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 173 HIS : no HD1:sc= 1.16 K(o=3.4,f=-9.1!) USER MOD Set 1.2: B 172 SER OG : rot -47:sc= 2.28 USER MOD Set 2.1: A 172 SER OG : rot 94:sc= 0.716 USER MOD Set 2.2: B 173 HIS : no HE2:sc= 0.997 K(o=1.7,f=-1.9) 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 180:sc= 0 USER MOD Single : B 182 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 260 N LEU A 166 66.626 50.280 53.245 1.00 0.00 N ATOM 261 CA LEU A 166 67.047 49.736 51.933 1.00 0.00 C ATOM 262 C LEU A 166 66.057 48.877 51.102 1.00 0.00 C ATOM 263 O LEU A 166 65.921 49.226 49.929 1.00 0.00 O ATOM 264 CB LEU A 166 68.453 49.138 52.026 1.00 0.00 C ATOM 265 CG LEU A 166 69.488 50.179 51.592 1.00 0.00 C ATOM 266 CD1 LEU A 166 70.831 49.922 52.281 1.00 0.00 C ATOM 267 CD2 LEU A 166 69.679 50.104 50.074 1.00 0.00 C ATOM 0 HA LEU A 166 67.053 50.624 51.301 1.00 0.00 H new ATOM 0 HB2 LEU A 166 68.654 48.815 53.048 1.00 0.00 H new ATOM 0 HB3 LEU A 166 68.525 48.254 51.392 1.00 0.00 H new ATOM 0 HG LEU A 166 69.129 51.168 51.876 1.00 0.00 H new ATOM 0 HD11 LEU A 166 71.554 50.672 51.960 1.00 0.00 H new ATOM 0 HD12 LEU A 166 70.703 49.981 53.362 1.00 0.00 H new ATOM 0 HD13 LEU A 166 71.194 48.930 52.012 1.00 0.00 H new ATOM 0 HD21 LEU A 166 70.416 50.845 49.763 1.00 0.00 H new ATOM 0 HD22 LEU A 166 70.027 49.108 49.800 1.00 0.00 H new ATOM 0 HD23 LEU A 166 68.730 50.306 49.577 1.00 0.00 H new ATOM 273 N PRO A 167 65.329 47.879 51.635 1.00 0.00 N ATOM 274 CA PRO A 167 64.292 47.139 50.883 1.00 0.00 C ATOM 275 C PRO A 167 63.256 48.086 50.244 1.00 0.00 C ATOM 276 O PRO A 167 63.207 48.216 49.013 1.00 0.00 O ATOM 277 CB PRO A 167 63.660 46.179 51.894 1.00 0.00 C ATOM 278 CG PRO A 167 64.810 45.890 52.852 1.00 0.00 C ATOM 279 CD PRO A 167 65.521 47.244 52.957 1.00 0.00 C ATOM 0 HA PRO A 167 64.720 46.595 50.041 1.00 0.00 H new ATOM 0 HB2 PRO A 167 62.811 46.633 52.406 1.00 0.00 H new ATOM 0 HB3 PRO A 167 63.295 45.271 51.415 1.00 0.00 H new ATOM 0 HG2 PRO A 167 64.450 45.547 53.822 1.00 0.00 H new ATOM 0 HG3 PRO A 167 65.472 45.115 52.465 1.00 0.00 H new ATOM 0 HD2 PRO A 167 65.094 47.853 53.754 1.00 0.00 H new ATOM 0 HD3 PRO A 167 66.579 47.118 53.185 1.00 0.00 H new ATOM 285 N SER A 168 62.496 48.772 51.092 1.00 0.00 N ATOM 286 CA SER A 168 61.593 49.876 50.688 1.00 0.00 C ATOM 287 C SER A 168 62.206 50.930 49.749 1.00 0.00 C ATOM 288 O SER A 168 61.556 51.327 48.779 1.00 0.00 O ATOM 289 CB SER A 168 61.012 50.580 51.916 1.00 0.00 C ATOM 290 OG SER A 168 60.025 49.763 52.547 1.00 0.00 O ATOM 0 H SER A 168 62.480 48.584 52.094 1.00 0.00 H new ATOM 0 HA SER A 168 60.813 49.379 50.111 1.00 0.00 H new ATOM 0 HB2 SER A 168 61.810 50.806 52.623 1.00 0.00 H new ATOM 0 HB3 SER A 168 60.569 51.531 51.620 1.00 0.00 H new ATOM 0 HG SER A 168 59.667 50.229 53.331 1.00 0.00 H new ATOM 296 N LEU A 169 63.433 51.388 50.042 1.00 0.00 N ATOM 297 CA LEU A 169 64.186 52.288 49.147 1.00 0.00 C ATOM 298 C LEU A 169 64.269 51.738 47.709 1.00 0.00 C ATOM 299 O LEU A 169 63.457 52.153 46.878 1.00 0.00 O ATOM 300 CB LEU A 169 65.596 52.603 49.673 1.00 0.00 C ATOM 301 CG LEU A 169 65.605 53.611 50.818 1.00 0.00 C ATOM 302 CD1 LEU A 169 66.985 53.603 51.481 1.00 0.00 C ATOM 303 CD2 LEU A 169 65.328 55.030 50.325 1.00 0.00 C ATOM 0 H LEU A 169 63.931 51.148 50.900 1.00 0.00 H new ATOM 0 HA LEU A 169 63.622 53.221 49.128 1.00 0.00 H new ATOM 0 HB2 LEU A 169 66.065 51.678 50.009 1.00 0.00 H new ATOM 0 HB3 LEU A 169 66.203 52.989 48.854 1.00 0.00 H new ATOM 0 HG LEU A 169 64.822 53.323 51.520 1.00 0.00 H new ATOM 0 HD11 LEU A 169 66.999 54.321 52.301 1.00 0.00 H new ATOM 0 HD12 LEU A 169 67.197 52.606 51.868 1.00 0.00 H new ATOM 0 HD13 LEU A 169 67.743 53.876 50.747 1.00 0.00 H new ATOM 0 HD21 LEU A 169 65.343 55.718 51.170 1.00 0.00 H new ATOM 0 HD22 LEU A 169 66.094 55.321 49.606 1.00 0.00 H new ATOM 0 HD23 LEU A 169 64.349 55.064 49.846 1.00 0.00 H new ATOM 309 N LEU A 170 64.946 50.598 47.577 1.00 0.00 N ATOM 310 CA LEU A 170 65.116 49.845 46.316 1.00 0.00 C ATOM 311 C LEU A 170 63.809 49.723 45.521 1.00 0.00 C ATOM 312 O LEU A 170 63.664 50.357 44.475 1.00 0.00 O ATOM 313 CB LEU A 170 65.686 48.454 46.602 1.00 0.00 C ATOM 314 CG LEU A 170 67.186 48.488 46.919 1.00 0.00 C ATOM 315 CD1 LEU A 170 67.562 47.235 47.711 1.00 0.00 C ATOM 316 CD2 LEU A 170 68.001 48.519 45.623 1.00 0.00 C ATOM 0 H LEU A 170 65.411 50.150 48.367 1.00 0.00 H new ATOM 0 HA LEU A 170 65.816 50.410 45.701 1.00 0.00 H new ATOM 0 HB2 LEU A 170 65.150 48.011 47.442 1.00 0.00 H new ATOM 0 HB3 LEU A 170 65.515 47.810 45.739 1.00 0.00 H new ATOM 0 HG LEU A 170 67.404 49.383 47.502 1.00 0.00 H new ATOM 0 HD11 LEU A 170 68.628 47.255 47.939 1.00 0.00 H new ATOM 0 HD12 LEU A 170 66.993 47.207 48.640 1.00 0.00 H new ATOM 0 HD13 LEU A 170 67.334 46.348 47.119 1.00 0.00 H new ATOM 0 HD21 LEU A 170 69.064 48.543 45.862 1.00 0.00 H new ATOM 0 HD22 LEU A 170 67.782 47.629 45.034 1.00 0.00 H new ATOM 0 HD23 LEU A 170 67.738 49.408 45.049 1.00 0.00 H new ATOM 322 N LEU A 171 62.811 49.120 46.152 1.00 0.00 N ATOM 323 CA LEU A 171 61.492 48.885 45.522 1.00 0.00 C ATOM 324 C LEU A 171 60.766 50.174 45.093 1.00 0.00 C ATOM 325 O LEU A 171 60.506 50.317 43.904 1.00 0.00 O ATOM 326 CB LEU A 171 60.624 47.955 46.387 1.00 0.00 C ATOM 327 CG LEU A 171 61.280 46.564 46.507 1.00 0.00 C ATOM 328 CD1 LEU A 171 60.467 45.687 47.466 1.00 0.00 C ATOM 329 CD2 LEU A 171 61.425 45.858 45.154 1.00 0.00 C ATOM 0 H LEU A 171 62.878 48.777 47.110 1.00 0.00 H new ATOM 0 HA LEU A 171 61.684 48.367 44.582 1.00 0.00 H new ATOM 0 HB2 LEU A 171 60.492 48.388 47.378 1.00 0.00 H new ATOM 0 HB3 LEU A 171 59.632 47.859 45.946 1.00 0.00 H new ATOM 0 HG LEU A 171 62.286 46.717 46.898 1.00 0.00 H new ATOM 0 HD11 LEU A 171 60.935 44.706 47.547 1.00 0.00 H new ATOM 0 HD12 LEU A 171 60.435 46.156 48.449 1.00 0.00 H new ATOM 0 HD13 LEU A 171 59.452 45.575 47.084 1.00 0.00 H new ATOM 0 HD21 LEU A 171 61.893 44.884 45.300 1.00 0.00 H new ATOM 0 HD22 LEU A 171 60.440 45.724 44.706 1.00 0.00 H new ATOM 0 HD23 LEU A 171 62.045 46.463 44.493 1.00 0.00 H new ATOM 335 N SER A 172 60.679 51.175 45.971 1.00 0.00 N ATOM 336 CA SER A 172 60.030 52.462 45.648 1.00 0.00 C ATOM 337 C SER A 172 60.695 53.203 44.470 1.00 0.00 C ATOM 338 O SER A 172 60.005 53.734 43.595 1.00 0.00 O ATOM 339 CB SER A 172 59.914 53.400 46.856 1.00 0.00 C ATOM 340 OG SER A 172 61.184 53.918 47.253 1.00 0.00 O ATOM 0 H SER A 172 61.051 51.125 46.920 1.00 0.00 H new ATOM 0 HA SER A 172 59.022 52.182 45.341 1.00 0.00 H new ATOM 0 HB2 SER A 172 59.246 54.226 46.611 1.00 0.00 H new ATOM 0 HB3 SER A 172 59.464 52.863 47.691 1.00 0.00 H new ATOM 0 HG SER A 172 61.334 54.784 46.820 1.00 0.00 H new ATOM 346 N HIS A 173 62.023 53.216 44.439 1.00 0.00 N ATOM 347 CA HIS A 173 62.811 53.751 43.299 1.00 0.00 C ATOM 348 C HIS A 173 62.618 52.987 41.989 1.00 0.00 C ATOM 349 O HIS A 173 62.405 53.594 40.937 1.00 0.00 O ATOM 350 CB HIS A 173 64.297 53.771 43.632 1.00 0.00 C ATOM 351 CG HIS A 173 64.641 54.816 44.688 1.00 0.00 C ATOM 352 ND1 HIS A 173 64.764 54.610 45.992 1.00 0.00 N ATOM 353 CD2 HIS A 173 64.828 56.111 44.453 1.00 0.00 C ATOM 354 CE1 HIS A 173 65.045 55.771 46.569 1.00 0.00 C ATOM 355 NE2 HIS A 173 65.064 56.698 45.616 1.00 0.00 N ATOM 0 H HIS A 173 62.600 52.858 45.200 1.00 0.00 H new ATOM 0 HA HIS A 173 62.431 54.761 43.145 1.00 0.00 H new ATOM 0 HB2 HIS A 173 64.601 52.786 43.987 1.00 0.00 H new ATOM 0 HB3 HIS A 173 64.867 53.973 42.725 1.00 0.00 H new ATOM 0 HD2 HIS A 173 64.794 56.596 43.489 1.00 0.00 H new ATOM 0 HE1 HIS A 173 65.225 55.934 47.621 1.00 0.00 H new ATOM 0 HE2 HIS A 173 65.232 57.694 45.757 1.00 0.00 H new ATOM 360 N LEU A 174 62.720 51.661 42.053 1.00 0.00 N ATOM 361 CA LEU A 174 62.494 50.773 40.892 1.00 0.00 C ATOM 362 C LEU A 174 61.062 50.869 40.337 1.00 0.00 C ATOM 363 O LEU A 174 60.873 50.915 39.123 1.00 0.00 O ATOM 364 CB LEU A 174 62.917 49.348 41.245 1.00 0.00 C ATOM 365 CG LEU A 174 64.441 49.283 41.460 1.00 0.00 C ATOM 366 CD1 LEU A 174 64.814 48.056 42.278 1.00 0.00 C ATOM 367 CD2 LEU A 174 65.196 49.249 40.126 1.00 0.00 C ATOM 0 H LEU A 174 62.962 51.162 42.909 1.00 0.00 H new ATOM 0 HA LEU A 174 63.123 51.112 40.069 1.00 0.00 H new ATOM 0 HB2 LEU A 174 62.401 49.021 42.148 1.00 0.00 H new ATOM 0 HB3 LEU A 174 62.626 48.666 40.446 1.00 0.00 H new ATOM 0 HG LEU A 174 64.729 50.184 42.001 1.00 0.00 H new ATOM 0 HD11 LEU A 174 65.894 48.028 42.419 1.00 0.00 H new ATOM 0 HD12 LEU A 174 64.322 48.103 43.250 1.00 0.00 H new ATOM 0 HD13 LEU A 174 64.493 47.157 41.752 1.00 0.00 H new ATOM 0 HD21 LEU A 174 66.268 49.203 40.316 1.00 0.00 H new ATOM 0 HD22 LEU A 174 64.890 48.371 39.557 1.00 0.00 H new ATOM 0 HD23 LEU A 174 64.967 50.149 39.555 1.00 0.00 H new ATOM 373 N LEU A 175 60.101 51.082 41.235 1.00 0.00 N ATOM 374 CA LEU A 175 58.715 51.483 40.899 1.00 0.00 C ATOM 375 C LEU A 175 58.641 52.802 40.117 1.00 0.00 C ATOM 376 O LEU A 175 57.894 52.886 39.144 1.00 0.00 O ATOM 377 CB LEU A 175 57.880 51.564 42.189 1.00 0.00 C ATOM 378 CG LEU A 175 57.229 50.221 42.499 1.00 0.00 C ATOM 379 CD1 LEU A 175 57.286 49.920 44.001 1.00 0.00 C ATOM 380 CD2 LEU A 175 55.764 50.229 42.053 1.00 0.00 C ATOM 0 H LEU A 175 60.256 50.982 42.238 1.00 0.00 H new ATOM 0 HA LEU A 175 58.305 50.720 40.238 1.00 0.00 H new ATOM 0 HB2 LEU A 175 58.517 51.865 43.021 1.00 0.00 H new ATOM 0 HB3 LEU A 175 57.111 52.330 42.082 1.00 0.00 H new ATOM 0 HG LEU A 175 57.779 49.451 41.957 1.00 0.00 H new ATOM 0 HD11 LEU A 175 56.815 48.957 44.197 1.00 0.00 H new ATOM 0 HD12 LEU A 175 58.326 49.889 44.327 1.00 0.00 H new ATOM 0 HD13 LEU A 175 56.758 50.700 44.549 1.00 0.00 H new ATOM 0 HD21 LEU A 175 55.309 49.265 42.280 1.00 0.00 H new ATOM 0 HD22 LEU A 175 55.227 51.016 42.582 1.00 0.00 H new ATOM 0 HD23 LEU A 175 55.711 50.412 40.980 1.00 0.00 H new ATOM 386 N ALA A 176 59.446 53.785 40.523 1.00 0.00 N ATOM 387 CA ALA A 176 59.580 55.084 39.826 1.00 0.00 C ATOM 388 C ALA A 176 60.241 54.980 38.438 1.00 0.00 C ATOM 389 O ALA A 176 59.766 55.592 37.486 1.00 0.00 O ATOM 390 CB ALA A 176 60.349 56.054 40.717 1.00 0.00 C ATOM 0 H ALA A 176 60.034 53.710 41.353 1.00 0.00 H new ATOM 0 HA ALA A 176 58.571 55.454 39.641 1.00 0.00 H new ATOM 0 HB1 ALA A 176 60.451 57.013 40.208 1.00 0.00 H new ATOM 0 HB2 ALA A 176 59.808 56.195 41.653 1.00 0.00 H new ATOM 0 HB3 ALA A 176 61.339 55.648 40.927 1.00 0.00 H new ATOM 396 N ILE A 177 61.317 54.188 38.327 1.00 0.00 N ATOM 397 CA ILE A 177 61.946 53.861 37.030 1.00 0.00 C ATOM 398 C ILE A 177 60.913 53.164 36.111 1.00 0.00 C ATOM 399 O ILE A 177 60.659 53.646 35.011 1.00 0.00 O ATOM 400 CB ILE A 177 63.234 53.022 37.187 1.00 0.00 C ATOM 401 CG1 ILE A 177 64.215 53.726 38.131 1.00 0.00 C ATOM 402 CG2 ILE A 177 63.910 52.799 35.827 1.00 0.00 C ATOM 403 CD1 ILE A 177 65.297 52.809 38.726 1.00 0.00 C ATOM 0 H ILE A 177 61.778 53.755 39.128 1.00 0.00 H new ATOM 0 HA ILE A 177 62.260 54.795 36.564 1.00 0.00 H new ATOM 0 HB ILE A 177 62.956 52.055 37.606 1.00 0.00 H new ATOM 0 HG12 ILE A 177 64.702 54.537 37.590 1.00 0.00 H new ATOM 0 HG13 ILE A 177 63.652 54.180 38.947 1.00 0.00 H new ATOM 0 HG21 ILE A 177 64.814 52.206 35.963 1.00 0.00 H new ATOM 0 HG22 ILE A 177 63.226 52.270 35.163 1.00 0.00 H new ATOM 0 HG23 ILE A 177 64.170 53.762 35.388 1.00 0.00 H new ATOM 0 HD11 ILE A 177 65.946 53.390 39.381 1.00 0.00 H new ATOM 0 HD12 ILE A 177 64.823 52.012 39.299 1.00 0.00 H new ATOM 0 HD13 ILE A 177 65.889 52.375 37.920 1.00 0.00 H new ATOM 407 N GLY A 178 60.250 52.137 36.644 1.00 0.00 N ATOM 408 CA GLY A 178 59.138 51.420 35.988 1.00 0.00 C ATOM 409 C GLY A 178 58.066 52.375 35.455 1.00 0.00 C ATOM 410 O GLY A 178 57.765 52.379 34.253 1.00 0.00 O ATOM 0 H GLY A 178 60.472 51.765 37.568 1.00 0.00 H new ATOM 0 HA2 GLY A 178 59.529 50.821 35.166 1.00 0.00 H new ATOM 0 HA3 GLY A 178 58.685 50.729 36.698 1.00 0.00 H new ATOM 414 N LEU A 179 57.554 53.213 36.350 1.00 0.00 N ATOM 415 CA LEU A 179 56.673 54.365 36.035 1.00 0.00 C ATOM 416 C LEU A 179 57.201 55.181 34.845 1.00 0.00 C ATOM 417 O LEU A 179 56.546 55.210 33.802 1.00 0.00 O ATOM 418 CB LEU A 179 56.535 55.221 37.309 1.00 0.00 C ATOM 419 CG LEU A 179 55.790 56.552 37.120 1.00 0.00 C ATOM 420 CD1 LEU A 179 54.304 56.328 36.808 1.00 0.00 C ATOM 421 CD2 LEU A 179 55.960 57.404 38.369 1.00 0.00 C ATOM 0 H LEU A 179 57.738 53.119 37.349 1.00 0.00 H new ATOM 0 HA LEU A 179 55.691 54.005 35.729 1.00 0.00 H new ATOM 0 HB2 LEU A 179 56.015 54.636 38.067 1.00 0.00 H new ATOM 0 HB3 LEU A 179 57.532 55.432 37.697 1.00 0.00 H new ATOM 0 HG LEU A 179 56.219 57.074 36.265 1.00 0.00 H new ATOM 0 HD11 LEU A 179 53.810 57.291 36.681 1.00 0.00 H new ATOM 0 HD12 LEU A 179 54.208 55.747 35.891 1.00 0.00 H new ATOM 0 HD13 LEU A 179 53.837 55.786 37.631 1.00 0.00 H new ATOM 0 HD21 LEU A 179 55.433 58.349 38.239 1.00 0.00 H new ATOM 0 HD22 LEU A 179 55.550 56.875 39.229 1.00 0.00 H new ATOM 0 HD23 LEU A 179 57.019 57.599 38.535 1.00 0.00 H new ATOM 427 N GLY A 180 58.432 55.682 34.971 1.00 0.00 N ATOM 428 CA GLY A 180 59.143 56.472 33.942 1.00 0.00 C ATOM 429 C GLY A 180 59.155 55.818 32.559 1.00 0.00 C ATOM 430 O GLY A 180 58.832 56.470 31.570 1.00 0.00 O ATOM 0 H GLY A 180 58.986 55.549 35.817 1.00 0.00 H new ATOM 0 HA2 GLY A 180 58.676 57.454 33.865 1.00 0.00 H new ATOM 0 HA3 GLY A 180 60.171 56.632 34.267 1.00 0.00 H new ATOM 434 N ILE A 181 59.515 54.526 32.512 1.00 0.00 N ATOM 435 CA ILE A 181 59.530 53.725 31.260 1.00 0.00 C ATOM 436 C ILE A 181 58.124 53.692 30.662 1.00 0.00 C ATOM 437 O ILE A 181 57.887 54.313 29.619 1.00 0.00 O ATOM 438 CB ILE A 181 60.061 52.300 31.508 1.00 0.00 C ATOM 439 CG1 ILE A 181 61.439 52.339 32.190 1.00 0.00 C ATOM 440 CG2 ILE A 181 60.197 51.539 30.169 1.00 0.00 C ATOM 441 CD1 ILE A 181 61.692 51.122 33.071 1.00 0.00 C ATOM 0 H ILE A 181 59.805 54.000 33.336 1.00 0.00 H new ATOM 0 HA ILE A 181 60.209 54.198 30.550 1.00 0.00 H new ATOM 0 HB ILE A 181 59.349 51.790 32.158 1.00 0.00 H new ATOM 0 HG12 ILE A 181 62.216 52.399 31.428 1.00 0.00 H new ATOM 0 HG13 ILE A 181 61.515 53.243 32.795 1.00 0.00 H new ATOM 0 HG21 ILE A 181 60.573 50.534 30.358 1.00 0.00 H new ATOM 0 HG22 ILE A 181 59.222 51.477 29.685 1.00 0.00 H new ATOM 0 HG23 ILE A 181 60.892 52.070 29.518 1.00 0.00 H new ATOM 0 HD11 ILE A 181 62.679 51.202 33.527 1.00 0.00 H new ATOM 0 HD12 ILE A 181 60.934 51.075 33.852 1.00 0.00 H new ATOM 0 HD13 ILE A 181 61.645 50.218 32.464 1.00 0.00 H new ATOM 445 N TYR A 182 57.178 53.186 31.449 1.00 0.00 N ATOM 446 CA TYR A 182 55.748 53.100 31.117 1.00 0.00 C ATOM 447 C TYR A 182 55.187 54.427 30.555 1.00 0.00 C ATOM 448 O TYR A 182 54.935 54.504 29.350 1.00 0.00 O ATOM 449 CB TYR A 182 55.012 52.646 32.385 1.00 0.00 C ATOM 450 CG TYR A 182 53.525 52.385 32.217 1.00 0.00 C ATOM 451 CD1 TYR A 182 53.082 51.142 31.711 1.00 0.00 C ATOM 452 CD2 TYR A 182 52.604 53.332 32.727 1.00 0.00 C ATOM 453 CE1 TYR A 182 51.713 50.833 31.718 1.00 0.00 C ATOM 454 CE2 TYR A 182 51.237 53.026 32.744 1.00 0.00 C ATOM 455 CZ TYR A 182 50.803 51.786 32.236 1.00 0.00 C ATOM 456 OH TYR A 182 49.475 51.583 32.098 1.00 0.00 O ATOM 0 H TYR A 182 57.389 52.808 32.373 1.00 0.00 H new ATOM 0 HA TYR A 182 55.596 52.377 30.315 1.00 0.00 H new ATOM 0 HB2 TYR A 182 55.484 51.735 32.752 1.00 0.00 H new ATOM 0 HB3 TYR A 182 55.146 53.407 33.154 1.00 0.00 H new ATOM 0 HD1 TYR A 182 53.795 50.432 31.320 1.00 0.00 H new ATOM 0 HD2 TYR A 182 52.953 54.283 33.100 1.00 0.00 H new ATOM 0 HE1 TYR A 182 51.360 49.886 31.336 1.00 0.00 H new ATOM 0 HE2 TYR A 182 50.524 53.733 33.142 1.00 0.00 H new ATOM 0 HH TYR A 182 48.986 52.327 32.508 1.00 0.00 H new ATOM 461 N ILE A 183 55.245 55.490 31.349 1.00 0.00 N ATOM 462 CA ILE A 183 54.719 56.824 30.968 1.00 0.00 C ATOM 463 C ILE A 183 55.457 57.470 29.775 1.00 0.00 C ATOM 464 O ILE A 183 54.816 57.905 28.815 1.00 0.00 O ATOM 465 CB ILE A 183 54.592 57.809 32.155 1.00 0.00 C ATOM 466 CG1 ILE A 183 55.926 58.109 32.860 1.00 0.00 C ATOM 467 CG2 ILE A 183 53.502 57.293 33.117 1.00 0.00 C ATOM 468 CD1 ILE A 183 55.900 59.313 33.804 1.00 0.00 C ATOM 0 H ILE A 183 55.657 55.465 32.282 1.00 0.00 H new ATOM 0 HA ILE A 183 53.705 56.614 30.628 1.00 0.00 H new ATOM 0 HB ILE A 183 54.289 58.779 31.761 1.00 0.00 H new ATOM 0 HG12 ILE A 183 56.227 57.228 33.427 1.00 0.00 H new ATOM 0 HG13 ILE A 183 56.691 58.277 32.102 1.00 0.00 H new ATOM 0 HG21 ILE A 183 53.404 57.980 33.958 1.00 0.00 H new ATOM 0 HG22 ILE A 183 52.551 57.228 32.588 1.00 0.00 H new ATOM 0 HG23 ILE A 183 53.780 56.306 33.486 1.00 0.00 H new ATOM 0 HD11 ILE A 183 56.884 59.445 34.253 1.00 0.00 H new ATOM 0 HD12 ILE A 183 55.634 60.209 33.243 1.00 0.00 H new ATOM 0 HD13 ILE A 183 55.163 59.144 34.589 1.00 0.00 H new ATOM 472 N GLY A 184 56.793 57.401 29.805 1.00 0.00 N ATOM 473 CA GLY A 184 57.691 57.920 28.750 1.00 0.00 C ATOM 474 C GLY A 184 57.462 57.231 27.394 1.00 0.00 C ATOM 475 O GLY A 184 57.588 57.863 26.348 1.00 0.00 O ATOM 0 H GLY A 184 57.299 56.973 30.581 1.00 0.00 H new ATOM 0 HA2 GLY A 184 57.536 58.993 28.640 1.00 0.00 H new ATOM 0 HA3 GLY A 184 58.727 57.778 29.056 1.00 0.00 H new ATOM 479 N ARG A 185 57.208 55.923 27.432 1.00 0.00 N ATOM 480 CA ARG A 185 56.811 55.139 26.254 1.00 0.00 C ATOM 481 C ARG A 185 55.430 55.570 25.734 1.00 0.00 C ATOM 482 O ARG A 185 55.332 56.053 24.606 1.00 0.00 O ATOM 483 CB ARG A 185 56.834 53.655 26.606 1.00 0.00 C ATOM 484 CG ARG A 185 56.612 52.794 25.355 1.00 0.00 C ATOM 485 CD ARG A 185 56.163 51.402 25.780 1.00 0.00 C ATOM 486 NE ARG A 185 55.738 50.639 24.600 1.00 0.00 N ATOM 487 CZ ARG A 185 55.088 49.470 24.638 1.00 0.00 C ATOM 488 NH1 ARG A 185 54.752 48.887 25.789 1.00 0.00 N ATOM 489 NH2 ARG A 185 54.798 48.834 23.493 1.00 0.00 N ATOM 0 H ARG A 185 57.271 55.370 28.287 1.00 0.00 H new ATOM 0 HA ARG A 185 57.522 55.324 25.449 1.00 0.00 H new ATOM 0 HB2 ARG A 185 57.790 53.400 27.063 1.00 0.00 H new ATOM 0 HB3 ARG A 185 56.060 53.440 27.343 1.00 0.00 H new ATOM 0 HG2 ARG A 185 55.860 53.252 24.712 1.00 0.00 H new ATOM 0 HG3 ARG A 185 57.532 52.731 24.774 1.00 0.00 H new ATOM 0 HD2 ARG A 185 56.978 50.885 26.286 1.00 0.00 H new ATOM 0 HD3 ARG A 185 55.342 51.476 26.493 1.00 0.00 H new ATOM 0 HE ARG A 185 55.954 51.029 23.683 1.00 0.00 H new ATOM 0 HH11 ARG A 185 54.990 49.333 26.675 1.00 0.00 H new ATOM 0 HH12 ARG A 185 54.257 47.995 25.784 1.00 0.00 H new ATOM 0 HH21 ARG A 185 55.073 49.242 22.599 1.00 0.00 H new ATOM 0 HH22 ARG A 185 54.303 47.943 23.516 1.00 0.00 H new ATOM 802 N PHE B 165 66.546 64.244 54.528 1.00 0.00 N ATOM 803 CA PHE B 165 66.134 63.000 53.853 1.00 0.00 C ATOM 804 C PHE B 165 64.968 63.188 52.860 1.00 0.00 C ATOM 805 O PHE B 165 65.181 62.939 51.674 1.00 0.00 O ATOM 806 CB PHE B 165 65.867 61.921 54.914 1.00 0.00 C ATOM 807 CG PHE B 165 65.164 60.653 54.412 1.00 0.00 C ATOM 808 CD1 PHE B 165 65.841 59.701 53.600 1.00 0.00 C ATOM 809 CD2 PHE B 165 63.834 60.429 54.809 1.00 0.00 C ATOM 810 CE1 PHE B 165 65.172 58.523 53.207 1.00 0.00 C ATOM 811 CE2 PHE B 165 63.161 59.260 54.414 1.00 0.00 C ATOM 812 CZ PHE B 165 63.839 58.310 53.611 1.00 0.00 C ATOM 0 HA PHE B 165 66.954 62.668 53.216 1.00 0.00 H new ATOM 0 HB2 PHE B 165 66.819 61.634 55.361 1.00 0.00 H new ATOM 0 HB3 PHE B 165 65.262 62.360 55.707 1.00 0.00 H new ATOM 0 HD1 PHE B 165 66.859 59.879 53.287 1.00 0.00 H new ATOM 0 HD2 PHE B 165 63.326 61.160 55.421 1.00 0.00 H new ATOM 0 HE1 PHE B 165 65.679 57.788 52.599 1.00 0.00 H new ATOM 0 HE2 PHE B 165 62.139 59.088 54.719 1.00 0.00 H new ATOM 0 HZ PHE B 165 63.327 57.410 53.304 1.00 0.00 H new ATOM 818 N LEU B 166 63.889 63.855 53.272 1.00 0.00 N ATOM 819 CA LEU B 166 62.682 63.967 52.417 1.00 0.00 C ATOM 820 C LEU B 166 62.857 64.709 51.068 1.00 0.00 C ATOM 821 O LEU B 166 62.555 64.064 50.062 1.00 0.00 O ATOM 822 CB LEU B 166 61.428 64.422 53.194 1.00 0.00 C ATOM 823 CG LEU B 166 60.985 63.419 54.267 1.00 0.00 C ATOM 824 CD1 LEU B 166 59.815 64.007 55.052 1.00 0.00 C ATOM 825 CD2 LEU B 166 60.572 62.070 53.669 1.00 0.00 C ATOM 0 H LEU B 166 63.815 64.323 54.175 1.00 0.00 H new ATOM 0 HA LEU B 166 62.513 62.935 52.108 1.00 0.00 H new ATOM 0 HB2 LEU B 166 61.630 65.384 53.666 1.00 0.00 H new ATOM 0 HB3 LEU B 166 60.610 64.578 52.491 1.00 0.00 H new ATOM 0 HG LEU B 166 61.837 63.238 54.923 1.00 0.00 H new ATOM 0 HD11 LEU B 166 59.496 63.298 55.816 1.00 0.00 H new ATOM 0 HD12 LEU B 166 60.127 64.937 55.528 1.00 0.00 H new ATOM 0 HD13 LEU B 166 58.985 64.207 54.374 1.00 0.00 H new ATOM 0 HD21 LEU B 166 60.267 61.395 54.469 1.00 0.00 H new ATOM 0 HD22 LEU B 166 59.739 62.217 52.981 1.00 0.00 H new ATOM 0 HD23 LEU B 166 61.415 61.637 53.131 1.00 0.00 H new ATOM 831 N PRO B 167 63.401 65.936 50.986 1.00 0.00 N ATOM 832 CA PRO B 167 63.693 66.592 49.686 1.00 0.00 C ATOM 833 C PRO B 167 64.686 65.786 48.821 1.00 0.00 C ATOM 834 O PRO B 167 64.447 65.619 47.624 1.00 0.00 O ATOM 835 CB PRO B 167 64.238 67.974 50.032 1.00 0.00 C ATOM 836 CG PRO B 167 63.564 68.269 51.363 1.00 0.00 C ATOM 837 CD PRO B 167 63.592 66.916 52.075 1.00 0.00 C ATOM 0 HA PRO B 167 62.791 66.657 49.078 1.00 0.00 H new ATOM 0 HB2 PRO B 167 65.325 67.972 50.119 1.00 0.00 H new ATOM 0 HB3 PRO B 167 63.980 68.713 49.274 1.00 0.00 H new ATOM 0 HG2 PRO B 167 64.101 69.032 51.926 1.00 0.00 H new ATOM 0 HG3 PRO B 167 62.545 68.632 51.227 1.00 0.00 H new ATOM 0 HD2 PRO B 167 64.537 66.757 52.594 1.00 0.00 H new ATOM 0 HD3 PRO B 167 62.802 66.842 52.822 1.00 0.00 H new ATOM 843 N SER B 168 65.741 65.272 49.452 1.00 0.00 N ATOM 844 CA SER B 168 66.712 64.349 48.806 1.00 0.00 C ATOM 845 C SER B 168 66.008 63.148 48.153 1.00 0.00 C ATOM 846 O SER B 168 66.048 62.979 46.945 1.00 0.00 O ATOM 847 CB SER B 168 67.744 63.852 49.830 1.00 0.00 C ATOM 848 OG SER B 168 68.390 64.946 50.496 1.00 0.00 O ATOM 0 H SER B 168 65.959 65.476 50.427 1.00 0.00 H new ATOM 0 HA SER B 168 67.221 64.910 48.022 1.00 0.00 H new ATOM 0 HB2 SER B 168 67.252 63.216 50.566 1.00 0.00 H new ATOM 0 HB3 SER B 168 68.491 63.238 49.327 1.00 0.00 H new ATOM 0 HG SER B 168 69.039 64.598 51.142 1.00 0.00 H new ATOM 854 N LEU B 169 65.223 62.449 48.970 1.00 0.00 N ATOM 855 CA LEU B 169 64.336 61.340 48.584 1.00 0.00 C ATOM 856 C LEU B 169 63.383 61.720 47.425 1.00 0.00 C ATOM 857 O LEU B 169 63.460 61.104 46.368 1.00 0.00 O ATOM 858 CB LEU B 169 63.577 60.919 49.847 1.00 0.00 C ATOM 859 CG LEU B 169 62.686 59.700 49.677 1.00 0.00 C ATOM 860 CD1 LEU B 169 63.510 58.406 49.629 1.00 0.00 C ATOM 861 CD2 LEU B 169 61.683 59.682 50.814 1.00 0.00 C ATOM 0 H LEU B 169 65.182 62.646 49.970 1.00 0.00 H new ATOM 0 HA LEU B 169 64.921 60.506 48.195 1.00 0.00 H new ATOM 0 HB2 LEU B 169 64.299 60.716 50.638 1.00 0.00 H new ATOM 0 HB3 LEU B 169 62.964 61.756 50.182 1.00 0.00 H new ATOM 0 HG LEU B 169 62.157 59.760 48.726 1.00 0.00 H new ATOM 0 HD11 LEU B 169 62.842 57.554 49.507 1.00 0.00 H new ATOM 0 HD12 LEU B 169 64.203 58.447 48.789 1.00 0.00 H new ATOM 0 HD13 LEU B 169 64.071 58.297 50.557 1.00 0.00 H new ATOM 0 HD21 LEU B 169 61.032 58.814 50.711 1.00 0.00 H new ATOM 0 HD22 LEU B 169 62.212 59.628 51.765 1.00 0.00 H new ATOM 0 HD23 LEU B 169 61.082 60.591 50.784 1.00 0.00 H new ATOM 867 N LEU B 170 62.649 62.821 47.584 1.00 0.00 N ATOM 868 CA LEU B 170 61.766 63.370 46.530 1.00 0.00 C ATOM 869 C LEU B 170 62.479 63.536 45.181 1.00 0.00 C ATOM 870 O LEU B 170 62.136 62.851 44.221 1.00 0.00 O ATOM 871 CB LEU B 170 61.142 64.696 46.982 1.00 0.00 C ATOM 872 CG LEU B 170 60.011 64.482 47.997 1.00 0.00 C ATOM 873 CD1 LEU B 170 59.777 65.758 48.791 1.00 0.00 C ATOM 874 CD2 LEU B 170 58.706 64.092 47.280 1.00 0.00 C ATOM 0 H LEU B 170 62.643 63.366 48.446 1.00 0.00 H new ATOM 0 HA LEU B 170 60.972 62.639 46.375 1.00 0.00 H new ATOM 0 HB2 LEU B 170 61.912 65.327 47.425 1.00 0.00 H new ATOM 0 HB3 LEU B 170 60.754 65.229 46.114 1.00 0.00 H new ATOM 0 HG LEU B 170 60.305 63.676 48.670 1.00 0.00 H new ATOM 0 HD11 LEU B 170 58.973 65.597 49.509 1.00 0.00 H new ATOM 0 HD12 LEU B 170 60.689 66.028 49.323 1.00 0.00 H new ATOM 0 HD13 LEU B 170 59.501 66.564 48.111 1.00 0.00 H new ATOM 0 HD21 LEU B 170 57.916 63.945 48.017 1.00 0.00 H new ATOM 0 HD22 LEU B 170 58.417 64.887 46.592 1.00 0.00 H new ATOM 0 HD23 LEU B 170 58.859 63.168 46.723 1.00 0.00 H new ATOM 880 N LEU B 171 63.592 64.273 45.188 1.00 0.00 N ATOM 881 CA LEU B 171 64.428 64.452 43.988 1.00 0.00 C ATOM 882 C LEU B 171 65.022 63.147 43.430 1.00 0.00 C ATOM 883 O LEU B 171 64.963 62.948 42.210 1.00 0.00 O ATOM 884 CB LEU B 171 65.502 65.528 44.174 1.00 0.00 C ATOM 885 CG LEU B 171 64.922 66.896 43.801 1.00 0.00 C ATOM 886 CD1 LEU B 171 64.088 67.522 44.922 1.00 0.00 C ATOM 887 CD2 LEU B 171 66.042 67.834 43.341 1.00 0.00 C ATOM 0 H LEU B 171 63.941 64.760 46.014 1.00 0.00 H new ATOM 0 HA LEU B 171 63.736 64.808 43.225 1.00 0.00 H new ATOM 0 HB2 LEU B 171 65.848 65.537 45.208 1.00 0.00 H new ATOM 0 HB3 LEU B 171 66.367 65.305 43.550 1.00 0.00 H new ATOM 0 HG LEU B 171 64.230 66.739 42.974 1.00 0.00 H new ATOM 0 HD11 LEU B 171 63.706 68.489 44.595 1.00 0.00 H new ATOM 0 HD12 LEU B 171 63.253 66.865 45.164 1.00 0.00 H new ATOM 0 HD13 LEU B 171 64.711 67.658 45.806 1.00 0.00 H new ATOM 0 HD21 LEU B 171 65.619 68.804 43.078 1.00 0.00 H new ATOM 0 HD22 LEU B 171 66.765 67.960 44.147 1.00 0.00 H new ATOM 0 HD23 LEU B 171 66.540 67.407 42.470 1.00 0.00 H new ATOM 893 N SER B 172 65.408 62.222 44.304 1.00 0.00 N ATOM 894 CA SER B 172 65.864 60.870 43.888 1.00 0.00 C ATOM 895 C SER B 172 64.809 60.074 43.110 1.00 0.00 C ATOM 896 O SER B 172 65.125 59.452 42.100 1.00 0.00 O ATOM 897 CB SER B 172 66.367 60.047 45.086 1.00 0.00 C ATOM 898 OG SER B 172 65.344 59.406 45.844 1.00 0.00 O ATOM 0 H SER B 172 65.419 62.371 45.313 1.00 0.00 H new ATOM 0 HA SER B 172 66.693 61.049 43.203 1.00 0.00 H new ATOM 0 HB2 SER B 172 67.059 59.288 44.722 1.00 0.00 H new ATOM 0 HB3 SER B 172 66.932 60.703 45.748 1.00 0.00 H new ATOM 0 HG SER B 172 64.625 60.045 46.029 1.00 0.00 H new ATOM 904 N HIS B 173 63.559 60.196 43.545 1.00 0.00 N ATOM 905 CA HIS B 173 62.390 59.592 42.857 1.00 0.00 C ATOM 906 C HIS B 173 62.102 60.237 41.502 1.00 0.00 C ATOM 907 O HIS B 173 61.943 59.530 40.506 1.00 0.00 O ATOM 908 CB HIS B 173 61.171 59.630 43.776 1.00 0.00 C ATOM 909 CG HIS B 173 61.269 58.515 44.815 1.00 0.00 C ATOM 910 ND1 HIS B 173 61.854 58.588 46.006 1.00 0.00 N ATOM 911 CD2 HIS B 173 60.874 57.259 44.628 1.00 0.00 C ATOM 912 CE1 HIS B 173 61.799 57.378 46.557 1.00 0.00 C ATOM 913 NE2 HIS B 173 61.213 56.553 45.702 1.00 0.00 N ATOM 0 H HIS B 173 63.312 60.716 44.387 1.00 0.00 H new ATOM 0 HA HIS B 173 62.633 58.552 42.640 1.00 0.00 H new ATOM 0 HB2 HIS B 173 61.110 60.598 44.273 1.00 0.00 H new ATOM 0 HB3 HIS B 173 60.259 59.514 43.190 1.00 0.00 H new ATOM 0 HD1 HIS B 173 62.270 59.421 46.423 1.00 0.00 H new ATOM 0 HD2 HIS B 173 60.366 56.878 43.754 1.00 0.00 H new ATOM 0 HE1 HIS B 173 62.170 57.113 47.536 1.00 0.00 H new ATOM 918 N LEU B 174 62.173 61.568 41.448 1.00 0.00 N ATOM 919 CA LEU B 174 62.075 62.340 40.185 1.00 0.00 C ATOM 920 C LEU B 174 63.184 61.927 39.196 1.00 0.00 C ATOM 921 O LEU B 174 62.896 61.670 38.028 1.00 0.00 O ATOM 922 CB LEU B 174 62.140 63.846 40.461 1.00 0.00 C ATOM 923 CG LEU B 174 61.132 64.295 41.532 1.00 0.00 C ATOM 924 CD1 LEU B 174 61.417 65.756 41.908 1.00 0.00 C ATOM 925 CD2 LEU B 174 59.666 64.130 41.099 1.00 0.00 C ATOM 0 H LEU B 174 62.300 62.152 42.274 1.00 0.00 H new ATOM 0 HA LEU B 174 61.111 62.113 39.730 1.00 0.00 H new ATOM 0 HB2 LEU B 174 63.148 64.110 40.783 1.00 0.00 H new ATOM 0 HB3 LEU B 174 61.948 64.390 39.536 1.00 0.00 H new ATOM 0 HG LEU B 174 61.264 63.644 42.396 1.00 0.00 H new ATOM 0 HD11 LEU B 174 60.706 66.082 42.667 1.00 0.00 H new ATOM 0 HD12 LEU B 174 62.431 65.840 42.300 1.00 0.00 H new ATOM 0 HD13 LEU B 174 61.317 66.385 41.024 1.00 0.00 H new ATOM 0 HD21 LEU B 174 59.010 64.466 41.902 1.00 0.00 H new ATOM 0 HD22 LEU B 174 59.481 64.727 40.206 1.00 0.00 H new ATOM 0 HD23 LEU B 174 59.467 63.081 40.882 1.00 0.00 H new ATOM 931 N LEU B 175 64.403 61.769 39.708 1.00 0.00 N ATOM 932 CA LEU B 175 65.547 61.229 38.935 1.00 0.00 C ATOM 933 C LEU B 175 65.333 59.787 38.463 1.00 0.00 C ATOM 934 O LEU B 175 65.684 59.449 37.325 1.00 0.00 O ATOM 935 CB LEU B 175 66.850 61.341 39.743 1.00 0.00 C ATOM 936 CG LEU B 175 67.276 62.787 39.992 1.00 0.00 C ATOM 937 CD1 LEU B 175 68.488 62.803 40.928 1.00 0.00 C ATOM 938 CD2 LEU B 175 67.607 63.546 38.693 1.00 0.00 C ATOM 0 H LEU B 175 64.638 62.009 40.671 1.00 0.00 H new ATOM 0 HA LEU B 175 65.624 61.842 38.037 1.00 0.00 H new ATOM 0 HB2 LEU B 175 66.722 60.836 40.700 1.00 0.00 H new ATOM 0 HB3 LEU B 175 67.646 60.820 39.212 1.00 0.00 H new ATOM 0 HG LEU B 175 66.432 63.302 40.451 1.00 0.00 H new ATOM 0 HD11 LEU B 175 68.795 63.833 41.108 1.00 0.00 H new ATOM 0 HD12 LEU B 175 68.223 62.333 41.875 1.00 0.00 H new ATOM 0 HD13 LEU B 175 69.310 62.255 40.468 1.00 0.00 H new ATOM 0 HD21 LEU B 175 67.903 64.567 38.934 1.00 0.00 H new ATOM 0 HD22 LEU B 175 68.425 63.043 38.176 1.00 0.00 H new ATOM 0 HD23 LEU B 175 66.728 63.565 38.049 1.00 0.00 H new ATOM 944 N ALA B 176 64.783 58.940 39.332 1.00 0.00 N ATOM 945 CA ALA B 176 64.347 57.576 38.969 1.00 0.00 C ATOM 946 C ALA B 176 63.320 57.555 37.816 1.00 0.00 C ATOM 947 O ALA B 176 63.528 56.852 36.828 1.00 0.00 O ATOM 948 CB ALA B 176 63.817 56.857 40.208 1.00 0.00 C ATOM 0 H ALA B 176 64.623 59.173 40.312 1.00 0.00 H new ATOM 0 HA ALA B 176 65.219 57.042 38.592 1.00 0.00 H new ATOM 0 HB1 ALA B 176 63.496 55.851 39.936 1.00 0.00 H new ATOM 0 HB2 ALA B 176 64.605 56.796 40.958 1.00 0.00 H new ATOM 0 HB3 ALA B 176 62.970 57.410 40.615 1.00 0.00 H new ATOM 954 N ILE B 177 62.313 58.415 37.912 1.00 0.00 N ATOM 955 CA ILE B 177 61.336 58.657 36.821 1.00 0.00 C ATOM 956 C ILE B 177 62.067 59.151 35.543 1.00 0.00 C ATOM 957 O ILE B 177 61.777 58.668 34.453 1.00 0.00 O ATOM 958 CB ILE B 177 60.212 59.618 37.258 1.00 0.00 C ATOM 959 CG1 ILE B 177 59.519 59.106 38.536 1.00 0.00 C ATOM 960 CG2 ILE B 177 59.140 59.756 36.163 1.00 0.00 C ATOM 961 CD1 ILE B 177 58.775 60.201 39.320 1.00 0.00 C ATOM 0 H ILE B 177 62.138 58.974 38.747 1.00 0.00 H new ATOM 0 HA ILE B 177 60.850 57.711 36.583 1.00 0.00 H new ATOM 0 HB ILE B 177 60.679 60.585 37.443 1.00 0.00 H new ATOM 0 HG12 ILE B 177 58.812 58.322 38.265 1.00 0.00 H new ATOM 0 HG13 ILE B 177 60.266 58.651 39.186 1.00 0.00 H new ATOM 0 HG21 ILE B 177 58.361 60.440 36.500 1.00 0.00 H new ATOM 0 HG22 ILE B 177 59.597 60.147 35.254 1.00 0.00 H new ATOM 0 HG23 ILE B 177 58.702 58.779 35.958 1.00 0.00 H new ATOM 0 HD11 ILE B 177 58.313 59.764 40.206 1.00 0.00 H new ATOM 0 HD12 ILE B 177 59.480 60.975 39.623 1.00 0.00 H new ATOM 0 HD13 ILE B 177 58.003 60.641 38.688 1.00 0.00 H new ATOM 965 N GLY B 178 63.042 60.044 35.724 1.00 0.00 N ATOM 966 CA GLY B 178 63.958 60.537 34.664 1.00 0.00 C ATOM 967 C GLY B 178 64.728 59.429 33.932 1.00 0.00 C ATOM 968 O GLY B 178 64.768 59.431 32.702 1.00 0.00 O ATOM 0 H GLY B 178 63.231 60.463 36.634 1.00 0.00 H new ATOM 0 HA2 GLY B 178 63.380 61.105 33.935 1.00 0.00 H new ATOM 0 HA3 GLY B 178 64.674 61.227 35.110 1.00 0.00 H new ATOM 972 N LEU B 179 65.376 58.551 34.691 1.00 0.00 N ATOM 973 CA LEU B 179 66.041 57.333 34.155 1.00 0.00 C ATOM 974 C LEU B 179 65.040 56.450 33.383 1.00 0.00 C ATOM 975 O LEU B 179 65.337 55.959 32.300 1.00 0.00 O ATOM 976 CB LEU B 179 66.689 56.522 35.292 1.00 0.00 C ATOM 977 CG LEU B 179 67.610 55.424 34.737 1.00 0.00 C ATOM 978 CD1 LEU B 179 68.965 55.991 34.313 1.00 0.00 C ATOM 979 CD2 LEU B 179 67.785 54.291 35.751 1.00 0.00 C ATOM 0 H LEU B 179 65.464 58.650 35.702 1.00 0.00 H new ATOM 0 HA LEU B 179 66.820 57.657 33.465 1.00 0.00 H new ATOM 0 HB2 LEU B 179 67.261 57.189 35.937 1.00 0.00 H new ATOM 0 HB3 LEU B 179 65.912 56.071 35.909 1.00 0.00 H new ATOM 0 HG LEU B 179 67.132 55.013 33.848 1.00 0.00 H new ATOM 0 HD11 LEU B 179 69.591 55.187 33.926 1.00 0.00 H new ATOM 0 HD12 LEU B 179 68.818 56.743 33.537 1.00 0.00 H new ATOM 0 HD13 LEU B 179 69.453 56.448 35.173 1.00 0.00 H new ATOM 0 HD21 LEU B 179 68.441 53.527 35.333 1.00 0.00 H new ATOM 0 HD22 LEU B 179 68.225 54.687 36.666 1.00 0.00 H new ATOM 0 HD23 LEU B 179 66.813 53.851 35.976 1.00 0.00 H new ATOM 985 N GLY B 180 63.871 56.257 33.992 1.00 0.00 N ATOM 986 CA GLY B 180 62.703 55.638 33.338 1.00 0.00 C ATOM 987 C GLY B 180 62.394 56.273 31.968 1.00 0.00 C ATOM 988 O GLY B 180 62.427 55.593 30.953 1.00 0.00 O ATOM 0 H GLY B 180 63.699 56.526 34.961 1.00 0.00 H new ATOM 0 HA2 GLY B 180 62.885 54.571 33.209 1.00 0.00 H new ATOM 0 HA3 GLY B 180 61.832 55.736 33.986 1.00 0.00 H new ATOM 992 N ILE B 181 62.128 57.580 31.969 1.00 0.00 N ATOM 993 CA ILE B 181 61.896 58.398 30.761 1.00 0.00 C ATOM 994 C ILE B 181 63.001 58.231 29.700 1.00 0.00 C ATOM 995 O ILE B 181 62.685 58.050 28.527 1.00 0.00 O ATOM 996 CB ILE B 181 61.625 59.851 31.203 1.00 0.00 C ATOM 997 CG1 ILE B 181 60.205 59.890 31.772 1.00 0.00 C ATOM 998 CG2 ILE B 181 61.820 60.889 30.088 1.00 0.00 C ATOM 999 CD1 ILE B 181 60.017 60.959 32.852 1.00 0.00 C ATOM 0 H ILE B 181 62.065 58.121 32.831 1.00 0.00 H new ATOM 0 HA ILE B 181 61.010 58.043 30.234 1.00 0.00 H new ATOM 0 HB ILE B 181 62.360 60.134 31.956 1.00 0.00 H new ATOM 0 HG12 ILE B 181 59.501 60.074 30.961 1.00 0.00 H new ATOM 0 HG13 ILE B 181 59.961 58.913 32.190 1.00 0.00 H new ATOM 0 HG21 ILE B 181 61.611 61.885 30.478 1.00 0.00 H new ATOM 0 HG22 ILE B 181 62.848 60.848 29.729 1.00 0.00 H new ATOM 0 HG23 ILE B 181 61.140 60.671 29.265 1.00 0.00 H new ATOM 0 HD11 ILE B 181 58.989 60.934 33.214 1.00 0.00 H new ATOM 0 HD12 ILE B 181 60.698 60.763 33.680 1.00 0.00 H new ATOM 0 HD13 ILE B 181 60.230 61.942 32.432 1.00 0.00 H new ATOM 1003 N TYR B 182 64.259 58.332 30.112 1.00 0.00 N ATOM 1004 CA TYR B 182 65.444 57.963 29.300 1.00 0.00 C ATOM 1005 C TYR B 182 65.240 56.666 28.500 1.00 0.00 C ATOM 1006 O TYR B 182 65.137 56.710 27.276 1.00 0.00 O ATOM 1007 CB TYR B 182 66.616 57.875 30.288 1.00 0.00 C ATOM 1008 CG TYR B 182 67.881 57.174 29.832 1.00 0.00 C ATOM 1009 CD1 TYR B 182 68.709 57.795 28.874 1.00 0.00 C ATOM 1010 CD2 TYR B 182 68.388 56.173 30.691 1.00 0.00 C ATOM 1011 CE1 TYR B 182 70.078 57.474 28.839 1.00 0.00 C ATOM 1012 CE2 TYR B 182 69.764 55.867 30.662 1.00 0.00 C ATOM 1013 CZ TYR B 182 70.583 56.536 29.744 1.00 0.00 C ATOM 1014 OH TYR B 182 71.922 56.321 29.800 1.00 0.00 O ATOM 0 H TYR B 182 64.504 58.679 31.039 1.00 0.00 H new ATOM 0 HA TYR B 182 65.637 58.711 28.531 1.00 0.00 H new ATOM 0 HB2 TYR B 182 66.884 58.891 30.580 1.00 0.00 H new ATOM 0 HB3 TYR B 182 66.259 57.369 31.185 1.00 0.00 H new ATOM 0 HD1 TYR B 182 68.297 58.508 28.176 1.00 0.00 H new ATOM 0 HD2 TYR B 182 67.727 55.647 31.364 1.00 0.00 H new ATOM 0 HE1 TYR B 182 70.732 57.947 28.121 1.00 0.00 H new ATOM 0 HE2 TYR B 182 70.178 55.131 31.335 1.00 0.00 H new ATOM 0 HH TYR B 182 72.116 55.641 30.479 1.00 0.00 H new ATOM 1019 N ILE B 183 64.957 55.601 29.238 1.00 0.00 N ATOM 1020 CA ILE B 183 64.630 54.272 28.677 1.00 0.00 C ATOM 1021 C ILE B 183 63.396 54.361 27.759 1.00 0.00 C ATOM 1022 O ILE B 183 63.512 54.000 26.591 1.00 0.00 O ATOM 1023 CB ILE B 183 64.443 53.267 29.835 1.00 0.00 C ATOM 1024 CG1 ILE B 183 65.717 53.179 30.686 1.00 0.00 C ATOM 1025 CG2 ILE B 183 64.071 51.871 29.307 1.00 0.00 C ATOM 1026 CD1 ILE B 183 65.469 52.688 32.115 1.00 0.00 C ATOM 0 H ILE B 183 64.945 55.623 30.258 1.00 0.00 H new ATOM 0 HA ILE B 183 65.450 53.915 28.054 1.00 0.00 H new ATOM 0 HB ILE B 183 63.624 53.630 30.456 1.00 0.00 H new ATOM 0 HG12 ILE B 183 66.424 52.508 30.198 1.00 0.00 H new ATOM 0 HG13 ILE B 183 66.186 54.162 30.725 1.00 0.00 H new ATOM 0 HG21 ILE B 183 63.946 51.186 30.146 1.00 0.00 H new ATOM 0 HG22 ILE B 183 63.139 51.931 28.746 1.00 0.00 H new ATOM 0 HG23 ILE B 183 64.864 51.505 28.655 1.00 0.00 H new ATOM 0 HD11 ILE B 183 66.414 52.651 32.656 1.00 0.00 H new ATOM 0 HD12 ILE B 183 64.787 53.371 32.621 1.00 0.00 H new ATOM 0 HD13 ILE B 183 65.029 51.691 32.086 1.00 0.00 H new