USER MOD reduce.3.24.130724 H: found=0, std=0, add=859, rem=0, adj=33 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 430 TYR OH : rot 40:sc= -1.39! USER MOD Set 1.2: B 447 GLN :FLIP amide:sc= 1.08 F(o=-1.3!,f=-0.31) USER MOD Set 2.1: B 429 CYS SG : rot -12:sc= -2.61 USER MOD Set 2.2: B 433 ASN : amide:sc= -0.983 K(o=-13,f=-25!) USER MOD Set 2.3: B 437 HIS : no HD1:sc= -9.1! C(o=-13!,f=-22!) USER MOD Set 3.1: B 369 HIS : no HD1:sc= -20.9! C(o=-20!,f=-21!) USER MOD Set 3.2: B 372 TYR OH : rot -14:sc= 1.23 USER MOD Set 4.1: B 364 MET CE :methyl -165:sc= -5.87! (180deg=-6.34!) USER MOD Set 4.2: B 425 MET CE :methyl -159:sc= -9.27! (180deg=-11.8!) USER MOD Single : B 351 SER OG : rot 180:sc= 0 USER MOD Single : B 353 GLN : amide:sc= -2.46! C(o=-2.5!,f=-5.6!) USER MOD Single : B 355 LYS NZ :NH3+ -124:sc= -0.0468 (180deg=-0.624) USER MOD Single : B 356 CYS SG : rot 180:sc= 0 USER MOD Single : B 357 CYS SG : rot -31:sc= -18.4! USER MOD Single : B 358 SER OG : rot -80:sc= 1.22 USER MOD Single : B 362 LYS NZ :NH3+ 140:sc= -0.0691 (180deg=-0.939) USER MOD Single : B 367 LYS NZ :NH3+ -167:sc=-0.00878 (180deg=-0.179) USER MOD Single : B 368 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 377 TYR OH : rot -18:sc= -3.73! USER MOD Single : B 378 LYS NZ :NH3+ 152:sc= -0.31 (180deg=-1.15!) 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= -4.3! USER MOD Single : B 391 CYS SG : rot -28:sc= 0.117 USER MOD Single : B 395 LYS NZ :NH3+ 158:sc= -0.0573 (180deg=-0.261) USER MOD Single : B 396 HIS :FLIP no HD1:sc= -1.56 F(o=-2.2,f=-1.6) USER MOD Single : B 398 MET CE :methyl 148:sc= -7.32! (180deg=-8.72!) USER MOD Single : B 400 MET CE :methyl 167:sc= -10.2! (180deg=-11.2!) USER MOD Single : B 401 SER OG : rot 180:sc= 0 USER MOD Single : B 402 THR OG1 : rot 108:sc= 0.857 USER MOD Single : B 404 LYS NZ :NH3+ 174:sc= 1.08 (180deg=0.914) USER MOD Single : B 405 SER OG : rot 180:sc= 0 USER MOD Single : B 406 LYS NZ :NH3+ 168:sc= -1.26! (180deg=-1.3!) USER MOD Single : B 412 TYR OH : rot -41:sc= -1.39 USER MOD Single : B 416 GLN : amide:sc= 0.103 X(o=0.1,f=0) USER MOD Single : B 427 SER OG : rot 180:sc= 0 USER MOD Single : B 428 ASN : amide:sc= -7.52! C(o=-7.5!,f=-13!) USER MOD Single : B 431 LYS NZ :NH3+ -150:sc= 0.19 (180deg=-0.339) USER MOD Single : B 432 TYR OH : rot 130:sc= -1.13 USER MOD Single : B 442 MET CE :methyl -125:sc= -3.01 (180deg=-7.89!) USER MOD Single : B 445 LYS NZ :NH3+ -93:sc= -0.243 (180deg=-1) USER MOD Single : B 452 MET CE :methyl 168:sc= -0.274 (180deg=-0.82) USER MOD ----------------------------------------------------------------- ATOM 88 N ARG A 7 19.008 2.129 -0.984 1.00 0.00 N ATOM 89 CA ARG A 7 19.983 1.116 -1.406 1.00 0.00 C ATOM 90 C ARG A 7 19.325 -0.250 -1.314 1.00 0.00 C ATOM 91 O ARG A 7 19.933 -1.295 -1.553 1.00 0.00 O ATOM 92 CB ARG A 7 21.283 1.171 -0.585 1.00 0.00 C ATOM 93 CG ARG A 7 22.386 0.271 -1.119 1.00 0.00 C ATOM 94 CD ARG A 7 22.665 0.558 -2.585 1.00 0.00 C ATOM 95 NE ARG A 7 23.063 1.946 -2.800 1.00 0.00 N ATOM 96 CZ ARG A 7 22.981 2.573 -3.971 1.00 0.00 C ATOM 97 NH1 ARG A 7 22.540 1.929 -5.044 1.00 0.00 N ATOM 98 NH2 ARG A 7 23.352 3.842 -4.068 1.00 0.00 N ATOM 0 HA ARG A 7 20.278 1.319 -2.436 1.00 0.00 H new ATOM 0 HB2 ARG A 7 21.645 2.199 -0.563 1.00 0.00 H new ATOM 0 HB3 ARG A 7 21.063 0.889 0.445 1.00 0.00 H new ATOM 0 HG2 ARG A 7 23.295 0.420 -0.537 1.00 0.00 H new ATOM 0 HG3 ARG A 7 22.098 -0.773 -0.998 1.00 0.00 H new ATOM 0 HD2 ARG A 7 23.453 -0.105 -2.942 1.00 0.00 H new ATOM 0 HD3 ARG A 7 21.774 0.340 -3.174 1.00 0.00 H new ATOM 0 HE ARG A 7 23.427 2.468 -2.003 1.00 0.00 H new ATOM 0 HH11 ARG A 7 22.262 0.950 -4.973 1.00 0.00 H new ATOM 0 HH12 ARG A 7 22.479 2.413 -5.940 1.00 0.00 H new ATOM 0 HH21 ARG A 7 23.700 4.336 -3.246 1.00 0.00 H new ATOM 0 HH22 ARG A 7 23.290 4.324 -4.965 1.00 0.00 H new ATOM 112 N GLY A 8 18.045 -0.208 -1.002 1.00 0.00 N ATOM 113 CA GLY A 8 17.281 -1.402 -0.823 1.00 0.00 C ATOM 114 C GLY A 8 16.837 -2.013 -2.122 1.00 0.00 C ATOM 115 O GLY A 8 16.728 -1.310 -3.129 1.00 0.00 O ATOM 0 H GLY A 8 17.518 0.655 -0.869 1.00 0.00 H new ATOM 0 HA2 GLY A 8 17.876 -2.129 -0.270 1.00 0.00 H new ATOM 0 HA3 GLY A 8 16.405 -1.179 -0.214 1.00 0.00 H new ATOM 450 N VAL B 350 -19.171 -1.358 2.163 1.00 0.00 N ATOM 451 CA VAL B 350 -17.940 -1.206 2.933 1.00 0.00 C ATOM 452 C VAL B 350 -17.082 -2.456 3.000 1.00 0.00 C ATOM 453 O VAL B 350 -15.980 -2.495 2.473 1.00 0.00 O ATOM 454 CB VAL B 350 -18.322 -0.756 4.334 1.00 0.00 C ATOM 455 CG1 VAL B 350 -17.160 -0.096 4.981 1.00 0.00 C ATOM 456 CG2 VAL B 350 -19.502 0.180 4.231 1.00 0.00 C ATOM 0 HA VAL B 350 -17.322 -0.468 2.421 1.00 0.00 H new ATOM 0 HB VAL B 350 -18.602 -1.610 4.950 1.00 0.00 H new ATOM 0 HG11 VAL B 350 -17.437 0.226 5.985 1.00 0.00 H new ATOM 0 HG12 VAL B 350 -16.329 -0.799 5.041 1.00 0.00 H new ATOM 0 HG13 VAL B 350 -16.860 0.771 4.392 1.00 0.00 H new ATOM 0 HG21 VAL B 350 -19.790 0.513 5.228 1.00 0.00 H new ATOM 0 HG22 VAL B 350 -19.230 1.044 3.624 1.00 0.00 H new ATOM 0 HG23 VAL B 350 -20.340 -0.340 3.766 1.00 0.00 H new ATOM 466 N SER B 351 -17.557 -3.455 3.687 1.00 0.00 N ATOM 467 CA SER B 351 -16.879 -4.732 3.718 1.00 0.00 C ATOM 468 C SER B 351 -16.796 -5.329 2.308 1.00 0.00 C ATOM 469 O SER B 351 -15.913 -6.132 2.005 1.00 0.00 O ATOM 470 CB SER B 351 -17.589 -5.654 4.700 1.00 0.00 C ATOM 471 OG SER B 351 -16.899 -6.882 4.862 1.00 0.00 O ATOM 0 H SER B 351 -18.415 -3.416 4.238 1.00 0.00 H new ATOM 0 HA SER B 351 -15.853 -4.602 4.063 1.00 0.00 H new ATOM 0 HB2 SER B 351 -17.678 -5.157 5.666 1.00 0.00 H new ATOM 0 HB3 SER B 351 -18.602 -5.850 4.348 1.00 0.00 H new ATOM 0 HG SER B 351 -17.383 -7.447 5.500 1.00 0.00 H new ATOM 477 N GLU B 352 -17.697 -4.884 1.439 1.00 0.00 N ATOM 478 CA GLU B 352 -17.631 -5.220 0.019 1.00 0.00 C ATOM 479 C GLU B 352 -16.380 -4.585 -0.572 1.00 0.00 C ATOM 480 O GLU B 352 -15.716 -5.158 -1.439 1.00 0.00 O ATOM 481 CB GLU B 352 -18.855 -4.685 -0.728 1.00 0.00 C ATOM 482 CG GLU B 352 -20.128 -4.657 0.097 1.00 0.00 C ATOM 483 CD GLU B 352 -20.617 -6.033 0.484 1.00 0.00 C ATOM 484 OE1 GLU B 352 -21.235 -6.708 -0.361 1.00 0.00 O ATOM 485 OE2 GLU B 352 -20.381 -6.442 1.642 1.00 0.00 O ATOM 0 H GLU B 352 -18.485 -4.288 1.693 1.00 0.00 H new ATOM 0 HA GLU B 352 -17.606 -6.305 -0.085 1.00 0.00 H new ATOM 0 HB2 GLU B 352 -18.640 -3.675 -1.077 1.00 0.00 H new ATOM 0 HB3 GLU B 352 -19.023 -5.299 -1.613 1.00 0.00 H new ATOM 0 HG2 GLU B 352 -19.955 -4.073 1.001 1.00 0.00 H new ATOM 0 HG3 GLU B 352 -20.908 -4.147 -0.468 1.00 0.00 H new ATOM 492 N GLN B 353 -16.065 -3.393 -0.063 1.00 0.00 N ATOM 493 CA GLN B 353 -14.869 -2.673 -0.449 1.00 0.00 C ATOM 494 C GLN B 353 -13.670 -3.487 -0.056 1.00 0.00 C ATOM 495 O GLN B 353 -12.685 -3.504 -0.758 1.00 0.00 O ATOM 496 CB GLN B 353 -14.772 -1.289 0.223 1.00 0.00 C ATOM 497 CG GLN B 353 -15.726 -0.239 -0.320 1.00 0.00 C ATOM 498 CD GLN B 353 -15.009 0.949 -0.922 1.00 0.00 C ATOM 499 OE1 GLN B 353 -13.898 0.838 -1.425 1.00 0.00 O ATOM 500 NE2 GLN B 353 -15.657 2.096 -0.886 1.00 0.00 N ATOM 0 H GLN B 353 -16.637 -2.907 0.628 1.00 0.00 H new ATOM 0 HA GLN B 353 -14.909 -2.515 -1.527 1.00 0.00 H new ATOM 0 HB2 GLN B 353 -14.957 -1.407 1.291 1.00 0.00 H new ATOM 0 HB3 GLN B 353 -13.752 -0.921 0.115 1.00 0.00 H new ATOM 0 HG2 GLN B 353 -16.366 -0.693 -1.077 1.00 0.00 H new ATOM 0 HG3 GLN B 353 -16.377 0.104 0.484 1.00 0.00 H new ATOM 0 HE21 GLN B 353 -16.581 2.146 -0.458 1.00 0.00 H new ATOM 0 HE22 GLN B 353 -15.234 2.933 -1.287 1.00 0.00 H new ATOM 509 N LEU B 354 -13.753 -4.184 1.061 1.00 0.00 N ATOM 510 CA LEU B 354 -12.611 -4.917 1.523 1.00 0.00 C ATOM 511 C LEU B 354 -12.419 -6.238 0.813 1.00 0.00 C ATOM 512 O LEU B 354 -11.300 -6.722 0.701 1.00 0.00 O ATOM 513 CB LEU B 354 -12.655 -5.155 2.983 1.00 0.00 C ATOM 514 CG LEU B 354 -12.690 -3.900 3.784 1.00 0.00 C ATOM 515 CD1 LEU B 354 -13.642 -4.030 4.935 1.00 0.00 C ATOM 516 CD2 LEU B 354 -11.297 -3.598 4.262 1.00 0.00 C ATOM 0 H LEU B 354 -14.584 -4.253 1.648 1.00 0.00 H new ATOM 0 HA LEU B 354 -11.759 -4.280 1.286 1.00 0.00 H new ATOM 0 HB2 LEU B 354 -13.534 -5.754 3.220 1.00 0.00 H new ATOM 0 HB3 LEU B 354 -11.783 -5.740 3.275 1.00 0.00 H new ATOM 0 HG LEU B 354 -13.046 -3.077 3.165 1.00 0.00 H new ATOM 0 HD11 LEU B 354 -13.651 -3.102 5.506 1.00 0.00 H new ATOM 0 HD12 LEU B 354 -14.644 -4.234 4.557 1.00 0.00 H new ATOM 0 HD13 LEU B 354 -13.324 -4.849 5.580 1.00 0.00 H new ATOM 0 HD21 LEU B 354 -11.305 -2.681 4.851 1.00 0.00 H new ATOM 0 HD22 LEU B 354 -10.937 -4.422 4.878 1.00 0.00 H new ATOM 0 HD23 LEU B 354 -10.637 -3.472 3.404 1.00 0.00 H new ATOM 528 N LYS B 355 -13.481 -6.849 0.349 1.00 0.00 N ATOM 529 CA LYS B 355 -13.309 -8.065 -0.421 1.00 0.00 C ATOM 530 C LYS B 355 -12.617 -7.721 -1.731 1.00 0.00 C ATOM 531 O LYS B 355 -11.883 -8.520 -2.311 1.00 0.00 O ATOM 532 CB LYS B 355 -14.644 -8.767 -0.665 1.00 0.00 C ATOM 533 CG LYS B 355 -15.019 -9.784 0.394 1.00 0.00 C ATOM 534 CD LYS B 355 -15.057 -9.183 1.791 1.00 0.00 C ATOM 535 CE LYS B 355 -13.992 -9.793 2.692 1.00 0.00 C ATOM 536 NZ LYS B 355 -14.188 -11.256 2.882 1.00 0.00 N ATOM 0 H LYS B 355 -14.444 -6.542 0.482 1.00 0.00 H new ATOM 0 HA LYS B 355 -12.690 -8.763 0.143 1.00 0.00 H new ATOM 0 HB2 LYS B 355 -15.431 -8.015 -0.724 1.00 0.00 H new ATOM 0 HB3 LYS B 355 -14.607 -9.266 -1.633 1.00 0.00 H new ATOM 0 HG2 LYS B 355 -15.995 -10.207 0.157 1.00 0.00 H new ATOM 0 HG3 LYS B 355 -14.302 -10.605 0.375 1.00 0.00 H new ATOM 0 HD2 LYS B 355 -14.908 -8.105 1.728 1.00 0.00 H new ATOM 0 HD3 LYS B 355 -16.042 -9.343 2.230 1.00 0.00 H new ATOM 0 HE2 LYS B 355 -13.007 -9.613 2.261 1.00 0.00 H new ATOM 0 HE3 LYS B 355 -14.011 -9.296 3.662 1.00 0.00 H new ATOM 0 HZ1 LYS B 355 -14.256 -11.468 3.898 1.00 0.00 H new ATOM 0 HZ2 LYS B 355 -15.064 -11.554 2.407 1.00 0.00 H new ATOM 0 HZ3 LYS B 355 -13.381 -11.770 2.474 1.00 0.00 H new ATOM 550 N CYS B 356 -12.833 -6.490 -2.140 1.00 0.00 N ATOM 551 CA CYS B 356 -12.169 -5.913 -3.288 1.00 0.00 C ATOM 552 C CYS B 356 -10.783 -5.458 -2.888 1.00 0.00 C ATOM 553 O CYS B 356 -9.800 -5.860 -3.501 1.00 0.00 O ATOM 554 CB CYS B 356 -12.971 -4.737 -3.798 1.00 0.00 C ATOM 555 SG CYS B 356 -13.152 -4.682 -5.596 1.00 0.00 S ATOM 0 H CYS B 356 -13.483 -5.854 -1.679 1.00 0.00 H new ATOM 0 HA CYS B 356 -12.089 -6.659 -4.079 1.00 0.00 H new ATOM 0 HB2 CYS B 356 -13.962 -4.765 -3.346 1.00 0.00 H new ATOM 0 HB3 CYS B 356 -12.494 -3.815 -3.464 1.00 0.00 H new ATOM 0 HG CYS B 356 -13.855 -3.641 -5.930 1.00 0.00 H new ATOM 561 N CYS B 357 -10.728 -4.648 -1.831 1.00 0.00 N ATOM 562 CA CYS B 357 -9.484 -4.112 -1.301 1.00 0.00 C ATOM 563 C CYS B 357 -8.478 -5.230 -1.159 1.00 0.00 C ATOM 564 O CYS B 357 -7.328 -5.119 -1.570 1.00 0.00 O ATOM 565 CB CYS B 357 -9.711 -3.470 0.082 1.00 0.00 C ATOM 566 SG CYS B 357 -9.713 -4.590 1.480 1.00 0.00 S ATOM 0 H CYS B 357 -11.556 -4.345 -1.317 1.00 0.00 H new ATOM 0 HA CYS B 357 -9.114 -3.352 -1.989 1.00 0.00 H new ATOM 0 HB2 CYS B 357 -8.936 -2.721 0.244 1.00 0.00 H new ATOM 0 HB3 CYS B 357 -10.665 -2.943 0.063 1.00 0.00 H new ATOM 0 HG CYS B 357 -10.162 -5.751 1.105 1.00 0.00 H new ATOM 572 N SER B 358 -8.941 -6.334 -0.599 1.00 0.00 N ATOM 573 CA SER B 358 -8.060 -7.443 -0.332 1.00 0.00 C ATOM 574 C SER B 358 -7.564 -8.056 -1.616 1.00 0.00 C ATOM 575 O SER B 358 -6.368 -8.136 -1.820 1.00 0.00 O ATOM 576 CB SER B 358 -8.721 -8.502 0.546 1.00 0.00 C ATOM 577 OG SER B 358 -9.984 -8.884 0.035 1.00 0.00 O ATOM 0 H SER B 358 -9.913 -6.480 -0.325 1.00 0.00 H new ATOM 0 HA SER B 358 -7.207 -7.048 0.219 1.00 0.00 H new ATOM 0 HB2 SER B 358 -8.074 -9.377 0.612 1.00 0.00 H new ATOM 0 HB3 SER B 358 -8.839 -8.115 1.558 1.00 0.00 H new ATOM 0 HG SER B 358 -10.654 -8.213 0.284 1.00 0.00 H new ATOM 583 N GLY B 359 -8.485 -8.454 -2.493 1.00 0.00 N ATOM 584 CA GLY B 359 -8.100 -9.020 -3.778 1.00 0.00 C ATOM 585 C GLY B 359 -7.230 -8.071 -4.581 1.00 0.00 C ATOM 586 O GLY B 359 -6.590 -8.466 -5.548 1.00 0.00 O ATOM 0 H GLY B 359 -9.491 -8.395 -2.337 1.00 0.00 H new ATOM 0 HA2 GLY B 359 -7.563 -9.954 -3.616 1.00 0.00 H new ATOM 0 HA3 GLY B 359 -8.996 -9.262 -4.350 1.00 0.00 H new ATOM 590 N ILE B 360 -7.228 -6.817 -4.163 1.00 0.00 N ATOM 591 CA ILE B 360 -6.402 -5.785 -4.751 1.00 0.00 C ATOM 592 C ILE B 360 -4.962 -5.848 -4.228 1.00 0.00 C ATOM 593 O ILE B 360 -4.023 -5.963 -5.009 1.00 0.00 O ATOM 594 CB ILE B 360 -7.022 -4.423 -4.472 1.00 0.00 C ATOM 595 CG1 ILE B 360 -8.260 -4.214 -5.321 1.00 0.00 C ATOM 596 CG2 ILE B 360 -6.037 -3.309 -4.696 1.00 0.00 C ATOM 597 CD1 ILE B 360 -8.889 -2.898 -5.025 1.00 0.00 C ATOM 0 H ILE B 360 -7.810 -6.486 -3.394 1.00 0.00 H new ATOM 0 HA ILE B 360 -6.357 -5.947 -5.828 1.00 0.00 H new ATOM 0 HB ILE B 360 -7.311 -4.404 -3.421 1.00 0.00 H new ATOM 0 HG12 ILE B 360 -7.995 -4.266 -6.377 1.00 0.00 H new ATOM 0 HG13 ILE B 360 -8.975 -5.015 -5.132 1.00 0.00 H new ATOM 0 HG21 ILE B 360 -6.516 -2.352 -4.487 1.00 0.00 H new ATOM 0 HG22 ILE B 360 -5.183 -3.440 -4.032 1.00 0.00 H new ATOM 0 HG23 ILE B 360 -5.698 -3.326 -5.732 1.00 0.00 H new ATOM 0 HD11 ILE B 360 -9.775 -2.770 -5.646 1.00 0.00 H new ATOM 0 HD12 ILE B 360 -9.174 -2.859 -3.974 1.00 0.00 H new ATOM 0 HD13 ILE B 360 -8.179 -2.099 -5.238 1.00 0.00 H new ATOM 609 N LEU B 361 -4.795 -5.764 -2.908 1.00 0.00 N ATOM 610 CA LEU B 361 -3.485 -6.000 -2.274 1.00 0.00 C ATOM 611 C LEU B 361 -2.999 -7.362 -2.629 1.00 0.00 C ATOM 612 O LEU B 361 -1.915 -7.526 -3.147 1.00 0.00 O ATOM 613 CB LEU B 361 -3.616 -5.995 -0.774 1.00 0.00 C ATOM 614 CG LEU B 361 -2.802 -4.975 -0.027 1.00 0.00 C ATOM 615 CD1 LEU B 361 -2.832 -5.342 1.425 1.00 0.00 C ATOM 616 CD2 LEU B 361 -1.398 -4.958 -0.495 1.00 0.00 C ATOM 0 H LEU B 361 -5.543 -5.536 -2.254 1.00 0.00 H new ATOM 0 HA LEU B 361 -2.808 -5.217 -2.616 1.00 0.00 H new ATOM 0 HB2 LEU B 361 -4.666 -5.841 -0.525 1.00 0.00 H new ATOM 0 HB3 LEU B 361 -3.343 -6.984 -0.406 1.00 0.00 H new ATOM 0 HG LEU B 361 -3.223 -3.984 -0.197 1.00 0.00 H new ATOM 0 HD11 LEU B 361 -2.249 -4.619 1.995 1.00 0.00 H new ATOM 0 HD12 LEU B 361 -3.863 -5.338 1.780 1.00 0.00 H new ATOM 0 HD13 LEU B 361 -2.407 -6.337 1.558 1.00 0.00 H new ATOM 0 HD21 LEU B 361 -0.837 -4.210 0.065 1.00 0.00 H new ATOM 0 HD22 LEU B 361 -0.950 -5.940 -0.339 1.00 0.00 H new ATOM 0 HD23 LEU B 361 -1.371 -4.712 -1.557 1.00 0.00 H new ATOM 628 N LYS B 362 -3.803 -8.330 -2.256 1.00 0.00 N ATOM 629 CA LYS B 362 -3.610 -9.719 -2.655 1.00 0.00 C ATOM 630 C LYS B 362 -3.181 -9.834 -4.124 1.00 0.00 C ATOM 631 O LYS B 362 -2.449 -10.746 -4.494 1.00 0.00 O ATOM 632 CB LYS B 362 -4.902 -10.500 -2.457 1.00 0.00 C ATOM 633 CG LYS B 362 -5.114 -11.029 -1.062 1.00 0.00 C ATOM 634 CD LYS B 362 -4.736 -10.035 0.002 1.00 0.00 C ATOM 635 CE LYS B 362 -5.336 -10.453 1.317 1.00 0.00 C ATOM 636 NZ LYS B 362 -4.772 -11.744 1.815 1.00 0.00 N ATOM 0 H LYS B 362 -4.619 -8.182 -1.662 1.00 0.00 H new ATOM 0 HA LYS B 362 -2.818 -10.131 -2.030 1.00 0.00 H new ATOM 0 HB2 LYS B 362 -5.742 -9.857 -2.718 1.00 0.00 H new ATOM 0 HB3 LYS B 362 -4.914 -11.338 -3.154 1.00 0.00 H new ATOM 0 HG2 LYS B 362 -6.161 -11.306 -0.939 1.00 0.00 H new ATOM 0 HG3 LYS B 362 -4.526 -11.937 -0.930 1.00 0.00 H new ATOM 0 HD2 LYS B 362 -3.651 -9.974 0.088 1.00 0.00 H new ATOM 0 HD3 LYS B 362 -5.090 -9.041 -0.272 1.00 0.00 H new ATOM 0 HE2 LYS B 362 -5.160 -9.673 2.058 1.00 0.00 H new ATOM 0 HE3 LYS B 362 -6.416 -10.550 1.206 1.00 0.00 H new ATOM 0 HZ1 LYS B 362 -4.630 -11.687 2.844 1.00 0.00 H new ATOM 0 HZ2 LYS B 362 -5.433 -12.518 1.599 1.00 0.00 H new ATOM 0 HZ3 LYS B 362 -3.860 -11.927 1.349 1.00 0.00 H new ATOM 650 N GLU B 363 -3.664 -8.919 -4.959 1.00 0.00 N ATOM 651 CA GLU B 363 -3.241 -8.858 -6.352 1.00 0.00 C ATOM 652 C GLU B 363 -1.829 -8.314 -6.471 1.00 0.00 C ATOM 653 O GLU B 363 -1.011 -8.915 -7.109 1.00 0.00 O ATOM 654 CB GLU B 363 -4.164 -8.007 -7.210 1.00 0.00 C ATOM 655 CG GLU B 363 -3.685 -7.910 -8.646 1.00 0.00 C ATOM 656 CD GLU B 363 -3.852 -9.203 -9.422 1.00 0.00 C ATOM 657 OE1 GLU B 363 -4.553 -10.118 -8.936 1.00 0.00 O ATOM 658 OE2 GLU B 363 -3.292 -9.300 -10.530 1.00 0.00 O ATOM 0 H GLU B 363 -4.348 -8.210 -4.694 1.00 0.00 H new ATOM 0 HA GLU B 363 -3.280 -9.884 -6.719 1.00 0.00 H new ATOM 0 HB2 GLU B 363 -5.168 -8.431 -7.192 1.00 0.00 H new ATOM 0 HB3 GLU B 363 -4.233 -7.006 -6.784 1.00 0.00 H new ATOM 0 HG2 GLU B 363 -4.235 -7.117 -9.152 1.00 0.00 H new ATOM 0 HG3 GLU B 363 -2.633 -7.623 -8.653 1.00 0.00 H new ATOM 665 N MET B 364 -1.532 -7.166 -5.887 1.00 0.00 N ATOM 666 CA MET B 364 -0.146 -6.695 -5.866 1.00 0.00 C ATOM 667 C MET B 364 0.729 -7.759 -5.180 1.00 0.00 C ATOM 668 O MET B 364 1.907 -7.912 -5.480 1.00 0.00 O ATOM 669 CB MET B 364 -0.023 -5.295 -5.217 1.00 0.00 C ATOM 670 CG MET B 364 -1.252 -4.837 -4.470 1.00 0.00 C ATOM 671 SD MET B 364 -1.468 -3.054 -4.468 1.00 0.00 S ATOM 672 CE MET B 364 0.060 -2.522 -3.720 1.00 0.00 C ATOM 0 H MET B 364 -2.207 -6.552 -5.431 1.00 0.00 H new ATOM 0 HA MET B 364 0.213 -6.565 -6.887 1.00 0.00 H new ATOM 0 HB2 MET B 364 0.823 -5.301 -4.529 1.00 0.00 H new ATOM 0 HB3 MET B 364 0.205 -4.567 -5.996 1.00 0.00 H new ATOM 0 HG2 MET B 364 -2.132 -5.301 -4.916 1.00 0.00 H new ATOM 0 HG3 MET B 364 -1.193 -5.189 -3.440 1.00 0.00 H new ATOM 0 HE1 MET B 364 -0.031 -1.482 -3.408 1.00 0.00 H new ATOM 0 HE2 MET B 364 0.276 -3.144 -2.851 1.00 0.00 H new ATOM 0 HE3 MET B 364 0.871 -2.615 -4.443 1.00 0.00 H new ATOM 682 N PHE B 365 0.103 -8.518 -4.292 1.00 0.00 N ATOM 683 CA PHE B 365 0.707 -9.681 -3.654 1.00 0.00 C ATOM 684 C PHE B 365 0.857 -10.849 -4.638 1.00 0.00 C ATOM 685 O PHE B 365 1.539 -11.836 -4.351 1.00 0.00 O ATOM 686 CB PHE B 365 -0.190 -10.166 -2.525 1.00 0.00 C ATOM 687 CG PHE B 365 0.301 -9.933 -1.148 1.00 0.00 C ATOM 688 CD1 PHE B 365 1.213 -10.786 -0.559 1.00 0.00 C ATOM 689 CD2 PHE B 365 -0.188 -8.883 -0.431 1.00 0.00 C ATOM 690 CE1 PHE B 365 1.633 -10.572 0.734 1.00 0.00 C ATOM 691 CE2 PHE B 365 0.216 -8.663 0.850 1.00 0.00 C ATOM 692 CZ PHE B 365 1.131 -9.502 1.441 1.00 0.00 C ATOM 0 H PHE B 365 -0.855 -8.341 -3.989 1.00 0.00 H new ATOM 0 HA PHE B 365 1.688 -9.376 -3.289 1.00 0.00 H new ATOM 0 HB2 PHE B 365 -1.161 -9.682 -2.628 1.00 0.00 H new ATOM 0 HB3 PHE B 365 -0.352 -11.236 -2.653 1.00 0.00 H new ATOM 0 HD1 PHE B 365 1.599 -11.626 -1.116 1.00 0.00 H new ATOM 0 HD2 PHE B 365 -0.906 -8.216 -0.885 1.00 0.00 H new ATOM 0 HE1 PHE B 365 2.350 -11.238 1.191 1.00 0.00 H new ATOM 0 HE2 PHE B 365 -0.184 -7.827 1.404 1.00 0.00 H new ATOM 0 HZ PHE B 365 1.455 -9.323 2.456 1.00 0.00 H new ATOM 702 N ALA B 366 0.150 -10.763 -5.759 1.00 0.00 N ATOM 703 CA ALA B 366 0.198 -11.790 -6.791 1.00 0.00 C ATOM 704 C ALA B 366 1.617 -11.995 -7.266 1.00 0.00 C ATOM 705 O ALA B 366 2.404 -11.055 -7.256 1.00 0.00 O ATOM 706 CB ALA B 366 -0.709 -11.443 -7.970 1.00 0.00 C ATOM 0 H ALA B 366 -0.470 -9.983 -5.977 1.00 0.00 H new ATOM 0 HA ALA B 366 -0.166 -12.718 -6.351 1.00 0.00 H new ATOM 0 HB1 ALA B 366 -0.648 -12.231 -8.720 1.00 0.00 H new ATOM 0 HB2 ALA B 366 -1.738 -11.352 -7.623 1.00 0.00 H new ATOM 0 HB3 ALA B 366 -0.389 -10.498 -8.409 1.00 0.00 H new ATOM 712 N LYS B 367 1.949 -13.213 -7.681 1.00 0.00 N ATOM 713 CA LYS B 367 3.268 -13.493 -8.238 1.00 0.00 C ATOM 714 C LYS B 367 3.506 -12.528 -9.399 1.00 0.00 C ATOM 715 O LYS B 367 4.624 -12.077 -9.655 1.00 0.00 O ATOM 716 CB LYS B 367 3.345 -14.947 -8.703 1.00 0.00 C ATOM 717 CG LYS B 367 4.706 -15.604 -8.497 1.00 0.00 C ATOM 718 CD LYS B 367 5.795 -14.949 -9.328 1.00 0.00 C ATOM 719 CE LYS B 367 7.145 -15.610 -9.103 1.00 0.00 C ATOM 720 NZ LYS B 367 7.612 -15.467 -7.696 1.00 0.00 N ATOM 0 H LYS B 367 1.326 -14.019 -7.643 1.00 0.00 H new ATOM 0 HA LYS B 367 4.041 -13.351 -7.483 1.00 0.00 H new ATOM 0 HB2 LYS B 367 2.591 -15.526 -8.170 1.00 0.00 H new ATOM 0 HB3 LYS B 367 3.091 -14.991 -9.762 1.00 0.00 H new ATOM 0 HG2 LYS B 367 4.976 -15.552 -7.442 1.00 0.00 H new ATOM 0 HG3 LYS B 367 4.640 -16.660 -8.757 1.00 0.00 H new ATOM 0 HD2 LYS B 367 5.532 -15.008 -10.384 1.00 0.00 H new ATOM 0 HD3 LYS B 367 5.860 -13.891 -9.074 1.00 0.00 H new ATOM 0 HE2 LYS B 367 7.077 -16.668 -9.356 1.00 0.00 H new ATOM 0 HE3 LYS B 367 7.881 -15.169 -9.775 1.00 0.00 H new ATOM 0 HZ1 LYS B 367 8.616 -15.731 -7.635 1.00 0.00 H new ATOM 0 HZ2 LYS B 367 7.494 -14.480 -7.390 1.00 0.00 H new ATOM 0 HZ3 LYS B 367 7.052 -16.090 -7.079 1.00 0.00 H new ATOM 734 N LYS B 368 2.402 -12.209 -10.057 1.00 0.00 N ATOM 735 CA LYS B 368 2.319 -11.165 -11.062 1.00 0.00 C ATOM 736 C LYS B 368 3.009 -9.862 -10.593 1.00 0.00 C ATOM 737 O LYS B 368 3.814 -9.292 -11.327 1.00 0.00 O ATOM 738 CB LYS B 368 0.834 -10.968 -11.375 1.00 0.00 C ATOM 739 CG LYS B 368 0.303 -9.585 -11.154 1.00 0.00 C ATOM 740 CD LYS B 368 0.814 -8.581 -12.173 1.00 0.00 C ATOM 741 CE LYS B 368 0.339 -8.934 -13.551 1.00 0.00 C ATOM 742 NZ LYS B 368 0.715 -7.920 -14.567 1.00 0.00 N ATOM 0 H LYS B 368 1.514 -12.685 -9.900 1.00 0.00 H new ATOM 0 HA LYS B 368 2.854 -11.453 -11.967 1.00 0.00 H new ATOM 0 HB2 LYS B 368 0.661 -11.242 -12.416 1.00 0.00 H new ATOM 0 HB3 LYS B 368 0.257 -11.661 -10.763 1.00 0.00 H new ATOM 0 HG2 LYS B 368 -0.786 -9.610 -11.192 1.00 0.00 H new ATOM 0 HG3 LYS B 368 0.580 -9.251 -10.154 1.00 0.00 H new ATOM 0 HD2 LYS B 368 0.470 -7.581 -11.910 1.00 0.00 H new ATOM 0 HD3 LYS B 368 1.904 -8.558 -12.153 1.00 0.00 H new ATOM 0 HE2 LYS B 368 0.755 -9.900 -13.837 1.00 0.00 H new ATOM 0 HE3 LYS B 368 -0.745 -9.045 -13.539 1.00 0.00 H new ATOM 0 HZ1 LYS B 368 0.361 -8.215 -15.499 1.00 0.00 H new ATOM 0 HZ2 LYS B 368 0.297 -7.002 -14.313 1.00 0.00 H new ATOM 0 HZ3 LYS B 368 1.751 -7.831 -14.602 1.00 0.00 H new ATOM 756 N HIS B 369 2.717 -9.397 -9.369 1.00 0.00 N ATOM 757 CA HIS B 369 3.321 -8.153 -8.880 1.00 0.00 C ATOM 758 C HIS B 369 4.396 -8.443 -7.856 1.00 0.00 C ATOM 759 O HIS B 369 5.024 -7.536 -7.357 1.00 0.00 O ATOM 760 CB HIS B 369 2.298 -7.144 -8.310 1.00 0.00 C ATOM 761 CG HIS B 369 1.110 -6.887 -9.170 1.00 0.00 C ATOM 762 ND1 HIS B 369 1.071 -5.969 -10.188 1.00 0.00 N ATOM 763 CD2 HIS B 369 -0.110 -7.437 -9.129 1.00 0.00 C ATOM 764 CE1 HIS B 369 -0.130 -5.976 -10.725 1.00 0.00 C ATOM 765 NE2 HIS B 369 -0.867 -6.856 -10.100 1.00 0.00 N ATOM 0 H HIS B 369 2.081 -9.853 -8.714 1.00 0.00 H new ATOM 0 HA HIS B 369 3.766 -7.678 -9.754 1.00 0.00 H new ATOM 0 HB2 HIS B 369 1.953 -7.509 -7.342 1.00 0.00 H new ATOM 0 HB3 HIS B 369 2.808 -6.197 -8.131 1.00 0.00 H new ATOM 0 HD2 HIS B 369 -0.436 -8.207 -8.445 1.00 0.00 H new ATOM 0 HE1 HIS B 369 -0.454 -5.356 -11.548 1.00 0.00 H new ATOM 0 HE2 HIS B 369 -1.843 -7.071 -10.305 1.00 0.00 H new ATOM 774 N ALA B 370 4.656 -9.712 -7.587 1.00 0.00 N ATOM 775 CA ALA B 370 5.683 -10.087 -6.622 1.00 0.00 C ATOM 776 C ALA B 370 7.064 -9.908 -7.193 1.00 0.00 C ATOM 777 O ALA B 370 8.055 -10.268 -6.570 1.00 0.00 O ATOM 778 CB ALA B 370 5.512 -11.507 -6.145 1.00 0.00 C ATOM 0 H ALA B 370 4.173 -10.499 -8.020 1.00 0.00 H new ATOM 0 HA ALA B 370 5.565 -9.420 -5.768 1.00 0.00 H new ATOM 0 HB1 ALA B 370 6.297 -11.747 -5.428 1.00 0.00 H new ATOM 0 HB2 ALA B 370 4.538 -11.616 -5.667 1.00 0.00 H new ATOM 0 HB3 ALA B 370 5.577 -12.187 -6.995 1.00 0.00 H new ATOM 784 N ALA B 371 7.119 -9.418 -8.405 1.00 0.00 N ATOM 785 CA ALA B 371 8.367 -9.004 -8.983 1.00 0.00 C ATOM 786 C ALA B 371 8.772 -7.674 -8.377 1.00 0.00 C ATOM 787 O ALA B 371 9.945 -7.298 -8.392 1.00 0.00 O ATOM 788 CB ALA B 371 8.208 -8.860 -10.477 1.00 0.00 C ATOM 0 H ALA B 371 6.308 -9.296 -9.012 1.00 0.00 H new ATOM 0 HA ALA B 371 9.137 -9.748 -8.779 1.00 0.00 H new ATOM 0 HB1 ALA B 371 9.155 -8.546 -10.915 1.00 0.00 H new ATOM 0 HB2 ALA B 371 7.910 -9.817 -10.905 1.00 0.00 H new ATOM 0 HB3 ALA B 371 7.444 -8.113 -10.691 1.00 0.00 H new ATOM 794 N TYR B 372 7.784 -6.962 -7.825 1.00 0.00 N ATOM 795 CA TYR B 372 8.011 -5.594 -7.402 1.00 0.00 C ATOM 796 C TYR B 372 7.158 -5.141 -6.222 1.00 0.00 C ATOM 797 O TYR B 372 7.410 -4.103 -5.637 1.00 0.00 O ATOM 798 CB TYR B 372 7.790 -4.687 -8.580 1.00 0.00 C ATOM 799 CG TYR B 372 6.585 -5.038 -9.389 1.00 0.00 C ATOM 800 CD1 TYR B 372 5.361 -4.515 -9.061 1.00 0.00 C ATOM 801 CD2 TYR B 372 6.688 -5.842 -10.516 1.00 0.00 C ATOM 802 CE1 TYR B 372 4.260 -4.775 -9.829 1.00 0.00 C ATOM 803 CE2 TYR B 372 5.584 -6.122 -11.287 1.00 0.00 C ATOM 804 CZ TYR B 372 4.370 -5.582 -10.942 1.00 0.00 C ATOM 805 OH TYR B 372 3.267 -5.841 -11.712 1.00 0.00 O ATOM 0 H TYR B 372 6.839 -7.310 -7.666 1.00 0.00 H new ATOM 0 HA TYR B 372 9.039 -5.543 -7.043 1.00 0.00 H new ATOM 0 HB2 TYR B 372 7.692 -3.661 -8.224 1.00 0.00 H new ATOM 0 HB3 TYR B 372 8.670 -4.719 -9.222 1.00 0.00 H new ATOM 0 HD1 TYR B 372 5.265 -3.890 -8.185 1.00 0.00 H new ATOM 0 HD2 TYR B 372 7.648 -6.253 -10.791 1.00 0.00 H new ATOM 0 HE1 TYR B 372 3.304 -4.348 -9.564 1.00 0.00 H new ATOM 0 HE2 TYR B 372 5.671 -6.760 -12.154 1.00 0.00 H new ATOM 0 HH TYR B 372 2.459 -5.575 -11.226 1.00 0.00 H new ATOM 815 N ALA B 373 6.164 -5.899 -5.861 1.00 0.00 N ATOM 816 CA ALA B 373 5.340 -5.539 -4.721 1.00 0.00 C ATOM 817 C ALA B 373 5.807 -6.297 -3.526 1.00 0.00 C ATOM 818 O ALA B 373 5.488 -5.967 -2.393 1.00 0.00 O ATOM 819 CB ALA B 373 3.886 -5.845 -4.965 1.00 0.00 C ATOM 0 H ALA B 373 5.898 -6.766 -6.329 1.00 0.00 H new ATOM 0 HA ALA B 373 5.435 -4.465 -4.558 1.00 0.00 H new ATOM 0 HB1 ALA B 373 3.303 -5.561 -4.089 1.00 0.00 H new ATOM 0 HB2 ALA B 373 3.536 -5.283 -5.831 1.00 0.00 H new ATOM 0 HB3 ALA B 373 3.765 -6.912 -5.152 1.00 0.00 H new ATOM 825 N TRP B 374 6.569 -7.325 -3.801 1.00 0.00 N ATOM 826 CA TRP B 374 7.106 -8.177 -2.778 1.00 0.00 C ATOM 827 C TRP B 374 7.815 -7.386 -1.652 1.00 0.00 C ATOM 828 O TRP B 374 7.668 -7.773 -0.501 1.00 0.00 O ATOM 829 CB TRP B 374 8.016 -9.221 -3.428 1.00 0.00 C ATOM 830 CG TRP B 374 9.284 -8.633 -3.962 1.00 0.00 C ATOM 831 CD1 TRP B 374 9.560 -8.317 -5.251 1.00 0.00 C ATOM 832 CD2 TRP B 374 10.418 -8.232 -3.199 1.00 0.00 C ATOM 833 NE1 TRP B 374 10.792 -7.731 -5.342 1.00 0.00 N ATOM 834 CE2 TRP B 374 11.347 -7.668 -4.084 1.00 0.00 C ATOM 835 CE3 TRP B 374 10.721 -8.290 -1.845 1.00 0.00 C ATOM 836 CZ2 TRP B 374 12.568 -7.160 -3.644 1.00 0.00 C ATOM 837 CZ3 TRP B 374 11.914 -7.786 -1.407 1.00 0.00 C ATOM 838 CH2 TRP B 374 12.830 -7.223 -2.297 1.00 0.00 C ATOM 0 H TRP B 374 6.834 -7.594 -4.749 1.00 0.00 H new ATOM 0 HA TRP B 374 6.282 -8.689 -2.280 1.00 0.00 H new ATOM 0 HB2 TRP B 374 8.258 -9.991 -2.696 1.00 0.00 H new ATOM 0 HB3 TRP B 374 7.478 -9.711 -4.240 1.00 0.00 H new ATOM 0 HD1 TRP B 374 8.901 -8.502 -6.087 1.00 0.00 H new ATOM 0 HE1 TRP B 374 11.228 -7.396 -6.201 1.00 0.00 H new ATOM 0 HE3 TRP B 374 10.023 -8.728 -1.147 1.00 0.00 H new ATOM 0 HZ2 TRP B 374 13.280 -6.734 -4.335 1.00 0.00 H new ATOM 0 HZ3 TRP B 374 12.152 -7.824 -0.354 1.00 0.00 H new ATOM 0 HH2 TRP B 374 13.762 -6.830 -1.920 1.00 0.00 H new ATOM 849 N PRO B 375 8.563 -6.252 -1.915 1.00 0.00 N ATOM 850 CA PRO B 375 9.244 -5.518 -0.843 1.00 0.00 C ATOM 851 C PRO B 375 8.261 -4.646 -0.114 1.00 0.00 C ATOM 852 O PRO B 375 8.610 -3.866 0.767 1.00 0.00 O ATOM 853 CB PRO B 375 10.263 -4.670 -1.592 1.00 0.00 C ATOM 854 CG PRO B 375 9.573 -4.335 -2.855 1.00 0.00 C ATOM 855 CD PRO B 375 8.787 -5.572 -3.221 1.00 0.00 C ATOM 0 HA PRO B 375 9.700 -6.165 -0.094 1.00 0.00 H new ATOM 0 HB2 PRO B 375 10.530 -3.774 -1.031 1.00 0.00 H new ATOM 0 HB3 PRO B 375 11.187 -5.220 -1.773 1.00 0.00 H new ATOM 0 HG2 PRO B 375 8.916 -3.475 -2.728 1.00 0.00 H new ATOM 0 HG3 PRO B 375 10.287 -4.077 -3.637 1.00 0.00 H new ATOM 0 HD2 PRO B 375 7.845 -5.318 -3.706 1.00 0.00 H new ATOM 0 HD3 PRO B 375 9.340 -6.207 -3.913 1.00 0.00 H new ATOM 863 N PHE B 376 7.025 -4.776 -0.541 1.00 0.00 N ATOM 864 CA PHE B 376 5.930 -4.110 0.100 1.00 0.00 C ATOM 865 C PHE B 376 5.142 -5.108 0.918 1.00 0.00 C ATOM 866 O PHE B 376 4.681 -4.735 1.971 1.00 0.00 O ATOM 867 CB PHE B 376 5.048 -3.359 -0.905 1.00 0.00 C ATOM 868 CG PHE B 376 5.832 -2.352 -1.692 1.00 0.00 C ATOM 869 CD1 PHE B 376 6.604 -2.753 -2.761 1.00 0.00 C ATOM 870 CD2 PHE B 376 5.842 -1.016 -1.327 1.00 0.00 C ATOM 871 CE1 PHE B 376 7.365 -1.849 -3.463 1.00 0.00 C ATOM 872 CE2 PHE B 376 6.621 -0.101 -2.028 1.00 0.00 C ATOM 873 CZ PHE B 376 7.376 -0.525 -3.096 1.00 0.00 C ATOM 0 H PHE B 376 6.758 -5.348 -1.342 1.00 0.00 H new ATOM 0 HA PHE B 376 6.328 -3.350 0.772 1.00 0.00 H new ATOM 0 HB2 PHE B 376 4.586 -4.073 -1.587 1.00 0.00 H new ATOM 0 HB3 PHE B 376 4.240 -2.856 -0.374 1.00 0.00 H new ATOM 0 HD1 PHE B 376 6.611 -3.793 -3.051 1.00 0.00 H new ATOM 0 HD2 PHE B 376 5.242 -0.683 -0.493 1.00 0.00 H new ATOM 0 HE1 PHE B 376 7.955 -2.180 -4.305 1.00 0.00 H new ATOM 0 HE2 PHE B 376 6.633 0.938 -1.734 1.00 0.00 H new ATOM 0 HZ PHE B 376 7.978 0.183 -3.647 1.00 0.00 H new ATOM 883 N TYR B 377 5.018 -6.393 0.473 1.00 0.00 N ATOM 884 CA TYR B 377 4.324 -7.408 1.306 1.00 0.00 C ATOM 885 C TYR B 377 4.892 -7.313 2.683 1.00 0.00 C ATOM 886 O TYR B 377 4.204 -7.117 3.654 1.00 0.00 O ATOM 887 CB TYR B 377 4.533 -8.872 0.876 1.00 0.00 C ATOM 888 CG TYR B 377 4.351 -9.225 -0.571 1.00 0.00 C ATOM 889 CD1 TYR B 377 4.002 -8.289 -1.496 1.00 0.00 C ATOM 890 CD2 TYR B 377 4.492 -10.542 -0.989 1.00 0.00 C ATOM 891 CE1 TYR B 377 3.789 -8.628 -2.800 1.00 0.00 C ATOM 892 CE2 TYR B 377 4.290 -10.891 -2.304 1.00 0.00 C ATOM 893 CZ TYR B 377 3.932 -9.917 -3.200 1.00 0.00 C ATOM 894 OH TYR B 377 3.693 -10.228 -4.502 1.00 0.00 O ATOM 0 H TYR B 377 5.374 -6.736 -0.419 1.00 0.00 H new ATOM 0 HA TYR B 377 3.260 -7.188 1.217 1.00 0.00 H new ATOM 0 HB2 TYR B 377 5.544 -9.161 1.163 1.00 0.00 H new ATOM 0 HB3 TYR B 377 3.848 -9.489 1.457 1.00 0.00 H new ATOM 0 HD1 TYR B 377 3.892 -7.259 -1.192 1.00 0.00 H new ATOM 0 HD2 TYR B 377 4.764 -11.302 -0.272 1.00 0.00 H new ATOM 0 HE1 TYR B 377 3.506 -7.870 -3.515 1.00 0.00 H new ATOM 0 HE2 TYR B 377 4.411 -11.915 -2.625 1.00 0.00 H new ATOM 0 HH TYR B 377 3.171 -9.511 -4.919 1.00 0.00 H new ATOM 904 N LYS B 378 6.175 -7.314 2.720 1.00 0.00 N ATOM 905 CA LYS B 378 6.877 -7.218 3.949 1.00 0.00 C ATOM 906 C LYS B 378 7.524 -5.853 4.074 1.00 0.00 C ATOM 907 O LYS B 378 7.640 -5.112 3.103 1.00 0.00 O ATOM 908 CB LYS B 378 7.869 -8.351 4.049 1.00 0.00 C ATOM 909 CG LYS B 378 8.229 -8.927 2.729 1.00 0.00 C ATOM 910 CD LYS B 378 9.066 -7.952 1.949 1.00 0.00 C ATOM 911 CE LYS B 378 10.559 -8.106 2.202 1.00 0.00 C ATOM 912 NZ LYS B 378 10.996 -9.528 2.139 1.00 0.00 N ATOM 0 H LYS B 378 6.771 -7.382 1.895 1.00 0.00 H new ATOM 0 HA LYS B 378 6.188 -7.314 4.788 1.00 0.00 H new ATOM 0 HB2 LYS B 378 8.773 -7.992 4.541 1.00 0.00 H new ATOM 0 HB3 LYS B 378 7.453 -9.136 4.680 1.00 0.00 H new ATOM 0 HG2 LYS B 378 8.777 -9.859 2.868 1.00 0.00 H new ATOM 0 HG3 LYS B 378 7.325 -9.169 2.171 1.00 0.00 H new ATOM 0 HD2 LYS B 378 8.869 -8.084 0.885 1.00 0.00 H new ATOM 0 HD3 LYS B 378 8.763 -6.937 2.206 1.00 0.00 H new ATOM 0 HE2 LYS B 378 11.113 -7.524 1.465 1.00 0.00 H new ATOM 0 HE3 LYS B 378 10.804 -7.695 3.181 1.00 0.00 H new ATOM 0 HZ1 LYS B 378 11.992 -9.572 1.844 1.00 0.00 H new ATOM 0 HZ2 LYS B 378 10.893 -9.965 3.077 1.00 0.00 H new ATOM 0 HZ3 LYS B 378 10.408 -10.042 1.452 1.00 0.00 H new ATOM 926 N PRO B 379 7.946 -5.528 5.276 1.00 0.00 N ATOM 927 CA PRO B 379 8.412 -4.195 5.643 1.00 0.00 C ATOM 928 C PRO B 379 9.771 -3.862 5.048 1.00 0.00 C ATOM 929 O PRO B 379 10.605 -4.751 4.844 1.00 0.00 O ATOM 930 CB PRO B 379 8.502 -4.264 7.176 1.00 0.00 C ATOM 931 CG PRO B 379 7.848 -5.557 7.561 1.00 0.00 C ATOM 932 CD PRO B 379 8.030 -6.458 6.385 1.00 0.00 C ATOM 0 HA PRO B 379 7.746 -3.417 5.270 1.00 0.00 H new ATOM 0 HB2 PRO B 379 9.539 -4.235 7.509 1.00 0.00 H new ATOM 0 HB3 PRO B 379 7.995 -3.416 7.637 1.00 0.00 H new ATOM 0 HG2 PRO B 379 8.308 -5.979 8.454 1.00 0.00 H new ATOM 0 HG3 PRO B 379 6.791 -5.412 7.785 1.00 0.00 H new ATOM 0 HD2 PRO B 379 8.989 -6.975 6.412 1.00 0.00 H new ATOM 0 HD3 PRO B 379 7.256 -7.224 6.334 1.00 0.00 H new ATOM 940 N VAL B 380 9.965 -2.572 4.758 1.00 0.00 N ATOM 941 CA VAL B 380 11.263 -2.044 4.342 1.00 0.00 C ATOM 942 C VAL B 380 12.351 -2.595 5.244 1.00 0.00 C ATOM 943 O VAL B 380 12.399 -2.318 6.448 1.00 0.00 O ATOM 944 CB VAL B 380 11.279 -0.493 4.321 1.00 0.00 C ATOM 945 CG1 VAL B 380 10.171 0.084 5.187 1.00 0.00 C ATOM 946 CG2 VAL B 380 12.618 0.057 4.758 1.00 0.00 C ATOM 0 H VAL B 380 9.228 -1.868 4.805 1.00 0.00 H new ATOM 0 HA VAL B 380 11.453 -2.369 3.319 1.00 0.00 H new ATOM 0 HB VAL B 380 11.106 -0.189 3.289 1.00 0.00 H new ATOM 0 HG11 VAL B 380 10.210 1.173 5.150 1.00 0.00 H new ATOM 0 HG12 VAL B 380 9.204 -0.257 4.816 1.00 0.00 H new ATOM 0 HG13 VAL B 380 10.303 -0.249 6.216 1.00 0.00 H new ATOM 0 HG21 VAL B 380 12.590 1.146 4.730 1.00 0.00 H new ATOM 0 HG22 VAL B 380 12.834 -0.275 5.774 1.00 0.00 H new ATOM 0 HG23 VAL B 380 13.396 -0.303 4.086 1.00 0.00 H new ATOM 956 N ASP B 381 13.194 -3.419 4.657 1.00 0.00 N ATOM 957 CA ASP B 381 14.180 -4.147 5.416 1.00 0.00 C ATOM 958 C ASP B 381 15.444 -3.344 5.570 1.00 0.00 C ATOM 959 O ASP B 381 16.337 -3.374 4.740 1.00 0.00 O ATOM 960 CB ASP B 381 14.465 -5.488 4.781 1.00 0.00 C ATOM 961 CG ASP B 381 15.040 -6.465 5.787 1.00 0.00 C ATOM 962 OD1 ASP B 381 16.120 -6.188 6.357 1.00 0.00 O ATOM 963 OD2 ASP B 381 14.406 -7.514 6.022 1.00 0.00 O ATOM 0 H ASP B 381 13.213 -3.599 3.653 1.00 0.00 H new ATOM 0 HA ASP B 381 13.774 -4.325 6.412 1.00 0.00 H new ATOM 0 HB2 ASP B 381 13.546 -5.896 4.360 1.00 0.00 H new ATOM 0 HB3 ASP B 381 15.165 -5.360 3.955 1.00 0.00 H new ATOM 968 N VAL B 382 15.508 -2.669 6.684 1.00 0.00 N ATOM 969 CA VAL B 382 16.524 -1.676 6.960 1.00 0.00 C ATOM 970 C VAL B 382 17.917 -2.287 7.064 1.00 0.00 C ATOM 971 O VAL B 382 18.928 -1.590 6.952 1.00 0.00 O ATOM 972 CB VAL B 382 16.124 -0.956 8.245 1.00 0.00 C ATOM 973 CG1 VAL B 382 17.083 0.155 8.617 1.00 0.00 C ATOM 974 CG2 VAL B 382 14.700 -0.447 8.072 1.00 0.00 C ATOM 0 H VAL B 382 14.842 -2.793 7.447 1.00 0.00 H new ATOM 0 HA VAL B 382 16.582 -0.969 6.133 1.00 0.00 H new ATOM 0 HB VAL B 382 16.171 -1.657 9.079 1.00 0.00 H new ATOM 0 HG11 VAL B 382 16.748 0.631 9.539 1.00 0.00 H new ATOM 0 HG12 VAL B 382 18.080 -0.259 8.764 1.00 0.00 H new ATOM 0 HG13 VAL B 382 17.112 0.894 7.816 1.00 0.00 H new ATOM 0 HG21 VAL B 382 14.387 0.073 8.977 1.00 0.00 H new ATOM 0 HG22 VAL B 382 14.659 0.240 7.227 1.00 0.00 H new ATOM 0 HG23 VAL B 382 14.033 -1.289 7.888 1.00 0.00 H new ATOM 984 N GLU B 383 17.962 -3.595 7.219 1.00 0.00 N ATOM 985 CA GLU B 383 19.219 -4.305 7.273 1.00 0.00 C ATOM 986 C GLU B 383 19.582 -4.788 5.886 1.00 0.00 C ATOM 987 O GLU B 383 20.664 -4.510 5.366 1.00 0.00 O ATOM 988 CB GLU B 383 19.117 -5.477 8.227 1.00 0.00 C ATOM 989 CG GLU B 383 19.962 -6.641 7.785 1.00 0.00 C ATOM 990 CD GLU B 383 20.980 -7.069 8.817 1.00 0.00 C ATOM 991 OE1 GLU B 383 20.585 -7.710 9.810 1.00 0.00 O ATOM 992 OE2 GLU B 383 22.181 -6.771 8.641 1.00 0.00 O ATOM 0 H GLU B 383 17.137 -4.188 7.310 1.00 0.00 H new ATOM 0 HA GLU B 383 19.998 -3.634 7.635 1.00 0.00 H new ATOM 0 HB2 GLU B 383 19.428 -5.161 9.223 1.00 0.00 H new ATOM 0 HB3 GLU B 383 18.077 -5.793 8.303 1.00 0.00 H new ATOM 0 HG2 GLU B 383 19.312 -7.485 7.554 1.00 0.00 H new ATOM 0 HG3 GLU B 383 20.479 -6.376 6.863 1.00 0.00 H new ATOM 999 N ALA B 384 18.639 -5.497 5.304 1.00 0.00 N ATOM 1000 CA ALA B 384 18.755 -6.054 3.973 1.00 0.00 C ATOM 1001 C ALA B 384 19.094 -4.980 2.966 1.00 0.00 C ATOM 1002 O ALA B 384 19.986 -5.136 2.131 1.00 0.00 O ATOM 1003 CB ALA B 384 17.417 -6.640 3.637 1.00 0.00 C ATOM 0 H ALA B 384 17.748 -5.707 5.754 1.00 0.00 H new ATOM 0 HA ALA B 384 19.548 -6.801 3.942 1.00 0.00 H new ATOM 0 HB1 ALA B 384 17.451 -7.075 2.638 1.00 0.00 H new ATOM 0 HB2 ALA B 384 17.167 -7.414 4.362 1.00 0.00 H new ATOM 0 HB3 ALA B 384 16.659 -5.857 3.666 1.00 0.00 H new ATOM 1009 N LEU B 385 18.360 -3.893 3.063 1.00 0.00 N ATOM 1010 CA LEU B 385 18.464 -2.804 2.127 1.00 0.00 C ATOM 1011 C LEU B 385 19.712 -1.968 2.410 1.00 0.00 C ATOM 1012 O LEU B 385 20.250 -1.311 1.521 1.00 0.00 O ATOM 1013 CB LEU B 385 17.207 -1.935 2.222 1.00 0.00 C ATOM 1014 CG LEU B 385 15.865 -2.672 2.093 1.00 0.00 C ATOM 1015 CD1 LEU B 385 14.728 -1.683 1.879 1.00 0.00 C ATOM 1016 CD2 LEU B 385 15.893 -3.687 0.966 1.00 0.00 C ATOM 0 H LEU B 385 17.671 -3.743 3.800 1.00 0.00 H new ATOM 0 HA LEU B 385 18.550 -3.207 1.118 1.00 0.00 H new ATOM 0 HB2 LEU B 385 17.222 -1.414 3.179 1.00 0.00 H new ATOM 0 HB3 LEU B 385 17.257 -1.174 1.444 1.00 0.00 H new ATOM 0 HG LEU B 385 15.696 -3.209 3.026 1.00 0.00 H new ATOM 0 HD11 LEU B 385 13.786 -2.225 1.790 1.00 0.00 H new ATOM 0 HD12 LEU B 385 14.675 -1.000 2.727 1.00 0.00 H new ATOM 0 HD13 LEU B 385 14.907 -1.115 0.966 1.00 0.00 H new ATOM 0 HD21 LEU B 385 14.927 -4.189 0.904 1.00 0.00 H new ATOM 0 HD22 LEU B 385 16.099 -3.179 0.024 1.00 0.00 H new ATOM 0 HD23 LEU B 385 16.673 -4.423 1.159 1.00 0.00 H new ATOM 1028 N GLY B 386 20.182 -2.034 3.655 1.00 0.00 N ATOM 1029 CA GLY B 386 21.298 -1.211 4.085 1.00 0.00 C ATOM 1030 C GLY B 386 20.888 0.233 4.217 1.00 0.00 C ATOM 1031 O GLY B 386 21.542 1.136 3.696 1.00 0.00 O ATOM 0 H GLY B 386 19.805 -2.648 4.377 1.00 0.00 H new ATOM 0 HA2 GLY B 386 21.674 -1.574 5.041 1.00 0.00 H new ATOM 0 HA3 GLY B 386 22.114 -1.296 3.368 1.00 0.00 H new ATOM 1035 N LEU B 387 19.809 0.434 4.944 1.00 0.00 N ATOM 1036 CA LEU B 387 19.141 1.719 5.000 1.00 0.00 C ATOM 1037 C LEU B 387 19.814 2.692 5.964 1.00 0.00 C ATOM 1038 O LEU B 387 20.279 3.759 5.556 1.00 0.00 O ATOM 1039 CB LEU B 387 17.689 1.519 5.395 1.00 0.00 C ATOM 1040 CG LEU B 387 16.830 0.813 4.356 1.00 0.00 C ATOM 1041 CD1 LEU B 387 15.392 1.161 4.531 1.00 0.00 C ATOM 1042 CD2 LEU B 387 17.251 1.169 2.970 1.00 0.00 C ATOM 0 H LEU B 387 19.369 -0.289 5.514 1.00 0.00 H new ATOM 0 HA LEU B 387 19.205 2.162 4.006 1.00 0.00 H new ATOM 0 HB2 LEU B 387 17.656 0.946 6.322 1.00 0.00 H new ATOM 0 HB3 LEU B 387 17.249 2.493 5.607 1.00 0.00 H new ATOM 0 HG LEU B 387 16.966 -0.258 4.504 1.00 0.00 H new ATOM 0 HD11 LEU B 387 14.798 0.644 3.777 1.00 0.00 H new ATOM 0 HD12 LEU B 387 15.062 0.856 5.524 1.00 0.00 H new ATOM 0 HD13 LEU B 387 15.262 2.238 4.420 1.00 0.00 H new ATOM 0 HD21 LEU B 387 16.617 0.648 2.252 1.00 0.00 H new ATOM 0 HD22 LEU B 387 17.154 2.245 2.825 1.00 0.00 H new ATOM 0 HD23 LEU B 387 18.289 0.874 2.818 1.00 0.00 H new ATOM 1054 N HIS B 388 19.852 2.311 7.243 1.00 0.00 N ATOM 1055 CA HIS B 388 20.453 3.122 8.310 1.00 0.00 C ATOM 1056 C HIS B 388 19.587 4.333 8.662 1.00 0.00 C ATOM 1057 O HIS B 388 19.016 4.394 9.749 1.00 0.00 O ATOM 1058 CB HIS B 388 21.871 3.571 7.936 1.00 0.00 C ATOM 1059 CG HIS B 388 22.810 2.433 7.684 1.00 0.00 C ATOM 1060 ND1 HIS B 388 23.142 1.998 6.420 1.00 0.00 N ATOM 1061 CD2 HIS B 388 23.485 1.638 8.541 1.00 0.00 C ATOM 1062 CE1 HIS B 388 23.975 0.981 6.513 1.00 0.00 C ATOM 1063 NE2 HIS B 388 24.203 0.743 7.789 1.00 0.00 N ATOM 0 H HIS B 388 19.465 1.426 7.572 1.00 0.00 H new ATOM 0 HA HIS B 388 20.514 2.487 9.194 1.00 0.00 H new ATOM 0 HB2 HIS B 388 21.822 4.196 7.044 1.00 0.00 H new ATOM 0 HB3 HIS B 388 22.271 4.191 8.738 1.00 0.00 H new ATOM 0 HD2 HIS B 388 23.464 1.696 9.619 1.00 0.00 H new ATOM 0 HE1 HIS B 388 24.399 0.435 5.683 1.00 0.00 H new ATOM 0 HE2 HIS B 388 24.813 0.013 8.157 1.00 0.00 H new ATOM 1072 N ASP B 389 19.470 5.277 7.734 1.00 0.00 N ATOM 1073 CA ASP B 389 18.744 6.530 7.978 1.00 0.00 C ATOM 1074 C ASP B 389 17.234 6.315 7.973 1.00 0.00 C ATOM 1075 O ASP B 389 16.468 7.232 8.254 1.00 0.00 O ATOM 1076 CB ASP B 389 19.112 7.574 6.925 1.00 0.00 C ATOM 1077 CG ASP B 389 20.568 7.980 6.991 1.00 0.00 C ATOM 1078 OD1 ASP B 389 21.432 7.175 6.588 1.00 0.00 O ATOM 1079 OD2 ASP B 389 20.857 9.114 7.429 1.00 0.00 O ATOM 0 H ASP B 389 19.870 5.202 6.798 1.00 0.00 H new ATOM 0 HA ASP B 389 19.037 6.887 8.965 1.00 0.00 H new ATOM 0 HB2 ASP B 389 18.894 7.177 5.934 1.00 0.00 H new ATOM 0 HB3 ASP B 389 18.486 8.456 7.060 1.00 0.00 H new ATOM 1084 N TYR B 390 16.835 5.101 7.626 1.00 0.00 N ATOM 1085 CA TYR B 390 15.437 4.660 7.619 1.00 0.00 C ATOM 1086 C TYR B 390 14.562 5.301 8.685 1.00 0.00 C ATOM 1087 O TYR B 390 13.584 5.936 8.352 1.00 0.00 O ATOM 1088 CB TYR B 390 15.424 3.187 7.801 1.00 0.00 C ATOM 1089 CG TYR B 390 14.089 2.641 8.133 1.00 0.00 C ATOM 1090 CD1 TYR B 390 13.130 2.581 7.165 1.00 0.00 C ATOM 1091 CD2 TYR B 390 13.795 2.178 9.408 1.00 0.00 C ATOM 1092 CE1 TYR B 390 11.905 2.065 7.428 1.00 0.00 C ATOM 1093 CE2 TYR B 390 12.559 1.657 9.693 1.00 0.00 C ATOM 1094 CZ TYR B 390 11.615 1.596 8.699 1.00 0.00 C ATOM 1095 OH TYR B 390 10.394 1.055 8.976 1.00 0.00 O ATOM 0 H TYR B 390 17.486 4.372 7.333 1.00 0.00 H new ATOM 0 HA TYR B 390 15.011 4.971 6.665 1.00 0.00 H new ATOM 0 HB2 TYR B 390 15.784 2.714 6.887 1.00 0.00 H new ATOM 0 HB3 TYR B 390 16.123 2.921 8.594 1.00 0.00 H new ATOM 0 HD1 TYR B 390 13.350 2.950 6.174 1.00 0.00 H new ATOM 0 HD2 TYR B 390 14.546 2.229 10.182 1.00 0.00 H new ATOM 0 HE1 TYR B 390 11.158 2.019 6.650 1.00 0.00 H new ATOM 0 HE2 TYR B 390 12.332 1.299 10.686 1.00 0.00 H new ATOM 0 HH TYR B 390 10.365 0.777 9.915 1.00 0.00 H new ATOM 1105 N CYS B 391 14.901 5.129 9.956 1.00 0.00 N ATOM 1106 CA CYS B 391 14.012 5.554 11.038 1.00 0.00 C ATOM 1107 C CYS B 391 13.858 7.076 11.070 1.00 0.00 C ATOM 1108 O CYS B 391 12.954 7.611 11.715 1.00 0.00 O ATOM 1109 CB CYS B 391 14.533 5.029 12.375 1.00 0.00 C ATOM 1110 SG CYS B 391 13.477 5.407 13.794 1.00 0.00 S ATOM 0 H CYS B 391 15.775 4.703 10.265 1.00 0.00 H new ATOM 0 HA CYS B 391 13.023 5.133 10.855 1.00 0.00 H new ATOM 0 HB2 CYS B 391 14.652 3.948 12.305 1.00 0.00 H new ATOM 0 HB3 CYS B 391 15.523 5.447 12.554 1.00 0.00 H new ATOM 0 HG CYS B 391 12.814 6.501 13.562 1.00 0.00 H new ATOM 1116 N ASP B 392 14.737 7.763 10.358 1.00 0.00 N ATOM 1117 CA ASP B 392 14.666 9.208 10.223 1.00 0.00 C ATOM 1118 C ASP B 392 13.743 9.580 9.111 1.00 0.00 C ATOM 1119 O ASP B 392 13.015 10.570 9.173 1.00 0.00 O ATOM 1120 CB ASP B 392 16.035 9.775 9.923 1.00 0.00 C ATOM 1121 CG ASP B 392 16.699 10.389 11.135 1.00 0.00 C ATOM 1122 OD1 ASP B 392 17.349 9.647 11.905 1.00 0.00 O ATOM 1123 OD2 ASP B 392 16.579 11.617 11.328 1.00 0.00 O ATOM 0 H ASP B 392 15.517 7.336 9.859 1.00 0.00 H new ATOM 0 HA ASP B 392 14.295 9.617 11.163 1.00 0.00 H new ATOM 0 HB2 ASP B 392 16.672 8.983 9.529 1.00 0.00 H new ATOM 0 HB3 ASP B 392 15.946 10.531 9.142 1.00 0.00 H new ATOM 1128 N ILE B 393 13.809 8.793 8.081 1.00 0.00 N ATOM 1129 CA ILE B 393 12.919 8.930 6.975 1.00 0.00 C ATOM 1130 C ILE B 393 11.547 8.467 7.359 1.00 0.00 C ATOM 1131 O ILE B 393 10.573 9.204 7.343 1.00 0.00 O ATOM 1132 CB ILE B 393 13.381 8.070 5.808 1.00 0.00 C ATOM 1133 CG1 ILE B 393 14.698 8.585 5.297 1.00 0.00 C ATOM 1134 CG2 ILE B 393 12.337 8.132 4.710 1.00 0.00 C ATOM 1135 CD1 ILE B 393 15.798 7.575 5.248 1.00 0.00 C ATOM 0 H ILE B 393 14.485 8.035 7.986 1.00 0.00 H new ATOM 0 HA ILE B 393 12.906 9.981 6.688 1.00 0.00 H new ATOM 0 HB ILE B 393 13.508 7.037 6.131 1.00 0.00 H new ATOM 0 HG12 ILE B 393 14.549 8.986 4.294 1.00 0.00 H new ATOM 0 HG13 ILE B 393 15.016 9.415 5.928 1.00 0.00 H new ATOM 0 HG21 ILE B 393 12.658 7.519 3.868 1.00 0.00 H new ATOM 0 HG22 ILE B 393 11.386 7.758 5.090 1.00 0.00 H new ATOM 0 HG23 ILE B 393 12.215 9.164 4.382 1.00 0.00 H new ATOM 0 HD11 ILE B 393 16.705 8.043 4.866 1.00 0.00 H new ATOM 0 HD12 ILE B 393 15.983 7.190 6.251 1.00 0.00 H new ATOM 0 HD13 ILE B 393 15.509 6.754 4.591 1.00 0.00 H new ATOM 1147 N ILE B 394 11.525 7.233 7.747 1.00 0.00 N ATOM 1148 CA ILE B 394 10.335 6.468 7.853 1.00 0.00 C ATOM 1149 C ILE B 394 9.752 6.534 9.235 1.00 0.00 C ATOM 1150 O ILE B 394 10.393 6.191 10.226 1.00 0.00 O ATOM 1151 CB ILE B 394 10.650 5.022 7.494 1.00 0.00 C ATOM 1152 CG1 ILE B 394 11.167 4.915 6.058 1.00 0.00 C ATOM 1153 CG2 ILE B 394 9.450 4.145 7.737 1.00 0.00 C ATOM 1154 CD1 ILE B 394 10.136 5.189 5.005 1.00 0.00 C ATOM 0 H ILE B 394 12.366 6.717 8.006 1.00 0.00 H new ATOM 0 HA ILE B 394 9.595 6.880 7.167 1.00 0.00 H new ATOM 0 HB ILE B 394 11.449 4.665 8.144 1.00 0.00 H new ATOM 0 HG12 ILE B 394 11.994 5.614 5.930 1.00 0.00 H new ATOM 0 HG13 ILE B 394 11.569 3.914 5.903 1.00 0.00 H new ATOM 0 HG21 ILE B 394 9.693 3.115 7.475 1.00 0.00 H new ATOM 0 HG22 ILE B 394 9.170 4.195 8.789 1.00 0.00 H new ATOM 0 HG23 ILE B 394 8.618 4.489 7.123 1.00 0.00 H new ATOM 0 HD11 ILE B 394 10.589 5.091 4.018 1.00 0.00 H new ATOM 0 HD12 ILE B 394 9.318 4.475 5.102 1.00 0.00 H new ATOM 0 HD13 ILE B 394 9.750 6.201 5.128 1.00 0.00 H new ATOM 1166 N LYS B 395 8.525 6.987 9.275 1.00 0.00 N ATOM 1167 CA LYS B 395 7.811 7.141 10.511 1.00 0.00 C ATOM 1168 C LYS B 395 6.709 6.109 10.556 1.00 0.00 C ATOM 1169 O LYS B 395 6.375 5.559 11.600 1.00 0.00 O ATOM 1170 CB LYS B 395 7.222 8.517 10.590 1.00 0.00 C ATOM 1171 CG LYS B 395 8.057 9.586 9.915 1.00 0.00 C ATOM 1172 CD LYS B 395 9.538 9.538 10.247 1.00 0.00 C ATOM 1173 CE LYS B 395 10.163 10.912 10.130 1.00 0.00 C ATOM 1174 NZ LYS B 395 9.733 11.820 11.226 1.00 0.00 N ATOM 0 H LYS B 395 7.994 7.259 8.448 1.00 0.00 H new ATOM 0 HA LYS B 395 8.488 7.003 11.354 1.00 0.00 H new ATOM 0 HB2 LYS B 395 6.232 8.503 10.135 1.00 0.00 H new ATOM 0 HB3 LYS B 395 7.088 8.784 11.638 1.00 0.00 H new ATOM 0 HG2 LYS B 395 7.937 9.494 8.836 1.00 0.00 H new ATOM 0 HG3 LYS B 395 7.667 10.564 10.196 1.00 0.00 H new ATOM 0 HD2 LYS B 395 9.676 9.156 11.259 1.00 0.00 H new ATOM 0 HD3 LYS B 395 10.043 8.846 9.574 1.00 0.00 H new ATOM 0 HE2 LYS B 395 11.249 10.818 10.144 1.00 0.00 H new ATOM 0 HE3 LYS B 395 9.893 11.351 9.170 1.00 0.00 H new ATOM 0 HZ1 LYS B 395 10.429 12.585 11.337 1.00 0.00 H new ATOM 0 HZ2 LYS B 395 8.805 12.228 10.995 1.00 0.00 H new ATOM 0 HZ3 LYS B 395 9.664 11.284 12.114 1.00 0.00 H new ATOM 1188 N HIS B 396 6.167 5.846 9.374 1.00 0.00 N ATOM 1189 CA HIS B 396 5.115 4.878 9.188 1.00 0.00 C ATOM 1190 C HIS B 396 5.304 4.201 7.866 1.00 0.00 C ATOM 1191 O HIS B 396 4.769 4.602 6.835 1.00 0.00 O ATOM 1192 CB HIS B 396 3.716 5.492 9.270 1.00 0.00 C ATOM 1193 CG HIS B 396 3.590 6.872 8.702 1.00 0.00 C ATOM 1194 ND1 HIS B 396 4.425 7.576 7.908 1.00 0.00 N flip ATOM 1195 CD2 HIS B 396 2.501 7.686 8.926 1.00 0.00 C flip ATOM 1196 CE1 HIS B 396 3.834 8.789 7.667 1.00 0.00 C flip ATOM 1197 NE2 HIS B 396 2.675 8.832 8.292 1.00 0.00 N flip ATOM 0 H HIS B 396 6.455 6.309 8.512 1.00 0.00 H new ATOM 0 HA HIS B 396 5.183 4.157 10.002 1.00 0.00 H new ATOM 0 HB2 HIS B 396 3.018 4.837 8.749 1.00 0.00 H new ATOM 0 HB3 HIS B 396 3.409 5.517 10.315 1.00 0.00 H new ATOM 0 HD2 HIS B 396 1.641 7.428 9.526 1.00 0.00 H new ATOM 0 HE1 HIS B 396 4.251 9.581 7.063 1.00 0.00 H new ATOM 0 HE2 HIS B 396 2.023 9.616 8.287 1.00 0.00 H new ATOM 1206 N PRO B 397 6.130 3.193 7.915 1.00 0.00 N ATOM 1207 CA PRO B 397 6.356 2.296 6.824 1.00 0.00 C ATOM 1208 C PRO B 397 5.239 1.286 6.759 1.00 0.00 C ATOM 1209 O PRO B 397 5.029 0.509 7.694 1.00 0.00 O ATOM 1210 CB PRO B 397 7.648 1.618 7.197 1.00 0.00 C ATOM 1211 CG PRO B 397 7.699 1.674 8.669 1.00 0.00 C ATOM 1212 CD PRO B 397 6.883 2.832 9.101 1.00 0.00 C ATOM 0 HA PRO B 397 6.397 2.791 5.854 1.00 0.00 H new ATOM 0 HB2 PRO B 397 7.670 0.588 6.841 1.00 0.00 H new ATOM 0 HB3 PRO B 397 8.503 2.127 6.753 1.00 0.00 H new ATOM 0 HG2 PRO B 397 7.313 0.751 9.101 1.00 0.00 H new ATOM 0 HG3 PRO B 397 8.728 1.781 9.013 1.00 0.00 H new ATOM 0 HD2 PRO B 397 6.223 2.569 9.928 1.00 0.00 H new ATOM 0 HD3 PRO B 397 7.509 3.656 9.442 1.00 0.00 H new ATOM 1220 N MET B 398 4.518 1.290 5.682 1.00 0.00 N ATOM 1221 CA MET B 398 3.445 0.354 5.534 1.00 0.00 C ATOM 1222 C MET B 398 3.937 -0.838 4.757 1.00 0.00 C ATOM 1223 O MET B 398 4.886 -0.736 3.978 1.00 0.00 O ATOM 1224 CB MET B 398 2.270 1.008 4.872 1.00 0.00 C ATOM 1225 CG MET B 398 1.060 0.122 4.754 1.00 0.00 C ATOM 1226 SD MET B 398 0.788 -0.925 6.200 1.00 0.00 S ATOM 1227 CE MET B 398 0.880 0.312 7.478 1.00 0.00 C ATOM 0 H MET B 398 4.650 1.926 4.896 1.00 0.00 H new ATOM 0 HA MET B 398 3.110 0.012 6.513 1.00 0.00 H new ATOM 0 HB2 MET B 398 2.000 1.901 5.436 1.00 0.00 H new ATOM 0 HB3 MET B 398 2.565 1.337 3.876 1.00 0.00 H new ATOM 0 HG2 MET B 398 0.179 0.744 4.595 1.00 0.00 H new ATOM 0 HG3 MET B 398 1.167 -0.510 3.873 1.00 0.00 H new ATOM 0 HE1 MET B 398 0.222 0.034 8.301 1.00 0.00 H new ATOM 0 HE2 MET B 398 1.905 0.384 7.842 1.00 0.00 H new ATOM 0 HE3 MET B 398 0.570 1.276 7.074 1.00 0.00 H new ATOM 1237 N ASP B 399 3.331 -1.964 4.995 1.00 0.00 N ATOM 1238 CA ASP B 399 3.672 -3.151 4.272 1.00 0.00 C ATOM 1239 C ASP B 399 2.400 -3.847 3.858 1.00 0.00 C ATOM 1240 O ASP B 399 1.483 -4.006 4.663 1.00 0.00 O ATOM 1241 CB ASP B 399 4.566 -4.076 5.113 1.00 0.00 C ATOM 1242 CG ASP B 399 3.897 -4.580 6.377 1.00 0.00 C ATOM 1243 OD1 ASP B 399 3.964 -3.884 7.414 1.00 0.00 O ATOM 1244 OD2 ASP B 399 3.310 -5.679 6.347 1.00 0.00 O ATOM 0 H ASP B 399 2.593 -2.084 5.689 1.00 0.00 H new ATOM 0 HA ASP B 399 4.244 -2.884 3.383 1.00 0.00 H new ATOM 0 HB2 ASP B 399 4.865 -4.930 4.505 1.00 0.00 H new ATOM 0 HB3 ASP B 399 5.477 -3.541 5.382 1.00 0.00 H new ATOM 1249 N MET B 400 2.368 -4.214 2.578 1.00 0.00 N ATOM 1250 CA MET B 400 1.264 -4.909 1.933 1.00 0.00 C ATOM 1251 C MET B 400 0.737 -6.048 2.802 1.00 0.00 C ATOM 1252 O MET B 400 -0.405 -6.452 2.662 1.00 0.00 O ATOM 1253 CB MET B 400 1.724 -5.467 0.566 1.00 0.00 C ATOM 1254 CG MET B 400 1.818 -4.465 -0.566 1.00 0.00 C ATOM 1255 SD MET B 400 2.632 -5.137 -2.001 1.00 0.00 S ATOM 1256 CE MET B 400 1.365 -6.270 -2.514 1.00 0.00 C ATOM 0 H MET B 400 3.142 -4.026 1.940 1.00 0.00 H new ATOM 0 HA MET B 400 0.455 -4.193 1.787 1.00 0.00 H new ATOM 0 HB2 MET B 400 2.702 -5.930 0.696 1.00 0.00 H new ATOM 0 HB3 MET B 400 1.034 -6.257 0.268 1.00 0.00 H new ATOM 0 HG2 MET B 400 0.816 -4.136 -0.841 1.00 0.00 H new ATOM 0 HG3 MET B 400 2.360 -3.584 -0.223 1.00 0.00 H new ATOM 0 HE1 MET B 400 1.580 -6.624 -3.522 1.00 0.00 H new ATOM 0 HE2 MET B 400 1.337 -7.118 -1.830 1.00 0.00 H new ATOM 0 HE3 MET B 400 0.399 -5.764 -2.505 1.00 0.00 H new ATOM 1266 N SER B 401 1.558 -6.552 3.709 1.00 0.00 N ATOM 1267 CA SER B 401 1.156 -7.667 4.535 1.00 0.00 C ATOM 1268 C SER B 401 0.320 -7.210 5.740 1.00 0.00 C ATOM 1269 O SER B 401 -0.639 -7.886 6.087 1.00 0.00 O ATOM 1270 CB SER B 401 2.381 -8.482 4.989 1.00 0.00 C ATOM 1271 OG SER B 401 2.013 -9.780 5.431 1.00 0.00 O ATOM 0 H SER B 401 2.501 -6.206 3.888 1.00 0.00 H new ATOM 0 HA SER B 401 0.522 -8.313 3.928 1.00 0.00 H new ATOM 0 HB2 SER B 401 3.089 -8.565 4.164 1.00 0.00 H new ATOM 0 HB3 SER B 401 2.891 -7.954 5.795 1.00 0.00 H new ATOM 0 HG SER B 401 2.814 -10.270 5.710 1.00 0.00 H new ATOM 1277 N THR B 402 0.660 -6.083 6.383 1.00 0.00 N ATOM 1278 CA THR B 402 -0.183 -5.572 7.472 1.00 0.00 C ATOM 1279 C THR B 402 -1.507 -5.128 6.934 1.00 0.00 C ATOM 1280 O THR B 402 -2.532 -5.598 7.378 1.00 0.00 O ATOM 1281 CB THR B 402 0.376 -4.364 8.224 1.00 0.00 C ATOM 1282 OG1 THR B 402 1.690 -4.656 8.724 1.00 0.00 O ATOM 1283 CG2 THR B 402 -0.561 -3.998 9.391 1.00 0.00 C ATOM 0 H THR B 402 1.487 -5.523 6.176 1.00 0.00 H new ATOM 0 HA THR B 402 -0.245 -6.412 8.164 1.00 0.00 H new ATOM 0 HB THR B 402 0.442 -3.519 7.538 1.00 0.00 H new ATOM 0 HG1 THR B 402 2.356 -4.164 8.200 1.00 0.00 H new ATOM 0 HG21 THR B 402 -0.159 -3.137 9.924 1.00 0.00 H new ATOM 0 HG22 THR B 402 -1.549 -3.754 9.001 1.00 0.00 H new ATOM 0 HG23 THR B 402 -0.639 -4.844 10.074 1.00 0.00 H new ATOM 1291 N ILE B 403 -1.475 -4.201 5.989 1.00 0.00 N ATOM 1292 CA ILE B 403 -2.667 -3.696 5.378 1.00 0.00 C ATOM 1293 C ILE B 403 -3.580 -4.832 4.977 1.00 0.00 C ATOM 1294 O ILE B 403 -4.788 -4.793 5.191 1.00 0.00 O ATOM 1295 CB ILE B 403 -2.259 -2.837 4.188 1.00 0.00 C ATOM 1296 CG1 ILE B 403 -3.321 -2.739 3.161 1.00 0.00 C ATOM 1297 CG2 ILE B 403 -1.007 -3.370 3.516 1.00 0.00 C ATOM 1298 CD1 ILE B 403 -2.768 -2.003 1.997 1.00 0.00 C ATOM 0 H ILE B 403 -0.614 -3.785 5.633 1.00 0.00 H new ATOM 0 HA ILE B 403 -3.230 -3.083 6.081 1.00 0.00 H new ATOM 0 HB ILE B 403 -2.072 -1.846 4.603 1.00 0.00 H new ATOM 0 HG12 ILE B 403 -3.653 -3.733 2.861 1.00 0.00 H new ATOM 0 HG13 ILE B 403 -4.192 -2.220 3.562 1.00 0.00 H new ATOM 0 HG21 ILE B 403 -0.747 -2.731 2.672 1.00 0.00 H new ATOM 0 HG22 ILE B 403 -0.185 -3.378 4.232 1.00 0.00 H new ATOM 0 HG23 ILE B 403 -1.188 -4.384 3.161 1.00 0.00 H new ATOM 0 HD11 ILE B 403 -3.532 -1.917 1.224 1.00 0.00 H new ATOM 0 HD12 ILE B 403 -2.456 -1.007 2.311 1.00 0.00 H new ATOM 0 HD13 ILE B 403 -1.909 -2.544 1.599 1.00 0.00 H new ATOM 1310 N LYS B 404 -2.974 -5.869 4.462 1.00 0.00 N ATOM 1311 CA LYS B 404 -3.662 -7.085 4.167 1.00 0.00 C ATOM 1312 C LYS B 404 -4.141 -7.778 5.430 1.00 0.00 C ATOM 1313 O LYS B 404 -5.278 -8.185 5.533 1.00 0.00 O ATOM 1314 CB LYS B 404 -2.682 -7.956 3.478 1.00 0.00 C ATOM 1315 CG LYS B 404 -2.899 -9.429 3.625 1.00 0.00 C ATOM 1316 CD LYS B 404 -1.759 -10.094 2.957 1.00 0.00 C ATOM 1317 CE LYS B 404 -0.710 -10.458 3.974 1.00 0.00 C ATOM 1318 NZ LYS B 404 -1.130 -11.579 4.857 1.00 0.00 N ATOM 0 H LYS B 404 -1.980 -5.887 4.236 1.00 0.00 H new ATOM 0 HA LYS B 404 -4.542 -6.880 3.558 1.00 0.00 H new ATOM 0 HB2 LYS B 404 -2.692 -7.711 2.416 1.00 0.00 H new ATOM 0 HB3 LYS B 404 -1.686 -7.716 3.851 1.00 0.00 H new ATOM 0 HG2 LYS B 404 -2.949 -9.710 4.677 1.00 0.00 H new ATOM 0 HG3 LYS B 404 -3.843 -9.729 3.170 1.00 0.00 H new ATOM 0 HD2 LYS B 404 -2.102 -10.990 2.439 1.00 0.00 H new ATOM 0 HD3 LYS B 404 -1.333 -9.433 2.202 1.00 0.00 H new ATOM 0 HE2 LYS B 404 0.210 -10.733 3.458 1.00 0.00 H new ATOM 0 HE3 LYS B 404 -0.484 -9.584 4.585 1.00 0.00 H new ATOM 0 HZ1 LYS B 404 -0.336 -11.855 5.469 1.00 0.00 H new ATOM 0 HZ2 LYS B 404 -1.931 -11.275 5.446 1.00 0.00 H new ATOM 0 HZ3 LYS B 404 -1.417 -12.391 4.274 1.00 0.00 H new ATOM 1332 N SER B 405 -3.220 -7.954 6.352 1.00 0.00 N ATOM 1333 CA SER B 405 -3.501 -8.554 7.652 1.00 0.00 C ATOM 1334 C SER B 405 -4.694 -7.880 8.300 1.00 0.00 C ATOM 1335 O SER B 405 -5.495 -8.524 8.959 1.00 0.00 O ATOM 1336 CB SER B 405 -2.302 -8.388 8.586 1.00 0.00 C ATOM 1337 OG SER B 405 -2.156 -9.503 9.451 1.00 0.00 O ATOM 0 H SER B 405 -2.244 -7.685 6.226 1.00 0.00 H new ATOM 0 HA SER B 405 -3.709 -9.612 7.490 1.00 0.00 H new ATOM 0 HB2 SER B 405 -1.394 -8.264 7.995 1.00 0.00 H new ATOM 0 HB3 SER B 405 -2.424 -7.481 9.178 1.00 0.00 H new ATOM 0 HG SER B 405 -1.380 -9.366 10.033 1.00 0.00 H new ATOM 1343 N LYS B 406 -4.785 -6.573 8.116 1.00 0.00 N ATOM 1344 CA LYS B 406 -5.855 -5.792 8.688 1.00 0.00 C ATOM 1345 C LYS B 406 -7.139 -6.027 7.904 1.00 0.00 C ATOM 1346 O LYS B 406 -8.219 -6.030 8.472 1.00 0.00 O ATOM 1347 CB LYS B 406 -5.507 -4.329 8.666 1.00 0.00 C ATOM 1348 CG LYS B 406 -4.107 -4.040 9.129 1.00 0.00 C ATOM 1349 CD LYS B 406 -3.872 -4.318 10.587 1.00 0.00 C ATOM 1350 CE LYS B 406 -4.968 -3.738 11.440 1.00 0.00 C ATOM 1351 NZ LYS B 406 -4.721 -3.946 12.891 1.00 0.00 N ATOM 0 H LYS B 406 -4.118 -6.030 7.567 1.00 0.00 H new ATOM 0 HA LYS B 406 -6.000 -6.102 9.723 1.00 0.00 H new ATOM 0 HB2 LYS B 406 -5.632 -3.949 7.652 1.00 0.00 H new ATOM 0 HB3 LYS B 406 -6.210 -3.787 9.298 1.00 0.00 H new ATOM 0 HG2 LYS B 406 -3.411 -4.637 8.540 1.00 0.00 H new ATOM 0 HG3 LYS B 406 -3.879 -2.993 8.929 1.00 0.00 H new ATOM 0 HD2 LYS B 406 -3.814 -5.394 10.749 1.00 0.00 H new ATOM 0 HD3 LYS B 406 -2.913 -3.898 10.889 1.00 0.00 H new ATOM 0 HE2 LYS B 406 -5.057 -2.671 11.238 1.00 0.00 H new ATOM 0 HE3 LYS B 406 -5.919 -4.195 11.166 1.00 0.00 H new ATOM 0 HZ1 LYS B 406 -5.383 -3.363 13.443 1.00 0.00 H new ATOM 0 HZ2 LYS B 406 -4.863 -4.949 13.127 1.00 0.00 H new ATOM 0 HZ3 LYS B 406 -3.744 -3.672 13.120 1.00 0.00 H new ATOM 1365 N LEU B 407 -7.013 -6.169 6.578 1.00 0.00 N ATOM 1366 CA LEU B 407 -8.075 -6.722 5.754 1.00 0.00 C ATOM 1367 C LEU B 407 -8.543 -8.027 6.354 1.00 0.00 C ATOM 1368 O LEU B 407 -9.723 -8.233 6.630 1.00 0.00 O ATOM 1369 CB LEU B 407 -7.553 -7.052 4.352 1.00 0.00 C ATOM 1370 CG LEU B 407 -6.899 -5.923 3.581 1.00 0.00 C ATOM 1371 CD1 LEU B 407 -6.822 -6.278 2.133 1.00 0.00 C ATOM 1372 CD2 LEU B 407 -7.741 -4.717 3.750 1.00 0.00 C ATOM 0 H LEU B 407 -6.177 -5.904 6.058 1.00 0.00 H new ATOM 0 HA LEU B 407 -8.877 -5.986 5.702 1.00 0.00 H new ATOM 0 HB2 LEU B 407 -6.832 -7.864 4.441 1.00 0.00 H new ATOM 0 HB3 LEU B 407 -8.387 -7.429 3.760 1.00 0.00 H new ATOM 0 HG LEU B 407 -5.889 -5.744 3.950 1.00 0.00 H new ATOM 0 HD11 LEU B 407 -6.351 -5.463 1.583 1.00 0.00 H new ATOM 0 HD12 LEU B 407 -6.232 -7.186 2.012 1.00 0.00 H new ATOM 0 HD13 LEU B 407 -7.827 -6.444 1.745 1.00 0.00 H new ATOM 0 HD21 LEU B 407 -7.297 -3.884 3.206 1.00 0.00 H new ATOM 0 HD22 LEU B 407 -8.740 -4.913 3.361 1.00 0.00 H new ATOM 0 HD23 LEU B 407 -7.807 -4.465 4.808 1.00 0.00 H new ATOM 1384 N GLU B 408 -7.568 -8.904 6.542 1.00 0.00 N ATOM 1385 CA GLU B 408 -7.775 -10.223 7.097 1.00 0.00 C ATOM 1386 C GLU B 408 -8.297 -10.112 8.522 1.00 0.00 C ATOM 1387 O GLU B 408 -8.858 -11.050 9.080 1.00 0.00 O ATOM 1388 CB GLU B 408 -6.451 -10.999 7.066 1.00 0.00 C ATOM 1389 CG GLU B 408 -5.821 -11.094 5.687 1.00 0.00 C ATOM 1390 CD GLU B 408 -4.608 -11.995 5.661 1.00 0.00 C ATOM 1391 OE1 GLU B 408 -3.508 -11.531 6.018 1.00 0.00 O ATOM 1392 OE2 GLU B 408 -4.750 -13.170 5.270 1.00 0.00 O ATOM 0 H GLU B 408 -6.595 -8.710 6.307 1.00 0.00 H new ATOM 0 HA GLU B 408 -8.515 -10.759 6.502 1.00 0.00 H new ATOM 0 HB2 GLU B 408 -5.745 -10.520 7.744 1.00 0.00 H new ATOM 0 HB3 GLU B 408 -6.623 -12.006 7.445 1.00 0.00 H new ATOM 0 HG2 GLU B 408 -6.561 -11.467 4.979 1.00 0.00 H new ATOM 0 HG3 GLU B 408 -5.535 -10.097 5.353 1.00 0.00 H new ATOM 1399 N ALA B 409 -8.120 -8.930 9.073 1.00 0.00 N ATOM 1400 CA ALA B 409 -8.529 -8.623 10.426 1.00 0.00 C ATOM 1401 C ALA B 409 -9.859 -7.908 10.445 1.00 0.00 C ATOM 1402 O ALA B 409 -10.478 -7.757 11.499 1.00 0.00 O ATOM 1403 CB ALA B 409 -7.445 -7.802 11.131 1.00 0.00 C ATOM 0 H ALA B 409 -7.683 -8.146 8.588 1.00 0.00 H new ATOM 0 HA ALA B 409 -8.658 -9.559 10.969 1.00 0.00 H new ATOM 0 HB1 ALA B 409 -7.764 -7.577 12.149 1.00 0.00 H new ATOM 0 HB2 ALA B 409 -6.517 -8.373 11.159 1.00 0.00 H new ATOM 0 HB3 ALA B 409 -7.282 -6.871 10.587 1.00 0.00 H new ATOM 1409 N ARG B 410 -10.296 -7.482 9.259 1.00 0.00 N ATOM 1410 CA ARG B 410 -11.505 -6.684 9.110 1.00 0.00 C ATOM 1411 C ARG B 410 -11.374 -5.420 9.944 1.00 0.00 C ATOM 1412 O ARG B 410 -12.351 -4.760 10.302 1.00 0.00 O ATOM 1413 CB ARG B 410 -12.738 -7.499 9.517 1.00 0.00 C ATOM 1414 CG ARG B 410 -13.206 -8.503 8.473 1.00 0.00 C ATOM 1415 CD ARG B 410 -12.152 -9.559 8.172 1.00 0.00 C ATOM 1416 NE ARG B 410 -12.666 -10.618 7.298 1.00 0.00 N ATOM 1417 CZ ARG B 410 -11.995 -11.145 6.277 1.00 0.00 C ATOM 1418 NH1 ARG B 410 -10.837 -10.629 5.895 1.00 0.00 N ATOM 1419 NH2 ARG B 410 -12.504 -12.172 5.612 1.00 0.00 N ATOM 0 H ARG B 410 -9.820 -7.682 8.379 1.00 0.00 H new ATOM 0 HA ARG B 410 -11.633 -6.401 8.065 1.00 0.00 H new ATOM 0 HB2 ARG B 410 -12.516 -8.032 10.441 1.00 0.00 H new ATOM 0 HB3 ARG B 410 -13.556 -6.812 9.734 1.00 0.00 H new ATOM 0 HG2 ARG B 410 -14.116 -8.991 8.824 1.00 0.00 H new ATOM 0 HG3 ARG B 410 -13.461 -7.975 7.554 1.00 0.00 H new ATOM 0 HD2 ARG B 410 -11.291 -9.086 7.700 1.00 0.00 H new ATOM 0 HD3 ARG B 410 -11.803 -9.998 9.106 1.00 0.00 H new ATOM 0 HE ARG B 410 -13.603 -10.975 7.486 1.00 0.00 H new ATOM 0 HH11 ARG B 410 -10.452 -9.821 6.385 1.00 0.00 H new ATOM 0 HH12 ARG B 410 -10.329 -11.040 5.111 1.00 0.00 H new ATOM 0 HH21 ARG B 410 -13.409 -12.557 5.883 1.00 0.00 H new ATOM 0 HH22 ARG B 410 -11.991 -12.577 4.829 1.00 0.00 H new ATOM 1433 N GLU B 411 -10.124 -5.126 10.245 1.00 0.00 N ATOM 1434 CA GLU B 411 -9.710 -3.922 10.911 1.00 0.00 C ATOM 1435 C GLU B 411 -9.998 -2.739 10.015 1.00 0.00 C ATOM 1436 O GLU B 411 -10.318 -1.639 10.467 1.00 0.00 O ATOM 1437 CB GLU B 411 -8.226 -4.052 11.187 1.00 0.00 C ATOM 1438 CG GLU B 411 -7.909 -4.789 12.473 1.00 0.00 C ATOM 1439 CD GLU B 411 -8.554 -4.163 13.692 1.00 0.00 C ATOM 1440 OE1 GLU B 411 -8.056 -3.124 14.166 1.00 0.00 O ATOM 1441 OE2 GLU B 411 -9.565 -4.702 14.182 1.00 0.00 O ATOM 0 H GLU B 411 -9.346 -5.747 10.021 1.00 0.00 H new ATOM 0 HA GLU B 411 -10.247 -3.771 11.848 1.00 0.00 H new ATOM 0 HB2 GLU B 411 -7.755 -4.573 10.354 1.00 0.00 H new ATOM 0 HB3 GLU B 411 -7.785 -3.056 11.231 1.00 0.00 H new ATOM 0 HG2 GLU B 411 -8.242 -5.823 12.384 1.00 0.00 H new ATOM 0 HG3 GLU B 411 -6.828 -4.814 12.614 1.00 0.00 H new ATOM 1448 N TYR B 412 -9.873 -3.002 8.730 1.00 0.00 N ATOM 1449 CA TYR B 412 -10.243 -2.056 7.709 1.00 0.00 C ATOM 1450 C TYR B 412 -11.728 -2.085 7.509 1.00 0.00 C ATOM 1451 O TYR B 412 -12.322 -3.139 7.320 1.00 0.00 O ATOM 1452 CB TYR B 412 -9.435 -2.302 6.438 1.00 0.00 C ATOM 1453 CG TYR B 412 -7.975 -2.001 6.646 1.00 0.00 C ATOM 1454 CD1 TYR B 412 -7.536 -1.459 7.840 1.00 0.00 C ATOM 1455 CD2 TYR B 412 -7.038 -2.287 5.679 1.00 0.00 C ATOM 1456 CE1 TYR B 412 -6.197 -1.219 8.061 1.00 0.00 C ATOM 1457 CE2 TYR B 412 -5.702 -2.040 5.888 1.00 0.00 C ATOM 1458 CZ TYR B 412 -5.289 -1.513 7.082 1.00 0.00 C ATOM 1459 OH TYR B 412 -3.960 -1.287 7.306 1.00 0.00 O ATOM 0 H TYR B 412 -9.510 -3.884 8.368 1.00 0.00 H new ATOM 0 HA TYR B 412 -9.995 -1.041 8.021 1.00 0.00 H new ATOM 0 HB2 TYR B 412 -9.553 -3.340 6.126 1.00 0.00 H new ATOM 0 HB3 TYR B 412 -9.825 -1.680 5.632 1.00 0.00 H new ATOM 0 HD1 TYR B 412 -8.253 -1.220 8.611 1.00 0.00 H new ATOM 0 HD2 TYR B 412 -7.358 -2.713 4.740 1.00 0.00 H new ATOM 0 HE1 TYR B 412 -5.867 -0.802 9.001 1.00 0.00 H new ATOM 0 HE2 TYR B 412 -4.982 -2.261 5.114 1.00 0.00 H new ATOM 0 HH TYR B 412 -3.848 -0.434 7.775 1.00 0.00 H new ATOM 1469 N ARG B 413 -12.328 -0.910 7.678 1.00 0.00 N ATOM 1470 CA ARG B 413 -13.758 -0.759 7.527 1.00 0.00 C ATOM 1471 C ARG B 413 -14.123 -1.060 6.121 1.00 0.00 C ATOM 1472 O ARG B 413 -15.102 -1.736 5.835 1.00 0.00 O ATOM 1473 CB ARG B 413 -14.244 0.647 7.822 1.00 0.00 C ATOM 1474 CG ARG B 413 -13.892 1.146 9.192 1.00 0.00 C ATOM 1475 CD ARG B 413 -12.631 1.964 9.174 1.00 0.00 C ATOM 1476 NE ARG B 413 -12.638 2.979 8.114 1.00 0.00 N ATOM 1477 CZ ARG B 413 -11.953 4.122 8.163 1.00 0.00 C ATOM 1478 NH1 ARG B 413 -11.250 4.438 9.242 1.00 0.00 N ATOM 1479 NH2 ARG B 413 -11.987 4.957 7.135 1.00 0.00 N ATOM 0 H ARG B 413 -11.837 -0.050 7.921 1.00 0.00 H new ATOM 0 HA ARG B 413 -14.222 -1.440 8.240 1.00 0.00 H new ATOM 0 HB2 ARG B 413 -13.824 1.327 7.081 1.00 0.00 H new ATOM 0 HB3 ARG B 413 -15.327 0.677 7.704 1.00 0.00 H new ATOM 0 HG2 ARG B 413 -14.712 1.749 9.583 1.00 0.00 H new ATOM 0 HG3 ARG B 413 -13.768 0.300 9.868 1.00 0.00 H new ATOM 0 HD2 ARG B 413 -12.504 2.452 10.140 1.00 0.00 H new ATOM 0 HD3 ARG B 413 -11.775 1.304 9.036 1.00 0.00 H new ATOM 0 HE ARG B 413 -13.204 2.798 7.285 1.00 0.00 H new ATOM 0 HH11 ARG B 413 -11.231 3.805 10.042 1.00 0.00 H new ATOM 0 HH12 ARG B 413 -10.728 5.314 9.272 1.00 0.00 H new ATOM 0 HH21 ARG B 413 -12.537 4.725 6.308 1.00 0.00 H new ATOM 0 HH22 ARG B 413 -11.464 5.832 7.171 1.00 0.00 H new ATOM 1493 N ASP B 414 -13.272 -0.560 5.261 1.00 0.00 N ATOM 1494 CA ASP B 414 -13.496 -0.547 3.847 1.00 0.00 C ATOM 1495 C ASP B 414 -12.169 -0.445 3.166 1.00 0.00 C ATOM 1496 O ASP B 414 -11.118 -0.419 3.809 1.00 0.00 O ATOM 1497 CB ASP B 414 -14.383 0.638 3.461 1.00 0.00 C ATOM 1498 CG ASP B 414 -13.641 1.956 3.479 1.00 0.00 C ATOM 1499 OD1 ASP B 414 -13.350 2.473 4.581 1.00 0.00 O ATOM 1500 OD2 ASP B 414 -13.337 2.472 2.391 1.00 0.00 O ATOM 0 H ASP B 414 -12.384 -0.142 5.537 1.00 0.00 H new ATOM 0 HA ASP B 414 -14.005 -1.461 3.540 1.00 0.00 H new ATOM 0 HB2 ASP B 414 -14.792 0.470 2.465 1.00 0.00 H new ATOM 0 HB3 ASP B 414 -15.228 0.692 4.148 1.00 0.00 H new ATOM 1505 N ALA B 415 -12.228 -0.360 1.875 1.00 0.00 N ATOM 1506 CA ALA B 415 -11.058 -0.428 1.062 1.00 0.00 C ATOM 1507 C ALA B 415 -10.246 0.855 1.150 1.00 0.00 C ATOM 1508 O ALA B 415 -9.105 0.896 0.723 1.00 0.00 O ATOM 1509 CB ALA B 415 -11.485 -0.669 -0.348 1.00 0.00 C ATOM 0 H ALA B 415 -13.096 -0.241 1.353 1.00 0.00 H new ATOM 0 HA ALA B 415 -10.421 -1.240 1.414 1.00 0.00 H new ATOM 0 HB1 ALA B 415 -10.606 -0.725 -0.990 1.00 0.00 H new ATOM 0 HB2 ALA B 415 -12.037 -1.607 -0.406 1.00 0.00 H new ATOM 0 HB3 ALA B 415 -12.125 0.149 -0.679 1.00 0.00 H new ATOM 1515 N GLN B 416 -10.822 1.909 1.690 1.00 0.00 N ATOM 1516 CA GLN B 416 -10.096 3.155 1.797 1.00 0.00 C ATOM 1517 C GLN B 416 -9.277 3.179 3.080 1.00 0.00 C ATOM 1518 O GLN B 416 -8.288 3.893 3.166 1.00 0.00 O ATOM 1519 CB GLN B 416 -11.040 4.343 1.697 1.00 0.00 C ATOM 1520 CG GLN B 416 -11.580 4.525 0.300 1.00 0.00 C ATOM 1521 CD GLN B 416 -12.922 5.221 0.268 1.00 0.00 C ATOM 1522 OE1 GLN B 416 -13.002 6.445 0.153 1.00 0.00 O ATOM 1523 NE2 GLN B 416 -13.985 4.448 0.402 1.00 0.00 N ATOM 0 H GLN B 416 -11.774 1.929 2.056 1.00 0.00 H new ATOM 0 HA GLN B 416 -9.401 3.232 0.961 1.00 0.00 H new ATOM 0 HB2 GLN B 416 -11.870 4.205 2.390 1.00 0.00 H new ATOM 0 HB3 GLN B 416 -10.516 5.248 2.003 1.00 0.00 H new ATOM 0 HG2 GLN B 416 -10.865 5.101 -0.287 1.00 0.00 H new ATOM 0 HG3 GLN B 416 -11.672 3.549 -0.177 1.00 0.00 H new ATOM 0 HE21 GLN B 416 -13.873 3.438 0.494 1.00 0.00 H new ATOM 0 HE22 GLN B 416 -14.918 4.861 0.413 1.00 0.00 H new ATOM 1532 N GLU B 417 -9.702 2.403 4.083 1.00 0.00 N ATOM 1533 CA GLU B 417 -8.788 1.977 5.145 1.00 0.00 C ATOM 1534 C GLU B 417 -7.624 1.277 4.481 1.00 0.00 C ATOM 1535 O GLU B 417 -6.448 1.550 4.741 1.00 0.00 O ATOM 1536 CB GLU B 417 -9.463 0.968 6.074 1.00 0.00 C ATOM 1537 CG GLU B 417 -9.817 1.482 7.456 1.00 0.00 C ATOM 1538 CD GLU B 417 -8.653 2.131 8.177 1.00 0.00 C ATOM 1539 OE1 GLU B 417 -8.296 3.279 7.842 1.00 0.00 O ATOM 1540 OE2 GLU B 417 -8.096 1.494 9.092 1.00 0.00 O ATOM 0 H GLU B 417 -10.658 2.062 4.181 1.00 0.00 H new ATOM 0 HA GLU B 417 -8.479 2.846 5.726 1.00 0.00 H new ATOM 0 HB2 GLU B 417 -10.375 0.613 5.594 1.00 0.00 H new ATOM 0 HB3 GLU B 417 -8.805 0.106 6.184 1.00 0.00 H new ATOM 0 HG2 GLU B 417 -10.629 2.205 7.369 1.00 0.00 H new ATOM 0 HG3 GLU B 417 -10.191 0.654 8.058 1.00 0.00 H new ATOM 1547 N PHE B 418 -8.006 0.384 3.582 1.00 0.00 N ATOM 1548 CA PHE B 418 -7.083 -0.434 2.854 1.00 0.00 C ATOM 1549 C PHE B 418 -6.047 0.394 2.107 1.00 0.00 C ATOM 1550 O PHE B 418 -4.852 0.332 2.391 1.00 0.00 O ATOM 1551 CB PHE B 418 -7.857 -1.326 1.893 1.00 0.00 C ATOM 1552 CG PHE B 418 -6.987 -1.951 0.869 1.00 0.00 C ATOM 1553 CD1 PHE B 418 -6.174 -2.987 1.224 1.00 0.00 C ATOM 1554 CD2 PHE B 418 -6.970 -1.494 -0.438 1.00 0.00 C ATOM 1555 CE1 PHE B 418 -5.356 -3.570 0.318 1.00 0.00 C ATOM 1556 CE2 PHE B 418 -6.146 -2.077 -1.369 1.00 0.00 C ATOM 1557 CZ PHE B 418 -5.332 -3.122 -0.990 1.00 0.00 C ATOM 0 H PHE B 418 -8.983 0.214 3.343 1.00 0.00 H new ATOM 0 HA PHE B 418 -6.534 -1.049 3.567 1.00 0.00 H new ATOM 0 HB2 PHE B 418 -8.366 -2.107 2.458 1.00 0.00 H new ATOM 0 HB3 PHE B 418 -8.629 -0.737 1.398 1.00 0.00 H new ATOM 0 HD1 PHE B 418 -6.183 -3.347 2.242 1.00 0.00 H new ATOM 0 HD2 PHE B 418 -7.609 -0.673 -0.727 1.00 0.00 H new ATOM 0 HE1 PHE B 418 -4.719 -4.389 0.618 1.00 0.00 H new ATOM 0 HE2 PHE B 418 -6.136 -1.720 -2.388 1.00 0.00 H new ATOM 0 HZ PHE B 418 -4.678 -3.589 -1.711 1.00 0.00 H new ATOM 1567 N GLY B 419 -6.520 1.174 1.161 1.00 0.00 N ATOM 1568 CA GLY B 419 -5.637 1.938 0.316 1.00 0.00 C ATOM 1569 C GLY B 419 -4.985 3.077 1.033 1.00 0.00 C ATOM 1570 O GLY B 419 -4.028 3.667 0.532 1.00 0.00 O ATOM 0 H GLY B 419 -7.513 1.294 0.959 1.00 0.00 H new ATOM 0 HA2 GLY B 419 -4.867 1.279 -0.085 1.00 0.00 H new ATOM 0 HA3 GLY B 419 -6.200 2.325 -0.533 1.00 0.00 H new ATOM 1574 N ALA B 420 -5.491 3.382 2.210 1.00 0.00 N ATOM 1575 CA ALA B 420 -4.863 4.352 3.059 1.00 0.00 C ATOM 1576 C ALA B 420 -3.474 3.863 3.417 1.00 0.00 C ATOM 1577 O ALA B 420 -2.503 4.619 3.390 1.00 0.00 O ATOM 1578 CB ALA B 420 -5.699 4.573 4.306 1.00 0.00 C ATOM 0 H ALA B 420 -6.339 2.966 2.595 1.00 0.00 H new ATOM 0 HA ALA B 420 -4.782 5.306 2.538 1.00 0.00 H new ATOM 0 HB1 ALA B 420 -5.213 5.311 4.944 1.00 0.00 H new ATOM 0 HB2 ALA B 420 -6.688 4.933 4.022 1.00 0.00 H new ATOM 0 HB3 ALA B 420 -5.798 3.633 4.849 1.00 0.00 H new ATOM 1584 N ASP B 421 -3.394 2.578 3.715 1.00 0.00 N ATOM 1585 CA ASP B 421 -2.137 1.937 4.028 1.00 0.00 C ATOM 1586 C ASP B 421 -1.343 1.597 2.763 1.00 0.00 C ATOM 1587 O ASP B 421 -0.122 1.696 2.769 1.00 0.00 O ATOM 1588 CB ASP B 421 -2.402 0.726 4.897 1.00 0.00 C ATOM 1589 CG ASP B 421 -2.717 1.156 6.318 1.00 0.00 C ATOM 1590 OD1 ASP B 421 -1.780 1.430 7.090 1.00 0.00 O ATOM 1591 OD2 ASP B 421 -3.906 1.249 6.666 1.00 0.00 O ATOM 0 H ASP B 421 -4.200 1.953 3.746 1.00 0.00 H new ATOM 0 HA ASP B 421 -1.508 2.629 4.588 1.00 0.00 H new ATOM 0 HB2 ASP B 421 -3.235 0.153 4.490 1.00 0.00 H new ATOM 0 HB3 ASP B 421 -1.532 0.070 4.893 1.00 0.00 H new ATOM 1596 N VAL B 422 -1.998 1.217 1.664 1.00 0.00 N ATOM 1597 CA VAL B 422 -1.289 1.103 0.404 1.00 0.00 C ATOM 1598 C VAL B 422 -0.538 2.395 0.104 1.00 0.00 C ATOM 1599 O VAL B 422 0.656 2.383 -0.171 1.00 0.00 O ATOM 1600 CB VAL B 422 -2.219 0.805 -0.776 1.00 0.00 C ATOM 1601 CG1 VAL B 422 -1.384 0.460 -1.960 1.00 0.00 C ATOM 1602 CG2 VAL B 422 -3.131 -0.354 -0.493 1.00 0.00 C ATOM 0 H VAL B 422 -2.992 0.990 1.626 1.00 0.00 H new ATOM 0 HA VAL B 422 -0.599 0.267 0.516 1.00 0.00 H new ATOM 0 HB VAL B 422 -2.831 1.689 -0.955 1.00 0.00 H new ATOM 0 HG11 VAL B 422 -2.030 0.244 -2.811 1.00 0.00 H new ATOM 0 HG12 VAL B 422 -0.732 1.299 -2.203 1.00 0.00 H new ATOM 0 HG13 VAL B 422 -0.777 -0.417 -1.734 1.00 0.00 H new ATOM 0 HG21 VAL B 422 -3.773 -0.531 -1.356 1.00 0.00 H new ATOM 0 HG22 VAL B 422 -2.536 -1.245 -0.295 1.00 0.00 H new ATOM 0 HG23 VAL B 422 -3.747 -0.128 0.377 1.00 0.00 H new ATOM 1612 N ARG B 423 -1.242 3.512 0.179 1.00 0.00 N ATOM 1613 CA ARG B 423 -0.618 4.811 -0.034 1.00 0.00 C ATOM 1614 C ARG B 423 0.394 5.124 1.067 1.00 0.00 C ATOM 1615 O ARG B 423 1.305 5.905 0.856 1.00 0.00 O ATOM 1616 CB ARG B 423 -1.665 5.921 -0.123 1.00 0.00 C ATOM 1617 CG ARG B 423 -2.538 5.845 -1.368 1.00 0.00 C ATOM 1618 CD ARG B 423 -1.707 5.837 -2.648 1.00 0.00 C ATOM 1619 NE ARG B 423 -0.753 6.948 -2.707 1.00 0.00 N ATOM 1620 CZ ARG B 423 -0.217 7.420 -3.836 1.00 0.00 C ATOM 1621 NH1 ARG B 423 -0.574 6.917 -5.013 1.00 0.00 N ATOM 1622 NH2 ARG B 423 0.671 8.402 -3.785 1.00 0.00 N ATOM 0 H ARG B 423 -2.240 3.548 0.384 1.00 0.00 H new ATOM 0 HA ARG B 423 -0.088 4.765 -0.985 1.00 0.00 H new ATOM 0 HB2 ARG B 423 -2.303 5.877 0.760 1.00 0.00 H new ATOM 0 HB3 ARG B 423 -1.160 6.887 -0.104 1.00 0.00 H new ATOM 0 HG2 ARG B 423 -3.150 4.944 -1.327 1.00 0.00 H new ATOM 0 HG3 ARG B 423 -3.221 6.694 -1.384 1.00 0.00 H new ATOM 0 HD2 ARG B 423 -1.166 4.894 -2.719 1.00 0.00 H new ATOM 0 HD3 ARG B 423 -2.373 5.888 -3.509 1.00 0.00 H new ATOM 0 HE ARG B 423 -0.481 7.390 -1.829 1.00 0.00 H new ATOM 0 HH11 ARG B 423 -1.262 6.165 -5.059 1.00 0.00 H new ATOM 0 HH12 ARG B 423 -0.160 7.283 -5.871 1.00 0.00 H new ATOM 0 HH21 ARG B 423 0.944 8.796 -2.885 1.00 0.00 H new ATOM 0 HH22 ARG B 423 1.081 8.764 -4.646 1.00 0.00 H new ATOM 1636 N LEU B 424 0.225 4.506 2.230 1.00 0.00 N ATOM 1637 CA LEU B 424 1.177 4.640 3.329 1.00 0.00 C ATOM 1638 C LEU B 424 2.518 4.010 2.930 1.00 0.00 C ATOM 1639 O LEU B 424 3.559 4.655 3.045 1.00 0.00 O ATOM 1640 CB LEU B 424 0.605 3.957 4.581 1.00 0.00 C ATOM 1641 CG LEU B 424 0.829 4.619 5.949 1.00 0.00 C ATOM 1642 CD1 LEU B 424 1.436 3.656 6.911 1.00 0.00 C ATOM 1643 CD2 LEU B 424 1.696 5.846 5.869 1.00 0.00 C ATOM 0 H LEU B 424 -0.570 3.902 2.438 1.00 0.00 H new ATOM 0 HA LEU B 424 1.344 5.694 3.549 1.00 0.00 H new ATOM 0 HB2 LEU B 424 -0.470 3.850 4.437 1.00 0.00 H new ATOM 0 HB3 LEU B 424 1.022 2.951 4.628 1.00 0.00 H new ATOM 0 HG LEU B 424 -0.156 4.927 6.300 1.00 0.00 H new ATOM 0 HD11 LEU B 424 1.585 4.147 7.872 1.00 0.00 H new ATOM 0 HD12 LEU B 424 0.771 2.802 7.039 1.00 0.00 H new ATOM 0 HD13 LEU B 424 2.396 3.313 6.526 1.00 0.00 H new ATOM 0 HD21 LEU B 424 1.819 6.270 6.865 1.00 0.00 H new ATOM 0 HD22 LEU B 424 2.672 5.576 5.467 1.00 0.00 H new ATOM 0 HD23 LEU B 424 1.226 6.582 5.217 1.00 0.00 H new ATOM 1655 N MET B 425 2.475 2.762 2.428 1.00 0.00 N ATOM 1656 CA MET B 425 3.696 2.041 2.018 1.00 0.00 C ATOM 1657 C MET B 425 4.300 2.679 0.800 1.00 0.00 C ATOM 1658 O MET B 425 5.517 2.722 0.637 1.00 0.00 O ATOM 1659 CB MET B 425 3.445 0.537 1.759 1.00 0.00 C ATOM 1660 CG MET B 425 2.447 0.225 0.697 1.00 0.00 C ATOM 1661 SD MET B 425 1.439 -1.191 1.118 1.00 0.00 S ATOM 1662 CE MET B 425 0.814 -1.517 -0.504 1.00 0.00 C ATOM 0 H MET B 425 1.613 2.233 2.297 1.00 0.00 H new ATOM 0 HA MET B 425 4.395 2.111 2.852 1.00 0.00 H new ATOM 0 HB2 MET B 425 4.393 0.070 1.491 1.00 0.00 H new ATOM 0 HB3 MET B 425 3.114 0.076 2.690 1.00 0.00 H new ATOM 0 HG2 MET B 425 1.806 1.092 0.537 1.00 0.00 H new ATOM 0 HG3 MET B 425 2.965 0.034 -0.243 1.00 0.00 H new ATOM 0 HE1 MET B 425 -0.101 -2.104 -0.430 1.00 0.00 H new ATOM 0 HE2 MET B 425 0.601 -0.574 -1.008 1.00 0.00 H new ATOM 0 HE3 MET B 425 1.557 -2.074 -1.075 1.00 0.00 H new ATOM 1672 N PHE B 426 3.440 3.174 -0.049 1.00 0.00 N ATOM 1673 CA PHE B 426 3.878 3.925 -1.196 1.00 0.00 C ATOM 1674 C PHE B 426 4.536 5.232 -0.749 1.00 0.00 C ATOM 1675 O PHE B 426 5.635 5.568 -1.189 1.00 0.00 O ATOM 1676 CB PHE B 426 2.692 4.214 -2.097 1.00 0.00 C ATOM 1677 CG PHE B 426 2.101 3.008 -2.788 1.00 0.00 C ATOM 1678 CD1 PHE B 426 2.562 1.722 -2.527 1.00 0.00 C ATOM 1679 CD2 PHE B 426 1.066 3.168 -3.695 1.00 0.00 C ATOM 1680 CE1 PHE B 426 1.997 0.629 -3.154 1.00 0.00 C ATOM 1681 CE2 PHE B 426 0.505 2.074 -4.324 1.00 0.00 C ATOM 1682 CZ PHE B 426 0.976 0.806 -4.047 1.00 0.00 C ATOM 0 H PHE B 426 2.428 3.071 0.032 1.00 0.00 H new ATOM 0 HA PHE B 426 4.612 3.340 -1.750 1.00 0.00 H new ATOM 0 HB2 PHE B 426 1.912 4.691 -1.503 1.00 0.00 H new ATOM 0 HB3 PHE B 426 2.999 4.933 -2.856 1.00 0.00 H new ATOM 0 HD1 PHE B 426 3.371 1.577 -1.826 1.00 0.00 H new ATOM 0 HD2 PHE B 426 0.694 4.158 -3.912 1.00 0.00 H new ATOM 0 HE1 PHE B 426 2.361 -0.365 -2.939 1.00 0.00 H new ATOM 0 HE2 PHE B 426 -0.300 2.210 -5.031 1.00 0.00 H new ATOM 0 HZ PHE B 426 0.536 -0.050 -4.538 1.00 0.00 H new ATOM 1692 N SER B 427 3.865 5.950 0.148 1.00 0.00 N ATOM 1693 CA SER B 427 4.351 7.233 0.641 1.00 0.00 C ATOM 1694 C SER B 427 5.718 7.086 1.291 1.00 0.00 C ATOM 1695 O SER B 427 6.686 7.687 0.824 1.00 0.00 O ATOM 1696 CB SER B 427 3.357 7.840 1.635 1.00 0.00 C ATOM 1697 OG SER B 427 3.771 9.127 2.062 1.00 0.00 O ATOM 0 H SER B 427 2.974 5.660 0.551 1.00 0.00 H new ATOM 0 HA SER B 427 4.448 7.904 -0.213 1.00 0.00 H new ATOM 0 HB2 SER B 427 2.373 7.908 1.172 1.00 0.00 H new ATOM 0 HB3 SER B 427 3.258 7.183 2.499 1.00 0.00 H new ATOM 0 HG SER B 427 3.115 9.489 2.694 1.00 0.00 H new ATOM 1703 N ASN B 428 5.806 6.264 2.348 1.00 0.00 N ATOM 1704 CA ASN B 428 7.063 6.080 3.076 1.00 0.00 C ATOM 1705 C ASN B 428 8.159 5.656 2.119 1.00 0.00 C ATOM 1706 O ASN B 428 9.327 5.997 2.308 1.00 0.00 O ATOM 1707 CB ASN B 428 6.924 5.078 4.237 1.00 0.00 C ATOM 1708 CG ASN B 428 6.728 3.630 3.818 1.00 0.00 C ATOM 1709 OD1 ASN B 428 5.614 3.130 3.802 1.00 0.00 O ATOM 1710 ND2 ASN B 428 7.809 2.938 3.499 1.00 0.00 N ATOM 0 H ASN B 428 5.024 5.720 2.713 1.00 0.00 H new ATOM 0 HA ASN B 428 7.331 7.038 3.522 1.00 0.00 H new ATOM 0 HB2 ASN B 428 7.816 5.142 4.861 1.00 0.00 H new ATOM 0 HB3 ASN B 428 6.079 5.378 4.857 1.00 0.00 H new ATOM 0 HD21 ASN B 428 7.726 1.958 3.230 1.00 0.00 H new ATOM 0 HD22 ASN B 428 8.726 3.385 3.522 1.00 0.00 H new ATOM 1717 N CYS B 429 7.775 4.957 1.063 1.00 0.00 N ATOM 1718 CA CYS B 429 8.730 4.546 0.069 1.00 0.00 C ATOM 1719 C CYS B 429 9.365 5.757 -0.619 1.00 0.00 C ATOM 1720 O CYS B 429 10.576 5.919 -0.569 1.00 0.00 O ATOM 1721 CB CYS B 429 8.098 3.606 -0.959 1.00 0.00 C ATOM 1722 SG CYS B 429 9.166 3.239 -2.368 1.00 0.00 S ATOM 0 H CYS B 429 6.814 4.668 0.880 1.00 0.00 H new ATOM 0 HA CYS B 429 9.519 3.995 0.582 1.00 0.00 H new ATOM 0 HB2 CYS B 429 7.830 2.672 -0.466 1.00 0.00 H new ATOM 0 HB3 CYS B 429 7.172 4.051 -1.323 1.00 0.00 H new ATOM 0 HG CYS B 429 10.181 4.052 -2.367 1.00 0.00 H new ATOM 1728 N TYR B 430 8.568 6.637 -1.222 1.00 0.00 N ATOM 1729 CA TYR B 430 9.151 7.733 -2.003 1.00 0.00 C ATOM 1730 C TYR B 430 9.756 8.805 -1.105 1.00 0.00 C ATOM 1731 O TYR B 430 10.524 9.647 -1.572 1.00 0.00 O ATOM 1732 CB TYR B 430 8.156 8.401 -2.951 1.00 0.00 C ATOM 1733 CG TYR B 430 7.011 7.539 -3.411 1.00 0.00 C ATOM 1734 CD1 TYR B 430 7.229 6.293 -3.979 1.00 0.00 C ATOM 1735 CD2 TYR B 430 5.703 7.991 -3.296 1.00 0.00 C ATOM 1736 CE1 TYR B 430 6.172 5.526 -4.413 1.00 0.00 C ATOM 1737 CE2 TYR B 430 4.645 7.224 -3.728 1.00 0.00 C ATOM 1738 CZ TYR B 430 4.888 5.991 -4.285 1.00 0.00 C ATOM 1739 OH TYR B 430 3.843 5.220 -4.724 1.00 0.00 O ATOM 0 H TYR B 430 7.549 6.619 -1.190 1.00 0.00 H new ATOM 0 HA TYR B 430 9.930 7.263 -2.603 1.00 0.00 H new ATOM 0 HB2 TYR B 430 7.747 9.282 -2.457 1.00 0.00 H new ATOM 0 HB3 TYR B 430 8.698 8.751 -3.829 1.00 0.00 H new ATOM 0 HD1 TYR B 430 8.238 5.921 -4.082 1.00 0.00 H new ATOM 0 HD2 TYR B 430 5.513 8.961 -2.860 1.00 0.00 H new ATOM 0 HE1 TYR B 430 6.354 4.557 -4.855 1.00 0.00 H new ATOM 0 HE2 TYR B 430 3.633 7.588 -3.630 1.00 0.00 H new ATOM 0 HH TYR B 430 4.011 4.281 -4.498 1.00 0.00 H new ATOM 1749 N LYS B 431 9.387 8.811 0.172 1.00 0.00 N ATOM 1750 CA LYS B 431 10.045 9.694 1.129 1.00 0.00 C ATOM 1751 C LYS B 431 11.503 9.326 1.187 1.00 0.00 C ATOM 1752 O LYS B 431 12.398 10.158 1.047 1.00 0.00 O ATOM 1753 CB LYS B 431 9.497 9.525 2.538 1.00 0.00 C ATOM 1754 CG LYS B 431 7.995 9.486 2.642 1.00 0.00 C ATOM 1755 CD LYS B 431 7.555 9.651 4.081 1.00 0.00 C ATOM 1756 CE LYS B 431 8.534 9.015 5.064 1.00 0.00 C ATOM 1757 NZ LYS B 431 8.218 9.453 6.441 1.00 0.00 N ATOM 0 H LYS B 431 8.649 8.226 0.563 1.00 0.00 H new ATOM 0 HA LYS B 431 9.877 10.719 0.799 1.00 0.00 H new ATOM 0 HB2 LYS B 431 9.898 8.603 2.958 1.00 0.00 H new ATOM 0 HB3 LYS B 431 9.867 10.344 3.155 1.00 0.00 H new ATOM 0 HG2 LYS B 431 7.562 10.278 2.031 1.00 0.00 H new ATOM 0 HG3 LYS B 431 7.622 8.540 2.249 1.00 0.00 H new ATOM 0 HD2 LYS B 431 7.454 10.712 4.308 1.00 0.00 H new ATOM 0 HD3 LYS B 431 6.570 9.202 4.211 1.00 0.00 H new ATOM 0 HE2 LYS B 431 8.477 7.929 4.996 1.00 0.00 H new ATOM 0 HE3 LYS B 431 9.555 9.297 4.808 1.00 0.00 H new ATOM 0 HZ1 LYS B 431 9.090 9.472 7.008 1.00 0.00 H new ATOM 0 HZ2 LYS B 431 7.801 10.405 6.415 1.00 0.00 H new ATOM 0 HZ3 LYS B 431 7.541 8.790 6.869 1.00 0.00 H new ATOM 1771 N TYR B 432 11.712 8.046 1.399 1.00 0.00 N ATOM 1772 CA TYR B 432 13.028 7.490 1.542 1.00 0.00 C ATOM 1773 C TYR B 432 13.723 7.442 0.188 1.00 0.00 C ATOM 1774 O TYR B 432 14.898 7.791 0.048 1.00 0.00 O ATOM 1775 CB TYR B 432 12.916 6.080 2.121 1.00 0.00 C ATOM 1776 CG TYR B 432 14.208 5.593 2.698 1.00 0.00 C ATOM 1777 CD1 TYR B 432 15.408 5.820 2.058 1.00 0.00 C ATOM 1778 CD2 TYR B 432 14.226 4.904 3.878 1.00 0.00 C ATOM 1779 CE1 TYR B 432 16.587 5.378 2.585 1.00 0.00 C ATOM 1780 CE2 TYR B 432 15.403 4.454 4.409 1.00 0.00 C ATOM 1781 CZ TYR B 432 16.584 4.694 3.761 1.00 0.00 C ATOM 1782 OH TYR B 432 17.765 4.260 4.298 1.00 0.00 O ATOM 0 H TYR B 432 10.962 7.359 1.477 1.00 0.00 H new ATOM 0 HA TYR B 432 13.616 8.115 2.214 1.00 0.00 H new ATOM 0 HB2 TYR B 432 12.149 6.069 2.895 1.00 0.00 H new ATOM 0 HB3 TYR B 432 12.590 5.394 1.339 1.00 0.00 H new ATOM 0 HD1 TYR B 432 15.415 6.358 1.122 1.00 0.00 H new ATOM 0 HD2 TYR B 432 13.299 4.712 4.398 1.00 0.00 H new ATOM 0 HE1 TYR B 432 17.517 5.570 2.071 1.00 0.00 H new ATOM 0 HE2 TYR B 432 15.400 3.908 5.341 1.00 0.00 H new ATOM 0 HH TYR B 432 17.816 4.530 5.239 1.00 0.00 H new ATOM 1792 N ASN B 433 12.987 7.012 -0.804 1.00 0.00 N ATOM 1793 CA ASN B 433 13.573 6.690 -2.080 1.00 0.00 C ATOM 1794 C ASN B 433 13.333 7.767 -3.125 1.00 0.00 C ATOM 1795 O ASN B 433 12.222 8.268 -3.280 1.00 0.00 O ATOM 1796 CB ASN B 433 13.002 5.381 -2.595 1.00 0.00 C ATOM 1797 CG ASN B 433 13.212 4.226 -1.656 1.00 0.00 C ATOM 1798 OD1 ASN B 433 14.246 3.592 -1.687 1.00 0.00 O ATOM 1799 ND2 ASN B 433 12.223 3.928 -0.837 1.00 0.00 N ATOM 0 H ASN B 433 11.977 6.876 -0.753 1.00 0.00 H new ATOM 0 HA ASN B 433 14.648 6.610 -1.919 1.00 0.00 H new ATOM 0 HB2 ASN B 433 11.934 5.505 -2.773 1.00 0.00 H new ATOM 0 HB3 ASN B 433 13.461 5.146 -3.556 1.00 0.00 H new ATOM 0 HD21 ASN B 433 12.311 3.138 -0.197 1.00 0.00 H new ATOM 0 HD22 ASN B 433 11.370 4.487 -0.843 1.00 0.00 H new ATOM 1806 N PRO B 434 14.392 8.120 -3.858 1.00 0.00 N ATOM 1807 CA PRO B 434 14.298 8.928 -5.081 1.00 0.00 C ATOM 1808 C PRO B 434 13.572 8.148 -6.170 1.00 0.00 C ATOM 1809 O PRO B 434 13.552 6.924 -6.129 1.00 0.00 O ATOM 1810 CB PRO B 434 15.766 9.119 -5.473 1.00 0.00 C ATOM 1811 CG PRO B 434 16.451 7.947 -4.871 1.00 0.00 C ATOM 1812 CD PRO B 434 15.784 7.758 -3.557 1.00 0.00 C ATOM 0 HA PRO B 434 13.754 9.862 -4.943 1.00 0.00 H new ATOM 0 HB2 PRO B 434 15.891 9.142 -6.556 1.00 0.00 H new ATOM 0 HB3 PRO B 434 16.164 10.057 -5.086 1.00 0.00 H new ATOM 0 HG2 PRO B 434 16.348 7.062 -5.499 1.00 0.00 H new ATOM 0 HG3 PRO B 434 17.519 8.130 -4.751 1.00 0.00 H new ATOM 0 HD2 PRO B 434 15.869 6.731 -3.201 1.00 0.00 H new ATOM 0 HD3 PRO B 434 16.214 8.399 -2.787 1.00 0.00 H new ATOM 1820 N PRO B 435 12.991 8.824 -7.172 1.00 0.00 N ATOM 1821 CA PRO B 435 12.249 8.148 -8.246 1.00 0.00 C ATOM 1822 C PRO B 435 13.173 7.435 -9.226 1.00 0.00 C ATOM 1823 O PRO B 435 12.728 6.855 -10.215 1.00 0.00 O ATOM 1824 CB PRO B 435 11.512 9.293 -8.936 1.00 0.00 C ATOM 1825 CG PRO B 435 12.364 10.491 -8.695 1.00 0.00 C ATOM 1826 CD PRO B 435 13.002 10.289 -7.345 1.00 0.00 C ATOM 0 HA PRO B 435 11.590 7.369 -7.863 1.00 0.00 H new ATOM 0 HB2 PRO B 435 11.391 9.101 -10.002 1.00 0.00 H new ATOM 0 HB3 PRO B 435 10.513 9.428 -8.521 1.00 0.00 H new ATOM 0 HG2 PRO B 435 13.122 10.593 -9.472 1.00 0.00 H new ATOM 0 HG3 PRO B 435 11.767 11.403 -8.711 1.00 0.00 H new ATOM 0 HD2 PRO B 435 14.016 10.688 -7.317 1.00 0.00 H new ATOM 0 HD3 PRO B 435 12.440 10.790 -6.557 1.00 0.00 H new ATOM 1834 N ASP B 436 14.456 7.491 -8.934 1.00 0.00 N ATOM 1835 CA ASP B 436 15.462 6.768 -9.689 1.00 0.00 C ATOM 1836 C ASP B 436 15.841 5.494 -8.932 1.00 0.00 C ATOM 1837 O ASP B 436 16.875 4.876 -9.170 1.00 0.00 O ATOM 1838 CB ASP B 436 16.675 7.675 -9.906 1.00 0.00 C ATOM 1839 CG ASP B 436 17.813 7.014 -10.659 1.00 0.00 C ATOM 1840 OD1 ASP B 436 17.588 6.523 -11.785 1.00 0.00 O ATOM 1841 OD2 ASP B 436 18.948 7.000 -10.128 1.00 0.00 O ATOM 0 H ASP B 436 14.833 8.042 -8.163 1.00 0.00 H new ATOM 0 HA ASP B 436 15.074 6.479 -10.666 1.00 0.00 H new ATOM 0 HB2 ASP B 436 16.358 8.563 -10.453 1.00 0.00 H new ATOM 0 HB3 ASP B 436 17.042 8.012 -8.936 1.00 0.00 H new ATOM 1846 N HIS B 437 14.974 5.098 -8.009 1.00 0.00 N ATOM 1847 CA HIS B 437 15.255 3.969 -7.145 1.00 0.00 C ATOM 1848 C HIS B 437 14.527 2.714 -7.588 1.00 0.00 C ATOM 1849 O HIS B 437 13.513 2.770 -8.274 1.00 0.00 O ATOM 1850 CB HIS B 437 14.852 4.282 -5.716 1.00 0.00 C ATOM 1851 CG HIS B 437 15.559 3.453 -4.701 1.00 0.00 C ATOM 1852 ND1 HIS B 437 15.585 2.081 -4.701 1.00 0.00 N ATOM 1853 CD2 HIS B 437 16.258 3.824 -3.639 1.00 0.00 C ATOM 1854 CE1 HIS B 437 16.265 1.652 -3.665 1.00 0.00 C ATOM 1855 NE2 HIS B 437 16.699 2.694 -3.006 1.00 0.00 N ATOM 0 H HIS B 437 14.072 5.544 -7.843 1.00 0.00 H new ATOM 0 HA HIS B 437 16.328 3.788 -7.206 1.00 0.00 H new ATOM 0 HB2 HIS B 437 15.049 5.335 -5.514 1.00 0.00 H new ATOM 0 HB3 HIS B 437 13.777 4.133 -5.610 1.00 0.00 H new ATOM 0 HD2 HIS B 437 16.447 4.841 -3.327 1.00 0.00 H new ATOM 0 HE1 HIS B 437 16.436 0.619 -3.402 1.00 0.00 H new ATOM 0 HE2 HIS B 437 17.271 2.669 -2.162 1.00 0.00 H new ATOM 1864 N GLU B 438 15.072 1.588 -7.185 1.00 0.00 N ATOM 1865 CA GLU B 438 14.400 0.325 -7.241 1.00 0.00 C ATOM 1866 C GLU B 438 13.098 0.319 -6.419 1.00 0.00 C ATOM 1867 O GLU B 438 12.048 0.004 -6.943 1.00 0.00 O ATOM 1868 CB GLU B 438 15.354 -0.730 -6.726 1.00 0.00 C ATOM 1869 CG GLU B 438 14.667 -1.982 -6.331 1.00 0.00 C ATOM 1870 CD GLU B 438 14.107 -2.715 -7.532 1.00 0.00 C ATOM 1871 OE1 GLU B 438 13.077 -2.291 -8.071 1.00 0.00 O ATOM 1872 OE2 GLU B 438 14.725 -3.702 -7.964 1.00 0.00 O ATOM 0 H GLU B 438 16.016 1.532 -6.802 1.00 0.00 H new ATOM 0 HA GLU B 438 14.113 0.121 -8.272 1.00 0.00 H new ATOM 0 HB2 GLU B 438 16.092 -0.953 -7.497 1.00 0.00 H new ATOM 0 HB3 GLU B 438 15.898 -0.334 -5.869 1.00 0.00 H new ATOM 0 HG2 GLU B 438 15.366 -2.630 -5.802 1.00 0.00 H new ATOM 0 HG3 GLU B 438 13.859 -1.751 -5.636 1.00 0.00 H new ATOM 1879 N VAL B 439 13.159 0.657 -5.129 1.00 0.00 N ATOM 1880 CA VAL B 439 11.964 0.579 -4.282 1.00 0.00 C ATOM 1881 C VAL B 439 10.846 1.370 -4.882 1.00 0.00 C ATOM 1882 O VAL B 439 9.714 0.917 -4.927 1.00 0.00 O ATOM 1883 CB VAL B 439 12.188 1.083 -2.876 1.00 0.00 C ATOM 1884 CG1 VAL B 439 11.183 0.517 -1.899 1.00 0.00 C ATOM 1885 CG2 VAL B 439 13.573 0.850 -2.537 1.00 0.00 C ATOM 0 H VAL B 439 14.002 0.981 -4.655 1.00 0.00 H new ATOM 0 HA VAL B 439 11.715 -0.481 -4.227 1.00 0.00 H new ATOM 0 HB VAL B 439 12.008 2.156 -2.814 1.00 0.00 H new ATOM 0 HG11 VAL B 439 11.385 0.908 -0.902 1.00 0.00 H new ATOM 0 HG12 VAL B 439 10.177 0.804 -2.205 1.00 0.00 H new ATOM 0 HG13 VAL B 439 11.262 -0.570 -1.885 1.00 0.00 H new ATOM 0 HG21 VAL B 439 13.764 1.205 -1.524 1.00 0.00 H new ATOM 0 HG22 VAL B 439 13.787 -0.217 -2.594 1.00 0.00 H new ATOM 0 HG23 VAL B 439 14.214 1.386 -3.237 1.00 0.00 H new ATOM 1895 N VAL B 440 11.178 2.560 -5.350 1.00 0.00 N ATOM 1896 CA VAL B 440 10.180 3.377 -6.004 1.00 0.00 C ATOM 1897 C VAL B 440 9.731 2.744 -7.310 1.00 0.00 C ATOM 1898 O VAL B 440 8.551 2.723 -7.612 1.00 0.00 O ATOM 1899 CB VAL B 440 10.630 4.811 -6.264 1.00 0.00 C ATOM 1900 CG1 VAL B 440 10.999 5.453 -4.975 1.00 0.00 C ATOM 1901 CG2 VAL B 440 11.773 4.849 -7.225 1.00 0.00 C ATOM 0 H VAL B 440 12.109 2.972 -5.291 1.00 0.00 H new ATOM 0 HA VAL B 440 9.345 3.427 -5.305 1.00 0.00 H new ATOM 0 HB VAL B 440 9.807 5.364 -6.716 1.00 0.00 H new ATOM 0 HG11 VAL B 440 11.321 6.478 -5.158 1.00 0.00 H new ATOM 0 HG12 VAL B 440 10.135 5.457 -4.310 1.00 0.00 H new ATOM 0 HG13 VAL B 440 11.812 4.895 -4.510 1.00 0.00 H new ATOM 0 HG21 VAL B 440 12.073 5.883 -7.392 1.00 0.00 H new ATOM 0 HG22 VAL B 440 12.613 4.289 -6.814 1.00 0.00 H new ATOM 0 HG23 VAL B 440 11.468 4.402 -8.171 1.00 0.00 H new ATOM 1911 N ALA B 441 10.694 2.247 -8.078 1.00 0.00 N ATOM 1912 CA ALA B 441 10.420 1.461 -9.276 1.00 0.00 C ATOM 1913 C ALA B 441 9.272 0.505 -9.012 1.00 0.00 C ATOM 1914 O ALA B 441 8.240 0.519 -9.691 1.00 0.00 O ATOM 1915 CB ALA B 441 11.668 0.666 -9.649 1.00 0.00 C ATOM 0 H ALA B 441 11.688 2.378 -7.888 1.00 0.00 H new ATOM 0 HA ALA B 441 10.149 2.128 -10.094 1.00 0.00 H new ATOM 0 HB1 ALA B 441 11.470 0.076 -10.544 1.00 0.00 H new ATOM 0 HB2 ALA B 441 12.492 1.352 -9.842 1.00 0.00 H new ATOM 0 HB3 ALA B 441 11.935 0.001 -8.828 1.00 0.00 H new ATOM 1921 N MET B 442 9.468 -0.272 -7.970 1.00 0.00 N ATOM 1922 CA MET B 442 8.499 -1.239 -7.504 1.00 0.00 C ATOM 1923 C MET B 442 7.237 -0.528 -7.057 1.00 0.00 C ATOM 1924 O MET B 442 6.120 -0.875 -7.451 1.00 0.00 O ATOM 1925 CB MET B 442 9.126 -1.974 -6.338 1.00 0.00 C ATOM 1926 CG MET B 442 10.516 -2.437 -6.652 1.00 0.00 C ATOM 1927 SD MET B 442 10.670 -4.226 -6.685 1.00 0.00 S ATOM 1928 CE MET B 442 12.033 -4.399 -5.565 1.00 0.00 C ATOM 0 H MET B 442 10.322 -0.249 -7.412 1.00 0.00 H new ATOM 0 HA MET B 442 8.230 -1.936 -8.298 1.00 0.00 H new ATOM 0 HB2 MET B 442 9.149 -1.320 -5.467 1.00 0.00 H new ATOM 0 HB3 MET B 442 8.508 -2.833 -6.075 1.00 0.00 H new ATOM 0 HG2 MET B 442 10.817 -2.034 -7.619 1.00 0.00 H new ATOM 0 HG3 MET B 442 11.204 -2.032 -5.910 1.00 0.00 H new ATOM 0 HE1 MET B 442 12.832 -4.961 -6.048 1.00 0.00 H new ATOM 0 HE2 MET B 442 12.402 -3.412 -5.285 1.00 0.00 H new ATOM 0 HE3 MET B 442 11.705 -4.930 -4.672 1.00 0.00 H new ATOM 1938 N ALA B 443 7.458 0.481 -6.231 1.00 0.00 N ATOM 1939 CA ALA B 443 6.414 1.330 -5.691 1.00 0.00 C ATOM 1940 C ALA B 443 5.430 1.846 -6.760 1.00 0.00 C ATOM 1941 O ALA B 443 4.216 1.709 -6.609 1.00 0.00 O ATOM 1942 CB ALA B 443 7.080 2.492 -4.975 1.00 0.00 C ATOM 0 H ALA B 443 8.392 0.737 -5.911 1.00 0.00 H new ATOM 0 HA ALA B 443 5.812 0.735 -5.004 1.00 0.00 H new ATOM 0 HB1 ALA B 443 6.316 3.148 -4.558 1.00 0.00 H new ATOM 0 HB2 ALA B 443 7.710 2.111 -4.171 1.00 0.00 H new ATOM 0 HB3 ALA B 443 7.693 3.052 -5.682 1.00 0.00 H new ATOM 1948 N ARG B 444 5.956 2.430 -7.842 1.00 0.00 N ATOM 1949 CA ARG B 444 5.112 3.023 -8.888 1.00 0.00 C ATOM 1950 C ARG B 444 4.290 1.968 -9.615 1.00 0.00 C ATOM 1951 O ARG B 444 3.161 2.228 -10.026 1.00 0.00 O ATOM 1952 CB ARG B 444 5.932 3.801 -9.919 1.00 0.00 C ATOM 1953 CG ARG B 444 6.452 5.145 -9.437 1.00 0.00 C ATOM 1954 CD ARG B 444 7.902 5.063 -9.006 1.00 0.00 C ATOM 1955 NE ARG B 444 8.756 4.484 -10.046 1.00 0.00 N ATOM 1956 CZ ARG B 444 9.741 5.144 -10.656 1.00 0.00 C ATOM 1957 NH1 ARG B 444 9.931 6.435 -10.416 1.00 0.00 N ATOM 1958 NH2 ARG B 444 10.521 4.516 -11.528 1.00 0.00 N ATOM 0 H ARG B 444 6.958 2.505 -8.017 1.00 0.00 H new ATOM 0 HA ARG B 444 4.443 3.713 -8.373 1.00 0.00 H new ATOM 0 HB2 ARG B 444 6.780 3.188 -10.226 1.00 0.00 H new ATOM 0 HB3 ARG B 444 5.318 3.961 -10.805 1.00 0.00 H new ATOM 0 HG2 ARG B 444 6.350 5.882 -10.234 1.00 0.00 H new ATOM 0 HG3 ARG B 444 5.843 5.493 -8.602 1.00 0.00 H new ATOM 0 HD2 ARG B 444 8.262 6.061 -8.756 1.00 0.00 H new ATOM 0 HD3 ARG B 444 7.977 4.461 -8.100 1.00 0.00 H new ATOM 0 HE ARG B 444 8.587 3.516 -10.320 1.00 0.00 H new ATOM 0 HH11 ARG B 444 9.322 6.927 -9.762 1.00 0.00 H new ATOM 0 HH12 ARG B 444 10.686 6.935 -10.885 1.00 0.00 H new ATOM 0 HH21 ARG B 444 10.367 3.528 -11.731 1.00 0.00 H new ATOM 0 HH22 ARG B 444 11.274 5.021 -11.994 1.00 0.00 H new ATOM 1972 N LYS B 445 4.861 0.787 -9.792 1.00 0.00 N ATOM 1973 CA LYS B 445 4.145 -0.314 -10.418 1.00 0.00 C ATOM 1974 C LYS B 445 2.894 -0.647 -9.647 1.00 0.00 C ATOM 1975 O LYS B 445 1.838 -0.925 -10.218 1.00 0.00 O ATOM 1976 CB LYS B 445 5.047 -1.517 -10.477 1.00 0.00 C ATOM 1977 CG LYS B 445 6.208 -1.275 -11.361 1.00 0.00 C ATOM 1978 CD LYS B 445 7.346 -2.191 -11.052 1.00 0.00 C ATOM 1979 CE LYS B 445 7.338 -3.288 -12.050 1.00 0.00 C ATOM 1980 NZ LYS B 445 7.605 -2.807 -13.434 1.00 0.00 N ATOM 0 H LYS B 445 5.817 0.566 -9.512 1.00 0.00 H new ATOM 0 HA LYS B 445 3.853 -0.020 -11.426 1.00 0.00 H new ATOM 0 HB2 LYS B 445 5.396 -1.762 -9.474 1.00 0.00 H new ATOM 0 HB3 LYS B 445 4.485 -2.378 -10.839 1.00 0.00 H new ATOM 0 HG2 LYS B 445 5.907 -1.409 -12.400 1.00 0.00 H new ATOM 0 HG3 LYS B 445 6.536 -0.241 -11.255 1.00 0.00 H new ATOM 0 HD2 LYS B 445 8.291 -1.650 -11.089 1.00 0.00 H new ATOM 0 HD3 LYS B 445 7.248 -2.593 -10.044 1.00 0.00 H new ATOM 0 HE2 LYS B 445 8.089 -4.029 -11.776 1.00 0.00 H new ATOM 0 HE3 LYS B 445 6.371 -3.790 -12.024 1.00 0.00 H new ATOM 0 HZ1 LYS B 445 6.703 -2.610 -13.913 1.00 0.00 H new ATOM 0 HZ2 LYS B 445 8.174 -1.937 -13.396 1.00 0.00 H new ATOM 0 HZ3 LYS B 445 8.124 -3.538 -13.961 1.00 0.00 H new ATOM 1994 N LEU B 446 3.029 -0.617 -8.342 1.00 0.00 N ATOM 1995 CA LEU B 446 1.924 -0.855 -7.453 1.00 0.00 C ATOM 1996 C LEU B 446 0.920 0.263 -7.539 1.00 0.00 C ATOM 1997 O LEU B 446 -0.261 0.034 -7.390 1.00 0.00 O ATOM 1998 CB LEU B 446 2.440 -0.998 -6.051 1.00 0.00 C ATOM 1999 CG LEU B 446 3.495 -2.056 -5.904 1.00 0.00 C ATOM 2000 CD1 LEU B 446 3.616 -2.433 -4.453 1.00 0.00 C ATOM 2001 CD2 LEU B 446 3.086 -3.240 -6.739 1.00 0.00 C ATOM 0 H LEU B 446 3.912 -0.426 -7.869 1.00 0.00 H new ATOM 0 HA LEU B 446 1.420 -1.776 -7.746 1.00 0.00 H new ATOM 0 HB2 LEU B 446 2.848 -0.042 -5.724 1.00 0.00 H new ATOM 0 HB3 LEU B 446 1.607 -1.233 -5.388 1.00 0.00 H new ATOM 0 HG LEU B 446 4.466 -1.695 -6.243 1.00 0.00 H new ATOM 0 HD11 LEU B 446 4.381 -3.201 -4.339 1.00 0.00 H new ATOM 0 HD12 LEU B 446 3.895 -1.555 -3.871 1.00 0.00 H new ATOM 0 HD13 LEU B 446 2.660 -2.817 -4.096 1.00 0.00 H new ATOM 0 HD21 LEU B 446 3.837 -4.025 -6.650 1.00 0.00 H new ATOM 0 HD22 LEU B 446 2.124 -3.617 -6.390 1.00 0.00 H new ATOM 0 HD23 LEU B 446 3.000 -2.937 -7.782 1.00 0.00 H new ATOM 2013 N GLN B 447 1.393 1.469 -7.770 1.00 0.00 N ATOM 2014 CA GLN B 447 0.486 2.578 -8.048 1.00 0.00 C ATOM 2015 C GLN B 447 -0.367 2.244 -9.259 1.00 0.00 C ATOM 2016 O GLN B 447 -1.588 2.349 -9.217 1.00 0.00 O ATOM 2017 CB GLN B 447 1.218 3.890 -8.317 1.00 0.00 C ATOM 2018 CG GLN B 447 1.817 4.543 -7.090 1.00 0.00 C ATOM 2019 CD GLN B 447 2.037 6.032 -7.290 1.00 0.00 C ATOM 2020 OE1 GLN B 447 1.122 6.684 -7.990 1.00 0.00 O flip ATOM 2021 NE2 GLN B 447 2.995 6.604 -6.778 1.00 0.00 N flip ATOM 0 H GLN B 447 2.384 1.712 -7.773 1.00 0.00 H new ATOM 0 HA GLN B 447 -0.127 2.715 -7.157 1.00 0.00 H new ATOM 0 HB2 GLN B 447 2.014 3.705 -9.038 1.00 0.00 H new ATOM 0 HB3 GLN B 447 0.523 4.589 -8.781 1.00 0.00 H new ATOM 0 HG2 GLN B 447 1.158 4.385 -6.237 1.00 0.00 H new ATOM 0 HG3 GLN B 447 2.767 4.065 -6.852 1.00 0.00 H new ATOM 0 HE21 GLN B 447 3.682 6.071 -6.245 1.00 0.00 H new ATOM 0 HE22 GLN B 447 3.104 7.612 -6.886 1.00 0.00 H new ATOM 2030 N ASP B 448 0.290 1.827 -10.336 1.00 0.00 N ATOM 2031 CA ASP B 448 -0.409 1.459 -11.560 1.00 0.00 C ATOM 2032 C ASP B 448 -1.465 0.403 -11.283 1.00 0.00 C ATOM 2033 O ASP B 448 -2.631 0.579 -11.640 1.00 0.00 O ATOM 2034 CB ASP B 448 0.563 0.959 -12.629 1.00 0.00 C ATOM 2035 CG ASP B 448 1.334 2.086 -13.284 1.00 0.00 C ATOM 2036 OD1 ASP B 448 0.712 3.109 -13.646 1.00 0.00 O ATOM 2037 OD2 ASP B 448 2.564 1.949 -13.459 1.00 0.00 O ATOM 0 H ASP B 448 1.305 1.736 -10.385 1.00 0.00 H new ATOM 0 HA ASP B 448 -0.899 2.357 -11.937 1.00 0.00 H new ATOM 0 HB2 ASP B 448 1.265 0.257 -12.178 1.00 0.00 H new ATOM 0 HB3 ASP B 448 0.009 0.411 -13.391 1.00 0.00 H new ATOM 2042 N VAL B 449 -1.072 -0.680 -10.622 1.00 0.00 N ATOM 2043 CA VAL B 449 -2.022 -1.726 -10.294 1.00 0.00 C ATOM 2044 C VAL B 449 -2.981 -1.288 -9.188 1.00 0.00 C ATOM 2045 O VAL B 449 -4.154 -1.118 -9.473 1.00 0.00 O ATOM 2046 CB VAL B 449 -1.356 -3.087 -9.994 1.00 0.00 C ATOM 2047 CG1 VAL B 449 -0.218 -2.985 -9.002 1.00 0.00 C ATOM 2048 CG2 VAL B 449 -2.387 -4.087 -9.511 1.00 0.00 C ATOM 0 H VAL B 449 -0.117 -0.852 -10.309 1.00 0.00 H new ATOM 0 HA VAL B 449 -2.617 -1.890 -11.192 1.00 0.00 H new ATOM 0 HB VAL B 449 -0.924 -3.434 -10.932 1.00 0.00 H new ATOM 0 HG11 VAL B 449 0.208 -3.974 -8.834 1.00 0.00 H new ATOM 0 HG12 VAL B 449 0.551 -2.321 -9.397 1.00 0.00 H new ATOM 0 HG13 VAL B 449 -0.592 -2.586 -8.059 1.00 0.00 H new ATOM 0 HG21 VAL B 449 -1.900 -5.040 -9.304 1.00 0.00 H new ATOM 0 HG22 VAL B 449 -2.857 -3.714 -8.601 1.00 0.00 H new ATOM 0 HG23 VAL B 449 -3.147 -4.227 -10.280 1.00 0.00 H new ATOM 2058 N PHE B 450 -2.498 -1.064 -7.957 1.00 0.00 N ATOM 2059 CA PHE B 450 -3.363 -0.649 -6.846 1.00 0.00 C ATOM 2060 C PHE B 450 -4.354 0.455 -7.220 1.00 0.00 C ATOM 2061 O PHE B 450 -5.510 0.366 -6.855 1.00 0.00 O ATOM 2062 CB PHE B 450 -2.539 -0.184 -5.643 1.00 0.00 C ATOM 2063 CG PHE B 450 -3.338 0.625 -4.660 1.00 0.00 C ATOM 2064 CD1 PHE B 450 -4.203 0.011 -3.767 1.00 0.00 C ATOM 2065 CD2 PHE B 450 -3.233 2.009 -4.642 1.00 0.00 C ATOM 2066 CE1 PHE B 450 -4.947 0.762 -2.881 1.00 0.00 C ATOM 2067 CE2 PHE B 450 -3.971 2.761 -3.755 1.00 0.00 C ATOM 2068 CZ PHE B 450 -4.828 2.138 -2.875 1.00 0.00 C ATOM 0 H PHE B 450 -1.514 -1.163 -7.707 1.00 0.00 H new ATOM 0 HA PHE B 450 -3.938 -1.539 -6.588 1.00 0.00 H new ATOM 0 HB2 PHE B 450 -2.124 -1.055 -5.136 1.00 0.00 H new ATOM 0 HB3 PHE B 450 -1.697 0.411 -5.995 1.00 0.00 H new ATOM 0 HD1 PHE B 450 -4.295 -1.065 -3.765 1.00 0.00 H new ATOM 0 HD2 PHE B 450 -2.564 2.502 -5.332 1.00 0.00 H new ATOM 0 HE1 PHE B 450 -5.622 0.275 -2.193 1.00 0.00 H new ATOM 0 HE2 PHE B 450 -3.878 3.837 -3.750 1.00 0.00 H new ATOM 0 HZ PHE B 450 -5.408 2.726 -2.179 1.00 0.00 H new ATOM 2078 N GLU B 451 -3.922 1.498 -7.918 1.00 0.00 N ATOM 2079 CA GLU B 451 -4.816 2.626 -8.171 1.00 0.00 C ATOM 2080 C GLU B 451 -5.831 2.318 -9.272 1.00 0.00 C ATOM 2081 O GLU B 451 -6.940 2.852 -9.256 1.00 0.00 O ATOM 2082 CB GLU B 451 -4.033 3.901 -8.490 1.00 0.00 C ATOM 2083 CG GLU B 451 -3.177 4.382 -7.327 1.00 0.00 C ATOM 2084 CD GLU B 451 -2.519 5.718 -7.590 1.00 0.00 C ATOM 2085 OE1 GLU B 451 -1.484 5.752 -8.282 1.00 0.00 O ATOM 2086 OE2 GLU B 451 -3.029 6.745 -7.092 1.00 0.00 O ATOM 0 H GLU B 451 -2.985 1.589 -8.311 1.00 0.00 H new ATOM 0 HA GLU B 451 -5.376 2.796 -7.251 1.00 0.00 H new ATOM 0 HB2 GLU B 451 -3.393 3.721 -9.354 1.00 0.00 H new ATOM 0 HB3 GLU B 451 -4.732 4.689 -8.769 1.00 0.00 H new ATOM 0 HG2 GLU B 451 -3.797 4.458 -6.434 1.00 0.00 H new ATOM 0 HG3 GLU B 451 -2.407 3.639 -7.118 1.00 0.00 H new ATOM 2093 N MET B 452 -5.471 1.460 -10.221 1.00 0.00 N ATOM 2094 CA MET B 452 -6.444 0.976 -11.202 1.00 0.00 C ATOM 2095 C MET B 452 -7.363 -0.021 -10.511 1.00 0.00 C ATOM 2096 O MET B 452 -8.578 -0.029 -10.702 1.00 0.00 O ATOM 2097 CB MET B 452 -5.750 0.303 -12.390 1.00 0.00 C ATOM 2098 CG MET B 452 -6.709 -0.090 -13.506 1.00 0.00 C ATOM 2099 SD MET B 452 -6.558 -1.822 -13.997 1.00 0.00 S ATOM 2100 CE MET B 452 -7.063 -2.651 -12.490 1.00 0.00 C ATOM 0 H MET B 452 -4.528 1.088 -10.334 1.00 0.00 H new ATOM 0 HA MET B 452 -7.013 1.822 -11.588 1.00 0.00 H new ATOM 0 HB2 MET B 452 -4.995 0.979 -12.791 1.00 0.00 H new ATOM 0 HB3 MET B 452 -5.227 -0.587 -12.040 1.00 0.00 H new ATOM 0 HG2 MET B 452 -7.732 0.101 -13.181 1.00 0.00 H new ATOM 0 HG3 MET B 452 -6.526 0.544 -14.373 1.00 0.00 H new ATOM 0 HE1 MET B 452 -7.227 -3.709 -12.694 1.00 0.00 H new ATOM 0 HE2 MET B 452 -6.282 -2.544 -11.737 1.00 0.00 H new ATOM 0 HE3 MET B 452 -7.987 -2.205 -12.121 1.00 0.00 H new ATOM 2110 N ARG B 453 -6.738 -0.858 -9.702 1.00 0.00 N ATOM 2111 CA ARG B 453 -7.398 -1.785 -8.824 1.00 0.00 C ATOM 2112 C ARG B 453 -8.408 -1.061 -7.949 1.00 0.00 C ATOM 2113 O ARG B 453 -9.556 -1.479 -7.816 1.00 0.00 O ATOM 2114 CB ARG B 453 -6.307 -2.420 -7.975 1.00 0.00 C ATOM 2115 CG ARG B 453 -5.631 -3.592 -8.631 1.00 0.00 C ATOM 2116 CD ARG B 453 -6.345 -4.867 -8.306 1.00 0.00 C ATOM 2117 NE ARG B 453 -6.131 -5.884 -9.333 1.00 0.00 N ATOM 2118 CZ ARG B 453 -6.829 -7.017 -9.438 1.00 0.00 C ATOM 2119 NH1 ARG B 453 -7.794 -7.304 -8.571 1.00 0.00 N ATOM 2120 NH2 ARG B 453 -6.549 -7.867 -10.419 1.00 0.00 N ATOM 0 H ARG B 453 -5.721 -0.906 -9.642 1.00 0.00 H new ATOM 0 HA ARG B 453 -7.947 -2.541 -9.385 1.00 0.00 H new ATOM 0 HB2 ARG B 453 -5.557 -1.665 -7.740 1.00 0.00 H new ATOM 0 HB3 ARG B 453 -6.739 -2.745 -7.029 1.00 0.00 H new ATOM 0 HG2 ARG B 453 -5.609 -3.447 -9.711 1.00 0.00 H new ATOM 0 HG3 ARG B 453 -4.595 -3.654 -8.297 1.00 0.00 H new ATOM 0 HD2 ARG B 453 -5.998 -5.243 -7.344 1.00 0.00 H new ATOM 0 HD3 ARG B 453 -7.412 -4.671 -8.205 1.00 0.00 H new ATOM 0 HE ARG B 453 -5.395 -5.716 -10.019 1.00 0.00 H new ATOM 0 HH11 ARG B 453 -8.009 -6.655 -7.814 1.00 0.00 H new ATOM 0 HH12 ARG B 453 -8.320 -8.173 -8.662 1.00 0.00 H new ATOM 0 HH21 ARG B 453 -5.806 -7.652 -11.084 1.00 0.00 H new ATOM 0 HH22 ARG B 453 -7.077 -8.735 -10.508 1.00 0.00 H new ATOM 2134 N PHE B 454 -7.963 0.047 -7.381 1.00 0.00 N ATOM 2135 CA PHE B 454 -8.767 0.832 -6.472 1.00 0.00 C ATOM 2136 C PHE B 454 -9.825 1.624 -7.230 1.00 0.00 C ATOM 2137 O PHE B 454 -10.817 2.077 -6.661 1.00 0.00 O ATOM 2138 CB PHE B 454 -7.893 1.789 -5.682 1.00 0.00 C ATOM 2139 CG PHE B 454 -8.422 1.969 -4.307 1.00 0.00 C ATOM 2140 CD1 PHE B 454 -8.541 0.872 -3.492 1.00 0.00 C ATOM 2141 CD2 PHE B 454 -8.845 3.200 -3.842 1.00 0.00 C ATOM 2142 CE1 PHE B 454 -9.062 0.971 -2.258 1.00 0.00 C ATOM 2143 CE2 PHE B 454 -9.372 3.314 -2.572 1.00 0.00 C ATOM 2144 CZ PHE B 454 -9.485 2.189 -1.780 1.00 0.00 C ATOM 0 H PHE B 454 -7.029 0.425 -7.541 1.00 0.00 H new ATOM 0 HA PHE B 454 -9.262 0.145 -5.786 1.00 0.00 H new ATOM 0 HB2 PHE B 454 -6.874 1.406 -5.638 1.00 0.00 H new ATOM 0 HB3 PHE B 454 -7.849 2.753 -6.189 1.00 0.00 H new ATOM 0 HD1 PHE B 454 -8.209 -0.091 -3.850 1.00 0.00 H new ATOM 0 HD2 PHE B 454 -8.763 4.073 -4.473 1.00 0.00 H new ATOM 0 HE1 PHE B 454 -9.149 0.090 -1.639 1.00 0.00 H new ATOM 0 HE2 PHE B 454 -9.694 4.276 -2.200 1.00 0.00 H new ATOM 0 HZ PHE B 454 -9.904 2.265 -0.788 1.00 0.00 H new