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 172 SER OG : rot 125:sc= 1.37 USER MOD Set 1.2: A 173 HIS : no HE2:sc= 0.622 K(o=2.8,f=-0.66!) USER MOD Set 1.3: B 173 HIS : no HE2:sc= 0.828 K(o=2.8,f=-6.7!) 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 34:sc= 0.422 USER MOD Single : B 172 SER OG : rot 74:sc= 1.07 USER MOD Single : B 182 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 260 N LEU A 166 66.456 50.689 53.514 1.00 0.00 N ATOM 261 CA LEU A 166 67.031 50.268 52.213 1.00 0.00 C ATOM 262 C LEU A 166 66.180 49.313 51.359 1.00 0.00 C ATOM 263 O LEU A 166 65.958 49.685 50.200 1.00 0.00 O ATOM 264 CB LEU A 166 68.505 49.840 52.333 1.00 0.00 C ATOM 265 CG LEU A 166 69.404 51.088 52.308 1.00 0.00 C ATOM 266 CD1 LEU A 166 70.796 50.738 52.849 1.00 0.00 C ATOM 267 CD2 LEU A 166 69.520 51.654 50.890 1.00 0.00 C ATOM 0 HA LEU A 166 67.007 51.182 51.619 1.00 0.00 H new ATOM 0 HB2 LEU A 166 68.660 49.285 53.259 1.00 0.00 H new ATOM 0 HB3 LEU A 166 68.769 49.172 51.513 1.00 0.00 H new ATOM 0 HG LEU A 166 68.950 51.850 52.942 1.00 0.00 H new ATOM 0 HD11 LEU A 166 71.428 51.626 52.829 1.00 0.00 H new ATOM 0 HD12 LEU A 166 70.708 50.378 53.874 1.00 0.00 H new ATOM 0 HD13 LEU A 166 71.242 49.961 52.229 1.00 0.00 H new ATOM 0 HD21 LEU A 166 70.161 52.536 50.901 1.00 0.00 H new ATOM 0 HD22 LEU A 166 69.951 50.900 50.231 1.00 0.00 H new ATOM 0 HD23 LEU A 166 68.530 51.930 50.526 1.00 0.00 H new ATOM 273 N PRO A 167 65.559 48.236 51.885 1.00 0.00 N ATOM 274 CA PRO A 167 64.587 47.430 51.112 1.00 0.00 C ATOM 275 C PRO A 167 63.410 48.272 50.583 1.00 0.00 C ATOM 276 O PRO A 167 63.280 48.414 49.373 1.00 0.00 O ATOM 277 CB PRO A 167 64.145 46.323 52.058 1.00 0.00 C ATOM 278 CG PRO A 167 65.396 46.111 52.898 1.00 0.00 C ATOM 279 CD PRO A 167 65.904 47.535 53.133 1.00 0.00 C ATOM 0 HA PRO A 167 65.036 47.019 50.208 1.00 0.00 H new ATOM 0 HB2 PRO A 167 63.291 46.622 52.666 1.00 0.00 H new ATOM 0 HB3 PRO A 167 63.855 45.419 51.522 1.00 0.00 H new ATOM 0 HG2 PRO A 167 65.170 45.604 53.836 1.00 0.00 H new ATOM 0 HG3 PRO A 167 66.133 45.501 52.376 1.00 0.00 H new ATOM 0 HD2 PRO A 167 65.424 47.995 53.997 1.00 0.00 H new ATOM 0 HD3 PRO A 167 66.978 47.552 53.319 1.00 0.00 H new ATOM 285 N SER A 168 62.693 48.932 51.495 1.00 0.00 N ATOM 286 CA SER A 168 61.615 49.904 51.157 1.00 0.00 C ATOM 287 C SER A 168 61.998 50.901 50.040 1.00 0.00 C ATOM 288 O SER A 168 61.267 51.068 49.070 1.00 0.00 O ATOM 289 CB SER A 168 61.187 50.697 52.399 1.00 0.00 C ATOM 290 OG SER A 168 60.633 49.839 53.405 1.00 0.00 O ATOM 0 H SER A 168 62.834 48.816 52.499 1.00 0.00 H new ATOM 0 HA SER A 168 60.790 49.297 50.784 1.00 0.00 H new ATOM 0 HB2 SER A 168 62.047 51.229 52.806 1.00 0.00 H new ATOM 0 HB3 SER A 168 60.451 51.450 52.116 1.00 0.00 H new ATOM 0 HG SER A 168 60.372 50.374 54.184 1.00 0.00 H new ATOM 296 N LEU A 169 63.203 51.461 50.163 1.00 0.00 N ATOM 297 CA LEU A 169 63.826 52.380 49.187 1.00 0.00 C ATOM 298 C LEU A 169 64.082 51.766 47.805 1.00 0.00 C ATOM 299 O LEU A 169 63.728 52.367 46.787 1.00 0.00 O ATOM 300 CB LEU A 169 65.151 52.889 49.750 1.00 0.00 C ATOM 301 CG LEU A 169 64.960 53.995 50.783 1.00 0.00 C ATOM 302 CD1 LEU A 169 66.277 54.234 51.525 1.00 0.00 C ATOM 303 CD2 LEU A 169 64.530 55.293 50.097 1.00 0.00 C ATOM 0 H LEU A 169 63.800 51.286 50.971 1.00 0.00 H new ATOM 0 HA LEU A 169 63.108 53.186 49.037 1.00 0.00 H new ATOM 0 HB2 LEU A 169 65.691 52.059 50.206 1.00 0.00 H new ATOM 0 HB3 LEU A 169 65.770 53.262 48.934 1.00 0.00 H new ATOM 0 HG LEU A 169 64.186 53.688 51.487 1.00 0.00 H new ATOM 0 HD11 LEU A 169 66.141 55.024 52.263 1.00 0.00 H new ATOM 0 HD12 LEU A 169 66.583 53.317 52.028 1.00 0.00 H new ATOM 0 HD13 LEU A 169 67.047 54.532 50.813 1.00 0.00 H new ATOM 0 HD21 LEU A 169 64.397 56.074 50.846 1.00 0.00 H new ATOM 0 HD22 LEU A 169 65.296 55.600 49.385 1.00 0.00 H new ATOM 0 HD23 LEU A 169 63.589 55.132 49.570 1.00 0.00 H new ATOM 309 N LEU A 170 64.792 50.633 47.782 1.00 0.00 N ATOM 310 CA LEU A 170 65.060 49.869 46.560 1.00 0.00 C ATOM 311 C LEU A 170 63.764 49.530 45.788 1.00 0.00 C ATOM 312 O LEU A 170 63.642 49.913 44.629 1.00 0.00 O ATOM 313 CB LEU A 170 65.871 48.605 46.897 1.00 0.00 C ATOM 314 CG LEU A 170 67.307 48.986 47.269 1.00 0.00 C ATOM 315 CD1 LEU A 170 67.865 47.968 48.267 1.00 0.00 C ATOM 316 CD2 LEU A 170 68.208 49.018 46.030 1.00 0.00 C ATOM 0 H LEU A 170 65.200 50.217 48.619 1.00 0.00 H new ATOM 0 HA LEU A 170 65.655 50.494 45.894 1.00 0.00 H new ATOM 0 HB2 LEU A 170 65.402 48.072 47.724 1.00 0.00 H new ATOM 0 HB3 LEU A 170 65.876 47.928 46.043 1.00 0.00 H new ATOM 0 HG LEU A 170 67.290 49.981 47.714 1.00 0.00 H new ATOM 0 HD11 LEU A 170 68.887 48.240 48.531 1.00 0.00 H new ATOM 0 HD12 LEU A 170 67.247 47.963 49.165 1.00 0.00 H new ATOM 0 HD13 LEU A 170 67.859 46.976 47.816 1.00 0.00 H new ATOM 0 HD21 LEU A 170 69.221 49.291 46.324 1.00 0.00 H new ATOM 0 HD22 LEU A 170 68.219 48.033 45.563 1.00 0.00 H new ATOM 0 HD23 LEU A 170 67.826 49.752 45.321 1.00 0.00 H new ATOM 322 N LEU A 171 62.757 49.109 46.545 1.00 0.00 N ATOM 323 CA LEU A 171 61.379 48.889 46.053 1.00 0.00 C ATOM 324 C LEU A 171 60.799 50.106 45.326 1.00 0.00 C ATOM 325 O LEU A 171 60.721 50.099 44.096 1.00 0.00 O ATOM 326 CB LEU A 171 60.451 48.477 47.201 1.00 0.00 C ATOM 327 CG LEU A 171 60.733 47.048 47.676 1.00 0.00 C ATOM 328 CD1 LEU A 171 60.333 46.930 49.136 1.00 0.00 C ATOM 329 CD2 LEU A 171 59.923 46.043 46.852 1.00 0.00 C ATOM 0 H LEU A 171 62.865 48.904 47.538 1.00 0.00 H new ATOM 0 HA LEU A 171 61.442 48.080 45.325 1.00 0.00 H new ATOM 0 HB2 LEU A 171 60.575 49.168 48.035 1.00 0.00 H new ATOM 0 HB3 LEU A 171 59.414 48.554 46.875 1.00 0.00 H new ATOM 0 HG LEU A 171 61.794 46.832 47.553 1.00 0.00 H new ATOM 0 HD11 LEU A 171 60.529 45.917 49.486 1.00 0.00 H new ATOM 0 HD12 LEU A 171 60.912 47.637 49.730 1.00 0.00 H new ATOM 0 HD13 LEU A 171 59.271 47.151 49.241 1.00 0.00 H new ATOM 0 HD21 LEU A 171 60.134 45.032 47.201 1.00 0.00 H new ATOM 0 HD22 LEU A 171 58.859 46.252 46.967 1.00 0.00 H new ATOM 0 HD23 LEU A 171 60.198 46.129 45.801 1.00 0.00 H new ATOM 335 N SER A 172 60.649 51.212 46.060 1.00 0.00 N ATOM 336 CA SER A 172 60.009 52.449 45.543 1.00 0.00 C ATOM 337 C SER A 172 60.735 53.019 44.306 1.00 0.00 C ATOM 338 O SER A 172 60.094 53.297 43.296 1.00 0.00 O ATOM 339 CB SER A 172 59.879 53.494 46.646 1.00 0.00 C ATOM 340 OG SER A 172 61.092 54.234 46.840 1.00 0.00 O ATOM 0 H SER A 172 60.963 51.287 47.028 1.00 0.00 H new ATOM 0 HA SER A 172 59.007 52.176 45.212 1.00 0.00 H new ATOM 0 HB2 SER A 172 59.072 54.183 46.398 1.00 0.00 H new ATOM 0 HB3 SER A 172 59.603 53.002 47.579 1.00 0.00 H new ATOM 0 HG SER A 172 60.906 55.193 46.762 1.00 0.00 H new ATOM 346 N HIS A 173 62.065 53.040 44.357 1.00 0.00 N ATOM 347 CA HIS A 173 62.922 53.501 43.249 1.00 0.00 C ATOM 348 C HIS A 173 62.861 52.615 41.997 1.00 0.00 C ATOM 349 O HIS A 173 62.628 53.126 40.908 1.00 0.00 O ATOM 350 CB HIS A 173 64.360 53.732 43.732 1.00 0.00 C ATOM 351 CG HIS A 173 64.438 54.990 44.606 1.00 0.00 C ATOM 352 ND1 HIS A 173 64.016 55.082 45.866 1.00 0.00 N ATOM 353 CD2 HIS A 173 64.768 56.204 44.200 1.00 0.00 C ATOM 354 CE1 HIS A 173 64.064 56.362 46.230 1.00 0.00 C ATOM 355 NE2 HIS A 173 64.529 57.059 45.193 1.00 0.00 N ATOM 0 H HIS A 173 62.592 52.735 45.176 1.00 0.00 H new ATOM 0 HA HIS A 173 62.513 54.458 42.925 1.00 0.00 H new ATOM 0 HB2 HIS A 173 64.703 52.866 44.299 1.00 0.00 H new ATOM 0 HB3 HIS A 173 65.025 53.836 42.875 1.00 0.00 H new ATOM 0 HD1 HIS A 173 63.709 54.305 46.452 1.00 0.00 H new ATOM 0 HD2 HIS A 173 65.164 56.459 43.228 1.00 0.00 H new ATOM 0 HE1 HIS A 173 63.778 56.763 47.191 1.00 0.00 H new ATOM 360 N LEU A 174 62.962 51.295 42.182 1.00 0.00 N ATOM 361 CA LEU A 174 62.732 50.326 41.079 1.00 0.00 C ATOM 362 C LEU A 174 61.351 50.477 40.418 1.00 0.00 C ATOM 363 O LEU A 174 61.252 50.560 39.198 1.00 0.00 O ATOM 364 CB LEU A 174 62.934 48.867 41.505 1.00 0.00 C ATOM 365 CG LEU A 174 64.349 48.350 41.184 1.00 0.00 C ATOM 366 CD1 LEU A 174 64.471 46.889 41.620 1.00 0.00 C ATOM 367 CD2 LEU A 174 64.670 48.417 39.685 1.00 0.00 C ATOM 0 H LEU A 174 63.200 50.864 43.075 1.00 0.00 H new ATOM 0 HA LEU A 174 63.495 50.577 40.342 1.00 0.00 H new ATOM 0 HB2 LEU A 174 62.751 48.776 42.576 1.00 0.00 H new ATOM 0 HB3 LEU A 174 62.198 48.240 41.002 1.00 0.00 H new ATOM 0 HG LEU A 174 65.049 48.990 41.721 1.00 0.00 H new ATOM 0 HD11 LEU A 174 65.473 46.524 41.393 1.00 0.00 H new ATOM 0 HD12 LEU A 174 64.292 46.813 42.693 1.00 0.00 H new ATOM 0 HD13 LEU A 174 63.735 46.287 41.086 1.00 0.00 H new ATOM 0 HD21 LEU A 174 65.678 48.041 39.512 1.00 0.00 H new ATOM 0 HD22 LEU A 174 63.956 47.807 39.132 1.00 0.00 H new ATOM 0 HD23 LEU A 174 64.604 49.450 39.345 1.00 0.00 H new ATOM 373 N LEU A 175 60.319 50.605 41.247 1.00 0.00 N ATOM 374 CA LEU A 175 58.947 50.855 40.787 1.00 0.00 C ATOM 375 C LEU A 175 58.817 52.186 40.001 1.00 0.00 C ATOM 376 O LEU A 175 58.278 52.195 38.901 1.00 0.00 O ATOM 377 CB LEU A 175 57.957 50.802 41.956 1.00 0.00 C ATOM 378 CG LEU A 175 57.918 49.420 42.631 1.00 0.00 C ATOM 379 CD1 LEU A 175 57.096 49.498 43.921 1.00 0.00 C ATOM 380 CD2 LEU A 175 57.328 48.347 41.717 1.00 0.00 C ATOM 0 H LEU A 175 60.406 50.539 42.261 1.00 0.00 H new ATOM 0 HA LEU A 175 58.696 50.055 40.090 1.00 0.00 H new ATOM 0 HB2 LEU A 175 58.230 51.556 42.694 1.00 0.00 H new ATOM 0 HB3 LEU A 175 56.960 51.055 41.596 1.00 0.00 H new ATOM 0 HG LEU A 175 58.947 49.137 42.854 1.00 0.00 H new ATOM 0 HD11 LEU A 175 57.071 48.517 44.396 1.00 0.00 H new ATOM 0 HD12 LEU A 175 57.552 50.219 44.600 1.00 0.00 H new ATOM 0 HD13 LEU A 175 56.079 49.814 43.686 1.00 0.00 H new ATOM 0 HD21 LEU A 175 57.321 47.389 42.237 1.00 0.00 H new ATOM 0 HD22 LEU A 175 56.308 48.620 41.447 1.00 0.00 H new ATOM 0 HD23 LEU A 175 57.933 48.265 40.814 1.00 0.00 H new ATOM 386 N ALA A 176 59.427 53.250 40.545 1.00 0.00 N ATOM 387 CA ALA A 176 59.516 54.572 39.899 1.00 0.00 C ATOM 388 C ALA A 176 60.158 54.543 38.500 1.00 0.00 C ATOM 389 O ALA A 176 59.614 55.141 37.571 1.00 0.00 O ATOM 390 CB ALA A 176 60.257 55.546 40.823 1.00 0.00 C ATOM 0 H ALA A 176 59.879 53.218 41.459 1.00 0.00 H new ATOM 0 HA ALA A 176 58.493 54.914 39.738 1.00 0.00 H new ATOM 0 HB1 ALA A 176 60.322 56.523 40.344 1.00 0.00 H new ATOM 0 HB2 ALA A 176 59.715 55.638 41.764 1.00 0.00 H new ATOM 0 HB3 ALA A 176 61.261 55.170 41.018 1.00 0.00 H new ATOM 396 N ILE A 177 61.284 53.843 38.369 1.00 0.00 N ATOM 397 CA ILE A 177 61.918 53.532 37.058 1.00 0.00 C ATOM 398 C ILE A 177 60.884 52.997 36.046 1.00 0.00 C ATOM 399 O ILE A 177 60.650 53.628 35.018 1.00 0.00 O ATOM 400 CB ILE A 177 63.126 52.592 37.297 1.00 0.00 C ATOM 401 CG1 ILE A 177 64.259 53.410 37.920 1.00 0.00 C ATOM 402 CG2 ILE A 177 63.644 51.880 36.035 1.00 0.00 C ATOM 403 CD1 ILE A 177 65.124 52.614 38.899 1.00 0.00 C ATOM 0 H ILE A 177 61.797 53.466 39.166 1.00 0.00 H new ATOM 0 HA ILE A 177 62.304 54.441 36.596 1.00 0.00 H new ATOM 0 HB ILE A 177 62.779 51.799 37.960 1.00 0.00 H new ATOM 0 HG12 ILE A 177 64.893 53.802 37.124 1.00 0.00 H new ATOM 0 HG13 ILE A 177 63.833 54.268 38.440 1.00 0.00 H new ATOM 0 HG21 ILE A 177 64.489 51.244 36.297 1.00 0.00 H new ATOM 0 HG22 ILE A 177 62.848 51.269 35.609 1.00 0.00 H new ATOM 0 HG23 ILE A 177 63.962 52.622 35.303 1.00 0.00 H new ATOM 0 HD11 ILE A 177 65.906 53.258 39.301 1.00 0.00 H new ATOM 0 HD12 ILE A 177 64.503 52.244 39.715 1.00 0.00 H new ATOM 0 HD13 ILE A 177 65.580 51.771 38.379 1.00 0.00 H new ATOM 407 N GLY A 178 60.173 51.939 36.462 1.00 0.00 N ATOM 408 CA GLY A 178 59.089 51.302 35.688 1.00 0.00 C ATOM 409 C GLY A 178 58.021 52.305 35.201 1.00 0.00 C ATOM 410 O GLY A 178 57.801 52.457 33.991 1.00 0.00 O ATOM 0 H GLY A 178 60.336 51.491 37.364 1.00 0.00 H new ATOM 0 HA2 GLY A 178 59.518 50.791 34.826 1.00 0.00 H new ATOM 0 HA3 GLY A 178 58.610 50.541 36.304 1.00 0.00 H new ATOM 414 N LEU A 179 57.433 53.026 36.152 1.00 0.00 N ATOM 415 CA LEU A 179 56.474 54.119 35.895 1.00 0.00 C ATOM 416 C LEU A 179 57.036 55.147 34.889 1.00 0.00 C ATOM 417 O LEU A 179 56.405 55.405 33.859 1.00 0.00 O ATOM 418 CB LEU A 179 56.087 54.852 37.187 1.00 0.00 C ATOM 419 CG LEU A 179 55.523 53.923 38.273 1.00 0.00 C ATOM 420 CD1 LEU A 179 55.415 54.708 39.586 1.00 0.00 C ATOM 421 CD2 LEU A 179 54.159 53.343 37.910 1.00 0.00 C ATOM 0 H LEU A 179 57.607 52.871 37.145 1.00 0.00 H new ATOM 0 HA LEU A 179 55.587 53.649 35.470 1.00 0.00 H new ATOM 0 HB2 LEU A 179 56.964 55.367 37.580 1.00 0.00 H new ATOM 0 HB3 LEU A 179 55.346 55.617 36.954 1.00 0.00 H new ATOM 0 HG LEU A 179 56.207 53.080 38.374 1.00 0.00 H new ATOM 0 HD11 LEU A 179 55.016 54.060 40.366 1.00 0.00 H new ATOM 0 HD12 LEU A 179 56.403 55.063 39.880 1.00 0.00 H new ATOM 0 HD13 LEU A 179 54.750 55.560 39.447 1.00 0.00 H new ATOM 0 HD21 LEU A 179 53.813 52.695 38.716 1.00 0.00 H new ATOM 0 HD22 LEU A 179 53.446 54.154 37.765 1.00 0.00 H new ATOM 0 HD23 LEU A 179 54.243 52.765 36.990 1.00 0.00 H new ATOM 427 N GLY A 180 58.272 55.587 35.131 1.00 0.00 N ATOM 428 CA GLY A 180 59.025 56.526 34.275 1.00 0.00 C ATOM 429 C GLY A 180 59.061 56.081 32.804 1.00 0.00 C ATOM 430 O GLY A 180 58.595 56.810 31.916 1.00 0.00 O ATOM 0 H GLY A 180 58.800 55.294 35.953 1.00 0.00 H new ATOM 0 HA2 GLY A 180 58.573 57.516 34.341 1.00 0.00 H new ATOM 0 HA3 GLY A 180 60.045 56.616 34.649 1.00 0.00 H new ATOM 434 N ILE A 181 59.452 54.825 32.600 1.00 0.00 N ATOM 435 CA ILE A 181 59.459 54.140 31.288 1.00 0.00 C ATOM 436 C ILE A 181 58.059 54.210 30.637 1.00 0.00 C ATOM 437 O ILE A 181 57.915 54.782 29.558 1.00 0.00 O ATOM 438 CB ILE A 181 59.911 52.673 31.424 1.00 0.00 C ATOM 439 CG1 ILE A 181 61.292 52.573 32.085 1.00 0.00 C ATOM 440 CG2 ILE A 181 59.979 51.988 30.042 1.00 0.00 C ATOM 441 CD1 ILE A 181 61.502 51.242 32.821 1.00 0.00 C ATOM 0 H ILE A 181 59.784 54.229 33.358 1.00 0.00 H new ATOM 0 HA ILE A 181 60.174 54.654 30.646 1.00 0.00 H new ATOM 0 HB ILE A 181 59.173 52.171 32.050 1.00 0.00 H new ATOM 0 HG12 ILE A 181 62.064 52.688 31.324 1.00 0.00 H new ATOM 0 HG13 ILE A 181 61.414 53.396 32.789 1.00 0.00 H new ATOM 0 HG21 ILE A 181 60.300 50.954 30.164 1.00 0.00 H new ATOM 0 HG22 ILE A 181 58.994 52.009 29.576 1.00 0.00 H new ATOM 0 HG23 ILE A 181 60.691 52.517 29.408 1.00 0.00 H new ATOM 0 HD11 ILE A 181 62.496 51.227 33.269 1.00 0.00 H new ATOM 0 HD12 ILE A 181 60.750 51.136 33.603 1.00 0.00 H new ATOM 0 HD13 ILE A 181 61.410 50.417 32.114 1.00 0.00 H new ATOM 445 N TYR A 182 57.062 53.739 31.394 1.00 0.00 N ATOM 446 CA TYR A 182 55.653 53.688 30.973 1.00 0.00 C ATOM 447 C TYR A 182 55.172 55.065 30.487 1.00 0.00 C ATOM 448 O TYR A 182 54.852 55.196 29.297 1.00 0.00 O ATOM 449 CB TYR A 182 54.807 53.137 32.140 1.00 0.00 C ATOM 450 CG TYR A 182 53.421 52.716 31.767 1.00 0.00 C ATOM 451 CD1 TYR A 182 52.382 53.688 31.549 1.00 0.00 C ATOM 452 CD2 TYR A 182 53.093 51.324 31.562 1.00 0.00 C ATOM 453 CE1 TYR A 182 51.146 53.318 31.137 1.00 0.00 C ATOM 454 CE2 TYR A 182 51.856 50.954 31.140 1.00 0.00 C ATOM 455 CZ TYR A 182 50.838 51.926 30.892 1.00 0.00 C ATOM 456 OH TYR A 182 49.702 51.588 30.320 1.00 0.00 O ATOM 0 H TYR A 182 57.212 53.375 32.335 1.00 0.00 H new ATOM 0 HA TYR A 182 55.540 53.016 30.122 1.00 0.00 H new ATOM 0 HB2 TYR A 182 55.326 52.283 32.575 1.00 0.00 H new ATOM 0 HB3 TYR A 182 54.743 53.900 32.916 1.00 0.00 H new ATOM 0 HD1 TYR A 182 52.592 54.734 31.717 1.00 0.00 H new ATOM 0 HD2 TYR A 182 53.841 50.567 31.747 1.00 0.00 H new ATOM 0 HE1 TYR A 182 50.384 54.069 30.990 1.00 0.00 H new ATOM 0 HE2 TYR A 182 51.638 49.907 30.989 1.00 0.00 H new ATOM 0 HH TYR A 182 49.658 50.613 30.230 1.00 0.00 H new ATOM 461 N ILE A 183 55.382 56.104 31.300 1.00 0.00 N ATOM 462 CA ILE A 183 55.050 57.513 30.964 1.00 0.00 C ATOM 463 C ILE A 183 55.768 57.923 29.656 1.00 0.00 C ATOM 464 O ILE A 183 55.098 58.041 28.636 1.00 0.00 O ATOM 465 CB ILE A 183 55.390 58.512 32.098 1.00 0.00 C ATOM 466 CG1 ILE A 183 54.853 58.053 33.456 1.00 0.00 C ATOM 467 CG2 ILE A 183 54.769 59.878 31.772 1.00 0.00 C ATOM 468 CD1 ILE A 183 55.586 58.706 34.639 1.00 0.00 C ATOM 0 H ILE A 183 55.794 56.000 32.228 1.00 0.00 H new ATOM 0 HA ILE A 183 53.969 57.559 30.829 1.00 0.00 H new ATOM 0 HB ILE A 183 56.476 58.573 32.162 1.00 0.00 H new ATOM 0 HG12 ILE A 183 53.790 58.287 33.519 1.00 0.00 H new ATOM 0 HG13 ILE A 183 54.946 56.970 33.531 1.00 0.00 H new ATOM 0 HG21 ILE A 183 55.006 60.584 32.568 1.00 0.00 H new ATOM 0 HG22 ILE A 183 55.173 60.245 30.828 1.00 0.00 H new ATOM 0 HG23 ILE A 183 53.687 59.775 31.688 1.00 0.00 H new ATOM 0 HD11 ILE A 183 55.162 58.343 35.575 1.00 0.00 H new ATOM 0 HD12 ILE A 183 56.645 58.451 34.597 1.00 0.00 H new ATOM 0 HD13 ILE A 183 55.472 59.789 34.585 1.00 0.00 H new ATOM 472 N GLY A 184 57.098 57.915 29.688 1.00 0.00 N ATOM 473 CA GLY A 184 57.976 58.236 28.530 1.00 0.00 C ATOM 474 C GLY A 184 57.503 57.596 27.207 1.00 0.00 C ATOM 475 O GLY A 184 57.108 58.306 26.279 1.00 0.00 O ATOM 0 H GLY A 184 57.622 57.682 30.531 1.00 0.00 H new ATOM 0 HA2 GLY A 184 58.021 59.318 28.406 1.00 0.00 H new ATOM 0 HA3 GLY A 184 58.989 57.898 28.747 1.00 0.00 H new ATOM 479 N ARG A 185 57.375 56.275 27.233 1.00 0.00 N ATOM 480 CA ARG A 185 56.943 55.455 26.080 1.00 0.00 C ATOM 481 C ARG A 185 55.510 55.794 25.609 1.00 0.00 C ATOM 482 O ARG A 185 55.318 56.236 24.480 1.00 0.00 O ATOM 483 CB ARG A 185 57.085 53.975 26.455 1.00 0.00 C ATOM 484 CG ARG A 185 57.015 53.038 25.242 1.00 0.00 C ATOM 485 CD ARG A 185 57.227 51.578 25.627 1.00 0.00 C ATOM 486 NE ARG A 185 57.195 50.752 24.415 1.00 0.00 N ATOM 487 CZ ARG A 185 58.064 49.801 24.063 1.00 0.00 C ATOM 488 NH1 ARG A 185 58.799 49.124 24.941 1.00 0.00 N ATOM 489 NH2 ARG A 185 57.979 49.314 22.831 1.00 0.00 N ATOM 0 H ARG A 185 57.570 55.721 28.067 1.00 0.00 H new ATOM 0 HA ARG A 185 57.585 55.682 25.229 1.00 0.00 H new ATOM 0 HB2 ARG A 185 58.035 53.826 26.968 1.00 0.00 H new ATOM 0 HB3 ARG A 185 56.297 53.707 27.159 1.00 0.00 H new ATOM 0 HG2 ARG A 185 56.045 53.147 24.757 1.00 0.00 H new ATOM 0 HG3 ARG A 185 57.770 53.333 24.514 1.00 0.00 H new ATOM 0 HD2 ARG A 185 58.182 51.459 26.138 1.00 0.00 H new ATOM 0 HD3 ARG A 185 56.451 51.256 26.322 1.00 0.00 H new ATOM 0 HE ARG A 185 56.424 50.923 23.770 1.00 0.00 H new ATOM 0 HH11 ARG A 185 58.713 49.322 25.938 1.00 0.00 H new ATOM 0 HH12 ARG A 185 59.448 48.407 24.617 1.00 0.00 H new ATOM 0 HH21 ARG A 185 57.268 49.667 22.191 1.00 0.00 H new ATOM 0 HH22 ARG A 185 58.625 48.587 22.524 1.00 0.00 H new ATOM 802 N PHE B 165 66.441 63.906 54.437 1.00 0.00 N ATOM 803 CA PHE B 165 66.151 62.837 53.463 1.00 0.00 C ATOM 804 C PHE B 165 65.028 63.250 52.493 1.00 0.00 C ATOM 805 O PHE B 165 65.269 63.286 51.293 1.00 0.00 O ATOM 806 CB PHE B 165 65.711 61.600 54.258 1.00 0.00 C ATOM 807 CG PHE B 165 66.263 60.297 53.705 1.00 0.00 C ATOM 808 CD1 PHE B 165 65.530 59.563 52.742 1.00 0.00 C ATOM 809 CD2 PHE B 165 67.397 59.724 54.334 1.00 0.00 C ATOM 810 CE1 PHE B 165 65.902 58.238 52.438 1.00 0.00 C ATOM 811 CE2 PHE B 165 67.779 58.409 54.030 1.00 0.00 C ATOM 812 CZ PHE B 165 67.016 57.665 53.087 1.00 0.00 C ATOM 0 HA PHE B 165 67.041 62.634 52.867 1.00 0.00 H new ATOM 0 HB2 PHE B 165 66.031 61.711 55.294 1.00 0.00 H new ATOM 0 HB3 PHE B 165 64.622 61.550 54.265 1.00 0.00 H new ATOM 0 HD1 PHE B 165 64.688 60.017 52.241 1.00 0.00 H new ATOM 0 HD2 PHE B 165 67.967 60.300 55.048 1.00 0.00 H new ATOM 0 HE1 PHE B 165 65.339 57.666 51.715 1.00 0.00 H new ATOM 0 HE2 PHE B 165 68.642 57.967 54.506 1.00 0.00 H new ATOM 0 HZ PHE B 165 67.294 56.645 52.865 1.00 0.00 H new ATOM 818 N LEU B 166 63.894 63.719 53.023 1.00 0.00 N ATOM 819 CA LEU B 166 62.701 64.081 52.233 1.00 0.00 C ATOM 820 C LEU B 166 62.896 64.817 50.896 1.00 0.00 C ATOM 821 O LEU B 166 62.623 64.178 49.884 1.00 0.00 O ATOM 822 CB LEU B 166 61.585 64.708 53.094 1.00 0.00 C ATOM 823 CG LEU B 166 60.393 63.767 53.340 1.00 0.00 C ATOM 824 CD1 LEU B 166 59.678 63.365 52.048 1.00 0.00 C ATOM 825 CD2 LEU B 166 60.783 62.538 54.156 1.00 0.00 C ATOM 0 H LEU B 166 63.772 63.862 54.026 1.00 0.00 H new ATOM 0 HA LEU B 166 62.376 63.099 51.889 1.00 0.00 H new ATOM 0 HB2 LEU B 166 62.004 65.008 54.054 1.00 0.00 H new ATOM 0 HB3 LEU B 166 61.227 65.614 52.605 1.00 0.00 H new ATOM 0 HG LEU B 166 59.682 64.343 53.932 1.00 0.00 H new ATOM 0 HD11 LEU B 166 58.846 62.701 52.284 1.00 0.00 H new ATOM 0 HD12 LEU B 166 59.300 64.257 51.549 1.00 0.00 H new ATOM 0 HD13 LEU B 166 60.378 62.850 51.390 1.00 0.00 H new ATOM 0 HD21 LEU B 166 59.907 61.906 54.302 1.00 0.00 H new ATOM 0 HD22 LEU B 166 61.551 61.977 53.624 1.00 0.00 H new ATOM 0 HD23 LEU B 166 61.170 62.853 55.125 1.00 0.00 H new ATOM 831 N PRO B 167 63.476 66.032 50.820 1.00 0.00 N ATOM 832 CA PRO B 167 63.601 66.787 49.553 1.00 0.00 C ATOM 833 C PRO B 167 64.359 65.977 48.491 1.00 0.00 C ATOM 834 O PRO B 167 63.764 65.535 47.499 1.00 0.00 O ATOM 835 CB PRO B 167 64.339 68.073 49.918 1.00 0.00 C ATOM 836 CG PRO B 167 64.086 68.236 51.408 1.00 0.00 C ATOM 837 CD PRO B 167 64.108 66.794 51.913 1.00 0.00 C ATOM 0 HA PRO B 167 62.627 67.000 49.113 1.00 0.00 H new ATOM 0 HB2 PRO B 167 65.404 67.997 49.701 1.00 0.00 H new ATOM 0 HB3 PRO B 167 63.959 68.925 49.354 1.00 0.00 H new ATOM 0 HG2 PRO B 167 64.855 68.844 51.885 1.00 0.00 H new ATOM 0 HG3 PRO B 167 63.129 68.720 51.606 1.00 0.00 H new ATOM 0 HD2 PRO B 167 65.125 66.452 52.104 1.00 0.00 H new ATOM 0 HD3 PRO B 167 63.556 66.688 52.847 1.00 0.00 H new ATOM 843 N SER B 168 65.572 65.567 48.841 1.00 0.00 N ATOM 844 CA SER B 168 66.460 64.717 48.029 1.00 0.00 C ATOM 845 C SER B 168 65.953 63.293 47.744 1.00 0.00 C ATOM 846 O SER B 168 66.329 62.700 46.733 1.00 0.00 O ATOM 847 CB SER B 168 67.850 64.697 48.680 1.00 0.00 C ATOM 848 OG SER B 168 67.709 64.631 50.100 1.00 0.00 O ATOM 0 H SER B 168 65.990 65.824 49.735 1.00 0.00 H new ATOM 0 HA SER B 168 66.494 65.171 47.038 1.00 0.00 H new ATOM 0 HB2 SER B 168 68.420 63.840 48.320 1.00 0.00 H new ATOM 0 HB3 SER B 168 68.407 65.591 48.400 1.00 0.00 H new ATOM 0 HG SER B 168 66.915 64.102 50.326 1.00 0.00 H new ATOM 854 N LEU B 169 65.127 62.733 48.631 1.00 0.00 N ATOM 855 CA LEU B 169 64.338 61.507 48.397 1.00 0.00 C ATOM 856 C LEU B 169 63.317 61.682 47.276 1.00 0.00 C ATOM 857 O LEU B 169 63.265 60.895 46.334 1.00 0.00 O ATOM 858 CB LEU B 169 63.640 61.087 49.705 1.00 0.00 C ATOM 859 CG LEU B 169 62.650 59.929 49.570 1.00 0.00 C ATOM 860 CD1 LEU B 169 63.352 58.606 49.286 1.00 0.00 C ATOM 861 CD2 LEU B 169 61.780 59.837 50.829 1.00 0.00 C ATOM 0 H LEU B 169 64.980 63.126 49.561 1.00 0.00 H new ATOM 0 HA LEU B 169 65.024 60.722 48.078 1.00 0.00 H new ATOM 0 HB2 LEU B 169 64.403 60.809 50.433 1.00 0.00 H new ATOM 0 HB3 LEU B 169 63.112 61.950 50.110 1.00 0.00 H new ATOM 0 HG LEU B 169 62.009 60.132 48.712 1.00 0.00 H new ATOM 0 HD11 LEU B 169 62.610 57.812 49.198 1.00 0.00 H new ATOM 0 HD12 LEU B 169 63.912 58.684 48.354 1.00 0.00 H new ATOM 0 HD13 LEU B 169 64.036 58.374 50.102 1.00 0.00 H new ATOM 0 HD21 LEU B 169 61.077 59.010 50.726 1.00 0.00 H new ATOM 0 HD22 LEU B 169 62.415 59.667 51.698 1.00 0.00 H new ATOM 0 HD23 LEU B 169 61.228 60.768 50.959 1.00 0.00 H new ATOM 867 N LEU B 170 62.498 62.735 47.389 1.00 0.00 N ATOM 868 CA LEU B 170 61.516 63.099 46.349 1.00 0.00 C ATOM 869 C LEU B 170 62.205 63.360 44.990 1.00 0.00 C ATOM 870 O LEU B 170 61.750 62.869 43.958 1.00 0.00 O ATOM 871 CB LEU B 170 60.715 64.331 46.802 1.00 0.00 C ATOM 872 CG LEU B 170 59.985 64.120 48.141 1.00 0.00 C ATOM 873 CD1 LEU B 170 59.383 65.444 48.624 1.00 0.00 C ATOM 874 CD2 LEU B 170 58.895 63.051 48.066 1.00 0.00 C ATOM 0 H LEU B 170 62.493 63.358 48.197 1.00 0.00 H new ATOM 0 HA LEU B 170 60.833 62.261 46.210 1.00 0.00 H new ATOM 0 HB2 LEU B 170 61.390 65.182 46.894 1.00 0.00 H new ATOM 0 HB3 LEU B 170 59.985 64.585 46.033 1.00 0.00 H new ATOM 0 HG LEU B 170 60.730 63.764 48.853 1.00 0.00 H new ATOM 0 HD11 LEU B 170 58.868 65.285 49.572 1.00 0.00 H new ATOM 0 HD12 LEU B 170 60.178 66.177 48.761 1.00 0.00 H new ATOM 0 HD13 LEU B 170 58.673 65.813 47.883 1.00 0.00 H new ATOM 0 HD21 LEU B 170 58.418 62.949 49.041 1.00 0.00 H new ATOM 0 HD22 LEU B 170 58.150 63.342 47.326 1.00 0.00 H new ATOM 0 HD23 LEU B 170 59.339 62.098 47.778 1.00 0.00 H new ATOM 880 N LEU B 171 63.390 63.950 45.074 1.00 0.00 N ATOM 881 CA LEU B 171 64.290 64.151 43.915 1.00 0.00 C ATOM 882 C LEU B 171 64.981 62.879 43.392 1.00 0.00 C ATOM 883 O LEU B 171 65.163 62.754 42.181 1.00 0.00 O ATOM 884 CB LEU B 171 65.310 65.239 44.260 1.00 0.00 C ATOM 885 CG LEU B 171 64.578 66.583 44.273 1.00 0.00 C ATOM 886 CD1 LEU B 171 65.209 67.525 45.307 1.00 0.00 C ATOM 887 CD2 LEU B 171 64.614 67.228 42.885 1.00 0.00 C ATOM 0 H LEU B 171 63.769 64.310 45.950 1.00 0.00 H new ATOM 0 HA LEU B 171 63.658 64.464 43.084 1.00 0.00 H new ATOM 0 HB2 LEU B 171 65.764 65.042 45.231 1.00 0.00 H new ATOM 0 HB3 LEU B 171 66.117 65.251 43.528 1.00 0.00 H new ATOM 0 HG LEU B 171 63.538 66.404 44.548 1.00 0.00 H new ATOM 0 HD11 LEU B 171 64.678 68.477 45.304 1.00 0.00 H new ATOM 0 HD12 LEU B 171 65.142 67.075 46.298 1.00 0.00 H new ATOM 0 HD13 LEU B 171 66.256 67.693 45.055 1.00 0.00 H new ATOM 0 HD21 LEU B 171 64.089 68.183 42.914 1.00 0.00 H new ATOM 0 HD22 LEU B 171 65.649 67.392 42.587 1.00 0.00 H new ATOM 0 HD23 LEU B 171 64.130 66.569 42.165 1.00 0.00 H new ATOM 893 N SER B 172 65.308 61.939 44.269 1.00 0.00 N ATOM 894 CA SER B 172 65.820 60.605 43.865 1.00 0.00 C ATOM 895 C SER B 172 64.739 59.717 43.221 1.00 0.00 C ATOM 896 O SER B 172 65.005 59.043 42.229 1.00 0.00 O ATOM 897 CB SER B 172 66.466 59.856 45.033 1.00 0.00 C ATOM 898 OG SER B 172 67.619 60.585 45.467 1.00 0.00 O ATOM 0 H SER B 172 65.232 62.063 45.279 1.00 0.00 H new ATOM 0 HA SER B 172 66.582 60.809 43.113 1.00 0.00 H new ATOM 0 HB2 SER B 172 65.756 59.750 45.853 1.00 0.00 H new ATOM 0 HB3 SER B 172 66.750 58.849 44.725 1.00 0.00 H new ATOM 0 HG SER B 172 67.335 61.382 45.961 1.00 0.00 H new ATOM 904 N HIS B 173 63.507 59.845 43.710 1.00 0.00 N ATOM 905 CA HIS B 173 62.312 59.317 43.008 1.00 0.00 C ATOM 906 C HIS B 173 62.199 59.881 41.579 1.00 0.00 C ATOM 907 O HIS B 173 62.056 59.132 40.627 1.00 0.00 O ATOM 908 CB HIS B 173 61.019 59.603 43.777 1.00 0.00 C ATOM 909 CG HIS B 173 60.707 58.517 44.813 1.00 0.00 C ATOM 910 ND1 HIS B 173 60.294 58.720 46.054 1.00 0.00 N ATOM 911 CD2 HIS B 173 60.739 57.198 44.609 1.00 0.00 C ATOM 912 CE1 HIS B 173 60.094 57.546 46.630 1.00 0.00 C ATOM 913 NE2 HIS B 173 60.383 56.601 45.737 1.00 0.00 N ATOM 0 H HIS B 173 63.297 60.310 44.593 1.00 0.00 H new ATOM 0 HA HIS B 173 62.445 58.237 42.951 1.00 0.00 H new ATOM 0 HB2 HIS B 173 61.103 60.567 44.278 1.00 0.00 H new ATOM 0 HB3 HIS B 173 60.190 59.680 43.074 1.00 0.00 H new ATOM 0 HD1 HIS B 173 60.153 59.630 46.493 1.00 0.00 H new ATOM 0 HD2 HIS B 173 61.008 56.704 43.687 1.00 0.00 H new ATOM 0 HE1 HIS B 173 59.757 57.383 47.643 1.00 0.00 H new ATOM 918 N LEU B 174 62.458 61.183 41.464 1.00 0.00 N ATOM 919 CA LEU B 174 62.433 61.897 40.176 1.00 0.00 C ATOM 920 C LEU B 174 63.627 61.580 39.266 1.00 0.00 C ATOM 921 O LEU B 174 63.497 61.623 38.046 1.00 0.00 O ATOM 922 CB LEU B 174 62.280 63.405 40.401 1.00 0.00 C ATOM 923 CG LEU B 174 60.856 63.771 40.850 1.00 0.00 C ATOM 924 CD1 LEU B 174 60.793 65.270 41.135 1.00 0.00 C ATOM 925 CD2 LEU B 174 59.790 63.406 39.808 1.00 0.00 C ATOM 0 H LEU B 174 62.692 61.778 42.259 1.00 0.00 H new ATOM 0 HA LEU B 174 61.559 61.529 39.638 1.00 0.00 H new ATOM 0 HB2 LEU B 174 62.995 63.735 41.154 1.00 0.00 H new ATOM 0 HB3 LEU B 174 62.519 63.937 39.480 1.00 0.00 H new ATOM 0 HG LEU B 174 60.638 63.192 41.748 1.00 0.00 H new ATOM 0 HD11 LEU B 174 59.786 65.538 41.454 1.00 0.00 H new ATOM 0 HD12 LEU B 174 61.502 65.520 41.924 1.00 0.00 H new ATOM 0 HD13 LEU B 174 61.046 65.823 40.231 1.00 0.00 H new ATOM 0 HD21 LEU B 174 58.805 63.688 40.181 1.00 0.00 H new ATOM 0 HD22 LEU B 174 59.992 63.938 38.879 1.00 0.00 H new ATOM 0 HD23 LEU B 174 59.814 62.332 39.624 1.00 0.00 H new ATOM 931 N LEU B 175 64.798 61.359 39.867 1.00 0.00 N ATOM 932 CA LEU B 175 65.974 60.741 39.236 1.00 0.00 C ATOM 933 C LEU B 175 65.616 59.369 38.631 1.00 0.00 C ATOM 934 O LEU B 175 65.699 59.204 37.411 1.00 0.00 O ATOM 935 CB LEU B 175 67.044 60.626 40.327 1.00 0.00 C ATOM 936 CG LEU B 175 68.448 60.230 39.857 1.00 0.00 C ATOM 937 CD1 LEU B 175 69.148 61.398 39.151 1.00 0.00 C ATOM 938 CD2 LEU B 175 69.280 59.793 41.056 1.00 0.00 C ATOM 0 H LEU B 175 64.963 61.613 40.841 1.00 0.00 H new ATOM 0 HA LEU B 175 66.344 61.344 38.407 1.00 0.00 H new ATOM 0 HB2 LEU B 175 67.112 61.584 40.842 1.00 0.00 H new ATOM 0 HB3 LEU B 175 66.708 59.893 41.060 1.00 0.00 H new ATOM 0 HG LEU B 175 68.351 59.409 39.147 1.00 0.00 H new ATOM 0 HD11 LEU B 175 70.142 61.086 38.829 1.00 0.00 H new ATOM 0 HD12 LEU B 175 68.564 61.701 38.282 1.00 0.00 H new ATOM 0 HD13 LEU B 175 69.237 62.239 39.839 1.00 0.00 H new ATOM 0 HD21 LEU B 175 70.279 59.511 40.723 1.00 0.00 H new ATOM 0 HD22 LEU B 175 69.354 60.616 41.767 1.00 0.00 H new ATOM 0 HD23 LEU B 175 68.804 58.939 41.537 1.00 0.00 H new ATOM 944 N ALA B 176 65.043 58.482 39.448 1.00 0.00 N ATOM 945 CA ALA B 176 64.525 57.159 39.003 1.00 0.00 C ATOM 946 C ALA B 176 63.505 57.254 37.852 1.00 0.00 C ATOM 947 O ALA B 176 63.682 56.608 36.810 1.00 0.00 O ATOM 948 CB ALA B 176 63.930 56.420 40.210 1.00 0.00 C ATOM 0 H ALA B 176 64.918 58.650 40.446 1.00 0.00 H new ATOM 0 HA ALA B 176 65.366 56.597 38.598 1.00 0.00 H new ATOM 0 HB1 ALA B 176 63.549 55.450 39.891 1.00 0.00 H new ATOM 0 HB2 ALA B 176 64.703 56.276 40.965 1.00 0.00 H new ATOM 0 HB3 ALA B 176 63.116 57.009 40.632 1.00 0.00 H new ATOM 954 N ILE B 177 62.517 58.145 38.004 1.00 0.00 N ATOM 955 CA ILE B 177 61.526 58.479 36.964 1.00 0.00 C ATOM 956 C ILE B 177 62.192 59.069 35.707 1.00 0.00 C ATOM 957 O ILE B 177 61.907 58.610 34.605 1.00 0.00 O ATOM 958 CB ILE B 177 60.417 59.378 37.556 1.00 0.00 C ATOM 959 CG1 ILE B 177 59.623 58.588 38.602 1.00 0.00 C ATOM 960 CG2 ILE B 177 59.453 59.933 36.497 1.00 0.00 C ATOM 961 CD1 ILE B 177 58.884 59.478 39.625 1.00 0.00 C ATOM 0 H ILE B 177 62.378 58.666 38.870 1.00 0.00 H new ATOM 0 HA ILE B 177 61.045 57.561 36.626 1.00 0.00 H new ATOM 0 HB ILE B 177 60.915 60.234 38.010 1.00 0.00 H new ATOM 0 HG12 ILE B 177 58.896 57.956 38.092 1.00 0.00 H new ATOM 0 HG13 ILE B 177 60.303 57.924 39.136 1.00 0.00 H new ATOM 0 HG21 ILE B 177 58.700 60.555 36.981 1.00 0.00 H new ATOM 0 HG22 ILE B 177 60.010 60.532 35.776 1.00 0.00 H new ATOM 0 HG23 ILE B 177 58.964 59.107 35.981 1.00 0.00 H new ATOM 0 HD11 ILE B 177 58.345 58.848 40.333 1.00 0.00 H new ATOM 0 HD12 ILE B 177 59.607 60.091 40.163 1.00 0.00 H new ATOM 0 HD13 ILE B 177 58.178 60.124 39.103 1.00 0.00 H new ATOM 965 N GLY B 178 63.043 60.086 35.881 1.00 0.00 N ATOM 966 CA GLY B 178 63.828 60.736 34.824 1.00 0.00 C ATOM 967 C GLY B 178 64.608 59.736 33.961 1.00 0.00 C ATOM 968 O GLY B 178 64.390 59.648 32.751 1.00 0.00 O ATOM 0 H GLY B 178 63.211 60.496 36.800 1.00 0.00 H new ATOM 0 HA2 GLY B 178 63.160 61.315 34.186 1.00 0.00 H new ATOM 0 HA3 GLY B 178 64.526 61.440 35.277 1.00 0.00 H new ATOM 972 N LEU B 179 65.395 58.900 34.639 1.00 0.00 N ATOM 973 CA LEU B 179 66.115 57.769 34.026 1.00 0.00 C ATOM 974 C LEU B 179 65.184 56.813 33.272 1.00 0.00 C ATOM 975 O LEU B 179 65.387 56.558 32.082 1.00 0.00 O ATOM 976 CB LEU B 179 66.980 57.063 35.085 1.00 0.00 C ATOM 977 CG LEU B 179 68.122 57.981 35.549 1.00 0.00 C ATOM 978 CD1 LEU B 179 68.725 57.442 36.848 1.00 0.00 C ATOM 979 CD2 LEU B 179 69.222 58.114 34.501 1.00 0.00 C ATOM 0 H LEU B 179 65.556 58.985 35.643 1.00 0.00 H new ATOM 0 HA LEU B 179 66.783 58.164 33.260 1.00 0.00 H new ATOM 0 HB2 LEU B 179 66.363 56.782 35.938 1.00 0.00 H new ATOM 0 HB3 LEU B 179 67.391 56.142 34.672 1.00 0.00 H new ATOM 0 HG LEU B 179 67.695 58.971 35.710 1.00 0.00 H new ATOM 0 HD11 LEU B 179 69.534 58.096 37.173 1.00 0.00 H new ATOM 0 HD12 LEU B 179 67.955 57.407 37.619 1.00 0.00 H new ATOM 0 HD13 LEU B 179 69.116 56.439 36.679 1.00 0.00 H new ATOM 0 HD21 LEU B 179 70.005 58.773 34.877 1.00 0.00 H new ATOM 0 HD22 LEU B 179 69.644 57.132 34.290 1.00 0.00 H new ATOM 0 HD23 LEU B 179 68.804 58.533 33.586 1.00 0.00 H new ATOM 985 N GLY B 180 64.086 56.451 33.930 1.00 0.00 N ATOM 986 CA GLY B 180 62.943 55.723 33.337 1.00 0.00 C ATOM 987 C GLY B 180 62.429 56.363 32.028 1.00 0.00 C ATOM 988 O GLY B 180 62.366 55.696 30.996 1.00 0.00 O ATOM 0 H GLY B 180 63.953 56.657 34.920 1.00 0.00 H new ATOM 0 HA2 GLY B 180 63.240 54.693 33.139 1.00 0.00 H new ATOM 0 HA3 GLY B 180 62.129 55.686 34.061 1.00 0.00 H new ATOM 992 N ILE B 181 62.118 57.650 32.072 1.00 0.00 N ATOM 993 CA ILE B 181 61.642 58.430 30.904 1.00 0.00 C ATOM 994 C ILE B 181 62.614 58.362 29.715 1.00 0.00 C ATOM 995 O ILE B 181 62.167 58.132 28.594 1.00 0.00 O ATOM 996 CB ILE B 181 61.279 59.876 31.308 1.00 0.00 C ATOM 997 CG1 ILE B 181 60.059 59.852 32.237 1.00 0.00 C ATOM 998 CG2 ILE B 181 60.983 60.767 30.091 1.00 0.00 C ATOM 999 CD1 ILE B 181 59.927 61.108 33.101 1.00 0.00 C ATOM 0 H ILE B 181 62.185 58.204 32.926 1.00 0.00 H new ATOM 0 HA ILE B 181 60.723 57.962 30.551 1.00 0.00 H new ATOM 0 HB ILE B 181 62.141 60.302 31.821 1.00 0.00 H new ATOM 0 HG12 ILE B 181 59.157 59.737 31.636 1.00 0.00 H new ATOM 0 HG13 ILE B 181 60.123 58.979 32.886 1.00 0.00 H new ATOM 0 HG21 ILE B 181 60.733 61.773 30.429 1.00 0.00 H new ATOM 0 HG22 ILE B 181 61.862 60.808 29.448 1.00 0.00 H new ATOM 0 HG23 ILE B 181 60.144 60.353 29.532 1.00 0.00 H new ATOM 0 HD11 ILE B 181 59.043 61.023 33.733 1.00 0.00 H new ATOM 0 HD12 ILE B 181 60.813 61.213 33.728 1.00 0.00 H new ATOM 0 HD13 ILE B 181 59.831 61.983 32.458 1.00 0.00 H new ATOM 1003 N TYR B 182 63.912 58.553 29.967 1.00 0.00 N ATOM 1004 CA TYR B 182 64.954 58.445 28.917 1.00 0.00 C ATOM 1005 C TYR B 182 64.857 57.137 28.133 1.00 0.00 C ATOM 1006 O TYR B 182 64.538 57.148 26.943 1.00 0.00 O ATOM 1007 CB TYR B 182 66.363 58.595 29.499 1.00 0.00 C ATOM 1008 CG TYR B 182 66.631 59.895 30.254 1.00 0.00 C ATOM 1009 CD1 TYR B 182 66.270 61.164 29.727 1.00 0.00 C ATOM 1010 CD2 TYR B 182 67.430 59.798 31.414 1.00 0.00 C ATOM 1011 CE1 TYR B 182 66.779 62.326 30.322 1.00 0.00 C ATOM 1012 CE2 TYR B 182 67.909 60.971 32.028 1.00 0.00 C ATOM 1013 CZ TYR B 182 67.619 62.220 31.452 1.00 0.00 C ATOM 1014 OH TYR B 182 68.551 63.177 31.636 1.00 0.00 O ATOM 0 H TYR B 182 64.277 58.785 30.891 1.00 0.00 H new ATOM 0 HA TYR B 182 64.769 59.268 28.227 1.00 0.00 H new ATOM 0 HB2 TYR B 182 66.549 57.759 30.174 1.00 0.00 H new ATOM 0 HB3 TYR B 182 67.083 58.514 28.685 1.00 0.00 H new ATOM 0 HD1 TYR B 182 65.609 61.232 28.875 1.00 0.00 H new ATOM 0 HD2 TYR B 182 67.672 58.830 31.828 1.00 0.00 H new ATOM 0 HE1 TYR B 182 66.530 63.297 29.919 1.00 0.00 H new ATOM 0 HE2 TYR B 182 68.494 60.912 32.934 1.00 0.00 H new ATOM 0 HH TYR B 182 69.061 62.985 32.451 1.00 0.00 H new ATOM 1019 N ILE B 183 64.895 56.014 28.869 1.00 0.00 N ATOM 1020 CA ILE B 183 64.708 54.675 28.265 1.00 0.00 C ATOM 1021 C ILE B 183 63.320 54.515 27.613 1.00 0.00 C ATOM 1022 O ILE B 183 63.264 54.148 26.432 1.00 0.00 O ATOM 1023 CB ILE B 183 65.127 53.515 29.202 1.00 0.00 C ATOM 1024 CG1 ILE B 183 64.899 52.125 28.607 1.00 0.00 C ATOM 1025 CG2 ILE B 183 64.545 53.596 30.611 1.00 0.00 C ATOM 1026 CD1 ILE B 183 65.783 51.837 27.387 1.00 0.00 C ATOM 0 H ILE B 183 65.052 56.001 29.877 1.00 0.00 H new ATOM 0 HA ILE B 183 65.414 54.603 27.438 1.00 0.00 H new ATOM 0 HB ILE B 183 66.203 53.659 29.298 1.00 0.00 H new ATOM 0 HG12 ILE B 183 65.091 51.373 29.372 1.00 0.00 H new ATOM 0 HG13 ILE B 183 63.852 52.027 28.320 1.00 0.00 H new ATOM 0 HG21 ILE B 183 64.891 52.744 31.197 1.00 0.00 H new ATOM 0 HG22 ILE B 183 64.872 54.521 31.087 1.00 0.00 H new ATOM 0 HG23 ILE B 183 63.456 53.581 30.556 1.00 0.00 H new ATOM 0 HD11 ILE B 183 65.572 50.835 27.013 1.00 0.00 H new ATOM 0 HD12 ILE B 183 65.574 52.567 26.606 1.00 0.00 H new ATOM 0 HD13 ILE B 183 66.832 51.903 27.674 1.00 0.00 H new