USER MOD reduce.3.24.130724 H: found=0, std=0, add=696, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 695 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: B 57 CYS SG : rot 155:sc= 1.12 USER MOD Set 1.2: B 59 THR OG1 : rot -74:sc= 1.36 USER MOD Set 2.1: B 44 CYS SG : rot -75:sc= 0.213 USER MOD Set 2.2: B 49 CYS SG : rot 153:sc= -0.0491 USER MOD Set 2.3: B 54 CYS SG : rot -60:sc= -0.245 USER MOD Set 2.4: B 56 SER OG : rot 109:sc= 0.319 USER MOD Single : A 329 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 330 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 336 GLN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 337 SER OG : rot 74:sc= 0.0753 USER MOD Single : A 341 ASN : amide:sc= -1.86 K(o=-1.9,f=-3.8!) USER MOD Single : A 348 ASN : amide:sc= -0.0217 K(o=-0.022,f=-2!) USER MOD Single : A 349 ASN : amide:sc= -1.21 K(o=-1.2,f=-2.2!) USER MOD Single : A 354 ASN : amide:sc= -0.0631 K(o=-0.063,f=-1.8!) USER MOD Single : A 356 MET CE :methyl -177:sc= -0.139 (180deg=-0.144) USER MOD Single : A 358 SER OG : rot 78:sc= 0.0118 USER MOD Single : B 25 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.381) USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 36 TYR OH : rot 164:sc= 1.1 USER MOD Single : B 37 TYR OH : rot 105:sc= -1.35 USER MOD Single : B 38 HIS : no HD1:sc= -0.776 K(o=-0.78,f=-0.075) USER MOD Single : B 39 GLN : amide:sc= -0.235 K(o=-0.23,f=-4.6!) USER MOD Single : B 41 THR OG1 : rot -8:sc= -0.0998 USER MOD Single : B 46 ASN : amide:sc= 0 X(o=0,f=-0.041) USER MOD Single : B 50 THR OG1 : rot 180:sc= 0 USER MOD Single : B 51 ASN : amide:sc= 0 X(o=0,f=-0.06) USER MOD Single : B 63 MET CE :methyl 143:sc= -1.18 (180deg=-6.51!) USER MOD Single : B 65 ASN : amide:sc= -1.19 K(o=-1.2,f=-2.1!) USER MOD Single : B 66 ASN : amide:sc= -2.4! C(o=-2.4!,f=-5.2!) USER MOD Single : B 71 LYS NZ :NH3+ 149:sc= -0.25 (180deg=-1.19!) USER MOD Single : B 76 TYR OH : rot -15:sc= -3.25! USER MOD Single : B 77 LYS NZ :NH3+ 159:sc=-0.00844 (180deg=-0.315) USER MOD Single : B 79 ASN : amide:sc= -0.24 K(o=-0.24,f=-1.5!) USER MOD Single : B 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 299 N ASP A 327 42.563 1.576 -7.326 1.00 0.00 N ATOM 300 CA ASP A 327 43.710 2.118 -6.606 1.00 0.00 C ATOM 301 C ASP A 327 43.437 2.149 -5.104 1.00 0.00 C ATOM 302 O ASP A 327 42.516 2.821 -4.643 1.00 0.00 O ATOM 303 CB ASP A 327 44.032 3.529 -7.105 1.00 0.00 C ATOM 304 CG ASP A 327 45.256 4.070 -6.373 1.00 0.00 C ATOM 305 OD1 ASP A 327 45.745 3.387 -5.489 1.00 0.00 O ATOM 306 OD2 ASP A 327 45.685 5.163 -6.707 1.00 0.00 O ATOM 0 HA ASP A 327 44.567 1.470 -6.792 1.00 0.00 H new ATOM 0 HB2 ASP A 327 44.218 3.511 -8.179 1.00 0.00 H new ATOM 0 HB3 ASP A 327 43.178 4.186 -6.940 1.00 0.00 H new ATOM 311 N VAL A 328 44.241 1.418 -4.346 1.00 0.00 N ATOM 312 CA VAL A 328 44.074 1.365 -2.898 1.00 0.00 C ATOM 313 C VAL A 328 44.219 2.761 -2.294 1.00 0.00 C ATOM 314 O VAL A 328 43.503 3.120 -1.358 1.00 0.00 O ATOM 315 CB VAL A 328 45.111 0.427 -2.281 1.00 0.00 C ATOM 316 CG1 VAL A 328 45.049 0.526 -0.756 1.00 0.00 C ATOM 317 CG2 VAL A 328 44.815 -1.010 -2.713 1.00 0.00 C ATOM 0 H VAL A 328 45.012 0.855 -4.705 1.00 0.00 H new ATOM 0 HA VAL A 328 43.075 0.987 -2.680 1.00 0.00 H new ATOM 0 HB VAL A 328 46.107 0.712 -2.620 1.00 0.00 H new ATOM 0 HG11 VAL A 328 45.789 -0.143 -0.318 1.00 0.00 H new ATOM 0 HG12 VAL A 328 45.259 1.550 -0.449 1.00 0.00 H new ATOM 0 HG13 VAL A 328 44.054 0.242 -0.413 1.00 0.00 H new ATOM 0 HG21 VAL A 328 45.553 -1.681 -2.274 1.00 0.00 H new ATOM 0 HG22 VAL A 328 43.819 -1.294 -2.373 1.00 0.00 H new ATOM 0 HG23 VAL A 328 44.861 -1.080 -3.800 1.00 0.00 H new ATOM 327 N MET A 329 45.156 3.535 -2.827 1.00 0.00 N ATOM 328 CA MET A 329 45.398 4.886 -2.332 1.00 0.00 C ATOM 329 C MET A 329 44.184 5.776 -2.579 1.00 0.00 C ATOM 330 O MET A 329 44.156 6.934 -2.165 1.00 0.00 O ATOM 331 CB MET A 329 46.623 5.488 -3.027 1.00 0.00 C ATOM 332 CG MET A 329 47.863 4.657 -2.692 1.00 0.00 C ATOM 333 SD MET A 329 48.231 4.797 -0.922 1.00 0.00 S ATOM 334 CE MET A 329 49.554 3.564 -0.865 1.00 0.00 C ATOM 0 H MET A 329 45.759 3.253 -3.599 1.00 0.00 H new ATOM 0 HA MET A 329 45.580 4.829 -1.259 1.00 0.00 H new ATOM 0 HB2 MET A 329 46.468 5.509 -4.106 1.00 0.00 H new ATOM 0 HB3 MET A 329 46.766 6.519 -2.705 1.00 0.00 H new ATOM 0 HG2 MET A 329 47.696 3.613 -2.957 1.00 0.00 H new ATOM 0 HG3 MET A 329 48.714 5.003 -3.279 1.00 0.00 H new ATOM 0 HE1 MET A 329 49.934 3.485 0.153 1.00 0.00 H new ATOM 0 HE2 MET A 329 49.164 2.597 -1.182 1.00 0.00 H new ATOM 0 HE3 MET A 329 50.362 3.866 -1.532 1.00 0.00 H new ATOM 344 N GLN A 330 43.180 5.222 -3.248 1.00 0.00 N ATOM 345 CA GLN A 330 41.961 5.963 -3.544 1.00 0.00 C ATOM 346 C GLN A 330 41.192 6.254 -2.263 1.00 0.00 C ATOM 347 O GLN A 330 40.469 7.246 -2.182 1.00 0.00 O ATOM 348 CB GLN A 330 41.074 5.165 -4.497 1.00 0.00 C ATOM 349 CG GLN A 330 39.874 6.018 -4.910 1.00 0.00 C ATOM 350 CD GLN A 330 39.034 5.269 -5.939 1.00 0.00 C ATOM 351 OE1 GLN A 330 39.410 4.181 -6.375 1.00 0.00 O ATOM 352 NE2 GLN A 330 37.912 5.791 -6.355 1.00 0.00 N ATOM 0 H GLN A 330 43.186 4.263 -3.595 1.00 0.00 H new ATOM 0 HA GLN A 330 42.241 6.905 -4.016 1.00 0.00 H new ATOM 0 HB2 GLN A 330 41.643 4.868 -5.378 1.00 0.00 H new ATOM 0 HB3 GLN A 330 40.734 4.249 -4.014 1.00 0.00 H new ATOM 0 HG2 GLN A 330 39.268 6.255 -4.036 1.00 0.00 H new ATOM 0 HG3 GLN A 330 40.216 6.965 -5.327 1.00 0.00 H new ATOM 0 HE21 GLN A 330 37.603 6.693 -5.992 1.00 0.00 H new ATOM 0 HE22 GLN A 330 37.344 5.297 -7.043 1.00 0.00 H new ATOM 361 N ASP A 331 41.346 5.379 -1.271 1.00 0.00 N ATOM 362 CA ASP A 331 40.654 5.550 0.006 1.00 0.00 C ATOM 363 C ASP A 331 41.651 5.591 1.169 1.00 0.00 C ATOM 364 O ASP A 331 41.882 4.585 1.849 1.00 0.00 O ATOM 365 CB ASP A 331 39.672 4.401 0.219 1.00 0.00 C ATOM 366 CG ASP A 331 38.649 4.379 -0.912 1.00 0.00 C ATOM 367 OD1 ASP A 331 38.584 5.355 -1.643 1.00 0.00 O ATOM 368 OD2 ASP A 331 37.949 3.390 -1.031 1.00 0.00 O ATOM 0 H ASP A 331 41.939 4.551 -1.325 1.00 0.00 H new ATOM 0 HA ASP A 331 40.114 6.497 -0.022 1.00 0.00 H new ATOM 0 HB2 ASP A 331 40.209 3.453 0.254 1.00 0.00 H new ATOM 0 HB3 ASP A 331 39.166 4.516 1.177 1.00 0.00 H new ATOM 373 N PRO A 332 42.236 6.738 1.412 1.00 0.00 N ATOM 374 CA PRO A 332 43.225 6.925 2.515 1.00 0.00 C ATOM 375 C PRO A 332 42.640 6.509 3.864 1.00 0.00 C ATOM 376 O PRO A 332 43.344 5.978 4.720 1.00 0.00 O ATOM 377 CB PRO A 332 43.520 8.430 2.489 1.00 0.00 C ATOM 378 CG PRO A 332 43.187 8.869 1.104 1.00 0.00 C ATOM 379 CD PRO A 332 42.037 7.984 0.649 1.00 0.00 C ATOM 0 HA PRO A 332 44.118 6.314 2.382 1.00 0.00 H new ATOM 0 HB2 PRO A 332 42.919 8.962 3.226 1.00 0.00 H new ATOM 0 HB3 PRO A 332 44.565 8.631 2.725 1.00 0.00 H new ATOM 0 HG2 PRO A 332 42.901 9.921 1.086 1.00 0.00 H new ATOM 0 HG3 PRO A 332 44.047 8.762 0.443 1.00 0.00 H new ATOM 0 HD2 PRO A 332 41.071 8.438 0.868 1.00 0.00 H new ATOM 0 HD3 PRO A 332 42.069 7.806 -0.426 1.00 0.00 H new ATOM 387 N GLU A 333 41.344 6.753 4.043 1.00 0.00 N ATOM 388 CA GLU A 333 40.677 6.397 5.290 1.00 0.00 C ATOM 389 C GLU A 333 40.721 4.885 5.503 1.00 0.00 C ATOM 390 O GLU A 333 40.907 4.410 6.622 1.00 0.00 O ATOM 391 CB GLU A 333 39.220 6.871 5.261 1.00 0.00 C ATOM 392 CG GLU A 333 39.178 8.400 5.285 1.00 0.00 C ATOM 393 CD GLU A 333 39.632 8.911 6.649 1.00 0.00 C ATOM 394 OE1 GLU A 333 39.702 8.110 7.566 1.00 0.00 O ATOM 395 OE2 GLU A 333 39.901 10.096 6.756 1.00 0.00 O ATOM 0 H GLU A 333 40.741 7.191 3.347 1.00 0.00 H new ATOM 0 HA GLU A 333 41.198 6.886 6.113 1.00 0.00 H new ATOM 0 HB2 GLU A 333 38.723 6.497 4.366 1.00 0.00 H new ATOM 0 HB3 GLU A 333 38.679 6.469 6.117 1.00 0.00 H new ATOM 0 HG2 GLU A 333 39.822 8.802 4.503 1.00 0.00 H new ATOM 0 HG3 GLU A 333 38.167 8.748 5.075 1.00 0.00 H new ATOM 402 N PHE A 334 40.545 4.137 4.417 1.00 0.00 N ATOM 403 CA PHE A 334 40.562 2.682 4.492 1.00 0.00 C ATOM 404 C PHE A 334 41.926 2.200 4.973 1.00 0.00 C ATOM 405 O PHE A 334 42.024 1.325 5.837 1.00 0.00 O ATOM 406 CB PHE A 334 40.253 2.082 3.119 1.00 0.00 C ATOM 407 CG PHE A 334 40.120 0.583 3.245 1.00 0.00 C ATOM 408 CD1 PHE A 334 38.946 0.034 3.779 1.00 0.00 C ATOM 409 CD2 PHE A 334 41.157 -0.256 2.825 1.00 0.00 C ATOM 410 CE1 PHE A 334 38.814 -1.355 3.896 1.00 0.00 C ATOM 411 CE2 PHE A 334 41.025 -1.645 2.944 1.00 0.00 C ATOM 412 CZ PHE A 334 39.852 -2.194 3.478 1.00 0.00 C ATOM 0 H PHE A 334 40.390 4.513 3.481 1.00 0.00 H new ATOM 0 HA PHE A 334 39.800 2.357 5.201 1.00 0.00 H new ATOM 0 HB2 PHE A 334 39.331 2.508 2.723 1.00 0.00 H new ATOM 0 HB3 PHE A 334 41.047 2.330 2.415 1.00 0.00 H new ATOM 0 HD1 PHE A 334 38.144 0.682 4.100 1.00 0.00 H new ATOM 0 HD2 PHE A 334 42.059 0.167 2.409 1.00 0.00 H new ATOM 0 HE1 PHE A 334 37.910 -1.779 4.309 1.00 0.00 H new ATOM 0 HE2 PHE A 334 41.828 -2.293 2.624 1.00 0.00 H new ATOM 0 HZ PHE A 334 39.749 -3.265 3.567 1.00 0.00 H new ATOM 422 N LEU A 335 42.980 2.774 4.406 1.00 0.00 N ATOM 423 CA LEU A 335 44.340 2.394 4.788 1.00 0.00 C ATOM 424 C LEU A 335 44.588 2.691 6.262 1.00 0.00 C ATOM 425 O LEU A 335 45.232 1.910 6.964 1.00 0.00 O ATOM 426 CB LEU A 335 45.355 3.155 3.936 1.00 0.00 C ATOM 427 CG LEU A 335 45.325 2.621 2.500 1.00 0.00 C ATOM 428 CD1 LEU A 335 46.168 3.526 1.601 1.00 0.00 C ATOM 429 CD2 LEU A 335 45.886 1.194 2.455 1.00 0.00 C ATOM 0 H LEU A 335 42.924 3.496 3.688 1.00 0.00 H new ATOM 0 HA LEU A 335 44.456 1.323 4.621 1.00 0.00 H new ATOM 0 HB2 LEU A 335 45.125 4.220 3.943 1.00 0.00 H new ATOM 0 HB3 LEU A 335 46.355 3.042 4.356 1.00 0.00 H new ATOM 0 HG LEU A 335 44.294 2.610 2.148 1.00 0.00 H new ATOM 0 HD11 LEU A 335 46.147 3.146 0.580 1.00 0.00 H new ATOM 0 HD12 LEU A 335 45.763 4.538 1.620 1.00 0.00 H new ATOM 0 HD13 LEU A 335 47.197 3.540 1.961 1.00 0.00 H new ATOM 0 HD21 LEU A 335 45.860 0.825 1.430 1.00 0.00 H new ATOM 0 HD22 LEU A 335 46.915 1.196 2.814 1.00 0.00 H new ATOM 0 HD23 LEU A 335 45.282 0.545 3.090 1.00 0.00 H new ATOM 441 N GLN A 336 44.077 3.824 6.725 1.00 0.00 N ATOM 442 CA GLN A 336 44.252 4.213 8.119 1.00 0.00 C ATOM 443 C GLN A 336 43.603 3.187 9.042 1.00 0.00 C ATOM 444 O GLN A 336 44.155 2.840 10.087 1.00 0.00 O ATOM 445 CB GLN A 336 43.626 5.589 8.357 1.00 0.00 C ATOM 446 CG GLN A 336 43.899 6.037 9.796 1.00 0.00 C ATOM 447 CD GLN A 336 43.266 7.399 10.047 1.00 0.00 C ATOM 448 OE1 GLN A 336 42.062 7.569 9.859 1.00 0.00 O ATOM 449 NE2 GLN A 336 44.009 8.384 10.468 1.00 0.00 N ATOM 0 H GLN A 336 43.542 4.485 6.162 1.00 0.00 H new ATOM 0 HA GLN A 336 45.319 4.258 8.337 1.00 0.00 H new ATOM 0 HB2 GLN A 336 44.039 6.314 7.655 1.00 0.00 H new ATOM 0 HB3 GLN A 336 42.552 5.547 8.176 1.00 0.00 H new ATOM 0 HG2 GLN A 336 43.496 5.305 10.496 1.00 0.00 H new ATOM 0 HG3 GLN A 336 44.973 6.088 9.972 1.00 0.00 H new ATOM 0 HE21 GLN A 336 45.007 8.240 10.623 1.00 0.00 H new ATOM 0 HE22 GLN A 336 43.592 9.299 10.642 1.00 0.00 H new ATOM 458 N SER A 337 42.426 2.706 8.654 1.00 0.00 N ATOM 459 CA SER A 337 41.715 1.723 9.460 1.00 0.00 C ATOM 460 C SER A 337 42.546 0.454 9.610 1.00 0.00 C ATOM 461 O SER A 337 42.583 -0.156 10.676 1.00 0.00 O ATOM 462 CB SER A 337 40.372 1.385 8.806 1.00 0.00 C ATOM 463 OG SER A 337 39.532 2.531 8.845 1.00 0.00 O ATOM 0 H SER A 337 41.949 2.978 7.795 1.00 0.00 H new ATOM 0 HA SER A 337 41.540 2.147 10.449 1.00 0.00 H new ATOM 0 HB2 SER A 337 40.526 1.067 7.775 1.00 0.00 H new ATOM 0 HB3 SER A 337 39.898 0.554 9.329 1.00 0.00 H new ATOM 0 HG SER A 337 39.844 3.188 8.188 1.00 0.00 H new ATOM 469 N VAL A 338 43.211 0.058 8.532 1.00 0.00 N ATOM 470 CA VAL A 338 44.035 -1.145 8.556 1.00 0.00 C ATOM 471 C VAL A 338 45.169 -0.988 9.566 1.00 0.00 C ATOM 472 O VAL A 338 45.443 -1.894 10.352 1.00 0.00 O ATOM 473 CB VAL A 338 44.619 -1.405 7.167 1.00 0.00 C ATOM 474 CG1 VAL A 338 45.604 -2.572 7.235 1.00 0.00 C ATOM 475 CG2 VAL A 338 43.490 -1.738 6.186 1.00 0.00 C ATOM 0 H VAL A 338 43.197 0.547 7.637 1.00 0.00 H new ATOM 0 HA VAL A 338 43.411 -1.989 8.849 1.00 0.00 H new ATOM 0 HB VAL A 338 45.141 -0.512 6.823 1.00 0.00 H new ATOM 0 HG11 VAL A 338 46.019 -2.756 6.244 1.00 0.00 H new ATOM 0 HG12 VAL A 338 46.410 -2.328 7.927 1.00 0.00 H new ATOM 0 HG13 VAL A 338 45.086 -3.466 7.583 1.00 0.00 H new ATOM 0 HG21 VAL A 338 43.910 -1.923 5.197 1.00 0.00 H new ATOM 0 HG22 VAL A 338 42.962 -2.628 6.528 1.00 0.00 H new ATOM 0 HG23 VAL A 338 42.794 -0.901 6.134 1.00 0.00 H new ATOM 485 N LEU A 339 45.823 0.169 9.541 1.00 0.00 N ATOM 486 CA LEU A 339 46.923 0.430 10.463 1.00 0.00 C ATOM 487 C LEU A 339 46.429 0.371 11.902 1.00 0.00 C ATOM 488 O LEU A 339 47.109 -0.160 12.780 1.00 0.00 O ATOM 489 CB LEU A 339 47.519 1.810 10.178 1.00 0.00 C ATOM 490 CG LEU A 339 48.258 1.784 8.836 1.00 0.00 C ATOM 491 CD1 LEU A 339 48.680 3.205 8.458 1.00 0.00 C ATOM 492 CD2 LEU A 339 49.503 0.894 8.934 1.00 0.00 C ATOM 0 H LEU A 339 45.613 0.934 8.899 1.00 0.00 H new ATOM 0 HA LEU A 339 47.690 -0.332 10.322 1.00 0.00 H new ATOM 0 HB2 LEU A 339 46.729 2.561 10.155 1.00 0.00 H new ATOM 0 HB3 LEU A 339 48.205 2.093 10.977 1.00 0.00 H new ATOM 0 HG LEU A 339 47.591 1.382 8.073 1.00 0.00 H new ATOM 0 HD11 LEU A 339 49.206 3.187 7.503 1.00 0.00 H new ATOM 0 HD12 LEU A 339 47.796 3.837 8.373 1.00 0.00 H new ATOM 0 HD13 LEU A 339 49.340 3.606 9.228 1.00 0.00 H new ATOM 0 HD21 LEU A 339 50.019 0.884 7.974 1.00 0.00 H new ATOM 0 HD22 LEU A 339 50.171 1.286 9.701 1.00 0.00 H new ATOM 0 HD23 LEU A 339 49.205 -0.121 9.196 1.00 0.00 H new ATOM 504 N GLU A 340 45.240 0.915 12.135 1.00 0.00 N ATOM 505 CA GLU A 340 44.658 0.913 13.471 1.00 0.00 C ATOM 506 C GLU A 340 44.386 -0.517 13.932 1.00 0.00 C ATOM 507 O GLU A 340 44.582 -0.851 15.101 1.00 0.00 O ATOM 508 CB GLU A 340 43.353 1.708 13.474 1.00 0.00 C ATOM 509 CG GLU A 340 43.661 3.193 13.298 1.00 0.00 C ATOM 510 CD GLU A 340 42.369 3.974 13.087 1.00 0.00 C ATOM 511 OE1 GLU A 340 41.341 3.343 12.910 1.00 0.00 O ATOM 512 OE2 GLU A 340 42.428 5.192 13.102 1.00 0.00 O ATOM 0 H GLU A 340 44.664 1.360 11.421 1.00 0.00 H new ATOM 0 HA GLU A 340 45.366 1.377 14.157 1.00 0.00 H new ATOM 0 HB2 GLU A 340 42.703 1.363 12.670 1.00 0.00 H new ATOM 0 HB3 GLU A 340 42.818 1.545 14.409 1.00 0.00 H new ATOM 0 HG2 GLU A 340 44.184 3.571 14.177 1.00 0.00 H new ATOM 0 HG3 GLU A 340 44.325 3.336 12.446 1.00 0.00 H new ATOM 519 N ASN A 341 43.930 -1.355 13.005 1.00 0.00 N ATOM 520 CA ASN A 341 43.628 -2.741 13.325 1.00 0.00 C ATOM 521 C ASN A 341 44.875 -3.446 13.832 1.00 0.00 C ATOM 522 O ASN A 341 44.808 -4.271 14.750 1.00 0.00 O ATOM 523 CB ASN A 341 43.101 -3.463 12.082 1.00 0.00 C ATOM 524 CG ASN A 341 42.648 -4.872 12.448 1.00 0.00 C ATOM 525 OD1 ASN A 341 43.108 -5.437 13.440 1.00 0.00 O ATOM 526 ND2 ASN A 341 41.763 -5.474 11.702 1.00 0.00 N ATOM 0 H ASN A 341 43.763 -1.098 12.032 1.00 0.00 H new ATOM 0 HA ASN A 341 42.865 -2.761 14.103 1.00 0.00 H new ATOM 0 HB2 ASN A 341 42.269 -2.905 11.653 1.00 0.00 H new ATOM 0 HB3 ASN A 341 43.880 -3.509 11.321 1.00 0.00 H new ATOM 0 HD21 ASN A 341 41.451 -6.415 11.940 1.00 0.00 H new ATOM 0 HD22 ASN A 341 41.383 -5.003 10.881 1.00 0.00 H new ATOM 533 N LEU A 342 46.011 -3.138 13.218 1.00 0.00 N ATOM 534 CA LEU A 342 47.254 -3.778 13.607 1.00 0.00 C ATOM 535 C LEU A 342 47.539 -3.563 15.101 1.00 0.00 C ATOM 536 O LEU A 342 47.391 -2.454 15.625 1.00 0.00 O ATOM 537 CB LEU A 342 48.418 -3.219 12.788 1.00 0.00 C ATOM 538 CG LEU A 342 48.248 -3.623 11.321 1.00 0.00 C ATOM 539 CD1 LEU A 342 49.325 -2.946 10.473 1.00 0.00 C ATOM 540 CD2 LEU A 342 48.371 -5.147 11.176 1.00 0.00 C ATOM 0 H LEU A 342 46.094 -2.460 12.461 1.00 0.00 H new ATOM 0 HA LEU A 342 47.152 -4.846 13.416 1.00 0.00 H new ATOM 0 HB2 LEU A 342 48.451 -2.133 12.876 1.00 0.00 H new ATOM 0 HB3 LEU A 342 49.364 -3.599 13.174 1.00 0.00 H new ATOM 0 HG LEU A 342 47.261 -3.308 10.981 1.00 0.00 H new ATOM 0 HD11 LEU A 342 49.202 -3.235 9.429 1.00 0.00 H new ATOM 0 HD12 LEU A 342 49.232 -1.864 10.563 1.00 0.00 H new ATOM 0 HD13 LEU A 342 50.310 -3.256 10.821 1.00 0.00 H new ATOM 0 HD21 LEU A 342 48.249 -5.424 10.129 1.00 0.00 H new ATOM 0 HD22 LEU A 342 49.353 -5.467 11.524 1.00 0.00 H new ATOM 0 HD23 LEU A 342 47.599 -5.633 11.772 1.00 0.00 H new ATOM 552 N PRO A 343 47.941 -4.595 15.806 1.00 0.00 N ATOM 553 CA PRO A 343 48.233 -4.497 17.265 1.00 0.00 C ATOM 554 C PRO A 343 49.504 -3.708 17.559 1.00 0.00 C ATOM 555 O PRO A 343 50.518 -3.868 16.881 1.00 0.00 O ATOM 556 CB PRO A 343 48.382 -5.959 17.697 1.00 0.00 C ATOM 557 CG PRO A 343 48.794 -6.698 16.471 1.00 0.00 C ATOM 558 CD PRO A 343 48.182 -5.958 15.298 1.00 0.00 C ATOM 0 HA PRO A 343 47.450 -3.961 17.802 1.00 0.00 H new ATOM 0 HB2 PRO A 343 49.128 -6.061 18.485 1.00 0.00 H new ATOM 0 HB3 PRO A 343 47.444 -6.348 18.093 1.00 0.00 H new ATOM 0 HG2 PRO A 343 49.880 -6.732 16.385 1.00 0.00 H new ATOM 0 HG3 PRO A 343 48.445 -7.730 16.504 1.00 0.00 H new ATOM 0 HD2 PRO A 343 48.854 -5.949 14.440 1.00 0.00 H new ATOM 0 HD3 PRO A 343 47.255 -6.429 14.971 1.00 0.00 H new ATOM 566 N GLY A 344 49.442 -2.858 18.579 1.00 0.00 N ATOM 567 CA GLY A 344 50.593 -2.055 18.956 1.00 0.00 C ATOM 568 C GLY A 344 50.742 -0.852 18.034 1.00 0.00 C ATOM 569 O GLY A 344 51.687 -0.075 18.176 1.00 0.00 O ATOM 0 H GLY A 344 48.612 -2.710 19.154 1.00 0.00 H new ATOM 0 HA2 GLY A 344 50.484 -1.717 19.987 1.00 0.00 H new ATOM 0 HA3 GLY A 344 51.496 -2.664 18.914 1.00 0.00 H new ATOM 573 N VAL A 345 49.813 -0.707 17.089 1.00 0.00 N ATOM 574 CA VAL A 345 49.869 0.406 16.153 1.00 0.00 C ATOM 575 C VAL A 345 48.707 1.348 16.389 1.00 0.00 C ATOM 576 O VAL A 345 47.543 0.939 16.341 1.00 0.00 O ATOM 577 CB VAL A 345 49.811 -0.122 14.722 1.00 0.00 C ATOM 578 CG1 VAL A 345 49.863 1.047 13.738 1.00 0.00 C ATOM 579 CG2 VAL A 345 51.002 -1.052 14.474 1.00 0.00 C ATOM 0 H VAL A 345 49.024 -1.339 16.955 1.00 0.00 H new ATOM 0 HA VAL A 345 50.803 0.947 16.306 1.00 0.00 H new ATOM 0 HB VAL A 345 48.881 -0.672 14.578 1.00 0.00 H new ATOM 0 HG11 VAL A 345 49.821 0.666 12.718 1.00 0.00 H new ATOM 0 HG12 VAL A 345 49.014 1.708 13.913 1.00 0.00 H new ATOM 0 HG13 VAL A 345 50.790 1.602 13.881 1.00 0.00 H new ATOM 0 HG21 VAL A 345 50.962 -1.430 13.452 1.00 0.00 H new ATOM 0 HG22 VAL A 345 51.931 -0.501 14.621 1.00 0.00 H new ATOM 0 HG23 VAL A 345 50.962 -1.888 15.172 1.00 0.00 H new ATOM 589 N ASP A 346 49.028 2.617 16.634 1.00 0.00 N ATOM 590 CA ASP A 346 47.995 3.607 16.865 1.00 0.00 C ATOM 591 C ASP A 346 48.290 4.894 16.088 1.00 0.00 C ATOM 592 O ASP A 346 49.452 5.213 15.831 1.00 0.00 O ATOM 593 CB ASP A 346 47.876 3.928 18.355 1.00 0.00 C ATOM 594 CG ASP A 346 47.218 2.762 19.079 1.00 0.00 C ATOM 595 OD1 ASP A 346 46.558 1.980 18.417 1.00 0.00 O ATOM 596 OD2 ASP A 346 47.378 2.675 20.285 1.00 0.00 O ATOM 0 H ASP A 346 49.983 2.974 16.676 1.00 0.00 H new ATOM 0 HA ASP A 346 47.052 3.189 16.514 1.00 0.00 H new ATOM 0 HB2 ASP A 346 48.863 4.120 18.776 1.00 0.00 H new ATOM 0 HB3 ASP A 346 47.288 4.835 18.496 1.00 0.00 H new ATOM 601 N PRO A 347 47.276 5.648 15.732 1.00 0.00 N ATOM 602 CA PRO A 347 47.449 6.932 14.983 1.00 0.00 C ATOM 603 C PRO A 347 48.300 7.943 15.761 1.00 0.00 C ATOM 604 O PRO A 347 48.921 8.829 15.173 1.00 0.00 O ATOM 605 CB PRO A 347 46.020 7.458 14.816 1.00 0.00 C ATOM 606 CG PRO A 347 45.135 6.281 15.016 1.00 0.00 C ATOM 607 CD PRO A 347 45.852 5.371 15.985 1.00 0.00 C ATOM 0 HA PRO A 347 47.968 6.780 14.037 1.00 0.00 H new ATOM 0 HB2 PRO A 347 45.803 8.240 15.544 1.00 0.00 H new ATOM 0 HB3 PRO A 347 45.876 7.893 13.827 1.00 0.00 H new ATOM 0 HG2 PRO A 347 44.167 6.586 15.413 1.00 0.00 H new ATOM 0 HG3 PRO A 347 44.946 5.771 14.071 1.00 0.00 H new ATOM 0 HD2 PRO A 347 45.578 5.589 17.017 1.00 0.00 H new ATOM 0 HD3 PRO A 347 45.609 4.324 15.806 1.00 0.00 H new ATOM 615 N ASN A 348 48.311 7.809 17.084 1.00 0.00 N ATOM 616 CA ASN A 348 49.072 8.721 17.930 1.00 0.00 C ATOM 617 C ASN A 348 50.570 8.479 17.776 1.00 0.00 C ATOM 618 O ASN A 348 51.385 9.314 18.173 1.00 0.00 O ATOM 619 CB ASN A 348 48.673 8.528 19.396 1.00 0.00 C ATOM 620 CG ASN A 348 47.264 9.065 19.629 1.00 0.00 C ATOM 621 OD1 ASN A 348 46.765 9.865 18.838 1.00 0.00 O ATOM 622 ND2 ASN A 348 46.590 8.672 20.676 1.00 0.00 N ATOM 0 H ASN A 348 47.805 7.082 17.590 1.00 0.00 H new ATOM 0 HA ASN A 348 48.848 9.742 17.620 1.00 0.00 H new ATOM 0 HB2 ASN A 348 48.716 7.471 19.657 1.00 0.00 H new ATOM 0 HB3 ASN A 348 49.380 9.045 20.045 1.00 0.00 H new ATOM 0 HD21 ASN A 348 45.648 9.028 20.839 1.00 0.00 H new ATOM 0 HD22 ASN A 348 47.005 8.009 21.330 1.00 0.00 H new ATOM 629 N ASN A 349 50.932 7.338 17.196 1.00 0.00 N ATOM 630 CA ASN A 349 52.332 7.010 16.997 1.00 0.00 C ATOM 631 C ASN A 349 52.971 7.974 16.006 1.00 0.00 C ATOM 632 O ASN A 349 52.404 8.270 14.953 1.00 0.00 O ATOM 633 CB ASN A 349 52.457 5.577 16.473 1.00 0.00 C ATOM 634 CG ASN A 349 52.281 4.583 17.617 1.00 0.00 C ATOM 635 OD1 ASN A 349 52.394 4.955 18.786 1.00 0.00 O ATOM 636 ND2 ASN A 349 52.019 3.332 17.351 1.00 0.00 N ATOM 0 H ASN A 349 50.277 6.632 16.859 1.00 0.00 H new ATOM 0 HA ASN A 349 52.849 7.096 17.953 1.00 0.00 H new ATOM 0 HB2 ASN A 349 51.705 5.396 15.705 1.00 0.00 H new ATOM 0 HB3 ASN A 349 53.431 5.436 16.005 1.00 0.00 H new ATOM 0 HD21 ASN A 349 51.908 2.661 18.111 1.00 0.00 H new ATOM 0 HD22 ASN A 349 51.926 3.025 16.383 1.00 0.00 H new ATOM 643 N GLU A 350 54.156 8.455 16.350 1.00 0.00 N ATOM 644 CA GLU A 350 54.877 9.383 15.489 1.00 0.00 C ATOM 645 C GLU A 350 55.241 8.712 14.171 1.00 0.00 C ATOM 646 O GLU A 350 55.213 9.345 13.114 1.00 0.00 O ATOM 647 CB GLU A 350 56.147 9.876 16.185 1.00 0.00 C ATOM 648 CG GLU A 350 55.766 10.798 17.348 1.00 0.00 C ATOM 649 CD GLU A 350 57.009 11.174 18.144 1.00 0.00 C ATOM 650 OE1 GLU A 350 58.041 10.564 17.918 1.00 0.00 O ATOM 651 OE2 GLU A 350 56.912 12.068 18.969 1.00 0.00 O ATOM 0 H GLU A 350 54.639 8.219 17.217 1.00 0.00 H new ATOM 0 HA GLU A 350 54.229 10.235 15.285 1.00 0.00 H new ATOM 0 HB2 GLU A 350 56.725 9.029 16.553 1.00 0.00 H new ATOM 0 HB3 GLU A 350 56.780 10.410 15.476 1.00 0.00 H new ATOM 0 HG2 GLU A 350 55.283 11.697 16.966 1.00 0.00 H new ATOM 0 HG3 GLU A 350 55.046 10.300 17.997 1.00 0.00 H new ATOM 658 N ALA A 351 55.591 7.433 14.241 1.00 0.00 N ATOM 659 CA ALA A 351 55.974 6.692 13.041 1.00 0.00 C ATOM 660 C ALA A 351 54.823 6.651 12.043 1.00 0.00 C ATOM 661 O ALA A 351 55.016 6.876 10.849 1.00 0.00 O ATOM 662 CB ALA A 351 56.368 5.264 13.420 1.00 0.00 C ATOM 0 H ALA A 351 55.618 6.891 15.105 1.00 0.00 H new ATOM 0 HA ALA A 351 56.822 7.198 12.579 1.00 0.00 H new ATOM 0 HB1 ALA A 351 56.653 4.715 12.523 1.00 0.00 H new ATOM 0 HB2 ALA A 351 57.210 5.290 14.112 1.00 0.00 H new ATOM 0 HB3 ALA A 351 55.522 4.767 13.896 1.00 0.00 H new ATOM 668 N ILE A 352 53.624 6.379 12.542 1.00 0.00 N ATOM 669 CA ILE A 352 52.447 6.327 11.685 1.00 0.00 C ATOM 670 C ILE A 352 52.164 7.692 11.077 1.00 0.00 C ATOM 671 O ILE A 352 51.863 7.801 9.888 1.00 0.00 O ATOM 672 CB ILE A 352 51.233 5.851 12.487 1.00 0.00 C ATOM 673 CG1 ILE A 352 51.259 4.322 12.600 1.00 0.00 C ATOM 674 CG2 ILE A 352 49.945 6.291 11.787 1.00 0.00 C ATOM 675 CD1 ILE A 352 52.506 3.874 13.368 1.00 0.00 C ATOM 0 H ILE A 352 53.442 6.192 13.528 1.00 0.00 H new ATOM 0 HA ILE A 352 52.641 5.621 10.877 1.00 0.00 H new ATOM 0 HB ILE A 352 51.268 6.289 13.484 1.00 0.00 H new ATOM 0 HG12 ILE A 352 50.362 3.972 13.111 1.00 0.00 H new ATOM 0 HG13 ILE A 352 51.254 3.876 11.606 1.00 0.00 H new ATOM 0 HG21 ILE A 352 49.084 5.950 12.362 1.00 0.00 H new ATOM 0 HG22 ILE A 352 49.924 7.378 11.713 1.00 0.00 H new ATOM 0 HG23 ILE A 352 49.908 5.859 10.787 1.00 0.00 H new ATOM 0 HD11 ILE A 352 52.516 2.787 13.443 1.00 0.00 H new ATOM 0 HD12 ILE A 352 53.399 4.209 12.840 1.00 0.00 H new ATOM 0 HD13 ILE A 352 52.492 4.307 14.368 1.00 0.00 H new ATOM 687 N ARG A 353 52.255 8.728 11.897 1.00 0.00 N ATOM 688 CA ARG A 353 51.995 10.080 11.420 1.00 0.00 C ATOM 689 C ARG A 353 52.990 10.460 10.326 1.00 0.00 C ATOM 690 O ARG A 353 52.611 11.006 9.291 1.00 0.00 O ATOM 691 CB ARG A 353 52.107 11.072 12.583 1.00 0.00 C ATOM 692 CG ARG A 353 51.605 12.454 12.148 1.00 0.00 C ATOM 693 CD ARG A 353 50.095 12.548 12.381 1.00 0.00 C ATOM 694 NE ARG A 353 49.806 12.519 13.808 1.00 0.00 N ATOM 695 CZ ARG A 353 48.556 12.498 14.255 1.00 0.00 C ATOM 696 NH1 ARG A 353 48.322 12.471 15.539 1.00 0.00 N ATOM 697 NH2 ARG A 353 47.562 12.502 13.410 1.00 0.00 N ATOM 0 H ARG A 353 52.504 8.662 12.884 1.00 0.00 H new ATOM 0 HA ARG A 353 50.987 10.115 11.007 1.00 0.00 H new ATOM 0 HB2 ARG A 353 51.524 10.716 13.432 1.00 0.00 H new ATOM 0 HB3 ARG A 353 53.143 11.141 12.914 1.00 0.00 H new ATOM 0 HG2 ARG A 353 52.119 13.233 12.711 1.00 0.00 H new ATOM 0 HG3 ARG A 353 51.832 12.620 11.095 1.00 0.00 H new ATOM 0 HD2 ARG A 353 49.708 13.468 11.942 1.00 0.00 H new ATOM 0 HD3 ARG A 353 49.590 11.720 11.883 1.00 0.00 H new ATOM 0 HE ARG A 353 50.577 12.515 14.476 1.00 0.00 H new ATOM 0 HH11 ARG A 353 49.100 12.466 16.199 1.00 0.00 H new ATOM 0 HH12 ARG A 353 47.362 12.455 15.882 1.00 0.00 H new ATOM 0 HH21 ARG A 353 47.746 12.521 12.407 1.00 0.00 H new ATOM 0 HH22 ARG A 353 46.601 12.486 13.753 1.00 0.00 H new ATOM 711 N ASN A 354 54.261 10.168 10.567 1.00 0.00 N ATOM 712 CA ASN A 354 55.301 10.482 9.599 1.00 0.00 C ATOM 713 C ASN A 354 55.092 9.688 8.313 1.00 0.00 C ATOM 714 O ASN A 354 55.320 10.195 7.215 1.00 0.00 O ATOM 715 CB ASN A 354 56.677 10.165 10.182 1.00 0.00 C ATOM 716 CG ASN A 354 57.031 11.179 11.265 1.00 0.00 C ATOM 717 OD1 ASN A 354 56.465 12.271 11.303 1.00 0.00 O ATOM 718 ND2 ASN A 354 57.941 10.882 12.152 1.00 0.00 N ATOM 0 H ASN A 354 54.595 9.717 11.419 1.00 0.00 H new ATOM 0 HA ASN A 354 55.246 11.546 9.369 1.00 0.00 H new ATOM 0 HB2 ASN A 354 56.681 9.158 10.600 1.00 0.00 H new ATOM 0 HB3 ASN A 354 57.429 10.186 9.393 1.00 0.00 H new ATOM 0 HD21 ASN A 354 58.184 11.556 12.878 1.00 0.00 H new ATOM 0 HD22 ASN A 354 58.409 9.976 12.119 1.00 0.00 H new ATOM 725 N ALA A 355 54.666 8.438 8.460 1.00 0.00 N ATOM 726 CA ALA A 355 54.440 7.582 7.304 1.00 0.00 C ATOM 727 C ALA A 355 53.376 8.177 6.390 1.00 0.00 C ATOM 728 O ALA A 355 53.530 8.187 5.168 1.00 0.00 O ATOM 729 CB ALA A 355 53.990 6.195 7.768 1.00 0.00 C ATOM 0 H ALA A 355 54.472 7.999 9.360 1.00 0.00 H new ATOM 0 HA ALA A 355 55.375 7.502 6.749 1.00 0.00 H new ATOM 0 HB1 ALA A 355 53.822 5.558 6.900 1.00 0.00 H new ATOM 0 HB2 ALA A 355 54.762 5.754 8.398 1.00 0.00 H new ATOM 0 HB3 ALA A 355 53.065 6.284 8.337 1.00 0.00 H new ATOM 735 N MET A 356 52.299 8.674 6.984 1.00 0.00 N ATOM 736 CA MET A 356 51.220 9.265 6.205 1.00 0.00 C ATOM 737 C MET A 356 51.702 10.529 5.501 1.00 0.00 C ATOM 738 O MET A 356 51.339 10.789 4.355 1.00 0.00 O ATOM 739 CB MET A 356 50.046 9.609 7.125 1.00 0.00 C ATOM 740 CG MET A 356 49.440 8.328 7.711 1.00 0.00 C ATOM 741 SD MET A 356 48.748 7.298 6.388 1.00 0.00 S ATOM 742 CE MET A 356 50.019 6.007 6.405 1.00 0.00 C ATOM 0 H MET A 356 52.150 8.680 7.993 1.00 0.00 H new ATOM 0 HA MET A 356 50.897 8.544 5.454 1.00 0.00 H new ATOM 0 HB2 MET A 356 50.384 10.261 7.930 1.00 0.00 H new ATOM 0 HB3 MET A 356 49.287 10.158 6.568 1.00 0.00 H new ATOM 0 HG2 MET A 356 50.204 7.771 8.253 1.00 0.00 H new ATOM 0 HG3 MET A 356 48.660 8.582 8.429 1.00 0.00 H new ATOM 0 HE1 MET A 356 49.813 5.284 5.616 1.00 0.00 H new ATOM 0 HE2 MET A 356 50.997 6.458 6.238 1.00 0.00 H new ATOM 0 HE3 MET A 356 50.012 5.502 7.371 1.00 0.00 H new ATOM 752 N GLY A 357 52.526 11.311 6.195 1.00 0.00 N ATOM 753 CA GLY A 357 53.052 12.544 5.620 1.00 0.00 C ATOM 754 C GLY A 357 53.904 12.247 4.390 1.00 0.00 C ATOM 755 O GLY A 357 53.790 12.920 3.366 1.00 0.00 O ATOM 0 H GLY A 357 52.840 11.115 7.145 1.00 0.00 H new ATOM 0 HA2 GLY A 357 52.228 13.204 5.347 1.00 0.00 H new ATOM 0 HA3 GLY A 357 53.650 13.071 6.363 1.00 0.00 H new ATOM 759 N SER A 358 54.755 11.231 4.499 1.00 0.00 N ATOM 760 CA SER A 358 55.618 10.849 3.387 1.00 0.00 C ATOM 761 C SER A 358 54.789 10.327 2.221 1.00 0.00 C ATOM 762 O SER A 358 55.067 10.629 1.062 1.00 0.00 O ATOM 763 CB SER A 358 56.607 9.774 3.837 1.00 0.00 C ATOM 764 OG SER A 358 57.504 10.330 4.789 1.00 0.00 O ATOM 0 H SER A 358 54.865 10.662 5.338 1.00 0.00 H new ATOM 0 HA SER A 358 56.168 11.731 3.059 1.00 0.00 H new ATOM 0 HB2 SER A 358 56.072 8.931 4.274 1.00 0.00 H new ATOM 0 HB3 SER A 358 57.160 9.391 2.980 1.00 0.00 H new ATOM 0 HG SER A 358 57.062 10.385 5.662 1.00 0.00 H new ATOM 770 N LEU A 359 53.770 9.535 2.539 1.00 0.00 N ATOM 771 CA LEU A 359 52.913 8.969 1.508 1.00 0.00 C ATOM 772 C LEU A 359 52.205 10.078 0.738 1.00 0.00 C ATOM 773 O LEU A 359 52.131 10.045 -0.490 1.00 0.00 O ATOM 774 CB LEU A 359 51.872 8.035 2.144 1.00 0.00 C ATOM 775 CG LEU A 359 50.976 7.428 1.055 1.00 0.00 C ATOM 776 CD1 LEU A 359 51.825 6.600 0.089 1.00 0.00 C ATOM 777 CD2 LEU A 359 49.924 6.530 1.705 1.00 0.00 C ATOM 0 H LEU A 359 53.521 9.274 3.493 1.00 0.00 H new ATOM 0 HA LEU A 359 53.533 8.399 0.816 1.00 0.00 H new ATOM 0 HB2 LEU A 359 52.374 7.241 2.698 1.00 0.00 H new ATOM 0 HB3 LEU A 359 51.264 8.588 2.860 1.00 0.00 H new ATOM 0 HG LEU A 359 50.484 8.230 0.505 1.00 0.00 H new ATOM 0 HD11 LEU A 359 51.185 6.171 -0.682 1.00 0.00 H new ATOM 0 HD12 LEU A 359 52.575 7.240 -0.376 1.00 0.00 H new ATOM 0 HD13 LEU A 359 52.321 5.798 0.636 1.00 0.00 H new ATOM 0 HD21 LEU A 359 49.287 6.098 0.933 1.00 0.00 H new ATOM 0 HD22 LEU A 359 50.419 5.730 2.256 1.00 0.00 H new ATOM 0 HD23 LEU A 359 49.315 7.120 2.390 1.00 0.00 H new ATOM 789 N ALA A 360 51.678 11.054 1.467 1.00 0.00 N ATOM 790 CA ALA A 360 50.972 12.164 0.842 1.00 0.00 C ATOM 791 C ALA A 360 51.907 12.954 -0.067 1.00 0.00 C ATOM 792 O ALA A 360 51.524 13.369 -1.160 1.00 0.00 O ATOM 793 CB ALA A 360 50.397 13.088 1.916 1.00 0.00 C ATOM 0 H ALA A 360 51.726 11.099 2.485 1.00 0.00 H new ATOM 0 HA ALA A 360 50.159 11.758 0.239 1.00 0.00 H new ATOM 0 HB1 ALA A 360 49.871 13.915 1.440 1.00 0.00 H new ATOM 0 HB2 ALA A 360 49.703 12.529 2.543 1.00 0.00 H new ATOM 0 HB3 ALA A 360 51.207 13.479 2.531 1.00 0.00 H new ATOM 1099 N LYS B 25 37.676 -5.720 -3.099 1.00 0.00 N ATOM 1100 CA LYS B 25 39.024 -5.240 -3.370 1.00 0.00 C ATOM 1101 C LYS B 25 39.626 -4.598 -2.125 1.00 0.00 C ATOM 1102 O LYS B 25 40.781 -4.851 -1.782 1.00 0.00 O ATOM 1103 CB LYS B 25 39.002 -4.213 -4.511 1.00 0.00 C ATOM 1104 CG LYS B 25 37.671 -4.292 -5.266 1.00 0.00 C ATOM 1105 CD LYS B 25 37.795 -3.527 -6.590 1.00 0.00 C ATOM 1106 CE LYS B 25 36.411 -3.349 -7.206 1.00 0.00 C ATOM 1107 NZ LYS B 25 35.775 -4.683 -7.385 1.00 0.00 N ATOM 0 HA LYS B 25 39.636 -6.094 -3.661 1.00 0.00 H new ATOM 0 HB2 LYS B 25 39.142 -3.209 -4.110 1.00 0.00 H new ATOM 0 HB3 LYS B 25 39.829 -4.401 -5.196 1.00 0.00 H new ATOM 0 HG2 LYS B 25 37.409 -5.333 -5.457 1.00 0.00 H new ATOM 0 HG3 LYS B 25 36.870 -3.867 -4.661 1.00 0.00 H new ATOM 0 HD2 LYS B 25 38.256 -2.554 -6.419 1.00 0.00 H new ATOM 0 HD3 LYS B 25 38.443 -4.071 -7.277 1.00 0.00 H new ATOM 0 HE2 LYS B 25 35.793 -2.722 -6.564 1.00 0.00 H new ATOM 0 HE3 LYS B 25 36.491 -2.840 -8.167 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 34.959 -4.596 -8.024 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 36.466 -5.345 -7.793 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 35.455 -5.042 -6.463 1.00 0.00 H new ATOM 1121 N ARG B 26 38.838 -3.766 -1.451 1.00 0.00 N ATOM 1122 CA ARG B 26 39.314 -3.095 -0.245 1.00 0.00 C ATOM 1123 C ARG B 26 39.641 -4.119 0.839 1.00 0.00 C ATOM 1124 O ARG B 26 40.656 -4.011 1.527 1.00 0.00 O ATOM 1125 CB ARG B 26 38.234 -2.141 0.267 1.00 0.00 C ATOM 1126 CG ARG B 26 38.056 -0.993 -0.728 1.00 0.00 C ATOM 1127 CD ARG B 26 36.837 -0.162 -0.334 1.00 0.00 C ATOM 1128 NE ARG B 26 37.089 0.561 0.906 1.00 0.00 N ATOM 1129 CZ ARG B 26 36.127 1.260 1.503 1.00 0.00 C ATOM 1130 NH1 ARG B 26 34.930 1.301 0.983 1.00 0.00 N ATOM 1131 NH2 ARG B 26 36.380 1.905 2.609 1.00 0.00 N ATOM 0 H ARG B 26 37.878 -3.542 -1.715 1.00 0.00 H new ATOM 0 HA ARG B 26 40.218 -2.535 -0.487 1.00 0.00 H new ATOM 0 HB2 ARG B 26 37.292 -2.675 0.395 1.00 0.00 H new ATOM 0 HB3 ARG B 26 38.513 -1.749 1.245 1.00 0.00 H new ATOM 0 HG2 ARG B 26 38.948 -0.367 -0.740 1.00 0.00 H new ATOM 0 HG3 ARG B 26 37.930 -1.388 -1.736 1.00 0.00 H new ATOM 0 HD2 ARG B 26 36.598 0.543 -1.130 1.00 0.00 H new ATOM 0 HD3 ARG B 26 35.971 -0.812 -0.213 1.00 0.00 H new ATOM 0 HE ARG B 26 38.019 0.531 1.324 1.00 0.00 H new ATOM 0 HH11 ARG B 26 34.732 0.797 0.119 1.00 0.00 H new ATOM 0 HH12 ARG B 26 34.193 1.837 1.441 1.00 0.00 H new ATOM 0 HH21 ARG B 26 37.315 1.873 3.015 1.00 0.00 H new ATOM 0 HH22 ARG B 26 35.643 2.441 3.067 1.00 0.00 H new ATOM 1145 N ALA B 27 38.776 -5.117 0.982 1.00 0.00 N ATOM 1146 CA ALA B 27 38.990 -6.161 1.982 1.00 0.00 C ATOM 1147 C ALA B 27 40.270 -6.937 1.685 1.00 0.00 C ATOM 1148 O ALA B 27 41.032 -7.274 2.591 1.00 0.00 O ATOM 1149 CB ALA B 27 37.800 -7.122 2.004 1.00 0.00 C ATOM 0 H ALA B 27 37.928 -5.227 0.426 1.00 0.00 H new ATOM 0 HA ALA B 27 39.087 -5.684 2.958 1.00 0.00 H new ATOM 0 HB1 ALA B 27 37.971 -7.895 2.753 1.00 0.00 H new ATOM 0 HB2 ALA B 27 36.892 -6.572 2.251 1.00 0.00 H new ATOM 0 HB3 ALA B 27 37.688 -7.585 1.023 1.00 0.00 H new ATOM 1155 N ALA B 28 40.497 -7.218 0.405 1.00 0.00 N ATOM 1156 CA ALA B 28 41.686 -7.954 -0.006 1.00 0.00 C ATOM 1157 C ALA B 28 42.948 -7.182 0.365 1.00 0.00 C ATOM 1158 O ALA B 28 43.939 -7.766 0.801 1.00 0.00 O ATOM 1159 CB ALA B 28 41.657 -8.195 -1.517 1.00 0.00 C ATOM 0 H ALA B 28 39.878 -6.949 -0.360 1.00 0.00 H new ATOM 0 HA ALA B 28 41.694 -8.913 0.513 1.00 0.00 H new ATOM 0 HB1 ALA B 28 42.549 -8.746 -1.815 1.00 0.00 H new ATOM 0 HB2 ALA B 28 40.770 -8.774 -1.776 1.00 0.00 H new ATOM 0 HB3 ALA B 28 41.631 -7.238 -2.038 1.00 0.00 H new ATOM 1165 N ALA B 29 42.903 -5.864 0.188 1.00 0.00 N ATOM 1166 CA ALA B 29 44.052 -5.023 0.507 1.00 0.00 C ATOM 1167 C ALA B 29 44.402 -5.137 1.985 1.00 0.00 C ATOM 1168 O ALA B 29 45.573 -5.239 2.351 1.00 0.00 O ATOM 1169 CB ALA B 29 43.737 -3.564 0.167 1.00 0.00 C ATOM 0 H ALA B 29 42.092 -5.360 -0.171 1.00 0.00 H new ATOM 0 HA ALA B 29 44.904 -5.360 -0.084 1.00 0.00 H new ATOM 0 HB1 ALA B 29 44.598 -2.940 0.407 1.00 0.00 H new ATOM 0 HB2 ALA B 29 43.512 -3.479 -0.896 1.00 0.00 H new ATOM 0 HB3 ALA B 29 42.876 -3.233 0.748 1.00 0.00 H new ATOM 1175 N LYS B 30 43.381 -5.129 2.833 1.00 0.00 N ATOM 1176 CA LYS B 30 43.594 -5.239 4.272 1.00 0.00 C ATOM 1177 C LYS B 30 44.266 -6.561 4.616 1.00 0.00 C ATOM 1178 O LYS B 30 45.206 -6.604 5.408 1.00 0.00 O ATOM 1179 CB LYS B 30 42.259 -5.131 5.002 1.00 0.00 C ATOM 1180 CG LYS B 30 42.486 -5.283 6.510 1.00 0.00 C ATOM 1181 CD LYS B 30 41.230 -4.854 7.278 1.00 0.00 C ATOM 1182 CE LYS B 30 40.112 -5.877 7.061 1.00 0.00 C ATOM 1183 NZ LYS B 30 38.969 -5.559 7.958 1.00 0.00 N ATOM 0 H LYS B 30 42.404 -5.048 2.553 1.00 0.00 H new ATOM 0 HA LYS B 30 44.247 -4.426 4.589 1.00 0.00 H new ATOM 0 HB2 LYS B 30 41.793 -4.169 4.789 1.00 0.00 H new ATOM 0 HB3 LYS B 30 41.575 -5.902 4.647 1.00 0.00 H new ATOM 0 HG2 LYS B 30 42.730 -6.319 6.746 1.00 0.00 H new ATOM 0 HG3 LYS B 30 43.337 -4.676 6.821 1.00 0.00 H new ATOM 0 HD2 LYS B 30 41.455 -4.768 8.341 1.00 0.00 H new ATOM 0 HD3 LYS B 30 40.905 -3.870 6.940 1.00 0.00 H new ATOM 0 HE2 LYS B 30 39.787 -5.862 6.021 1.00 0.00 H new ATOM 0 HE3 LYS B 30 40.480 -6.883 7.265 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 38.209 -6.254 7.811 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 39.284 -5.595 8.948 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 38.613 -4.606 7.742 1.00 0.00 H new ATOM 1197 N HIS B 31 43.778 -7.638 4.013 1.00 0.00 N ATOM 1198 CA HIS B 31 44.341 -8.960 4.260 1.00 0.00 C ATOM 1199 C HIS B 31 45.810 -8.996 3.853 1.00 0.00 C ATOM 1200 O HIS B 31 46.654 -9.509 4.586 1.00 0.00 O ATOM 1201 CB HIS B 31 43.559 -10.016 3.471 1.00 0.00 C ATOM 1202 CG HIS B 31 42.518 -10.639 4.358 1.00 0.00 C ATOM 1203 ND1 HIS B 31 42.768 -11.779 5.104 1.00 0.00 N ATOM 1204 CD2 HIS B 31 41.218 -10.289 4.631 1.00 0.00 C ATOM 1205 CE1 HIS B 31 41.644 -12.074 5.782 1.00 0.00 C ATOM 1206 NE2 HIS B 31 40.669 -11.197 5.530 1.00 0.00 N ATOM 0 H HIS B 31 42.999 -7.623 3.354 1.00 0.00 H new ATOM 0 HA HIS B 31 44.266 -9.177 5.325 1.00 0.00 H new ATOM 0 HB2 HIS B 31 43.085 -9.559 2.603 1.00 0.00 H new ATOM 0 HB3 HIS B 31 44.238 -10.782 3.097 1.00 0.00 H new ATOM 0 HD2 HIS B 31 40.701 -9.439 4.212 1.00 0.00 H new ATOM 0 HE1 HIS B 31 41.543 -12.917 6.449 1.00 0.00 H new ATOM 0 HE2 HIS B 31 39.724 -11.194 5.914 1.00 0.00 H new ATOM 1215 N LEU B 32 46.108 -8.456 2.677 1.00 0.00 N ATOM 1216 CA LEU B 32 47.480 -8.443 2.186 1.00 0.00 C ATOM 1217 C LEU B 32 48.373 -7.645 3.125 1.00 0.00 C ATOM 1218 O LEU B 32 49.468 -8.084 3.471 1.00 0.00 O ATOM 1219 CB LEU B 32 47.522 -7.816 0.788 1.00 0.00 C ATOM 1220 CG LEU B 32 46.852 -8.757 -0.220 1.00 0.00 C ATOM 1221 CD1 LEU B 32 46.717 -8.051 -1.571 1.00 0.00 C ATOM 1222 CD2 LEU B 32 47.691 -10.029 -0.391 1.00 0.00 C ATOM 0 H LEU B 32 45.426 -8.026 2.052 1.00 0.00 H new ATOM 0 HA LEU B 32 47.843 -9.470 2.140 1.00 0.00 H new ATOM 0 HB2 LEU B 32 47.012 -6.853 0.795 1.00 0.00 H new ATOM 0 HB3 LEU B 32 48.555 -7.628 0.494 1.00 0.00 H new ATOM 0 HG LEU B 32 45.864 -9.028 0.152 1.00 0.00 H new ATOM 0 HD11 LEU B 32 46.241 -8.722 -2.286 1.00 0.00 H new ATOM 0 HD12 LEU B 32 46.109 -7.154 -1.454 1.00 0.00 H new ATOM 0 HD13 LEU B 32 47.706 -7.774 -1.937 1.00 0.00 H new ATOM 0 HD21 LEU B 32 47.206 -10.691 -1.109 1.00 0.00 H new ATOM 0 HD22 LEU B 32 48.684 -9.764 -0.754 1.00 0.00 H new ATOM 0 HD23 LEU B 32 47.780 -10.538 0.569 1.00 0.00 H new ATOM 1234 N ILE B 33 47.894 -6.481 3.546 1.00 0.00 N ATOM 1235 CA ILE B 33 48.658 -5.636 4.457 1.00 0.00 C ATOM 1236 C ILE B 33 48.893 -6.355 5.779 1.00 0.00 C ATOM 1237 O ILE B 33 49.998 -6.335 6.320 1.00 0.00 O ATOM 1238 CB ILE B 33 47.912 -4.326 4.704 1.00 0.00 C ATOM 1239 CG1 ILE B 33 47.923 -3.483 3.425 1.00 0.00 C ATOM 1240 CG2 ILE B 33 48.600 -3.553 5.832 1.00 0.00 C ATOM 1241 CD1 ILE B 33 46.942 -2.317 3.573 1.00 0.00 C ATOM 0 H ILE B 33 46.987 -6.102 3.274 1.00 0.00 H new ATOM 0 HA ILE B 33 49.624 -5.418 4.001 1.00 0.00 H new ATOM 0 HB ILE B 33 46.882 -4.542 4.987 1.00 0.00 H new ATOM 0 HG12 ILE B 33 48.927 -3.105 3.235 1.00 0.00 H new ATOM 0 HG13 ILE B 33 47.646 -4.098 2.569 1.00 0.00 H new ATOM 0 HG21 ILE B 33 48.069 -2.618 6.009 1.00 0.00 H new ATOM 0 HG22 ILE B 33 48.592 -4.153 6.742 1.00 0.00 H new ATOM 0 HG23 ILE B 33 49.630 -3.337 5.549 1.00 0.00 H new ATOM 0 HD11 ILE B 33 46.950 -1.717 2.663 1.00 0.00 H new ATOM 0 HD12 ILE B 33 45.938 -2.706 3.743 1.00 0.00 H new ATOM 0 HD13 ILE B 33 47.239 -1.697 4.419 1.00 0.00 H new ATOM 1253 N GLU B 34 47.843 -6.987 6.293 1.00 0.00 N ATOM 1254 CA GLU B 34 47.941 -7.709 7.553 1.00 0.00 C ATOM 1255 C GLU B 34 48.953 -8.840 7.437 1.00 0.00 C ATOM 1256 O GLU B 34 49.730 -9.085 8.362 1.00 0.00 O ATOM 1257 CB GLU B 34 46.572 -8.276 7.942 1.00 0.00 C ATOM 1258 CG GLU B 34 46.675 -8.985 9.294 1.00 0.00 C ATOM 1259 CD GLU B 34 45.300 -9.466 9.739 1.00 0.00 C ATOM 1260 OE1 GLU B 34 44.351 -9.245 9.005 1.00 0.00 O ATOM 1261 OE2 GLU B 34 45.216 -10.050 10.806 1.00 0.00 O ATOM 0 H GLU B 34 46.921 -7.013 5.859 1.00 0.00 H new ATOM 0 HA GLU B 34 48.274 -7.016 8.326 1.00 0.00 H new ATOM 0 HB2 GLU B 34 45.837 -7.473 7.996 1.00 0.00 H new ATOM 0 HB3 GLU B 34 46.226 -8.974 7.179 1.00 0.00 H new ATOM 0 HG2 GLU B 34 47.358 -9.831 9.219 1.00 0.00 H new ATOM 0 HG3 GLU B 34 47.090 -8.306 10.039 1.00 0.00 H new ATOM 1268 N ARG B 35 48.936 -9.532 6.302 1.00 0.00 N ATOM 1269 CA ARG B 35 49.860 -10.638 6.089 1.00 0.00 C ATOM 1270 C ARG B 35 51.303 -10.149 6.098 1.00 0.00 C ATOM 1271 O ARG B 35 52.181 -10.793 6.672 1.00 0.00 O ATOM 1272 CB ARG B 35 49.557 -11.311 4.747 1.00 0.00 C ATOM 1273 CG ARG B 35 48.225 -12.057 4.831 1.00 0.00 C ATOM 1274 CD ARG B 35 48.455 -13.473 5.372 1.00 0.00 C ATOM 1275 NE ARG B 35 47.191 -14.191 5.463 1.00 0.00 N ATOM 1276 CZ ARG B 35 47.149 -15.453 5.873 1.00 0.00 C ATOM 1277 NH1 ARG B 35 48.252 -16.068 6.202 1.00 0.00 N ATOM 1278 NH2 ARG B 35 46.007 -16.076 5.948 1.00 0.00 N ATOM 0 H ARG B 35 48.301 -9.349 5.525 1.00 0.00 H new ATOM 0 HA ARG B 35 49.731 -11.355 6.900 1.00 0.00 H new ATOM 0 HB2 ARG B 35 49.516 -10.563 3.956 1.00 0.00 H new ATOM 0 HB3 ARG B 35 50.357 -12.005 4.489 1.00 0.00 H new ATOM 0 HG2 ARG B 35 47.536 -11.517 5.481 1.00 0.00 H new ATOM 0 HG3 ARG B 35 47.762 -12.105 3.845 1.00 0.00 H new ATOM 0 HD2 ARG B 35 49.141 -14.012 4.719 1.00 0.00 H new ATOM 0 HD3 ARG B 35 48.924 -13.422 6.355 1.00 0.00 H new ATOM 0 HE ARG B 35 46.325 -13.717 5.208 1.00 0.00 H new ATOM 0 HH11 ARG B 35 49.145 -15.579 6.144 1.00 0.00 H new ATOM 0 HH12 ARG B 35 48.221 -17.038 6.517 1.00 0.00 H new ATOM 0 HH21 ARG B 35 45.145 -15.594 5.692 1.00 0.00 H new ATOM 0 HH22 ARG B 35 45.975 -17.046 6.263 1.00 0.00 H new ATOM 1292 N TYR B 36 51.542 -9.008 5.462 1.00 0.00 N ATOM 1293 CA TYR B 36 52.886 -8.450 5.407 1.00 0.00 C ATOM 1294 C TYR B 36 53.365 -8.058 6.802 1.00 0.00 C ATOM 1295 O TYR B 36 54.510 -8.311 7.167 1.00 0.00 O ATOM 1296 CB TYR B 36 52.900 -7.216 4.502 1.00 0.00 C ATOM 1297 CG TYR B 36 52.732 -7.640 3.061 1.00 0.00 C ATOM 1298 CD1 TYR B 36 51.729 -7.060 2.273 1.00 0.00 C ATOM 1299 CD2 TYR B 36 53.572 -8.615 2.518 1.00 0.00 C ATOM 1300 CE1 TYR B 36 51.570 -7.455 0.941 1.00 0.00 C ATOM 1301 CE2 TYR B 36 53.414 -9.011 1.184 1.00 0.00 C ATOM 1302 CZ TYR B 36 52.411 -8.432 0.397 1.00 0.00 C ATOM 1303 OH TYR B 36 52.250 -8.819 -0.917 1.00 0.00 O ATOM 0 H TYR B 36 50.830 -8.457 4.982 1.00 0.00 H new ATOM 0 HA TYR B 36 53.556 -9.210 5.004 1.00 0.00 H new ATOM 0 HB2 TYR B 36 52.098 -6.535 4.787 1.00 0.00 H new ATOM 0 HB3 TYR B 36 53.837 -6.674 4.625 1.00 0.00 H new ATOM 0 HD1 TYR B 36 51.079 -6.308 2.694 1.00 0.00 H new ATOM 0 HD2 TYR B 36 54.343 -9.063 3.127 1.00 0.00 H new ATOM 0 HE1 TYR B 36 50.799 -7.006 0.333 1.00 0.00 H new ATOM 0 HE2 TYR B 36 54.065 -9.762 0.763 1.00 0.00 H new ATOM 0 HH TYR B 36 53.049 -9.300 -1.217 1.00 0.00 H new ATOM 1313 N TYR B 37 52.480 -7.444 7.574 1.00 0.00 N ATOM 1314 CA TYR B 37 52.817 -7.021 8.928 1.00 0.00 C ATOM 1315 C TYR B 37 53.203 -8.217 9.785 1.00 0.00 C ATOM 1316 O TYR B 37 54.233 -8.206 10.460 1.00 0.00 O ATOM 1317 CB TYR B 37 51.626 -6.299 9.563 1.00 0.00 C ATOM 1318 CG TYR B 37 51.939 -5.983 11.006 1.00 0.00 C ATOM 1319 CD1 TYR B 37 52.752 -4.890 11.324 1.00 0.00 C ATOM 1320 CD2 TYR B 37 51.418 -6.789 12.025 1.00 0.00 C ATOM 1321 CE1 TYR B 37 53.044 -4.603 12.662 1.00 0.00 C ATOM 1322 CE2 TYR B 37 51.709 -6.501 13.363 1.00 0.00 C ATOM 1323 CZ TYR B 37 52.523 -5.408 13.683 1.00 0.00 C ATOM 1324 OH TYR B 37 52.811 -5.126 15.002 1.00 0.00 O ATOM 0 H TYR B 37 51.525 -7.227 7.288 1.00 0.00 H new ATOM 0 HA TYR B 37 53.667 -6.341 8.872 1.00 0.00 H new ATOM 0 HB2 TYR B 37 51.411 -5.380 9.017 1.00 0.00 H new ATOM 0 HB3 TYR B 37 50.734 -6.923 9.501 1.00 0.00 H new ATOM 0 HD1 TYR B 37 53.154 -4.268 10.538 1.00 0.00 H new ATOM 0 HD2 TYR B 37 50.791 -7.633 11.778 1.00 0.00 H new ATOM 0 HE1 TYR B 37 53.672 -3.759 12.908 1.00 0.00 H new ATOM 0 HE2 TYR B 37 51.306 -7.122 14.149 1.00 0.00 H new ATOM 0 HH TYR B 37 52.027 -4.721 15.429 1.00 0.00 H new ATOM 1334 N HIS B 38 52.372 -9.250 9.755 1.00 0.00 N ATOM 1335 CA HIS B 38 52.639 -10.448 10.536 1.00 0.00 C ATOM 1336 C HIS B 38 53.857 -11.217 10.037 1.00 0.00 C ATOM 1337 O HIS B 38 54.614 -11.767 10.829 1.00 0.00 O ATOM 1338 CB HIS B 38 51.458 -11.414 10.430 1.00 0.00 C ATOM 1339 CG HIS B 38 50.348 -10.953 11.335 1.00 0.00 C ATOM 1340 ND1 HIS B 38 49.082 -11.518 11.299 1.00 0.00 N ATOM 1341 CD2 HIS B 38 50.299 -9.985 12.306 1.00 0.00 C ATOM 1342 CE1 HIS B 38 48.332 -10.889 12.222 1.00 0.00 C ATOM 1343 NE2 HIS B 38 49.026 -9.945 12.865 1.00 0.00 N ATOM 0 H HIS B 38 51.515 -9.282 9.203 1.00 0.00 H new ATOM 0 HA HIS B 38 52.810 -10.106 11.557 1.00 0.00 H new ATOM 0 HB2 HIS B 38 51.105 -11.462 9.400 1.00 0.00 H new ATOM 0 HB3 HIS B 38 51.772 -12.421 10.706 1.00 0.00 H new ATOM 0 HD2 HIS B 38 51.124 -9.350 12.593 1.00 0.00 H new ATOM 0 HE1 HIS B 38 47.295 -11.119 12.419 1.00 0.00 H new ATOM 0 HE2 HIS B 38 48.694 -9.328 13.606 1.00 0.00 H new ATOM 1352 N GLN B 39 54.075 -11.190 8.728 1.00 0.00 N ATOM 1353 CA GLN B 39 55.247 -11.838 8.145 1.00 0.00 C ATOM 1354 C GLN B 39 56.536 -11.170 8.599 1.00 0.00 C ATOM 1355 O GLN B 39 57.538 -11.840 8.857 1.00 0.00 O ATOM 1356 CB GLN B 39 55.177 -11.761 6.620 1.00 0.00 C ATOM 1357 CG GLN B 39 56.406 -12.442 6.015 1.00 0.00 C ATOM 1358 CD GLN B 39 56.320 -12.418 4.493 1.00 0.00 C ATOM 1359 OE1 GLN B 39 55.235 -12.562 3.929 1.00 0.00 O ATOM 1360 NE2 GLN B 39 57.405 -12.240 3.792 1.00 0.00 N ATOM 0 H GLN B 39 53.463 -10.731 8.054 1.00 0.00 H new ATOM 0 HA GLN B 39 55.248 -12.876 8.479 1.00 0.00 H new ATOM 0 HB2 GLN B 39 54.268 -12.245 6.263 1.00 0.00 H new ATOM 0 HB3 GLN B 39 55.131 -10.720 6.300 1.00 0.00 H new ATOM 0 HG2 GLN B 39 57.312 -11.934 6.344 1.00 0.00 H new ATOM 0 HG3 GLN B 39 56.472 -13.471 6.367 1.00 0.00 H new ATOM 0 HE21 GLN B 39 58.302 -12.121 4.262 1.00 0.00 H new ATOM 0 HE22 GLN B 39 57.356 -12.220 2.773 1.00 0.00 H new ATOM 1369 N LEU B 40 56.504 -9.853 8.715 1.00 0.00 N ATOM 1370 CA LEU B 40 57.673 -9.112 9.179 1.00 0.00 C ATOM 1371 C LEU B 40 57.945 -9.378 10.655 1.00 0.00 C ATOM 1372 O LEU B 40 59.096 -9.476 11.078 1.00 0.00 O ATOM 1373 CB LEU B 40 57.464 -7.616 8.964 1.00 0.00 C ATOM 1374 CG LEU B 40 57.498 -7.304 7.464 1.00 0.00 C ATOM 1375 CD1 LEU B 40 57.084 -5.852 7.234 1.00 0.00 C ATOM 1376 CD2 LEU B 40 58.910 -7.528 6.907 1.00 0.00 C ATOM 0 H LEU B 40 55.691 -9.276 8.498 1.00 0.00 H new ATOM 0 HA LEU B 40 58.533 -9.450 8.602 1.00 0.00 H new ATOM 0 HB2 LEU B 40 56.509 -7.307 9.389 1.00 0.00 H new ATOM 0 HB3 LEU B 40 58.240 -7.052 9.481 1.00 0.00 H new ATOM 0 HG LEU B 40 56.804 -7.969 6.949 1.00 0.00 H new ATOM 0 HD11 LEU B 40 57.109 -5.631 6.167 1.00 0.00 H new ATOM 0 HD12 LEU B 40 56.074 -5.697 7.613 1.00 0.00 H new ATOM 0 HD13 LEU B 40 57.774 -5.190 7.757 1.00 0.00 H new ATOM 0 HD21 LEU B 40 58.920 -7.303 5.841 1.00 0.00 H new ATOM 0 HD22 LEU B 40 59.613 -6.874 7.423 1.00 0.00 H new ATOM 0 HD23 LEU B 40 59.201 -8.567 7.061 1.00 0.00 H new ATOM 1388 N THR B 41 56.877 -9.478 11.435 1.00 0.00 N ATOM 1389 CA THR B 41 57.007 -9.714 12.867 1.00 0.00 C ATOM 1390 C THR B 41 57.075 -11.206 13.178 1.00 0.00 C ATOM 1391 O THR B 41 57.392 -11.596 14.304 1.00 0.00 O ATOM 1392 CB THR B 41 55.815 -9.095 13.600 1.00 0.00 C ATOM 1393 OG1 THR B 41 54.616 -9.712 13.152 1.00 0.00 O ATOM 1394 CG2 THR B 41 55.757 -7.593 13.316 1.00 0.00 C ATOM 0 H THR B 41 55.916 -9.400 11.103 1.00 0.00 H new ATOM 0 HA THR B 41 57.934 -9.251 13.205 1.00 0.00 H new ATOM 0 HB THR B 41 55.927 -9.252 14.673 1.00 0.00 H new ATOM 0 HG1 THR B 41 54.814 -10.301 12.394 1.00 0.00 H new ATOM 0 HG21 THR B 41 54.907 -7.156 13.840 1.00 0.00 H new ATOM 0 HG22 THR B 41 56.677 -7.122 13.661 1.00 0.00 H new ATOM 0 HG23 THR B 41 55.646 -7.429 12.244 1.00 0.00 H new ATOM 1402 N GLU B 42 56.780 -12.031 12.180 1.00 0.00 N ATOM 1403 CA GLU B 42 56.682 -13.476 12.405 1.00 0.00 C ATOM 1404 C GLU B 42 57.696 -14.132 11.473 1.00 0.00 C ATOM 1405 O GLU B 42 58.685 -14.707 11.925 1.00 0.00 O ATOM 1406 CB GLU B 42 55.294 -14.055 12.126 1.00 0.00 C ATOM 1407 CG GLU B 42 54.270 -13.409 13.066 1.00 0.00 C ATOM 1408 CD GLU B 42 54.483 -13.914 14.488 1.00 0.00 C ATOM 1409 OE1 GLU B 42 55.238 -14.859 14.652 1.00 0.00 O ATOM 1410 OE2 GLU B 42 53.886 -13.353 15.391 1.00 0.00 O ATOM 0 H GLU B 42 56.606 -11.734 11.220 1.00 0.00 H new ATOM 0 HA GLU B 42 56.878 -13.673 13.459 1.00 0.00 H new ATOM 0 HB2 GLU B 42 55.015 -13.874 11.088 1.00 0.00 H new ATOM 0 HB3 GLU B 42 55.304 -15.135 12.270 1.00 0.00 H new ATOM 0 HG2 GLU B 42 54.370 -12.324 13.037 1.00 0.00 H new ATOM 0 HG3 GLU B 42 53.259 -13.645 12.734 1.00 0.00 H new ATOM 1417 N GLY B 43 57.442 -14.042 10.172 1.00 0.00 N ATOM 1418 CA GLY B 43 58.409 -14.527 9.188 1.00 0.00 C ATOM 1419 C GLY B 43 58.012 -15.963 8.868 1.00 0.00 C ATOM 1420 O GLY B 43 56.842 -16.333 8.978 1.00 0.00 O ATOM 0 H GLY B 43 56.590 -13.645 9.777 1.00 0.00 H new ATOM 0 HA2 GLY B 43 58.392 -13.910 8.290 1.00 0.00 H new ATOM 0 HA3 GLY B 43 59.423 -14.484 9.586 1.00 0.00 H new ATOM 1424 N CYS B 44 58.993 -16.768 8.474 1.00 0.00 N ATOM 1425 CA CYS B 44 58.727 -18.167 8.145 1.00 0.00 C ATOM 1426 C CYS B 44 59.094 -19.074 9.312 1.00 0.00 C ATOM 1427 O CYS B 44 58.714 -20.245 9.344 1.00 0.00 O ATOM 1428 CB CYS B 44 59.528 -18.572 6.904 1.00 0.00 C ATOM 1429 SG CYS B 44 61.231 -17.966 7.045 1.00 0.00 S ATOM 0 H CYS B 44 59.967 -16.483 8.375 1.00 0.00 H new ATOM 0 HA CYS B 44 57.662 -18.276 7.941 1.00 0.00 H new ATOM 0 HB2 CYS B 44 59.526 -19.657 6.797 1.00 0.00 H new ATOM 0 HB3 CYS B 44 59.060 -18.163 6.009 1.00 0.00 H new ATOM 0 HG CYS B 44 61.256 -16.686 6.818 1.00 0.00 H new ATOM 1434 N GLY B 45 59.823 -18.524 10.274 1.00 0.00 N ATOM 1435 CA GLY B 45 60.224 -19.289 11.448 1.00 0.00 C ATOM 1436 C GLY B 45 61.539 -20.021 11.205 1.00 0.00 C ATOM 1437 O GLY B 45 62.207 -20.446 12.147 1.00 0.00 O ATOM 0 H GLY B 45 60.147 -17.557 10.266 1.00 0.00 H new ATOM 0 HA2 GLY B 45 60.329 -18.621 12.303 1.00 0.00 H new ATOM 0 HA3 GLY B 45 59.445 -20.009 11.700 1.00 0.00 H new ATOM 1441 N ASN B 46 61.900 -20.169 9.935 1.00 0.00 N ATOM 1442 CA ASN B 46 63.132 -20.856 9.577 1.00 0.00 C ATOM 1443 C ASN B 46 64.326 -19.918 9.717 1.00 0.00 C ATOM 1444 O ASN B 46 64.234 -18.729 9.416 1.00 0.00 O ATOM 1445 CB ASN B 46 63.044 -21.367 8.136 1.00 0.00 C ATOM 1446 CG ASN B 46 61.851 -22.306 7.987 1.00 0.00 C ATOM 1447 OD1 ASN B 46 60.937 -22.030 7.210 1.00 0.00 O ATOM 1448 ND2 ASN B 46 61.806 -23.407 8.685 1.00 0.00 N ATOM 0 H ASN B 46 61.360 -19.824 9.142 1.00 0.00 H new ATOM 0 HA ASN B 46 63.268 -21.700 10.253 1.00 0.00 H new ATOM 0 HB2 ASN B 46 62.944 -20.527 7.449 1.00 0.00 H new ATOM 0 HB3 ASN B 46 63.963 -21.889 7.870 1.00 0.00 H new ATOM 0 HD21 ASN B 46 61.013 -24.041 8.587 1.00 0.00 H new ATOM 0 HD22 ASN B 46 62.564 -23.634 9.328 1.00 0.00 H new ATOM 1455 N GLU B 47 65.446 -20.465 10.172 1.00 0.00 N ATOM 1456 CA GLU B 47 66.657 -19.670 10.350 1.00 0.00 C ATOM 1457 C GLU B 47 67.106 -19.087 9.014 1.00 0.00 C ATOM 1458 O GLU B 47 67.565 -17.947 8.947 1.00 0.00 O ATOM 1459 CB GLU B 47 67.772 -20.538 10.938 1.00 0.00 C ATOM 1460 CG GLU B 47 67.440 -20.881 12.391 1.00 0.00 C ATOM 1461 CD GLU B 47 68.451 -21.884 12.934 1.00 0.00 C ATOM 1462 OE1 GLU B 47 69.236 -22.387 12.149 1.00 0.00 O ATOM 1463 OE2 GLU B 47 68.421 -22.138 14.127 1.00 0.00 O ATOM 0 H GLU B 47 65.542 -21.449 10.423 1.00 0.00 H new ATOM 0 HA GLU B 47 66.441 -18.852 11.038 1.00 0.00 H new ATOM 0 HB2 GLU B 47 67.882 -21.452 10.354 1.00 0.00 H new ATOM 0 HB3 GLU B 47 68.724 -20.010 10.886 1.00 0.00 H new ATOM 0 HG2 GLU B 47 67.451 -19.976 12.999 1.00 0.00 H new ATOM 0 HG3 GLU B 47 66.434 -21.296 12.455 1.00 0.00 H new ATOM 1470 N ALA B 48 66.973 -19.877 7.954 1.00 0.00 N ATOM 1471 CA ALA B 48 67.367 -19.426 6.624 1.00 0.00 C ATOM 1472 C ALA B 48 66.145 -18.966 5.833 1.00 0.00 C ATOM 1473 O ALA B 48 65.113 -19.636 5.823 1.00 0.00 O ATOM 1474 CB ALA B 48 68.066 -20.560 5.873 1.00 0.00 C ATOM 0 H ALA B 48 66.599 -20.825 7.988 1.00 0.00 H new ATOM 0 HA ALA B 48 68.054 -18.587 6.733 1.00 0.00 H new ATOM 0 HB1 ALA B 48 68.357 -20.214 4.881 1.00 0.00 H new ATOM 0 HB2 ALA B 48 68.954 -20.868 6.425 1.00 0.00 H new ATOM 0 HB3 ALA B 48 67.386 -21.407 5.777 1.00 0.00 H new ATOM 1480 N CYS B 49 66.269 -17.819 5.173 1.00 0.00 N ATOM 1481 CA CYS B 49 65.167 -17.280 4.383 1.00 0.00 C ATOM 1482 C CYS B 49 65.702 -16.557 3.150 1.00 0.00 C ATOM 1483 O CYS B 49 66.667 -15.799 3.231 1.00 0.00 O ATOM 1484 CB CYS B 49 64.343 -16.310 5.229 1.00 0.00 C ATOM 1485 SG CYS B 49 62.940 -15.705 4.264 1.00 0.00 S ATOM 0 H CYS B 49 67.114 -17.248 5.169 1.00 0.00 H new ATOM 0 HA CYS B 49 64.533 -18.107 4.062 1.00 0.00 H new ATOM 0 HB2 CYS B 49 63.989 -16.809 6.131 1.00 0.00 H new ATOM 0 HB3 CYS B 49 64.964 -15.474 5.550 1.00 0.00 H new ATOM 0 HG CYS B 49 61.968 -15.385 5.065 1.00 0.00 H new ATOM 1490 N THR B 50 65.069 -16.803 2.009 1.00 0.00 N ATOM 1491 CA THR B 50 65.487 -16.173 0.762 1.00 0.00 C ATOM 1492 C THR B 50 64.712 -14.883 0.519 1.00 0.00 C ATOM 1493 O THR B 50 64.885 -14.230 -0.510 1.00 0.00 O ATOM 1494 CB THR B 50 65.265 -17.137 -0.407 1.00 0.00 C ATOM 1495 OG1 THR B 50 63.887 -17.470 -0.490 1.00 0.00 O ATOM 1496 CG2 THR B 50 66.088 -18.409 -0.190 1.00 0.00 C ATOM 0 H THR B 50 64.269 -17.430 1.921 1.00 0.00 H new ATOM 0 HA THR B 50 66.547 -15.930 0.838 1.00 0.00 H new ATOM 0 HB THR B 50 65.580 -16.659 -1.335 1.00 0.00 H new ATOM 0 HG1 THR B 50 63.744 -18.086 -1.239 1.00 0.00 H new ATOM 0 HG21 THR B 50 65.928 -19.093 -1.024 1.00 0.00 H new ATOM 0 HG22 THR B 50 67.146 -18.152 -0.130 1.00 0.00 H new ATOM 0 HG23 THR B 50 65.778 -18.889 0.738 1.00 0.00 H new ATOM 1504 N ASN B 51 63.854 -14.520 1.472 1.00 0.00 N ATOM 1505 CA ASN B 51 63.057 -13.308 1.354 1.00 0.00 C ATOM 1506 C ASN B 51 63.610 -12.220 2.262 1.00 0.00 C ATOM 1507 O ASN B 51 63.586 -12.347 3.486 1.00 0.00 O ATOM 1508 CB ASN B 51 61.602 -13.603 1.721 1.00 0.00 C ATOM 1509 CG ASN B 51 60.813 -13.956 0.464 1.00 0.00 C ATOM 1510 OD1 ASN B 51 60.622 -13.109 -0.408 1.00 0.00 O ATOM 1511 ND2 ASN B 51 60.348 -15.163 0.311 1.00 0.00 N ATOM 0 H ASN B 51 63.696 -15.048 2.330 1.00 0.00 H new ATOM 0 HA ASN B 51 63.102 -12.959 0.322 1.00 0.00 H new ATOM 0 HB2 ASN B 51 61.557 -14.427 2.433 1.00 0.00 H new ATOM 0 HB3 ASN B 51 61.157 -12.736 2.209 1.00 0.00 H new ATOM 0 HD21 ASN B 51 59.826 -15.406 -0.531 1.00 0.00 H new ATOM 0 HD22 ASN B 51 60.506 -15.866 1.033 1.00 0.00 H new ATOM 1518 N GLU B 52 64.114 -11.153 1.655 1.00 0.00 N ATOM 1519 CA GLU B 52 64.678 -10.051 2.420 1.00 0.00 C ATOM 1520 C GLU B 52 63.619 -9.452 3.342 1.00 0.00 C ATOM 1521 O GLU B 52 63.916 -9.071 4.475 1.00 0.00 O ATOM 1522 CB GLU B 52 65.208 -8.969 1.477 1.00 0.00 C ATOM 1523 CG GLU B 52 65.146 -9.466 0.026 1.00 0.00 C ATOM 1524 CD GLU B 52 66.301 -10.420 -0.253 1.00 0.00 C ATOM 1525 OE1 GLU B 52 67.347 -10.248 0.346 1.00 0.00 O ATOM 1526 OE2 GLU B 52 66.120 -11.316 -1.063 1.00 0.00 O ATOM 0 H GLU B 52 64.143 -11.028 0.643 1.00 0.00 H new ATOM 0 HA GLU B 52 65.501 -10.434 3.023 1.00 0.00 H new ATOM 0 HB2 GLU B 52 64.618 -8.059 1.585 1.00 0.00 H new ATOM 0 HB3 GLU B 52 66.235 -8.716 1.740 1.00 0.00 H new ATOM 0 HG2 GLU B 52 64.197 -9.971 -0.153 1.00 0.00 H new ATOM 0 HG3 GLU B 52 65.191 -8.619 -0.659 1.00 0.00 H new ATOM 1533 N PHE B 53 62.387 -9.361 2.849 1.00 0.00 N ATOM 1534 CA PHE B 53 61.307 -8.798 3.647 1.00 0.00 C ATOM 1535 C PHE B 53 60.573 -9.903 4.403 1.00 0.00 C ATOM 1536 O PHE B 53 59.368 -10.090 4.234 1.00 0.00 O ATOM 1537 CB PHE B 53 60.318 -8.073 2.731 1.00 0.00 C ATOM 1538 CG PHE B 53 61.076 -7.176 1.783 1.00 0.00 C ATOM 1539 CD1 PHE B 53 61.314 -7.594 0.468 1.00 0.00 C ATOM 1540 CD2 PHE B 53 61.541 -5.929 2.216 1.00 0.00 C ATOM 1541 CE1 PHE B 53 62.021 -6.769 -0.412 1.00 0.00 C ATOM 1542 CE2 PHE B 53 62.248 -5.101 1.334 1.00 0.00 C ATOM 1543 CZ PHE B 53 62.488 -5.522 0.019 1.00 0.00 C ATOM 0 H PHE B 53 62.116 -9.666 1.914 1.00 0.00 H new ATOM 0 HA PHE B 53 61.732 -8.096 4.365 1.00 0.00 H new ATOM 0 HB2 PHE B 53 59.728 -8.797 2.170 1.00 0.00 H new ATOM 0 HB3 PHE B 53 59.619 -7.484 3.326 1.00 0.00 H new ATOM 0 HD1 PHE B 53 60.951 -8.555 0.133 1.00 0.00 H new ATOM 0 HD2 PHE B 53 61.355 -5.605 3.229 1.00 0.00 H new ATOM 0 HE1 PHE B 53 62.207 -7.094 -1.425 1.00 0.00 H new ATOM 0 HE2 PHE B 53 62.608 -4.139 1.667 1.00 0.00 H new ATOM 0 HZ PHE B 53 63.033 -4.885 -0.661 1.00 0.00 H new ATOM 1553 N CYS B 54 61.309 -10.627 5.243 1.00 0.00 N ATOM 1554 CA CYS B 54 60.721 -11.706 6.027 1.00 0.00 C ATOM 1555 C CYS B 54 61.467 -11.887 7.348 1.00 0.00 C ATOM 1556 O CYS B 54 62.694 -11.900 7.380 1.00 0.00 O ATOM 1557 CB CYS B 54 60.759 -13.006 5.231 1.00 0.00 C ATOM 1558 SG CYS B 54 60.036 -14.336 6.220 1.00 0.00 S ATOM 0 H CYS B 54 62.307 -10.486 5.397 1.00 0.00 H new ATOM 0 HA CYS B 54 59.686 -11.445 6.248 1.00 0.00 H new ATOM 0 HB2 CYS B 54 60.207 -12.890 4.298 1.00 0.00 H new ATOM 0 HB3 CYS B 54 61.787 -13.253 4.965 1.00 0.00 H new ATOM 0 HG CYS B 54 60.717 -14.480 7.318 1.00 0.00 H new ATOM 1563 N ALA B 55 60.717 -12.032 8.437 1.00 0.00 N ATOM 1564 CA ALA B 55 61.328 -12.215 9.747 1.00 0.00 C ATOM 1565 C ALA B 55 62.218 -13.455 9.745 1.00 0.00 C ATOM 1566 O ALA B 55 62.080 -14.332 8.891 1.00 0.00 O ATOM 1567 CB ALA B 55 60.246 -12.358 10.818 1.00 0.00 C ATOM 0 H ALA B 55 59.697 -12.026 8.438 1.00 0.00 H new ATOM 0 HA ALA B 55 61.938 -11.340 9.971 1.00 0.00 H new ATOM 0 HB1 ALA B 55 60.715 -12.494 11.793 1.00 0.00 H new ATOM 0 HB2 ALA B 55 59.629 -11.459 10.834 1.00 0.00 H new ATOM 0 HB3 ALA B 55 59.622 -13.222 10.592 1.00 0.00 H new ATOM 1573 N SER B 56 63.135 -13.508 10.697 1.00 0.00 N ATOM 1574 CA SER B 56 64.058 -14.630 10.803 1.00 0.00 C ATOM 1575 C SER B 56 65.143 -14.515 9.742 1.00 0.00 C ATOM 1576 O SER B 56 66.218 -15.109 9.869 1.00 0.00 O ATOM 1577 CB SER B 56 63.319 -15.961 10.637 1.00 0.00 C ATOM 1578 OG SER B 56 63.420 -16.388 9.284 1.00 0.00 O ATOM 0 H SER B 56 63.261 -12.788 11.408 1.00 0.00 H new ATOM 0 HA SER B 56 64.513 -14.604 11.793 1.00 0.00 H new ATOM 0 HB2 SER B 56 63.746 -16.713 11.301 1.00 0.00 H new ATOM 0 HB3 SER B 56 62.272 -15.846 10.917 1.00 0.00 H new ATOM 0 HG SER B 56 64.021 -17.160 9.229 1.00 0.00 H new ATOM 1584 N CYS B 57 64.853 -13.752 8.689 1.00 0.00 N ATOM 1585 CA CYS B 57 65.809 -13.583 7.611 1.00 0.00 C ATOM 1586 C CYS B 57 67.054 -12.837 8.112 1.00 0.00 C ATOM 1587 O CYS B 57 66.938 -11.759 8.694 1.00 0.00 O ATOM 1588 CB CYS B 57 65.184 -12.813 6.449 1.00 0.00 C ATOM 1589 SG CYS B 57 66.354 -12.759 5.065 1.00 0.00 S ATOM 0 H CYS B 57 63.974 -13.250 8.565 1.00 0.00 H new ATOM 0 HA CYS B 57 66.101 -14.573 7.261 1.00 0.00 H new ATOM 0 HB2 CYS B 57 64.256 -13.293 6.137 1.00 0.00 H new ATOM 0 HB3 CYS B 57 64.929 -11.801 6.764 1.00 0.00 H new ATOM 0 HG CYS B 57 65.702 -12.603 3.951 1.00 0.00 H new ATOM 1595 N PRO B 58 68.235 -13.370 7.896 1.00 0.00 N ATOM 1596 CA PRO B 58 69.504 -12.721 8.351 1.00 0.00 C ATOM 1597 C PRO B 58 69.586 -11.249 7.934 1.00 0.00 C ATOM 1598 O PRO B 58 70.111 -10.413 8.674 1.00 0.00 O ATOM 1599 CB PRO B 58 70.589 -13.529 7.632 1.00 0.00 C ATOM 1600 CG PRO B 58 69.991 -14.868 7.382 1.00 0.00 C ATOM 1601 CD PRO B 58 68.502 -14.656 7.223 1.00 0.00 C ATOM 0 HA PRO B 58 69.594 -12.721 9.437 1.00 0.00 H new ATOM 0 HB2 PRO B 58 70.881 -13.049 6.698 1.00 0.00 H new ATOM 0 HB3 PRO B 58 71.488 -13.609 8.243 1.00 0.00 H new ATOM 0 HG2 PRO B 58 70.415 -15.320 6.486 1.00 0.00 H new ATOM 0 HG3 PRO B 58 70.199 -15.546 8.210 1.00 0.00 H new ATOM 0 HD2 PRO B 58 68.217 -14.620 6.172 1.00 0.00 H new ATOM 0 HD3 PRO B 58 67.935 -15.467 7.679 1.00 0.00 H new ATOM 1609 N THR B 59 69.070 -10.939 6.752 1.00 0.00 N ATOM 1610 CA THR B 59 69.091 -9.567 6.253 1.00 0.00 C ATOM 1611 C THR B 59 68.019 -8.723 6.935 1.00 0.00 C ATOM 1612 O THR B 59 68.069 -7.493 6.899 1.00 0.00 O ATOM 1613 CB THR B 59 68.859 -9.559 4.741 1.00 0.00 C ATOM 1614 OG1 THR B 59 67.579 -10.104 4.457 1.00 0.00 O ATOM 1615 CG2 THR B 59 69.936 -10.400 4.053 1.00 0.00 C ATOM 0 H THR B 59 68.634 -11.613 6.123 1.00 0.00 H new ATOM 0 HA THR B 59 70.068 -9.139 6.477 1.00 0.00 H new ATOM 0 HB THR B 59 68.909 -8.535 4.371 1.00 0.00 H new ATOM 0 HG1 THR B 59 67.604 -11.077 4.573 1.00 0.00 H new ATOM 0 HG21 THR B 59 69.770 -10.394 2.976 1.00 0.00 H new ATOM 0 HG22 THR B 59 70.919 -9.982 4.271 1.00 0.00 H new ATOM 0 HG23 THR B 59 69.888 -11.425 4.421 1.00 0.00 H new ATOM 1623 N PHE B 60 67.053 -9.388 7.552 1.00 0.00 N ATOM 1624 CA PHE B 60 66.035 -8.687 8.333 1.00 0.00 C ATOM 1625 C PHE B 60 66.364 -8.512 9.811 1.00 0.00 C ATOM 1626 O PHE B 60 66.766 -9.462 10.483 1.00 0.00 O ATOM 1627 CB PHE B 60 64.732 -9.475 8.201 1.00 0.00 C ATOM 1628 CG PHE B 60 63.624 -8.750 8.927 1.00 0.00 C ATOM 1629 CD1 PHE B 60 62.901 -7.742 8.277 1.00 0.00 C ATOM 1630 CD2 PHE B 60 63.323 -9.083 10.253 1.00 0.00 C ATOM 1631 CE1 PHE B 60 61.877 -7.070 8.952 1.00 0.00 C ATOM 1632 CE2 PHE B 60 62.299 -8.412 10.928 1.00 0.00 C ATOM 1633 CZ PHE B 60 61.576 -7.404 10.280 1.00 0.00 C ATOM 0 H PHE B 60 66.950 -10.403 7.530 1.00 0.00 H new ATOM 0 HA PHE B 60 65.967 -7.676 7.932 1.00 0.00 H new ATOM 0 HB2 PHE B 60 64.473 -9.595 7.149 1.00 0.00 H new ATOM 0 HB3 PHE B 60 64.857 -10.476 8.615 1.00 0.00 H new ATOM 0 HD1 PHE B 60 63.134 -7.484 7.255 1.00 0.00 H new ATOM 0 HD2 PHE B 60 63.882 -9.859 10.755 1.00 0.00 H new ATOM 0 HE1 PHE B 60 61.318 -6.294 8.450 1.00 0.00 H new ATOM 0 HE2 PHE B 60 62.066 -8.672 11.950 1.00 0.00 H new ATOM 0 HZ PHE B 60 60.787 -6.884 10.803 1.00 0.00 H new ATOM 1643 N LEU B 61 66.191 -7.292 10.309 1.00 0.00 N ATOM 1644 CA LEU B 61 66.469 -6.998 11.711 1.00 0.00 C ATOM 1645 C LEU B 61 65.165 -6.785 12.475 1.00 0.00 C ATOM 1646 O LEU B 61 64.193 -6.266 11.929 1.00 0.00 O ATOM 1647 CB LEU B 61 67.340 -5.746 11.824 1.00 0.00 C ATOM 1648 CG LEU B 61 68.535 -5.868 10.880 1.00 0.00 C ATOM 1649 CD1 LEU B 61 68.262 -5.072 9.602 1.00 0.00 C ATOM 1650 CD2 LEU B 61 69.785 -5.314 11.568 1.00 0.00 C ATOM 0 H LEU B 61 65.861 -6.494 9.766 1.00 0.00 H new ATOM 0 HA LEU B 61 67.001 -7.845 12.144 1.00 0.00 H new ATOM 0 HB2 LEU B 61 66.756 -4.860 11.575 1.00 0.00 H new ATOM 0 HB3 LEU B 61 67.685 -5.622 12.850 1.00 0.00 H new ATOM 0 HG LEU B 61 68.692 -6.917 10.627 1.00 0.00 H new ATOM 0 HD11 LEU B 61 69.115 -5.160 8.929 1.00 0.00 H new ATOM 0 HD12 LEU B 61 67.371 -5.465 9.112 1.00 0.00 H new ATOM 0 HD13 LEU B 61 68.105 -4.023 9.853 1.00 0.00 H new ATOM 0 HD21 LEU B 61 70.639 -5.400 10.896 1.00 0.00 H new ATOM 0 HD22 LEU B 61 69.627 -4.266 11.821 1.00 0.00 H new ATOM 0 HD23 LEU B 61 69.981 -5.881 12.478 1.00 0.00 H new ATOM 1662 N ARG B 62 65.151 -7.193 13.738 1.00 0.00 N ATOM 1663 CA ARG B 62 63.963 -7.051 14.565 1.00 0.00 C ATOM 1664 C ARG B 62 63.590 -5.580 14.707 1.00 0.00 C ATOM 1665 O ARG B 62 64.456 -4.710 14.778 1.00 0.00 O ATOM 1666 CB ARG B 62 64.226 -7.652 15.951 1.00 0.00 C ATOM 1667 CG ARG B 62 64.565 -9.140 15.823 1.00 0.00 C ATOM 1668 CD ARG B 62 63.279 -9.964 15.689 1.00 0.00 C ATOM 1669 NE ARG B 62 62.438 -9.766 16.861 1.00 0.00 N ATOM 1670 CZ ARG B 62 62.645 -10.453 17.980 1.00 0.00 C ATOM 1671 NH1 ARG B 62 63.615 -11.323 18.040 1.00 0.00 N ATOM 1672 NH2 ARG B 62 61.879 -10.256 19.019 1.00 0.00 N ATOM 0 H ARG B 62 65.947 -7.623 14.209 1.00 0.00 H new ATOM 0 HA ARG B 62 63.137 -7.579 14.089 1.00 0.00 H new ATOM 0 HB2 ARG B 62 65.048 -7.124 16.435 1.00 0.00 H new ATOM 0 HB3 ARG B 62 63.348 -7.524 16.584 1.00 0.00 H new ATOM 0 HG2 ARG B 62 65.202 -9.302 14.954 1.00 0.00 H new ATOM 0 HG3 ARG B 62 65.128 -9.469 16.697 1.00 0.00 H new ATOM 0 HD2 ARG B 62 62.739 -9.668 14.789 1.00 0.00 H new ATOM 0 HD3 ARG B 62 63.524 -11.021 15.581 1.00 0.00 H new ATOM 0 HE ARG B 62 61.677 -9.088 16.823 1.00 0.00 H new ATOM 0 HH11 ARG B 62 64.214 -11.476 17.229 1.00 0.00 H new ATOM 0 HH12 ARG B 62 63.775 -11.851 18.898 1.00 0.00 H new ATOM 0 HH21 ARG B 62 61.121 -9.575 18.972 1.00 0.00 H new ATOM 0 HH22 ARG B 62 62.038 -10.783 19.877 1.00 0.00 H new ATOM 1686 N MET B 63 62.290 -5.318 14.738 1.00 0.00 N ATOM 1687 CA MET B 63 61.793 -3.952 14.859 1.00 0.00 C ATOM 1688 C MET B 63 60.477 -3.919 15.631 1.00 0.00 C ATOM 1689 O MET B 63 59.894 -4.960 15.932 1.00 0.00 O ATOM 1690 CB MET B 63 61.592 -3.349 13.468 1.00 0.00 C ATOM 1691 CG MET B 63 60.571 -4.183 12.695 1.00 0.00 C ATOM 1692 SD MET B 63 60.437 -3.547 11.006 1.00 0.00 S ATOM 1693 CE MET B 63 62.094 -4.008 10.442 1.00 0.00 C ATOM 0 H MET B 63 61.562 -6.030 14.681 1.00 0.00 H new ATOM 0 HA MET B 63 62.529 -3.365 15.408 1.00 0.00 H new ATOM 0 HB2 MET B 63 61.247 -2.319 13.553 1.00 0.00 H new ATOM 0 HB3 MET B 63 62.540 -3.324 12.930 1.00 0.00 H new ATOM 0 HG2 MET B 63 60.876 -5.229 12.679 1.00 0.00 H new ATOM 0 HG3 MET B 63 59.601 -4.141 13.190 1.00 0.00 H new ATOM 0 HE1 MET B 63 62.048 -4.329 9.401 1.00 0.00 H new ATOM 0 HE2 MET B 63 62.760 -3.149 10.528 1.00 0.00 H new ATOM 0 HE3 MET B 63 62.474 -4.824 11.057 1.00 0.00 H new ATOM 1703 N ASP B 64 60.022 -2.713 15.957 1.00 0.00 N ATOM 1704 CA ASP B 64 58.782 -2.548 16.697 1.00 0.00 C ATOM 1705 C ASP B 64 57.580 -2.658 15.769 1.00 0.00 C ATOM 1706 O ASP B 64 57.724 -2.666 14.546 1.00 0.00 O ATOM 1707 CB ASP B 64 58.766 -1.187 17.397 1.00 0.00 C ATOM 1708 CG ASP B 64 59.126 -1.349 18.873 1.00 0.00 C ATOM 1709 OD1 ASP B 64 58.714 -2.336 19.460 1.00 0.00 O ATOM 1710 OD2 ASP B 64 59.809 -0.482 19.393 1.00 0.00 O ATOM 0 H ASP B 64 60.494 -1.840 15.720 1.00 0.00 H new ATOM 0 HA ASP B 64 58.722 -3.341 17.442 1.00 0.00 H new ATOM 0 HB2 ASP B 64 59.474 -0.513 16.914 1.00 0.00 H new ATOM 0 HB3 ASP B 64 57.779 -0.733 17.303 1.00 0.00 H new ATOM 1715 N ASN B 65 56.395 -2.744 16.357 1.00 0.00 N ATOM 1716 CA ASN B 65 55.170 -2.854 15.574 1.00 0.00 C ATOM 1717 C ASN B 65 54.980 -1.618 14.702 1.00 0.00 C ATOM 1718 O ASN B 65 54.490 -1.709 13.578 1.00 0.00 O ATOM 1719 CB ASN B 65 53.966 -3.020 16.509 1.00 0.00 C ATOM 1720 CG ASN B 65 54.206 -2.267 17.814 1.00 0.00 C ATOM 1721 OD1 ASN B 65 54.019 -1.052 17.876 1.00 0.00 O ATOM 1722 ND2 ASN B 65 54.616 -2.918 18.866 1.00 0.00 N ATOM 0 H ASN B 65 56.255 -2.740 17.367 1.00 0.00 H new ATOM 0 HA ASN B 65 55.248 -3.728 14.928 1.00 0.00 H new ATOM 0 HB2 ASN B 65 53.065 -2.644 16.024 1.00 0.00 H new ATOM 0 HB3 ASN B 65 53.800 -4.077 16.716 1.00 0.00 H new ATOM 0 HD21 ASN B 65 54.782 -2.421 19.741 1.00 0.00 H new ATOM 0 HD22 ASN B 65 54.771 -3.925 18.814 1.00 0.00 H new ATOM 1729 N ASN B 66 55.380 -0.467 15.224 1.00 0.00 N ATOM 1730 CA ASN B 66 55.252 0.780 14.480 1.00 0.00 C ATOM 1731 C ASN B 66 56.130 0.743 13.233 1.00 0.00 C ATOM 1732 O ASN B 66 55.674 1.040 12.126 1.00 0.00 O ATOM 1733 CB ASN B 66 55.658 1.958 15.376 1.00 0.00 C ATOM 1734 CG ASN B 66 56.849 1.572 16.253 1.00 0.00 C ATOM 1735 OD1 ASN B 66 57.984 1.533 15.785 1.00 0.00 O ATOM 1736 ND2 ASN B 66 56.652 1.273 17.506 1.00 0.00 N ATOM 0 H ASN B 66 55.793 -0.370 16.152 1.00 0.00 H new ATOM 0 HA ASN B 66 54.214 0.905 14.170 1.00 0.00 H new ATOM 0 HB2 ASN B 66 55.915 2.820 14.760 1.00 0.00 H new ATOM 0 HB3 ASN B 66 54.817 2.254 16.003 1.00 0.00 H new ATOM 0 HD21 ASN B 66 57.440 1.007 18.097 1.00 0.00 H new ATOM 0 HD22 ASN B 66 55.710 1.305 17.896 1.00 0.00 H new ATOM 1743 N ALA B 67 57.389 0.366 13.420 1.00 0.00 N ATOM 1744 CA ALA B 67 58.324 0.281 12.306 1.00 0.00 C ATOM 1745 C ALA B 67 57.881 -0.799 11.329 1.00 0.00 C ATOM 1746 O ALA B 67 57.963 -0.624 10.113 1.00 0.00 O ATOM 1747 CB ALA B 67 59.733 -0.025 12.821 1.00 0.00 C ATOM 0 H ALA B 67 57.784 0.116 14.327 1.00 0.00 H new ATOM 0 HA ALA B 67 58.338 1.240 11.788 1.00 0.00 H new ATOM 0 HB1 ALA B 67 60.423 -0.086 11.979 1.00 0.00 H new ATOM 0 HB2 ALA B 67 60.054 0.768 13.496 1.00 0.00 H new ATOM 0 HB3 ALA B 67 59.727 -0.975 13.355 1.00 0.00 H new ATOM 1753 N ALA B 68 57.408 -1.920 11.873 1.00 0.00 N ATOM 1754 CA ALA B 68 56.950 -3.025 11.044 1.00 0.00 C ATOM 1755 C ALA B 68 55.750 -2.598 10.203 1.00 0.00 C ATOM 1756 O ALA B 68 55.635 -2.970 9.035 1.00 0.00 O ATOM 1757 CB ALA B 68 56.575 -4.214 11.927 1.00 0.00 C ATOM 0 H ALA B 68 57.334 -2.083 12.877 1.00 0.00 H new ATOM 0 HA ALA B 68 57.757 -3.318 10.373 1.00 0.00 H new ATOM 0 HB1 ALA B 68 56.233 -5.038 11.301 1.00 0.00 H new ATOM 0 HB2 ALA B 68 57.446 -4.531 12.500 1.00 0.00 H new ATOM 0 HB3 ALA B 68 55.778 -3.922 12.611 1.00 0.00 H new ATOM 1763 N ALA B 69 54.853 -1.821 10.807 1.00 0.00 N ATOM 1764 CA ALA B 69 53.663 -1.360 10.102 1.00 0.00 C ATOM 1765 C ALA B 69 54.045 -0.532 8.881 1.00 0.00 C ATOM 1766 O ALA B 69 53.464 -0.686 7.809 1.00 0.00 O ATOM 1767 CB ALA B 69 52.802 -0.514 11.042 1.00 0.00 C ATOM 0 H ALA B 69 54.927 -1.501 11.773 1.00 0.00 H new ATOM 0 HA ALA B 69 53.099 -2.232 9.770 1.00 0.00 H new ATOM 0 HB1 ALA B 69 51.914 -0.171 10.512 1.00 0.00 H new ATOM 0 HB2 ALA B 69 52.503 -1.115 11.901 1.00 0.00 H new ATOM 0 HB3 ALA B 69 53.375 0.348 11.384 1.00 0.00 H new ATOM 1773 N ILE B 70 55.034 0.334 9.044 1.00 0.00 N ATOM 1774 CA ILE B 70 55.486 1.172 7.941 1.00 0.00 C ATOM 1775 C ILE B 70 55.997 0.306 6.801 1.00 0.00 C ATOM 1776 O ILE B 70 55.646 0.522 5.641 1.00 0.00 O ATOM 1777 CB ILE B 70 56.602 2.112 8.427 1.00 0.00 C ATOM 1778 CG1 ILE B 70 56.001 3.466 8.815 1.00 0.00 C ATOM 1779 CG2 ILE B 70 57.646 2.326 7.318 1.00 0.00 C ATOM 1780 CD1 ILE B 70 54.805 3.258 9.750 1.00 0.00 C ATOM 0 H ILE B 70 55.536 0.475 9.921 1.00 0.00 H new ATOM 0 HA ILE B 70 54.647 1.767 7.581 1.00 0.00 H new ATOM 0 HB ILE B 70 57.086 1.658 9.291 1.00 0.00 H new ATOM 0 HG12 ILE B 70 56.755 4.081 9.306 1.00 0.00 H new ATOM 0 HG13 ILE B 70 55.685 4.003 7.921 1.00 0.00 H new ATOM 0 HG21 ILE B 70 58.428 2.994 7.679 1.00 0.00 H new ATOM 0 HG22 ILE B 70 58.086 1.367 7.042 1.00 0.00 H new ATOM 0 HG23 ILE B 70 57.165 2.769 6.446 1.00 0.00 H new ATOM 0 HD11 ILE B 70 54.383 4.226 10.022 1.00 0.00 H new ATOM 0 HD12 ILE B 70 54.047 2.661 9.244 1.00 0.00 H new ATOM 0 HD13 ILE B 70 55.133 2.740 10.651 1.00 0.00 H new ATOM 1792 N LYS B 71 56.828 -0.669 7.136 1.00 0.00 N ATOM 1793 CA LYS B 71 57.380 -1.551 6.123 1.00 0.00 C ATOM 1794 C LYS B 71 56.268 -2.359 5.464 1.00 0.00 C ATOM 1795 O LYS B 71 56.273 -2.567 4.252 1.00 0.00 O ATOM 1796 CB LYS B 71 58.400 -2.499 6.751 1.00 0.00 C ATOM 1797 CG LYS B 71 59.643 -1.706 7.170 1.00 0.00 C ATOM 1798 CD LYS B 71 60.685 -2.652 7.771 1.00 0.00 C ATOM 1799 CE LYS B 71 61.515 -3.293 6.651 1.00 0.00 C ATOM 1800 NZ LYS B 71 62.256 -2.228 5.921 1.00 0.00 N ATOM 0 H LYS B 71 57.131 -0.867 8.089 1.00 0.00 H new ATOM 0 HA LYS B 71 57.875 -0.943 5.366 1.00 0.00 H new ATOM 0 HB2 LYS B 71 57.964 -2.997 7.617 1.00 0.00 H new ATOM 0 HB3 LYS B 71 58.675 -3.278 6.040 1.00 0.00 H new ATOM 0 HG2 LYS B 71 60.063 -1.189 6.307 1.00 0.00 H new ATOM 0 HG3 LYS B 71 59.370 -0.942 7.898 1.00 0.00 H new ATOM 0 HD2 LYS B 71 61.337 -2.104 8.451 1.00 0.00 H new ATOM 0 HD3 LYS B 71 60.191 -3.426 8.358 1.00 0.00 H new ATOM 0 HE2 LYS B 71 62.214 -4.018 7.069 1.00 0.00 H new ATOM 0 HE3 LYS B 71 60.865 -3.836 5.965 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 63.153 -2.613 5.563 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 61.681 -1.890 5.123 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 62.452 -1.437 6.567 1.00 0.00 H new ATOM 1814 N ALA B 72 55.314 -2.807 6.276 1.00 0.00 N ATOM 1815 CA ALA B 72 54.199 -3.587 5.766 1.00 0.00 C ATOM 1816 C ALA B 72 53.395 -2.763 4.771 1.00 0.00 C ATOM 1817 O ALA B 72 52.975 -3.270 3.730 1.00 0.00 O ATOM 1818 CB ALA B 72 53.294 -4.025 6.920 1.00 0.00 C ATOM 0 H ALA B 72 55.294 -2.643 7.282 1.00 0.00 H new ATOM 0 HA ALA B 72 54.592 -4.470 5.263 1.00 0.00 H new ATOM 0 HB1 ALA B 72 52.461 -4.609 6.528 1.00 0.00 H new ATOM 0 HB2 ALA B 72 53.866 -4.634 7.620 1.00 0.00 H new ATOM 0 HB3 ALA B 72 52.909 -3.145 7.435 1.00 0.00 H new ATOM 1824 N LEU B 73 53.181 -1.487 5.093 1.00 0.00 N ATOM 1825 CA LEU B 73 52.420 -0.620 4.203 1.00 0.00 C ATOM 1826 C LEU B 73 53.144 -0.460 2.867 1.00 0.00 C ATOM 1827 O LEU B 73 52.529 -0.533 1.802 1.00 0.00 O ATOM 1828 CB LEU B 73 52.229 0.752 4.857 1.00 0.00 C ATOM 1829 CG LEU B 73 51.407 1.665 3.938 1.00 0.00 C ATOM 1830 CD1 LEU B 73 50.022 1.057 3.712 1.00 0.00 C ATOM 1831 CD2 LEU B 73 51.260 3.040 4.585 1.00 0.00 C ATOM 0 H LEU B 73 53.517 -1.041 5.946 1.00 0.00 H new ATOM 0 HA LEU B 73 51.446 -1.073 4.020 1.00 0.00 H new ATOM 0 HB2 LEU B 73 51.724 0.639 5.816 1.00 0.00 H new ATOM 0 HB3 LEU B 73 53.199 1.205 5.059 1.00 0.00 H new ATOM 0 HG LEU B 73 51.917 1.766 2.980 1.00 0.00 H new ATOM 0 HD11 LEU B 73 49.441 1.708 3.059 1.00 0.00 H new ATOM 0 HD12 LEU B 73 50.126 0.077 3.247 1.00 0.00 H new ATOM 0 HD13 LEU B 73 49.510 0.952 4.669 1.00 0.00 H new ATOM 0 HD21 LEU B 73 50.676 3.689 3.932 1.00 0.00 H new ATOM 0 HD22 LEU B 73 50.752 2.938 5.544 1.00 0.00 H new ATOM 0 HD23 LEU B 73 52.247 3.476 4.741 1.00 0.00 H new ATOM 1843 N GLU B 74 54.451 -0.237 2.935 1.00 0.00 N ATOM 1844 CA GLU B 74 55.251 -0.062 1.729 1.00 0.00 C ATOM 1845 C GLU B 74 55.276 -1.346 0.916 1.00 0.00 C ATOM 1846 O GLU B 74 55.203 -1.305 -0.309 1.00 0.00 O ATOM 1847 CB GLU B 74 56.679 0.336 2.098 1.00 0.00 C ATOM 1848 CG GLU B 74 56.682 1.753 2.673 1.00 0.00 C ATOM 1849 CD GLU B 74 58.091 2.134 3.114 1.00 0.00 C ATOM 1850 OE1 GLU B 74 58.946 1.265 3.113 1.00 0.00 O ATOM 1851 OE2 GLU B 74 58.293 3.291 3.446 1.00 0.00 O ATOM 0 H GLU B 74 54.977 -0.173 3.807 1.00 0.00 H new ATOM 0 HA GLU B 74 54.799 0.729 1.130 1.00 0.00 H new ATOM 0 HB2 GLU B 74 57.086 -0.364 2.827 1.00 0.00 H new ATOM 0 HB3 GLU B 74 57.320 0.288 1.218 1.00 0.00 H new ATOM 0 HG2 GLU B 74 56.323 2.459 1.924 1.00 0.00 H new ATOM 0 HG3 GLU B 74 55.999 1.812 3.520 1.00 0.00 H new ATOM 1858 N LEU B 75 55.381 -2.484 1.605 1.00 0.00 N ATOM 1859 CA LEU B 75 55.421 -3.780 0.930 1.00 0.00 C ATOM 1860 C LEU B 75 54.149 -4.006 0.126 1.00 0.00 C ATOM 1861 O LEU B 75 54.198 -4.477 -1.010 1.00 0.00 O ATOM 1862 CB LEU B 75 55.581 -4.892 1.971 1.00 0.00 C ATOM 1863 CG LEU B 75 57.008 -4.874 2.523 1.00 0.00 C ATOM 1864 CD1 LEU B 75 57.029 -5.552 3.896 1.00 0.00 C ATOM 1865 CD2 LEU B 75 57.946 -5.647 1.584 1.00 0.00 C ATOM 0 H LEU B 75 55.439 -2.534 2.622 1.00 0.00 H new ATOM 0 HA LEU B 75 56.269 -3.793 0.245 1.00 0.00 H new ATOM 0 HB2 LEU B 75 54.865 -4.752 2.781 1.00 0.00 H new ATOM 0 HB3 LEU B 75 55.367 -5.861 1.520 1.00 0.00 H new ATOM 0 HG LEU B 75 57.341 -3.839 2.605 1.00 0.00 H new ATOM 0 HD11 LEU B 75 58.045 -5.541 4.292 1.00 0.00 H new ATOM 0 HD12 LEU B 75 56.368 -5.016 4.577 1.00 0.00 H new ATOM 0 HD13 LEU B 75 56.689 -6.583 3.798 1.00 0.00 H new ATOM 0 HD21 LEU B 75 58.959 -5.628 1.986 1.00 0.00 H new ATOM 0 HD22 LEU B 75 57.608 -6.680 1.501 1.00 0.00 H new ATOM 0 HD23 LEU B 75 57.938 -5.182 0.598 1.00 0.00 H new ATOM 1877 N TYR B 76 53.015 -3.651 0.716 1.00 0.00 N ATOM 1878 CA TYR B 76 51.733 -3.801 0.043 1.00 0.00 C ATOM 1879 C TYR B 76 51.705 -2.961 -1.230 1.00 0.00 C ATOM 1880 O TYR B 76 51.267 -3.424 -2.279 1.00 0.00 O ATOM 1881 CB TYR B 76 50.595 -3.383 0.970 1.00 0.00 C ATOM 1882 CG TYR B 76 49.285 -3.470 0.224 1.00 0.00 C ATOM 1883 CD1 TYR B 76 48.707 -4.719 -0.040 1.00 0.00 C ATOM 1884 CD2 TYR B 76 48.646 -2.301 -0.202 1.00 0.00 C ATOM 1885 CE1 TYR B 76 47.492 -4.797 -0.730 1.00 0.00 C ATOM 1886 CE2 TYR B 76 47.430 -2.378 -0.892 1.00 0.00 C ATOM 1887 CZ TYR B 76 46.852 -3.628 -1.155 1.00 0.00 C ATOM 1888 OH TYR B 76 45.654 -3.706 -1.835 1.00 0.00 O ATOM 0 H TYR B 76 52.957 -3.259 1.656 1.00 0.00 H new ATOM 0 HA TYR B 76 51.601 -4.850 -0.223 1.00 0.00 H new ATOM 0 HB2 TYR B 76 50.570 -4.029 1.848 1.00 0.00 H new ATOM 0 HB3 TYR B 76 50.756 -2.366 1.327 1.00 0.00 H new ATOM 0 HD1 TYR B 76 49.200 -5.622 0.289 1.00 0.00 H new ATOM 0 HD2 TYR B 76 49.091 -1.338 0.001 1.00 0.00 H new ATOM 0 HE1 TYR B 76 47.048 -5.760 -0.934 1.00 0.00 H new ATOM 0 HE2 TYR B 76 46.938 -1.475 -1.221 1.00 0.00 H new ATOM 0 HH TYR B 76 45.513 -4.625 -2.145 1.00 0.00 H new ATOM 1898 N LYS B 77 52.172 -1.720 -1.125 1.00 0.00 N ATOM 1899 CA LYS B 77 52.188 -0.823 -2.276 1.00 0.00 C ATOM 1900 C LYS B 77 52.980 -1.434 -3.426 1.00 0.00 C ATOM 1901 O LYS B 77 52.533 -1.418 -4.574 1.00 0.00 O ATOM 1902 CB LYS B 77 52.813 0.518 -1.874 1.00 0.00 C ATOM 1903 CG LYS B 77 53.077 1.361 -3.124 1.00 0.00 C ATOM 1904 CD LYS B 77 53.437 2.785 -2.713 1.00 0.00 C ATOM 1905 CE LYS B 77 54.610 3.272 -3.563 1.00 0.00 C ATOM 1906 NZ LYS B 77 54.250 3.199 -5.010 1.00 0.00 N ATOM 0 H LYS B 77 52.541 -1.316 -0.264 1.00 0.00 H new ATOM 0 HA LYS B 77 51.162 -0.665 -2.608 1.00 0.00 H new ATOM 0 HB2 LYS B 77 52.146 1.053 -1.198 1.00 0.00 H new ATOM 0 HB3 LYS B 77 53.745 0.348 -1.335 1.00 0.00 H new ATOM 0 HG2 LYS B 77 53.888 0.923 -3.706 1.00 0.00 H new ATOM 0 HG3 LYS B 77 52.194 1.368 -3.763 1.00 0.00 H new ATOM 0 HD2 LYS B 77 52.578 3.443 -2.846 1.00 0.00 H new ATOM 0 HD3 LYS B 77 53.701 2.815 -1.656 1.00 0.00 H new ATOM 0 HE2 LYS B 77 54.866 4.297 -3.294 1.00 0.00 H new ATOM 0 HE3 LYS B 77 55.491 2.662 -3.367 1.00 0.00 H new ATOM 0 HZ1 LYS B 77 54.867 3.836 -5.554 1.00 0.00 H new ATOM 0 HZ2 LYS B 77 54.374 2.224 -5.350 1.00 0.00 H new ATOM 0 HZ3 LYS B 77 53.258 3.486 -5.136 1.00 0.00 H new ATOM 1920 N ILE B 78 54.154 -1.967 -3.115 1.00 0.00 N ATOM 1921 CA ILE B 78 55.002 -2.577 -4.137 1.00 0.00 C ATOM 1922 C ILE B 78 54.562 -4.005 -4.421 1.00 0.00 C ATOM 1923 O ILE B 78 55.123 -4.676 -5.287 1.00 0.00 O ATOM 1924 CB ILE B 78 56.462 -2.559 -3.677 1.00 0.00 C ATOM 1925 CG1 ILE B 78 56.592 -3.375 -2.404 1.00 0.00 C ATOM 1926 CG2 ILE B 78 56.903 -1.120 -3.404 1.00 0.00 C ATOM 1927 CD1 ILE B 78 58.039 -3.325 -1.903 1.00 0.00 C ATOM 0 H ILE B 78 54.541 -1.991 -2.172 1.00 0.00 H new ATOM 0 HA ILE B 78 54.907 -2.000 -5.057 1.00 0.00 H new ATOM 0 HB ILE B 78 57.093 -2.985 -4.457 1.00 0.00 H new ATOM 0 HG12 ILE B 78 55.919 -2.985 -1.640 1.00 0.00 H new ATOM 0 HG13 ILE B 78 56.297 -4.408 -2.591 1.00 0.00 H new ATOM 0 HG21 ILE B 78 57.943 -1.114 -3.077 1.00 0.00 H new ATOM 0 HG22 ILE B 78 56.806 -0.531 -4.316 1.00 0.00 H new ATOM 0 HG23 ILE B 78 56.275 -0.689 -2.624 1.00 0.00 H new ATOM 0 HD11 ILE B 78 58.128 -3.912 -0.989 1.00 0.00 H new ATOM 0 HD12 ILE B 78 58.702 -3.736 -2.664 1.00 0.00 H new ATOM 0 HD13 ILE B 78 58.318 -2.291 -1.699 1.00 0.00 H new ATOM 1939 N ASN B 79 53.559 -4.461 -3.686 1.00 0.00 N ATOM 1940 CA ASN B 79 53.051 -5.810 -3.864 1.00 0.00 C ATOM 1941 C ASN B 79 54.167 -6.832 -3.665 1.00 0.00 C ATOM 1942 O ASN B 79 54.241 -7.832 -4.377 1.00 0.00 O ATOM 1943 CB ASN B 79 52.457 -5.968 -5.266 1.00 0.00 C ATOM 1944 CG ASN B 79 51.515 -7.167 -5.303 1.00 0.00 C ATOM 1945 OD1 ASN B 79 50.807 -7.430 -4.330 1.00 0.00 O ATOM 1946 ND2 ASN B 79 51.464 -7.915 -6.371 1.00 0.00 N ATOM 0 H ASN B 79 53.084 -3.919 -2.965 1.00 0.00 H new ATOM 0 HA ASN B 79 52.274 -5.985 -3.120 1.00 0.00 H new ATOM 0 HB2 ASN B 79 51.918 -5.063 -5.545 1.00 0.00 H new ATOM 0 HB3 ASN B 79 53.256 -6.101 -5.995 1.00 0.00 H new ATOM 0 HD21 ASN B 79 50.837 -8.719 -6.401 1.00 0.00 H new ATOM 0 HD22 ASN B 79 52.051 -7.696 -7.176 1.00 0.00 H new ATOM 1953 N ALA B 80 55.036 -6.573 -2.689 1.00 0.00 N ATOM 1954 CA ALA B 80 56.143 -7.476 -2.405 1.00 0.00 C ATOM 1955 C ALA B 80 55.622 -8.892 -2.192 1.00 0.00 C ATOM 1956 O ALA B 80 54.559 -9.091 -1.612 1.00 0.00 O ATOM 1957 CB ALA B 80 56.879 -7.013 -1.147 1.00 0.00 C ATOM 0 H ALA B 80 54.993 -5.751 -2.087 1.00 0.00 H new ATOM 0 HA ALA B 80 56.828 -7.469 -3.252 1.00 0.00 H new ATOM 0 HB1 ALA B 80 57.706 -7.692 -0.939 1.00 0.00 H new ATOM 0 HB2 ALA B 80 57.266 -6.006 -1.302 1.00 0.00 H new ATOM 0 HB3 ALA B 80 56.190 -7.011 -0.302 1.00 0.00 H new ATOM 1963 N LYS B 81 56.381 -9.870 -2.670 1.00 0.00 N ATOM 1964 CA LYS B 81 55.995 -11.271 -2.538 1.00 0.00 C ATOM 1965 C LYS B 81 56.100 -11.721 -1.086 1.00 0.00 C ATOM 1966 O LYS B 81 56.977 -11.278 -0.347 1.00 0.00 O ATOM 1967 CB LYS B 81 56.894 -12.148 -3.412 1.00 0.00 C ATOM 1968 CG LYS B 81 56.669 -11.799 -4.883 1.00 0.00 C ATOM 1969 CD LYS B 81 57.573 -12.674 -5.757 1.00 0.00 C ATOM 1970 CE LYS B 81 57.355 -12.329 -7.231 1.00 0.00 C ATOM 1971 NZ LYS B 81 58.235 -13.184 -8.078 1.00 0.00 N ATOM 0 H LYS B 81 57.267 -9.720 -3.152 1.00 0.00 H new ATOM 0 HA LYS B 81 54.960 -11.374 -2.865 1.00 0.00 H new ATOM 0 HB2 LYS B 81 57.940 -11.994 -3.146 1.00 0.00 H new ATOM 0 HB3 LYS B 81 56.673 -13.201 -3.239 1.00 0.00 H new ATOM 0 HG2 LYS B 81 55.624 -11.956 -5.150 1.00 0.00 H new ATOM 0 HG3 LYS B 81 56.887 -10.745 -5.056 1.00 0.00 H new ATOM 0 HD2 LYS B 81 58.618 -12.518 -5.488 1.00 0.00 H new ATOM 0 HD3 LYS B 81 57.353 -13.728 -5.584 1.00 0.00 H new ATOM 0 HE2 LYS B 81 56.310 -12.484 -7.501 1.00 0.00 H new ATOM 0 HE3 LYS B 81 57.576 -11.276 -7.405 1.00 0.00 H new ATOM 0 HZ1 LYS B 81 58.087 -12.949 -9.080 1.00 0.00 H new ATOM 0 HZ2 LYS B 81 59.230 -13.015 -7.826 1.00 0.00 H new ATOM 0 HZ3 LYS B 81 58.003 -14.185 -7.919 1.00 0.00 H new ATOM 1985 N LEU B 82 55.192 -12.603 -0.685 1.00 0.00 N ATOM 1986 CA LEU B 82 55.183 -13.113 0.684 1.00 0.00 C ATOM 1987 C LEU B 82 56.017 -14.382 0.795 1.00 0.00 C ATOM 1988 O LEU B 82 56.136 -15.144 -0.164 1.00 0.00 O ATOM 1989 CB LEU B 82 53.749 -13.404 1.135 1.00 0.00 C ATOM 1990 CG LEU B 82 52.777 -12.502 0.367 1.00 0.00 C ATOM 1991 CD1 LEU B 82 52.081 -13.293 -0.744 1.00 0.00 C ATOM 1992 CD2 LEU B 82 51.724 -11.950 1.331 1.00 0.00 C ATOM 0 H LEU B 82 54.456 -12.979 -1.283 1.00 0.00 H new ATOM 0 HA LEU B 82 55.616 -12.349 1.329 1.00 0.00 H new ATOM 0 HB2 LEU B 82 53.507 -14.452 0.957 1.00 0.00 H new ATOM 0 HB3 LEU B 82 53.652 -13.231 2.207 1.00 0.00 H new ATOM 0 HG LEU B 82 53.337 -11.681 -0.080 1.00 0.00 H new ATOM 0 HD11 LEU B 82 51.394 -12.639 -1.281 1.00 0.00 H new ATOM 0 HD12 LEU B 82 52.828 -13.681 -1.437 1.00 0.00 H new ATOM 0 HD13 LEU B 82 51.525 -14.123 -0.307 1.00 0.00 H new ATOM 0 HD21 LEU B 82 51.032 -11.308 0.785 1.00 0.00 H new ATOM 0 HD22 LEU B 82 51.174 -12.776 1.781 1.00 0.00 H new ATOM 0 HD23 LEU B 82 52.215 -11.372 2.114 1.00 0.00 H new