LEU A 179 54.212 52.687 36.803 1.00 0.00 H new ATOM 0 HD13 LEU A 179 54.435 53.157 38.505 1.00 0.00 H new ATOM 0 HD21 LEU A 179 53.862 56.177 38.051 1.00 0.00 H new ATOM 0 HD22 LEU A 179 55.220 55.568 39.026 1.00 0.00 H new ATOM 0 HD23 LEU A 179 55.526 56.676 37.667 1.00 0.00 H new ATOM 427 N GLY A 180 58.317 54.980 34.651 1.00 0.00 N ATOM 428 CA GLY A 180 58.843 55.927 33.644 1.00 0.00 C ATOM 429 C GLY A 180 58.839 55.356 32.214 1.00 0.00 C ATOM 430 O GLY A 180 58.432 56.044 31.288 1.00 0.00 O ATOM 0 H GLY A 180 58.984 54.770 35.394 1.00 0.00 H new ATOM 0 HA2 GLY A 180 58.246 56.839 33.666 1.00 0.00 H new ATOM 0 HA3 GLY A 180 59.862 56.206 33.914 1.00 0.00 H new ATOM 434 N ILE A 181 59.318 54.112 32.073 1.00 0.00 N ATOM 435 CA ILE A 181 59.241 53.367 30.788 1.00 0.00 C ATOM 436 C ILE A 181 57.798 53.331 30.243 1.00 0.00 C ATOM 437 O ILE A 181 57.569 53.726 29.105 1.00 0.00 O ATOM 438 CB ILE A 181 59.938 51.996 30.874 1.00 0.00 C ATOM 439 CG1 ILE A 181 61.453 52.193 31.035 1.00 0.00 C ATOM 440 CG2 ILE A 181 59.735 51.115 29.636 1.00 0.00 C ATOM 441 CD1 ILE A 181 61.961 51.693 32.387 1.00 0.00 C ATOM 0 H ILE A 181 59.765 53.592 32.828 1.00 0.00 H new ATOM 0 HA ILE A 181 59.812 53.913 30.037 1.00 0.00 H new ATOM 0 HB ILE A 181 59.485 51.496 31.730 1.00 0.00 H new ATOM 0 HG12 ILE A 181 61.973 51.665 30.236 1.00 0.00 H new ATOM 0 HG13 ILE A 181 61.693 53.251 30.927 1.00 0.00 H new ATOM 0 HG21 ILE A 181 60.256 50.168 29.774 1.00 0.00 H new ATOM 0 HG22 ILE A 181 58.671 50.926 29.494 1.00 0.00 H new ATOM 0 HG23 ILE A 181 60.133 51.624 28.758 1.00 0.00 H new ATOM 0 HD11 ILE A 181 63.037 51.854 32.453 1.00 0.00 H new ATOM 0 HD12 ILE A 181 61.462 52.239 33.188 1.00 0.00 H new ATOM 0 HD13 ILE A 181 61.746 50.629 32.485 1.00 0.00 H new ATOM 445 N TYR A 182 56.839 53.029 31.129 1.00 0.00 N ATOM 446 CA TYR A 182 55.406 53.133 30.821 1.00 0.00 C ATOM 447 C TYR A 182 54.990 54.544 30.354 1.00 0.00 C ATOM 448 O TYR A 182 54.506 54.686 29.243 1.00 0.00 O ATOM 449 CB TYR A 182 54.572 52.676 32.024 1.00 0.00 C ATOM 450 CG TYR A 182 53.063 52.750 31.794 1.00 0.00 C ATOM 451 CD1 TYR A 182 52.407 51.668 31.137 1.00 0.00 C ATOM 452 CD2 TYR A 182 52.319 53.831 32.331 1.00 0.00 C ATOM 453 CE1 TYR A 182 51.016 51.657 31.089 1.00 0.00 C ATOM 454 CE2 TYR A 182 50.939 53.832 32.229 1.00 0.00 C ATOM 455 CZ TYR A 182 50.271 52.740 31.616 1.00 0.00 C ATOM 456 OH TYR A 182 48.931 52.699 31.593 1.00 0.00 O ATOM 0 H TYR A 182 57.034 52.707 32.077 1.00 0.00 H new ATOM 0 HA TYR A 182 55.209 52.469 29.979 1.00 0.00 H new ATOM 0 HB2 TYR A 182 54.842 51.650 32.272 1.00 0.00 H new ATOM 0 HB3 TYR A 182 54.829 53.291 32.887 1.00 0.00 H new ATOM 0 HD1 TYR A 182 52.979 50.871 30.685 1.00 0.00 H new ATOM 0 HD2 TYR A 182 52.827 54.650 32.818 1.00 0.00 H new ATOM 0 HE1 TYR A 182 50.501 50.817 30.647 1.00 0.00 H new ATOM 0 HE2 TYR A 182 50.370 54.664 32.616 1.00 0.00 H new ATOM 0 HH TYR A 182 48.572 53.518 31.993 1.00 0.00 H new ATOM 461 N ILE A 183 55.287 55.562 31.170 1.00 0.00 N ATOM 462 CA ILE A 183 54.950 56.979 30.891 1.00 0.00 C ATOM 463 C ILE A 183 55.470 57.414 29.511 1.00 0.00 C ATOM 464 O ILE A 183 54.665 57.695 28.620 1.00 0.00 O ATOM 465 CB ILE A 183 55.450 57.893 32.032 1.00 0.00 C ATOM 466 CG1 ILE A 183 54.827 57.465 33.375 1.00 0.00 C ATOM 467 CG2 ILE A 183 55.104 59.372 31.760 1.00 0.00 C ATOM 468 CD1 ILE A 183 55.530 58.020 34.622 1.00 0.00 C ATOM 0 H ILE A 183 55.775 55.432 32.056 1.00 0.00 H new ATOM 0 HA ILE A 183 53.865 57.078 30.856 1.00 0.00 H new ATOM 0 HB ILE A 183 56.534 57.791 32.081 1.00 0.00 H new ATOM 0 HG12 ILE A 183 53.784 57.783 33.392 1.00 0.00 H new ATOM 0 HG13 ILE A 183 54.830 56.376 33.429 1.00 0.00 H new ATOM 0 HG21 ILE A 183 55.470 59.988 32.581 1.00 0.00 H new ATOM 0 HG22 ILE A 183 55.575 59.691 30.830 1.00 0.00 H new ATOM 0 HG23 ILE A 183 54.023 59.483 31.676 1.00 0.00 H new ATOM 0 HD11 ILE A 183 55.019 57.664 35.517 1.00 0.00 H new ATOM 0 HD12 ILE A 183 56.566 57.681 34.637 1.00 0.00 H new ATOM 0 HD13 ILE A 183 55.505 59.109 34.599 1.00 0.00 H new ATOM 472 N GLY A 184 56.791 57.284 29.317 1.00 0.00 N ATOM 473 CA GLY A 184 57.489 57.573 28.047 1.00 0.00 C ATOM 474 C GLY A 184 56.815 56.887 26.834 1.00 0.00 C ATOM 475 O GLY A 184 56.386 57.568 25.901 1.00 0.00 O ATOM 0 H GLY A 184 57.422 56.968 30.054 1.00 0.00 H new ATOM 0 HA2 GLY A 184 57.512 58.651 27.885 1.00 0.00 H new ATOM 0 HA3 GLY A 184 58.524 57.240 28.120 1.00 0.00 H new ATOM 479 N ARG A 185 56.571 55.586 26.980 1.00 0.00 N ATOM 480 CA ARG A 185 55.879 54.751 25.972 1.00 0.00 C ATOM 481 C ARG A 185 54.432 55.166 25.675 1.00 0.00 C ATOM 482 O ARG A 185 54.062 55.253 24.512 1.00 0.00 O ATOM 483 CB ARG A 185 55.931 53.284 26.385 1.00 0.00 C ATOM 484 CG ARG A 185 57.219 52.644 25.864 1.00 0.00 C ATOM 485 CD ARG A 185 56.993 51.935 24.533 1.00 0.00 C ATOM 486 NE ARG A 185 56.301 50.657 24.796 1.00 0.00 N ATOM 487 CZ ARG A 185 56.872 49.452 24.658 1.00 0.00 C ATOM 488 NH1 ARG A 185 57.694 49.214 23.643 1.00 0.00 N ATOM 489 NH2 ARG A 185 56.293 48.396 25.244 1.00 0.00 N ATOM 0 H ARG A 185 56.849 55.064 27.811 1.00 0.00 H new ATOM 0 HA ARG A 185 56.422 54.908 25.040 1.00 0.00 H new ATOM 0 HB2 ARG A 185 55.886 53.201 27.471 1.00 0.00 H new ATOM 0 HB3 ARG A 185 55.065 52.754 25.989 1.00 0.00 H new ATOM 0 HG2 ARG A 185 57.984 53.411 25.743 1.00 0.00 H new ATOM 0 HG3 ARG A 185 57.595 51.931 26.598 1.00 0.00 H new ATOM 0 HD2 ARG A 185 56.396 52.559 23.868 1.00 0.00 H new ATOM 0 HD3 ARG A 185 57.945 51.755 24.033 1.00 0.00 H new ATOM 0 HE ARG A 185 55.329 50.693 25.102 1.00 0.00 H new ATOM 0 HH11 ARG A 185 57.893 49.949 22.965 1.00 0.00 H new ATOM 0 HH12 ARG A 185 58.126 48.296 23.541 1.00 0.00 H new ATOM 0 HH21 ARG A 185 55.435 48.518 25.782 1.00 0.00 H new ATOM 0 HH22 ARG A 185 56.710 47.470 25.152 1.00 0.00 H new ATOM 802 N PHE B 165 65.096 65.057 55.489 1.00 0.00 N ATOM 803 CA PHE B 165 65.219 63.906 54.573 1.00 0.00 C ATOM 804 C PHE B 165 64.426 64.058 53.257 1.00 0.00 C ATOM 805 O PHE B 165 65.000 63.876 52.190 1.00 0.00 O ATOM 806 CB PHE B 165 64.873 62.589 55.288 1.00 0.00 C ATOM 807 CG PHE B 165 65.202 61.296 54.509 1.00 0.00 C ATOM 808 CD1 PHE B 165 66.260 61.231 53.557 1.00 0.00 C ATOM 809 CD2 PHE B 165 64.520 60.120 54.901 1.00 0.00 C ATOM 810 CE1 PHE B 165 66.634 59.981 53.017 1.00 0.00 C ATOM 811 CE2 PHE B 165 64.928 58.868 54.385 1.00 0.00 C ATOM 812 CZ PHE B 165 65.972 58.817 53.437 1.00 0.00 C ATOM 0 HA PHE B 165 66.267 63.878 54.276 1.00 0.00 H new ATOM 0 HB2 PHE B 165 65.405 62.563 56.239 1.00 0.00 H new ATOM 0 HB3 PHE B 165 63.808 62.591 55.518 1.00 0.00 H new ATOM 0 HD1 PHE B 165 66.772 62.131 53.251 1.00 0.00 H new ATOM 0 HD2 PHE B 165 63.691 60.178 55.591 1.00 0.00 H new ATOM 0 HE1 PHE B 165 67.425 59.921 52.285 1.00 0.00 H new ATOM 0 HE2 PHE B 165 64.445 57.960 54.713 1.00 0.00 H new ATOM 0 HZ PHE B 165 66.268 57.863 53.026 1.00 0.00 H new ATOM 818 N LEU B 166 63.190 64.558 53.341 1.00 0.00 N ATOM 819 CA LEU B 166 62.293 64.699 52.171 1.00 0.00 C ATOM 820 C LEU B 166 62.878 65.245 50.848 1.00 0.00 C ATOM 821 O LEU B 166 62.563 64.623 49.824 1.00 0.00 O ATOM 822 CB LEU B 166 60.969 65.380 52.548 1.00 0.00 C ATOM 823 CG LEU B 166 59.979 64.385 53.163 1.00 0.00 C ATOM 824 CD1 LEU B 166 58.825 65.146 53.798 1.00 0.00 C ATOM 825 CD2 LEU B 166 59.413 63.432 52.106 1.00 0.00 C ATOM 0 H LEU B 166 62.776 64.878 54.216 1.00 0.00 H new ATOM 0 HA LEU B 166 62.112 63.658 51.904 1.00 0.00 H new ATOM 0 HB2 LEU B 166 61.162 66.186 53.255 1.00 0.00 H new ATOM 0 HB3 LEU B 166 60.527 65.833 51.661 1.00 0.00 H new ATOM 0 HG LEU B 166 60.514 63.800 53.911 1.00 0.00 H new ATOM 0 HD11 LEU B 166 58.120 64.439 54.236 1.00 0.00 H new ATOM 0 HD12 LEU B 166 59.209 65.805 54.577 1.00 0.00 H new ATOM 0 HD13 LEU B 166 58.318 65.740 53.037 1.00 0.00 H new ATOM 0 HD21 LEU B 166 58.715 62.740 52.577 1.00 0.00 H new ATOM 0 HD22 LEU B 166 58.893 64.006 51.339 1.00 0.00 H new ATOM 0 HD23 LEU B 166 60.228 62.870 51.649 1.00 0.00 H new ATOM 831 N PRO B 167 63.712 66.299 50.811 1.00 0.00 N ATOM 832 CA PRO B 167 64.389 66.760 49.582 1.00 0.00 C ATOM 833 C PRO B 167 65.139 65.634 48.843 1.00 0.00 C ATOM 834 O PRO B 167 64.624 65.168 47.838 1.00 0.00 O ATOM 835 CB PRO B 167 65.294 67.914 50.011 1.00 0.00 C ATOM 836 CG PRO B 167 64.523 68.516 51.172 1.00 0.00 C ATOM 837 CD PRO B 167 63.953 67.290 51.884 1.00 0.00 C ATOM 0 HA PRO B 167 63.663 67.096 48.841 1.00 0.00 H new ATOM 0 HB2 PRO B 167 66.281 67.565 50.315 1.00 0.00 H new ATOM 0 HB3 PRO B 167 65.445 68.634 49.206 1.00 0.00 H new ATOM 0 HG2 PRO B 167 65.171 69.098 51.828 1.00 0.00 H new ATOM 0 HG3 PRO B 167 63.734 69.185 50.828 1.00 0.00 H new ATOM 0 HD2 PRO B 167 64.652 66.905 52.627 1.00 0.00 H new ATOM 0 HD3 PRO B 167 63.030 67.533 52.411 1.00 0.00 H new ATOM 843 N SER B 168 66.199 65.091 49.445 1.00 0.00 N ATOM 844 CA SER B 168 66.975 63.972 48.856 1.00 0.00 C ATOM 845 C SER B 168 66.128 62.745 48.478 1.00 0.00 C ATOM 846 O SER B 168 66.277 62.224 47.377 1.00 0.00 O ATOM 847 CB SER B 168 68.131 63.511 49.742 1.00 0.00 C ATOM 848 OG SER B 168 67.676 63.282 51.073 1.00 0.00 O ATOM 0 H SER B 168 66.551 65.405 50.350 1.00 0.00 H new ATOM 0 HA SER B 168 67.373 64.405 47.938 1.00 0.00 H new ATOM 0 HB2 SER B 168 68.566 62.597 49.337 1.00 0.00 H new ATOM 0 HB3 SER B 168 68.918 64.265 49.745 1.00 0.00 H new ATOM 0 HG SER B 168 66.723 63.504 51.136 1.00 0.00 H new ATOM 854 N LEU B 169 65.201 62.387 49.361 1.00 0.00 N ATOM 855 CA LEU B 169 64.225 61.295 49.149 1.00 0.00 C ATOM 856 C LEU B 169 63.400 61.493 47.865 1.00 0.00 C ATOM 857 O LEU B 169 63.497 60.676 46.945 1.00 0.00 O ATOM 858 CB LEU B 169 63.346 61.222 50.409 1.00 0.00 C ATOM 859 CG LEU B 169 62.352 60.062 50.390 1.00 0.00 C ATOM 860 CD1 LEU B 169 63.053 58.699 50.465 1.00 0.00 C ATOM 861 CD2 LEU B 169 61.392 60.214 51.575 1.00 0.00 C ATOM 0 H LEU B 169 65.096 62.849 50.264 1.00 0.00 H new ATOM 0 HA LEU B 169 64.743 60.348 49.001 1.00 0.00 H new ATOM 0 HB2 LEU B 169 63.987 61.127 51.285 1.00 0.00 H new ATOM 0 HB3 LEU B 169 62.798 62.158 50.515 1.00 0.00 H new ATOM 0 HG LEU B 169 61.808 60.096 49.446 1.00 0.00 H new ATOM 0 HD11 LEU B 169 62.307 57.905 50.449 1.00 0.00 H new ATOM 0 HD12 LEU B 169 63.722 58.586 49.612 1.00 0.00 H new ATOM 0 HD13 LEU B 169 63.629 58.636 51.388 1.00 0.00 H new ATOM 0 HD21 LEU B 169 60.677 59.391 51.572 1.00 0.00 H new ATOM 0 HD22 LEU B 169 61.958 60.199 52.506 1.00 0.00 H new ATOM 0 HD23 LEU B 169 60.857 61.160 51.491 1.00 0.00 H new ATOM 867 N LEU B 170 62.697 62.611 47.757 1.00 0.00 N ATOM 868 CA LEU B 170 61.981 62.986 46.514 1.00 0.00 C ATOM 869 C LEU B 170 62.921 63.105 45.308 1.00 0.00 C ATOM 870 O LEU B 170 62.718 62.414 44.313 1.00 0.00 O ATOM 871 CB LEU B 170 61.157 64.249 46.706 1.00 0.00 C ATOM 872 CG LEU B 170 59.689 63.866 46.929 1.00 0.00 C ATOM 873 CD1 LEU B 170 59.163 64.454 48.237 1.00 0.00 C ATOM 874 CD2 LEU B 170 58.843 64.338 45.746 1.00 0.00 C ATOM 0 H LEU B 170 62.598 63.289 48.513 1.00 0.00 H new ATOM 0 HA LEU B 170 61.292 62.171 46.292 1.00 0.00 H new ATOM 0 HB2 LEU B 170 61.531 64.815 47.559 1.00 0.00 H new ATOM 0 HB3 LEU B 170 61.248 64.893 45.831 1.00 0.00 H new ATOM 0 HG LEU B 170 59.620 62.781 47.001 1.00 0.00 H new ATOM 0 HD11 LEU B 170 58.120 64.168 48.371 1.00 0.00 H new ATOM 0 HD12 LEU B 170 59.754 64.074 49.070 1.00 0.00 H new ATOM 0 HD13 LEU B 170 59.239 65.541 48.204 1.00 0.00 H new ATOM 0 HD21 LEU B 170 57.801 64.063 45.911 1.00 0.00 H new ATOM 0 HD22 LEU B 170 58.922 65.421 45.652 1.00 0.00 H new ATOM 0 HD23 LEU B 170 59.202 63.867 44.831 1.00 0.00 H new ATOM 880 N LEU B 171 64.045 63.806 45.501 1.00 0.00 N ATOM 881 CA LEU B 171 65.076 64.025 44.468 1.00 0.00 C ATOM 882 C LEU B 171 65.618 62.733 43.824 1.00 0.00 C ATOM 883 O LEU B 171 65.637 62.639 42.606 1.00 0.00 O ATOM 884 CB LEU B 171 66.186 64.906 45.062 1.00 0.00 C ATOM 885 CG LEU B 171 67.313 65.291 44.104 1.00 0.00 C ATOM 886 CD1 LEU B 171 66.798 66.069 42.882 1.00 0.00 C ATOM 887 CD2 LEU B 171 68.339 66.133 44.858 1.00 0.00 C ATOM 0 H LEU B 171 64.271 64.246 46.393 1.00 0.00 H new ATOM 0 HA LEU B 171 64.606 64.542 43.631 1.00 0.00 H new ATOM 0 HB2 LEU B 171 65.732 65.820 45.446 1.00 0.00 H new ATOM 0 HB3 LEU B 171 66.621 64.384 45.914 1.00 0.00 H new ATOM 0 HG LEU B 171 67.769 64.373 43.733 1.00 0.00 H new ATOM 0 HD11 LEU B 171 67.636 66.320 42.231 1.00 0.00 H new ATOM 0 HD12 LEU B 171 66.084 65.454 42.334 1.00 0.00 H new ATOM 0 HD13 LEU B 171 66.309 66.985 43.214 1.00 0.00 H new ATOM 0 HD21 LEU B 171 69.147 66.413 44.182 1.00 0.00 H new ATOM 0 HD22 LEU B 171 67.859 67.033 45.242 1.00 0.00 H new ATOM 0 HD23 LEU B 171 68.744 65.555 45.689 1.00 0.00 H new ATOM 893 N SER B 172 65.932 61.725 44.650 1.00 0.00 N ATOM 894 CA SER B 172 66.420 60.418 44.151 1.00 0.00 C ATOM 895 C SER B 172 65.380 59.709 43.268 1.00 0.00 C ATOM 896 O SER B 172 65.680 59.346 42.135 1.00 0.00 O ATOM 897 CB SER B 172 66.856 59.516 45.309 1.00 0.00 C ATOM 898 OG SER B 172 65.743 58.982 46.034 1.00 0.00 O ATOM 0 H SER B 172 65.859 61.783 45.666 1.00 0.00 H new ATOM 0 HA SER B 172 67.289 60.621 43.526 1.00 0.00 H new ATOM 0 HB2 SER B 172 67.460 58.696 44.920 1.00 0.00 H new ATOM 0 HB3 SER B 172 67.490 60.084 45.989 1.00 0.00 H new ATOM 0 HG SER B 172 65.120 59.705 46.257 1.00 0.00 H new ATOM 904 N HIS B 173 64.142 59.716 43.730 1.00 0.00 N ATOM 905 CA HIS B 173 62.971 59.158 43.014 1.00 0.00 C ATOM 906 C HIS B 173 62.618 59.960 41.747 1.00 0.00 C ATOM 907 O HIS B 173 62.286 59.380 40.720 1.00 0.00 O ATOM 908 CB HIS B 173 61.776 59.049 43.962 1.00 0.00 C ATOM 909 CG HIS B 173 61.992 57.983 45.042 1.00 0.00 C ATOM 910 ND1 HIS B 173 62.735 58.107 46.138 1.00 0.00 N ATOM 911 CD2 HIS B 173 61.464 56.757 45.044 1.00 0.00 C ATOM 912 CE1 HIS B 173 62.677 56.972 46.822 1.00 0.00 C ATOM 913 NE2 HIS B 173 61.887 56.131 46.147 1.00 0.00 N ATOM 0 H HIS B 173 63.900 60.117 44.636 1.00 0.00 H new ATOM 0 HA HIS B 173 63.238 58.157 42.674 1.00 0.00 H new ATOM 0 HB2 HIS B 173 61.601 60.015 44.436 1.00 0.00 H new ATOM 0 HB3 HIS B 173 60.880 58.808 43.389 1.00 0.00 H new ATOM 0 HD1 HIS B 173 63.262 58.937 46.408 1.00 0.00 H new ATOM 0 HD2 HIS B 173 60.811 56.344 44.289 1.00 0.00 H new ATOM 0 HE1 HIS B 173 63.178 56.765 47.756 1.00 0.00 H new ATOM 0 HE2 HIS B 173 61.649 55.179 46.425 1.00 0.00 H new ATOM 918 N LEU B 174 62.766 61.279 41.820 1.00 0.00 N ATOM 919 CA LEU B 174 62.637 62.204 40.676 1.00 0.00 C ATOM 920 C LEU B 174 63.651 61.904 39.568 1.00 0.00 C ATOM 921 O LEU B 174 63.244 61.610 38.442 1.00 0.00 O ATOM 922 CB LEU B 174 62.743 63.662 41.143 1.00 0.00 C ATOM 923 CG LEU B 174 61.416 64.143 41.741 1.00 0.00 C ATOM 924 CD1 LEU B 174 61.659 65.366 42.629 1.00 0.00 C ATOM 925 CD2 LEU B 174 60.426 64.524 40.644 1.00 0.00 C ATOM 0 H LEU B 174 62.985 61.756 42.695 1.00 0.00 H new ATOM 0 HA LEU B 174 61.647 62.049 40.246 1.00 0.00 H new ATOM 0 HB2 LEU B 174 63.535 63.753 41.886 1.00 0.00 H new ATOM 0 HB3 LEU B 174 63.019 64.298 40.302 1.00 0.00 H new ATOM 0 HG LEU B 174 60.998 63.326 42.329 1.00 0.00 H new ATOM 0 HD11 LEU B 174 60.712 65.703 43.051 1.00 0.00 H new ATOM 0 HD12 LEU B 174 62.342 65.100 43.436 1.00 0.00 H new ATOM 0 HD13 LEU B 174 62.096 66.167 42.033 1.00 0.00 H new ATOM 0 HD21 LEU B 174 59.494 64.861 41.097 1.00 0.00 H new ATOM 0 HD22 LEU B 174 60.846 65.326 40.037 1.00 0.00 H new ATOM 0 HD23 LEU B 174 60.230 63.657 40.013 1.00 0.00 H new ATOM 931 N LEU B 175 64.931 61.797 39.932 1.00 0.00 N ATOM 932 CA LEU B 175 65.989 61.330 39.016 1.00 0.00 C ATOM 933 C LEU B 175 65.717 59.917 38.469 1.00 0.00 C ATOM 934 O LEU B 175 65.811 59.703 37.263 1.00 0.00 O ATOM 935 CB LEU B 175 67.365 61.377 39.712 1.00 0.00 C ATOM 936 CG LEU B 175 67.794 62.805 40.091 1.00 0.00 C ATOM 937 CD1 LEU B 175 68.992 62.730 41.032 1.00 0.00 C ATOM 938 CD2 LEU B 175 68.160 63.640 38.864 1.00 0.00 C ATOM 0 H LEU B 175 65.269 62.029 40.866 1.00 0.00 H new ATOM 0 HA LEU B 175 65.991 62.009 38.163 1.00 0.00 H new ATOM 0 HB2 LEU B 175 67.333 60.762 40.611 1.00 0.00 H new ATOM 0 HB3 LEU B 175 68.115 60.940 39.053 1.00 0.00 H new ATOM 0 HG LEU B 175 66.950 63.293 40.580 1.00 0.00 H new ATOM 0 HD11 LEU B 175 69.303 63.738 41.306 1.00 0.00 H new ATOM 0 HD12 LEU B 175 68.715 62.179 41.931 1.00 0.00 H new ATOM 0 HD13 LEU B 175 69.815 62.219 40.533 1.00 0.00 H new ATOM 0 HD21 LEU B 175 68.456 64.640 39.180 1.00 0.00 H new ATOM 0 HD22 LEU B 175 68.987 63.166 38.335 1.00 0.00 H new ATOM 0 HD23 LEU B 175 67.298 63.710 38.201 1.00 0.00 H new ATOM 944 N ALA B 176 65.320 58.987 39.343 1.00 0.00 N ATOM 945 CA ALA B 176 64.949 57.604 38.974 1.00 0.00 C ATOM 946 C ALA B 176 63.788 57.515 37.968 1.00 0.00 C ATOM 947 O ALA B 176 63.886 56.783 36.973 1.00 0.00 O ATOM 948 CB ALA B 176 64.632 56.796 40.232 1.00 0.00 C ATOM 0 H ALA B 176 65.244 59.170 40.344 1.00 0.00 H new ATOM 0 HA ALA B 176 65.814 57.180 38.464 1.00 0.00 H new ATOM 0 HB1 ALA B 176 64.360 55.778 39.952 1.00 0.00 H new ATOM 0 HB2 ALA B 176 65.509 56.772 40.879 1.00 0.00 H new ATOM 0 HB3 ALA B 176 63.801 57.261 40.763 1.00 0.00 H new ATOM 954 N ILE B 177 62.712 58.267 38.203 1.00 0.00 N ATOM 955 CA ILE B 177 61.590 58.353 37.245 1.00 0.00 C ATOM 956 C ILE B 177 61.946 59.135 35.965 1.00 0.00 C ATOM 957 O ILE B 177 61.502 58.758 34.879 1.00 0.00 O ATOM 958 CB ILE B 177 60.306 58.846 37.947 1.00 0.00 C ATOM 959 CG1 ILE B 177 59.080 58.395 37.140 1.00 0.00 C ATOM 960 CG2 ILE B 177 60.275 60.359 38.173 1.00 0.00 C ATOM 961 CD1 ILE B 177 57.921 58.005 38.054 1.00 0.00 C ATOM 0 H ILE B 177 62.586 58.828 39.046 1.00 0.00 H new ATOM 0 HA ILE B 177 61.382 57.345 36.887 1.00 0.00 H new ATOM 0 HB ILE B 177 60.291 58.398 38.940 1.00 0.00 H new ATOM 0 HG12 ILE B 177 58.765 59.199 36.475 1.00 0.00 H new ATOM 0 HG13 ILE B 177 59.349 57.547 36.510 1.00 0.00 H new ATOM 0 HG21 ILE B 177 59.345 60.634 38.670 1.00 0.00 H new ATOM 0 HG22 ILE B 177 61.120 60.651 38.797 1.00 0.00 H new ATOM 0 HG23 ILE B 177 60.339 60.872 37.213 1.00 0.00 H new ATOM 0 HD11 ILE B 177 57.070 57.691 37.449 1.00 0.00 H new ATOM 0 HD12 ILE B 177 58.229 57.184 38.701 1.00 0.00 H new ATOM 0 HD13 ILE B 177 57.635 58.861 38.665 1.00 0.00 H new ATOM 965 N GLY B 178 62.751 60.185 36.120 1.00 0.00 N ATOM 966 CA GLY B 178 63.358 60.938 35.005 1.00 0.00 C ATOM 967 C GLY B 178 64.122 60.003 34.054 1.00 0.00 C ATOM 968 O GLY B 178 63.814 59.938 32.873 1.00 0.00 O ATOM 0 H GLY B 178 63.009 60.549 37.037 1.00 0.00 H new ATOM 0 HA2 GLY B 178 62.580 61.466 34.453 1.00 0.00 H new ATOM 0 HA3 GLY B 178 64.037 61.693 35.400 1.00 0.00 H new ATOM 972 N LEU B 179 64.987 59.177 34.656 1.00 0.00 N ATOM 973 CA LEU B 179 65.674 58.073 33.964 1.00 0.00 C ATOM 974 C LEU B 179 64.696 57.080 33.318 1.00 0.00 C ATOM 975 O LEU B 179 64.896 56.671 32.185 1.00 0.00 O ATOM 976 CB LEU B 179 66.600 57.358 34.963 1.00 0.00 C ATOM 977 CG LEU B 179 67.529 56.347 34.266 1.00 0.00 C ATOM 978 CD1 LEU B 179 68.557 57.044 33.368 1.00 0.00 C ATOM 979 CD2 LEU B 179 68.212 55.466 35.305 1.00 0.00 C ATOM 0 H LEU B 179 65.233 59.254 35.643 1.00 0.00 H new ATOM 0 HA LEU B 179 66.260 58.496 33.148 1.00 0.00 H new ATOM 0 HB2 LEU B 179 67.201 58.097 35.493 1.00 0.00 H new ATOM 0 HB3 LEU B 179 65.998 56.842 35.710 1.00 0.00 H new ATOM 0 HG LEU B 179 66.920 55.717 33.618 1.00 0.00 H new ATOM 0 HD11 LEU B 179 69.193 56.296 32.895 1.00 0.00 H new ATOM 0 HD12 LEU B 179 68.039 57.618 32.600 1.00 0.00 H new ATOM 0 HD13 LEU B 179 69.171 57.714 33.970 1.00 0.00 H new ATOM 0 HD21 LEU B 179 68.867 54.754 34.804 1.00 0.00 H new ATOM 0 HD22 LEU B 179 68.800 56.088 35.979 1.00 0.00 H new ATOM 0 HD23 LEU B 179 67.457 54.925 35.876 1.00 0.00 H new ATOM 985 N GLY B 180 63.630 56.733 34.039 1.00 0.00 N ATOM 986 CA GLY B 180 62.493 55.952 33.512 1.00 0.00 C ATOM 987 C GLY B 180 61.919 56.543 32.214 1.00 0.00 C ATOM 988 O GLY B 180 61.897 55.860 31.189 1.00 0.00 O ATOM 0 H GLY B 180 63.523 56.987 35.021 1.00 0.00 H new ATOM 0 HA2 GLY B 180 62.815 54.927 33.328 1.00 0.00 H new ATOM 0 HA3 GLY B 180 61.707 55.909 34.266 1.00 0.00 H new ATOM 992 N ILE B 181 61.502 57.813 32.249 1.00 0.00 N ATOM 993 CA ILE B 181 60.982 58.543 31.065 1.00 0.00 C ATOM 994 C ILE B 181 62.067 58.613 29.975 1.00 0.00 C ATOM 995 O ILE B 181 61.751 58.448 28.797 1.00 0.00 O ATOM 996 CB ILE B 181 60.498 59.965 31.418 1.00 0.00 C ATOM 997 CG1 ILE B 181 59.562 59.965 32.635 1.00 0.00 C ATOM 998 CG2 ILE B 181 59.746 60.581 30.236 1.00 0.00 C ATOM 999 CD1 ILE B 181 59.736 61.231 33.481 1.00 0.00 C ATOM 0 H ILE B 181 61.512 58.376 33.100 1.00 0.00 H new ATOM 0 HA ILE B 181 60.119 57.990 30.695 1.00 0.00 H new ATOM 0 HB ILE B 181 61.387 60.551 31.653 1.00 0.00 H new ATOM 0 HG12 ILE B 181 58.528 59.891 32.299 1.00 0.00 H new ATOM 0 HG13 ILE B 181 59.762 59.086 33.248 1.00 0.00 H new ATOM 0 HG21 ILE B 181 59.411 61.584 30.501 1.00 0.00 H new ATOM 0 HG22 ILE B 181 60.408 60.636 29.372 1.00 0.00 H new ATOM 0 HG23 ILE B 181 58.882 59.963 29.992 1.00 0.00 H new ATOM 0 HD11 ILE B 181 59.057 61.195 34.333 1.00 0.00 H new ATOM 0 HD12 ILE B 181 60.764 61.291 33.838 1.00 0.00 H new ATOM 0 HD13 ILE B 181 59.511 62.108 32.874 1.00 0.00 H new ATOM 1003 N TYR B 182 63.307 58.857 30.379 1.00 0.00 N ATOM 1004 CA TYR B 182 64.488 58.838 29.495 1.00 0.00 C ATOM 1005 C TYR B 182 64.558 57.533 28.693 1.00 0.00 C ATOM 1006 O TYR B 182 64.189 57.550 27.522 1.00 0.00 O ATOM 1007 CB TYR B 182 65.769 59.144 30.287 1.00 0.00 C ATOM 1008 CG TYR B 182 67.030 59.257 29.407 1.00 0.00 C ATOM 1009 CD1 TYR B 182 67.232 60.431 28.662 1.00 0.00 C ATOM 1010 CD2 TYR B 182 67.870 58.137 29.288 1.00 0.00 C ATOM 1011 CE1 TYR B 182 68.310 60.471 27.725 1.00 0.00 C ATOM 1012 CE2 TYR B 182 68.934 58.177 28.354 1.00 0.00 C ATOM 1013 CZ TYR B 182 69.118 59.338 27.591 1.00 0.00 C ATOM 1014 OH TYR B 182 70.059 59.279 26.605 1.00 0.00 O ATOM 0 H TYR B 182 63.535 59.079 31.348 1.00 0.00 H new ATOM 0 HA TYR B 182 64.390 59.635 28.758 1.00 0.00 H new ATOM 0 HB2 TYR B 182 65.633 60.077 30.834 1.00 0.00 H new ATOM 0 HB3 TYR B 182 65.923 58.360 31.028 1.00 0.00 H new ATOM 0 HD1 TYR B 182 66.586 61.286 28.795 1.00 0.00 H new ATOM 0 HD2 TYR B 182 67.707 57.261 29.898 1.00 0.00 H new ATOM 0 HE1 TYR B 182 68.496 61.356 27.134 1.00 0.00 H new ATOM 0 HE2 TYR B 182 69.591 57.329 28.232 1.00 0.00 H new ATOM 0 HH TYR B 182 70.532 58.422 26.655 1.00 0.00 H new ATOM 1019 N ILE B 183 64.678 56.402 29.398 1.00 0.00 N ATOM 1020 CA ILE B 183 64.702 55.063 28.767 1.00 0.00 C ATOM 1021 C ILE B 183 63.392 54.798 27.986 1.00 0.00 C ATOM 1022 O ILE B 183 63.460 54.373 26.839 1.00 0.00 O ATOM 1023 CB ILE B 183 65.027 53.932 29.765 1.00 0.00 C ATOM 1024 CG1 ILE B 183 66.298 54.249 30.580 1.00 0.00 C ATOM 1025 CG2 ILE B 183 65.264 52.628 28.995 1.00 0.00 C ATOM 1026 CD1 ILE B 183 66.452 53.399 31.850 1.00 0.00 C ATOM 0 H ILE B 183 64.761 56.381 30.414 1.00 0.00 H new ATOM 0 HA ILE B 183 65.523 55.063 28.051 1.00 0.00 H new ATOM 0 HB ILE B 183 64.183 53.836 30.448 1.00 0.00 H new ATOM 0 HG12 ILE B 183 67.171 54.098 29.946 1.00 0.00 H new ATOM 0 HG13 ILE B 183 66.285 55.303 30.859 1.00 0.00 H new ATOM 0 HG21 ILE B 183 65.494 51.827 29.698 1.00 0.00 H new ATOM 0 HG22 ILE B 183 64.367 52.370 28.432 1.00 0.00 H new ATOM 0 HG23 ILE B 183 66.100 52.758 28.307 1.00 0.00 H new ATOM 0 HD11 ILE B 183 67.369 53.681 32.368 1.00 0.00 H new ATOM 0 HD12 ILE B 183 65.598 53.568 32.506 1.00 0.00 H new ATOM 0 HD13 ILE B 183 66.498 52.344 31.579 1.00 0.00 H new