USER MOD reduce.3.24.130724 H: found=0, std=0, add=859, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 861 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 433 ASN : amide:sc= -0.745! K(o=-9.4!,f=-20) USER MOD Set 1.2: B 437 HIS : no HD1:sc= -8.67! C(o=-9.4!,f=-20!) USER MOD Set 2.1: B 401 SER OG : rot 180:sc= 0.235 USER MOD Set 2.2: B 404 LYS NZ :NH3+ 132:sc= 0.242 (180deg=0.232) USER MOD Set 3.1: B 369 HIS : no HD1:sc= -18.1! C(o=-17!,f=-20!) USER MOD Set 3.2: B 372 TYR OH : rot -14:sc= 1.35 USER MOD Set 4.1: B 364 MET CE :methyl -158:sc= -3.29! (180deg=-2.78!) USER MOD Set 4.2: B 425 MET CE :methyl -159:sc= -9.53! (180deg=-11.5!) USER MOD Set 5.1: B 351 SER OG : rot -109:sc= 0.45 USER MOD Set 5.2: B 355 LYS NZ :NH3+ -178:sc= 0.49 (180deg=0) USER MOD Single : B 353 GLN : amide:sc= -1.61 K(o=-1.6,f=-0.58) USER MOD Single : B 356 CYS SG : rot 180:sc= 0 USER MOD Single : B 357 CYS SG : rot -86:sc= -17.6! USER MOD Single : B 358 SER OG : rot -70:sc= 0.556 USER MOD Single : B 362 LYS NZ :NH3+ 169:sc= -0.0657 (180deg=-0.138) USER MOD Single : B 367 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 368 LYS NZ :NH3+ 150:sc= -0.809 (180deg=-2.07!) USER MOD Single : B 377 TYR OH : rot -121:sc= -2.73! USER MOD Single : B 378 LYS NZ :NH3+ 162:sc= -0.564 (180deg=-1.32!) USER MOD Single : B 388 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 390 TYR OH : rot 180:sc= -3.18! USER MOD Single : B 391 CYS SG : rot -25:sc= 0.149 USER MOD Single : B 395 LYS NZ :NH3+ -153:sc= 1.18 (180deg=0.737) USER MOD Single : B 396 HIS : no HD1:sc= -1.95 X(o=-1.9,f=-1.6) USER MOD Single : B 398 MET CE :methyl 154:sc= -6.43! (180deg=-7.75!) USER MOD Single : B 400 MET CE :methyl 174:sc= -11.2! (180deg=-11.6!) USER MOD Single : B 402 THR OG1 : rot 118:sc= 1.13 USER MOD Single : B 405 SER OG : rot 180:sc= 0 USER MOD Single : B 406 LYS NZ :NH3+ -174:sc= -1.27! (180deg=-1.34!) USER MOD Single : B 412 TYR OH : rot 1:sc= -1.79 USER MOD Single : B 416 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : B 427 SER OG : rot 180:sc= 0 USER MOD Single : B 428 ASN : amide:sc= -7.42! C(o=-7.4!,f=-14!) USER MOD Single : B 429 CYS SG : rot -178:sc= -3.32! USER MOD Single : B 430 TYR OH : rot 14:sc= -1.55! USER MOD Single : B 431 LYS NZ :NH3+ -179:sc= -16.6! (180deg=-16.9!) USER MOD Single : B 432 TYR OH : rot 126:sc= -0.139 USER MOD Single : B 442 MET CE :methyl -127:sc= -2.7! (180deg=-6.36!) USER MOD Single : B 445 LYS NZ :NH3+ -121:sc= -0.116 (180deg=-0.663) USER MOD Single : B 447 GLN : amide:sc= -2.29! C(o=-2.3!,f=-5.5!) USER MOD Single : B 452 MET CE :methyl -134:sc= -0.212 (180deg=-0.87) USER MOD ----------------------------------------------------------------- ATOM 88 N ARG A 7 18.999 2.147 -1.164 1.00 0.00 N ATOM 89 CA ARG A 7 20.014 1.184 -1.590 1.00 0.00 C ATOM 90 C ARG A 7 19.443 -0.211 -1.438 1.00 0.00 C ATOM 91 O ARG A 7 20.157 -1.213 -1.414 1.00 0.00 O ATOM 92 CB ARG A 7 21.332 1.353 -0.816 1.00 0.00 C ATOM 93 CG ARG A 7 21.811 2.797 -0.762 1.00 0.00 C ATOM 94 CD ARG A 7 21.876 3.413 -2.149 1.00 0.00 C ATOM 95 NE ARG A 7 21.875 4.873 -2.101 1.00 0.00 N ATOM 96 CZ ARG A 7 21.887 5.651 -3.181 1.00 0.00 C ATOM 97 NH1 ARG A 7 21.975 5.108 -4.391 1.00 0.00 N ATOM 98 NH2 ARG A 7 21.827 6.970 -3.051 1.00 0.00 N ATOM 0 HA ARG A 7 20.264 1.362 -2.636 1.00 0.00 H new ATOM 0 HB2 ARG A 7 21.200 0.982 0.200 1.00 0.00 H new ATOM 0 HB3 ARG A 7 22.102 0.738 -1.282 1.00 0.00 H new ATOM 0 HG2 ARG A 7 21.139 3.381 -0.134 1.00 0.00 H new ATOM 0 HG3 ARG A 7 22.796 2.838 -0.298 1.00 0.00 H new ATOM 0 HD2 ARG A 7 22.777 3.068 -2.657 1.00 0.00 H new ATOM 0 HD3 ARG A 7 21.026 3.069 -2.738 1.00 0.00 H new ATOM 0 HE ARG A 7 21.864 5.323 -1.186 1.00 0.00 H new ATOM 0 HH11 ARG A 7 22.033 4.095 -4.492 1.00 0.00 H new ATOM 0 HH12 ARG A 7 21.984 5.705 -5.218 1.00 0.00 H new ATOM 0 HH21 ARG A 7 21.772 7.389 -2.123 1.00 0.00 H new ATOM 0 HH22 ARG A 7 21.836 7.565 -3.879 1.00 0.00 H new ATOM 112 N GLY A 8 18.119 -0.241 -1.375 1.00 0.00 N ATOM 113 CA GLY A 8 17.394 -1.462 -1.170 1.00 0.00 C ATOM 114 C GLY A 8 16.898 -2.073 -2.456 1.00 0.00 C ATOM 115 O GLY A 8 16.754 -1.372 -3.460 1.00 0.00 O ATOM 0 H GLY A 8 17.529 0.586 -1.466 1.00 0.00 H new ATOM 0 HA2 GLY A 8 18.036 -2.178 -0.657 1.00 0.00 H new ATOM 0 HA3 GLY A 8 16.545 -1.269 -0.514 1.00 0.00 H new ATOM 450 N VAL B 350 -19.090 -1.550 2.574 1.00 0.00 N ATOM 451 CA VAL B 350 -17.863 -1.412 3.351 1.00 0.00 C ATOM 452 C VAL B 350 -16.963 -2.640 3.318 1.00 0.00 C ATOM 453 O VAL B 350 -15.900 -2.621 2.718 1.00 0.00 O ATOM 454 CB VAL B 350 -18.241 -1.067 4.782 1.00 0.00 C ATOM 455 CG1 VAL B 350 -17.091 -0.405 5.462 1.00 0.00 C ATOM 456 CG2 VAL B 350 -19.456 -0.169 4.753 1.00 0.00 C ATOM 0 HA VAL B 350 -17.274 -0.617 2.894 1.00 0.00 H new ATOM 0 HB VAL B 350 -18.481 -1.970 5.344 1.00 0.00 H new ATOM 0 HG11 VAL B 350 -17.367 -0.160 6.488 1.00 0.00 H new ATOM 0 HG12 VAL B 350 -16.235 -1.079 5.468 1.00 0.00 H new ATOM 0 HG13 VAL B 350 -16.830 0.509 4.928 1.00 0.00 H new ATOM 0 HG21 VAL B 350 -19.742 0.089 5.773 1.00 0.00 H new ATOM 0 HG22 VAL B 350 -19.223 0.741 4.200 1.00 0.00 H new ATOM 0 HG23 VAL B 350 -20.281 -0.689 4.265 1.00 0.00 H new ATOM 466 N SER B 351 -17.362 -3.686 3.987 1.00 0.00 N ATOM 467 CA SER B 351 -16.627 -4.933 3.937 1.00 0.00 C ATOM 468 C SER B 351 -16.569 -5.483 2.511 1.00 0.00 C ATOM 469 O SER B 351 -15.651 -6.218 2.153 1.00 0.00 O ATOM 470 CB SER B 351 -17.241 -5.936 4.910 1.00 0.00 C ATOM 471 OG SER B 351 -16.473 -7.128 4.996 1.00 0.00 O ATOM 0 H SER B 351 -18.194 -3.706 4.577 1.00 0.00 H new ATOM 0 HA SER B 351 -15.598 -4.749 4.244 1.00 0.00 H new ATOM 0 HB2 SER B 351 -17.319 -5.482 5.898 1.00 0.00 H new ATOM 0 HB3 SER B 351 -18.254 -6.179 4.590 1.00 0.00 H new ATOM 0 HG SER B 351 -16.958 -7.862 4.564 1.00 0.00 H new ATOM 477 N GLU B 352 -17.518 -5.074 1.684 1.00 0.00 N ATOM 478 CA GLU B 352 -17.520 -5.438 0.280 1.00 0.00 C ATOM 479 C GLU B 352 -16.346 -4.744 -0.416 1.00 0.00 C ATOM 480 O GLU B 352 -15.704 -5.304 -1.309 1.00 0.00 O ATOM 481 CB GLU B 352 -18.871 -5.049 -0.327 1.00 0.00 C ATOM 482 CG GLU B 352 -18.793 -4.100 -1.494 1.00 0.00 C ATOM 483 CD GLU B 352 -19.862 -4.350 -2.538 1.00 0.00 C ATOM 484 OE1 GLU B 352 -20.419 -5.467 -2.575 1.00 0.00 O ATOM 485 OE2 GLU B 352 -20.137 -3.439 -3.347 1.00 0.00 O ATOM 0 H GLU B 352 -18.302 -4.485 1.966 1.00 0.00 H new ATOM 0 HA GLU B 352 -17.392 -6.512 0.149 1.00 0.00 H new ATOM 0 HB2 GLU B 352 -19.383 -5.956 -0.649 1.00 0.00 H new ATOM 0 HB3 GLU B 352 -19.485 -4.595 0.451 1.00 0.00 H new ATOM 0 HG2 GLU B 352 -18.883 -3.077 -1.129 1.00 0.00 H new ATOM 0 HG3 GLU B 352 -17.811 -4.187 -1.960 1.00 0.00 H new ATOM 492 N GLN B 353 -16.079 -3.523 0.036 1.00 0.00 N ATOM 493 CA GLN B 353 -14.898 -2.771 -0.343 1.00 0.00 C ATOM 494 C GLN B 353 -13.661 -3.577 -0.038 1.00 0.00 C ATOM 495 O GLN B 353 -12.753 -3.677 -0.851 1.00 0.00 O ATOM 496 CB GLN B 353 -14.831 -1.451 0.428 1.00 0.00 C ATOM 497 CG GLN B 353 -15.809 -0.395 -0.032 1.00 0.00 C ATOM 498 CD GLN B 353 -16.235 -0.581 -1.452 1.00 0.00 C ATOM 499 OE1 GLN B 353 -15.557 -0.130 -2.352 1.00 0.00 O ATOM 500 NE2 GLN B 353 -17.368 -1.213 -1.649 1.00 0.00 N ATOM 0 H GLN B 353 -16.688 -3.025 0.685 1.00 0.00 H new ATOM 0 HA GLN B 353 -14.953 -2.561 -1.411 1.00 0.00 H new ATOM 0 HB2 GLN B 353 -15.009 -1.654 1.484 1.00 0.00 H new ATOM 0 HB3 GLN B 353 -13.821 -1.050 0.346 1.00 0.00 H new ATOM 0 HG2 GLN B 353 -16.688 -0.415 0.612 1.00 0.00 H new ATOM 0 HG3 GLN B 353 -15.354 0.589 0.080 1.00 0.00 H new ATOM 0 HE21 GLN B 353 -17.897 -1.572 -0.854 1.00 0.00 H new ATOM 0 HE22 GLN B 353 -17.720 -1.346 -2.597 1.00 0.00 H new ATOM 509 N LEU B 354 -13.632 -4.165 1.133 1.00 0.00 N ATOM 510 CA LEU B 354 -12.469 -4.886 1.555 1.00 0.00 C ATOM 511 C LEU B 354 -12.277 -6.167 0.781 1.00 0.00 C ATOM 512 O LEU B 354 -11.158 -6.566 0.536 1.00 0.00 O ATOM 513 CB LEU B 354 -12.537 -5.200 3.000 1.00 0.00 C ATOM 514 CG LEU B 354 -12.577 -3.987 3.865 1.00 0.00 C ATOM 515 CD1 LEU B 354 -13.454 -4.209 5.059 1.00 0.00 C ATOM 516 CD2 LEU B 354 -11.181 -3.658 4.288 1.00 0.00 C ATOM 0 H LEU B 354 -14.400 -4.156 1.804 1.00 0.00 H new ATOM 0 HA LEU B 354 -11.617 -4.236 1.358 1.00 0.00 H new ATOM 0 HB2 LEU B 354 -13.424 -5.804 3.192 1.00 0.00 H new ATOM 0 HB3 LEU B 354 -11.673 -5.805 3.274 1.00 0.00 H new ATOM 0 HG LEU B 354 -12.998 -3.153 3.304 1.00 0.00 H new ATOM 0 HD11 LEU B 354 -13.466 -3.309 5.674 1.00 0.00 H new ATOM 0 HD12 LEU B 354 -14.468 -4.436 4.729 1.00 0.00 H new ATOM 0 HD13 LEU B 354 -13.067 -5.043 5.644 1.00 0.00 H new ATOM 0 HD21 LEU B 354 -11.192 -2.772 4.922 1.00 0.00 H new ATOM 0 HD22 LEU B 354 -10.762 -4.497 4.844 1.00 0.00 H new ATOM 0 HD23 LEU B 354 -10.570 -3.465 3.406 1.00 0.00 H new ATOM 528 N LYS B 355 -13.367 -6.833 0.424 1.00 0.00 N ATOM 529 CA LYS B 355 -13.271 -8.038 -0.382 1.00 0.00 C ATOM 530 C LYS B 355 -12.627 -7.720 -1.721 1.00 0.00 C ATOM 531 O LYS B 355 -11.863 -8.506 -2.285 1.00 0.00 O ATOM 532 CB LYS B 355 -14.646 -8.659 -0.591 1.00 0.00 C ATOM 533 CG LYS B 355 -14.759 -10.062 -0.035 1.00 0.00 C ATOM 534 CD LYS B 355 -14.309 -10.139 1.418 1.00 0.00 C ATOM 535 CE LYS B 355 -14.906 -9.022 2.241 1.00 0.00 C ATOM 536 NZ LYS B 355 -14.677 -9.196 3.700 1.00 0.00 N ATOM 0 H LYS B 355 -14.317 -6.562 0.677 1.00 0.00 H new ATOM 0 HA LYS B 355 -12.648 -8.759 0.148 1.00 0.00 H new ATOM 0 HB2 LYS B 355 -15.398 -8.027 -0.119 1.00 0.00 H new ATOM 0 HB3 LYS B 355 -14.870 -8.679 -1.658 1.00 0.00 H new ATOM 0 HG2 LYS B 355 -15.792 -10.400 -0.113 1.00 0.00 H new ATOM 0 HG3 LYS B 355 -14.155 -10.740 -0.638 1.00 0.00 H new ATOM 0 HD2 LYS B 355 -14.602 -11.100 1.840 1.00 0.00 H new ATOM 0 HD3 LYS B 355 -13.221 -10.087 1.467 1.00 0.00 H new ATOM 0 HE2 LYS B 355 -14.477 -8.072 1.921 1.00 0.00 H new ATOM 0 HE3 LYS B 355 -15.978 -8.969 2.050 1.00 0.00 H new ATOM 0 HZ1 LYS B 355 -15.136 -8.420 4.218 1.00 0.00 H new ATOM 0 HZ2 LYS B 355 -15.079 -10.104 4.009 1.00 0.00 H new ATOM 0 HZ3 LYS B 355 -13.655 -9.185 3.895 1.00 0.00 H new ATOM 550 N CYS B 356 -12.952 -6.542 -2.199 1.00 0.00 N ATOM 551 CA CYS B 356 -12.355 -5.987 -3.398 1.00 0.00 C ATOM 552 C CYS B 356 -10.915 -5.656 -3.121 1.00 0.00 C ATOM 553 O CYS B 356 -10.011 -6.140 -3.799 1.00 0.00 O ATOM 554 CB CYS B 356 -13.093 -4.727 -3.809 1.00 0.00 C ATOM 555 SG CYS B 356 -13.265 -4.508 -5.595 1.00 0.00 S ATOM 0 H CYS B 356 -13.645 -5.933 -1.764 1.00 0.00 H new ATOM 0 HA CYS B 356 -12.420 -6.716 -4.206 1.00 0.00 H new ATOM 0 HB2 CYS B 356 -14.086 -4.740 -3.360 1.00 0.00 H new ATOM 0 HB3 CYS B 356 -12.569 -3.864 -3.399 1.00 0.00 H new ATOM 0 HG CYS B 356 -13.910 -3.406 -5.837 1.00 0.00 H new ATOM 561 N CYS B 357 -10.714 -4.862 -2.089 1.00 0.00 N ATOM 562 CA CYS B 357 -9.408 -4.375 -1.754 1.00 0.00 C ATOM 563 C CYS B 357 -8.453 -5.471 -1.367 1.00 0.00 C ATOM 564 O CYS B 357 -7.259 -5.376 -1.636 1.00 0.00 O ATOM 565 CB CYS B 357 -9.483 -3.362 -0.666 1.00 0.00 C ATOM 566 SG CYS B 357 -9.619 -1.761 -1.428 1.00 0.00 S ATOM 0 H CYS B 357 -11.455 -4.542 -1.465 1.00 0.00 H new ATOM 0 HA CYS B 357 -9.016 -3.910 -2.659 1.00 0.00 H new ATOM 0 HB2 CYS B 357 -10.342 -3.554 -0.023 1.00 0.00 H new ATOM 0 HB3 CYS B 357 -8.595 -3.411 -0.035 1.00 0.00 H new ATOM 0 HG CYS B 357 -8.431 -1.309 -1.702 1.00 0.00 H new ATOM 572 N SER B 358 -8.955 -6.501 -0.718 1.00 0.00 N ATOM 573 CA SER B 358 -8.097 -7.600 -0.369 1.00 0.00 C ATOM 574 C SER B 358 -7.556 -8.225 -1.628 1.00 0.00 C ATOM 575 O SER B 358 -6.354 -8.293 -1.795 1.00 0.00 O ATOM 576 CB SER B 358 -8.803 -8.646 0.495 1.00 0.00 C ATOM 577 OG SER B 358 -10.030 -9.059 -0.079 1.00 0.00 O ATOM 0 H SER B 358 -9.929 -6.595 -0.430 1.00 0.00 H new ATOM 0 HA SER B 358 -7.277 -7.208 0.233 1.00 0.00 H new ATOM 0 HB2 SER B 358 -8.152 -9.511 0.624 1.00 0.00 H new ATOM 0 HB3 SER B 358 -8.986 -8.234 1.488 1.00 0.00 H new ATOM 0 HG SER B 358 -10.680 -8.328 -0.022 1.00 0.00 H new ATOM 583 N GLY B 359 -8.448 -8.615 -2.535 1.00 0.00 N ATOM 584 CA GLY B 359 -8.024 -9.156 -3.817 1.00 0.00 C ATOM 585 C GLY B 359 -7.150 -8.179 -4.586 1.00 0.00 C ATOM 586 O GLY B 359 -6.441 -8.560 -5.510 1.00 0.00 O ATOM 0 H GLY B 359 -9.459 -8.566 -2.405 1.00 0.00 H new ATOM 0 HA2 GLY B 359 -7.475 -10.084 -3.655 1.00 0.00 H new ATOM 0 HA3 GLY B 359 -8.902 -9.405 -4.414 1.00 0.00 H new ATOM 590 N ILE B 360 -7.220 -6.919 -4.191 1.00 0.00 N ATOM 591 CA ILE B 360 -6.404 -5.858 -4.755 1.00 0.00 C ATOM 592 C ILE B 360 -4.978 -5.886 -4.195 1.00 0.00 C ATOM 593 O ILE B 360 -4.004 -5.900 -4.947 1.00 0.00 O ATOM 594 CB ILE B 360 -7.060 -4.513 -4.472 1.00 0.00 C ATOM 595 CG1 ILE B 360 -8.283 -4.313 -5.344 1.00 0.00 C ATOM 596 CG2 ILE B 360 -6.093 -3.374 -4.657 1.00 0.00 C ATOM 597 CD1 ILE B 360 -8.940 -3.008 -5.039 1.00 0.00 C ATOM 0 H ILE B 360 -7.855 -6.600 -3.459 1.00 0.00 H new ATOM 0 HA ILE B 360 -6.333 -6.012 -5.832 1.00 0.00 H new ATOM 0 HB ILE B 360 -7.374 -4.519 -3.428 1.00 0.00 H new ATOM 0 HG12 ILE B 360 -7.996 -4.344 -6.395 1.00 0.00 H new ATOM 0 HG13 ILE B 360 -8.989 -5.128 -5.182 1.00 0.00 H new ATOM 0 HG21 ILE B 360 -6.597 -2.431 -4.446 1.00 0.00 H new ATOM 0 HG22 ILE B 360 -5.252 -3.496 -3.975 1.00 0.00 H new ATOM 0 HG23 ILE B 360 -5.729 -3.369 -5.684 1.00 0.00 H new ATOM 0 HD11 ILE B 360 -9.816 -2.884 -5.676 1.00 0.00 H new ATOM 0 HD12 ILE B 360 -9.246 -2.991 -3.993 1.00 0.00 H new ATOM 0 HD13 ILE B 360 -8.238 -2.195 -5.225 1.00 0.00 H new ATOM 609 N LEU B 361 -4.859 -5.871 -2.874 1.00 0.00 N ATOM 610 CA LEU B 361 -3.561 -6.057 -2.216 1.00 0.00 C ATOM 611 C LEU B 361 -2.998 -7.399 -2.561 1.00 0.00 C ATOM 612 O LEU B 361 -1.882 -7.519 -3.041 1.00 0.00 O ATOM 613 CB LEU B 361 -3.703 -6.045 -0.726 1.00 0.00 C ATOM 614 CG LEU B 361 -2.887 -5.007 -0.008 1.00 0.00 C ATOM 615 CD1 LEU B 361 -2.909 -5.332 1.444 1.00 0.00 C ATOM 616 CD2 LEU B 361 -1.485 -5.001 -0.478 1.00 0.00 C ATOM 0 H LEU B 361 -5.640 -5.733 -2.233 1.00 0.00 H new ATOM 0 HA LEU B 361 -2.918 -5.244 -2.553 1.00 0.00 H new ATOM 0 HB2 LEU B 361 -4.754 -5.891 -0.480 1.00 0.00 H new ATOM 0 HB3 LEU B 361 -3.427 -7.028 -0.344 1.00 0.00 H new ATOM 0 HG LEU B 361 -3.312 -4.022 -0.204 1.00 0.00 H new ATOM 0 HD11 LEU B 361 -2.323 -4.593 1.991 1.00 0.00 H new ATOM 0 HD12 LEU B 361 -3.938 -5.319 1.804 1.00 0.00 H new ATOM 0 HD13 LEU B 361 -2.482 -6.323 1.602 1.00 0.00 H new ATOM 0 HD21 LEU B 361 -0.923 -4.239 0.062 1.00 0.00 H new ATOM 0 HD22 LEU B 361 -1.037 -5.978 -0.298 1.00 0.00 H new ATOM 0 HD23 LEU B 361 -1.460 -4.782 -1.545 1.00 0.00 H new ATOM 628 N LYS B 362 -3.780 -8.397 -2.210 1.00 0.00 N ATOM 629 CA LYS B 362 -3.559 -9.784 -2.622 1.00 0.00 C ATOM 630 C LYS B 362 -3.090 -9.867 -4.080 1.00 0.00 C ATOM 631 O LYS B 362 -2.384 -10.797 -4.462 1.00 0.00 O ATOM 632 CB LYS B 362 -4.851 -10.575 -2.481 1.00 0.00 C ATOM 633 CG LYS B 362 -5.126 -11.111 -1.096 1.00 0.00 C ATOM 634 CD LYS B 362 -4.787 -10.134 -0.003 1.00 0.00 C ATOM 635 CE LYS B 362 -5.522 -10.513 1.256 1.00 0.00 C ATOM 636 NZ LYS B 362 -5.048 -11.807 1.821 1.00 0.00 N ATOM 0 H LYS B 362 -4.603 -8.275 -1.621 1.00 0.00 H new ATOM 0 HA LYS B 362 -2.784 -10.201 -1.979 1.00 0.00 H new ATOM 0 HB2 LYS B 362 -5.683 -9.938 -2.779 1.00 0.00 H new ATOM 0 HB3 LYS B 362 -4.825 -11.412 -3.179 1.00 0.00 H new ATOM 0 HG2 LYS B 362 -6.180 -11.380 -1.020 1.00 0.00 H new ATOM 0 HG3 LYS B 362 -4.552 -12.026 -0.947 1.00 0.00 H new ATOM 0 HD2 LYS B 362 -3.712 -10.133 0.177 1.00 0.00 H new ATOM 0 HD3 LYS B 362 -5.061 -9.123 -0.306 1.00 0.00 H new ATOM 0 HE2 LYS B 362 -5.394 -9.726 1.999 1.00 0.00 H new ATOM 0 HE3 LYS B 362 -6.589 -10.581 1.044 1.00 0.00 H new ATOM 0 HZ1 LYS B 362 -5.444 -11.935 2.774 1.00 0.00 H new ATOM 0 HZ2 LYS B 362 -5.359 -12.588 1.209 1.00 0.00 H new ATOM 0 HZ3 LYS B 362 -4.009 -11.803 1.875 1.00 0.00 H new ATOM 650 N GLU B 363 -3.523 -8.903 -4.891 1.00 0.00 N ATOM 651 CA GLU B 363 -3.078 -8.797 -6.275 1.00 0.00 C ATOM 652 C GLU B 363 -1.662 -8.239 -6.365 1.00 0.00 C ATOM 653 O GLU B 363 -0.852 -8.778 -7.076 1.00 0.00 O ATOM 654 CB GLU B 363 -4.015 -7.937 -7.108 1.00 0.00 C ATOM 655 CG GLU B 363 -3.628 -7.903 -8.572 1.00 0.00 C ATOM 656 CD GLU B 363 -3.826 -9.235 -9.272 1.00 0.00 C ATOM 657 OE1 GLU B 363 -4.628 -10.064 -8.788 1.00 0.00 O ATOM 658 OE2 GLU B 363 -3.196 -9.448 -10.326 1.00 0.00 O ATOM 0 H GLU B 363 -4.186 -8.181 -4.609 1.00 0.00 H new ATOM 0 HA GLU B 363 -3.086 -9.809 -6.679 1.00 0.00 H new ATOM 0 HB2 GLU B 363 -5.032 -8.318 -7.014 1.00 0.00 H new ATOM 0 HB3 GLU B 363 -4.017 -6.921 -6.713 1.00 0.00 H new ATOM 0 HG2 GLU B 363 -4.219 -7.141 -9.080 1.00 0.00 H new ATOM 0 HG3 GLU B 363 -2.583 -7.606 -8.658 1.00 0.00 H new ATOM 665 N MET B 364 -1.341 -7.158 -5.668 1.00 0.00 N ATOM 666 CA MET B 364 0.062 -6.728 -5.605 1.00 0.00 C ATOM 667 C MET B 364 0.872 -7.871 -5.027 1.00 0.00 C ATOM 668 O MET B 364 2.002 -8.132 -5.418 1.00 0.00 O ATOM 669 CB MET B 364 0.202 -5.432 -4.811 1.00 0.00 C ATOM 670 CG MET B 364 -0.531 -4.342 -5.538 1.00 0.00 C ATOM 671 SD MET B 364 -0.158 -2.671 -5.011 1.00 0.00 S ATOM 672 CE MET B 364 -0.670 -2.753 -3.317 1.00 0.00 C ATOM 0 H MET B 364 -2.001 -6.576 -5.153 1.00 0.00 H new ATOM 0 HA MET B 364 0.443 -6.499 -6.600 1.00 0.00 H new ATOM 0 HB2 MET B 364 -0.205 -5.557 -3.808 1.00 0.00 H new ATOM 0 HB3 MET B 364 1.254 -5.170 -4.698 1.00 0.00 H new ATOM 0 HG2 MET B 364 -0.308 -4.426 -6.602 1.00 0.00 H new ATOM 0 HG3 MET B 364 -1.602 -4.510 -5.422 1.00 0.00 H new ATOM 0 HE1 MET B 364 -0.878 -1.748 -2.951 1.00 0.00 H new ATOM 0 HE2 MET B 364 -1.571 -3.362 -3.238 1.00 0.00 H new ATOM 0 HE3 MET B 364 0.124 -3.200 -2.718 1.00 0.00 H new ATOM 682 N PHE B 365 0.212 -8.616 -4.166 1.00 0.00 N ATOM 683 CA PHE B 365 0.765 -9.817 -3.593 1.00 0.00 C ATOM 684 C PHE B 365 0.842 -10.950 -4.630 1.00 0.00 C ATOM 685 O PHE B 365 1.445 -11.990 -4.376 1.00 0.00 O ATOM 686 CB PHE B 365 -0.126 -10.306 -2.460 1.00 0.00 C ATOM 687 CG PHE B 365 0.324 -10.008 -1.082 1.00 0.00 C ATOM 688 CD1 PHE B 365 1.256 -10.808 -0.451 1.00 0.00 C ATOM 689 CD2 PHE B 365 -0.215 -8.953 -0.406 1.00 0.00 C ATOM 690 CE1 PHE B 365 1.645 -10.540 0.842 1.00 0.00 C ATOM 691 CE2 PHE B 365 0.164 -8.680 0.878 1.00 0.00 C ATOM 692 CZ PHE B 365 1.094 -9.470 1.506 1.00 0.00 C ATOM 0 H PHE B 365 -0.731 -8.400 -3.844 1.00 0.00 H new ATOM 0 HA PHE B 365 1.766 -9.573 -3.236 1.00 0.00 H new ATOM 0 HB2 PHE B 365 -1.117 -9.872 -2.595 1.00 0.00 H new ATOM 0 HB3 PHE B 365 -0.235 -11.386 -2.556 1.00 0.00 H new ATOM 0 HD1 PHE B 365 1.683 -11.650 -0.976 1.00 0.00 H new ATOM 0 HD2 PHE B 365 -0.949 -8.327 -0.891 1.00 0.00 H new ATOM 0 HE1 PHE B 365 2.377 -11.165 1.331 1.00 0.00 H new ATOM 0 HE2 PHE B 365 -0.270 -7.840 1.400 1.00 0.00 H new ATOM 0 HZ PHE B 365 1.393 -9.251 2.521 1.00 0.00 H new ATOM 702 N ALA B 366 0.158 -10.770 -5.757 1.00 0.00 N ATOM 703 CA ALA B 366 0.138 -11.759 -6.825 1.00 0.00 C ATOM 704 C ALA B 366 1.526 -11.976 -7.375 1.00 0.00 C ATOM 705 O ALA B 366 2.333 -11.054 -7.389 1.00 0.00 O ATOM 706 CB ALA B 366 -0.813 -11.348 -7.944 1.00 0.00 C ATOM 0 H ALA B 366 -0.396 -9.936 -5.953 1.00 0.00 H new ATOM 0 HA ALA B 366 -0.223 -12.696 -6.401 1.00 0.00 H new ATOM 0 HB1 ALA B 366 -0.805 -12.107 -8.726 1.00 0.00 H new ATOM 0 HB2 ALA B 366 -1.823 -11.249 -7.545 1.00 0.00 H new ATOM 0 HB3 ALA B 366 -0.492 -10.394 -8.362 1.00 0.00 H new ATOM 712 N LYS B 367 1.798 -13.195 -7.825 1.00 0.00 N ATOM 713 CA LYS B 367 3.054 -13.503 -8.495 1.00 0.00 C ATOM 714 C LYS B 367 3.221 -12.553 -9.675 1.00 0.00 C ATOM 715 O LYS B 367 4.329 -12.173 -10.054 1.00 0.00 O ATOM 716 CB LYS B 367 3.054 -14.953 -8.967 1.00 0.00 C ATOM 717 CG LYS B 367 4.431 -15.481 -9.291 1.00 0.00 C ATOM 718 CD LYS B 367 5.244 -15.747 -8.033 1.00 0.00 C ATOM 719 CE LYS B 367 6.616 -16.314 -8.364 1.00 0.00 C ATOM 720 NZ LYS B 367 7.419 -16.574 -7.140 1.00 0.00 N ATOM 0 H LYS B 367 1.163 -13.988 -7.737 1.00 0.00 H new ATOM 0 HA LYS B 367 3.887 -13.374 -7.804 1.00 0.00 H new ATOM 0 HB2 LYS B 367 2.606 -15.578 -8.194 1.00 0.00 H new ATOM 0 HB3 LYS B 367 2.423 -15.039 -9.852 1.00 0.00 H new ATOM 0 HG2 LYS B 367 4.341 -16.402 -9.867 1.00 0.00 H new ATOM 0 HG3 LYS B 367 4.958 -14.762 -9.919 1.00 0.00 H new ATOM 0 HD2 LYS B 367 5.358 -14.821 -7.470 1.00 0.00 H new ATOM 0 HD3 LYS B 367 4.706 -16.445 -7.392 1.00 0.00 H new ATOM 0 HE2 LYS B 367 6.500 -17.241 -8.926 1.00 0.00 H new ATOM 0 HE3 LYS B 367 7.151 -15.616 -9.008 1.00 0.00 H new ATOM 0 HZ1 LYS B 367 8.347 -16.960 -7.409 1.00 0.00 H new ATOM 0 HZ2 LYS B 367 7.552 -15.685 -6.617 1.00 0.00 H new ATOM 0 HZ3 LYS B 367 6.921 -17.259 -6.537 1.00 0.00 H new ATOM 734 N LYS B 368 2.076 -12.175 -10.225 1.00 0.00 N ATOM 735 CA LYS B 368 1.960 -11.131 -11.225 1.00 0.00 C ATOM 736 C LYS B 368 2.707 -9.843 -10.816 1.00 0.00 C ATOM 737 O LYS B 368 3.403 -9.247 -11.636 1.00 0.00 O ATOM 738 CB LYS B 368 0.492 -10.880 -11.456 1.00 0.00 C ATOM 739 CG LYS B 368 0.081 -9.491 -11.197 1.00 0.00 C ATOM 740 CD LYS B 368 -0.418 -8.779 -12.433 1.00 0.00 C ATOM 741 CE LYS B 368 0.653 -8.581 -13.496 1.00 0.00 C ATOM 742 NZ LYS B 368 0.800 -9.760 -14.399 1.00 0.00 N ATOM 0 H LYS B 368 1.181 -12.599 -9.980 1.00 0.00 H new ATOM 0 HA LYS B 368 2.434 -11.456 -12.151 1.00 0.00 H new ATOM 0 HB2 LYS B 368 0.247 -11.136 -12.487 1.00 0.00 H new ATOM 0 HB3 LYS B 368 -0.086 -11.546 -10.816 1.00 0.00 H new ATOM 0 HG2 LYS B 368 -0.704 -9.486 -10.441 1.00 0.00 H new ATOM 0 HG3 LYS B 368 0.926 -8.940 -10.784 1.00 0.00 H new ATOM 0 HD2 LYS B 368 -1.243 -9.348 -12.862 1.00 0.00 H new ATOM 0 HD3 LYS B 368 -0.817 -7.806 -12.146 1.00 0.00 H new ATOM 0 HE2 LYS B 368 0.408 -7.702 -14.092 1.00 0.00 H new ATOM 0 HE3 LYS B 368 1.608 -8.381 -13.010 1.00 0.00 H new ATOM 0 HZ1 LYS B 368 1.112 -9.441 -15.338 1.00 0.00 H new ATOM 0 HZ2 LYS B 368 1.505 -10.414 -14.004 1.00 0.00 H new ATOM 0 HZ3 LYS B 368 -0.115 -10.248 -14.485 1.00 0.00 H new ATOM 756 N HIS B 369 2.575 -9.416 -9.551 1.00 0.00 N ATOM 757 CA HIS B 369 3.243 -8.193 -9.093 1.00 0.00 C ATOM 758 C HIS B 369 4.335 -8.517 -8.097 1.00 0.00 C ATOM 759 O HIS B 369 4.941 -7.623 -7.546 1.00 0.00 O ATOM 760 CB HIS B 369 2.268 -7.151 -8.496 1.00 0.00 C ATOM 761 CG HIS B 369 1.054 -6.870 -9.319 1.00 0.00 C ATOM 762 ND1 HIS B 369 1.026 -5.998 -10.378 1.00 0.00 N ATOM 763 CD2 HIS B 369 -0.198 -7.349 -9.207 1.00 0.00 C ATOM 764 CE1 HIS B 369 -0.196 -5.955 -10.867 1.00 0.00 C ATOM 765 NE2 HIS B 369 -0.954 -6.760 -10.171 1.00 0.00 N ATOM 0 H HIS B 369 2.021 -9.892 -8.839 1.00 0.00 H new ATOM 0 HA HIS B 369 3.684 -7.739 -9.980 1.00 0.00 H new ATOM 0 HB2 HIS B 369 1.949 -7.498 -7.513 1.00 0.00 H new ATOM 0 HB3 HIS B 369 2.809 -6.217 -8.344 1.00 0.00 H new ATOM 0 HD2 HIS B 369 -0.541 -8.072 -8.481 1.00 0.00 H new ATOM 0 HE1 HIS B 369 -0.518 -5.354 -11.704 1.00 0.00 H new ATOM 0 HE2 HIS B 369 -1.949 -6.920 -10.326 1.00 0.00 H new ATOM 774 N ALA B 370 4.635 -9.790 -7.911 1.00 0.00 N ATOM 775 CA ALA B 370 5.660 -10.188 -6.954 1.00 0.00 C ATOM 776 C ALA B 370 7.044 -9.947 -7.490 1.00 0.00 C ATOM 777 O ALA B 370 8.034 -10.277 -6.850 1.00 0.00 O ATOM 778 CB ALA B 370 5.521 -11.636 -6.569 1.00 0.00 C ATOM 0 H ALA B 370 4.189 -10.563 -8.404 1.00 0.00 H new ATOM 0 HA ALA B 370 5.514 -9.569 -6.069 1.00 0.00 H new ATOM 0 HB1 ALA B 370 6.301 -11.899 -5.854 1.00 0.00 H new ATOM 0 HB2 ALA B 370 4.543 -11.800 -6.116 1.00 0.00 H new ATOM 0 HB3 ALA B 370 5.618 -12.260 -7.458 1.00 0.00 H new ATOM 784 N ALA B 371 7.108 -9.417 -8.680 1.00 0.00 N ATOM 785 CA ALA B 371 8.356 -8.969 -9.228 1.00 0.00 C ATOM 786 C ALA B 371 8.727 -7.644 -8.597 1.00 0.00 C ATOM 787 O ALA B 371 9.891 -7.239 -8.599 1.00 0.00 O ATOM 788 CB ALA B 371 8.214 -8.806 -10.720 1.00 0.00 C ATOM 0 H ALA B 371 6.303 -9.285 -9.292 1.00 0.00 H new ATOM 0 HA ALA B 371 9.138 -9.699 -9.020 1.00 0.00 H new ATOM 0 HB1 ALA B 371 9.160 -8.466 -11.141 1.00 0.00 H new ATOM 0 HB2 ALA B 371 7.942 -9.762 -11.166 1.00 0.00 H new ATOM 0 HB3 ALA B 371 7.437 -8.072 -10.933 1.00 0.00 H new ATOM 794 N TYR B 372 7.719 -6.968 -8.043 1.00 0.00 N ATOM 795 CA TYR B 372 7.905 -5.599 -7.606 1.00 0.00 C ATOM 796 C TYR B 372 6.960 -5.157 -6.494 1.00 0.00 C ATOM 797 O TYR B 372 6.965 -4.003 -6.098 1.00 0.00 O ATOM 798 CB TYR B 372 7.747 -4.705 -8.803 1.00 0.00 C ATOM 799 CG TYR B 372 6.530 -5.017 -9.617 1.00 0.00 C ATOM 800 CD1 TYR B 372 5.313 -4.499 -9.259 1.00 0.00 C ATOM 801 CD2 TYR B 372 6.613 -5.779 -10.775 1.00 0.00 C ATOM 802 CE1 TYR B 372 4.200 -4.720 -10.021 1.00 0.00 C ATOM 803 CE2 TYR B 372 5.497 -6.021 -11.544 1.00 0.00 C ATOM 804 CZ TYR B 372 4.291 -5.484 -11.167 1.00 0.00 C ATOM 805 OH TYR B 372 3.176 -5.706 -11.939 1.00 0.00 O ATOM 0 H TYR B 372 6.783 -7.345 -7.891 1.00 0.00 H new ATOM 0 HA TYR B 372 8.903 -5.529 -7.174 1.00 0.00 H new ATOM 0 HB2 TYR B 372 7.697 -3.668 -8.470 1.00 0.00 H new ATOM 0 HB3 TYR B 372 8.631 -4.795 -9.434 1.00 0.00 H new ATOM 0 HD1 TYR B 372 5.232 -3.906 -8.360 1.00 0.00 H new ATOM 0 HD2 TYR B 372 7.566 -6.187 -11.077 1.00 0.00 H new ATOM 0 HE1 TYR B 372 3.251 -4.297 -9.727 1.00 0.00 H new ATOM 0 HE2 TYR B 372 5.569 -6.627 -12.435 1.00 0.00 H new ATOM 0 HH TYR B 372 2.374 -5.454 -11.436 1.00 0.00 H new ATOM 815 N ALA B 373 6.144 -6.053 -6.007 1.00 0.00 N ATOM 816 CA ALA B 373 5.313 -5.753 -4.854 1.00 0.00 C ATOM 817 C ALA B 373 5.789 -6.558 -3.697 1.00 0.00 C ATOM 818 O ALA B 373 5.439 -6.306 -2.553 1.00 0.00 O ATOM 819 CB ALA B 373 3.863 -6.069 -5.098 1.00 0.00 C ATOM 0 H ALA B 373 6.031 -6.995 -6.383 1.00 0.00 H new ATOM 0 HA ALA B 373 5.393 -4.684 -4.655 1.00 0.00 H new ATOM 0 HB1 ALA B 373 3.283 -5.828 -4.207 1.00 0.00 H new ATOM 0 HB2 ALA B 373 3.499 -5.479 -5.939 1.00 0.00 H new ATOM 0 HB3 ALA B 373 3.755 -7.130 -5.325 1.00 0.00 H new ATOM 825 N TRP B 374 6.587 -7.545 -4.021 1.00 0.00 N ATOM 826 CA TRP B 374 7.168 -8.411 -3.036 1.00 0.00 C ATOM 827 C TRP B 374 7.862 -7.621 -1.898 1.00 0.00 C ATOM 828 O TRP B 374 7.754 -8.043 -0.756 1.00 0.00 O ATOM 829 CB TRP B 374 8.109 -9.405 -3.730 1.00 0.00 C ATOM 830 CG TRP B 374 9.366 -8.769 -4.230 1.00 0.00 C ATOM 831 CD1 TRP B 374 9.649 -8.414 -5.507 1.00 0.00 C ATOM 832 CD2 TRP B 374 10.475 -8.353 -3.440 1.00 0.00 C ATOM 833 NE1 TRP B 374 10.870 -7.797 -5.566 1.00 0.00 N ATOM 834 CE2 TRP B 374 11.402 -7.746 -4.298 1.00 0.00 C ATOM 835 CE3 TRP B 374 10.756 -8.432 -2.081 1.00 0.00 C ATOM 836 CZ2 TRP B 374 12.601 -7.216 -3.826 1.00 0.00 C ATOM 837 CZ3 TRP B 374 11.923 -7.905 -1.610 1.00 0.00 C ATOM 838 CH2 TRP B 374 12.841 -7.299 -2.475 1.00 0.00 C ATOM 0 H TRP B 374 6.850 -7.768 -4.981 1.00 0.00 H new ATOM 0 HA TRP B 374 6.374 -8.975 -2.546 1.00 0.00 H new ATOM 0 HB2 TRP B 374 8.365 -10.202 -3.032 1.00 0.00 H new ATOM 0 HB3 TRP B 374 7.586 -9.869 -4.566 1.00 0.00 H new ATOM 0 HD1 TRP B 374 9.005 -8.592 -6.355 1.00 0.00 H new ATOM 0 HE1 TRP B 374 11.312 -7.435 -6.411 1.00 0.00 H new ATOM 0 HE3 TRP B 374 10.059 -8.905 -1.406 1.00 0.00 H new ATOM 0 HZ2 TRP B 374 13.314 -6.758 -4.495 1.00 0.00 H new ATOM 0 HZ3 TRP B 374 12.142 -7.956 -0.554 1.00 0.00 H new ATOM 0 HH2 TRP B 374 13.756 -6.889 -2.073 1.00 0.00 H new ATOM 849 N PRO B 375 8.558 -6.447 -2.147 1.00 0.00 N ATOM 850 CA PRO B 375 9.211 -5.696 -1.067 1.00 0.00 C ATOM 851 C PRO B 375 8.203 -4.844 -0.341 1.00 0.00 C ATOM 852 O PRO B 375 8.539 -4.058 0.541 1.00 0.00 O ATOM 853 CB PRO B 375 10.232 -4.834 -1.800 1.00 0.00 C ATOM 854 CG PRO B 375 9.597 -4.539 -3.105 1.00 0.00 C ATOM 855 CD PRO B 375 8.762 -5.753 -3.449 1.00 0.00 C ATOM 0 HA PRO B 375 9.668 -6.334 -0.311 1.00 0.00 H new ATOM 0 HB2 PRO B 375 10.449 -3.919 -1.248 1.00 0.00 H new ATOM 0 HB3 PRO B 375 11.178 -5.361 -1.928 1.00 0.00 H new ATOM 0 HG2 PRO B 375 8.977 -3.644 -3.044 1.00 0.00 H new ATOM 0 HG3 PRO B 375 10.349 -4.354 -3.872 1.00 0.00 H new ATOM 0 HD2 PRO B 375 7.812 -5.466 -3.899 1.00 0.00 H new ATOM 0 HD3 PRO B 375 9.273 -6.396 -4.166 1.00 0.00 H new ATOM 863 N PHE B 376 6.965 -4.999 -0.761 1.00 0.00 N ATOM 864 CA PHE B 376 5.860 -4.324 -0.131 1.00 0.00 C ATOM 865 C PHE B 376 5.021 -5.309 0.639 1.00 0.00 C ATOM 866 O PHE B 376 4.438 -4.908 1.623 1.00 0.00 O ATOM 867 CB PHE B 376 5.006 -3.549 -1.135 1.00 0.00 C ATOM 868 CG PHE B 376 5.826 -2.601 -1.933 1.00 0.00 C ATOM 869 CD1 PHE B 376 6.603 -3.061 -2.970 1.00 0.00 C ATOM 870 CD2 PHE B 376 5.870 -1.265 -1.607 1.00 0.00 C ATOM 871 CE1 PHE B 376 7.405 -2.209 -3.680 1.00 0.00 C ATOM 872 CE2 PHE B 376 6.687 -0.404 -2.316 1.00 0.00 C ATOM 873 CZ PHE B 376 7.451 -0.882 -3.353 1.00 0.00 C ATOM 0 H PHE B 376 6.701 -5.595 -1.546 1.00 0.00 H new ATOM 0 HA PHE B 376 6.274 -3.592 0.562 1.00 0.00 H new ATOM 0 HB2 PHE B 376 4.504 -4.249 -1.803 1.00 0.00 H new ATOM 0 HB3 PHE B 376 4.228 -3.001 -0.605 1.00 0.00 H new ATOM 0 HD1 PHE B 376 6.580 -4.110 -3.228 1.00 0.00 H new ATOM 0 HD2 PHE B 376 5.265 -0.888 -0.796 1.00 0.00 H new ATOM 0 HE1 PHE B 376 8.001 -2.585 -4.498 1.00 0.00 H new ATOM 0 HE2 PHE B 376 6.725 0.643 -2.055 1.00 0.00 H new ATOM 0 HZ PHE B 376 8.088 -0.210 -3.910 1.00 0.00 H new ATOM 883 N TYR B 377 4.962 -6.607 0.222 1.00 0.00 N ATOM 884 CA TYR B 377 4.229 -7.599 1.033 1.00 0.00 C ATOM 885 C TYR B 377 4.707 -7.433 2.439 1.00 0.00 C ATOM 886 O TYR B 377 3.961 -7.289 3.371 1.00 0.00 O ATOM 887 CB TYR B 377 4.486 -9.078 0.710 1.00 0.00 C ATOM 888 CG TYR B 377 4.410 -9.547 -0.713 1.00 0.00 C ATOM 889 CD1 TYR B 377 4.070 -8.705 -1.716 1.00 0.00 C ATOM 890 CD2 TYR B 377 4.601 -10.886 -1.015 1.00 0.00 C ATOM 891 CE1 TYR B 377 3.895 -9.143 -2.997 1.00 0.00 C ATOM 892 CE2 TYR B 377 4.454 -11.343 -2.303 1.00 0.00 C ATOM 893 CZ TYR B 377 4.089 -10.461 -3.286 1.00 0.00 C ATOM 894 OH TYR B 377 3.877 -10.901 -4.550 1.00 0.00 O ATOM 0 H TYR B 377 5.393 -6.969 -0.629 1.00 0.00 H new ATOM 0 HA TYR B 377 3.174 -7.406 0.839 1.00 0.00 H new ATOM 0 HB2 TYR B 377 5.480 -9.326 1.083 1.00 0.00 H new ATOM 0 HB3 TYR B 377 3.773 -9.667 1.287 1.00 0.00 H new ATOM 0 HD1 TYR B 377 3.933 -7.656 -1.497 1.00 0.00 H new ATOM 0 HD2 TYR B 377 4.868 -11.578 -0.230 1.00 0.00 H new ATOM 0 HE1 TYR B 377 3.605 -8.452 -3.774 1.00 0.00 H new ATOM 0 HE2 TYR B 377 4.624 -12.384 -2.537 1.00 0.00 H new ATOM 0 HH TYR B 377 3.189 -11.599 -4.542 1.00 0.00 H new ATOM 904 N LYS B 378 5.987 -7.352 2.530 1.00 0.00 N ATOM 905 CA LYS B 378 6.659 -7.199 3.773 1.00 0.00 C ATOM 906 C LYS B 378 7.267 -5.814 3.857 1.00 0.00 C ATOM 907 O LYS B 378 7.300 -5.077 2.876 1.00 0.00 O ATOM 908 CB LYS B 378 7.695 -8.290 3.909 1.00 0.00 C ATOM 909 CG LYS B 378 8.123 -8.861 2.608 1.00 0.00 C ATOM 910 CD LYS B 378 8.922 -7.854 1.826 1.00 0.00 C ATOM 911 CE LYS B 378 10.415 -7.918 2.118 1.00 0.00 C ATOM 912 NZ LYS B 378 10.888 -9.310 2.356 1.00 0.00 N ATOM 0 H LYS B 378 6.611 -7.391 1.724 1.00 0.00 H new ATOM 0 HA LYS B 378 5.959 -7.295 4.603 1.00 0.00 H new ATOM 0 HB2 LYS B 378 8.567 -7.890 4.427 1.00 0.00 H new ATOM 0 HB3 LYS B 378 7.292 -9.088 4.533 1.00 0.00 H new ATOM 0 HG2 LYS B 378 8.721 -9.756 2.777 1.00 0.00 H new ATOM 0 HG3 LYS B 378 7.249 -9.166 2.033 1.00 0.00 H new ATOM 0 HD2 LYS B 378 8.759 -8.018 0.761 1.00 0.00 H new ATOM 0 HD3 LYS B 378 8.556 -6.853 2.054 1.00 0.00 H new ATOM 0 HE2 LYS B 378 10.965 -7.489 1.281 1.00 0.00 H new ATOM 0 HE3 LYS B 378 10.638 -7.307 2.993 1.00 0.00 H new ATOM 0 HZ1 LYS B 378 11.922 -9.349 2.247 1.00 0.00 H new ATOM 0 HZ2 LYS B 378 10.630 -9.604 3.319 1.00 0.00 H new ATOM 0 HZ3 LYS B 378 10.443 -9.950 1.667 1.00 0.00 H new ATOM 926 N PRO B 379 7.747 -5.454 5.028 1.00 0.00 N ATOM 927 CA PRO B 379 8.248 -4.118 5.318 1.00 0.00 C ATOM 928 C PRO B 379 9.616 -3.874 4.696 1.00 0.00 C ATOM 929 O PRO B 379 10.383 -4.815 4.467 1.00 0.00 O ATOM 930 CB PRO B 379 8.337 -4.103 6.857 1.00 0.00 C ATOM 931 CG PRO B 379 7.678 -5.374 7.304 1.00 0.00 C ATOM 932 CD PRO B 379 7.869 -6.330 6.176 1.00 0.00 C ATOM 0 HA PRO B 379 7.608 -3.336 4.910 1.00 0.00 H new ATOM 0 HB2 PRO B 379 9.374 -4.059 7.191 1.00 0.00 H new ATOM 0 HB3 PRO B 379 7.832 -3.231 7.272 1.00 0.00 H new ATOM 0 HG2 PRO B 379 8.131 -5.751 8.221 1.00 0.00 H new ATOM 0 HG3 PRO B 379 6.620 -5.217 7.512 1.00 0.00 H new ATOM 0 HD2 PRO B 379 8.841 -6.821 6.215 1.00 0.00 H new ATOM 0 HD3 PRO B 379 7.114 -7.117 6.173 1.00 0.00 H new ATOM 940 N VAL B 380 9.891 -2.604 4.402 1.00 0.00 N ATOM 941 CA VAL B 380 11.207 -2.169 3.944 1.00 0.00 C ATOM 942 C VAL B 380 12.287 -2.788 4.821 1.00 0.00 C ATOM 943 O VAL B 380 12.354 -2.541 6.031 1.00 0.00 O ATOM 944 CB VAL B 380 11.311 -0.623 3.904 1.00 0.00 C ATOM 945 CG1 VAL B 380 10.171 0.029 4.676 1.00 0.00 C ATOM 946 CG2 VAL B 380 12.641 -0.137 4.428 1.00 0.00 C ATOM 0 H VAL B 380 9.208 -1.850 4.475 1.00 0.00 H new ATOM 0 HA VAL B 380 11.355 -2.516 2.921 1.00 0.00 H new ATOM 0 HB VAL B 380 11.233 -0.328 2.857 1.00 0.00 H new ATOM 0 HG11 VAL B 380 10.273 1.113 4.629 1.00 0.00 H new ATOM 0 HG12 VAL B 380 9.218 -0.266 4.236 1.00 0.00 H new ATOM 0 HG13 VAL B 380 10.205 -0.294 5.717 1.00 0.00 H new ATOM 0 HG21 VAL B 380 12.674 0.952 4.383 1.00 0.00 H new ATOM 0 HG22 VAL B 380 12.766 -0.462 5.461 1.00 0.00 H new ATOM 0 HG23 VAL B 380 13.445 -0.550 3.819 1.00 0.00 H new ATOM 956 N ASP B 381 13.091 -3.640 4.209 1.00 0.00 N ATOM 957 CA ASP B 381 14.073 -4.414 4.941 1.00 0.00 C ATOM 958 C ASP B 381 15.328 -3.612 5.162 1.00 0.00 C ATOM 959 O ASP B 381 16.235 -3.588 4.345 1.00 0.00 O ATOM 960 CB ASP B 381 14.381 -5.717 4.231 1.00 0.00 C ATOM 961 CG ASP B 381 14.999 -6.744 5.161 1.00 0.00 C ATOM 962 OD1 ASP B 381 16.012 -6.430 5.824 1.00 0.00 O ATOM 963 OD2 ASP B 381 14.474 -7.876 5.228 1.00 0.00 O ATOM 0 H ASP B 381 13.081 -3.812 3.204 1.00 0.00 H new ATOM 0 HA ASP B 381 13.650 -4.658 5.915 1.00 0.00 H new ATOM 0 HB2 ASP B 381 13.464 -6.122 3.804 1.00 0.00 H new ATOM 0 HB3 ASP B 381 15.061 -5.525 3.401 1.00 0.00 H new ATOM 968 N VAL B 382 15.371 -2.996 6.311 1.00 0.00 N ATOM 969 CA VAL B 382 16.391 -2.032 6.661 1.00 0.00 C ATOM 970 C VAL B 382 17.765 -2.678 6.780 1.00 0.00 C ATOM 971 O VAL B 382 18.795 -1.999 6.760 1.00 0.00 O ATOM 972 CB VAL B 382 15.969 -1.367 7.968 1.00 0.00 C ATOM 973 CG1 VAL B 382 16.931 -0.283 8.411 1.00 0.00 C ATOM 974 CG2 VAL B 382 14.555 -0.838 7.786 1.00 0.00 C ATOM 0 H VAL B 382 14.685 -3.150 7.050 1.00 0.00 H new ATOM 0 HA VAL B 382 16.482 -1.286 5.872 1.00 0.00 H new ATOM 0 HB VAL B 382 15.991 -2.104 8.771 1.00 0.00 H new ATOM 0 HG11 VAL B 382 16.581 0.155 9.346 1.00 0.00 H new ATOM 0 HG12 VAL B 382 17.921 -0.714 8.561 1.00 0.00 H new ATOM 0 HG13 VAL B 382 16.984 0.491 7.645 1.00 0.00 H new ATOM 0 HG21 VAL B 382 14.226 -0.356 8.706 1.00 0.00 H new ATOM 0 HG22 VAL B 382 14.539 -0.114 6.972 1.00 0.00 H new ATOM 0 HG23 VAL B 382 13.885 -1.665 7.549 1.00 0.00 H new ATOM 984 N GLU B 383 17.774 -3.994 6.845 1.00 0.00 N ATOM 985 CA GLU B 383 19.004 -4.744 6.910 1.00 0.00 C ATOM 986 C GLU B 383 19.420 -5.141 5.508 1.00 0.00 C ATOM 987 O GLU B 383 20.522 -4.841 5.049 1.00 0.00 O ATOM 988 CB GLU B 383 18.815 -5.975 7.767 1.00 0.00 C ATOM 989 CG GLU B 383 19.722 -7.096 7.344 1.00 0.00 C ATOM 990 CD GLU B 383 20.789 -7.419 8.366 1.00 0.00 C ATOM 991 OE1 GLU B 383 21.834 -6.729 8.383 1.00 0.00 O ATOM 992 OE2 GLU B 383 20.597 -8.369 9.154 1.00 0.00 O ATOM 0 H GLU B 383 16.931 -4.568 6.854 1.00 0.00 H new ATOM 0 HA GLU B 383 19.784 -4.127 7.357 1.00 0.00 H new ATOM 0 HB2 GLU B 383 19.009 -5.725 8.810 1.00 0.00 H new ATOM 0 HB3 GLU B 383 17.778 -6.304 7.706 1.00 0.00 H new ATOM 0 HG2 GLU B 383 19.124 -7.988 7.159 1.00 0.00 H new ATOM 0 HG3 GLU B 383 20.200 -6.831 6.401 1.00 0.00 H new ATOM 999 N ALA B 384 18.496 -5.799 4.845 1.00 0.00 N ATOM 1000 CA ALA B 384 18.660 -6.265 3.486 1.00 0.00 C ATOM 1001 C ALA B 384 19.041 -5.130 2.563 1.00 0.00 C ATOM 1002 O ALA B 384 19.960 -5.238 1.749 1.00 0.00 O ATOM 1003 CB ALA B 384 17.335 -6.824 3.062 1.00 0.00 C ATOM 0 H ALA B 384 17.587 -6.031 5.246 1.00 0.00 H new ATOM 0 HA ALA B 384 19.453 -7.011 3.437 1.00 0.00 H new ATOM 0 HB1 ALA B 384 17.406 -7.191 2.038 1.00 0.00 H new ATOM 0 HB2 ALA B 384 17.058 -7.645 3.723 1.00 0.00 H new ATOM 0 HB3 ALA B 384 16.577 -6.043 3.116 1.00 0.00 H new ATOM 1009 N LEU B 385 18.318 -4.039 2.711 1.00 0.00 N ATOM 1010 CA LEU B 385 18.463 -2.896 1.843 1.00 0.00 C ATOM 1011 C LEU B 385 19.681 -2.062 2.243 1.00 0.00 C ATOM 1012 O LEU B 385 20.166 -1.234 1.474 1.00 0.00 O ATOM 1013 CB LEU B 385 17.199 -2.042 1.909 1.00 0.00 C ATOM 1014 CG LEU B 385 15.869 -2.782 1.718 1.00 0.00 C ATOM 1015 CD1 LEU B 385 14.743 -1.786 1.475 1.00 0.00 C ATOM 1016 CD2 LEU B 385 15.941 -3.787 0.585 1.00 0.00 C ATOM 0 H LEU B 385 17.613 -3.923 3.439 1.00 0.00 H new ATOM 0 HA LEU B 385 18.612 -3.248 0.822 1.00 0.00 H new ATOM 0 HB2 LEU B 385 17.175 -1.540 2.876 1.00 0.00 H new ATOM 0 HB3 LEU B 385 17.271 -1.265 1.148 1.00 0.00 H new ATOM 0 HG LEU B 385 15.664 -3.336 2.634 1.00 0.00 H new ATOM 0 HD11 LEU B 385 13.804 -2.324 1.341 1.00 0.00 H new ATOM 0 HD12 LEU B 385 14.659 -1.116 2.331 1.00 0.00 H new ATOM 0 HD13 LEU B 385 14.959 -1.204 0.579 1.00 0.00 H new ATOM 0 HD21 LEU B 385 14.979 -4.289 0.483 1.00 0.00 H new ATOM 0 HD22 LEU B 385 16.181 -3.271 -0.344 1.00 0.00 H new ATOM 0 HD23 LEU B 385 16.714 -4.524 0.801 1.00 0.00 H new ATOM 1028 N GLY B 386 20.172 -2.306 3.459 1.00 0.00 N ATOM 1029 CA GLY B 386 21.288 -1.542 3.993 1.00 0.00 C ATOM 1030 C GLY B 386 20.922 -0.096 4.220 1.00 0.00 C ATOM 1031 O GLY B 386 21.717 0.809 3.968 1.00 0.00 O ATOM 0 H GLY B 386 19.812 -3.025 4.087 1.00 0.00 H new ATOM 0 HA2 GLY B 386 21.615 -1.986 4.933 1.00 0.00 H new ATOM 0 HA3 GLY B 386 22.130 -1.599 3.304 1.00 0.00 H new ATOM 1035 N LEU B 387 19.718 0.107 4.721 1.00 0.00 N ATOM 1036 CA LEU B 387 19.144 1.437 4.847 1.00 0.00 C ATOM 1037 C LEU B 387 19.854 2.278 5.898 1.00 0.00 C ATOM 1038 O LEU B 387 20.427 3.320 5.581 1.00 0.00 O ATOM 1039 CB LEU B 387 17.675 1.333 5.191 1.00 0.00 C ATOM 1040 CG LEU B 387 16.827 0.651 4.133 1.00 0.00 C ATOM 1041 CD1 LEU B 387 15.395 1.017 4.282 1.00 0.00 C ATOM 1042 CD2 LEU B 387 17.276 1.017 2.758 1.00 0.00 C ATOM 0 H LEU B 387 19.110 -0.642 5.052 1.00 0.00 H new ATOM 0 HA LEU B 387 19.271 1.935 3.886 1.00 0.00 H new ATOM 0 HB2 LEU B 387 17.572 0.787 6.129 1.00 0.00 H new ATOM 0 HB3 LEU B 387 17.283 2.336 5.362 1.00 0.00 H new ATOM 0 HG LEU B 387 16.946 -0.423 4.275 1.00 0.00 H new ATOM 0 HD11 LEU B 387 14.809 0.515 3.512 1.00 0.00 H new ATOM 0 HD12 LEU B 387 15.041 0.709 5.266 1.00 0.00 H new ATOM 0 HD13 LEU B 387 15.283 2.096 4.178 1.00 0.00 H new ATOM 0 HD21 LEU B 387 16.648 0.512 2.024 1.00 0.00 H new ATOM 0 HD22 LEU B 387 17.195 2.096 2.624 1.00 0.00 H new ATOM 0 HD23 LEU B 387 18.313 0.711 2.620 1.00 0.00 H new ATOM 1054 N HIS B 388 19.794 1.812 7.150 1.00 0.00 N ATOM 1055 CA HIS B 388 20.389 2.506 8.303 1.00 0.00 C ATOM 1056 C HIS B 388 19.602 3.766 8.669 1.00 0.00 C ATOM 1057 O HIS B 388 19.093 3.884 9.781 1.00 0.00 O ATOM 1058 CB HIS B 388 21.858 2.868 8.057 1.00 0.00 C ATOM 1059 CG HIS B 388 22.741 1.697 7.754 1.00 0.00 C ATOM 1060 ND1 HIS B 388 23.433 1.569 6.570 1.00 0.00 N ATOM 1061 CD2 HIS B 388 23.053 0.604 8.489 1.00 0.00 C ATOM 1062 CE1 HIS B 388 24.130 0.450 6.588 1.00 0.00 C ATOM 1063 NE2 HIS B 388 23.917 -0.154 7.740 1.00 0.00 N ATOM 0 H HIS B 388 19.329 0.938 7.396 1.00 0.00 H new ATOM 0 HA HIS B 388 20.342 1.808 9.139 1.00 0.00 H new ATOM 0 HB2 HIS B 388 21.912 3.573 7.227 1.00 0.00 H new ATOM 0 HB3 HIS B 388 22.245 3.382 8.937 1.00 0.00 H new ATOM 0 HD2 HIS B 388 22.690 0.372 9.479 1.00 0.00 H new ATOM 0 HE1 HIS B 388 24.767 0.090 5.794 1.00 0.00 H new ATOM 0 HE2 HIS B 388 24.328 -1.042 8.028 1.00 0.00 H new ATOM 1072 N ASP B 389 19.498 4.694 7.722 1.00 0.00 N ATOM 1073 CA ASP B 389 18.832 5.979 7.951 1.00 0.00 C ATOM 1074 C ASP B 389 17.316 5.821 7.960 1.00 0.00 C ATOM 1075 O ASP B 389 16.593 6.738 8.338 1.00 0.00 O ATOM 1076 CB ASP B 389 19.228 6.981 6.865 1.00 0.00 C ATOM 1077 CG ASP B 389 20.727 7.194 6.778 1.00 0.00 C ATOM 1078 OD1 ASP B 389 21.423 6.340 6.186 1.00 0.00 O ATOM 1079 OD2 ASP B 389 21.218 8.221 7.295 1.00 0.00 O ATOM 0 H ASP B 389 19.869 4.581 6.779 1.00 0.00 H new ATOM 0 HA ASP B 389 19.151 6.348 8.926 1.00 0.00 H new ATOM 0 HB2 ASP B 389 18.859 6.629 5.901 1.00 0.00 H new ATOM 0 HB3 ASP B 389 18.741 7.936 7.063 1.00 0.00 H new ATOM 1084 N TYR B 390 16.863 4.655 7.513 1.00 0.00 N ATOM 1085 CA TYR B 390 15.445 4.275 7.469 1.00 0.00 C ATOM 1086 C TYR B 390 14.585 4.900 8.566 1.00 0.00 C ATOM 1087 O TYR B 390 13.625 5.582 8.259 1.00 0.00 O ATOM 1088 CB TYR B 390 15.373 2.795 7.571 1.00 0.00 C ATOM 1089 CG TYR B 390 14.017 2.275 7.867 1.00 0.00 C ATOM 1090 CD1 TYR B 390 13.073 2.279 6.886 1.00 0.00 C ATOM 1091 CD2 TYR B 390 13.692 1.764 9.117 1.00 0.00 C ATOM 1092 CE1 TYR B 390 11.832 1.781 7.108 1.00 0.00 C ATOM 1093 CE2 TYR B 390 12.438 1.263 9.362 1.00 0.00 C ATOM 1094 CZ TYR B 390 11.509 1.266 8.351 1.00 0.00 C ATOM 1095 OH TYR B 390 10.271 0.735 8.576 1.00 0.00 O ATOM 0 H TYR B 390 17.483 3.925 7.161 1.00 0.00 H new ATOM 0 HA TYR B 390 15.038 4.652 6.531 1.00 0.00 H new ATOM 0 HB2 TYR B 390 15.721 2.359 6.634 1.00 0.00 H new ATOM 0 HB3 TYR B 390 16.057 2.461 8.351 1.00 0.00 H new ATOM 0 HD1 TYR B 390 13.317 2.685 5.916 1.00 0.00 H new ATOM 0 HD2 TYR B 390 14.433 1.761 9.903 1.00 0.00 H new ATOM 0 HE1 TYR B 390 11.097 1.786 6.317 1.00 0.00 H new ATOM 0 HE2 TYR B 390 12.185 0.872 10.336 1.00 0.00 H new ATOM 0 HH TYR B 390 10.214 0.418 9.502 1.00 0.00 H new ATOM 1105 N CYS B 391 14.923 4.668 9.830 1.00 0.00 N ATOM 1106 CA CYS B 391 14.063 5.082 10.944 1.00 0.00 C ATOM 1107 C CYS B 391 13.910 6.603 11.011 1.00 0.00 C ATOM 1108 O CYS B 391 12.959 7.118 11.602 1.00 0.00 O ATOM 1109 CB CYS B 391 14.621 4.543 12.263 1.00 0.00 C ATOM 1110 SG CYS B 391 13.623 4.944 13.718 1.00 0.00 S ATOM 0 H CYS B 391 15.783 4.197 10.113 1.00 0.00 H new ATOM 0 HA CYS B 391 13.071 4.663 10.773 1.00 0.00 H new ATOM 0 HB2 CYS B 391 14.713 3.459 12.188 1.00 0.00 H new ATOM 0 HB3 CYS B 391 15.626 4.939 12.407 1.00 0.00 H new ATOM 0 HG CYS B 391 12.935 6.023 13.489 1.00 0.00 H new ATOM 1116 N ASP B 392 14.843 7.309 10.397 1.00 0.00 N ATOM 1117 CA ASP B 392 14.790 8.760 10.316 1.00 0.00 C ATOM 1118 C ASP B 392 13.827 9.175 9.247 1.00 0.00 C ATOM 1119 O ASP B 392 12.964 10.028 9.444 1.00 0.00 O ATOM 1120 CB ASP B 392 16.169 9.311 10.006 1.00 0.00 C ATOM 1121 CG ASP B 392 16.833 9.952 11.208 1.00 0.00 C ATOM 1122 OD1 ASP B 392 17.021 9.257 12.230 1.00 0.00 O ATOM 1123 OD2 ASP B 392 17.185 11.148 11.135 1.00 0.00 O ATOM 0 H ASP B 392 15.657 6.895 9.942 1.00 0.00 H new ATOM 0 HA ASP B 392 14.454 9.157 11.274 1.00 0.00 H new ATOM 0 HB2 ASP B 392 16.802 8.505 9.635 1.00 0.00 H new ATOM 0 HB3 ASP B 392 16.089 10.047 9.206 1.00 0.00 H new ATOM 1128 N ILE B 393 13.998 8.544 8.121 1.00 0.00 N ATOM 1129 CA ILE B 393 13.131 8.719 6.994 1.00 0.00 C ATOM 1130 C ILE B 393 11.731 8.277 7.309 1.00 0.00 C ATOM 1131 O ILE B 393 10.780 9.052 7.344 1.00 0.00 O ATOM 1132 CB ILE B 393 13.648 7.868 5.839 1.00 0.00 C ATOM 1133 CG1 ILE B 393 14.985 8.374 5.401 1.00 0.00 C ATOM 1134 CG2 ILE B 393 12.711 7.942 4.680 1.00 0.00 C ATOM 1135 CD1 ILE B 393 16.045 7.333 5.322 1.00 0.00 C ATOM 0 H ILE B 393 14.757 7.882 7.959 1.00 0.00 H new ATOM 0 HA ILE B 393 13.118 9.778 6.734 1.00 0.00 H new ATOM 0 HB ILE B 393 13.727 6.836 6.180 1.00 0.00 H new ATOM 0 HG12 ILE B 393 14.879 8.841 4.422 1.00 0.00 H new ATOM 0 HG13 ILE B 393 15.309 9.152 6.092 1.00 0.00 H new ATOM 0 HG21 ILE B 393 13.093 7.330 3.863 1.00 0.00 H new ATOM 0 HG22 ILE B 393 11.730 7.574 4.981 1.00 0.00 H new ATOM 0 HG23 ILE B 393 12.624 8.977 4.348 1.00 0.00 H new ATOM 0 HD11 ILE B 393 16.980 7.790 4.997 1.00 0.00 H new ATOM 0 HD12 ILE B 393 16.185 6.881 6.304 1.00 0.00 H new ATOM 0 HD13 ILE B 393 15.748 6.565 4.608 1.00 0.00 H new ATOM 1147 N ILE B 394 11.651 7.010 7.562 1.00 0.00 N ATOM 1148 CA ILE B 394 10.429 6.290 7.578 1.00 0.00 C ATOM 1149 C ILE B 394 9.705 6.449 8.894 1.00 0.00 C ATOM 1150 O ILE B 394 10.049 5.839 9.907 1.00 0.00 O ATOM 1151 CB ILE B 394 10.741 4.833 7.295 1.00 0.00 C ATOM 1152 CG1 ILE B 394 11.274 4.673 5.872 1.00 0.00 C ATOM 1153 CG2 ILE B 394 9.545 3.959 7.557 1.00 0.00 C ATOM 1154 CD1 ILE B 394 10.246 4.880 4.800 1.00 0.00 C ATOM 0 H ILE B 394 12.466 6.433 7.770 1.00 0.00 H new ATOM 0 HA ILE B 394 9.761 6.685 6.813 1.00 0.00 H new ATOM 0 HB ILE B 394 11.523 4.503 7.979 1.00 0.00 H new ATOM 0 HG12 ILE B 394 12.088 5.382 5.720 1.00 0.00 H new ATOM 0 HG13 ILE B 394 11.697 3.674 5.765 1.00 0.00 H new ATOM 0 HG21 ILE B 394 9.800 2.921 7.345 1.00 0.00 H new ATOM 0 HG22 ILE B 394 9.247 4.054 8.601 1.00 0.00 H new ATOM 0 HG23 ILE B 394 8.720 4.269 6.915 1.00 0.00 H new ATOM 0 HD11 ILE B 394 10.709 4.748 3.822 1.00 0.00 H new ATOM 0 HD12 ILE B 394 9.442 4.154 4.922 1.00 0.00 H new ATOM 0 HD13 ILE B 394 9.839 5.888 4.876 1.00 0.00 H new ATOM 1166 N LYS B 395 8.706 7.296 8.859 1.00 0.00 N ATOM 1167 CA LYS B 395 7.881 7.545 10.011 1.00 0.00 C ATOM 1168 C LYS B 395 6.806 6.479 10.109 1.00 0.00 C ATOM 1169 O LYS B 395 6.458 6.022 11.193 1.00 0.00 O ATOM 1170 CB LYS B 395 7.242 8.910 9.880 1.00 0.00 C ATOM 1171 CG LYS B 395 8.184 9.963 9.324 1.00 0.00 C ATOM 1172 CD LYS B 395 9.319 10.271 10.274 1.00 0.00 C ATOM 1173 CE LYS B 395 10.078 11.491 9.805 1.00 0.00 C ATOM 1174 NZ LYS B 395 11.227 11.806 10.689 1.00 0.00 N ATOM 0 H LYS B 395 8.444 7.831 8.031 1.00 0.00 H new ATOM 0 HA LYS B 395 8.492 7.516 10.913 1.00 0.00 H new ATOM 0 HB2 LYS B 395 6.369 8.834 9.231 1.00 0.00 H new ATOM 0 HB3 LYS B 395 6.885 9.232 10.858 1.00 0.00 H new ATOM 0 HG2 LYS B 395 8.591 9.619 8.373 1.00 0.00 H new ATOM 0 HG3 LYS B 395 7.625 10.876 9.119 1.00 0.00 H new ATOM 0 HD2 LYS B 395 8.927 10.441 11.277 1.00 0.00 H new ATOM 0 HD3 LYS B 395 9.993 9.416 10.336 1.00 0.00 H new ATOM 0 HE2 LYS B 395 10.437 11.326 8.789 1.00 0.00 H new ATOM 0 HE3 LYS B 395 9.403 12.346 9.770 1.00 0.00 H new ATOM 0 HZ1 LYS B 395 11.432 12.824 10.642 1.00 0.00 H new ATOM 0 HZ2 LYS B 395 10.993 11.545 11.668 1.00 0.00 H new ATOM 0 HZ3 LYS B 395 12.062 11.270 10.378 1.00 0.00 H new ATOM 1188 N HIS B 396 6.302 6.072 8.954 1.00 0.00 N ATOM 1189 CA HIS B 396 5.249 5.094 8.876 1.00 0.00 C ATOM 1190 C HIS B 396 5.397 4.313 7.614 1.00 0.00 C ATOM 1191 O HIS B 396 4.898 4.674 6.551 1.00 0.00 O ATOM 1192 CB HIS B 396 3.860 5.722 8.951 1.00 0.00 C ATOM 1193 CG HIS B 396 3.738 7.066 8.299 1.00 0.00 C ATOM 1194 ND1 HIS B 396 2.750 7.966 8.615 1.00 0.00 N ATOM 1195 CD2 HIS B 396 4.486 7.653 7.336 1.00 0.00 C ATOM 1196 CE1 HIS B 396 2.892 9.049 7.878 1.00 0.00 C ATOM 1197 NE2 HIS B 396 3.940 8.887 7.090 1.00 0.00 N ATOM 0 H HIS B 396 6.618 6.416 8.047 1.00 0.00 H new ATOM 0 HA HIS B 396 5.341 4.435 9.739 1.00 0.00 H new ATOM 0 HB2 HIS B 396 3.145 5.043 8.487 1.00 0.00 H new ATOM 0 HB3 HIS B 396 3.576 5.816 9.999 1.00 0.00 H new ATOM 0 HD2 HIS B 396 5.353 7.228 6.851 1.00 0.00 H new ATOM 0 HE1 HIS B 396 2.258 9.923 7.912 1.00 0.00 H new ATOM 0 HE2 HIS B 396 4.285 9.566 6.412 1.00 0.00 H new ATOM 1206 N PRO B 397 6.145 3.255 7.742 1.00 0.00 N ATOM 1207 CA PRO B 397 6.320 2.287 6.709 1.00 0.00 C ATOM 1208 C PRO B 397 5.150 1.335 6.701 1.00 0.00 C ATOM 1209 O PRO B 397 4.899 0.627 7.679 1.00 0.00 O ATOM 1210 CB PRO B 397 7.580 1.569 7.118 1.00 0.00 C ATOM 1211 CG PRO B 397 7.644 1.710 8.588 1.00 0.00 C ATOM 1212 CD PRO B 397 6.854 2.910 8.962 1.00 0.00 C ATOM 0 HA PRO B 397 6.383 2.720 5.710 1.00 0.00 H new ATOM 0 HB2 PRO B 397 7.549 0.520 6.824 1.00 0.00 H new ATOM 0 HB3 PRO B 397 8.456 2.008 6.641 1.00 0.00 H new ATOM 0 HG2 PRO B 397 7.243 0.821 9.075 1.00 0.00 H new ATOM 0 HG3 PRO B 397 8.678 1.815 8.917 1.00 0.00 H new ATOM 0 HD2 PRO B 397 6.164 2.696 9.778 1.00 0.00 H new ATOM 0 HD3 PRO B 397 7.498 3.725 9.294 1.00 0.00 H new ATOM 1220 N MET B 398 4.428 1.325 5.624 1.00 0.00 N ATOM 1221 CA MET B 398 3.346 0.400 5.488 1.00 0.00 C ATOM 1222 C MET B 398 3.841 -0.802 4.731 1.00 0.00 C ATOM 1223 O MET B 398 4.792 -0.707 3.956 1.00 0.00 O ATOM 1224 CB MET B 398 2.180 1.050 4.796 1.00 0.00 C ATOM 1225 CG MET B 398 0.970 0.166 4.680 1.00 0.00 C ATOM 1226 SD MET B 398 0.662 -0.825 6.158 1.00 0.00 S ATOM 1227 CE MET B 398 0.686 0.468 7.382 1.00 0.00 C ATOM 0 H MET B 398 4.568 1.946 4.827 1.00 0.00 H new ATOM 0 HA MET B 398 2.995 0.083 6.470 1.00 0.00 H new ATOM 0 HB2 MET B 398 1.906 1.955 5.339 1.00 0.00 H new ATOM 0 HB3 MET B 398 2.489 1.359 3.797 1.00 0.00 H new ATOM 0 HG2 MET B 398 0.096 0.784 4.477 1.00 0.00 H new ATOM 0 HG3 MET B 398 1.095 -0.499 3.825 1.00 0.00 H new ATOM 0 HE1 MET B 398 0.086 0.167 8.241 1.00 0.00 H new ATOM 0 HE2 MET B 398 1.713 0.647 7.702 1.00 0.00 H new ATOM 0 HE3 MET B 398 0.274 1.382 6.954 1.00 0.00 H new ATOM 1237 N ASP B 399 3.240 -1.929 4.981 1.00 0.00 N ATOM 1238 CA ASP B 399 3.581 -3.121 4.261 1.00 0.00 C ATOM 1239 C ASP B 399 2.316 -3.828 3.872 1.00 0.00 C ATOM 1240 O ASP B 399 1.406 -3.984 4.686 1.00 0.00 O ATOM 1241 CB ASP B 399 4.483 -4.046 5.088 1.00 0.00 C ATOM 1242 CG ASP B 399 3.834 -4.516 6.375 1.00 0.00 C ATOM 1243 OD1 ASP B 399 3.853 -3.762 7.371 1.00 0.00 O ATOM 1244 OD2 ASP B 399 3.300 -5.643 6.401 1.00 0.00 O ATOM 0 H ASP B 399 2.508 -2.048 5.681 1.00 0.00 H new ATOM 0 HA ASP B 399 4.143 -2.844 3.369 1.00 0.00 H new ATOM 0 HB2 ASP B 399 4.752 -4.914 4.486 1.00 0.00 H new ATOM 0 HB3 ASP B 399 5.409 -3.523 5.325 1.00 0.00 H new ATOM 1249 N MET B 400 2.287 -4.221 2.609 1.00 0.00 N ATOM 1250 CA MET B 400 1.182 -4.924 1.978 1.00 0.00 C ATOM 1251 C MET B 400 0.650 -6.047 2.855 1.00 0.00 C ATOM 1252 O MET B 400 -0.496 -6.435 2.724 1.00 0.00 O ATOM 1253 CB MET B 400 1.649 -5.497 0.633 1.00 0.00 C ATOM 1254 CG MET B 400 1.670 -4.506 -0.512 1.00 0.00 C ATOM 1255 SD MET B 400 2.485 -5.123 -1.977 1.00 0.00 S ATOM 1256 CE MET B 400 1.987 -6.820 -1.902 1.00 0.00 C ATOM 0 H MET B 400 3.064 -4.052 1.970 1.00 0.00 H new ATOM 0 HA MET B 400 0.371 -4.211 1.826 1.00 0.00 H new ATOM 0 HB2 MET B 400 2.651 -5.906 0.758 1.00 0.00 H new ATOM 0 HB3 MET B 400 0.997 -6.328 0.363 1.00 0.00 H new ATOM 0 HG2 MET B 400 0.645 -4.233 -0.764 1.00 0.00 H new ATOM 0 HG3 MET B 400 2.171 -3.595 -0.184 1.00 0.00 H new ATOM 0 HE1 MET B 400 2.319 -7.337 -2.802 1.00 0.00 H new ATOM 0 HE2 MET B 400 2.434 -7.292 -1.027 1.00 0.00 H new ATOM 0 HE3 MET B 400 0.901 -6.878 -1.831 1.00 0.00 H new ATOM 1266 N SER B 401 1.474 -6.565 3.743 1.00 0.00 N ATOM 1267 CA SER B 401 1.066 -7.665 4.588 1.00 0.00 C ATOM 1268 C SER B 401 0.251 -7.181 5.786 1.00 0.00 C ATOM 1269 O SER B 401 -0.693 -7.854 6.162 1.00 0.00 O ATOM 1270 CB SER B 401 2.290 -8.479 5.052 1.00 0.00 C ATOM 1271 OG SER B 401 1.919 -9.773 5.502 1.00 0.00 O ATOM 0 H SER B 401 2.429 -6.241 3.897 1.00 0.00 H new ATOM 0 HA SER B 401 0.423 -8.316 3.995 1.00 0.00 H new ATOM 0 HB2 SER B 401 3.000 -8.569 4.230 1.00 0.00 H new ATOM 0 HB3 SER B 401 2.798 -7.946 5.855 1.00 0.00 H new ATOM 0 HG SER B 401 2.719 -10.262 5.787 1.00 0.00 H new ATOM 1277 N THR B 402 0.594 -6.040 6.391 1.00 0.00 N ATOM 1278 CA THR B 402 -0.241 -5.513 7.471 1.00 0.00 C ATOM 1279 C THR B 402 -1.572 -5.089 6.926 1.00 0.00 C ATOM 1280 O THR B 402 -2.588 -5.587 7.351 1.00 0.00 O ATOM 1281 CB THR B 402 0.320 -4.290 8.195 1.00 0.00 C ATOM 1282 OG1 THR B 402 1.650 -4.556 8.665 1.00 0.00 O ATOM 1283 CG2 THR B 402 -0.595 -3.933 9.377 1.00 0.00 C ATOM 0 H THR B 402 1.415 -5.481 6.161 1.00 0.00 H new ATOM 0 HA THR B 402 -0.298 -6.335 8.185 1.00 0.00 H new ATOM 0 HB THR B 402 0.360 -3.450 7.501 1.00 0.00 H new ATOM 0 HG1 THR B 402 2.279 -3.943 8.231 1.00 0.00 H new ATOM 0 HG21 THR B 402 -0.197 -3.061 9.895 1.00 0.00 H new ATOM 0 HG22 THR B 402 -1.596 -3.710 9.008 1.00 0.00 H new ATOM 0 HG23 THR B 402 -0.642 -4.775 10.068 1.00 0.00 H new ATOM 1291 N ILE B 403 -1.551 -4.155 5.986 1.00 0.00 N ATOM 1292 CA ILE B 403 -2.746 -3.668 5.362 1.00 0.00 C ATOM 1293 C ILE B 403 -3.648 -4.808 4.943 1.00 0.00 C ATOM 1294 O ILE B 403 -4.862 -4.769 5.121 1.00 0.00 O ATOM 1295 CB ILE B 403 -2.340 -2.796 4.183 1.00 0.00 C ATOM 1296 CG1 ILE B 403 -3.401 -2.706 3.151 1.00 0.00 C ATOM 1297 CG2 ILE B 403 -1.075 -3.310 3.519 1.00 0.00 C ATOM 1298 CD1 ILE B 403 -2.846 -1.988 1.981 1.00 0.00 C ATOM 0 H ILE B 403 -0.695 -3.720 5.642 1.00 0.00 H new ATOM 0 HA ILE B 403 -3.324 -3.072 6.068 1.00 0.00 H new ATOM 0 HB ILE B 403 -2.166 -1.804 4.601 1.00 0.00 H new ATOM 0 HG12 ILE B 403 -3.736 -3.702 2.862 1.00 0.00 H new ATOM 0 HG13 ILE B 403 -4.270 -2.179 3.544 1.00 0.00 H new ATOM 0 HG21 ILE B 403 -0.815 -2.663 2.681 1.00 0.00 H new ATOM 0 HG22 ILE B 403 -0.260 -3.312 4.242 1.00 0.00 H new ATOM 0 HG23 ILE B 403 -1.241 -4.324 3.156 1.00 0.00 H new ATOM 0 HD11 ILE B 403 -3.609 -1.909 1.207 1.00 0.00 H new ATOM 0 HD12 ILE B 403 -2.531 -0.989 2.283 1.00 0.00 H new ATOM 0 HD13 ILE B 403 -1.989 -2.536 1.591 1.00 0.00 H new ATOM 1310 N LYS B 404 -3.037 -5.845 4.446 1.00 0.00 N ATOM 1311 CA LYS B 404 -3.737 -7.043 4.121 1.00 0.00 C ATOM 1312 C LYS B 404 -4.208 -7.756 5.371 1.00 0.00 C ATOM 1313 O LYS B 404 -5.343 -8.166 5.470 1.00 0.00 O ATOM 1314 CB LYS B 404 -2.780 -7.919 3.409 1.00 0.00 C ATOM 1315 CG LYS B 404 -3.086 -9.364 3.468 1.00 0.00 C ATOM 1316 CD LYS B 404 -1.896 -10.092 3.015 1.00 0.00 C ATOM 1317 CE LYS B 404 -1.099 -10.461 4.233 1.00 0.00 C ATOM 1318 NZ LYS B 404 -0.089 -11.508 3.977 1.00 0.00 N ATOM 0 H LYS B 404 -2.035 -5.878 4.256 1.00 0.00 H new ATOM 0 HA LYS B 404 -4.612 -6.808 3.515 1.00 0.00 H new ATOM 0 HB2 LYS B 404 -2.742 -7.614 2.363 1.00 0.00 H new ATOM 0 HB3 LYS B 404 -1.785 -7.757 3.825 1.00 0.00 H new ATOM 0 HG2 LYS B 404 -3.350 -9.658 4.484 1.00 0.00 H new ATOM 0 HG3 LYS B 404 -3.942 -9.600 2.836 1.00 0.00 H new ATOM 0 HD2 LYS B 404 -2.182 -10.985 2.459 1.00 0.00 H new ATOM 0 HD3 LYS B 404 -1.302 -9.474 2.342 1.00 0.00 H new ATOM 0 HE2 LYS B 404 -0.600 -9.571 4.615 1.00 0.00 H new ATOM 0 HE3 LYS B 404 -1.779 -10.805 5.013 1.00 0.00 H new ATOM 0 HZ1 LYS B 404 0.824 -11.216 4.380 1.00 0.00 H new ATOM 0 HZ2 LYS B 404 -0.393 -12.399 4.419 1.00 0.00 H new ATOM 0 HZ3 LYS B 404 0.014 -11.647 2.952 1.00 0.00 H new ATOM 1332 N SER B 405 -3.285 -7.937 6.291 1.00 0.00 N ATOM 1333 CA SER B 405 -3.557 -8.554 7.583 1.00 0.00 C ATOM 1334 C SER B 405 -4.742 -7.879 8.240 1.00 0.00 C ATOM 1335 O SER B 405 -5.546 -8.522 8.889 1.00 0.00 O ATOM 1336 CB SER B 405 -2.344 -8.389 8.505 1.00 0.00 C ATOM 1337 OG SER B 405 -2.089 -9.550 9.274 1.00 0.00 O ATOM 0 H SER B 405 -2.312 -7.659 6.167 1.00 0.00 H new ATOM 0 HA SER B 405 -3.768 -9.611 7.422 1.00 0.00 H new ATOM 0 HB2 SER B 405 -1.465 -8.153 7.906 1.00 0.00 H new ATOM 0 HB3 SER B 405 -2.511 -7.544 9.173 1.00 0.00 H new ATOM 0 HG SER B 405 -1.307 -9.399 9.845 1.00 0.00 H new ATOM 1343 N LYS B 406 -4.825 -6.571 8.063 1.00 0.00 N ATOM 1344 CA LYS B 406 -5.890 -5.787 8.634 1.00 0.00 C ATOM 1345 C LYS B 406 -7.177 -6.021 7.848 1.00 0.00 C ATOM 1346 O LYS B 406 -8.251 -6.038 8.421 1.00 0.00 O ATOM 1347 CB LYS B 406 -5.537 -4.324 8.624 1.00 0.00 C ATOM 1348 CG LYS B 406 -4.141 -4.038 9.106 1.00 0.00 C ATOM 1349 CD LYS B 406 -3.913 -4.332 10.562 1.00 0.00 C ATOM 1350 CE LYS B 406 -4.981 -3.714 11.424 1.00 0.00 C ATOM 1351 NZ LYS B 406 -4.762 -3.979 12.873 1.00 0.00 N ATOM 0 H LYS B 406 -4.153 -6.030 7.519 1.00 0.00 H new ATOM 0 HA LYS B 406 -6.037 -6.096 9.669 1.00 0.00 H new ATOM 0 HB2 LYS B 406 -5.648 -3.939 7.610 1.00 0.00 H new ATOM 0 HB3 LYS B 406 -6.247 -3.783 9.250 1.00 0.00 H new ATOM 0 HG2 LYS B 406 -3.438 -4.626 8.515 1.00 0.00 H new ATOM 0 HG3 LYS B 406 -3.914 -2.988 8.920 1.00 0.00 H new ATOM 0 HD2 LYS B 406 -3.897 -5.411 10.718 1.00 0.00 H new ATOM 0 HD3 LYS B 406 -2.937 -3.952 10.862 1.00 0.00 H new ATOM 0 HE2 LYS B 406 -5.005 -2.638 11.253 1.00 0.00 H new ATOM 0 HE3 LYS B 406 -5.955 -4.105 11.129 1.00 0.00 H new ATOM 0 HZ1 LYS B 406 -5.573 -3.623 13.418 1.00 0.00 H new ATOM 0 HZ2 LYS B 406 -4.664 -5.003 13.028 1.00 0.00 H new ATOM 0 HZ3 LYS B 406 -3.896 -3.497 13.187 1.00 0.00 H new ATOM 1365 N LEU B 407 -7.067 -6.146 6.514 1.00 0.00 N ATOM 1366 CA LEU B 407 -8.128 -6.720 5.702 1.00 0.00 C ATOM 1367 C LEU B 407 -8.571 -8.044 6.298 1.00 0.00 C ATOM 1368 O LEU B 407 -9.749 -8.271 6.561 1.00 0.00 O ATOM 1369 CB LEU B 407 -7.627 -7.026 4.288 1.00 0.00 C ATOM 1370 CG LEU B 407 -7.034 -5.876 3.496 1.00 0.00 C ATOM 1371 CD1 LEU B 407 -6.929 -6.269 2.057 1.00 0.00 C ATOM 1372 CD2 LEU B 407 -7.941 -4.703 3.621 1.00 0.00 C ATOM 0 H LEU B 407 -6.247 -5.853 5.984 1.00 0.00 H new ATOM 0 HA LEU B 407 -8.944 -5.998 5.673 1.00 0.00 H new ATOM 0 HB2 LEU B 407 -6.873 -7.810 4.359 1.00 0.00 H new ATOM 0 HB3 LEU B 407 -8.460 -7.435 3.716 1.00 0.00 H new ATOM 0 HG LEU B 407 -6.043 -5.628 3.876 1.00 0.00 H new ATOM 0 HD11 LEU B 407 -6.503 -5.445 1.485 1.00 0.00 H new ATOM 0 HD12 LEU B 407 -6.286 -7.145 1.965 1.00 0.00 H new ATOM 0 HD13 LEU B 407 -7.921 -6.504 1.671 1.00 0.00 H new ATOM 0 HD21 LEU B 407 -7.531 -3.865 3.058 1.00 0.00 H new ATOM 0 HD22 LEU B 407 -8.924 -4.960 3.226 1.00 0.00 H new ATOM 0 HD23 LEU B 407 -8.033 -4.424 4.671 1.00 0.00 H new ATOM 1384 N GLU B 408 -7.581 -8.905 6.508 1.00 0.00 N ATOM 1385 CA GLU B 408 -7.782 -10.243 7.035 1.00 0.00 C ATOM 1386 C GLU B 408 -8.219 -10.169 8.491 1.00 0.00 C ATOM 1387 O GLU B 408 -8.608 -11.165 9.103 1.00 0.00 O ATOM 1388 CB GLU B 408 -6.477 -11.055 6.905 1.00 0.00 C ATOM 1389 CG GLU B 408 -5.905 -11.090 5.497 1.00 0.00 C ATOM 1390 CD GLU B 408 -4.747 -12.062 5.328 1.00 0.00 C ATOM 1391 OE1 GLU B 408 -5.006 -13.246 5.038 1.00 0.00 O ATOM 1392 OE2 GLU B 408 -3.571 -11.645 5.448 1.00 0.00 O ATOM 0 H GLU B 408 -6.604 -8.687 6.313 1.00 0.00 H new ATOM 0 HA GLU B 408 -8.565 -10.741 6.463 1.00 0.00 H new ATOM 0 HB2 GLU B 408 -5.731 -10.633 7.578 1.00 0.00 H new ATOM 0 HB3 GLU B 408 -6.663 -12.077 7.235 1.00 0.00 H new ATOM 0 HG2 GLU B 408 -6.698 -11.360 4.799 1.00 0.00 H new ATOM 0 HG3 GLU B 408 -5.569 -10.089 5.226 1.00 0.00 H new ATOM 1399 N ALA B 409 -8.143 -8.964 9.018 1.00 0.00 N ATOM 1400 CA ALA B 409 -8.530 -8.666 10.379 1.00 0.00 C ATOM 1401 C ALA B 409 -9.846 -7.927 10.401 1.00 0.00 C ATOM 1402 O ALA B 409 -10.464 -7.770 11.451 1.00 0.00 O ATOM 1403 CB ALA B 409 -7.433 -7.856 11.070 1.00 0.00 C ATOM 0 H ALA B 409 -7.805 -8.151 8.503 1.00 0.00 H new ATOM 0 HA ALA B 409 -8.660 -9.601 10.924 1.00 0.00 H new ATOM 0 HB1 ALA B 409 -7.733 -7.636 12.094 1.00 0.00 H new ATOM 0 HB2 ALA B 409 -6.507 -8.431 11.079 1.00 0.00 H new ATOM 0 HB3 ALA B 409 -7.275 -6.922 10.530 1.00 0.00 H new ATOM 1409 N ARG B 410 -10.275 -7.503 9.211 1.00 0.00 N ATOM 1410 CA ARG B 410 -11.449 -6.654 9.048 1.00 0.00 C ATOM 1411 C ARG B 410 -11.306 -5.406 9.906 1.00 0.00 C ATOM 1412 O ARG B 410 -12.272 -4.719 10.233 1.00 0.00 O ATOM 1413 CB ARG B 410 -12.722 -7.433 9.368 1.00 0.00 C ATOM 1414 CG ARG B 410 -13.329 -8.130 8.160 1.00 0.00 C ATOM 1415 CD ARG B 410 -12.449 -9.252 7.610 1.00 0.00 C ATOM 1416 NE ARG B 410 -12.842 -10.570 8.125 1.00 0.00 N ATOM 1417 CZ ARG B 410 -12.286 -11.183 9.172 1.00 0.00 C ATOM 1418 NH1 ARG B 410 -11.375 -10.567 9.907 1.00 0.00 N ATOM 1419 NH2 ARG B 410 -12.669 -12.411 9.498 1.00 0.00 N ATOM 0 H ARG B 410 -9.814 -7.741 8.333 1.00 0.00 H new ATOM 0 HA ARG B 410 -11.526 -6.334 8.009 1.00 0.00 H new ATOM 0 HB2 ARG B 410 -12.500 -8.177 10.133 1.00 0.00 H new ATOM 0 HB3 ARG B 410 -13.459 -6.751 9.792 1.00 0.00 H new ATOM 0 HG2 ARG B 410 -14.301 -8.540 8.435 1.00 0.00 H new ATOM 0 HG3 ARG B 410 -13.504 -7.395 7.374 1.00 0.00 H new ATOM 0 HD2 ARG B 410 -12.508 -9.257 6.522 1.00 0.00 H new ATOM 0 HD3 ARG B 410 -11.409 -9.057 7.872 1.00 0.00 H new ATOM 0 HE ARG B 410 -13.600 -11.055 7.645 1.00 0.00 H new ATOM 0 HH11 ARG B 410 -11.092 -9.615 9.676 1.00 0.00 H new ATOM 0 HH12 ARG B 410 -10.956 -11.044 10.705 1.00 0.00 H new ATOM 0 HH21 ARG B 410 -13.387 -12.884 8.949 1.00 0.00 H new ATOM 0 HH22 ARG B 410 -12.246 -12.882 10.298 1.00 0.00 H new ATOM 1433 N GLU B 411 -10.056 -5.147 10.240 1.00 0.00 N ATOM 1434 CA GLU B 411 -9.622 -3.951 10.908 1.00 0.00 C ATOM 1435 C GLU B 411 -9.880 -2.765 10.012 1.00 0.00 C ATOM 1436 O GLU B 411 -10.240 -1.677 10.458 1.00 0.00 O ATOM 1437 CB GLU B 411 -8.145 -4.109 11.187 1.00 0.00 C ATOM 1438 CG GLU B 411 -7.850 -4.872 12.458 1.00 0.00 C ATOM 1439 CD GLU B 411 -8.367 -4.178 13.697 1.00 0.00 C ATOM 1440 OE1 GLU B 411 -9.587 -4.237 13.964 1.00 0.00 O ATOM 1441 OE2 GLU B 411 -7.548 -3.573 14.414 1.00 0.00 O ATOM 0 H GLU B 411 -9.292 -5.793 10.043 1.00 0.00 H new ATOM 0 HA GLU B 411 -10.161 -3.790 11.842 1.00 0.00 H new ATOM 0 HB2 GLU B 411 -7.678 -4.623 10.347 1.00 0.00 H new ATOM 0 HB3 GLU B 411 -7.688 -3.122 11.251 1.00 0.00 H new ATOM 0 HG2 GLU B 411 -8.296 -5.864 12.391 1.00 0.00 H new ATOM 0 HG3 GLU B 411 -6.773 -5.012 12.549 1.00 0.00 H new ATOM 1448 N TYR B 412 -9.698 -3.010 8.730 1.00 0.00 N ATOM 1449 CA TYR B 412 -10.080 -2.073 7.714 1.00 0.00 C ATOM 1450 C TYR B 412 -11.556 -2.144 7.555 1.00 0.00 C ATOM 1451 O TYR B 412 -12.112 -3.201 7.311 1.00 0.00 O ATOM 1452 CB TYR B 412 -9.290 -2.319 6.431 1.00 0.00 C ATOM 1453 CG TYR B 412 -7.833 -2.013 6.636 1.00 0.00 C ATOM 1454 CD1 TYR B 412 -7.406 -1.413 7.810 1.00 0.00 C ATOM 1455 CD2 TYR B 412 -6.888 -2.342 5.692 1.00 0.00 C ATOM 1456 CE1 TYR B 412 -6.073 -1.164 8.035 1.00 0.00 C ATOM 1457 CE2 TYR B 412 -5.557 -2.083 5.907 1.00 0.00 C ATOM 1458 CZ TYR B 412 -5.155 -1.500 7.079 1.00 0.00 C ATOM 1459 OH TYR B 412 -3.823 -1.274 7.306 1.00 0.00 O ATOM 0 H TYR B 412 -9.280 -3.868 8.371 1.00 0.00 H new ATOM 0 HA TYR B 412 -9.832 -1.050 7.997 1.00 0.00 H new ATOM 0 HB2 TYR B 412 -9.408 -3.357 6.119 1.00 0.00 H new ATOM 0 HB3 TYR B 412 -9.688 -1.698 5.629 1.00 0.00 H new ATOM 0 HD1 TYR B 412 -8.132 -1.137 8.560 1.00 0.00 H new ATOM 0 HD2 TYR B 412 -7.197 -2.810 4.769 1.00 0.00 H new ATOM 0 HE1 TYR B 412 -5.753 -0.707 8.960 1.00 0.00 H new ATOM 0 HE2 TYR B 412 -4.828 -2.339 5.153 1.00 0.00 H new ATOM 0 HH TYR B 412 -3.704 -0.886 8.198 1.00 0.00 H new ATOM 1469 N ARG B 413 -12.189 -1.017 7.852 1.00 0.00 N ATOM 1470 CA ARG B 413 -13.618 -0.918 7.762 1.00 0.00 C ATOM 1471 C ARG B 413 -14.025 -1.200 6.358 1.00 0.00 C ATOM 1472 O ARG B 413 -14.940 -1.966 6.095 1.00 0.00 O ATOM 1473 CB ARG B 413 -14.131 0.451 8.158 1.00 0.00 C ATOM 1474 CG ARG B 413 -13.754 0.850 9.557 1.00 0.00 C ATOM 1475 CD ARG B 413 -12.621 1.831 9.547 1.00 0.00 C ATOM 1476 NE ARG B 413 -12.917 3.012 8.733 1.00 0.00 N ATOM 1477 CZ ARG B 413 -12.197 4.135 8.740 1.00 0.00 C ATOM 1478 NH1 ARG B 413 -11.145 4.253 9.542 1.00 0.00 N ATOM 1479 NH2 ARG B 413 -12.543 5.147 7.952 1.00 0.00 N ATOM 0 H ARG B 413 -11.723 -0.162 8.157 1.00 0.00 H new ATOM 0 HA ARG B 413 -14.048 -1.641 8.455 1.00 0.00 H new ATOM 0 HB2 ARG B 413 -13.742 1.192 7.460 1.00 0.00 H new ATOM 0 HB3 ARG B 413 -15.217 0.464 8.065 1.00 0.00 H new ATOM 0 HG2 ARG B 413 -14.616 1.289 10.059 1.00 0.00 H new ATOM 0 HG3 ARG B 413 -13.470 -0.034 10.127 1.00 0.00 H new ATOM 0 HD2 ARG B 413 -12.403 2.142 10.569 1.00 0.00 H new ATOM 0 HD3 ARG B 413 -11.724 1.344 9.164 1.00 0.00 H new ATOM 0 HE ARG B 413 -13.730 2.973 8.118 1.00 0.00 H new ATOM 0 HH11 ARG B 413 -10.884 3.482 10.157 1.00 0.00 H new ATOM 0 HH12 ARG B 413 -10.598 5.114 9.543 1.00 0.00 H new ATOM 0 HH21 ARG B 413 -13.357 5.064 7.344 1.00 0.00 H new ATOM 0 HH22 ARG B 413 -11.994 6.007 7.955 1.00 0.00 H new ATOM 1493 N ASP B 414 -13.265 -0.606 5.470 1.00 0.00 N ATOM 1494 CA ASP B 414 -13.531 -0.648 4.059 1.00 0.00 C ATOM 1495 C ASP B 414 -12.244 -0.488 3.329 1.00 0.00 C ATOM 1496 O ASP B 414 -11.164 -0.445 3.919 1.00 0.00 O ATOM 1497 CB ASP B 414 -14.529 0.445 3.645 1.00 0.00 C ATOM 1498 CG ASP B 414 -13.881 1.771 3.307 1.00 0.00 C ATOM 1499 OD1 ASP B 414 -13.347 2.434 4.220 1.00 0.00 O ATOM 1500 OD2 ASP B 414 -13.894 2.142 2.118 1.00 0.00 O ATOM 0 H ASP B 414 -12.431 -0.072 5.715 1.00 0.00 H new ATOM 0 HA ASP B 414 -13.984 -1.607 3.807 1.00 0.00 H new ATOM 0 HB2 ASP B 414 -15.095 0.098 2.781 1.00 0.00 H new ATOM 0 HB3 ASP B 414 -15.243 0.597 4.454 1.00 0.00 H new ATOM 1505 N ALA B 415 -12.375 -0.388 2.056 1.00 0.00 N ATOM 1506 CA ALA B 415 -11.265 -0.384 1.178 1.00 0.00 C ATOM 1507 C ALA B 415 -10.461 0.897 1.298 1.00 0.00 C ATOM 1508 O ALA B 415 -9.297 0.950 0.929 1.00 0.00 O ATOM 1509 CB ALA B 415 -11.807 -0.508 -0.196 1.00 0.00 C ATOM 0 H ALA B 415 -13.277 -0.305 1.587 1.00 0.00 H new ATOM 0 HA ALA B 415 -10.593 -1.206 1.425 1.00 0.00 H new ATOM 0 HB1 ALA B 415 -10.986 -0.510 -0.912 1.00 0.00 H new ATOM 0 HB2 ALA B 415 -12.367 -1.439 -0.284 1.00 0.00 H new ATOM 0 HB3 ALA B 415 -12.468 0.333 -0.404 1.00 0.00 H new ATOM 1515 N GLN B 416 -11.082 1.942 1.797 1.00 0.00 N ATOM 1516 CA GLN B 416 -10.393 3.204 1.908 1.00 0.00 C ATOM 1517 C GLN B 416 -9.521 3.226 3.161 1.00 0.00 C ATOM 1518 O GLN B 416 -8.566 3.992 3.238 1.00 0.00 O ATOM 1519 CB GLN B 416 -11.386 4.355 1.860 1.00 0.00 C ATOM 1520 CG GLN B 416 -11.900 4.611 0.460 1.00 0.00 C ATOM 1521 CD GLN B 416 -13.340 5.087 0.428 1.00 0.00 C ATOM 1522 OE1 GLN B 416 -13.817 5.733 1.363 1.00 0.00 O ATOM 1523 NE2 GLN B 416 -14.041 4.781 -0.655 1.00 0.00 N ATOM 0 H GLN B 416 -12.047 1.943 2.127 1.00 0.00 H new ATOM 0 HA GLN B 416 -9.724 3.328 1.056 1.00 0.00 H new ATOM 0 HB2 GLN B 416 -12.226 4.135 2.519 1.00 0.00 H new ATOM 0 HB3 GLN B 416 -10.910 5.259 2.241 1.00 0.00 H new ATOM 0 HG2 GLN B 416 -11.267 5.357 -0.021 1.00 0.00 H new ATOM 0 HG3 GLN B 416 -11.814 3.695 -0.124 1.00 0.00 H new ATOM 0 HE21 GLN B 416 -13.609 4.244 -1.407 1.00 0.00 H new ATOM 0 HE22 GLN B 416 -15.012 5.082 -0.736 1.00 0.00 H new ATOM 1532 N GLU B 417 -9.861 2.387 4.146 1.00 0.00 N ATOM 1533 CA GLU B 417 -8.888 1.972 5.154 1.00 0.00 C ATOM 1534 C GLU B 417 -7.733 1.300 4.444 1.00 0.00 C ATOM 1535 O GLU B 417 -6.557 1.611 4.660 1.00 0.00 O ATOM 1536 CB GLU B 417 -9.495 0.957 6.122 1.00 0.00 C ATOM 1537 CG GLU B 417 -9.867 1.507 7.483 1.00 0.00 C ATOM 1538 CD GLU B 417 -8.775 2.363 8.094 1.00 0.00 C ATOM 1539 OE1 GLU B 417 -8.544 3.487 7.602 1.00 0.00 O ATOM 1540 OE2 GLU B 417 -8.153 1.919 9.077 1.00 0.00 O ATOM 0 H GLU B 417 -10.792 1.988 4.264 1.00 0.00 H new ATOM 0 HA GLU B 417 -8.568 2.851 5.714 1.00 0.00 H new ATOM 0 HB2 GLU B 417 -10.387 0.531 5.664 1.00 0.00 H new ATOM 0 HB3 GLU B 417 -8.786 0.141 6.259 1.00 0.00 H new ATOM 0 HG2 GLU B 417 -10.778 2.099 7.393 1.00 0.00 H new ATOM 0 HG3 GLU B 417 -10.091 0.678 8.155 1.00 0.00 H new ATOM 1547 N PHE B 418 -8.114 0.382 3.571 1.00 0.00 N ATOM 1548 CA PHE B 418 -7.182 -0.429 2.838 1.00 0.00 C ATOM 1549 C PHE B 418 -6.146 0.402 2.103 1.00 0.00 C ATOM 1550 O PHE B 418 -4.954 0.351 2.403 1.00 0.00 O ATOM 1551 CB PHE B 418 -7.920 -1.331 1.857 1.00 0.00 C ATOM 1552 CG PHE B 418 -7.002 -1.939 0.854 1.00 0.00 C ATOM 1553 CD1 PHE B 418 -6.235 -3.011 1.203 1.00 0.00 C ATOM 1554 CD2 PHE B 418 -6.901 -1.435 -0.432 1.00 0.00 C ATOM 1555 CE1 PHE B 418 -5.393 -3.583 0.311 1.00 0.00 C ATOM 1556 CE2 PHE B 418 -6.051 -2.009 -1.345 1.00 0.00 C ATOM 1557 CZ PHE B 418 -5.293 -3.088 -0.973 1.00 0.00 C ATOM 0 H PHE B 418 -9.091 0.184 3.356 1.00 0.00 H new ATOM 0 HA PHE B 418 -6.651 -1.042 3.566 1.00 0.00 H new ATOM 0 HB2 PHE B 418 -8.431 -2.122 2.406 1.00 0.00 H new ATOM 0 HB3 PHE B 418 -8.688 -0.754 1.342 1.00 0.00 H new ATOM 0 HD1 PHE B 418 -6.300 -3.409 2.205 1.00 0.00 H new ATOM 0 HD2 PHE B 418 -7.497 -0.582 -0.720 1.00 0.00 H new ATOM 0 HE1 PHE B 418 -4.795 -4.433 0.606 1.00 0.00 H new ATOM 0 HE2 PHE B 418 -5.981 -1.613 -2.347 1.00 0.00 H new ATOM 0 HZ PHE B 418 -4.621 -3.549 -1.681 1.00 0.00 H new ATOM 1567 N GLY B 419 -6.614 1.162 1.139 1.00 0.00 N ATOM 1568 CA GLY B 419 -5.718 1.905 0.291 1.00 0.00 C ATOM 1569 C GLY B 419 -5.051 3.033 1.006 1.00 0.00 C ATOM 1570 O GLY B 419 -4.048 3.561 0.535 1.00 0.00 O ATOM 0 H GLY B 419 -7.604 1.280 0.925 1.00 0.00 H new ATOM 0 HA2 GLY B 419 -4.958 1.232 -0.106 1.00 0.00 H new ATOM 0 HA3 GLY B 419 -6.273 2.298 -0.561 1.00 0.00 H new ATOM 1574 N ALA B 420 -5.587 3.386 2.154 1.00 0.00 N ATOM 1575 CA ALA B 420 -4.968 4.374 2.991 1.00 0.00 C ATOM 1576 C ALA B 420 -3.577 3.902 3.366 1.00 0.00 C ATOM 1577 O ALA B 420 -2.614 4.670 3.365 1.00 0.00 O ATOM 1578 CB ALA B 420 -5.815 4.606 4.228 1.00 0.00 C ATOM 0 H ALA B 420 -6.454 2.998 2.525 1.00 0.00 H new ATOM 0 HA ALA B 420 -4.887 5.320 2.455 1.00 0.00 H new ATOM 0 HB1 ALA B 420 -5.340 5.357 4.859 1.00 0.00 H new ATOM 0 HB2 ALA B 420 -6.804 4.955 3.931 1.00 0.00 H new ATOM 0 HB3 ALA B 420 -5.911 3.673 4.784 1.00 0.00 H new ATOM 1584 N ASP B 421 -3.485 2.618 3.656 1.00 0.00 N ATOM 1585 CA ASP B 421 -2.225 1.988 3.981 1.00 0.00 C ATOM 1586 C ASP B 421 -1.419 1.646 2.727 1.00 0.00 C ATOM 1587 O ASP B 421 -0.204 1.777 2.736 1.00 0.00 O ATOM 1588 CB ASP B 421 -2.502 0.779 4.845 1.00 0.00 C ATOM 1589 CG ASP B 421 -2.921 1.214 6.236 1.00 0.00 C ATOM 1590 OD1 ASP B 421 -2.046 1.485 7.083 1.00 0.00 O ATOM 1591 OD2 ASP B 421 -4.134 1.303 6.489 1.00 0.00 O ATOM 0 H ASP B 421 -4.284 1.984 3.672 1.00 0.00 H new ATOM 0 HA ASP B 421 -1.600 2.684 4.541 1.00 0.00 H new ATOM 0 HB2 ASP B 421 -3.287 0.173 4.394 1.00 0.00 H new ATOM 0 HB3 ASP B 421 -1.611 0.154 4.905 1.00 0.00 H new ATOM 1596 N VAL B 422 -2.057 1.227 1.634 1.00 0.00 N ATOM 1597 CA VAL B 422 -1.337 1.113 0.377 1.00 0.00 C ATOM 1598 C VAL B 422 -0.613 2.419 0.063 1.00 0.00 C ATOM 1599 O VAL B 422 0.582 2.431 -0.218 1.00 0.00 O ATOM 1600 CB VAL B 422 -2.255 0.793 -0.805 1.00 0.00 C ATOM 1601 CG1 VAL B 422 -1.406 0.432 -1.971 1.00 0.00 C ATOM 1602 CG2 VAL B 422 -3.169 -0.361 -0.514 1.00 0.00 C ATOM 0 H VAL B 422 -3.043 0.969 1.597 1.00 0.00 H new ATOM 0 HA VAL B 422 -0.633 0.291 0.505 1.00 0.00 H new ATOM 0 HB VAL B 422 -2.869 1.671 -1.004 1.00 0.00 H new ATOM 0 HG11 VAL B 422 -2.041 0.200 -2.826 1.00 0.00 H new ATOM 0 HG12 VAL B 422 -0.755 1.270 -2.220 1.00 0.00 H new ATOM 0 HG13 VAL B 422 -0.799 -0.439 -1.723 1.00 0.00 H new ATOM 0 HG21 VAL B 422 -3.802 -0.552 -1.381 1.00 0.00 H new ATOM 0 HG22 VAL B 422 -2.576 -1.249 -0.295 1.00 0.00 H new ATOM 0 HG23 VAL B 422 -3.795 -0.122 0.346 1.00 0.00 H new ATOM 1612 N ARG B 423 -1.347 3.518 0.131 1.00 0.00 N ATOM 1613 CA ARG B 423 -0.764 4.836 -0.072 1.00 0.00 C ATOM 1614 C ARG B 423 0.222 5.176 1.040 1.00 0.00 C ATOM 1615 O ARG B 423 1.102 6.004 0.848 1.00 0.00 O ATOM 1616 CB ARG B 423 -1.848 5.910 -0.162 1.00 0.00 C ATOM 1617 CG ARG B 423 -2.485 6.014 -1.536 1.00 0.00 C ATOM 1618 CD ARG B 423 -3.968 5.698 -1.492 1.00 0.00 C ATOM 1619 NE ARG B 423 -4.588 5.804 -2.808 1.00 0.00 N ATOM 1620 CZ ARG B 423 -5.893 5.988 -3.006 1.00 0.00 C ATOM 1621 NH1 ARG B 423 -6.719 6.101 -1.972 1.00 0.00 N ATOM 1622 NH2 ARG B 423 -6.374 6.057 -4.238 1.00 0.00 N ATOM 0 H ARG B 423 -2.348 3.524 0.325 1.00 0.00 H new ATOM 0 HA ARG B 423 -0.223 4.813 -1.018 1.00 0.00 H new ATOM 0 HB2 ARG B 423 -2.623 5.695 0.574 1.00 0.00 H new ATOM 0 HB3 ARG B 423 -1.415 6.875 0.103 1.00 0.00 H new ATOM 0 HG2 ARG B 423 -2.339 7.020 -1.930 1.00 0.00 H new ATOM 0 HG3 ARG B 423 -1.987 5.328 -2.221 1.00 0.00 H new ATOM 0 HD2 ARG B 423 -4.113 4.690 -1.103 1.00 0.00 H new ATOM 0 HD3 ARG B 423 -4.464 6.380 -0.801 1.00 0.00 H new ATOM 0 HE ARG B 423 -3.985 5.733 -3.628 1.00 0.00 H new ATOM 0 HH11 ARG B 423 -6.355 6.047 -1.021 1.00 0.00 H new ATOM 0 HH12 ARG B 423 -7.717 6.242 -2.129 1.00 0.00 H new ATOM 0 HH21 ARG B 423 -5.745 5.969 -5.037 1.00 0.00 H new ATOM 0 HH22 ARG B 423 -7.373 6.198 -4.388 1.00 0.00 H new ATOM 1636 N LEU B 424 0.069 4.538 2.193 1.00 0.00 N ATOM 1637 CA LEU B 424 1.005 4.704 3.297 1.00 0.00 C ATOM 1638 C LEU B 424 2.345 4.068 2.922 1.00 0.00 C ATOM 1639 O LEU B 424 3.393 4.698 3.078 1.00 0.00 O ATOM 1640 CB LEU B 424 0.433 4.068 4.578 1.00 0.00 C ATOM 1641 CG LEU B 424 0.780 4.721 5.925 1.00 0.00 C ATOM 1642 CD1 LEU B 424 1.468 3.751 6.826 1.00 0.00 C ATOM 1643 CD2 LEU B 424 1.644 5.947 5.768 1.00 0.00 C ATOM 0 H LEU B 424 -0.700 3.897 2.388 1.00 0.00 H new ATOM 0 HA LEU B 424 1.160 5.765 3.490 1.00 0.00 H new ATOM 0 HB2 LEU B 424 -0.653 4.050 4.486 1.00 0.00 H new ATOM 0 HB3 LEU B 424 0.767 3.031 4.614 1.00 0.00 H new ATOM 0 HG LEU B 424 -0.168 5.028 6.367 1.00 0.00 H new ATOM 0 HD11 LEU B 424 1.703 4.237 7.773 1.00 0.00 H new ATOM 0 HD12 LEU B 424 0.815 2.898 7.009 1.00 0.00 H new ATOM 0 HD13 LEU B 424 2.390 3.408 6.356 1.00 0.00 H new ATOM 0 HD21 LEU B 424 1.859 6.369 6.750 1.00 0.00 H new ATOM 0 HD22 LEU B 424 2.578 5.673 5.278 1.00 0.00 H new ATOM 0 HD23 LEU B 424 1.120 6.686 5.163 1.00 0.00 H new ATOM 1655 N MET B 425 2.309 2.833 2.390 1.00 0.00 N ATOM 1656 CA MET B 425 3.541 2.153 1.984 1.00 0.00 C ATOM 1657 C MET B 425 4.144 2.857 0.809 1.00 0.00 C ATOM 1658 O MET B 425 5.321 3.194 0.829 1.00 0.00 O ATOM 1659 CB MET B 425 3.367 0.634 1.706 1.00 0.00 C ATOM 1660 CG MET B 425 2.411 0.264 0.625 1.00 0.00 C ATOM 1661 SD MET B 425 1.364 -1.109 1.088 1.00 0.00 S ATOM 1662 CE MET B 425 0.794 -1.506 -0.537 1.00 0.00 C ATOM 0 H MET B 425 1.455 2.298 2.235 1.00 0.00 H new ATOM 0 HA MET B 425 4.222 2.206 2.834 1.00 0.00 H new ATOM 0 HB2 MET B 425 4.343 0.218 1.456 1.00 0.00 H new ATOM 0 HB3 MET B 425 3.043 0.153 2.629 1.00 0.00 H new ATOM 0 HG2 MET B 425 1.790 1.126 0.381 1.00 0.00 H new ATOM 0 HG3 MET B 425 2.967 0.007 -0.277 1.00 0.00 H new ATOM 0 HE1 MET B 425 -0.135 -2.072 -0.469 1.00 0.00 H new ATOM 0 HE2 MET B 425 0.618 -0.587 -1.096 1.00 0.00 H new ATOM 0 HE3 MET B 425 1.547 -2.104 -1.051 1.00 0.00 H new ATOM 1672 N PHE B 426 3.331 3.140 -0.181 1.00 0.00 N ATOM 1673 CA PHE B 426 3.802 3.852 -1.344 1.00 0.00 C ATOM 1674 C PHE B 426 4.418 5.191 -0.928 1.00 0.00 C ATOM 1675 O PHE B 426 5.453 5.596 -1.457 1.00 0.00 O ATOM 1676 CB PHE B 426 2.661 4.083 -2.319 1.00 0.00 C ATOM 1677 CG PHE B 426 2.062 2.834 -2.929 1.00 0.00 C ATOM 1678 CD1 PHE B 426 2.573 1.569 -2.654 1.00 0.00 C ATOM 1679 CD2 PHE B 426 0.962 2.930 -3.766 1.00 0.00 C ATOM 1680 CE1 PHE B 426 1.996 0.436 -3.203 1.00 0.00 C ATOM 1681 CE2 PHE B 426 0.391 1.801 -4.319 1.00 0.00 C ATOM 1682 CZ PHE B 426 0.910 0.554 -4.031 1.00 0.00 C ATOM 0 H PHE B 426 2.343 2.889 -0.204 1.00 0.00 H new ATOM 0 HA PHE B 426 4.566 3.250 -1.836 1.00 0.00 H new ATOM 0 HB2 PHE B 426 1.871 4.629 -1.804 1.00 0.00 H new ATOM 0 HB3 PHE B 426 3.019 4.724 -3.125 1.00 0.00 H new ATOM 0 HD1 PHE B 426 3.430 1.470 -2.004 1.00 0.00 H new ATOM 0 HD2 PHE B 426 0.546 3.901 -3.989 1.00 0.00 H new ATOM 0 HE1 PHE B 426 2.401 -0.540 -2.979 1.00 0.00 H new ATOM 0 HE2 PHE B 426 -0.461 1.893 -4.976 1.00 0.00 H new ATOM 0 HZ PHE B 426 0.460 -0.329 -4.459 1.00 0.00 H new ATOM 1692 N SER B 427 3.789 5.849 0.046 1.00 0.00 N ATOM 1693 CA SER B 427 4.282 7.121 0.562 1.00 0.00 C ATOM 1694 C SER B 427 5.680 6.957 1.144 1.00 0.00 C ATOM 1695 O SER B 427 6.628 7.547 0.635 1.00 0.00 O ATOM 1696 CB SER B 427 3.332 7.680 1.627 1.00 0.00 C ATOM 1697 OG SER B 427 3.697 8.996 2.010 1.00 0.00 O ATOM 0 H SER B 427 2.934 5.518 0.493 1.00 0.00 H new ATOM 0 HA SER B 427 4.328 7.827 -0.268 1.00 0.00 H new ATOM 0 HB2 SER B 427 2.312 7.682 1.242 1.00 0.00 H new ATOM 0 HB3 SER B 427 3.341 7.030 2.502 1.00 0.00 H new ATOM 0 HG SER B 427 3.071 9.325 2.689 1.00 0.00 H new ATOM 1703 N ASN B 428 5.816 6.125 2.187 1.00 0.00 N ATOM 1704 CA ASN B 428 7.116 5.900 2.833 1.00 0.00 C ATOM 1705 C ASN B 428 8.156 5.438 1.821 1.00 0.00 C ATOM 1706 O ASN B 428 9.352 5.646 2.036 1.00 0.00 O ATOM 1707 CB ASN B 428 7.011 4.911 4.003 1.00 0.00 C ATOM 1708 CG ASN B 428 6.661 3.486 3.616 1.00 0.00 C ATOM 1709 OD1 ASN B 428 5.521 3.071 3.749 1.00 0.00 O ATOM 1710 ND2 ASN B 428 7.637 2.721 3.152 1.00 0.00 N ATOM 0 H ASN B 428 5.045 5.599 2.599 1.00 0.00 H new ATOM 0 HA ASN B 428 7.441 6.855 3.245 1.00 0.00 H new ATOM 0 HB2 ASN B 428 7.961 4.902 4.537 1.00 0.00 H new ATOM 0 HB3 ASN B 428 6.257 5.277 4.700 1.00 0.00 H new ATOM 0 HD21 ASN B 428 7.447 1.753 2.893 1.00 0.00 H new ATOM 0 HD22 ASN B 428 8.579 3.100 3.053 1.00 0.00 H new ATOM 1717 N CYS B 429 7.718 4.857 0.709 1.00 0.00 N ATOM 1718 CA CYS B 429 8.651 4.475 -0.334 1.00 0.00 C ATOM 1719 C CYS B 429 9.256 5.716 -0.991 1.00 0.00 C ATOM 1720 O CYS B 429 10.412 6.033 -0.742 1.00 0.00 O ATOM 1721 CB CYS B 429 8.005 3.582 -1.393 1.00 0.00 C ATOM 1722 SG CYS B 429 7.239 2.099 -0.746 1.00 0.00 S ATOM 0 H CYS B 429 6.740 4.645 0.512 1.00 0.00 H new ATOM 0 HA CYS B 429 9.442 3.896 0.142 1.00 0.00 H new ATOM 0 HB2 CYS B 429 7.252 4.161 -1.928 1.00 0.00 H new ATOM 0 HB3 CYS B 429 8.764 3.296 -2.121 1.00 0.00 H new ATOM 0 HG CYS B 429 6.766 1.391 -1.728 1.00 0.00 H new ATOM 1728 N TYR B 430 8.481 6.451 -1.791 1.00 0.00 N ATOM 1729 CA TYR B 430 9.043 7.595 -2.522 1.00 0.00 C ATOM 1730 C TYR B 430 9.491 8.682 -1.544 1.00 0.00 C ATOM 1731 O TYR B 430 10.294 9.550 -1.878 1.00 0.00 O ATOM 1732 CB TYR B 430 8.061 8.204 -3.530 1.00 0.00 C ATOM 1733 CG TYR B 430 6.898 7.328 -3.946 1.00 0.00 C ATOM 1734 CD1 TYR B 430 7.078 6.115 -4.616 1.00 0.00 C ATOM 1735 CD2 TYR B 430 5.600 7.750 -3.696 1.00 0.00 C ATOM 1736 CE1 TYR B 430 5.977 5.360 -5.014 1.00 0.00 C ATOM 1737 CE2 TYR B 430 4.513 6.999 -4.085 1.00 0.00 C ATOM 1738 CZ TYR B 430 4.707 5.809 -4.743 1.00 0.00 C ATOM 1739 OH TYR B 430 3.623 5.061 -5.137 1.00 0.00 O ATOM 0 H TYR B 430 7.487 6.284 -1.949 1.00 0.00 H new ATOM 0 HA TYR B 430 9.895 7.210 -3.082 1.00 0.00 H new ATOM 0 HB2 TYR B 430 7.661 9.125 -3.105 1.00 0.00 H new ATOM 0 HB3 TYR B 430 8.618 8.482 -4.425 1.00 0.00 H new ATOM 0 HD1 TYR B 430 8.076 5.761 -4.826 1.00 0.00 H new ATOM 0 HD2 TYR B 430 5.439 8.688 -3.185 1.00 0.00 H new ATOM 0 HE1 TYR B 430 6.121 4.425 -5.534 1.00 0.00 H new ATOM 0 HE2 TYR B 430 3.512 7.344 -3.873 1.00 0.00 H new ATOM 0 HH TYR B 430 3.920 4.161 -5.385 1.00 0.00 H new ATOM 1749 N LYS B 431 8.942 8.632 -0.342 1.00 0.00 N ATOM 1750 CA LYS B 431 9.378 9.482 0.760 1.00 0.00 C ATOM 1751 C LYS B 431 10.873 9.283 1.019 1.00 0.00 C ATOM 1752 O LYS B 431 11.644 10.237 1.110 1.00 0.00 O ATOM 1753 CB LYS B 431 8.613 9.082 2.013 1.00 0.00 C ATOM 1754 CG LYS B 431 8.792 10.001 3.200 1.00 0.00 C ATOM 1755 CD LYS B 431 8.234 9.360 4.454 1.00 0.00 C ATOM 1756 CE LYS B 431 9.245 8.386 5.020 1.00 0.00 C ATOM 1757 NZ LYS B 431 9.927 7.629 3.953 1.00 0.00 N ATOM 0 H LYS B 431 8.179 8.000 -0.099 1.00 0.00 H new ATOM 0 HA LYS B 431 9.191 10.525 0.506 1.00 0.00 H new ATOM 0 HB2 LYS B 431 7.552 9.032 1.770 1.00 0.00 H new ATOM 0 HB3 LYS B 431 8.922 8.077 2.302 1.00 0.00 H new ATOM 0 HG2 LYS B 431 9.850 10.225 3.338 1.00 0.00 H new ATOM 0 HG3 LYS B 431 8.287 10.949 3.013 1.00 0.00 H new ATOM 0 HD2 LYS B 431 7.999 10.126 5.193 1.00 0.00 H new ATOM 0 HD3 LYS B 431 7.303 8.841 4.226 1.00 0.00 H new ATOM 0 HE2 LYS B 431 9.983 8.929 5.610 1.00 0.00 H new ATOM 0 HE3 LYS B 431 8.744 7.693 5.696 1.00 0.00 H new ATOM 0 HZ1 LYS B 431 10.600 6.960 4.378 1.00 0.00 H new ATOM 0 HZ2 LYS B 431 9.223 7.105 3.395 1.00 0.00 H new ATOM 0 HZ3 LYS B 431 10.439 8.288 3.333 1.00 0.00 H new ATOM 1771 N TYR B 432 11.260 8.014 1.146 1.00 0.00 N ATOM 1772 CA TYR B 432 12.643 7.629 1.418 1.00 0.00 C ATOM 1773 C TYR B 432 13.451 7.684 0.127 1.00 0.00 C ATOM 1774 O TYR B 432 14.569 8.190 0.086 1.00 0.00 O ATOM 1775 CB TYR B 432 12.665 6.192 2.003 1.00 0.00 C ATOM 1776 CG TYR B 432 14.016 5.710 2.515 1.00 0.00 C ATOM 1777 CD1 TYR B 432 15.199 6.028 1.873 1.00 0.00 C ATOM 1778 CD2 TYR B 432 14.096 4.886 3.626 1.00 0.00 C ATOM 1779 CE1 TYR B 432 16.409 5.558 2.327 1.00 0.00 C ATOM 1780 CE2 TYR B 432 15.298 4.404 4.071 1.00 0.00 C ATOM 1781 CZ TYR B 432 16.454 4.740 3.426 1.00 0.00 C ATOM 1782 OH TYR B 432 17.657 4.251 3.879 1.00 0.00 O ATOM 0 H TYR B 432 10.621 7.223 1.063 1.00 0.00 H new ATOM 0 HA TYR B 432 13.085 8.317 2.139 1.00 0.00 H new ATOM 0 HB2 TYR B 432 11.947 6.141 2.822 1.00 0.00 H new ATOM 0 HB3 TYR B 432 12.320 5.501 1.234 1.00 0.00 H new ATOM 0 HD1 TYR B 432 15.172 6.659 0.997 1.00 0.00 H new ATOM 0 HD2 TYR B 432 13.192 4.618 4.152 1.00 0.00 H new ATOM 0 HE1 TYR B 432 17.322 5.833 1.819 1.00 0.00 H new ATOM 0 HE2 TYR B 432 15.332 3.756 4.935 1.00 0.00 H new ATOM 0 HH TYR B 432 17.766 4.476 4.827 1.00 0.00 H new ATOM 1792 N ASN B 433 12.867 7.168 -0.922 1.00 0.00 N ATOM 1793 CA ASN B 433 13.599 6.916 -2.145 1.00 0.00 C ATOM 1794 C ASN B 433 13.480 8.042 -3.158 1.00 0.00 C ATOM 1795 O ASN B 433 12.457 8.714 -3.252 1.00 0.00 O ATOM 1796 CB ASN B 433 13.076 5.654 -2.801 1.00 0.00 C ATOM 1797 CG ASN B 433 13.165 4.436 -1.930 1.00 0.00 C ATOM 1798 OD1 ASN B 433 14.155 3.728 -1.957 1.00 0.00 O ATOM 1799 ND2 ASN B 433 12.120 4.178 -1.167 1.00 0.00 N ATOM 0 H ASN B 433 11.881 6.911 -0.958 1.00 0.00 H new ATOM 0 HA ASN B 433 14.646 6.823 -1.858 1.00 0.00 H new ATOM 0 HB2 ASN B 433 12.036 5.809 -3.087 1.00 0.00 H new ATOM 0 HB3 ASN B 433 13.636 5.474 -3.719 1.00 0.00 H new ATOM 0 HD21 ASN B 433 12.119 3.355 -0.565 1.00 0.00 H new ATOM 0 HD22 ASN B 433 11.313 4.802 -1.179 1.00 0.00 H new ATOM 1806 N PRO B 434 14.548 8.244 -3.928 1.00 0.00 N ATOM 1807 CA PRO B 434 14.503 8.999 -5.182 1.00 0.00 C ATOM 1808 C PRO B 434 13.703 8.218 -6.224 1.00 0.00 C ATOM 1809 O PRO B 434 13.679 6.990 -6.186 1.00 0.00 O ATOM 1810 CB PRO B 434 15.975 9.071 -5.591 1.00 0.00 C ATOM 1811 CG PRO B 434 16.576 7.867 -4.955 1.00 0.00 C ATOM 1812 CD PRO B 434 15.903 7.761 -3.631 1.00 0.00 C ATOM 0 HA PRO B 434 14.033 9.978 -5.089 1.00 0.00 H new ATOM 0 HB2 PRO B 434 16.091 9.052 -6.675 1.00 0.00 H new ATOM 0 HB3 PRO B 434 16.445 9.988 -5.236 1.00 0.00 H new ATOM 0 HG2 PRO B 434 16.406 6.975 -5.558 1.00 0.00 H new ATOM 0 HG3 PRO B 434 17.655 7.976 -4.843 1.00 0.00 H new ATOM 0 HD2 PRO B 434 15.897 6.736 -3.259 1.00 0.00 H new ATOM 0 HD3 PRO B 434 16.396 8.372 -2.875 1.00 0.00 H new ATOM 1820 N PRO B 435 13.050 8.896 -7.173 1.00 0.00 N ATOM 1821 CA PRO B 435 12.149 8.237 -8.126 1.00 0.00 C ATOM 1822 C PRO B 435 12.869 7.462 -9.230 1.00 0.00 C ATOM 1823 O PRO B 435 12.225 6.904 -10.119 1.00 0.00 O ATOM 1824 CB PRO B 435 11.362 9.403 -8.715 1.00 0.00 C ATOM 1825 CG PRO B 435 12.286 10.570 -8.626 1.00 0.00 C ATOM 1826 CD PRO B 435 13.120 10.354 -7.391 1.00 0.00 C ATOM 0 HA PRO B 435 11.539 7.479 -7.634 1.00 0.00 H new ATOM 0 HB2 PRO B 435 11.074 9.204 -9.747 1.00 0.00 H new ATOM 0 HB3 PRO B 435 10.443 9.582 -8.157 1.00 0.00 H new ATOM 0 HG2 PRO B 435 12.915 10.637 -9.514 1.00 0.00 H new ATOM 0 HG3 PRO B 435 11.728 11.504 -8.560 1.00 0.00 H new ATOM 0 HD2 PRO B 435 14.147 10.688 -7.538 1.00 0.00 H new ATOM 0 HD3 PRO B 435 12.724 10.906 -6.539 1.00 0.00 H new ATOM 1834 N ASP B 436 14.190 7.425 -9.173 1.00 0.00 N ATOM 1835 CA ASP B 436 14.968 6.601 -10.074 1.00 0.00 C ATOM 1836 C ASP B 436 15.333 5.294 -9.387 1.00 0.00 C ATOM 1837 O ASP B 436 16.032 4.448 -9.946 1.00 0.00 O ATOM 1838 CB ASP B 436 16.237 7.336 -10.494 1.00 0.00 C ATOM 1839 CG ASP B 436 17.201 7.557 -9.345 1.00 0.00 C ATOM 1840 OD1 ASP B 436 16.997 8.515 -8.571 1.00 0.00 O ATOM 1841 OD2 ASP B 436 18.172 6.780 -9.212 1.00 0.00 O ATOM 0 H ASP B 436 14.746 7.961 -8.507 1.00 0.00 H new ATOM 0 HA ASP B 436 14.373 6.388 -10.962 1.00 0.00 H new ATOM 0 HB2 ASP B 436 16.738 6.767 -11.277 1.00 0.00 H new ATOM 0 HB3 ASP B 436 15.966 8.300 -10.925 1.00 0.00 H new ATOM 1846 N HIS B 437 14.838 5.137 -8.166 1.00 0.00 N ATOM 1847 CA HIS B 437 15.185 4.002 -7.330 1.00 0.00 C ATOM 1848 C HIS B 437 14.474 2.730 -7.773 1.00 0.00 C ATOM 1849 O HIS B 437 13.452 2.768 -8.447 1.00 0.00 O ATOM 1850 CB HIS B 437 14.821 4.284 -5.880 1.00 0.00 C ATOM 1851 CG HIS B 437 15.546 3.435 -4.891 1.00 0.00 C ATOM 1852 ND1 HIS B 437 15.562 2.065 -4.911 1.00 0.00 N ATOM 1853 CD2 HIS B 437 16.261 3.785 -3.835 1.00 0.00 C ATOM 1854 CE1 HIS B 437 16.255 1.618 -3.891 1.00 0.00 C ATOM 1855 NE2 HIS B 437 16.705 2.644 -3.223 1.00 0.00 N ATOM 0 H HIS B 437 14.188 5.792 -7.731 1.00 0.00 H new ATOM 0 HA HIS B 437 16.260 3.852 -7.428 1.00 0.00 H new ATOM 0 HB2 HIS B 437 15.027 5.332 -5.663 1.00 0.00 H new ATOM 0 HB3 HIS B 437 13.749 4.137 -5.751 1.00 0.00 H new ATOM 0 HD2 HIS B 437 16.460 4.796 -3.512 1.00 0.00 H new ATOM 0 HE1 HIS B 437 16.424 0.580 -3.646 1.00 0.00 H new ATOM 0 HE2 HIS B 437 17.288 2.603 -2.387 1.00 0.00 H new ATOM 1864 N GLU B 438 15.044 1.611 -7.382 1.00 0.00 N ATOM 1865 CA GLU B 438 14.397 0.334 -7.447 1.00 0.00 C ATOM 1866 C GLU B 438 13.110 0.287 -6.597 1.00 0.00 C ATOM 1867 O GLU B 438 12.064 -0.083 -7.095 1.00 0.00 O ATOM 1868 CB GLU B 438 15.385 -0.716 -6.980 1.00 0.00 C ATOM 1869 CG GLU B 438 14.729 -1.992 -6.591 1.00 0.00 C ATOM 1870 CD GLU B 438 14.189 -2.744 -7.796 1.00 0.00 C ATOM 1871 OE1 GLU B 438 13.093 -2.418 -8.279 1.00 0.00 O ATOM 1872 OE2 GLU B 438 14.890 -3.648 -8.289 1.00 0.00 O ATOM 0 H GLU B 438 15.990 1.571 -7.003 1.00 0.00 H new ATOM 0 HA GLU B 438 14.091 0.143 -8.476 1.00 0.00 H new ATOM 0 HB2 GLU B 438 16.105 -0.910 -7.775 1.00 0.00 H new ATOM 0 HB3 GLU B 438 15.946 -0.328 -6.130 1.00 0.00 H new ATOM 0 HG2 GLU B 438 15.445 -2.621 -6.062 1.00 0.00 H new ATOM 0 HG3 GLU B 438 13.914 -1.784 -5.898 1.00 0.00 H new ATOM 1879 N VAL B 439 13.172 0.656 -5.312 1.00 0.00 N ATOM 1880 CA VAL B 439 11.984 0.560 -4.459 1.00 0.00 C ATOM 1881 C VAL B 439 10.862 1.362 -5.033 1.00 0.00 C ATOM 1882 O VAL B 439 9.732 0.914 -5.067 1.00 0.00 O ATOM 1883 CB VAL B 439 12.210 1.015 -3.035 1.00 0.00 C ATOM 1884 CG1 VAL B 439 11.202 0.407 -2.085 1.00 0.00 C ATOM 1885 CG2 VAL B 439 13.594 0.771 -2.708 1.00 0.00 C ATOM 0 H VAL B 439 14.008 1.014 -4.851 1.00 0.00 H new ATOM 0 HA VAL B 439 11.738 -0.502 -4.430 1.00 0.00 H new ATOM 0 HB VAL B 439 12.034 2.085 -2.928 1.00 0.00 H new ATOM 0 HG11 VAL B 439 11.398 0.759 -1.072 1.00 0.00 H new ATOM 0 HG12 VAL B 439 10.196 0.703 -2.383 1.00 0.00 H new ATOM 0 HG13 VAL B 439 11.284 -0.680 -2.114 1.00 0.00 H new ATOM 0 HG21 VAL B 439 13.788 1.090 -1.684 1.00 0.00 H new ATOM 0 HG22 VAL B 439 13.808 -0.294 -2.803 1.00 0.00 H new ATOM 0 HG23 VAL B 439 14.233 1.332 -3.390 1.00 0.00 H new ATOM 1895 N VAL B 440 11.187 2.557 -5.490 1.00 0.00 N ATOM 1896 CA VAL B 440 10.180 3.389 -6.118 1.00 0.00 C ATOM 1897 C VAL B 440 9.719 2.796 -7.437 1.00 0.00 C ATOM 1898 O VAL B 440 8.554 2.880 -7.778 1.00 0.00 O ATOM 1899 CB VAL B 440 10.624 4.824 -6.351 1.00 0.00 C ATOM 1900 CG1 VAL B 440 11.001 5.435 -5.053 1.00 0.00 C ATOM 1901 CG2 VAL B 440 11.761 4.880 -7.317 1.00 0.00 C ATOM 0 H VAL B 440 12.120 2.966 -5.440 1.00 0.00 H new ATOM 0 HA VAL B 440 9.355 3.414 -5.406 1.00 0.00 H new ATOM 0 HB VAL B 440 9.799 5.388 -6.786 1.00 0.00 H new ATOM 0 HG11 VAL B 440 11.320 6.465 -5.215 1.00 0.00 H new ATOM 0 HG12 VAL B 440 10.142 5.423 -4.382 1.00 0.00 H new ATOM 0 HG13 VAL B 440 11.818 4.867 -4.607 1.00 0.00 H new ATOM 0 HG21 VAL B 440 12.060 5.917 -7.467 1.00 0.00 H new ATOM 0 HG22 VAL B 440 12.603 4.313 -6.921 1.00 0.00 H new ATOM 0 HG23 VAL B 440 11.451 4.451 -8.270 1.00 0.00 H new ATOM 1911 N ALA B 441 10.663 2.244 -8.186 1.00 0.00 N ATOM 1912 CA ALA B 441 10.363 1.457 -9.378 1.00 0.00 C ATOM 1913 C ALA B 441 9.218 0.505 -9.085 1.00 0.00 C ATOM 1914 O ALA B 441 8.189 0.506 -9.758 1.00 0.00 O ATOM 1915 CB ALA B 441 11.598 0.660 -9.784 1.00 0.00 C ATOM 0 H ALA B 441 11.660 2.328 -7.986 1.00 0.00 H new ATOM 0 HA ALA B 441 10.078 2.125 -10.191 1.00 0.00 H new ATOM 0 HB1 ALA B 441 11.375 0.072 -10.674 1.00 0.00 H new ATOM 0 HB2 ALA B 441 12.419 1.345 -9.998 1.00 0.00 H new ATOM 0 HB3 ALA B 441 11.884 -0.007 -8.971 1.00 0.00 H new ATOM 1921 N MET B 442 9.413 -0.263 -8.036 1.00 0.00 N ATOM 1922 CA MET B 442 8.451 -1.244 -7.581 1.00 0.00 C ATOM 1923 C MET B 442 7.205 -0.552 -7.052 1.00 0.00 C ATOM 1924 O MET B 442 6.075 -0.886 -7.417 1.00 0.00 O ATOM 1925 CB MET B 442 9.103 -2.056 -6.479 1.00 0.00 C ATOM 1926 CG MET B 442 10.484 -2.494 -6.856 1.00 0.00 C ATOM 1927 SD MET B 442 10.646 -4.281 -6.950 1.00 0.00 S ATOM 1928 CE MET B 442 12.057 -4.480 -5.895 1.00 0.00 C ATOM 0 H MET B 442 10.258 -0.223 -7.466 1.00 0.00 H new ATOM 0 HA MET B 442 8.153 -1.892 -8.405 1.00 0.00 H new ATOM 0 HB2 MET B 442 9.146 -1.462 -5.566 1.00 0.00 H new ATOM 0 HB3 MET B 442 8.491 -2.931 -6.261 1.00 0.00 H new ATOM 0 HG2 MET B 442 10.748 -2.059 -7.820 1.00 0.00 H new ATOM 0 HG3 MET B 442 11.195 -2.107 -6.126 1.00 0.00 H new ATOM 0 HE1 MET B 442 12.823 -5.053 -6.417 1.00 0.00 H new ATOM 0 HE2 MET B 442 12.454 -3.500 -5.630 1.00 0.00 H new ATOM 0 HE3 MET B 442 11.762 -5.009 -4.989 1.00 0.00 H new ATOM 1938 N ALA B 443 7.444 0.439 -6.207 1.00 0.00 N ATOM 1939 CA ALA B 443 6.393 1.198 -5.554 1.00 0.00 C ATOM 1940 C ALA B 443 5.515 1.960 -6.554 1.00 0.00 C ATOM 1941 O ALA B 443 4.361 2.267 -6.260 1.00 0.00 O ATOM 1942 CB ALA B 443 7.032 2.141 -4.539 1.00 0.00 C ATOM 0 H ALA B 443 8.385 0.741 -5.954 1.00 0.00 H new ATOM 0 HA ALA B 443 5.725 0.505 -5.043 1.00 0.00 H new ATOM 0 HB1 ALA B 443 6.254 2.719 -4.039 1.00 0.00 H new ATOM 0 HB2 ALA B 443 7.584 1.560 -3.800 1.00 0.00 H new ATOM 0 HB3 ALA B 443 7.715 2.819 -5.052 1.00 0.00 H new ATOM 1948 N ARG B 444 6.058 2.254 -7.732 1.00 0.00 N ATOM 1949 CA ARG B 444 5.308 2.947 -8.779 1.00 0.00 C ATOM 1950 C ARG B 444 4.462 1.974 -9.580 1.00 0.00 C ATOM 1951 O ARG B 444 3.425 2.341 -10.129 1.00 0.00 O ATOM 1952 CB ARG B 444 6.237 3.706 -9.727 1.00 0.00 C ATOM 1953 CG ARG B 444 6.287 5.199 -9.464 1.00 0.00 C ATOM 1954 CD ARG B 444 7.218 5.547 -8.320 1.00 0.00 C ATOM 1955 NE ARG B 444 7.187 6.975 -8.021 1.00 0.00 N ATOM 1956 CZ ARG B 444 7.892 7.890 -8.679 1.00 0.00 C ATOM 1957 NH1 ARG B 444 8.678 7.534 -9.692 1.00 0.00 N ATOM 1958 NH2 ARG B 444 7.797 9.166 -8.334 1.00 0.00 N ATOM 0 H ARG B 444 7.018 2.023 -7.987 1.00 0.00 H new ATOM 0 HA ARG B 444 4.656 3.663 -8.279 1.00 0.00 H new ATOM 0 HB2 ARG B 444 7.244 3.297 -9.641 1.00 0.00 H new ATOM 0 HB3 ARG B 444 5.911 3.537 -10.753 1.00 0.00 H new ATOM 0 HG2 ARG B 444 6.615 5.715 -10.367 1.00 0.00 H new ATOM 0 HG3 ARG B 444 5.284 5.560 -9.237 1.00 0.00 H new ATOM 0 HD2 ARG B 444 6.933 4.982 -7.433 1.00 0.00 H new ATOM 0 HD3 ARG B 444 8.235 5.249 -8.574 1.00 0.00 H new ATOM 0 HE ARG B 444 6.587 7.291 -7.259 1.00 0.00 H new ATOM 0 HH11 ARG B 444 8.742 6.554 -9.968 1.00 0.00 H new ATOM 0 HH12 ARG B 444 9.216 8.241 -10.193 1.00 0.00 H new ATOM 0 HH21 ARG B 444 7.185 9.443 -7.566 1.00 0.00 H new ATOM 0 HH22 ARG B 444 8.336 9.872 -8.836 1.00 0.00 H new ATOM 1972 N LYS B 445 4.916 0.738 -9.664 1.00 0.00 N ATOM 1973 CA LYS B 445 4.169 -0.301 -10.340 1.00 0.00 C ATOM 1974 C LYS B 445 2.941 -0.665 -9.550 1.00 0.00 C ATOM 1975 O LYS B 445 1.859 -0.839 -10.103 1.00 0.00 O ATOM 1976 CB LYS B 445 5.049 -1.504 -10.514 1.00 0.00 C ATOM 1977 CG LYS B 445 6.201 -1.211 -11.394 1.00 0.00 C ATOM 1978 CD LYS B 445 7.335 -2.151 -11.150 1.00 0.00 C ATOM 1979 CE LYS B 445 7.308 -3.197 -12.200 1.00 0.00 C ATOM 1980 NZ LYS B 445 7.640 -2.665 -13.548 1.00 0.00 N ATOM 0 H LYS B 445 5.804 0.429 -9.269 1.00 0.00 H new ATOM 0 HA LYS B 445 3.850 0.062 -11.317 1.00 0.00 H new ATOM 0 HB2 LYS B 445 5.409 -1.836 -9.540 1.00 0.00 H new ATOM 0 HB3 LYS B 445 4.467 -2.324 -10.936 1.00 0.00 H new ATOM 0 HG2 LYS B 445 5.889 -1.279 -12.436 1.00 0.00 H new ATOM 0 HG3 LYS B 445 6.535 -0.187 -11.228 1.00 0.00 H new ATOM 0 HD2 LYS B 445 8.284 -1.615 -11.173 1.00 0.00 H new ATOM 0 HD3 LYS B 445 7.248 -2.603 -10.162 1.00 0.00 H new ATOM 0 HE2 LYS B 445 8.015 -3.985 -11.941 1.00 0.00 H new ATOM 0 HE3 LYS B 445 6.318 -3.653 -12.227 1.00 0.00 H new ATOM 0 HZ1 LYS B 445 6.847 -2.843 -14.197 1.00 0.00 H new ATOM 0 HZ2 LYS B 445 7.812 -1.641 -13.485 1.00 0.00 H new ATOM 0 HZ3 LYS B 445 8.494 -3.138 -13.907 1.00 0.00 H new ATOM 1994 N LEU B 446 3.126 -0.792 -8.253 1.00 0.00 N ATOM 1995 CA LEU B 446 2.020 -0.990 -7.350 1.00 0.00 C ATOM 1996 C LEU B 446 1.130 0.225 -7.368 1.00 0.00 C ATOM 1997 O LEU B 446 -0.085 0.115 -7.339 1.00 0.00 O ATOM 1998 CB LEU B 446 2.532 -1.221 -5.950 1.00 0.00 C ATOM 1999 CG LEU B 446 3.493 -2.363 -5.795 1.00 0.00 C ATOM 2000 CD1 LEU B 446 3.407 -2.855 -4.373 1.00 0.00 C ATOM 2001 CD2 LEU B 446 3.088 -3.456 -6.733 1.00 0.00 C ATOM 0 H LEU B 446 4.040 -0.761 -7.801 1.00 0.00 H new ATOM 0 HA LEU B 446 1.451 -1.863 -7.670 1.00 0.00 H new ATOM 0 HB2 LEU B 446 3.019 -0.309 -5.605 1.00 0.00 H new ATOM 0 HB3 LEU B 446 1.679 -1.395 -5.294 1.00 0.00 H new ATOM 0 HG LEU B 446 4.513 -2.051 -6.020 1.00 0.00 H new ATOM 0 HD11 LEU B 446 4.097 -3.687 -4.233 1.00 0.00 H new ATOM 0 HD12 LEU B 446 3.671 -2.046 -3.692 1.00 0.00 H new ATOM 0 HD13 LEU B 446 2.390 -3.188 -4.164 1.00 0.00 H new ATOM 0 HD21 LEU B 446 3.777 -4.295 -6.633 1.00 0.00 H new ATOM 0 HD22 LEU B 446 2.077 -3.786 -6.493 1.00 0.00 H new ATOM 0 HD23 LEU B 446 3.114 -3.085 -7.757 1.00 0.00 H new ATOM 2013 N GLN B 447 1.764 1.380 -7.406 1.00 0.00 N ATOM 2014 CA GLN B 447 1.062 2.644 -7.568 1.00 0.00 C ATOM 2015 C GLN B 447 0.129 2.549 -8.770 1.00 0.00 C ATOM 2016 O GLN B 447 -1.031 2.947 -8.712 1.00 0.00 O ATOM 2017 CB GLN B 447 2.068 3.772 -7.784 1.00 0.00 C ATOM 2018 CG GLN B 447 1.552 5.147 -7.417 1.00 0.00 C ATOM 2019 CD GLN B 447 2.331 6.255 -8.092 1.00 0.00 C ATOM 2020 OE1 GLN B 447 3.522 6.120 -8.364 1.00 0.00 O ATOM 2021 NE2 GLN B 447 1.663 7.359 -8.373 1.00 0.00 N ATOM 0 H GLN B 447 2.777 1.472 -7.326 1.00 0.00 H new ATOM 0 HA GLN B 447 0.481 2.855 -6.670 1.00 0.00 H new ATOM 0 HB2 GLN B 447 2.962 3.563 -7.196 1.00 0.00 H new ATOM 0 HB3 GLN B 447 2.370 3.778 -8.831 1.00 0.00 H new ATOM 0 HG2 GLN B 447 0.501 5.224 -7.695 1.00 0.00 H new ATOM 0 HG3 GLN B 447 1.606 5.276 -6.336 1.00 0.00 H new ATOM 0 HE21 GLN B 447 0.675 7.433 -8.131 1.00 0.00 H new ATOM 0 HE22 GLN B 447 2.135 8.138 -8.832 1.00 0.00 H new ATOM 2030 N ASP B 448 0.656 1.989 -9.850 1.00 0.00 N ATOM 2031 CA ASP B 448 -0.105 1.780 -11.071 1.00 0.00 C ATOM 2032 C ASP B 448 -1.219 0.754 -10.866 1.00 0.00 C ATOM 2033 O ASP B 448 -2.389 1.055 -11.102 1.00 0.00 O ATOM 2034 CB ASP B 448 0.827 1.330 -12.197 1.00 0.00 C ATOM 2035 CG ASP B 448 0.083 1.022 -13.477 1.00 0.00 C ATOM 2036 OD1 ASP B 448 -0.346 1.972 -14.162 1.00 0.00 O ATOM 2037 OD2 ASP B 448 -0.069 -0.174 -13.806 1.00 0.00 O ATOM 0 H ASP B 448 1.623 1.667 -9.903 1.00 0.00 H new ATOM 0 HA ASP B 448 -0.570 2.727 -11.345 1.00 0.00 H new ATOM 0 HB2 ASP B 448 1.564 2.110 -12.388 1.00 0.00 H new ATOM 0 HB3 ASP B 448 1.376 0.444 -11.878 1.00 0.00 H new ATOM 2042 N VAL B 449 -0.863 -0.452 -10.416 1.00 0.00 N ATOM 2043 CA VAL B 449 -1.858 -1.504 -10.239 1.00 0.00 C ATOM 2044 C VAL B 449 -2.838 -1.177 -9.122 1.00 0.00 C ATOM 2045 O VAL B 449 -4.023 -1.070 -9.400 1.00 0.00 O ATOM 2046 CB VAL B 449 -1.258 -2.921 -10.074 1.00 0.00 C ATOM 2047 CG1 VAL B 449 -0.125 -2.973 -9.078 1.00 0.00 C ATOM 2048 CG2 VAL B 449 -2.343 -3.909 -9.688 1.00 0.00 C ATOM 0 H VAL B 449 0.091 -0.718 -10.172 1.00 0.00 H new ATOM 0 HA VAL B 449 -2.413 -1.531 -11.177 1.00 0.00 H new ATOM 0 HB VAL B 449 -0.836 -3.196 -11.041 1.00 0.00 H new ATOM 0 HG11 VAL B 449 0.252 -3.993 -9.008 1.00 0.00 H new ATOM 0 HG12 VAL B 449 0.677 -2.311 -9.405 1.00 0.00 H new ATOM 0 HG13 VAL B 449 -0.485 -2.652 -8.101 1.00 0.00 H new ATOM 0 HG21 VAL B 449 -1.908 -4.902 -9.575 1.00 0.00 H new ATOM 0 HG22 VAL B 449 -2.796 -3.602 -8.745 1.00 0.00 H new ATOM 0 HG23 VAL B 449 -3.106 -3.934 -10.466 1.00 0.00 H new ATOM 2058 N PHE B 450 -2.371 -0.995 -7.882 1.00 0.00 N ATOM 2059 CA PHE B 450 -3.263 -0.646 -6.779 1.00 0.00 C ATOM 2060 C PHE B 450 -4.227 0.483 -7.133 1.00 0.00 C ATOM 2061 O PHE B 450 -5.393 0.393 -6.811 1.00 0.00 O ATOM 2062 CB PHE B 450 -2.486 -0.243 -5.529 1.00 0.00 C ATOM 2063 CG PHE B 450 -3.315 0.576 -4.578 1.00 0.00 C ATOM 2064 CD1 PHE B 450 -4.241 -0.024 -3.735 1.00 0.00 C ATOM 2065 CD2 PHE B 450 -3.179 1.956 -4.543 1.00 0.00 C ATOM 2066 CE1 PHE B 450 -5.009 0.741 -2.881 1.00 0.00 C ATOM 2067 CE2 PHE B 450 -3.943 2.718 -3.689 1.00 0.00 C ATOM 2068 CZ PHE B 450 -4.858 2.111 -2.859 1.00 0.00 C ATOM 0 H PHE B 450 -1.389 -1.083 -7.622 1.00 0.00 H new ATOM 0 HA PHE B 450 -3.840 -1.550 -6.581 1.00 0.00 H new ATOM 0 HB2 PHE B 450 -2.133 -1.139 -5.019 1.00 0.00 H new ATOM 0 HB3 PHE B 450 -1.604 0.327 -5.821 1.00 0.00 H new ATOM 0 HD1 PHE B 450 -4.361 -1.097 -3.748 1.00 0.00 H new ATOM 0 HD2 PHE B 450 -2.465 2.438 -5.194 1.00 0.00 H new ATOM 0 HE1 PHE B 450 -5.728 0.266 -2.230 1.00 0.00 H new ATOM 0 HE2 PHE B 450 -3.825 3.791 -3.670 1.00 0.00 H new ATOM 0 HZ PHE B 450 -5.459 2.709 -2.190 1.00 0.00 H new ATOM 2078 N GLU B 451 -3.753 1.545 -7.767 1.00 0.00 N ATOM 2079 CA GLU B 451 -4.614 2.701 -8.009 1.00 0.00 C ATOM 2080 C GLU B 451 -5.678 2.380 -9.060 1.00 0.00 C ATOM 2081 O GLU B 451 -6.814 2.838 -8.951 1.00 0.00 O ATOM 2082 CB GLU B 451 -3.779 3.912 -8.428 1.00 0.00 C ATOM 2083 CG GLU B 451 -4.561 5.210 -8.551 1.00 0.00 C ATOM 2084 CD GLU B 451 -5.202 5.640 -7.247 1.00 0.00 C ATOM 2085 OE1 GLU B 451 -4.474 5.850 -6.254 1.00 0.00 O ATOM 2086 OE2 GLU B 451 -6.438 5.785 -7.208 1.00 0.00 O ATOM 0 H GLU B 451 -2.799 1.634 -8.118 1.00 0.00 H new ATOM 0 HA GLU B 451 -5.128 2.945 -7.079 1.00 0.00 H new ATOM 0 HB2 GLU B 451 -2.978 4.053 -7.702 1.00 0.00 H new ATOM 0 HB3 GLU B 451 -3.306 3.696 -9.386 1.00 0.00 H new ATOM 0 HG2 GLU B 451 -3.894 5.998 -8.899 1.00 0.00 H new ATOM 0 HG3 GLU B 451 -5.336 5.091 -9.309 1.00 0.00 H new ATOM 2093 N MET B 452 -5.315 1.594 -10.071 1.00 0.00 N ATOM 2094 CA MET B 452 -6.295 1.100 -11.040 1.00 0.00 C ATOM 2095 C MET B 452 -7.235 0.148 -10.318 1.00 0.00 C ATOM 2096 O MET B 452 -8.457 0.222 -10.436 1.00 0.00 O ATOM 2097 CB MET B 452 -5.592 0.356 -12.182 1.00 0.00 C ATOM 2098 CG MET B 452 -6.353 0.350 -13.505 1.00 0.00 C ATOM 2099 SD MET B 452 -8.019 -0.355 -13.420 1.00 0.00 S ATOM 2100 CE MET B 452 -7.704 -2.016 -12.821 1.00 0.00 C ATOM 0 H MET B 452 -4.358 1.286 -10.242 1.00 0.00 H new ATOM 0 HA MET B 452 -6.847 1.938 -11.465 1.00 0.00 H new ATOM 0 HB2 MET B 452 -4.614 0.808 -12.344 1.00 0.00 H new ATOM 0 HB3 MET B 452 -5.419 -0.675 -11.873 1.00 0.00 H new ATOM 0 HG2 MET B 452 -6.425 1.374 -13.871 1.00 0.00 H new ATOM 0 HG3 MET B 452 -5.774 -0.210 -14.239 1.00 0.00 H new ATOM 0 HE1 MET B 452 -8.274 -2.731 -13.414 1.00 0.00 H new ATOM 0 HE2 MET B 452 -6.641 -2.239 -12.908 1.00 0.00 H new ATOM 0 HE3 MET B 452 -8.005 -2.089 -11.776 1.00 0.00 H new ATOM 2110 N ARG B 453 -6.619 -0.734 -9.550 1.00 0.00 N ATOM 2111 CA ARG B 453 -7.295 -1.675 -8.703 1.00 0.00 C ATOM 2112 C ARG B 453 -8.279 -0.964 -7.789 1.00 0.00 C ATOM 2113 O ARG B 453 -9.404 -1.414 -7.587 1.00 0.00 O ATOM 2114 CB ARG B 453 -6.215 -2.374 -7.895 1.00 0.00 C ATOM 2115 CG ARG B 453 -5.551 -3.508 -8.623 1.00 0.00 C ATOM 2116 CD ARG B 453 -6.242 -4.802 -8.331 1.00 0.00 C ATOM 2117 NE ARG B 453 -5.984 -5.803 -9.365 1.00 0.00 N ATOM 2118 CZ ARG B 453 -6.677 -6.933 -9.511 1.00 0.00 C ATOM 2119 NH1 ARG B 453 -7.655 -7.234 -8.667 1.00 0.00 N ATOM 2120 NH2 ARG B 453 -6.376 -7.770 -10.499 1.00 0.00 N ATOM 0 H ARG B 453 -5.603 -0.809 -9.504 1.00 0.00 H new ATOM 0 HA ARG B 453 -7.872 -2.391 -9.289 1.00 0.00 H new ATOM 0 HB2 ARG B 453 -5.457 -1.644 -7.611 1.00 0.00 H new ATOM 0 HB3 ARG B 453 -6.653 -2.754 -6.972 1.00 0.00 H new ATOM 0 HG2 ARG B 453 -5.566 -3.316 -9.696 1.00 0.00 H new ATOM 0 HG3 ARG B 453 -4.504 -3.574 -8.326 1.00 0.00 H new ATOM 0 HD2 ARG B 453 -5.908 -5.182 -7.366 1.00 0.00 H new ATOM 0 HD3 ARG B 453 -7.315 -4.631 -8.251 1.00 0.00 H new ATOM 0 HE ARG B 453 -5.222 -5.625 -10.019 1.00 0.00 H new ATOM 0 HH11 ARG B 453 -7.881 -6.600 -7.901 1.00 0.00 H new ATOM 0 HH12 ARG B 453 -8.181 -8.100 -8.784 1.00 0.00 H new ATOM 0 HH21 ARG B 453 -5.617 -7.547 -11.143 1.00 0.00 H new ATOM 0 HH22 ARG B 453 -6.904 -8.635 -10.613 1.00 0.00 H new ATOM 2134 N PHE B 454 -7.845 0.167 -7.263 1.00 0.00 N ATOM 2135 CA PHE B 454 -8.628 0.928 -6.322 1.00 0.00 C ATOM 2136 C PHE B 454 -9.657 1.791 -7.045 1.00 0.00 C ATOM 2137 O PHE B 454 -10.672 2.179 -6.478 1.00 0.00 O ATOM 2138 CB PHE B 454 -7.734 1.818 -5.474 1.00 0.00 C ATOM 2139 CG PHE B 454 -8.337 2.025 -4.134 1.00 0.00 C ATOM 2140 CD1 PHE B 454 -8.553 0.933 -3.342 1.00 0.00 C ATOM 2141 CD2 PHE B 454 -8.746 3.269 -3.687 1.00 0.00 C ATOM 2142 CE1 PHE B 454 -9.153 1.044 -2.146 1.00 0.00 C ATOM 2143 CE2 PHE B 454 -9.353 3.395 -2.451 1.00 0.00 C ATOM 2144 CZ PHE B 454 -9.561 2.265 -1.682 1.00 0.00 C ATOM 0 H PHE B 454 -6.938 0.580 -7.480 1.00 0.00 H new ATOM 0 HA PHE B 454 -9.147 0.220 -5.676 1.00 0.00 H new ATOM 0 HB2 PHE B 454 -6.749 1.363 -5.371 1.00 0.00 H new ATOM 0 HB3 PHE B 454 -7.591 2.779 -5.969 1.00 0.00 H new ATOM 0 HD1 PHE B 454 -8.234 -0.040 -3.685 1.00 0.00 H new ATOM 0 HD2 PHE B 454 -8.591 4.142 -4.304 1.00 0.00 H new ATOM 0 HE1 PHE B 454 -9.315 0.162 -1.545 1.00 0.00 H new ATOM 0 HE2 PHE B 454 -9.661 4.365 -2.090 1.00 0.00 H new ATOM 0 HZ PHE B 454 -10.043 2.346 -0.719 1.00 0.00 H new