USER MOD reduce.3.24.130724 H: found=0, std=0, add=1307, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 1309 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 56 HIS : no HD1:sc=-0.00756 X(o=-0.46,f=-0.87) USER MOD Set 1.2: B 60 CYS SG : rot -130:sc=-0.00803 USER MOD Set 1.3: B 97 MET CE :methyl -148:sc= -0.445 (180deg=-0.497) USER MOD Set 2.1: A 56 HIS : no HD1:sc= 0 X(o=-0.36,f=-0.49) USER MOD Set 2.2: A 60 CYS SG : rot -120:sc= -0.0163 USER MOD Set 2.3: A 97 MET CE :methyl -145:sc= -0.348 (180deg=-0.761) USER MOD Single : A 36 LYS NZ :NH3+ 169:sc= 1.36 (180deg=1.01) USER MOD Single : A 38 SER OG : rot 64:sc= 0.694 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 ASN : amide:sc= -0.322 X(o=-0.32,f=-0.068) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= -0.506 USER MOD Single : A 49 THR OG1 : rot -57:sc= 1.26 USER MOD Single : A 51 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 64 ASN :FLIP amide:sc= -1.06 F(o=-2.8!,f=-1.1) USER MOD Single : A 67 THR OG1 : rot 81:sc= 0.0474 USER MOD Single : A 70 CYS SG : rot 170:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 165:sc= 1.23 (180deg=1.16) USER MOD Single : A 74 SER OG : rot -160:sc= 0 USER MOD Single : A 76 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 78 LYS NZ :NH3+ -170:sc= -0.0206 (180deg=-0.183) USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot -125:sc= 0.0535 USER MOD Single : A 89 ASN : amide:sc= -0.0299 X(o=-0.03,f=-0.4) USER MOD Single : A 90 SER OG : rot 180:sc= -0.165 USER MOD Single : A 100 THR OG1 : rot -62:sc= 0.379 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ -165:sc= -0.0181 (180deg=-0.182) USER MOD Single : A 112 LYS NZ :NH3+ 165:sc= 1.19 (180deg=0.679) USER MOD Single : B 24 GLN : amide:sc= -0.526 X(o=-0.53,f=-0.3) USER MOD Single : B 27 SER OG : rot 180:sc= 0 USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 LYS NZ :NH3+ -174:sc=-0.00518 (180deg=-0.0518) USER MOD Single : B 36 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00722) USER MOD Single : B 38 SER OG : rot 73:sc= 1.09 USER MOD Single : B 40 TYR OH : rot 180:sc= 0 USER MOD Single : B 43 ASN : amide:sc= -0.499 X(o=-0.5,f=-0.13) USER MOD Single : B 46 TYR OH : rot 130:sc=-0.00265 USER MOD Single : B 48 SER OG : rot -158:sc= 0.352 USER MOD Single : B 49 THR OG1 : rot -68:sc= 1.2 USER MOD Single : B 51 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : B 58 SER OG : rot 180:sc= 0 USER MOD Single : B 59 SER OG : rot 79:sc= 0.105 USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 64 ASN : amide:sc= -0.792 X(o=-0.79,f=-0.72) USER MOD Single : B 67 THR OG1 : rot 72:sc= 0.00385 USER MOD Single : B 70 CYS SG : rot 180:sc= 0 USER MOD Single : B 72 LYS NZ :NH3+ 173:sc= 1.27 (180deg=1.05) USER MOD Single : B 74 SER OG : rot -30:sc= 0.357 USER MOD Single : B 76 HIS : no HD1:sc= -0.111 X(o=-0.11,f=-0.0053) USER MOD Single : B 78 LYS NZ :NH3+ -166:sc= -0.0344 (180deg=-0.368) USER MOD Single : B 80 TYR OH : rot 180:sc= 0 USER MOD Single : B 82 TYR OH : rot -113:sc=0.000407 USER MOD Single : B 89 ASN : amide:sc= 1.23 K(o=1.2,f=-0.29) USER MOD Single : B 90 SER OG : rot 170:sc= -1.42 USER MOD Single : B 100 THR OG1 : rot -70:sc= 1.2 USER MOD Single : B 106 THR OG1 : rot 180:sc= 0 USER MOD Single : B 108 LYS NZ :NH3+ -168:sc= -0.014 (180deg=-0.139) USER MOD Single : B 112 LYS NZ :NH3+ -164:sc= 0.722 (180deg=0.536) USER MOD ----------------------------------------------------------------- ATOM 468 N GLU A 33 -14.615 8.434 9.045 1.00 35.22 N ATOM 469 CA GLU A 33 -15.600 8.833 8.024 1.00 73.11 C ATOM 470 C GLU A 33 -15.260 8.196 6.677 1.00 13.14 C ATOM 471 O GLU A 33 -16.155 7.742 5.946 1.00 1.41 O ATOM 472 CB GLU A 33 -15.642 10.352 7.896 1.00 64.12 C ATOM 473 CG GLU A 33 -16.261 11.077 9.083 1.00 75.43 C ATOM 474 CD GLU A 33 -17.750 11.254 8.959 1.00 21.14 C ATOM 475 OE1 GLU A 33 -18.179 12.168 8.239 1.00 23.30 O ATOM 476 OE2 GLU A 33 -18.520 10.510 9.592 1.00 30.24 O ATOM 0 HA GLU A 33 -16.584 8.481 8.335 1.00 73.11 H new ATOM 0 HB2 GLU A 33 -14.625 10.719 7.755 1.00 64.12 H new ATOM 0 HB3 GLU A 33 -16.202 10.611 6.998 1.00 64.12 H new ATOM 0 HG2 GLU A 33 -16.042 10.521 9.994 1.00 75.43 H new ATOM 0 HG3 GLU A 33 -15.793 12.056 9.187 1.00 75.43 H new ATOM 483 N ILE A 34 -13.974 8.175 6.363 1.00 25.22 N ATOM 484 CA ILE A 34 -13.495 7.539 5.144 1.00 71.13 C ATOM 485 C ILE A 34 -13.596 6.011 5.252 1.00 23.50 C ATOM 486 O ILE A 34 -13.968 5.356 4.294 1.00 12.51 O ATOM 487 CB ILE A 34 -12.088 8.030 4.678 1.00 32.21 C ATOM 488 CG1 ILE A 34 -11.010 7.778 5.732 1.00 14.44 C ATOM 489 CG2 ILE A 34 -12.146 9.499 4.264 1.00 53.40 C ATOM 490 CD1 ILE A 34 -9.648 8.378 5.409 1.00 4.25 C ATOM 0 H ILE A 34 -13.241 8.592 6.937 1.00 25.22 H new ATOM 0 HA ILE A 34 -14.161 7.860 4.343 1.00 71.13 H new ATOM 0 HB ILE A 34 -11.803 7.443 3.805 1.00 32.21 H new ATOM 0 HG12 ILE A 34 -11.352 8.181 6.685 1.00 14.44 H new ATOM 0 HG13 ILE A 34 -10.895 6.702 5.864 1.00 14.44 H new ATOM 0 HG21 ILE A 34 -11.157 9.826 3.942 1.00 53.40 H new ATOM 0 HG22 ILE A 34 -12.853 9.618 3.443 1.00 53.40 H new ATOM 0 HG23 ILE A 34 -12.469 10.103 5.111 1.00 53.40 H new ATOM 0 HD11 ILE A 34 -8.949 8.148 6.213 1.00 4.25 H new ATOM 0 HD12 ILE A 34 -9.277 7.957 4.474 1.00 4.25 H new ATOM 0 HD13 ILE A 34 -9.741 9.459 5.308 1.00 4.25 H new ATOM 502 N ASP A 35 -13.349 5.454 6.471 1.00 12.13 N ATOM 503 CA ASP A 35 -13.481 3.984 6.717 1.00 23.43 C ATOM 504 C ASP A 35 -14.900 3.526 6.411 1.00 32.33 C ATOM 505 O ASP A 35 -15.104 2.512 5.763 1.00 61.24 O ATOM 506 CB ASP A 35 -13.158 3.572 8.196 1.00 43.42 C ATOM 507 CG ASP A 35 -11.703 3.217 8.527 1.00 74.34 C ATOM 508 OD1 ASP A 35 -11.177 2.213 7.981 1.00 13.51 O ATOM 509 OD2 ASP A 35 -11.085 3.908 9.381 1.00 60.14 O ATOM 0 H ASP A 35 -13.061 5.990 7.290 1.00 12.13 H new ATOM 0 HA ASP A 35 -12.754 3.507 6.060 1.00 23.43 H new ATOM 0 HB2 ASP A 35 -13.462 4.391 8.848 1.00 43.42 H new ATOM 0 HB3 ASP A 35 -13.780 2.714 8.451 1.00 43.42 H new ATOM 514 N LYS A 36 -15.871 4.338 6.851 1.00 71.50 N ATOM 515 CA LYS A 36 -17.320 4.044 6.717 1.00 54.01 C ATOM 516 C LYS A 36 -17.733 3.898 5.266 1.00 41.52 C ATOM 517 O LYS A 36 -18.711 3.229 4.961 1.00 61.14 O ATOM 518 CB LYS A 36 -18.158 5.186 7.311 1.00 3.01 C ATOM 519 CG LYS A 36 -17.881 5.487 8.745 1.00 53.31 C ATOM 520 CD LYS A 36 -18.613 6.733 9.197 1.00 12.54 C ATOM 521 CE LYS A 36 -18.127 7.135 10.560 1.00 14.34 C ATOM 522 NZ LYS A 36 -18.763 8.361 11.067 1.00 4.44 N ATOM 0 H LYS A 36 -15.680 5.226 7.315 1.00 71.50 H new ATOM 0 HA LYS A 36 -17.495 3.109 7.249 1.00 54.01 H new ATOM 0 HB2 LYS A 36 -17.983 6.088 6.725 1.00 3.01 H new ATOM 0 HB3 LYS A 36 -19.214 4.936 7.204 1.00 3.01 H new ATOM 0 HG2 LYS A 36 -18.184 4.641 9.362 1.00 53.31 H new ATOM 0 HG3 LYS A 36 -16.809 5.620 8.890 1.00 53.31 H new ATOM 0 HD2 LYS A 36 -18.446 7.543 8.487 1.00 12.54 H new ATOM 0 HD3 LYS A 36 -19.687 6.547 9.223 1.00 12.54 H new ATOM 0 HE2 LYS A 36 -18.315 6.321 11.260 1.00 14.34 H new ATOM 0 HE3 LYS A 36 -17.048 7.282 10.524 1.00 14.34 H new ATOM 0 HZ1 LYS A 36 -18.530 8.482 12.073 1.00 4.44 H new ATOM 0 HZ2 LYS A 36 -18.415 9.180 10.530 1.00 4.44 H new ATOM 0 HZ3 LYS A 36 -19.795 8.288 10.957 1.00 4.44 H new ATOM 536 N ARG A 37 -17.004 4.546 4.389 1.00 52.01 N ATOM 537 CA ARG A 37 -17.332 4.564 2.979 1.00 43.11 C ATOM 538 C ARG A 37 -16.272 3.804 2.189 1.00 0.25 C ATOM 539 O ARG A 37 -16.112 3.985 0.987 1.00 14.03 O ATOM 540 CB ARG A 37 -17.495 6.023 2.507 1.00 34.04 C ATOM 541 CG ARG A 37 -16.255 6.861 2.673 1.00 52.21 C ATOM 542 CD ARG A 37 -16.522 8.341 2.471 1.00 25.41 C ATOM 543 NE ARG A 37 -17.340 8.890 3.567 1.00 61.13 N ATOM 544 CZ ARG A 37 -18.272 9.853 3.441 1.00 74.30 C ATOM 545 NH1 ARG A 37 -18.556 10.363 2.253 1.00 11.25 N ATOM 546 NH2 ARG A 37 -18.919 10.294 4.515 1.00 60.44 N ATOM 0 H ARG A 37 -16.167 5.076 4.630 1.00 52.01 H new ATOM 0 HA ARG A 37 -18.281 4.058 2.805 1.00 43.11 H new ATOM 0 HB2 ARG A 37 -17.784 6.024 1.456 1.00 34.04 H new ATOM 0 HB3 ARG A 37 -18.311 6.485 3.063 1.00 34.04 H new ATOM 0 HG2 ARG A 37 -15.844 6.702 3.670 1.00 52.21 H new ATOM 0 HG3 ARG A 37 -15.499 6.531 1.960 1.00 52.21 H new ATOM 0 HD2 ARG A 37 -15.576 8.879 2.415 1.00 25.41 H new ATOM 0 HD3 ARG A 37 -17.033 8.495 1.520 1.00 25.41 H new ATOM 0 HE ARG A 37 -17.187 8.508 4.500 1.00 61.13 H new ATOM 0 HH11 ARG A 37 -18.067 10.027 1.423 1.00 11.25 H new ATOM 0 HH12 ARG A 37 -19.264 11.092 2.167 1.00 11.25 H new ATOM 0 HH21 ARG A 37 -18.709 9.903 5.433 1.00 60.44 H new ATOM 0 HH22 ARG A 37 -19.625 11.024 4.421 1.00 60.44 H new ATOM 560 N SER A 38 -15.573 2.940 2.877 1.00 14.22 N ATOM 561 CA SER A 38 -14.610 2.074 2.260 1.00 62.21 C ATOM 562 C SER A 38 -15.054 0.614 2.355 1.00 30.32 C ATOM 563 O SER A 38 -16.000 0.280 3.078 1.00 32.24 O ATOM 564 CB SER A 38 -13.276 2.244 2.928 1.00 14.22 C ATOM 565 OG SER A 38 -12.813 3.558 2.812 1.00 32.11 O ATOM 0 H SER A 38 -15.658 2.819 3.886 1.00 14.22 H new ATOM 0 HA SER A 38 -14.528 2.342 1.207 1.00 62.21 H new ATOM 0 HB2 SER A 38 -13.358 1.977 3.982 1.00 14.22 H new ATOM 0 HB3 SER A 38 -12.554 1.561 2.481 1.00 14.22 H new ATOM 0 HG SER A 38 -13.420 4.162 3.288 1.00 32.11 H new ATOM 571 N VAL A 39 -14.350 -0.255 1.665 1.00 33.15 N ATOM 572 CA VAL A 39 -14.686 -1.661 1.639 1.00 74.11 C ATOM 573 C VAL A 39 -13.453 -2.529 1.745 1.00 73.32 C ATOM 574 O VAL A 39 -12.338 -2.083 1.516 1.00 34.40 O ATOM 575 CB VAL A 39 -15.463 -2.087 0.339 1.00 25.51 C ATOM 576 CG1 VAL A 39 -16.805 -1.399 0.224 1.00 23.12 C ATOM 577 CG2 VAL A 39 -14.630 -1.824 -0.909 1.00 52.42 C ATOM 0 H VAL A 39 -13.532 -0.009 1.108 1.00 33.15 H new ATOM 0 HA VAL A 39 -15.334 -1.810 2.502 1.00 74.11 H new ATOM 0 HB VAL A 39 -15.646 -3.158 0.421 1.00 25.51 H new ATOM 0 HG11 VAL A 39 -17.304 -1.725 -0.689 1.00 23.12 H new ATOM 0 HG12 VAL A 39 -17.421 -1.656 1.086 1.00 23.12 H new ATOM 0 HG13 VAL A 39 -16.659 -0.319 0.192 1.00 23.12 H new ATOM 0 HG21 VAL A 39 -15.192 -2.128 -1.792 1.00 52.42 H new ATOM 0 HG22 VAL A 39 -14.398 -0.761 -0.974 1.00 52.42 H new ATOM 0 HG23 VAL A 39 -13.703 -2.395 -0.855 1.00 52.42 H new ATOM 587 N TYR A 40 -13.700 -3.743 2.088 1.00 12.23 N ATOM 588 CA TYR A 40 -12.759 -4.847 2.064 1.00 43.14 C ATOM 589 C TYR A 40 -12.995 -5.570 0.748 1.00 14.41 C ATOM 590 O TYR A 40 -14.119 -5.952 0.453 1.00 4.43 O ATOM 591 CB TYR A 40 -13.102 -5.825 3.232 1.00 44.13 C ATOM 592 CG TYR A 40 -12.409 -7.233 3.272 1.00 14.42 C ATOM 593 CD1 TYR A 40 -12.025 -7.924 2.139 1.00 43.15 C ATOM 594 CD2 TYR A 40 -12.252 -7.883 4.448 1.00 3.04 C ATOM 595 CE1 TYR A 40 -11.511 -9.188 2.193 1.00 41.30 C ATOM 596 CE2 TYR A 40 -11.713 -9.158 4.499 1.00 33.13 C ATOM 597 CZ TYR A 40 -11.355 -9.794 3.377 1.00 24.34 C ATOM 598 OH TYR A 40 -10.861 -11.076 3.447 1.00 3.55 O ATOM 0 H TYR A 40 -14.622 -4.028 2.418 1.00 12.23 H new ATOM 0 HA TYR A 40 -11.729 -4.504 2.166 1.00 43.14 H new ATOM 0 HB2 TYR A 40 -12.868 -5.316 4.167 1.00 44.13 H new ATOM 0 HB3 TYR A 40 -14.180 -5.989 3.219 1.00 44.13 H new ATOM 0 HD1 TYR A 40 -12.135 -7.447 1.176 1.00 43.15 H new ATOM 0 HD2 TYR A 40 -12.553 -7.398 5.365 1.00 3.04 H new ATOM 0 HE1 TYR A 40 -11.231 -9.698 1.283 1.00 41.30 H new ATOM 0 HE2 TYR A 40 -11.580 -9.644 5.454 1.00 33.13 H new ATOM 0 HH TYR A 40 -10.813 -11.358 4.384 1.00 3.55 H new ATOM 608 N VAL A 41 -11.967 -5.739 -0.023 1.00 72.40 N ATOM 609 CA VAL A 41 -11.994 -6.520 -1.241 1.00 13.22 C ATOM 610 C VAL A 41 -10.840 -7.510 -1.168 1.00 41.34 C ATOM 611 O VAL A 41 -9.694 -7.117 -1.292 1.00 40.15 O ATOM 612 CB VAL A 41 -11.745 -5.586 -2.426 1.00 12.01 C ATOM 613 CG1 VAL A 41 -11.660 -6.373 -3.728 1.00 34.14 C ATOM 614 CG2 VAL A 41 -12.852 -4.573 -2.507 1.00 54.22 C ATOM 0 H VAL A 41 -11.054 -5.329 0.175 1.00 72.40 H new ATOM 0 HA VAL A 41 -12.951 -7.029 -1.358 1.00 13.22 H new ATOM 0 HB VAL A 41 -10.794 -5.075 -2.276 1.00 12.01 H new ATOM 0 HG11 VAL A 41 -11.483 -5.687 -4.557 1.00 34.14 H new ATOM 0 HG12 VAL A 41 -10.840 -7.089 -3.668 1.00 34.14 H new ATOM 0 HG13 VAL A 41 -12.596 -6.906 -3.893 1.00 34.14 H new ATOM 0 HG21 VAL A 41 -12.675 -3.907 -3.352 1.00 54.22 H new ATOM 0 HG22 VAL A 41 -13.805 -5.085 -2.642 1.00 54.22 H new ATOM 0 HG23 VAL A 41 -12.881 -3.991 -1.586 1.00 54.22 H new ATOM 624 N GLY A 42 -11.096 -8.766 -0.947 1.00 22.45 N ATOM 625 CA GLY A 42 -9.968 -9.614 -0.766 1.00 74.45 C ATOM 626 C GLY A 42 -10.110 -11.044 -1.140 1.00 74.15 C ATOM 627 O GLY A 42 -10.963 -11.758 -0.625 1.00 41.35 O ATOM 0 H GLY A 42 -12.017 -9.201 -0.891 1.00 22.45 H new ATOM 0 HA2 GLY A 42 -9.141 -9.198 -1.341 1.00 74.45 H new ATOM 0 HA3 GLY A 42 -9.681 -9.569 0.284 1.00 74.45 H new ATOM 631 N ASN A 43 -9.369 -11.369 -2.164 1.00 30.53 N ATOM 632 CA ASN A 43 -8.951 -12.723 -2.576 1.00 73.43 C ATOM 633 C ASN A 43 -8.197 -12.478 -3.873 1.00 35.42 C ATOM 634 O ASN A 43 -8.020 -13.339 -4.719 1.00 64.31 O ATOM 635 CB ASN A 43 -10.166 -13.664 -2.797 1.00 13.21 C ATOM 636 CG ASN A 43 -9.781 -15.130 -3.058 1.00 72.31 C ATOM 637 OD1 ASN A 43 -9.593 -15.913 -2.121 1.00 11.10 O ATOM 638 ND2 ASN A 43 -9.724 -15.512 -4.306 1.00 65.43 N ATOM 0 H ASN A 43 -9.003 -10.655 -2.794 1.00 30.53 H new ATOM 0 HA ASN A 43 -8.348 -13.223 -1.818 1.00 73.43 H new ATOM 0 HB2 ASN A 43 -10.812 -13.619 -1.920 1.00 13.21 H new ATOM 0 HB3 ASN A 43 -10.749 -13.296 -3.641 1.00 13.21 H new ATOM 0 HD21 ASN A 43 -9.519 -16.485 -4.533 1.00 65.43 H new ATOM 0 HD22 ASN A 43 -9.885 -14.837 -5.054 1.00 65.43 H new ATOM 645 N VAL A 44 -7.715 -11.251 -3.967 1.00 24.21 N ATOM 646 CA VAL A 44 -7.083 -10.732 -5.142 1.00 72.54 C ATOM 647 C VAL A 44 -5.580 -10.593 -4.932 1.00 61.51 C ATOM 648 O VAL A 44 -5.094 -9.660 -4.303 1.00 42.52 O ATOM 649 CB VAL A 44 -7.753 -9.389 -5.609 1.00 21.34 C ATOM 650 CG1 VAL A 44 -7.763 -8.327 -4.508 1.00 31.13 C ATOM 651 CG2 VAL A 44 -7.091 -8.859 -6.861 1.00 44.24 C ATOM 0 H VAL A 44 -7.759 -10.579 -3.201 1.00 24.21 H new ATOM 0 HA VAL A 44 -7.228 -11.446 -5.952 1.00 72.54 H new ATOM 0 HB VAL A 44 -8.793 -9.620 -5.838 1.00 21.34 H new ATOM 0 HG11 VAL A 44 -8.237 -7.419 -4.882 1.00 31.13 H new ATOM 0 HG12 VAL A 44 -8.320 -8.699 -3.648 1.00 31.13 H new ATOM 0 HG13 VAL A 44 -6.739 -8.105 -4.208 1.00 31.13 H new ATOM 0 HG21 VAL A 44 -7.574 -7.929 -7.162 1.00 44.24 H new ATOM 0 HG22 VAL A 44 -6.036 -8.672 -6.663 1.00 44.24 H new ATOM 0 HG23 VAL A 44 -7.186 -9.593 -7.661 1.00 44.24 H new ATOM 661 N ASP A 45 -4.866 -11.542 -5.455 1.00 64.53 N ATOM 662 CA ASP A 45 -3.435 -11.637 -5.289 1.00 15.52 C ATOM 663 C ASP A 45 -2.781 -10.923 -6.440 1.00 71.14 C ATOM 664 O ASP A 45 -3.481 -10.553 -7.402 1.00 22.11 O ATOM 665 CB ASP A 45 -2.981 -13.087 -5.309 1.00 32.43 C ATOM 666 CG ASP A 45 -3.851 -14.017 -4.503 1.00 45.45 C ATOM 667 OD1 ASP A 45 -3.965 -13.870 -3.281 1.00 41.15 O ATOM 668 OD2 ASP A 45 -4.449 -14.912 -5.116 1.00 43.30 O ATOM 0 H ASP A 45 -5.263 -12.291 -6.022 1.00 64.53 H new ATOM 0 HA ASP A 45 -3.159 -11.194 -4.332 1.00 15.52 H new ATOM 0 HB2 ASP A 45 -2.956 -13.434 -6.342 1.00 32.43 H new ATOM 0 HB3 ASP A 45 -1.961 -13.142 -4.930 1.00 32.43 H new ATOM 673 N TYR A 46 -1.452 -10.738 -6.347 1.00 12.33 N ATOM 674 CA TYR A 46 -0.554 -10.060 -7.333 1.00 52.14 C ATOM 675 C TYR A 46 -0.972 -10.089 -8.804 1.00 1.44 C ATOM 676 O TYR A 46 -0.662 -9.151 -9.535 1.00 13.54 O ATOM 677 CB TYR A 46 0.831 -10.686 -7.234 1.00 4.13 C ATOM 678 CG TYR A 46 1.579 -10.373 -5.988 1.00 34.25 C ATOM 679 CD1 TYR A 46 2.388 -9.264 -5.940 1.00 20.35 C ATOM 680 CD2 TYR A 46 1.504 -11.185 -4.874 1.00 11.44 C ATOM 681 CE1 TYR A 46 3.102 -8.957 -4.823 1.00 41.15 C ATOM 682 CE2 TYR A 46 2.224 -10.891 -3.736 1.00 44.15 C ATOM 683 CZ TYR A 46 3.024 -9.776 -3.713 1.00 11.21 C ATOM 684 OH TYR A 46 3.750 -9.481 -2.580 1.00 2.12 O ATOM 0 H TYR A 46 -0.932 -11.074 -5.536 1.00 12.33 H new ATOM 0 HA TYR A 46 -0.597 -9.008 -7.050 1.00 52.14 H new ATOM 0 HB2 TYR A 46 0.730 -11.768 -7.316 1.00 4.13 H new ATOM 0 HB3 TYR A 46 1.423 -10.356 -8.087 1.00 4.13 H new ATOM 0 HD1 TYR A 46 2.459 -8.623 -6.806 1.00 20.35 H new ATOM 0 HD2 TYR A 46 0.873 -12.061 -4.894 1.00 11.44 H new ATOM 0 HE1 TYR A 46 3.727 -8.077 -4.804 1.00 41.15 H new ATOM 0 HE2 TYR A 46 2.159 -11.533 -2.870 1.00 44.15 H new ATOM 0 HH TYR A 46 3.577 -10.160 -1.895 1.00 2.12 H new ATOM 694 N GLY A 47 -1.621 -11.155 -9.235 1.00 61.14 N ATOM 695 CA GLY A 47 -2.071 -11.270 -10.606 1.00 11.43 C ATOM 696 C GLY A 47 -2.902 -10.080 -11.065 1.00 31.13 C ATOM 697 O GLY A 47 -2.870 -9.709 -12.240 1.00 34.25 O ATOM 0 H GLY A 47 -1.849 -11.958 -8.649 1.00 61.14 H new ATOM 0 HA2 GLY A 47 -1.204 -11.373 -11.259 1.00 11.43 H new ATOM 0 HA3 GLY A 47 -2.661 -12.180 -10.713 1.00 11.43 H new ATOM 701 N SER A 48 -3.647 -9.497 -10.153 1.00 61.20 N ATOM 702 CA SER A 48 -4.418 -8.328 -10.454 1.00 61.14 C ATOM 703 C SER A 48 -3.814 -7.119 -9.746 1.00 42.23 C ATOM 704 O SER A 48 -3.152 -7.265 -8.717 1.00 61.12 O ATOM 705 CB SER A 48 -5.854 -8.555 -10.074 1.00 2.35 C ATOM 706 OG SER A 48 -6.358 -9.707 -10.757 1.00 12.32 O ATOM 0 H SER A 48 -3.731 -9.823 -9.190 1.00 61.20 H new ATOM 0 HA SER A 48 -4.393 -8.126 -11.525 1.00 61.14 H new ATOM 0 HB2 SER A 48 -5.937 -8.694 -8.996 1.00 2.35 H new ATOM 0 HB3 SER A 48 -6.450 -7.679 -10.329 1.00 2.35 H new ATOM 0 HG SER A 48 -7.294 -9.853 -10.506 1.00 12.32 H new ATOM 712 N THR A 49 -4.035 -5.943 -10.290 1.00 64.12 N ATOM 713 CA THR A 49 -3.357 -4.767 -9.813 1.00 24.11 C ATOM 714 C THR A 49 -4.341 -3.684 -9.345 1.00 33.44 C ATOM 715 O THR A 49 -5.557 -3.853 -9.453 1.00 51.42 O ATOM 716 CB THR A 49 -2.447 -4.221 -10.925 1.00 63.52 C ATOM 717 OG1 THR A 49 -3.247 -3.780 -12.033 1.00 41.22 O ATOM 718 CG2 THR A 49 -1.508 -5.324 -11.413 1.00 1.55 C ATOM 0 H THR A 49 -4.680 -5.780 -11.063 1.00 64.12 H new ATOM 0 HA THR A 49 -2.757 -5.047 -8.947 1.00 24.11 H new ATOM 0 HB THR A 49 -1.868 -3.388 -10.527 1.00 63.52 H new ATOM 0 HG1 THR A 49 -3.804 -4.521 -12.350 1.00 41.22 H new ATOM 0 HG21 THR A 49 -0.865 -4.932 -12.201 1.00 1.55 H new ATOM 0 HG22 THR A 49 -0.893 -5.672 -10.583 1.00 1.55 H new ATOM 0 HG23 THR A 49 -2.095 -6.155 -11.803 1.00 1.55 H new ATOM 726 N ALA A 50 -3.802 -2.557 -8.854 1.00 15.33 N ATOM 727 CA ALA A 50 -4.590 -1.453 -8.310 1.00 71.53 C ATOM 728 C ALA A 50 -5.490 -0.823 -9.376 1.00 11.15 C ATOM 729 O ALA A 50 -6.643 -0.538 -9.122 1.00 65.10 O ATOM 730 CB ALA A 50 -3.636 -0.418 -7.723 1.00 10.53 C ATOM 0 H ALA A 50 -2.796 -2.390 -8.826 1.00 15.33 H new ATOM 0 HA ALA A 50 -5.248 -1.835 -7.530 1.00 71.53 H new ATOM 0 HB1 ALA A 50 -4.209 0.413 -7.312 1.00 10.53 H new ATOM 0 HB2 ALA A 50 -3.044 -0.877 -6.931 1.00 10.53 H new ATOM 0 HB3 ALA A 50 -2.972 -0.050 -8.505 1.00 10.53 H new ATOM 736 N GLN A 51 -4.941 -0.600 -10.563 1.00 43.34 N ATOM 737 CA GLN A 51 -5.718 -0.057 -11.686 1.00 64.52 C ATOM 738 C GLN A 51 -6.923 -0.955 -12.026 1.00 5.31 C ATOM 739 O GLN A 51 -8.012 -0.462 -12.346 1.00 21.12 O ATOM 740 CB GLN A 51 -4.830 0.063 -12.912 1.00 34.53 C ATOM 741 CG GLN A 51 -5.514 0.713 -14.091 1.00 51.15 C ATOM 742 CD GLN A 51 -4.700 0.647 -15.352 1.00 32.44 C ATOM 743 OE1 GLN A 51 -3.481 0.583 -15.317 1.00 53.34 O ATOM 744 NE2 GLN A 51 -5.363 0.716 -16.472 1.00 72.33 N ATOM 0 H GLN A 51 -3.962 -0.784 -10.780 1.00 43.34 H new ATOM 0 HA GLN A 51 -6.090 0.924 -11.390 1.00 64.52 H new ATOM 0 HB2 GLN A 51 -3.943 0.641 -12.653 1.00 34.53 H new ATOM 0 HB3 GLN A 51 -4.489 -0.931 -13.203 1.00 34.53 H new ATOM 0 HG2 GLN A 51 -6.475 0.227 -14.260 1.00 51.15 H new ATOM 0 HG3 GLN A 51 -5.722 1.756 -13.853 1.00 51.15 H new ATOM 0 HE21 GLN A 51 -6.382 0.768 -16.459 1.00 72.33 H new ATOM 0 HE22 GLN A 51 -4.863 0.718 -17.361 1.00 72.33 H new ATOM 753 N ASP A 52 -6.714 -2.273 -11.942 1.00 64.22 N ATOM 754 CA ASP A 52 -7.792 -3.245 -12.224 1.00 1.13 C ATOM 755 C ASP A 52 -8.890 -3.088 -11.211 1.00 33.52 C ATOM 756 O ASP A 52 -10.087 -3.260 -11.515 1.00 53.50 O ATOM 757 CB ASP A 52 -7.290 -4.693 -12.203 1.00 23.04 C ATOM 758 CG ASP A 52 -6.179 -4.949 -13.173 1.00 61.45 C ATOM 759 OD1 ASP A 52 -6.326 -4.661 -14.373 1.00 44.11 O ATOM 760 OD2 ASP A 52 -5.140 -5.449 -12.754 1.00 34.14 O ATOM 0 H ASP A 52 -5.821 -2.694 -11.685 1.00 64.22 H new ATOM 0 HA ASP A 52 -8.164 -3.036 -13.227 1.00 1.13 H new ATOM 0 HB2 ASP A 52 -6.948 -4.937 -11.197 1.00 23.04 H new ATOM 0 HB3 ASP A 52 -8.121 -5.362 -12.428 1.00 23.04 H new ATOM 765 N LEU A 53 -8.477 -2.726 -10.026 1.00 72.41 N ATOM 766 CA LEU A 53 -9.356 -2.487 -8.927 1.00 43.25 C ATOM 767 C LEU A 53 -10.165 -1.227 -9.156 1.00 41.34 C ATOM 768 O LEU A 53 -11.394 -1.243 -8.965 1.00 34.30 O ATOM 769 CB LEU A 53 -8.558 -2.406 -7.628 1.00 35.21 C ATOM 770 CG LEU A 53 -8.038 -3.728 -7.079 1.00 72.35 C ATOM 771 CD1 LEU A 53 -7.042 -3.494 -5.961 1.00 4.41 C ATOM 772 CD2 LEU A 53 -9.205 -4.577 -6.594 1.00 55.32 C ATOM 0 H LEU A 53 -7.492 -2.587 -9.799 1.00 72.41 H new ATOM 0 HA LEU A 53 -10.056 -3.318 -8.846 1.00 43.25 H new ATOM 0 HB2 LEU A 53 -7.708 -1.743 -7.788 1.00 35.21 H new ATOM 0 HB3 LEU A 53 -9.186 -1.942 -6.868 1.00 35.21 H new ATOM 0 HG LEU A 53 -7.521 -4.261 -7.877 1.00 72.35 H new ATOM 0 HD11 LEU A 53 -6.685 -4.453 -5.585 1.00 4.41 H new ATOM 0 HD12 LEU A 53 -6.199 -2.916 -6.340 1.00 4.41 H new ATOM 0 HD13 LEU A 53 -7.525 -2.945 -5.153 1.00 4.41 H new ATOM 0 HD21 LEU A 53 -8.829 -5.522 -6.202 1.00 55.32 H new ATOM 0 HD22 LEU A 53 -9.740 -4.045 -5.807 1.00 55.32 H new ATOM 0 HD23 LEU A 53 -9.883 -4.773 -7.425 1.00 55.32 H new ATOM 784 N GLU A 54 -9.498 -0.130 -9.593 1.00 13.03 N ATOM 785 CA GLU A 54 -10.199 1.127 -9.837 1.00 4.24 C ATOM 786 C GLU A 54 -11.295 0.950 -10.843 1.00 21.21 C ATOM 787 O GLU A 54 -12.399 1.317 -10.587 1.00 23.44 O ATOM 788 CB GLU A 54 -9.268 2.181 -10.443 1.00 62.12 C ATOM 789 CG GLU A 54 -8.027 2.526 -9.676 1.00 12.21 C ATOM 790 CD GLU A 54 -7.244 3.608 -10.391 1.00 51.54 C ATOM 791 OE1 GLU A 54 -6.595 3.317 -11.430 1.00 75.52 O ATOM 792 OE2 GLU A 54 -7.283 4.781 -9.945 1.00 33.32 O ATOM 0 H GLU A 54 -8.495 -0.102 -9.777 1.00 13.03 H new ATOM 0 HA GLU A 54 -10.584 1.441 -8.867 1.00 4.24 H new ATOM 0 HB2 GLU A 54 -8.968 1.837 -11.433 1.00 62.12 H new ATOM 0 HB3 GLU A 54 -9.842 3.097 -10.585 1.00 62.12 H new ATOM 0 HG2 GLU A 54 -8.294 2.864 -8.674 1.00 12.21 H new ATOM 0 HG3 GLU A 54 -7.407 1.638 -9.558 1.00 12.21 H new ATOM 799 N ALA A 55 -10.982 0.344 -11.968 1.00 63.53 N ATOM 800 CA ALA A 55 -11.961 0.192 -13.037 1.00 12.13 C ATOM 801 C ALA A 55 -13.218 -0.546 -12.577 1.00 31.41 C ATOM 802 O ALA A 55 -14.371 -0.055 -12.737 1.00 41.24 O ATOM 803 CB ALA A 55 -11.339 -0.500 -14.240 1.00 24.05 C ATOM 0 H ALA A 55 -10.064 -0.052 -12.171 1.00 63.53 H new ATOM 0 HA ALA A 55 -12.272 1.195 -13.330 1.00 12.13 H new ATOM 0 HB1 ALA A 55 -12.086 -0.604 -15.027 1.00 24.05 H new ATOM 0 HB2 ALA A 55 -10.503 0.094 -14.610 1.00 24.05 H new ATOM 0 HB3 ALA A 55 -10.981 -1.487 -13.947 1.00 24.05 H new ATOM 809 N HIS A 56 -12.993 -1.653 -11.915 1.00 70.33 N ATOM 810 CA HIS A 56 -14.068 -2.513 -11.505 1.00 73.23 C ATOM 811 C HIS A 56 -14.906 -1.861 -10.402 1.00 23.13 C ATOM 812 O HIS A 56 -16.129 -1.950 -10.408 1.00 5.23 O ATOM 813 CB HIS A 56 -13.517 -3.882 -11.080 1.00 2.20 C ATOM 814 CG HIS A 56 -14.561 -4.916 -10.784 1.00 0.54 C ATOM 815 ND1 HIS A 56 -15.228 -5.602 -11.765 1.00 55.41 N ATOM 816 CD2 HIS A 56 -15.035 -5.388 -9.615 1.00 42.12 C ATOM 817 CE1 HIS A 56 -16.063 -6.451 -11.221 1.00 44.54 C ATOM 818 NE2 HIS A 56 -15.967 -6.345 -9.914 1.00 32.50 N ATOM 0 H HIS A 56 -12.064 -1.980 -11.648 1.00 70.33 H new ATOM 0 HA HIS A 56 -14.735 -2.672 -12.353 1.00 73.23 H new ATOM 0 HB2 HIS A 56 -12.868 -4.258 -11.871 1.00 2.20 H new ATOM 0 HB3 HIS A 56 -12.896 -3.749 -10.194 1.00 2.20 H new ATOM 0 HD2 HIS A 56 -14.736 -5.071 -8.627 1.00 42.12 H new ATOM 0 HE1 HIS A 56 -16.718 -7.123 -11.755 1.00 44.54 H new ATOM 0 HE2 HIS A 56 -16.500 -6.887 -9.234 1.00 32.50 H new ATOM 827 N PHE A 57 -14.254 -1.206 -9.467 1.00 3.11 N ATOM 828 CA PHE A 57 -14.952 -0.546 -8.381 1.00 2.34 C ATOM 829 C PHE A 57 -15.487 0.824 -8.719 1.00 10.40 C ATOM 830 O PHE A 57 -16.421 1.301 -8.089 1.00 21.11 O ATOM 831 CB PHE A 57 -14.195 -0.589 -7.078 1.00 2.04 C ATOM 832 CG PHE A 57 -14.242 -1.944 -6.482 1.00 41.51 C ATOM 833 CD1 PHE A 57 -15.390 -2.365 -5.858 1.00 74.02 C ATOM 834 CD2 PHE A 57 -13.178 -2.807 -6.566 1.00 74.13 C ATOM 835 CE1 PHE A 57 -15.480 -3.620 -5.317 1.00 32.32 C ATOM 836 CE2 PHE A 57 -13.267 -4.069 -6.029 1.00 11.13 C ATOM 837 CZ PHE A 57 -14.419 -4.471 -5.405 1.00 12.23 C ATOM 0 H PHE A 57 -13.239 -1.115 -9.435 1.00 3.11 H new ATOM 0 HA PHE A 57 -15.847 -1.149 -8.226 1.00 2.34 H new ATOM 0 HB2 PHE A 57 -13.158 -0.297 -7.246 1.00 2.04 H new ATOM 0 HB3 PHE A 57 -14.621 0.134 -6.382 1.00 2.04 H new ATOM 0 HD1 PHE A 57 -16.235 -1.696 -5.793 1.00 74.02 H new ATOM 0 HD2 PHE A 57 -12.268 -2.493 -7.056 1.00 74.13 H new ATOM 0 HE1 PHE A 57 -16.388 -3.934 -4.823 1.00 32.32 H new ATOM 0 HE2 PHE A 57 -12.428 -4.745 -6.099 1.00 11.13 H new ATOM 0 HZ PHE A 57 -14.486 -5.463 -4.983 1.00 12.23 H new ATOM 847 N SER A 58 -14.909 1.450 -9.716 1.00 74.44 N ATOM 848 CA SER A 58 -15.314 2.778 -10.109 1.00 22.34 C ATOM 849 C SER A 58 -16.666 2.721 -10.766 1.00 63.15 C ATOM 850 O SER A 58 -17.381 3.715 -10.808 1.00 21.31 O ATOM 851 CB SER A 58 -14.288 3.465 -11.006 1.00 5.35 C ATOM 852 OG SER A 58 -14.681 4.794 -11.330 1.00 53.43 O ATOM 0 H SER A 58 -14.151 1.057 -10.274 1.00 74.44 H new ATOM 0 HA SER A 58 -15.379 3.387 -9.207 1.00 22.34 H new ATOM 0 HB2 SER A 58 -13.320 3.483 -10.505 1.00 5.35 H new ATOM 0 HB3 SER A 58 -14.162 2.889 -11.923 1.00 5.35 H new ATOM 0 HG SER A 58 -14.001 5.205 -11.904 1.00 53.43 H new ATOM 858 N SER A 59 -17.017 1.552 -11.304 1.00 64.32 N ATOM 859 CA SER A 59 -18.354 1.342 -11.817 1.00 42.43 C ATOM 860 C SER A 59 -19.380 1.592 -10.672 1.00 12.34 C ATOM 861 O SER A 59 -20.482 2.088 -10.905 1.00 33.21 O ATOM 862 CB SER A 59 -18.472 -0.117 -12.323 1.00 40.55 C ATOM 863 OG SER A 59 -19.737 -0.388 -12.929 1.00 44.23 O ATOM 0 H SER A 59 -16.395 0.749 -11.391 1.00 64.32 H new ATOM 0 HA SER A 59 -18.558 2.028 -12.639 1.00 42.43 H new ATOM 0 HB2 SER A 59 -17.678 -0.313 -13.044 1.00 40.55 H new ATOM 0 HB3 SER A 59 -18.319 -0.801 -11.488 1.00 40.55 H new ATOM 0 HG SER A 59 -19.761 -1.319 -13.233 1.00 44.23 H new ATOM 869 N CYS A 60 -18.973 1.295 -9.443 1.00 63.11 N ATOM 870 CA CYS A 60 -19.826 1.431 -8.278 1.00 42.00 C ATOM 871 C CYS A 60 -19.716 2.828 -7.614 1.00 1.31 C ATOM 872 O CYS A 60 -20.418 3.103 -6.633 1.00 14.31 O ATOM 873 CB CYS A 60 -19.453 0.344 -7.271 1.00 70.30 C ATOM 874 SG CYS A 60 -19.540 -1.330 -7.947 1.00 42.33 S ATOM 0 H CYS A 60 -18.036 0.952 -9.230 1.00 63.11 H new ATOM 0 HA CYS A 60 -20.861 1.321 -8.603 1.00 42.00 H new ATOM 0 HB2 CYS A 60 -18.442 0.528 -6.908 1.00 70.30 H new ATOM 0 HB3 CYS A 60 -20.118 0.414 -6.410 1.00 70.30 H new ATOM 0 HG CYS A 60 -20.398 -2.029 -7.265 1.00 42.33 H new ATOM 880 N GLY A 61 -18.884 3.705 -8.157 1.00 24.44 N ATOM 881 CA GLY A 61 -18.713 5.011 -7.536 1.00 53.12 C ATOM 882 C GLY A 61 -17.333 5.610 -7.707 1.00 51.34 C ATOM 883 O GLY A 61 -16.508 5.103 -8.464 1.00 52.21 O ATOM 0 H GLY A 61 -18.332 3.545 -9.000 1.00 24.44 H new ATOM 0 HA2 GLY A 61 -19.448 5.698 -7.955 1.00 53.12 H new ATOM 0 HA3 GLY A 61 -18.929 4.924 -6.471 1.00 53.12 H new ATOM 887 N SER A 62 -17.081 6.684 -6.989 1.00 40.52 N ATOM 888 CA SER A 62 -15.832 7.398 -7.079 1.00 55.51 C ATOM 889 C SER A 62 -14.875 6.938 -5.984 1.00 45.21 C ATOM 890 O SER A 62 -15.200 6.979 -4.792 1.00 34.34 O ATOM 891 CB SER A 62 -16.093 8.894 -6.957 1.00 32.04 C ATOM 892 OG SER A 62 -17.026 9.315 -7.940 1.00 5.10 O ATOM 0 H SER A 62 -17.742 7.086 -6.324 1.00 40.52 H new ATOM 0 HA SER A 62 -15.371 7.190 -8.045 1.00 55.51 H new ATOM 0 HB2 SER A 62 -16.475 9.123 -5.962 1.00 32.04 H new ATOM 0 HB3 SER A 62 -15.159 9.443 -7.074 1.00 32.04 H new ATOM 0 HG SER A 62 -17.185 10.278 -7.849 1.00 5.10 H new ATOM 898 N ILE A 63 -13.727 6.488 -6.390 1.00 32.03 N ATOM 899 CA ILE A 63 -12.712 6.006 -5.481 1.00 52.05 C ATOM 900 C ILE A 63 -11.754 7.139 -5.079 1.00 53.20 C ATOM 901 O ILE A 63 -11.174 7.806 -5.942 1.00 5.35 O ATOM 902 CB ILE A 63 -11.914 4.870 -6.155 1.00 43.31 C ATOM 903 CG1 ILE A 63 -12.858 3.725 -6.550 1.00 4.51 C ATOM 904 CG2 ILE A 63 -10.809 4.369 -5.241 1.00 61.34 C ATOM 905 CD1 ILE A 63 -12.186 2.602 -7.300 1.00 55.05 C ATOM 0 H ILE A 63 -13.458 6.441 -7.373 1.00 32.03 H new ATOM 0 HA ILE A 63 -13.202 5.632 -4.582 1.00 52.05 H new ATOM 0 HB ILE A 63 -11.447 5.262 -7.058 1.00 43.31 H new ATOM 0 HG12 ILE A 63 -13.318 3.321 -5.648 1.00 4.51 H new ATOM 0 HG13 ILE A 63 -13.662 4.128 -7.165 1.00 4.51 H new ATOM 0 HG21 ILE A 63 -10.261 3.569 -5.738 1.00 61.34 H new ATOM 0 HG22 ILE A 63 -10.127 5.188 -5.012 1.00 61.34 H new ATOM 0 HG23 ILE A 63 -11.245 3.990 -4.317 1.00 61.34 H new ATOM 0 HD11 ILE A 63 -12.921 1.835 -7.541 1.00 55.05 H new ATOM 0 HD12 ILE A 63 -11.750 2.989 -8.221 1.00 55.05 H new ATOM 0 HD13 ILE A 63 -11.400 2.170 -6.680 1.00 55.05 H new ATOM 917 N ASN A 64 -11.608 7.363 -3.781 1.00 11.54 N ATOM 918 CA ASN A 64 -10.672 8.384 -3.288 1.00 22.55 C ATOM 919 C ASN A 64 -9.319 7.813 -3.018 1.00 74.33 C ATOM 920 O ASN A 64 -8.307 8.467 -3.219 1.00 12.34 O ATOM 921 CB ASN A 64 -11.108 9.075 -1.971 1.00 23.33 C ATOM 922 CG ASN A 64 -12.264 10.021 -2.069 1.00 23.50 C ATOM 923 OD1 ASN A 64 -13.379 9.653 -1.541 1.00 44.41 O flip ATOM 924 ND2 ASN A 64 -12.102 11.150 -2.498 1.00 13.11 N flip ATOM 0 H ASN A 64 -12.115 6.862 -3.051 1.00 11.54 H new ATOM 0 HA ASN A 64 -10.658 9.116 -4.095 1.00 22.55 H new ATOM 0 HB2 ASN A 64 -11.360 8.301 -1.246 1.00 23.33 H new ATOM 0 HB3 ASN A 64 -10.253 9.620 -1.571 1.00 23.33 H new ATOM 0 HD21 ASN A 64 -11.208 11.415 -2.911 1.00 13.11 H new ATOM 0 HD22 ASN A 64 -12.860 11.830 -2.444 1.00 13.11 H new ATOM 931 N ARG A 65 -9.294 6.613 -2.556 1.00 1.04 N ATOM 932 CA ARG A 65 -8.085 6.074 -2.017 1.00 53.11 C ATOM 933 C ARG A 65 -8.182 4.557 -2.089 1.00 72.43 C ATOM 934 O ARG A 65 -9.281 4.033 -2.105 1.00 60.42 O ATOM 935 CB ARG A 65 -8.122 6.549 -0.558 1.00 43.21 C ATOM 936 CG ARG A 65 -6.858 7.097 0.041 1.00 64.35 C ATOM 937 CD ARG A 65 -5.830 6.052 0.286 1.00 54.10 C ATOM 938 NE ARG A 65 -4.824 6.579 1.185 1.00 65.51 N ATOM 939 CZ ARG A 65 -4.486 6.007 2.332 1.00 34.02 C ATOM 940 NH1 ARG A 65 -5.130 4.904 2.755 1.00 45.40 N ATOM 941 NH2 ARG A 65 -3.553 6.567 3.095 1.00 73.20 N ATOM 0 H ARG A 65 -10.095 5.981 -2.538 1.00 1.04 H new ATOM 0 HA ARG A 65 -7.173 6.377 -2.531 1.00 53.11 H new ATOM 0 HB2 ARG A 65 -8.890 7.318 -0.477 1.00 43.21 H new ATOM 0 HB3 ARG A 65 -8.446 5.710 0.058 1.00 43.21 H new ATOM 0 HG2 ARG A 65 -6.446 7.855 -0.625 1.00 64.35 H new ATOM 0 HG3 ARG A 65 -7.094 7.594 0.982 1.00 64.35 H new ATOM 0 HD2 ARG A 65 -6.292 5.164 0.717 1.00 54.10 H new ATOM 0 HD3 ARG A 65 -5.371 5.748 -0.655 1.00 54.10 H new ATOM 0 HE ARG A 65 -4.348 7.441 0.920 1.00 65.51 H new ATOM 0 HH11 ARG A 65 -5.881 4.505 2.192 1.00 45.40 H new ATOM 0 HH12 ARG A 65 -4.867 4.467 3.638 1.00 45.40 H new ATOM 0 HH21 ARG A 65 -3.102 7.432 2.797 1.00 73.20 H new ATOM 0 HH22 ARG A 65 -3.288 6.132 3.979 1.00 73.20 H new ATOM 955 N ILE A 66 -7.067 3.860 -2.174 1.00 11.51 N ATOM 956 CA ILE A 66 -7.082 2.397 -2.130 1.00 73.22 C ATOM 957 C ILE A 66 -5.823 1.892 -1.487 1.00 61.13 C ATOM 958 O ILE A 66 -4.745 2.470 -1.661 1.00 62.23 O ATOM 959 CB ILE A 66 -7.292 1.630 -3.507 1.00 22.44 C ATOM 960 CG1 ILE A 66 -6.183 1.903 -4.508 1.00 43.12 C ATOM 961 CG2 ILE A 66 -8.626 1.928 -4.145 1.00 22.43 C ATOM 962 CD1 ILE A 66 -6.357 1.141 -5.815 1.00 40.13 C ATOM 0 H ILE A 66 -6.140 4.273 -2.274 1.00 11.51 H new ATOM 0 HA ILE A 66 -7.975 2.172 -1.547 1.00 73.22 H new ATOM 0 HB ILE A 66 -7.265 0.573 -3.241 1.00 22.44 H new ATOM 0 HG12 ILE A 66 -6.148 2.972 -4.719 1.00 43.12 H new ATOM 0 HG13 ILE A 66 -5.225 1.634 -4.062 1.00 43.12 H new ATOM 0 HG21 ILE A 66 -8.713 1.377 -5.081 1.00 22.43 H new ATOM 0 HG22 ILE A 66 -9.427 1.626 -3.471 1.00 22.43 H new ATOM 0 HG23 ILE A 66 -8.703 2.997 -4.345 1.00 22.43 H new ATOM 0 HD11 ILE A 66 -5.533 1.379 -6.487 1.00 40.13 H new ATOM 0 HD12 ILE A 66 -6.363 0.070 -5.614 1.00 40.13 H new ATOM 0 HD13 ILE A 66 -7.300 1.428 -6.281 1.00 40.13 H new ATOM 974 N THR A 67 -5.959 0.844 -0.752 1.00 35.15 N ATOM 975 CA THR A 67 -4.856 0.211 -0.096 1.00 11.54 C ATOM 976 C THR A 67 -4.863 -1.253 -0.489 1.00 72.33 C ATOM 977 O THR A 67 -5.859 -1.930 -0.301 1.00 43.21 O ATOM 978 CB THR A 67 -4.961 0.388 1.438 1.00 72.44 C ATOM 979 OG1 THR A 67 -5.038 1.786 1.765 1.00 42.54 O ATOM 980 CG2 THR A 67 -3.770 -0.238 2.152 1.00 53.23 C ATOM 0 H THR A 67 -6.856 0.389 -0.583 1.00 35.15 H new ATOM 0 HA THR A 67 -3.915 0.668 -0.401 1.00 11.54 H new ATOM 0 HB THR A 67 -5.865 -0.120 1.773 1.00 72.44 H new ATOM 0 HG1 THR A 67 -5.959 2.099 1.647 1.00 42.54 H new ATOM 0 HG21 THR A 67 -3.875 -0.096 3.228 1.00 53.23 H new ATOM 0 HG22 THR A 67 -3.731 -1.304 1.929 1.00 53.23 H new ATOM 0 HG23 THR A 67 -2.850 0.238 1.811 1.00 53.23 H new ATOM 988 N ILE A 68 -3.778 -1.738 -1.036 1.00 24.11 N ATOM 989 CA ILE A 68 -3.719 -3.101 -1.502 1.00 21.45 C ATOM 990 C ILE A 68 -2.603 -3.751 -0.741 1.00 22.15 C ATOM 991 O ILE A 68 -1.484 -3.270 -0.776 1.00 71.21 O ATOM 992 CB ILE A 68 -3.364 -3.248 -3.036 1.00 51.53 C ATOM 993 CG1 ILE A 68 -4.107 -2.224 -3.908 1.00 31.32 C ATOM 994 CG2 ILE A 68 -3.700 -4.653 -3.523 1.00 54.54 C ATOM 995 CD1 ILE A 68 -3.434 -0.869 -3.959 1.00 54.13 C ATOM 0 H ILE A 68 -2.918 -1.206 -1.170 1.00 24.11 H new ATOM 0 HA ILE A 68 -4.703 -3.545 -1.354 1.00 21.45 H new ATOM 0 HB ILE A 68 -2.294 -3.061 -3.132 1.00 51.53 H new ATOM 0 HG12 ILE A 68 -4.192 -2.616 -4.921 1.00 31.32 H new ATOM 0 HG13 ILE A 68 -5.121 -2.103 -3.527 1.00 31.32 H new ATOM 0 HG21 ILE A 68 -3.451 -4.741 -4.580 1.00 54.54 H new ATOM 0 HG22 ILE A 68 -3.125 -5.383 -2.953 1.00 54.54 H new ATOM 0 HG23 ILE A 68 -4.765 -4.841 -3.384 1.00 54.54 H new ATOM 0 HD11 ILE A 68 -4.014 -0.198 -4.593 1.00 54.13 H new ATOM 0 HD12 ILE A 68 -3.373 -0.455 -2.953 1.00 54.13 H new ATOM 0 HD13 ILE A 68 -2.430 -0.977 -4.369 1.00 54.13 H new ATOM 1007 N LEU A 69 -2.883 -4.774 -0.033 1.00 54.41 N ATOM 1008 CA LEU A 69 -1.853 -5.447 0.699 1.00 33.12 C ATOM 1009 C LEU A 69 -1.717 -6.882 0.288 1.00 74.43 C ATOM 1010 O LEU A 69 -2.703 -7.620 0.199 1.00 50.41 O ATOM 1011 CB LEU A 69 -1.929 -5.267 2.240 1.00 12.13 C ATOM 1012 CG LEU A 69 -3.258 -5.569 2.956 1.00 75.43 C ATOM 1013 CD1 LEU A 69 -3.015 -5.626 4.446 1.00 61.41 C ATOM 1014 CD2 LEU A 69 -4.268 -4.468 2.681 1.00 73.33 C ATOM 0 H LEU A 69 -3.816 -5.175 0.064 1.00 54.41 H new ATOM 0 HA LEU A 69 -0.930 -4.941 0.418 1.00 33.12 H new ATOM 0 HB2 LEU A 69 -1.163 -5.902 2.685 1.00 12.13 H new ATOM 0 HB3 LEU A 69 -1.659 -4.235 2.466 1.00 12.13 H new ATOM 0 HG LEU A 69 -3.645 -6.520 2.590 1.00 75.43 H new ATOM 0 HD11 LEU A 69 -3.952 -5.840 4.960 1.00 61.41 H new ATOM 0 HD12 LEU A 69 -2.293 -6.412 4.667 1.00 61.41 H new ATOM 0 HD13 LEU A 69 -2.624 -4.668 4.788 1.00 61.41 H new ATOM 0 HD21 LEU A 69 -5.203 -4.695 3.194 1.00 73.33 H new ATOM 0 HD22 LEU A 69 -3.877 -3.517 3.043 1.00 73.33 H new ATOM 0 HD23 LEU A 69 -4.450 -4.401 1.608 1.00 73.33 H new ATOM 1026 N CYS A 70 -0.521 -7.274 0.012 1.00 50.14 N ATOM 1027 CA CYS A 70 -0.238 -8.614 -0.365 1.00 53.20 C ATOM 1028 C CYS A 70 0.566 -9.248 0.739 1.00 31.44 C ATOM 1029 O CYS A 70 1.709 -8.853 1.002 1.00 63.12 O ATOM 1030 CB CYS A 70 0.529 -8.639 -1.676 1.00 44.34 C ATOM 1031 SG CYS A 70 -0.329 -7.842 -3.053 1.00 41.32 S ATOM 0 H CYS A 70 0.297 -6.665 0.042 1.00 50.14 H new ATOM 0 HA CYS A 70 -1.163 -9.171 -0.514 1.00 53.20 H new ATOM 0 HB2 CYS A 70 1.492 -8.149 -1.530 1.00 44.34 H new ATOM 0 HB3 CYS A 70 0.736 -9.675 -1.943 1.00 44.34 H new ATOM 0 HG CYS A 70 0.483 -7.725 -4.061 1.00 41.32 H new ATOM 1037 N ASP A 71 -0.028 -10.177 1.402 1.00 52.42 N ATOM 1038 CA ASP A 71 0.581 -10.835 2.515 1.00 23.30 C ATOM 1039 C ASP A 71 1.074 -12.178 2.060 1.00 41.25 C ATOM 1040 O ASP A 71 0.299 -12.997 1.586 1.00 42.51 O ATOM 1041 CB ASP A 71 -0.454 -11.019 3.613 1.00 50.43 C ATOM 1042 CG ASP A 71 0.120 -11.570 4.887 1.00 12.04 C ATOM 1043 OD1 ASP A 71 0.411 -12.778 4.954 1.00 65.33 O ATOM 1044 OD2 ASP A 71 0.247 -10.795 5.849 1.00 41.43 O ATOM 0 H ASP A 71 -0.967 -10.510 1.186 1.00 52.42 H new ATOM 0 HA ASP A 71 1.412 -10.243 2.899 1.00 23.30 H new ATOM 0 HB2 ASP A 71 -0.927 -10.059 3.821 1.00 50.43 H new ATOM 0 HB3 ASP A 71 -1.236 -11.689 3.256 1.00 50.43 H new ATOM 1049 N LYS A 72 2.341 -12.411 2.174 1.00 74.12 N ATOM 1050 CA LYS A 72 2.880 -13.654 1.729 1.00 40.41 C ATOM 1051 C LYS A 72 3.338 -14.471 2.953 1.00 22.55 C ATOM 1052 O LYS A 72 4.051 -15.472 2.831 1.00 20.44 O ATOM 1053 CB LYS A 72 4.025 -13.393 0.728 1.00 33.11 C ATOM 1054 CG LYS A 72 4.456 -14.601 -0.097 1.00 40.20 C ATOM 1055 CD LYS A 72 5.639 -14.276 -1.016 1.00 55.11 C ATOM 1056 CE LYS A 72 5.276 -13.217 -2.059 1.00 15.33 C ATOM 1057 NZ LYS A 72 6.389 -12.924 -2.974 1.00 74.42 N ATOM 0 H LYS A 72 3.019 -11.760 2.570 1.00 74.12 H new ATOM 0 HA LYS A 72 2.123 -14.238 1.205 1.00 40.41 H new ATOM 0 HB2 LYS A 72 3.717 -12.600 0.047 1.00 33.11 H new ATOM 0 HB3 LYS A 72 4.890 -13.022 1.279 1.00 33.11 H new ATOM 0 HG2 LYS A 72 4.730 -15.417 0.571 1.00 40.20 H new ATOM 0 HG3 LYS A 72 3.615 -14.949 -0.697 1.00 40.20 H new ATOM 0 HD2 LYS A 72 6.478 -13.923 -0.417 1.00 55.11 H new ATOM 0 HD3 LYS A 72 5.968 -15.185 -1.520 1.00 55.11 H new ATOM 0 HE2 LYS A 72 4.416 -13.559 -2.635 1.00 15.33 H new ATOM 0 HE3 LYS A 72 4.976 -12.300 -1.552 1.00 15.33 H new ATOM 0 HZ1 LYS A 72 6.031 -12.406 -3.802 1.00 74.42 H new ATOM 0 HZ2 LYS A 72 7.099 -12.344 -2.483 1.00 74.42 H new ATOM 0 HZ3 LYS A 72 6.826 -13.815 -3.286 1.00 74.42 H new ATOM 1071 N PHE A 73 2.870 -14.058 4.150 1.00 0.33 N ATOM 1072 CA PHE A 73 3.162 -14.785 5.393 1.00 60.14 C ATOM 1073 C PHE A 73 2.481 -16.137 5.409 1.00 51.34 C ATOM 1074 O PHE A 73 2.842 -17.024 6.175 1.00 34.40 O ATOM 1075 CB PHE A 73 2.770 -13.995 6.655 1.00 31.14 C ATOM 1076 CG PHE A 73 3.705 -12.896 7.061 1.00 34.21 C ATOM 1077 CD1 PHE A 73 4.993 -13.199 7.462 1.00 70.54 C ATOM 1078 CD2 PHE A 73 3.304 -11.578 7.071 1.00 12.44 C ATOM 1079 CE1 PHE A 73 5.859 -12.212 7.860 1.00 20.33 C ATOM 1080 CE2 PHE A 73 4.174 -10.583 7.476 1.00 50.40 C ATOM 1081 CZ PHE A 73 5.451 -10.901 7.869 1.00 15.02 C ATOM 0 H PHE A 73 2.291 -13.228 4.277 1.00 0.33 H new ATOM 0 HA PHE A 73 4.243 -14.922 5.412 1.00 60.14 H new ATOM 0 HB2 PHE A 73 1.782 -13.564 6.497 1.00 31.14 H new ATOM 0 HB3 PHE A 73 2.683 -14.696 7.485 1.00 31.14 H new ATOM 0 HD1 PHE A 73 5.322 -14.228 7.462 1.00 70.54 H new ATOM 0 HD2 PHE A 73 2.302 -11.320 6.760 1.00 12.44 H new ATOM 0 HE1 PHE A 73 6.863 -12.467 8.167 1.00 20.33 H new ATOM 0 HE2 PHE A 73 3.849 -9.553 7.483 1.00 50.40 H new ATOM 0 HZ PHE A 73 6.131 -10.123 8.184 1.00 15.02 H new ATOM 1091 N SER A 74 1.503 -16.291 4.565 1.00 51.33 N ATOM 1092 CA SER A 74 0.804 -17.545 4.448 1.00 1.22 C ATOM 1093 C SER A 74 1.633 -18.557 3.621 1.00 42.03 C ATOM 1094 O SER A 74 1.284 -19.735 3.522 1.00 41.24 O ATOM 1095 CB SER A 74 -0.569 -17.316 3.814 1.00 63.21 C ATOM 1096 OG SER A 74 -1.327 -16.381 4.579 1.00 2.31 O ATOM 0 H SER A 74 1.166 -15.558 3.940 1.00 51.33 H new ATOM 0 HA SER A 74 0.663 -17.965 5.444 1.00 1.22 H new ATOM 0 HB2 SER A 74 -0.448 -16.947 2.796 1.00 63.21 H new ATOM 0 HB3 SER A 74 -1.107 -18.262 3.749 1.00 63.21 H new ATOM 0 HG SER A 74 -2.278 -16.478 4.365 1.00 2.31 H new ATOM 1102 N GLY A 75 2.740 -18.093 3.038 1.00 1.33 N ATOM 1103 CA GLY A 75 3.572 -18.947 2.205 1.00 20.44 C ATOM 1104 C GLY A 75 3.236 -18.714 0.768 1.00 61.30 C ATOM 1105 O GLY A 75 4.095 -18.444 -0.059 1.00 70.54 O ATOM 0 H GLY A 75 3.076 -17.134 3.130 1.00 1.33 H new ATOM 0 HA2 GLY A 75 4.626 -18.733 2.383 1.00 20.44 H new ATOM 0 HA3 GLY A 75 3.411 -19.994 2.463 1.00 20.44 H new ATOM 1109 N HIS A 76 1.979 -18.789 0.500 1.00 1.33 N ATOM 1110 CA HIS A 76 1.455 -18.480 -0.796 1.00 23.33 C ATOM 1111 C HIS A 76 0.992 -17.053 -0.717 1.00 74.13 C ATOM 1112 O HIS A 76 0.373 -16.675 0.285 1.00 51.24 O ATOM 1113 CB HIS A 76 0.322 -19.426 -1.209 1.00 33.13 C ATOM 1114 CG HIS A 76 0.760 -20.854 -1.368 1.00 51.42 C ATOM 1115 ND1 HIS A 76 0.595 -21.805 -0.392 1.00 24.11 N ATOM 1116 CD2 HIS A 76 1.365 -21.488 -2.402 1.00 44.22 C ATOM 1117 CE1 HIS A 76 1.076 -22.954 -0.810 1.00 14.11 C ATOM 1118 NE2 HIS A 76 1.550 -22.793 -2.027 1.00 73.54 N ATOM 0 H HIS A 76 1.272 -19.070 1.180 1.00 1.33 H new ATOM 0 HA HIS A 76 2.216 -18.611 -1.565 1.00 23.33 H new ATOM 0 HB2 HIS A 76 -0.470 -19.379 -0.462 1.00 33.13 H new ATOM 0 HB3 HIS A 76 -0.106 -19.079 -2.150 1.00 33.13 H new ATOM 0 HD2 HIS A 76 1.649 -21.047 -3.346 1.00 44.22 H new ATOM 0 HE1 HIS A 76 1.081 -23.877 -0.249 1.00 14.11 H new ATOM 0 HE2 HIS A 76 1.983 -23.519 -2.597 1.00 73.54 H new ATOM 1127 N PRO A 77 1.309 -16.223 -1.706 1.00 23.01 N ATOM 1128 CA PRO A 77 0.975 -14.807 -1.641 1.00 21.43 C ATOM 1129 C PRO A 77 -0.526 -14.568 -1.673 1.00 43.34 C ATOM 1130 O PRO A 77 -1.207 -14.935 -2.637 1.00 73.35 O ATOM 1131 CB PRO A 77 1.667 -14.227 -2.885 1.00 42.03 C ATOM 1132 CG PRO A 77 1.807 -15.375 -3.824 1.00 1.14 C ATOM 1133 CD PRO A 77 1.999 -16.587 -2.963 1.00 40.12 C ATOM 0 HA PRO A 77 1.302 -14.342 -0.711 1.00 21.43 H new ATOM 0 HB2 PRO A 77 1.075 -13.426 -3.328 1.00 42.03 H new ATOM 0 HB3 PRO A 77 2.639 -13.803 -2.633 1.00 42.03 H new ATOM 0 HG2 PRO A 77 0.921 -15.477 -4.451 1.00 1.14 H new ATOM 0 HG3 PRO A 77 2.656 -15.232 -4.492 1.00 1.14 H new ATOM 0 HD2 PRO A 77 1.564 -17.477 -3.418 1.00 40.12 H new ATOM 0 HD3 PRO A 77 3.055 -16.799 -2.796 1.00 40.12 H new ATOM 1141 N LYS A 78 -1.027 -13.983 -0.605 1.00 72.22 N ATOM 1142 CA LYS A 78 -2.414 -13.648 -0.464 1.00 2.41 C ATOM 1143 C LYS A 78 -2.591 -12.187 -0.748 1.00 5.43 C ATOM 1144 O LYS A 78 -1.751 -11.374 -0.364 1.00 74.42 O ATOM 1145 CB LYS A 78 -2.847 -13.900 0.983 1.00 22.40 C ATOM 1146 CG LYS A 78 -2.651 -15.328 1.476 1.00 50.24 C ATOM 1147 CD LYS A 78 -3.514 -16.326 0.724 1.00 43.35 C ATOM 1148 CE LYS A 78 -5.000 -16.001 0.856 1.00 4.34 C ATOM 1149 NZ LYS A 78 -5.437 -15.939 2.271 1.00 43.33 N ATOM 0 H LYS A 78 -0.461 -13.725 0.204 1.00 72.22 H new ATOM 0 HA LYS A 78 -3.007 -14.251 -1.152 1.00 2.41 H new ATOM 0 HB2 LYS A 78 -2.290 -13.227 1.635 1.00 22.40 H new ATOM 0 HB3 LYS A 78 -3.901 -13.639 1.081 1.00 22.40 H new ATOM 0 HG2 LYS A 78 -1.602 -15.605 1.368 1.00 50.24 H new ATOM 0 HG3 LYS A 78 -2.886 -15.378 2.539 1.00 50.24 H new ATOM 0 HD2 LYS A 78 -3.234 -16.328 -0.329 1.00 43.35 H new ATOM 0 HD3 LYS A 78 -3.326 -17.330 1.105 1.00 43.35 H new ATOM 0 HE2 LYS A 78 -5.206 -15.046 0.372 1.00 4.34 H new ATOM 0 HE3 LYS A 78 -5.583 -16.757 0.330 1.00 4.34 H new ATOM 0 HZ1 LYS A 78 -6.475 -15.885 2.312 1.00 43.33 H new ATOM 0 HZ2 LYS A 78 -5.115 -16.792 2.772 1.00 43.33 H new ATOM 0 HZ3 LYS A 78 -5.029 -15.096 2.724 1.00 43.33 H new ATOM 1163 N GLY A 79 -3.646 -11.847 -1.396 1.00 30.40 N ATOM 1164 CA GLY A 79 -3.892 -10.485 -1.667 1.00 3.45 C ATOM 1165 C GLY A 79 -5.258 -10.047 -1.237 1.00 51.12 C ATOM 1166 O GLY A 79 -6.251 -10.788 -1.379 1.00 34.40 O ATOM 0 H GLY A 79 -4.351 -12.496 -1.747 1.00 30.40 H new ATOM 0 HA2 GLY A 79 -3.143 -9.877 -1.159 1.00 3.45 H new ATOM 0 HA3 GLY A 79 -3.777 -10.305 -2.736 1.00 3.45 H new ATOM 1170 N TYR A 80 -5.308 -8.868 -0.707 1.00 24.02 N ATOM 1171 CA TYR A 80 -6.519 -8.230 -0.307 1.00 55.34 C ATOM 1172 C TYR A 80 -6.332 -6.750 -0.276 1.00 24.05 C ATOM 1173 O TYR A 80 -5.250 -6.255 0.008 1.00 24.43 O ATOM 1174 CB TYR A 80 -7.186 -8.836 0.970 1.00 51.33 C ATOM 1175 CG TYR A 80 -6.335 -8.973 2.215 1.00 74.03 C ATOM 1176 CD1 TYR A 80 -5.289 -9.875 2.250 1.00 52.45 C ATOM 1177 CD2 TYR A 80 -6.613 -8.238 3.363 1.00 50.23 C ATOM 1178 CE1 TYR A 80 -4.526 -10.046 3.385 1.00 12.11 C ATOM 1179 CE2 TYR A 80 -5.858 -8.396 4.517 1.00 31.52 C ATOM 1180 CZ TYR A 80 -4.808 -9.311 4.518 1.00 12.20 C ATOM 1181 OH TYR A 80 -4.027 -9.484 5.642 1.00 60.33 O ATOM 0 H TYR A 80 -4.476 -8.303 -0.535 1.00 24.02 H new ATOM 0 HA TYR A 80 -7.268 -8.444 -1.069 1.00 55.34 H new ATOM 0 HB2 TYR A 80 -8.049 -8.220 1.221 1.00 51.33 H new ATOM 0 HB3 TYR A 80 -7.564 -9.825 0.713 1.00 51.33 H new ATOM 0 HD1 TYR A 80 -5.064 -10.458 1.369 1.00 52.45 H new ATOM 0 HD2 TYR A 80 -7.430 -7.532 3.356 1.00 50.23 H new ATOM 0 HE1 TYR A 80 -3.710 -10.753 3.387 1.00 12.11 H new ATOM 0 HE2 TYR A 80 -6.082 -7.818 5.401 1.00 31.52 H new ATOM 0 HH TYR A 80 -4.348 -8.896 6.357 1.00 60.33 H new ATOM 1191 N ALA A 81 -7.356 -6.055 -0.584 1.00 10.34 N ATOM 1192 CA ALA A 81 -7.292 -4.654 -0.755 1.00 52.43 C ATOM 1193 C ALA A 81 -8.497 -4.033 -0.154 1.00 11.33 C ATOM 1194 O ALA A 81 -9.523 -4.664 0.007 1.00 74.44 O ATOM 1195 CB ALA A 81 -7.235 -4.329 -2.239 1.00 24.01 C ATOM 0 H ALA A 81 -8.285 -6.451 -0.728 1.00 10.34 H new ATOM 0 HA ALA A 81 -6.400 -4.263 -0.266 1.00 52.43 H new ATOM 0 HB1 ALA A 81 -7.186 -3.248 -2.373 1.00 24.01 H new ATOM 0 HB2 ALA A 81 -6.351 -4.790 -2.679 1.00 24.01 H new ATOM 0 HB3 ALA A 81 -8.128 -4.715 -2.731 1.00 24.01 H new ATOM 1201 N TYR A 82 -8.361 -2.830 0.206 1.00 63.13 N ATOM 1202 CA TYR A 82 -9.429 -2.074 0.713 1.00 45.11 C ATOM 1203 C TYR A 82 -9.609 -0.883 -0.156 1.00 3.12 C ATOM 1204 O TYR A 82 -8.709 -0.044 -0.280 1.00 22.31 O ATOM 1205 CB TYR A 82 -9.197 -1.702 2.172 1.00 4.32 C ATOM 1206 CG TYR A 82 -9.241 -2.899 3.108 1.00 43.13 C ATOM 1207 CD1 TYR A 82 -8.137 -3.711 3.290 1.00 32.22 C ATOM 1208 CD2 TYR A 82 -10.392 -3.204 3.809 1.00 31.32 C ATOM 1209 CE1 TYR A 82 -8.184 -4.789 4.146 1.00 42.53 C ATOM 1210 CE2 TYR A 82 -10.451 -4.279 4.676 1.00 43.34 C ATOM 1211 CZ TYR A 82 -9.340 -5.064 4.833 1.00 13.12 C ATOM 1212 OH TYR A 82 -9.376 -6.117 5.684 1.00 10.41 O ATOM 0 H TYR A 82 -7.478 -2.322 0.157 1.00 63.13 H new ATOM 0 HA TYR A 82 -10.347 -2.662 0.700 1.00 45.11 H new ATOM 0 HB2 TYR A 82 -8.228 -1.211 2.266 1.00 4.32 H new ATOM 0 HB3 TYR A 82 -9.952 -0.979 2.481 1.00 4.32 H new ATOM 0 HD1 TYR A 82 -7.225 -3.497 2.753 1.00 32.22 H new ATOM 0 HD2 TYR A 82 -11.268 -2.587 3.676 1.00 31.32 H new ATOM 0 HE1 TYR A 82 -7.314 -5.416 4.276 1.00 42.53 H new ATOM 0 HE2 TYR A 82 -11.358 -4.496 5.220 1.00 43.34 H new ATOM 0 HH TYR A 82 -10.123 -6.704 5.446 1.00 10.41 H new ATOM 1222 N ILE A 83 -10.737 -0.829 -0.790 1.00 13.11 N ATOM 1223 CA ILE A 83 -11.037 0.211 -1.723 1.00 64.41 C ATOM 1224 C ILE A 83 -11.822 1.267 -0.982 1.00 40.35 C ATOM 1225 O ILE A 83 -12.886 0.982 -0.427 1.00 34.12 O ATOM 1226 CB ILE A 83 -11.865 -0.353 -2.915 1.00 24.10 C ATOM 1227 CG1 ILE A 83 -11.188 -1.599 -3.531 1.00 21.23 C ATOM 1228 CG2 ILE A 83 -12.092 0.706 -3.976 1.00 53.25 C ATOM 1229 CD1 ILE A 83 -9.816 -1.370 -4.118 1.00 51.32 C ATOM 0 H ILE A 83 -11.484 -1.513 -0.673 1.00 13.11 H new ATOM 0 HA ILE A 83 -10.121 0.636 -2.134 1.00 64.41 H new ATOM 0 HB ILE A 83 -12.836 -0.655 -2.521 1.00 24.10 H new ATOM 0 HG12 ILE A 83 -11.111 -2.367 -2.761 1.00 21.23 H new ATOM 0 HG13 ILE A 83 -11.837 -1.995 -4.312 1.00 21.23 H new ATOM 0 HG21 ILE A 83 -12.673 0.282 -4.795 1.00 53.25 H new ATOM 0 HG22 ILE A 83 -12.636 1.545 -3.542 1.00 53.25 H new ATOM 0 HG23 ILE A 83 -11.131 1.053 -4.355 1.00 53.25 H new ATOM 0 HD11 ILE A 83 -9.432 -2.307 -4.522 1.00 51.32 H new ATOM 0 HD12 ILE A 83 -9.880 -0.630 -4.915 1.00 51.32 H new ATOM 0 HD13 ILE A 83 -9.143 -1.008 -3.340 1.00 51.32 H new ATOM 1241 N GLU A 84 -11.286 2.445 -0.927 1.00 54.21 N ATOM 1242 CA GLU A 84 -11.868 3.505 -0.162 1.00 43.24 C ATOM 1243 C GLU A 84 -12.621 4.476 -1.110 1.00 51.54 C ATOM 1244 O GLU A 84 -12.018 5.105 -2.006 1.00 51.31 O ATOM 1245 CB GLU A 84 -10.706 4.179 0.610 1.00 51.32 C ATOM 1246 CG GLU A 84 -9.859 3.133 1.408 1.00 64.30 C ATOM 1247 CD GLU A 84 -8.673 3.695 2.189 1.00 62.00 C ATOM 1248 OE1 GLU A 84 -8.864 4.048 3.370 1.00 14.54 O ATOM 1249 OE2 GLU A 84 -7.528 3.757 1.636 1.00 1.41 O ATOM 0 H GLU A 84 -10.427 2.701 -1.414 1.00 54.21 H new ATOM 0 HA GLU A 84 -12.610 3.151 0.553 1.00 43.24 H new ATOM 0 HB2 GLU A 84 -10.062 4.710 -0.092 1.00 51.32 H new ATOM 0 HB3 GLU A 84 -11.109 4.922 1.298 1.00 51.32 H new ATOM 0 HG2 GLU A 84 -10.518 2.617 2.106 1.00 64.30 H new ATOM 0 HG3 GLU A 84 -9.487 2.385 0.708 1.00 64.30 H new ATOM 1256 N PHE A 85 -13.932 4.596 -0.919 1.00 4.32 N ATOM 1257 CA PHE A 85 -14.779 5.371 -1.825 1.00 41.34 C ATOM 1258 C PHE A 85 -15.149 6.728 -1.282 1.00 22.11 C ATOM 1259 O PHE A 85 -14.885 7.060 -0.140 1.00 51.14 O ATOM 1260 CB PHE A 85 -16.078 4.635 -2.141 1.00 25.14 C ATOM 1261 CG PHE A 85 -15.934 3.328 -2.842 1.00 75.50 C ATOM 1262 CD1 PHE A 85 -15.818 3.281 -4.218 1.00 51.24 C ATOM 1263 CD2 PHE A 85 -15.946 2.147 -2.132 1.00 32.14 C ATOM 1264 CE1 PHE A 85 -15.710 2.077 -4.870 1.00 3.35 C ATOM 1265 CE2 PHE A 85 -15.844 0.942 -2.777 1.00 63.14 C ATOM 1266 CZ PHE A 85 -15.724 0.903 -4.146 1.00 44.40 C ATOM 0 H PHE A 85 -14.434 4.165 -0.142 1.00 4.32 H new ATOM 0 HA PHE A 85 -14.177 5.502 -2.724 1.00 41.34 H new ATOM 0 HB2 PHE A 85 -16.614 4.467 -1.207 1.00 25.14 H new ATOM 0 HB3 PHE A 85 -16.702 5.286 -2.753 1.00 25.14 H new ATOM 0 HD1 PHE A 85 -15.812 4.199 -4.786 1.00 51.24 H new ATOM 0 HD2 PHE A 85 -16.037 2.171 -1.056 1.00 32.14 H new ATOM 0 HE1 PHE A 85 -15.614 2.050 -5.945 1.00 3.35 H new ATOM 0 HE2 PHE A 85 -15.858 0.023 -2.210 1.00 63.14 H new ATOM 0 HZ PHE A 85 -15.641 -0.046 -4.654 1.00 44.40 H new ATOM 1276 N ALA A 86 -15.725 7.526 -2.159 1.00 3.30 N ATOM 1277 CA ALA A 86 -16.264 8.821 -1.818 1.00 61.31 C ATOM 1278 C ALA A 86 -17.567 8.722 -1.057 1.00 52.32 C ATOM 1279 O ALA A 86 -17.811 9.493 -0.147 1.00 62.10 O ATOM 1280 CB ALA A 86 -16.460 9.654 -3.075 1.00 12.12 C ATOM 0 H ALA A 86 -15.832 7.286 -3.144 1.00 3.30 H new ATOM 0 HA ALA A 86 -15.541 9.307 -1.163 1.00 61.31 H new ATOM 0 HB1 ALA A 86 -16.867 10.629 -2.806 1.00 12.12 H new ATOM 0 HB2 ALA A 86 -15.501 9.787 -3.577 1.00 12.12 H new ATOM 0 HB3 ALA A 86 -17.152 9.144 -3.745 1.00 12.12 H new ATOM 1286 N GLU A 87 -18.408 7.792 -1.427 1.00 53.43 N ATOM 1287 CA GLU A 87 -19.713 7.719 -0.802 1.00 30.10 C ATOM 1288 C GLU A 87 -20.020 6.357 -0.226 1.00 62.11 C ATOM 1289 O GLU A 87 -19.448 5.346 -0.628 1.00 43.31 O ATOM 1290 CB GLU A 87 -20.792 8.065 -1.817 1.00 52.43 C ATOM 1291 CG GLU A 87 -20.655 9.427 -2.450 1.00 2.25 C ATOM 1292 CD GLU A 87 -21.735 9.675 -3.455 1.00 21.25 C ATOM 1293 OE1 GLU A 87 -21.553 9.324 -4.633 1.00 24.22 O ATOM 1294 OE2 GLU A 87 -22.793 10.220 -3.080 1.00 43.32 O ATOM 0 H GLU A 87 -18.225 7.087 -2.141 1.00 53.43 H new ATOM 0 HA GLU A 87 -19.699 8.434 0.020 1.00 30.10 H new ATOM 0 HB2 GLU A 87 -20.784 7.312 -2.605 1.00 52.43 H new ATOM 0 HB3 GLU A 87 -21.764 8.004 -1.327 1.00 52.43 H new ATOM 0 HG2 GLU A 87 -20.693 10.194 -1.677 1.00 2.25 H new ATOM 0 HG3 GLU A 87 -19.681 9.509 -2.933 1.00 2.25 H new ATOM 1301 N ARG A 88 -20.965 6.354 0.705 1.00 75.12 N ATOM 1302 CA ARG A 88 -21.513 5.136 1.293 1.00 14.04 C ATOM 1303 C ARG A 88 -22.270 4.379 0.223 1.00 45.34 C ATOM 1304 O ARG A 88 -22.337 3.156 0.225 1.00 31.04 O ATOM 1305 CB ARG A 88 -22.492 5.506 2.405 1.00 74.45 C ATOM 1306 CG ARG A 88 -21.856 5.935 3.700 1.00 4.30 C ATOM 1307 CD ARG A 88 -21.340 4.724 4.453 1.00 42.03 C ATOM 1308 NE ARG A 88 -22.451 3.822 4.800 1.00 61.11 N ATOM 1309 CZ ARG A 88 -22.440 2.900 5.760 1.00 14.42 C ATOM 1310 NH1 ARG A 88 -21.331 2.665 6.459 1.00 71.35 N ATOM 1311 NH2 ARG A 88 -23.541 2.195 6.001 1.00 61.14 N ATOM 0 H ARG A 88 -21.379 7.208 1.079 1.00 75.12 H new ATOM 0 HA ARG A 88 -20.704 4.527 1.696 1.00 14.04 H new ATOM 0 HB2 ARG A 88 -23.134 6.312 2.049 1.00 74.45 H new ATOM 0 HB3 ARG A 88 -23.136 4.649 2.601 1.00 74.45 H new ATOM 0 HG2 ARG A 88 -21.036 6.625 3.501 1.00 4.30 H new ATOM 0 HG3 ARG A 88 -22.582 6.471 4.311 1.00 4.30 H new ATOM 0 HD2 ARG A 88 -20.609 4.193 3.843 1.00 42.03 H new ATOM 0 HD3 ARG A 88 -20.826 5.044 5.360 1.00 42.03 H new ATOM 0 HE ARG A 88 -23.308 3.912 4.254 1.00 61.11 H new ATOM 0 HH11 ARG A 88 -20.481 3.193 6.260 1.00 71.35 H new ATOM 0 HH12 ARG A 88 -21.331 1.957 7.193 1.00 71.35 H new ATOM 0 HH21 ARG A 88 -24.384 2.363 5.452 1.00 61.14 H new ATOM 0 HH22 ARG A 88 -23.542 1.486 6.735 1.00 61.14 H new ATOM 1325 N ASN A 89 -22.829 5.150 -0.690 1.00 54.22 N ATOM 1326 CA ASN A 89 -23.597 4.644 -1.822 1.00 64.21 C ATOM 1327 C ASN A 89 -22.753 3.709 -2.636 1.00 41.02 C ATOM 1328 O ASN A 89 -23.224 2.676 -3.110 1.00 54.10 O ATOM 1329 CB ASN A 89 -24.022 5.801 -2.722 1.00 2.30 C ATOM 1330 CG ASN A 89 -24.871 6.835 -2.018 1.00 1.12 C ATOM 1331 OD1 ASN A 89 -25.627 6.524 -1.104 1.00 34.35 O ATOM 1332 ND2 ASN A 89 -24.727 8.070 -2.408 1.00 71.13 N ATOM 0 H ASN A 89 -22.763 6.168 -0.669 1.00 54.22 H new ATOM 0 HA ASN A 89 -24.474 4.123 -1.437 1.00 64.21 H new ATOM 0 HB2 ASN A 89 -23.131 6.286 -3.122 1.00 2.30 H new ATOM 0 HB3 ASN A 89 -24.578 5.404 -3.572 1.00 2.30 H new ATOM 0 HD21 ASN A 89 -25.252 8.814 -1.949 1.00 71.13 H new ATOM 0 HD22 ASN A 89 -24.089 8.292 -3.172 1.00 71.13 H new ATOM 1339 N SER A 90 -21.489 4.058 -2.792 1.00 14.45 N ATOM 1340 CA SER A 90 -20.580 3.296 -3.574 1.00 73.54 C ATOM 1341 C SER A 90 -20.295 1.945 -2.926 1.00 54.51 C ATOM 1342 O SER A 90 -20.199 0.933 -3.621 1.00 41.31 O ATOM 1343 CB SER A 90 -19.294 4.092 -3.719 1.00 2.12 C ATOM 1344 OG SER A 90 -19.571 5.419 -4.174 1.00 51.32 O ATOM 0 H SER A 90 -21.077 4.889 -2.368 1.00 14.45 H new ATOM 0 HA SER A 90 -21.018 3.102 -4.553 1.00 73.54 H new ATOM 0 HB2 SER A 90 -18.775 4.131 -2.762 1.00 2.12 H new ATOM 0 HB3 SER A 90 -18.628 3.592 -4.423 1.00 2.12 H new ATOM 0 HG SER A 90 -18.732 5.917 -4.260 1.00 51.32 H new ATOM 1350 N VAL A 91 -20.186 1.917 -1.587 1.00 10.40 N ATOM 1351 CA VAL A 91 -19.902 0.661 -0.913 1.00 50.53 C ATOM 1352 C VAL A 91 -21.086 -0.244 -1.051 1.00 75.21 C ATOM 1353 O VAL A 91 -20.934 -1.416 -1.290 1.00 40.33 O ATOM 1354 CB VAL A 91 -19.481 0.795 0.601 1.00 52.23 C ATOM 1355 CG1 VAL A 91 -18.485 1.880 0.795 1.00 53.23 C ATOM 1356 CG2 VAL A 91 -20.639 0.884 1.602 1.00 74.24 C ATOM 0 H VAL A 91 -20.288 2.727 -0.976 1.00 10.40 H new ATOM 0 HA VAL A 91 -19.025 0.241 -1.405 1.00 50.53 H new ATOM 0 HB VAL A 91 -19.005 -0.156 0.840 1.00 52.23 H new ATOM 0 HG11 VAL A 91 -18.218 1.944 1.850 1.00 53.23 H new ATOM 0 HG12 VAL A 91 -17.593 1.664 0.207 1.00 53.23 H new ATOM 0 HG13 VAL A 91 -18.913 2.829 0.471 1.00 53.23 H new ATOM 0 HG21 VAL A 91 -20.240 0.973 2.613 1.00 74.24 H new ATOM 0 HG22 VAL A 91 -21.250 1.757 1.374 1.00 74.24 H new ATOM 0 HG23 VAL A 91 -21.251 -0.015 1.532 1.00 74.24 H new ATOM 1366 N ASP A 92 -22.274 0.342 -0.948 1.00 32.05 N ATOM 1367 CA ASP A 92 -23.539 -0.374 -1.056 1.00 73.13 C ATOM 1368 C ASP A 92 -23.632 -1.080 -2.408 1.00 3.33 C ATOM 1369 O ASP A 92 -24.126 -2.208 -2.515 1.00 11.32 O ATOM 1370 CB ASP A 92 -24.671 0.643 -0.905 1.00 23.13 C ATOM 1371 CG ASP A 92 -26.052 0.029 -0.844 1.00 72.00 C ATOM 1372 OD1 ASP A 92 -26.483 -0.387 0.253 1.00 54.24 O ATOM 1373 OD2 ASP A 92 -26.745 -0.012 -1.883 1.00 42.15 O ATOM 0 H ASP A 92 -22.386 1.343 -0.785 1.00 32.05 H new ATOM 0 HA ASP A 92 -23.612 -1.133 -0.277 1.00 73.13 H new ATOM 0 HB2 ASP A 92 -24.504 1.224 0.002 1.00 23.13 H new ATOM 0 HB3 ASP A 92 -24.632 1.340 -1.742 1.00 23.13 H new ATOM 1378 N ALA A 93 -23.148 -0.416 -3.430 1.00 64.23 N ATOM 1379 CA ALA A 93 -23.114 -0.966 -4.763 1.00 33.32 C ATOM 1380 C ALA A 93 -22.008 -2.032 -4.898 1.00 42.41 C ATOM 1381 O ALA A 93 -22.197 -3.060 -5.551 1.00 22.03 O ATOM 1382 CB ALA A 93 -22.926 0.146 -5.778 1.00 71.43 C ATOM 0 H ALA A 93 -22.765 0.527 -3.359 1.00 64.23 H new ATOM 0 HA ALA A 93 -24.066 -1.459 -4.958 1.00 33.32 H new ATOM 0 HB1 ALA A 93 -22.901 -0.278 -6.782 1.00 71.43 H new ATOM 0 HB2 ALA A 93 -23.753 0.851 -5.702 1.00 71.43 H new ATOM 0 HB3 ALA A 93 -21.988 0.664 -5.580 1.00 71.43 H new ATOM 1388 N ALA A 94 -20.872 -1.785 -4.254 1.00 3.21 N ATOM 1389 CA ALA A 94 -19.711 -2.672 -4.342 1.00 24.24 C ATOM 1390 C ALA A 94 -19.927 -3.967 -3.555 1.00 23.14 C ATOM 1391 O ALA A 94 -19.625 -5.049 -4.034 1.00 60.25 O ATOM 1392 CB ALA A 94 -18.457 -1.955 -3.855 1.00 1.51 C ATOM 0 H ALA A 94 -20.728 -0.969 -3.659 1.00 3.21 H new ATOM 0 HA ALA A 94 -19.580 -2.942 -5.390 1.00 24.24 H new ATOM 0 HB1 ALA A 94 -17.602 -2.628 -3.927 1.00 1.51 H new ATOM 0 HB2 ALA A 94 -18.278 -1.074 -4.472 1.00 1.51 H new ATOM 0 HB3 ALA A 94 -18.592 -1.649 -2.817 1.00 1.51 H new ATOM 1398 N VAL A 95 -20.442 -3.835 -2.341 1.00 33.01 N ATOM 1399 CA VAL A 95 -20.767 -4.979 -1.472 1.00 50.52 C ATOM 1400 C VAL A 95 -21.743 -5.950 -2.121 1.00 74.10 C ATOM 1401 O VAL A 95 -21.811 -7.109 -1.742 1.00 53.14 O ATOM 1402 CB VAL A 95 -21.275 -4.577 -0.063 1.00 62.21 C ATOM 1403 CG1 VAL A 95 -20.237 -3.727 0.633 1.00 11.43 C ATOM 1404 CG2 VAL A 95 -22.608 -3.850 -0.118 1.00 11.25 C ATOM 0 H VAL A 95 -20.651 -2.930 -1.920 1.00 33.01 H new ATOM 0 HA VAL A 95 -19.812 -5.487 -1.334 1.00 50.52 H new ATOM 0 HB VAL A 95 -21.436 -5.493 0.505 1.00 62.21 H new ATOM 0 HG11 VAL A 95 -20.599 -3.448 1.622 1.00 11.43 H new ATOM 0 HG12 VAL A 95 -19.311 -4.293 0.732 1.00 11.43 H new ATOM 0 HG13 VAL A 95 -20.051 -2.827 0.047 1.00 11.43 H new ATOM 0 HG21 VAL A 95 -22.922 -3.589 0.893 1.00 11.25 H new ATOM 0 HG22 VAL A 95 -22.503 -2.942 -0.711 1.00 11.25 H new ATOM 0 HG23 VAL A 95 -23.357 -4.497 -0.575 1.00 11.25 H new ATOM 1414 N ALA A 96 -22.499 -5.467 -3.100 1.00 31.12 N ATOM 1415 CA ALA A 96 -23.425 -6.303 -3.850 1.00 22.33 C ATOM 1416 C ALA A 96 -22.649 -7.293 -4.740 1.00 33.22 C ATOM 1417 O ALA A 96 -23.201 -8.266 -5.249 1.00 72.02 O ATOM 1418 CB ALA A 96 -24.358 -5.438 -4.690 1.00 72.24 C ATOM 0 H ALA A 96 -22.487 -4.490 -3.394 1.00 31.12 H new ATOM 0 HA ALA A 96 -24.030 -6.875 -3.147 1.00 22.33 H new ATOM 0 HB1 ALA A 96 -25.045 -6.077 -5.245 1.00 72.24 H new ATOM 0 HB2 ALA A 96 -24.926 -4.776 -4.037 1.00 72.24 H new ATOM 0 HB3 ALA A 96 -23.771 -4.842 -5.389 1.00 72.24 H new ATOM 1424 N MET A 97 -21.361 -7.035 -4.898 1.00 21.12 N ATOM 1425 CA MET A 97 -20.484 -7.890 -5.676 1.00 15.14 C ATOM 1426 C MET A 97 -19.675 -8.795 -4.753 1.00 53.24 C ATOM 1427 O MET A 97 -18.718 -9.427 -5.191 1.00 25.21 O ATOM 1428 CB MET A 97 -19.519 -7.072 -6.557 1.00 52.43 C ATOM 1429 CG MET A 97 -20.195 -6.159 -7.562 1.00 2.41 C ATOM 1430 SD MET A 97 -19.035 -5.345 -8.703 1.00 52.20 S ATOM 1431 CE MET A 97 -17.929 -4.482 -7.583 1.00 50.42 C ATOM 0 H MET A 97 -20.895 -6.225 -4.489 1.00 21.12 H new ATOM 0 HA MET A 97 -21.116 -8.493 -6.328 1.00 15.14 H new ATOM 0 HB2 MET A 97 -18.882 -6.469 -5.910 1.00 52.43 H new ATOM 0 HB3 MET A 97 -18.867 -7.761 -7.094 1.00 52.43 H new ATOM 0 HG2 MET A 97 -20.914 -6.739 -8.141 1.00 2.41 H new ATOM 0 HG3 MET A 97 -20.759 -5.396 -7.025 1.00 2.41 H new ATOM 0 HE1 MET A 97 -17.621 -3.538 -8.032 1.00 50.42 H new ATOM 0 HE2 MET A 97 -18.444 -4.286 -6.643 1.00 50.42 H new ATOM 0 HE3 MET A 97 -17.050 -5.098 -7.394 1.00 50.42 H new ATOM 1441 N ASP A 98 -20.058 -8.832 -3.475 1.00 50.10 N ATOM 1442 CA ASP A 98 -19.395 -9.644 -2.422 1.00 23.35 C ATOM 1443 C ASP A 98 -18.884 -11.008 -2.874 1.00 12.22 C ATOM 1444 O ASP A 98 -17.760 -11.348 -2.577 1.00 62.21 O ATOM 1445 CB ASP A 98 -20.312 -9.833 -1.186 1.00 33.32 C ATOM 1446 CG ASP A 98 -21.540 -10.696 -1.443 1.00 24.01 C ATOM 1447 OD1 ASP A 98 -22.523 -10.198 -2.021 1.00 13.35 O ATOM 1448 OD2 ASP A 98 -21.524 -11.895 -1.067 1.00 33.34 O ATOM 0 H ASP A 98 -20.850 -8.293 -3.125 1.00 50.10 H new ATOM 0 HA ASP A 98 -18.515 -9.056 -2.162 1.00 23.35 H new ATOM 0 HB2 ASP A 98 -19.729 -10.281 -0.381 1.00 33.32 H new ATOM 0 HB3 ASP A 98 -20.638 -8.853 -0.837 1.00 33.32 H new ATOM 1453 N GLU A 99 -19.706 -11.783 -3.541 1.00 0.13 N ATOM 1454 CA GLU A 99 -19.341 -13.127 -3.953 1.00 64.52 C ATOM 1455 C GLU A 99 -19.088 -13.208 -5.486 1.00 15.54 C ATOM 1456 O GLU A 99 -19.190 -14.286 -6.093 1.00 21.35 O ATOM 1457 CB GLU A 99 -20.522 -14.019 -3.567 1.00 51.31 C ATOM 1458 CG GLU A 99 -20.280 -15.508 -3.612 1.00 74.11 C ATOM 1459 CD GLU A 99 -21.545 -16.265 -3.360 1.00 5.24 C ATOM 1460 OE1 GLU A 99 -22.103 -16.167 -2.247 1.00 52.14 O ATOM 1461 OE2 GLU A 99 -22.035 -16.936 -4.285 1.00 35.10 O ATOM 0 H GLU A 99 -20.648 -11.504 -3.816 1.00 0.13 H new ATOM 0 HA GLU A 99 -18.415 -13.439 -3.470 1.00 64.52 H new ATOM 0 HB2 GLU A 99 -20.835 -13.754 -2.557 1.00 51.31 H new ATOM 0 HB3 GLU A 99 -21.356 -13.788 -4.230 1.00 51.31 H new ATOM 0 HG2 GLU A 99 -19.874 -15.785 -4.585 1.00 74.11 H new ATOM 0 HG3 GLU A 99 -19.534 -15.781 -2.866 1.00 74.11 H new ATOM 1468 N THR A 100 -18.722 -12.110 -6.104 1.00 13.12 N ATOM 1469 CA THR A 100 -18.509 -12.137 -7.543 1.00 62.33 C ATOM 1470 C THR A 100 -17.109 -12.626 -7.893 1.00 71.11 C ATOM 1471 O THR A 100 -16.245 -12.790 -7.020 1.00 31.14 O ATOM 1472 CB THR A 100 -18.774 -10.779 -8.230 1.00 1.51 C ATOM 1473 OG1 THR A 100 -17.948 -9.750 -7.660 1.00 14.05 O ATOM 1474 CG2 THR A 100 -20.239 -10.392 -8.135 1.00 2.32 C ATOM 0 H THR A 100 -18.567 -11.208 -5.654 1.00 13.12 H new ATOM 0 HA THR A 100 -19.245 -12.843 -7.928 1.00 62.33 H new ATOM 0 HB THR A 100 -18.519 -10.886 -9.284 1.00 1.51 H new ATOM 0 HG1 THR A 100 -18.167 -9.643 -6.711 1.00 14.05 H new ATOM 0 HG21 THR A 100 -20.394 -9.432 -8.627 1.00 2.32 H new ATOM 0 HG22 THR A 100 -20.849 -11.153 -8.623 1.00 2.32 H new ATOM 0 HG23 THR A 100 -20.527 -10.313 -7.087 1.00 2.32 H new ATOM 1482 N VAL A 101 -16.875 -12.831 -9.160 1.00 52.03 N ATOM 1483 CA VAL A 101 -15.619 -13.310 -9.620 1.00 54.54 C ATOM 1484 C VAL A 101 -14.831 -12.147 -10.215 1.00 11.43 C ATOM 1485 O VAL A 101 -15.395 -11.293 -10.904 1.00 44.32 O ATOM 1486 CB VAL A 101 -15.796 -14.482 -10.638 1.00 53.33 C ATOM 1487 CG1 VAL A 101 -16.594 -14.056 -11.853 1.00 22.30 C ATOM 1488 CG2 VAL A 101 -14.464 -15.078 -11.042 1.00 11.53 C ATOM 0 H VAL A 101 -17.559 -12.667 -9.899 1.00 52.03 H new ATOM 0 HA VAL A 101 -15.057 -13.719 -8.780 1.00 54.54 H new ATOM 0 HB VAL A 101 -16.365 -15.260 -10.129 1.00 53.33 H new ATOM 0 HG11 VAL A 101 -16.695 -14.899 -12.536 1.00 22.30 H new ATOM 0 HG12 VAL A 101 -17.583 -13.723 -11.540 1.00 22.30 H new ATOM 0 HG13 VAL A 101 -16.079 -13.239 -12.358 1.00 22.30 H new ATOM 0 HG21 VAL A 101 -14.629 -15.890 -11.750 1.00 11.53 H new ATOM 0 HG22 VAL A 101 -13.848 -14.309 -11.508 1.00 11.53 H new ATOM 0 HG23 VAL A 101 -13.956 -15.465 -10.159 1.00 11.53 H new ATOM 1498 N PHE A 102 -13.577 -12.071 -9.889 1.00 4.51 N ATOM 1499 CA PHE A 102 -12.723 -11.028 -10.377 1.00 4.31 C ATOM 1500 C PHE A 102 -11.529 -11.636 -11.080 1.00 11.43 C ATOM 1501 O PHE A 102 -10.746 -12.369 -10.471 1.00 54.34 O ATOM 1502 CB PHE A 102 -12.289 -10.130 -9.214 1.00 61.00 C ATOM 1503 CG PHE A 102 -11.457 -8.940 -9.603 1.00 30.22 C ATOM 1504 CD1 PHE A 102 -12.040 -7.843 -10.211 1.00 73.53 C ATOM 1505 CD2 PHE A 102 -10.099 -8.910 -9.341 1.00 72.44 C ATOM 1506 CE1 PHE A 102 -11.285 -6.739 -10.552 1.00 22.01 C ATOM 1507 CE2 PHE A 102 -9.340 -7.809 -9.681 1.00 24.54 C ATOM 1508 CZ PHE A 102 -9.933 -6.724 -10.287 1.00 51.01 C ATOM 0 H PHE A 102 -13.112 -12.736 -9.271 1.00 4.51 H new ATOM 0 HA PHE A 102 -13.263 -10.412 -11.096 1.00 4.31 H new ATOM 0 HB2 PHE A 102 -13.181 -9.777 -8.696 1.00 61.00 H new ATOM 0 HB3 PHE A 102 -11.724 -10.732 -8.502 1.00 61.00 H new ATOM 0 HD1 PHE A 102 -13.099 -7.850 -10.422 1.00 73.53 H new ATOM 0 HD2 PHE A 102 -9.628 -9.757 -8.865 1.00 72.44 H new ATOM 0 HE1 PHE A 102 -11.753 -5.889 -11.026 1.00 22.01 H new ATOM 0 HE2 PHE A 102 -8.281 -7.798 -9.472 1.00 24.54 H new ATOM 0 HZ PHE A 102 -9.339 -5.862 -10.554 1.00 51.01 H new ATOM 1518 N ARG A 103 -11.414 -11.337 -12.368 1.00 63.33 N ATOM 1519 CA ARG A 103 -10.358 -11.825 -13.278 1.00 1.04 C ATOM 1520 C ARG A 103 -10.079 -13.338 -13.145 1.00 1.44 C ATOM 1521 O ARG A 103 -8.957 -13.813 -13.370 1.00 64.54 O ATOM 1522 CB ARG A 103 -9.099 -10.982 -13.095 1.00 31.33 C ATOM 1523 CG ARG A 103 -9.386 -9.484 -13.240 1.00 41.24 C ATOM 1524 CD ARG A 103 -8.129 -8.659 -13.274 1.00 14.34 C ATOM 1525 NE ARG A 103 -7.357 -8.888 -14.499 1.00 53.21 N ATOM 1526 CZ ARG A 103 -6.063 -9.184 -14.536 1.00 43.04 C ATOM 1527 NH1 ARG A 103 -5.428 -9.473 -13.418 1.00 61.12 N ATOM 1528 NH2 ARG A 103 -5.421 -9.240 -15.699 1.00 53.52 N ATOM 0 H ARG A 103 -12.078 -10.722 -12.838 1.00 63.33 H new ATOM 0 HA ARG A 103 -10.719 -11.705 -14.299 1.00 1.04 H new ATOM 0 HB2 ARG A 103 -8.673 -11.176 -12.111 1.00 31.33 H new ATOM 0 HB3 ARG A 103 -8.352 -11.281 -13.831 1.00 31.33 H new ATOM 0 HG2 ARG A 103 -9.954 -9.313 -14.154 1.00 41.24 H new ATOM 0 HG3 ARG A 103 -10.011 -9.155 -12.410 1.00 41.24 H new ATOM 0 HD2 ARG A 103 -8.386 -7.602 -13.199 1.00 14.34 H new ATOM 0 HD3 ARG A 103 -7.514 -8.899 -12.407 1.00 14.34 H new ATOM 0 HE ARG A 103 -7.850 -8.815 -15.389 1.00 53.21 H new ATOM 0 HH11 ARG A 103 -5.930 -9.469 -12.530 1.00 61.12 H new ATOM 0 HH12 ARG A 103 -4.434 -9.701 -13.440 1.00 61.12 H new ATOM 0 HH21 ARG A 103 -5.922 -9.055 -16.568 1.00 53.52 H new ATOM 0 HH22 ARG A 103 -4.427 -9.468 -15.722 1.00 53.52 H new ATOM 1542 N GLY A 104 -11.125 -14.078 -12.827 1.00 72.24 N ATOM 1543 CA GLY A 104 -11.047 -15.526 -12.789 1.00 53.50 C ATOM 1544 C GLY A 104 -11.108 -16.110 -11.385 1.00 72.41 C ATOM 1545 O GLY A 104 -11.249 -17.329 -11.223 1.00 24.32 O ATOM 0 H GLY A 104 -12.042 -13.698 -12.591 1.00 72.24 H new ATOM 0 HA2 GLY A 104 -11.864 -15.940 -13.380 1.00 53.50 H new ATOM 0 HA3 GLY A 104 -10.118 -15.843 -13.264 1.00 53.50 H new ATOM 1549 N ARG A 105 -11.006 -15.262 -10.376 1.00 4.34 N ATOM 1550 CA ARG A 105 -11.056 -15.721 -8.988 1.00 33.02 C ATOM 1551 C ARG A 105 -12.150 -15.011 -8.196 1.00 35.30 C ATOM 1552 O ARG A 105 -12.286 -13.793 -8.262 1.00 30.32 O ATOM 1553 CB ARG A 105 -9.687 -15.570 -8.304 1.00 54.04 C ATOM 1554 CG ARG A 105 -9.092 -14.173 -8.363 1.00 5.40 C ATOM 1555 CD ARG A 105 -7.731 -14.099 -7.682 1.00 23.02 C ATOM 1556 NE ARG A 105 -6.756 -15.050 -8.241 1.00 34.25 N ATOM 1557 CZ ARG A 105 -5.439 -14.827 -8.346 1.00 15.55 C ATOM 1558 NH1 ARG A 105 -4.944 -13.618 -8.097 1.00 10.25 N ATOM 1559 NH2 ARG A 105 -4.626 -15.792 -8.761 1.00 3.25 N ATOM 0 H ARG A 105 -10.888 -14.255 -10.485 1.00 4.34 H new ATOM 0 HA ARG A 105 -11.307 -16.782 -9.006 1.00 33.02 H new ATOM 0 HB2 ARG A 105 -9.785 -15.863 -7.259 1.00 54.04 H new ATOM 0 HB3 ARG A 105 -8.988 -16.267 -8.766 1.00 54.04 H new ATOM 0 HG2 ARG A 105 -8.993 -13.866 -9.404 1.00 5.40 H new ATOM 0 HG3 ARG A 105 -9.774 -13.469 -7.886 1.00 5.40 H new ATOM 0 HD2 ARG A 105 -7.338 -13.087 -7.776 1.00 23.02 H new ATOM 0 HD3 ARG A 105 -7.853 -14.296 -6.617 1.00 23.02 H new ATOM 0 HE ARG A 105 -7.110 -15.947 -8.574 1.00 34.25 H new ATOM 0 HH11 ARG A 105 -5.567 -12.858 -7.825 1.00 10.25 H new ATOM 0 HH12 ARG A 105 -3.941 -13.451 -8.178 1.00 10.25 H new ATOM 0 HH21 ARG A 105 -5.003 -16.709 -9.002 1.00 3.25 H new ATOM 0 HH22 ARG A 105 -3.624 -15.616 -8.839 1.00 3.25 H new ATOM 1573 N THR A 106 -12.930 -15.779 -7.473 1.00 63.33 N ATOM 1574 CA THR A 106 -13.996 -15.236 -6.660 1.00 60.11 C ATOM 1575 C THR A 106 -13.428 -14.504 -5.461 1.00 14.55 C ATOM 1576 O THR A 106 -12.677 -15.074 -4.669 1.00 11.52 O ATOM 1577 CB THR A 106 -14.974 -16.337 -6.204 1.00 42.24 C ATOM 1578 OG1 THR A 106 -15.535 -16.983 -7.365 1.00 75.33 O ATOM 1579 CG2 THR A 106 -16.097 -15.755 -5.354 1.00 5.52 C ATOM 0 H THR A 106 -12.846 -16.795 -7.431 1.00 63.33 H new ATOM 0 HA THR A 106 -14.553 -14.528 -7.273 1.00 60.11 H new ATOM 0 HB THR A 106 -14.426 -17.059 -5.599 1.00 42.24 H new ATOM 0 HG1 THR A 106 -16.156 -17.685 -7.080 1.00 75.33 H new ATOM 0 HG21 THR A 106 -16.772 -16.554 -5.046 1.00 5.52 H new ATOM 0 HG22 THR A 106 -15.674 -15.277 -4.471 1.00 5.52 H new ATOM 0 HG23 THR A 106 -16.649 -15.018 -5.936 1.00 5.52 H new ATOM 1587 N ILE A 107 -13.756 -13.253 -5.356 1.00 61.04 N ATOM 1588 CA ILE A 107 -13.279 -12.433 -4.273 1.00 73.11 C ATOM 1589 C ILE A 107 -14.343 -12.219 -3.230 1.00 5.24 C ATOM 1590 O ILE A 107 -15.483 -12.636 -3.400 1.00 32.42 O ATOM 1591 CB ILE A 107 -12.760 -11.057 -4.773 1.00 62.22 C ATOM 1592 CG1 ILE A 107 -13.872 -10.301 -5.533 1.00 11.23 C ATOM 1593 CG2 ILE A 107 -11.516 -11.234 -5.646 1.00 32.40 C ATOM 1594 CD1 ILE A 107 -13.476 -8.920 -6.014 1.00 71.15 C ATOM 0 H ILE A 107 -14.362 -12.767 -6.017 1.00 61.04 H new ATOM 0 HA ILE A 107 -12.447 -12.975 -3.823 1.00 73.11 H new ATOM 0 HB ILE A 107 -12.478 -10.458 -3.907 1.00 62.22 H new ATOM 0 HG12 ILE A 107 -14.178 -10.898 -6.392 1.00 11.23 H new ATOM 0 HG13 ILE A 107 -14.742 -10.210 -4.883 1.00 11.23 H new ATOM 0 HG21 ILE A 107 -11.168 -10.258 -5.986 1.00 32.40 H new ATOM 0 HG22 ILE A 107 -10.730 -11.717 -5.066 1.00 32.40 H new ATOM 0 HG23 ILE A 107 -11.762 -11.852 -6.509 1.00 32.40 H new ATOM 0 HD11 ILE A 107 -14.316 -8.462 -6.537 1.00 71.15 H new ATOM 0 HD12 ILE A 107 -13.200 -8.302 -5.159 1.00 71.15 H new ATOM 0 HD13 ILE A 107 -12.627 -9.001 -6.693 1.00 71.15 H new ATOM 1606 N LYS A 108 -13.946 -11.620 -2.135 1.00 60.54 N ATOM 1607 CA LYS A 108 -14.849 -11.291 -1.077 1.00 33.45 C ATOM 1608 C LYS A 108 -14.850 -9.785 -0.893 1.00 24.12 C ATOM 1609 O LYS A 108 -13.788 -9.184 -0.738 1.00 10.14 O ATOM 1610 CB LYS A 108 -14.444 -12.023 0.217 1.00 14.43 C ATOM 1611 CG LYS A 108 -15.220 -11.646 1.431 1.00 15.45 C ATOM 1612 CD LYS A 108 -16.664 -11.748 1.188 1.00 13.25 C ATOM 1613 CE LYS A 108 -17.398 -11.400 2.422 1.00 14.31 C ATOM 1614 NZ LYS A 108 -17.304 -12.449 3.459 1.00 32.45 N ATOM 0 H LYS A 108 -12.979 -11.348 -1.958 1.00 60.54 H new ATOM 0 HA LYS A 108 -15.859 -11.616 -1.327 1.00 33.45 H new ATOM 0 HB2 LYS A 108 -14.550 -13.096 0.057 1.00 14.43 H new ATOM 0 HB3 LYS A 108 -13.388 -11.832 0.407 1.00 14.43 H new ATOM 0 HG2 LYS A 108 -14.941 -12.295 2.261 1.00 15.45 H new ATOM 0 HG3 LYS A 108 -14.969 -10.627 1.725 1.00 15.45 H new ATOM 0 HD2 LYS A 108 -16.955 -11.079 0.378 1.00 13.25 H new ATOM 0 HD3 LYS A 108 -16.920 -12.760 0.873 1.00 13.25 H new ATOM 0 HE2 LYS A 108 -17.006 -10.465 2.821 1.00 14.31 H new ATOM 0 HE3 LYS A 108 -18.447 -11.228 2.179 1.00 14.31 H new ATOM 0 HZ1 LYS A 108 -18.026 -12.282 4.188 1.00 32.45 H new ATOM 0 HZ2 LYS A 108 -17.460 -13.381 3.025 1.00 32.45 H new ATOM 0 HZ3 LYS A 108 -16.360 -12.423 3.894 1.00 32.45 H new ATOM 1628 N VAL A 109 -16.025 -9.181 -0.925 1.00 13.24 N ATOM 1629 CA VAL A 109 -16.146 -7.749 -0.762 1.00 63.41 C ATOM 1630 C VAL A 109 -17.129 -7.484 0.375 1.00 14.21 C ATOM 1631 O VAL A 109 -18.273 -7.934 0.316 1.00 73.13 O ATOM 1632 CB VAL A 109 -16.697 -7.034 -2.060 1.00 54.31 C ATOM 1633 CG1 VAL A 109 -16.652 -5.515 -1.933 1.00 44.13 C ATOM 1634 CG2 VAL A 109 -15.973 -7.477 -3.319 1.00 54.22 C ATOM 0 H VAL A 109 -16.912 -9.666 -1.063 1.00 13.24 H new ATOM 0 HA VAL A 109 -15.152 -7.351 -0.556 1.00 63.41 H new ATOM 0 HB VAL A 109 -17.739 -7.341 -2.152 1.00 54.31 H new ATOM 0 HG11 VAL A 109 -17.039 -5.062 -2.846 1.00 44.13 H new ATOM 0 HG12 VAL A 109 -17.262 -5.202 -1.086 1.00 44.13 H new ATOM 0 HG13 VAL A 109 -15.622 -5.193 -1.777 1.00 44.13 H new ATOM 0 HG21 VAL A 109 -16.390 -6.956 -4.181 1.00 54.22 H new ATOM 0 HG22 VAL A 109 -14.912 -7.241 -3.231 1.00 54.22 H new ATOM 0 HG23 VAL A 109 -16.096 -8.552 -3.450 1.00 54.22 H new ATOM 1644 N LEU A 110 -16.699 -6.791 1.402 1.00 21.32 N ATOM 1645 CA LEU A 110 -17.601 -6.398 2.468 1.00 65.31 C ATOM 1646 C LEU A 110 -17.200 -5.005 2.922 1.00 20.25 C ATOM 1647 O LEU A 110 -16.060 -4.648 2.745 1.00 63.51 O ATOM 1648 CB LEU A 110 -17.794 -7.473 3.653 1.00 23.30 C ATOM 1649 CG LEU A 110 -16.742 -7.775 4.793 1.00 1.13 C ATOM 1650 CD1 LEU A 110 -15.589 -8.610 4.360 1.00 4.42 C ATOM 1651 CD2 LEU A 110 -16.272 -6.538 5.517 1.00 11.02 C ATOM 0 H LEU A 110 -15.734 -6.486 1.526 1.00 21.32 H new ATOM 0 HA LEU A 110 -18.616 -6.370 2.071 1.00 65.31 H new ATOM 0 HB2 LEU A 110 -18.714 -7.190 4.164 1.00 23.30 H new ATOM 0 HB3 LEU A 110 -17.983 -8.427 3.161 1.00 23.30 H new ATOM 0 HG LEU A 110 -17.305 -8.377 5.506 1.00 1.13 H new ATOM 0 HD11 LEU A 110 -14.917 -8.768 5.204 1.00 4.42 H new ATOM 0 HD12 LEU A 110 -15.952 -9.573 4.000 1.00 4.42 H new ATOM 0 HD13 LEU A 110 -15.052 -8.102 3.559 1.00 4.42 H new ATOM 0 HD21 LEU A 110 -15.552 -6.818 6.286 1.00 11.02 H new ATOM 0 HD22 LEU A 110 -15.800 -5.859 4.808 1.00 11.02 H new ATOM 0 HD23 LEU A 110 -17.124 -6.042 5.981 1.00 11.02 H new ATOM 1663 N PRO A 111 -18.093 -4.186 3.473 1.00 32.10 N ATOM 1664 CA PRO A 111 -17.747 -2.812 3.816 1.00 44.35 C ATOM 1665 C PRO A 111 -16.937 -2.717 5.083 1.00 54.42 C ATOM 1666 O PRO A 111 -17.072 -3.550 5.996 1.00 14.51 O ATOM 1667 CB PRO A 111 -19.098 -2.147 4.037 1.00 11.03 C ATOM 1668 CG PRO A 111 -19.989 -3.250 4.487 1.00 61.40 C ATOM 1669 CD PRO A 111 -19.485 -4.510 3.844 1.00 33.13 C ATOM 0 HA PRO A 111 -17.138 -2.353 3.037 1.00 44.35 H new ATOM 0 HB2 PRO A 111 -19.034 -1.358 4.786 1.00 11.03 H new ATOM 0 HB3 PRO A 111 -19.468 -1.687 3.121 1.00 11.03 H new ATOM 0 HG2 PRO A 111 -19.975 -3.339 5.573 1.00 61.40 H new ATOM 0 HG3 PRO A 111 -21.021 -3.055 4.197 1.00 61.40 H new ATOM 0 HD2 PRO A 111 -19.529 -5.355 4.531 1.00 33.13 H new ATOM 0 HD3 PRO A 111 -20.079 -4.778 2.971 1.00 33.13 H new ATOM 1677 N LYS A 112 -16.098 -1.730 5.163 1.00 12.22 N ATOM 1678 CA LYS A 112 -15.439 -1.508 6.388 1.00 20.43 C ATOM 1679 C LYS A 112 -16.397 -0.678 7.228 1.00 62.12 C ATOM 1680 O LYS A 112 -16.878 0.361 6.776 1.00 13.34 O ATOM 1681 CB LYS A 112 -14.095 -0.814 6.251 1.00 4.24 C ATOM 1682 CG LYS A 112 -13.039 -1.485 5.391 1.00 42.52 C ATOM 1683 CD LYS A 112 -11.658 -0.829 5.666 1.00 54.33 C ATOM 1684 CE LYS A 112 -11.611 0.622 5.246 1.00 62.41 C ATOM 1685 NZ LYS A 112 -10.365 1.320 5.668 1.00 10.22 N ATOM 0 H LYS A 112 -15.865 -1.086 4.407 1.00 12.22 H new ATOM 0 HA LYS A 112 -15.198 -2.466 6.850 1.00 20.43 H new ATOM 0 HB2 LYS A 112 -14.272 0.183 5.848 1.00 4.24 H new ATOM 0 HB3 LYS A 112 -13.681 -0.685 7.251 1.00 4.24 H new ATOM 0 HG2 LYS A 112 -12.998 -2.552 5.612 1.00 42.52 H new ATOM 0 HG3 LYS A 112 -13.297 -1.388 4.336 1.00 42.52 H new ATOM 0 HD2 LYS A 112 -11.430 -0.903 6.729 1.00 54.33 H new ATOM 0 HD3 LYS A 112 -10.884 -1.383 5.134 1.00 54.33 H new ATOM 0 HE2 LYS A 112 -11.703 0.682 4.161 1.00 62.41 H new ATOM 0 HE3 LYS A 112 -12.471 1.143 5.668 1.00 62.41 H new ATOM 0 HZ1 LYS A 112 -10.274 2.215 5.145 1.00 10.22 H new ATOM 0 HZ2 LYS A 112 -10.406 1.518 6.688 1.00 10.22 H new ATOM 0 HZ3 LYS A 112 -9.543 0.716 5.466 1.00 10.22 H new ATOM 2166 N GLY B 21 -9.093 -6.480 9.692 1.00 4.42 N ATOM 2167 CA GLY B 21 -10.464 -6.855 9.663 1.00 23.24 C ATOM 2168 C GLY B 21 -10.715 -8.319 9.941 1.00 32.23 C ATOM 2169 O GLY B 21 -10.329 -8.832 10.990 1.00 42.54 O ATOM 0 HA2 GLY B 21 -11.007 -6.260 10.397 1.00 23.24 H new ATOM 0 HA3 GLY B 21 -10.876 -6.607 8.685 1.00 23.24 H new ATOM 2173 N PRO B 22 -11.396 -8.991 9.028 1.00 62.53 N ATOM 2174 CA PRO B 22 -11.752 -10.409 9.152 1.00 73.15 C ATOM 2175 C PRO B 22 -10.546 -11.394 9.408 1.00 51.20 C ATOM 2176 O PRO B 22 -10.657 -12.237 10.324 1.00 14.12 O ATOM 2177 CB PRO B 22 -12.529 -10.705 7.866 1.00 75.24 C ATOM 2178 CG PRO B 22 -13.013 -9.355 7.428 1.00 4.23 C ATOM 2179 CD PRO B 22 -11.930 -8.412 7.794 1.00 14.23 C ATOM 0 HA PRO B 22 -12.342 -10.585 10.052 1.00 73.15 H new ATOM 0 HB2 PRO B 22 -11.893 -11.167 7.111 1.00 75.24 H new ATOM 0 HB3 PRO B 22 -13.358 -11.389 8.047 1.00 75.24 H new ATOM 0 HG2 PRO B 22 -13.205 -9.335 6.355 1.00 4.23 H new ATOM 0 HG3 PRO B 22 -13.947 -9.092 7.924 1.00 4.23 H new ATOM 0 HD2 PRO B 22 -11.170 -8.348 7.016 1.00 14.23 H new ATOM 0 HD3 PRO B 22 -12.310 -7.403 7.952 1.00 14.23 H new ATOM 2187 N PRO B 23 -9.395 -11.354 8.616 1.00 44.34 N ATOM 2188 CA PRO B 23 -8.212 -12.164 8.944 1.00 21.44 C ATOM 2189 C PRO B 23 -7.784 -11.885 10.366 1.00 54.23 C ATOM 2190 O PRO B 23 -7.808 -10.727 10.811 1.00 63.13 O ATOM 2191 CB PRO B 23 -7.112 -11.690 7.970 1.00 32.00 C ATOM 2192 CG PRO B 23 -7.677 -10.498 7.273 1.00 60.12 C ATOM 2193 CD PRO B 23 -9.179 -10.586 7.381 1.00 23.10 C ATOM 0 HA PRO B 23 -8.408 -13.232 8.855 1.00 21.44 H new ATOM 0 HB2 PRO B 23 -6.198 -11.434 8.506 1.00 32.00 H new ATOM 0 HB3 PRO B 23 -6.855 -12.474 7.258 1.00 32.00 H new ATOM 0 HG2 PRO B 23 -7.312 -9.578 7.729 1.00 60.12 H new ATOM 0 HG3 PRO B 23 -7.367 -10.481 6.228 1.00 60.12 H new ATOM 0 HD2 PRO B 23 -9.635 -9.598 7.439 1.00 23.10 H new ATOM 0 HD3 PRO B 23 -9.614 -11.087 6.516 1.00 23.10 H new ATOM 2201 N GLN B 24 -7.423 -12.921 11.084 1.00 64.53 N ATOM 2202 CA GLN B 24 -7.070 -12.764 12.465 1.00 55.31 C ATOM 2203 C GLN B 24 -5.839 -11.911 12.629 1.00 23.04 C ATOM 2204 O GLN B 24 -4.763 -12.229 12.090 1.00 12.54 O ATOM 2205 CB GLN B 24 -6.953 -14.099 13.181 1.00 33.01 C ATOM 2206 CG GLN B 24 -8.267 -14.862 13.229 1.00 42.25 C ATOM 2207 CD GLN B 24 -9.378 -14.077 13.917 1.00 51.31 C ATOM 2208 OE1 GLN B 24 -9.553 -14.158 15.132 1.00 72.32 O ATOM 2209 NE2 GLN B 24 -10.131 -13.316 13.152 1.00 15.11 N ATOM 0 H GLN B 24 -7.368 -13.877 10.732 1.00 64.53 H new ATOM 0 HA GLN B 24 -7.889 -12.231 12.949 1.00 55.31 H new ATOM 0 HB2 GLN B 24 -6.202 -14.710 12.680 1.00 33.01 H new ATOM 0 HB3 GLN B 24 -6.599 -13.930 14.198 1.00 33.01 H new ATOM 0 HG2 GLN B 24 -8.577 -15.108 12.213 1.00 42.25 H new ATOM 0 HG3 GLN B 24 -8.116 -15.805 13.754 1.00 42.25 H new ATOM 0 HE21 GLN B 24 -9.958 -13.272 12.148 1.00 15.11 H new ATOM 0 HE22 GLN B 24 -10.888 -12.770 13.563 1.00 15.11 H new ATOM 2218 N PRO B 25 -5.979 -10.821 13.380 1.00 40.04 N ATOM 2219 CA PRO B 25 -4.923 -9.850 13.561 1.00 53.35 C ATOM 2220 C PRO B 25 -3.792 -10.439 14.351 1.00 44.41 C ATOM 2221 O PRO B 25 -3.996 -10.985 15.446 1.00 41.01 O ATOM 2222 CB PRO B 25 -5.589 -8.712 14.342 1.00 11.41 C ATOM 2223 CG PRO B 25 -6.764 -9.328 15.007 1.00 34.24 C ATOM 2224 CD PRO B 25 -7.195 -10.477 14.147 1.00 70.51 C ATOM 0 HA PRO B 25 -4.496 -9.516 12.615 1.00 53.35 H new ATOM 0 HB2 PRO B 25 -4.904 -8.283 15.073 1.00 11.41 H new ATOM 0 HB3 PRO B 25 -5.893 -7.904 13.677 1.00 11.41 H new ATOM 0 HG2 PRO B 25 -6.506 -9.671 16.009 1.00 34.24 H new ATOM 0 HG3 PRO B 25 -7.571 -8.603 15.116 1.00 34.24 H new ATOM 0 HD2 PRO B 25 -7.540 -11.319 14.748 1.00 70.51 H new ATOM 0 HD3 PRO B 25 -8.017 -10.197 13.488 1.00 70.51 H new ATOM 2232 N LEU B 26 -2.615 -10.367 13.812 1.00 43.11 N ATOM 2233 CA LEU B 26 -1.484 -10.912 14.498 1.00 71.12 C ATOM 2234 C LEU B 26 -1.001 -9.999 15.618 1.00 33.22 C ATOM 2235 O LEU B 26 -1.491 -8.871 15.769 1.00 31.52 O ATOM 2236 CB LEU B 26 -0.366 -11.520 13.562 1.00 12.43 C ATOM 2237 CG LEU B 26 0.304 -10.666 12.453 1.00 25.41 C ATOM 2238 CD1 LEU B 26 -0.686 -10.146 11.420 1.00 52.43 C ATOM 2239 CD2 LEU B 26 1.122 -9.551 13.037 1.00 54.33 C ATOM 0 H LEU B 26 -2.412 -9.941 12.908 1.00 43.11 H new ATOM 0 HA LEU B 26 -1.837 -11.810 15.006 1.00 71.12 H new ATOM 0 HB2 LEU B 26 0.431 -11.881 14.211 1.00 12.43 H new ATOM 0 HB3 LEU B 26 -0.799 -12.393 13.074 1.00 12.43 H new ATOM 0 HG LEU B 26 0.978 -11.336 11.919 1.00 25.41 H new ATOM 0 HD11 LEU B 26 -0.156 -9.557 10.672 1.00 52.43 H new ATOM 0 HD12 LEU B 26 -1.181 -10.987 10.935 1.00 52.43 H new ATOM 0 HD13 LEU B 26 -1.431 -9.521 11.912 1.00 52.43 H new ATOM 0 HD21 LEU B 26 1.577 -8.973 12.232 1.00 54.33 H new ATOM 0 HD22 LEU B 26 0.480 -8.902 13.632 1.00 54.33 H new ATOM 0 HD23 LEU B 26 1.904 -9.967 13.672 1.00 54.33 H new ATOM 2251 N SER B 27 -0.097 -10.480 16.402 1.00 14.33 N ATOM 2252 CA SER B 27 0.305 -9.801 17.603 1.00 70.52 C ATOM 2253 C SER B 27 1.108 -8.501 17.381 1.00 40.54 C ATOM 2254 O SER B 27 1.872 -8.380 16.438 1.00 24.51 O ATOM 2255 CB SER B 27 1.038 -10.775 18.469 1.00 53.31 C ATOM 2256 OG SER B 27 0.176 -11.846 18.862 1.00 51.54 O ATOM 0 H SER B 27 0.391 -11.360 16.234 1.00 14.33 H new ATOM 0 HA SER B 27 -0.600 -9.452 18.099 1.00 70.52 H new ATOM 0 HB2 SER B 27 1.899 -11.172 17.931 1.00 53.31 H new ATOM 0 HB3 SER B 27 1.422 -10.267 19.353 1.00 53.31 H new ATOM 0 HG SER B 27 0.672 -12.475 19.427 1.00 51.54 H new ATOM 2262 N ALA B 28 0.881 -7.539 18.282 1.00 54.30 N ATOM 2263 CA ALA B 28 1.536 -6.225 18.263 1.00 53.14 C ATOM 2264 C ALA B 28 3.061 -6.307 18.218 1.00 35.11 C ATOM 2265 O ALA B 28 3.690 -5.607 17.443 1.00 61.31 O ATOM 2266 CB ALA B 28 1.085 -5.382 19.434 1.00 71.33 C ATOM 0 H ALA B 28 0.227 -7.652 19.057 1.00 54.30 H new ATOM 0 HA ALA B 28 1.225 -5.746 17.334 1.00 53.14 H new ATOM 0 HB1 ALA B 28 1.584 -4.413 19.398 1.00 71.33 H new ATOM 0 HB2 ALA B 28 0.006 -5.237 19.383 1.00 71.33 H new ATOM 0 HB3 ALA B 28 1.340 -5.887 20.366 1.00 71.33 H new ATOM 2272 N GLU B 29 3.650 -7.148 19.030 1.00 0.55 N ATOM 2273 CA GLU B 29 5.102 -7.317 19.023 1.00 2.51 C ATOM 2274 C GLU B 29 5.571 -7.858 17.685 1.00 15.30 C ATOM 2275 O GLU B 29 6.553 -7.370 17.133 1.00 51.23 O ATOM 2276 CB GLU B 29 5.545 -8.163 20.197 1.00 61.40 C ATOM 2277 CG GLU B 29 5.343 -7.453 21.525 1.00 14.33 C ATOM 2278 CD GLU B 29 6.470 -6.536 21.911 1.00 2.54 C ATOM 2279 OE1 GLU B 29 7.479 -6.994 22.501 1.00 21.21 O ATOM 2280 OE2 GLU B 29 6.384 -5.352 21.638 1.00 55.12 O ATOM 0 H GLU B 29 3.158 -7.731 19.707 1.00 0.55 H new ATOM 0 HA GLU B 29 5.578 -6.344 19.146 1.00 2.51 H new ATOM 0 HB2 GLU B 29 4.987 -9.099 20.199 1.00 61.40 H new ATOM 0 HB3 GLU B 29 6.598 -8.420 20.081 1.00 61.40 H new ATOM 0 HG2 GLU B 29 4.419 -6.876 21.479 1.00 14.33 H new ATOM 0 HG3 GLU B 29 5.213 -8.200 22.308 1.00 14.33 H new ATOM 2287 N GLU B 30 4.829 -8.829 17.138 1.00 52.05 N ATOM 2288 CA GLU B 30 5.076 -9.317 15.777 1.00 73.40 C ATOM 2289 C GLU B 30 5.013 -8.169 14.802 1.00 65.42 C ATOM 2290 O GLU B 30 5.839 -8.060 13.905 1.00 43.24 O ATOM 2291 CB GLU B 30 4.042 -10.377 15.366 1.00 24.54 C ATOM 2292 CG GLU B 30 4.344 -11.798 15.783 1.00 22.33 C ATOM 2293 CD GLU B 30 4.652 -11.955 17.248 1.00 50.24 C ATOM 2294 OE1 GLU B 30 3.813 -11.642 18.079 1.00 43.55 O ATOM 2295 OE2 GLU B 30 5.754 -12.382 17.579 1.00 21.24 O ATOM 0 H GLU B 30 4.055 -9.291 17.616 1.00 52.05 H new ATOM 0 HA GLU B 30 6.067 -9.771 15.762 1.00 73.40 H new ATOM 0 HB2 GLU B 30 3.076 -10.095 15.785 1.00 24.54 H new ATOM 0 HB3 GLU B 30 3.938 -10.353 14.281 1.00 24.54 H new ATOM 0 HG2 GLU B 30 3.491 -12.428 15.532 1.00 22.33 H new ATOM 0 HG3 GLU B 30 5.192 -12.163 15.203 1.00 22.33 H new ATOM 2302 N LYS B 31 4.072 -7.272 15.036 1.00 51.44 N ATOM 2303 CA LYS B 31 3.851 -6.157 14.166 1.00 0.23 C ATOM 2304 C LYS B 31 4.977 -5.169 14.231 1.00 1.33 C ATOM 2305 O LYS B 31 5.395 -4.657 13.208 1.00 70.22 O ATOM 2306 CB LYS B 31 2.516 -5.485 14.416 1.00 21.45 C ATOM 2307 CG LYS B 31 1.354 -6.343 14.038 1.00 13.14 C ATOM 2308 CD LYS B 31 0.057 -5.625 14.221 1.00 41.32 C ATOM 2309 CE LYS B 31 -1.097 -6.509 13.823 1.00 1.42 C ATOM 2310 NZ LYS B 31 -2.369 -5.819 13.963 1.00 22.11 N ATOM 0 H LYS B 31 3.444 -7.306 15.839 1.00 51.44 H new ATOM 0 HA LYS B 31 3.821 -6.558 13.153 1.00 0.23 H new ATOM 0 HB2 LYS B 31 2.439 -5.222 15.471 1.00 21.45 H new ATOM 0 HB3 LYS B 31 2.472 -4.554 13.851 1.00 21.45 H new ATOM 0 HG2 LYS B 31 1.454 -6.655 12.998 1.00 13.14 H new ATOM 0 HG3 LYS B 31 1.358 -7.249 14.644 1.00 13.14 H new ATOM 0 HD2 LYS B 31 -0.053 -5.320 15.262 1.00 41.32 H new ATOM 0 HD3 LYS B 31 0.050 -4.716 13.620 1.00 41.32 H new ATOM 0 HE2 LYS B 31 -0.969 -6.833 12.790 1.00 1.42 H new ATOM 0 HE3 LYS B 31 -1.099 -7.407 14.441 1.00 1.42 H new ATOM 0 HZ1 LYS B 31 -3.142 -6.455 13.681 1.00 22.11 H new ATOM 0 HZ2 LYS B 31 -2.501 -5.532 14.954 1.00 22.11 H new ATOM 0 HZ3 LYS B 31 -2.375 -4.976 13.354 1.00 22.11 H new ATOM 2324 N LYS B 32 5.489 -4.883 15.416 1.00 44.41 N ATOM 2325 CA LYS B 32 6.612 -3.989 15.492 1.00 64.45 C ATOM 2326 C LYS B 32 7.862 -4.630 14.944 1.00 1.03 C ATOM 2327 O LYS B 32 8.638 -3.969 14.291 1.00 72.14 O ATOM 2328 CB LYS B 32 6.876 -3.362 16.891 1.00 53.02 C ATOM 2329 CG LYS B 32 6.081 -2.071 17.287 1.00 52.53 C ATOM 2330 CD LYS B 32 4.619 -2.254 17.752 1.00 24.02 C ATOM 2331 CE LYS B 32 3.663 -2.746 16.695 1.00 21.43 C ATOM 2332 NZ LYS B 32 3.605 -1.856 15.495 1.00 35.52 N ATOM 0 H LYS B 32 5.153 -5.247 16.307 1.00 44.41 H new ATOM 0 HA LYS B 32 6.328 -3.147 14.861 1.00 64.45 H new ATOM 0 HB2 LYS B 32 6.668 -4.124 17.642 1.00 53.02 H new ATOM 0 HB3 LYS B 32 7.939 -3.131 16.957 1.00 53.02 H new ATOM 0 HG2 LYS B 32 6.628 -1.569 18.085 1.00 52.53 H new ATOM 0 HG3 LYS B 32 6.080 -1.399 16.429 1.00 52.53 H new ATOM 0 HD2 LYS B 32 4.606 -2.956 18.586 1.00 24.02 H new ATOM 0 HD3 LYS B 32 4.254 -1.300 18.133 1.00 24.02 H new ATOM 0 HE2 LYS B 32 3.960 -3.747 16.383 1.00 21.43 H new ATOM 0 HE3 LYS B 32 2.666 -2.829 17.126 1.00 21.43 H new ATOM 0 HZ1 LYS B 32 2.860 -2.190 14.851 1.00 35.52 H new ATOM 0 HZ2 LYS B 32 3.394 -0.883 15.795 1.00 35.52 H new ATOM 0 HZ3 LYS B 32 4.521 -1.876 15.004 1.00 35.52 H new ATOM 2346 N GLU B 33 8.031 -5.935 15.154 1.00 13.25 N ATOM 2347 CA GLU B 33 9.232 -6.607 14.664 1.00 31.12 C ATOM 2348 C GLU B 33 9.255 -6.673 13.152 1.00 41.13 C ATOM 2349 O GLU B 33 10.304 -6.535 12.530 1.00 2.22 O ATOM 2350 CB GLU B 33 9.441 -7.990 15.260 1.00 55.52 C ATOM 2351 CG GLU B 33 9.585 -7.993 16.761 1.00 42.31 C ATOM 2352 CD GLU B 33 10.366 -9.168 17.238 1.00 45.24 C ATOM 2353 OE1 GLU B 33 9.824 -10.274 17.284 1.00 41.31 O ATOM 2354 OE2 GLU B 33 11.549 -9.001 17.562 1.00 13.20 O ATOM 0 H GLU B 33 7.370 -6.535 15.647 1.00 13.25 H new ATOM 0 HA GLU B 33 10.066 -5.992 15.002 1.00 31.12 H new ATOM 0 HB2 GLU B 33 8.599 -8.625 14.984 1.00 55.52 H new ATOM 0 HB3 GLU B 33 10.333 -8.434 14.818 1.00 55.52 H new ATOM 0 HG2 GLU B 33 10.077 -7.075 17.081 1.00 42.31 H new ATOM 0 HG3 GLU B 33 8.597 -8.002 17.221 1.00 42.31 H new ATOM 2361 N ILE B 34 8.104 -6.885 12.565 1.00 51.14 N ATOM 2362 CA ILE B 34 8.005 -6.893 11.119 1.00 32.31 C ATOM 2363 C ILE B 34 8.181 -5.482 10.567 1.00 63.43 C ATOM 2364 O ILE B 34 8.804 -5.285 9.540 1.00 45.23 O ATOM 2365 CB ILE B 34 6.733 -7.609 10.549 1.00 14.32 C ATOM 2366 CG1 ILE B 34 5.445 -6.937 11.046 1.00 24.33 C ATOM 2367 CG2 ILE B 34 6.746 -9.090 10.924 1.00 33.34 C ATOM 2368 CD1 ILE B 34 4.163 -7.654 10.651 1.00 62.33 C ATOM 0 H ILE B 34 7.227 -7.054 13.057 1.00 51.14 H new ATOM 0 HA ILE B 34 8.827 -7.513 10.763 1.00 32.31 H new ATOM 0 HB ILE B 34 6.755 -7.522 9.463 1.00 14.32 H new ATOM 0 HG12 ILE B 34 5.485 -6.864 12.133 1.00 24.33 H new ATOM 0 HG13 ILE B 34 5.410 -5.918 10.659 1.00 24.33 H new ATOM 0 HG21 ILE B 34 5.857 -9.575 10.522 1.00 33.34 H new ATOM 0 HG22 ILE B 34 7.636 -9.563 10.509 1.00 33.34 H new ATOM 0 HG23 ILE B 34 6.754 -9.190 12.009 1.00 33.34 H new ATOM 0 HD11 ILE B 34 3.305 -7.109 11.045 1.00 62.33 H new ATOM 0 HD12 ILE B 34 4.094 -7.704 9.564 1.00 62.33 H new ATOM 0 HD13 ILE B 34 4.170 -8.664 11.061 1.00 62.33 H new ATOM 2380 N ASP B 35 7.685 -4.493 11.328 1.00 62.35 N ATOM 2381 CA ASP B 35 7.718 -3.067 10.939 1.00 70.23 C ATOM 2382 C ASP B 35 9.181 -2.609 10.869 1.00 4.14 C ATOM 2383 O ASP B 35 9.575 -1.839 9.989 1.00 21.32 O ATOM 2384 CB ASP B 35 7.003 -2.238 12.016 1.00 41.23 C ATOM 2385 CG ASP B 35 6.210 -1.074 11.480 1.00 33.41 C ATOM 2386 OD1 ASP B 35 6.780 -0.034 11.202 1.00 14.42 O ATOM 2387 OD2 ASP B 35 4.961 -1.201 11.370 1.00 52.12 O ATOM 0 H ASP B 35 7.247 -4.657 12.235 1.00 62.35 H new ATOM 0 HA ASP B 35 7.229 -2.934 9.974 1.00 70.23 H new ATOM 0 HB2 ASP B 35 6.334 -2.891 12.575 1.00 41.23 H new ATOM 0 HB3 ASP B 35 7.745 -1.863 12.721 1.00 41.23 H new ATOM 2392 N LYS B 36 9.986 -3.138 11.807 1.00 32.23 N ATOM 2393 CA LYS B 36 11.432 -2.846 11.913 1.00 15.32 C ATOM 2394 C LYS B 36 12.166 -3.303 10.660 1.00 33.23 C ATOM 2395 O LYS B 36 13.197 -2.747 10.296 1.00 12.30 O ATOM 2396 CB LYS B 36 12.045 -3.587 13.118 1.00 74.40 C ATOM 2397 CG LYS B 36 11.475 -3.221 14.464 1.00 11.41 C ATOM 2398 CD LYS B 36 12.028 -4.132 15.551 1.00 15.20 C ATOM 2399 CE LYS B 36 11.444 -3.791 16.903 1.00 32.11 C ATOM 2400 NZ LYS B 36 11.891 -4.730 17.961 1.00 63.04 N ATOM 0 H LYS B 36 9.651 -3.786 12.520 1.00 32.23 H new ATOM 0 HA LYS B 36 11.540 -1.769 12.038 1.00 15.32 H new ATOM 0 HB2 LYS B 36 11.915 -4.659 12.967 1.00 74.40 H new ATOM 0 HB3 LYS B 36 13.118 -3.395 13.133 1.00 74.40 H new ATOM 0 HG2 LYS B 36 11.715 -2.183 14.696 1.00 11.41 H new ATOM 0 HG3 LYS B 36 10.388 -3.298 14.437 1.00 11.41 H new ATOM 0 HD2 LYS B 36 11.804 -5.170 15.307 1.00 15.20 H new ATOM 0 HD3 LYS B 36 13.114 -4.040 15.588 1.00 15.20 H new ATOM 0 HE2 LYS B 36 11.732 -2.776 17.176 1.00 32.11 H new ATOM 0 HE3 LYS B 36 10.356 -3.808 16.841 1.00 32.11 H new ATOM 0 HZ1 LYS B 36 11.413 -4.498 18.855 1.00 63.04 H new ATOM 0 HZ2 LYS B 36 11.654 -5.704 17.684 1.00 63.04 H new ATOM 0 HZ3 LYS B 36 12.920 -4.647 18.087 1.00 63.04 H new ATOM 2414 N ARG B 37 11.629 -4.324 10.027 1.00 23.04 N ATOM 2415 CA ARG B 37 12.220 -4.934 8.864 1.00 1.35 C ATOM 2416 C ARG B 37 11.457 -4.568 7.604 1.00 33.42 C ATOM 2417 O ARG B 37 11.591 -5.211 6.571 1.00 41.21 O ATOM 2418 CB ARG B 37 12.237 -6.428 9.075 1.00 44.13 C ATOM 2419 CG ARG B 37 13.155 -6.838 10.204 1.00 51.23 C ATOM 2420 CD ARG B 37 12.994 -8.284 10.547 1.00 3.31 C ATOM 2421 NE ARG B 37 11.699 -8.556 11.162 1.00 44.44 N ATOM 2422 CZ ARG B 37 11.036 -9.713 11.074 1.00 64.33 C ATOM 2423 NH1 ARG B 37 11.486 -10.690 10.300 1.00 52.01 N ATOM 2424 NH2 ARG B 37 9.913 -9.881 11.747 1.00 41.02 N ATOM 0 H ARG B 37 10.752 -4.759 10.315 1.00 23.04 H new ATOM 0 HA ARG B 37 13.238 -4.567 8.732 1.00 1.35 H new ATOM 0 HB2 ARG B 37 11.226 -6.774 9.288 1.00 44.13 H new ATOM 0 HB3 ARG B 37 12.555 -6.919 8.155 1.00 44.13 H new ATOM 0 HG2 ARG B 37 14.190 -6.644 9.921 1.00 51.23 H new ATOM 0 HG3 ARG B 37 12.945 -6.229 11.084 1.00 51.23 H new ATOM 0 HD2 ARG B 37 13.101 -8.885 9.644 1.00 3.31 H new ATOM 0 HD3 ARG B 37 13.790 -8.587 11.228 1.00 3.31 H new ATOM 0 HE ARG B 37 11.267 -7.805 11.700 1.00 44.44 H new ATOM 0 HH11 ARG B 37 12.345 -10.562 9.765 1.00 52.01 H new ATOM 0 HH12 ARG B 37 10.973 -11.570 10.239 1.00 52.01 H new ATOM 0 HH21 ARG B 37 9.552 -9.128 12.333 1.00 41.02 H new ATOM 0 HH22 ARG B 37 9.406 -10.764 11.681 1.00 41.02 H new ATOM 2438 N SER B 38 10.680 -3.536 7.685 1.00 54.40 N ATOM 2439 CA SER B 38 9.963 -3.055 6.541 1.00 52.43 C ATOM 2440 C SER B 38 10.531 -1.709 6.077 1.00 52.21 C ATOM 2441 O SER B 38 11.335 -1.083 6.781 1.00 62.01 O ATOM 2442 CB SER B 38 8.499 -2.914 6.888 1.00 21.41 C ATOM 2443 OG SER B 38 7.956 -4.131 7.333 1.00 71.12 O ATOM 0 H SER B 38 10.523 -3.003 8.540 1.00 54.40 H new ATOM 0 HA SER B 38 10.073 -3.770 5.726 1.00 52.43 H new ATOM 0 HB2 SER B 38 8.379 -2.156 7.662 1.00 21.41 H new ATOM 0 HB3 SER B 38 7.949 -2.567 6.014 1.00 21.41 H new ATOM 0 HG SER B 38 8.291 -4.329 8.232 1.00 71.12 H new ATOM 2449 N VAL B 39 10.089 -1.253 4.924 1.00 14.13 N ATOM 2450 CA VAL B 39 10.538 0.007 4.355 1.00 64.11 C ATOM 2451 C VAL B 39 9.386 0.792 3.771 1.00 72.34 C ATOM 2452 O VAL B 39 8.308 0.261 3.546 1.00 50.44 O ATOM 2453 CB VAL B 39 11.630 -0.146 3.250 1.00 23.52 C ATOM 2454 CG1 VAL B 39 12.902 -0.755 3.789 1.00 42.24 C ATOM 2455 CG2 VAL B 39 11.110 -0.952 2.083 1.00 14.33 C ATOM 0 H VAL B 39 9.405 -1.746 4.350 1.00 14.13 H new ATOM 0 HA VAL B 39 10.982 0.540 5.196 1.00 64.11 H new ATOM 0 HB VAL B 39 11.871 0.858 2.900 1.00 23.52 H new ATOM 0 HG11 VAL B 39 13.633 -0.842 2.985 1.00 42.24 H new ATOM 0 HG12 VAL B 39 13.304 -0.119 4.578 1.00 42.24 H new ATOM 0 HG13 VAL B 39 12.689 -1.744 4.194 1.00 42.24 H new ATOM 0 HG21 VAL B 39 11.890 -1.044 1.328 1.00 14.33 H new ATOM 0 HG22 VAL B 39 10.820 -1.945 2.427 1.00 14.33 H new ATOM 0 HG23 VAL B 39 10.244 -0.450 1.651 1.00 14.33 H new ATOM 2465 N TYR B 40 9.653 2.026 3.537 1.00 13.35 N ATOM 2466 CA TYR B 40 8.792 2.974 2.911 1.00 63.23 C ATOM 2467 C TYR B 40 9.339 3.194 1.539 1.00 33.20 C ATOM 2468 O TYR B 40 10.493 3.577 1.389 1.00 31.42 O ATOM 2469 CB TYR B 40 8.823 4.312 3.695 1.00 23.54 C ATOM 2470 CG TYR B 40 8.250 5.545 2.964 1.00 41.20 C ATOM 2471 CD1 TYR B 40 7.341 5.449 1.931 1.00 31.52 C ATOM 2472 CD2 TYR B 40 8.660 6.789 3.318 1.00 41.35 C ATOM 2473 CE1 TYR B 40 6.879 6.564 1.284 1.00 14.31 C ATOM 2474 CE2 TYR B 40 8.198 7.917 2.671 1.00 62.02 C ATOM 2475 CZ TYR B 40 7.309 7.788 1.652 1.00 72.41 C ATOM 2476 OH TYR B 40 6.835 8.897 0.998 1.00 10.43 O ATOM 0 H TYR B 40 10.550 2.435 3.798 1.00 13.35 H new ATOM 0 HA TYR B 40 7.763 2.616 2.884 1.00 63.23 H new ATOM 0 HB2 TYR B 40 8.270 4.177 4.624 1.00 23.54 H new ATOM 0 HB3 TYR B 40 9.857 4.525 3.968 1.00 23.54 H new ATOM 0 HD1 TYR B 40 6.987 4.475 1.626 1.00 31.52 H new ATOM 0 HD2 TYR B 40 9.366 6.899 4.127 1.00 41.35 H new ATOM 0 HE1 TYR B 40 6.168 6.463 0.477 1.00 14.31 H new ATOM 0 HE2 TYR B 40 8.541 8.896 2.973 1.00 62.02 H new ATOM 0 HH TYR B 40 7.241 9.702 1.383 1.00 10.43 H new ATOM 2486 N VAL B 41 8.548 2.922 0.566 1.00 33.53 N ATOM 2487 CA VAL B 41 8.892 3.130 -0.796 1.00 52.44 C ATOM 2488 C VAL B 41 7.825 4.005 -1.412 1.00 64.14 C ATOM 2489 O VAL B 41 6.717 3.548 -1.634 1.00 2.24 O ATOM 2490 CB VAL B 41 8.886 1.788 -1.526 1.00 4.41 C ATOM 2491 CG1 VAL B 41 9.212 1.943 -3.005 1.00 44.14 C ATOM 2492 CG2 VAL B 41 9.836 0.821 -0.856 1.00 24.00 C ATOM 0 H VAL B 41 7.613 2.536 0.698 1.00 33.53 H new ATOM 0 HA VAL B 41 9.877 3.591 -0.872 1.00 52.44 H new ATOM 0 HB VAL B 41 7.876 1.382 -1.466 1.00 4.41 H new ATOM 0 HG11 VAL B 41 9.197 0.965 -3.485 1.00 44.14 H new ATOM 0 HG12 VAL B 41 8.471 2.590 -3.475 1.00 44.14 H new ATOM 0 HG13 VAL B 41 10.202 2.386 -3.115 1.00 44.14 H new ATOM 0 HG21 VAL B 41 9.821 -0.131 -1.387 1.00 24.00 H new ATOM 0 HG22 VAL B 41 10.846 1.231 -0.875 1.00 24.00 H new ATOM 0 HG23 VAL B 41 9.527 0.665 0.178 1.00 24.00 H new ATOM 2502 N GLY B 42 8.108 5.251 -1.676 1.00 40.54 N ATOM 2503 CA GLY B 42 7.036 6.053 -2.157 1.00 61.41 C ATOM 2504 C GLY B 42 7.370 7.182 -3.063 1.00 13.34 C ATOM 2505 O GLY B 42 8.134 8.086 -2.704 1.00 64.11 O ATOM 0 H GLY B 42 9.015 5.705 -1.573 1.00 40.54 H new ATOM 0 HA2 GLY B 42 6.337 5.400 -2.679 1.00 61.41 H new ATOM 0 HA3 GLY B 42 6.509 6.460 -1.294 1.00 61.41 H new ATOM 2509 N ASN B 43 6.914 7.015 -4.289 1.00 62.20 N ATOM 2510 CA ASN B 43 6.714 8.073 -5.303 1.00 34.41 C ATOM 2511 C ASN B 43 6.266 7.345 -6.565 1.00 73.22 C ATOM 2512 O ASN B 43 6.377 7.814 -7.674 1.00 65.23 O ATOM 2513 CB ASN B 43 7.991 8.894 -5.551 1.00 40.11 C ATOM 2514 CG ASN B 43 7.756 10.148 -6.402 1.00 10.20 C ATOM 2515 OD1 ASN B 43 7.386 11.205 -5.881 1.00 22.11 O ATOM 2516 ND2 ASN B 43 8.017 10.057 -7.675 1.00 22.24 N ATOM 0 H ASN B 43 6.654 6.093 -4.639 1.00 62.20 H new ATOM 0 HA ASN B 43 5.974 8.800 -4.968 1.00 34.41 H new ATOM 0 HB2 ASN B 43 8.415 9.190 -4.592 1.00 40.11 H new ATOM 0 HB3 ASN B 43 8.729 8.262 -6.045 1.00 40.11 H new ATOM 0 HD21 ASN B 43 7.918 10.875 -8.276 1.00 22.24 H new ATOM 0 HD22 ASN B 43 8.321 9.167 -8.071 1.00 22.24 H new ATOM 2523 N VAL B 44 5.715 6.179 -6.334 1.00 43.14 N ATOM 2524 CA VAL B 44 5.254 5.309 -7.375 1.00 43.02 C ATOM 2525 C VAL B 44 3.740 5.391 -7.450 1.00 12.44 C ATOM 2526 O VAL B 44 3.017 4.735 -6.711 1.00 64.14 O ATOM 2527 CB VAL B 44 5.785 3.840 -7.196 1.00 30.45 C ATOM 2528 CG1 VAL B 44 5.447 3.257 -5.820 1.00 24.33 C ATOM 2529 CG2 VAL B 44 5.274 2.941 -8.306 1.00 14.03 C ATOM 0 H VAL B 44 5.574 5.805 -5.396 1.00 43.14 H new ATOM 0 HA VAL B 44 5.662 5.639 -8.330 1.00 43.02 H new ATOM 0 HB VAL B 44 6.872 3.887 -7.260 1.00 30.45 H new ATOM 0 HG11 VAL B 44 5.836 2.241 -5.749 1.00 24.33 H new ATOM 0 HG12 VAL B 44 5.898 3.874 -5.043 1.00 24.33 H new ATOM 0 HG13 VAL B 44 4.365 3.241 -5.687 1.00 24.33 H new ATOM 0 HG21 VAL B 44 5.655 1.930 -8.160 1.00 14.03 H new ATOM 0 HG22 VAL B 44 4.184 2.924 -8.288 1.00 14.03 H new ATOM 0 HG23 VAL B 44 5.615 3.322 -9.269 1.00 14.03 H new ATOM 2539 N ASP B 45 3.269 6.211 -8.340 1.00 21.22 N ATOM 2540 CA ASP B 45 1.874 6.536 -8.389 1.00 11.30 C ATOM 2541 C ASP B 45 1.314 5.833 -9.586 1.00 60.05 C ATOM 2542 O ASP B 45 1.525 6.303 -10.701 1.00 62.22 O ATOM 2543 CB ASP B 45 1.681 8.058 -8.609 1.00 70.52 C ATOM 2544 CG ASP B 45 2.606 8.971 -7.792 1.00 21.21 C ATOM 2545 OD1 ASP B 45 2.622 8.911 -6.555 1.00 25.33 O ATOM 2546 OD2 ASP B 45 3.341 9.765 -8.412 1.00 23.23 O ATOM 0 H ASP B 45 3.837 6.672 -9.050 1.00 21.22 H new ATOM 0 HA ASP B 45 1.387 6.243 -7.459 1.00 11.30 H new ATOM 0 HB2 ASP B 45 1.828 8.275 -9.667 1.00 70.52 H new ATOM 0 HB3 ASP B 45 0.648 8.313 -8.372 1.00 70.52 H new ATOM 2551 N TYR B 46 0.607 4.716 -9.396 1.00 1.13 N ATOM 2552 CA TYR B 46 0.137 3.877 -10.517 1.00 20.52 C ATOM 2553 C TYR B 46 1.225 3.483 -11.534 1.00 5.31 C ATOM 2554 O TYR B 46 2.427 3.764 -11.348 1.00 4.33 O ATOM 2555 CB TYR B 46 -1.145 4.429 -11.176 1.00 51.33 C ATOM 2556 CG TYR B 46 -2.350 4.302 -10.268 1.00 40.34 C ATOM 2557 CD1 TYR B 46 -2.956 3.062 -10.074 1.00 30.51 C ATOM 2558 CD2 TYR B 46 -2.859 5.393 -9.575 1.00 55.53 C ATOM 2559 CE1 TYR B 46 -4.026 2.921 -9.228 1.00 34.13 C ATOM 2560 CE2 TYR B 46 -3.931 5.251 -8.721 1.00 53.52 C ATOM 2561 CZ TYR B 46 -4.509 4.016 -8.553 1.00 53.15 C ATOM 2562 OH TYR B 46 -5.570 3.871 -7.699 1.00 23.25 O ATOM 0 H TYR B 46 0.343 4.365 -8.475 1.00 1.13 H new ATOM 0 HA TYR B 46 -0.137 2.930 -10.053 1.00 20.52 H new ATOM 0 HB2 TYR B 46 -0.996 5.477 -11.436 1.00 51.33 H new ATOM 0 HB3 TYR B 46 -1.334 3.893 -12.106 1.00 51.33 H new ATOM 0 HD1 TYR B 46 -2.577 2.198 -10.599 1.00 30.51 H new ATOM 0 HD2 TYR B 46 -2.408 6.366 -9.707 1.00 55.53 H new ATOM 0 HE1 TYR B 46 -4.487 1.954 -9.093 1.00 34.13 H new ATOM 0 HE2 TYR B 46 -4.315 6.107 -8.186 1.00 53.52 H new ATOM 0 HH TYR B 46 -5.355 4.284 -6.837 1.00 23.25 H new ATOM 2572 N GLY B 47 0.820 2.774 -12.557 1.00 62.44 N ATOM 2573 CA GLY B 47 1.731 2.322 -13.573 1.00 54.31 C ATOM 2574 C GLY B 47 2.426 1.053 -13.155 1.00 41.32 C ATOM 2575 O GLY B 47 2.290 0.010 -13.801 1.00 11.12 O ATOM 0 H GLY B 47 -0.150 2.495 -12.707 1.00 62.44 H new ATOM 0 HA2 GLY B 47 1.188 2.153 -14.503 1.00 54.31 H new ATOM 0 HA3 GLY B 47 2.471 3.097 -13.772 1.00 54.31 H new ATOM 2579 N SER B 48 3.128 1.136 -12.060 1.00 0.45 N ATOM 2580 CA SER B 48 3.866 0.038 -11.540 1.00 22.33 C ATOM 2581 C SER B 48 2.977 -0.773 -10.616 1.00 53.01 C ATOM 2582 O SER B 48 1.997 -0.252 -10.064 1.00 73.04 O ATOM 2583 CB SER B 48 5.087 0.559 -10.817 1.00 54.32 C ATOM 2584 OG SER B 48 5.900 1.318 -11.703 1.00 43.35 O ATOM 0 H SER B 48 3.200 1.986 -11.500 1.00 0.45 H new ATOM 0 HA SER B 48 4.199 -0.614 -12.348 1.00 22.33 H new ATOM 0 HB2 SER B 48 4.782 1.178 -9.973 1.00 54.32 H new ATOM 0 HB3 SER B 48 5.660 -0.274 -10.411 1.00 54.32 H new ATOM 0 HG SER B 48 6.816 1.353 -11.357 1.00 43.35 H new ATOM 2590 N THR B 49 3.294 -2.027 -10.454 1.00 75.11 N ATOM 2591 CA THR B 49 2.456 -2.899 -9.694 1.00 1.30 C ATOM 2592 C THR B 49 3.196 -3.477 -8.500 1.00 3.41 C ATOM 2593 O THR B 49 4.389 -3.208 -8.308 1.00 43.20 O ATOM 2594 CB THR B 49 1.951 -4.046 -10.574 1.00 51.50 C ATOM 2595 OG1 THR B 49 3.053 -4.889 -10.957 1.00 3.01 O ATOM 2596 CG2 THR B 49 1.292 -3.492 -11.835 1.00 4.22 C ATOM 0 H THR B 49 4.130 -2.465 -10.841 1.00 75.11 H new ATOM 0 HA THR B 49 1.613 -2.311 -9.331 1.00 1.30 H new ATOM 0 HB THR B 49 1.222 -4.624 -10.006 1.00 51.50 H new ATOM 0 HG1 THR B 49 3.641 -4.401 -11.571 1.00 3.01 H new ATOM 0 HG21 THR B 49 0.937 -4.317 -12.453 1.00 4.22 H new ATOM 0 HG22 THR B 49 0.450 -2.858 -11.557 1.00 4.22 H new ATOM 0 HG23 THR B 49 2.018 -2.905 -12.397 1.00 4.22 H new ATOM 2604 N ALA B 50 2.497 -4.285 -7.714 1.00 24.31 N ATOM 2605 CA ALA B 50 3.052 -4.927 -6.546 1.00 60.34 C ATOM 2606 C ALA B 50 4.155 -5.905 -6.963 1.00 72.11 C ATOM 2607 O ALA B 50 5.186 -5.999 -6.310 1.00 43.45 O ATOM 2608 CB ALA B 50 1.926 -5.639 -5.818 1.00 74.32 C ATOM 0 H ALA B 50 1.516 -4.511 -7.878 1.00 24.31 H new ATOM 0 HA ALA B 50 3.502 -4.192 -5.879 1.00 60.34 H new ATOM 0 HB1 ALA B 50 2.321 -6.133 -4.930 1.00 74.32 H new ATOM 0 HB2 ALA B 50 1.168 -4.914 -5.523 1.00 74.32 H new ATOM 0 HB3 ALA B 50 1.479 -6.383 -6.478 1.00 74.32 H new ATOM 2614 N GLN B 51 3.916 -6.628 -8.051 1.00 53.34 N ATOM 2615 CA GLN B 51 4.923 -7.518 -8.636 1.00 14.04 C ATOM 2616 C GLN B 51 6.210 -6.758 -9.026 1.00 40.51 C ATOM 2617 O GLN B 51 7.326 -7.256 -8.802 1.00 54.24 O ATOM 2618 CB GLN B 51 4.341 -8.231 -9.854 1.00 61.33 C ATOM 2619 CG GLN B 51 5.378 -8.983 -10.666 1.00 42.11 C ATOM 2620 CD GLN B 51 4.825 -9.648 -11.900 1.00 63.25 C ATOM 2621 OE1 GLN B 51 3.822 -9.217 -12.469 1.00 43.42 O ATOM 2622 NE2 GLN B 51 5.524 -10.635 -12.380 1.00 61.33 N ATOM 0 H GLN B 51 3.028 -6.618 -8.552 1.00 53.34 H new ATOM 0 HA GLN B 51 5.196 -8.253 -7.879 1.00 14.04 H new ATOM 0 HB2 GLN B 51 3.573 -8.930 -9.523 1.00 61.33 H new ATOM 0 HB3 GLN B 51 3.851 -7.498 -10.495 1.00 61.33 H new ATOM 0 HG2 GLN B 51 6.166 -8.290 -10.961 1.00 42.11 H new ATOM 0 HG3 GLN B 51 5.840 -9.741 -10.033 1.00 42.11 H new ATOM 0 HE21 GLN B 51 6.350 -10.965 -11.881 1.00 61.33 H new ATOM 0 HE22 GLN B 51 5.246 -11.078 -13.256 1.00 61.33 H new ATOM 2631 N ASP B 52 6.052 -5.556 -9.601 1.00 11.42 N ATOM 2632 CA ASP B 52 7.222 -4.715 -9.960 1.00 72.35 C ATOM 2633 C ASP B 52 8.023 -4.403 -8.719 1.00 30.23 C ATOM 2634 O ASP B 52 9.262 -4.339 -8.743 1.00 24.24 O ATOM 2635 CB ASP B 52 6.828 -3.386 -10.649 1.00 14.21 C ATOM 2636 CG ASP B 52 6.189 -3.542 -12.005 1.00 13.12 C ATOM 2637 OD1 ASP B 52 4.987 -3.721 -12.074 1.00 61.24 O ATOM 2638 OD2 ASP B 52 6.894 -3.444 -13.027 1.00 13.01 O ATOM 0 H ASP B 52 5.147 -5.144 -9.827 1.00 11.42 H new ATOM 0 HA ASP B 52 7.812 -5.290 -10.673 1.00 72.35 H new ATOM 0 HB2 ASP B 52 6.140 -2.846 -9.999 1.00 14.21 H new ATOM 0 HB3 ASP B 52 7.720 -2.768 -10.752 1.00 14.21 H new ATOM 2643 N LEU B 53 7.313 -4.224 -7.639 1.00 62.21 N ATOM 2644 CA LEU B 53 7.898 -3.957 -6.357 1.00 62.15 C ATOM 2645 C LEU B 53 8.660 -5.156 -5.839 1.00 74.32 C ATOM 2646 O LEU B 53 9.802 -5.001 -5.372 1.00 5.05 O ATOM 2647 CB LEU B 53 6.817 -3.490 -5.377 1.00 55.45 C ATOM 2648 CG LEU B 53 6.230 -2.137 -5.718 1.00 41.04 C ATOM 2649 CD1 LEU B 53 4.984 -1.889 -4.883 1.00 33.02 C ATOM 2650 CD2 LEU B 53 7.271 -1.071 -5.386 1.00 52.14 C ATOM 0 H LEU B 53 6.294 -4.261 -7.627 1.00 62.21 H new ATOM 0 HA LEU B 53 8.626 -3.152 -6.462 1.00 62.15 H new ATOM 0 HB2 LEU B 53 6.016 -4.229 -5.355 1.00 55.45 H new ATOM 0 HB3 LEU B 53 7.241 -3.450 -4.374 1.00 55.45 H new ATOM 0 HG LEU B 53 5.964 -2.103 -6.774 1.00 41.04 H new ATOM 0 HD11 LEU B 53 4.567 -0.914 -5.133 1.00 33.02 H new ATOM 0 HD12 LEU B 53 4.246 -2.664 -5.091 1.00 33.02 H new ATOM 0 HD13 LEU B 53 5.245 -1.911 -3.825 1.00 33.02 H new ATOM 0 HD21 LEU B 53 6.871 -0.085 -5.623 1.00 52.14 H new ATOM 0 HD22 LEU B 53 7.514 -1.118 -4.324 1.00 52.14 H new ATOM 0 HD23 LEU B 53 8.172 -1.248 -5.973 1.00 52.14 H new ATOM 2662 N GLU B 54 8.063 -6.364 -5.932 1.00 33.43 N ATOM 2663 CA GLU B 54 8.735 -7.567 -5.453 1.00 72.42 C ATOM 2664 C GLU B 54 10.055 -7.780 -6.137 1.00 21.03 C ATOM 2665 O GLU B 54 11.038 -7.930 -5.486 1.00 41.12 O ATOM 2666 CB GLU B 54 7.933 -8.816 -5.779 1.00 20.13 C ATOM 2667 CG GLU B 54 6.540 -8.904 -5.256 1.00 33.42 C ATOM 2668 CD GLU B 54 5.924 -10.212 -5.689 1.00 51.40 C ATOM 2669 OE1 GLU B 54 5.445 -10.301 -6.836 1.00 32.40 O ATOM 2670 OE2 GLU B 54 5.950 -11.187 -4.904 1.00 32.34 O ATOM 0 H GLU B 54 7.136 -6.520 -6.328 1.00 33.43 H new ATOM 0 HA GLU B 54 8.853 -7.417 -4.380 1.00 72.42 H new ATOM 0 HB2 GLU B 54 7.890 -8.913 -6.864 1.00 20.13 H new ATOM 0 HB3 GLU B 54 8.487 -9.677 -5.404 1.00 20.13 H new ATOM 0 HG2 GLU B 54 6.543 -8.833 -4.168 1.00 33.42 H new ATOM 0 HG3 GLU B 54 5.947 -8.069 -5.628 1.00 33.42 H new ATOM 2677 N ALA B 55 10.062 -7.737 -7.454 1.00 14.12 N ATOM 2678 CA ALA B 55 11.284 -8.010 -8.221 1.00 12.24 C ATOM 2679 C ALA B 55 12.413 -7.064 -7.830 1.00 70.34 C ATOM 2680 O ALA B 55 13.541 -7.507 -7.497 1.00 71.33 O ATOM 2681 CB ALA B 55 10.990 -7.894 -9.702 1.00 51.02 C ATOM 0 H ALA B 55 9.245 -7.518 -8.023 1.00 14.12 H new ATOM 0 HA ALA B 55 11.612 -9.024 -7.992 1.00 12.24 H new ATOM 0 HB1 ALA B 55 11.898 -8.097 -10.270 1.00 51.02 H new ATOM 0 HB2 ALA B 55 10.221 -8.615 -9.978 1.00 51.02 H new ATOM 0 HB3 ALA B 55 10.640 -6.886 -9.926 1.00 51.02 H new ATOM 2687 N HIS B 56 12.099 -5.797 -7.783 1.00 2.52 N ATOM 2688 CA HIS B 56 13.095 -4.785 -7.534 1.00 44.23 C ATOM 2689 C HIS B 56 13.618 -4.865 -6.098 1.00 61.41 C ATOM 2690 O HIS B 56 14.810 -4.700 -5.853 1.00 2.55 O ATOM 2691 CB HIS B 56 12.539 -3.392 -7.871 1.00 3.12 C ATOM 2692 CG HIS B 56 13.545 -2.279 -7.813 1.00 3.41 C ATOM 2693 ND1 HIS B 56 14.482 -2.067 -8.792 1.00 31.32 N ATOM 2694 CD2 HIS B 56 13.740 -1.304 -6.898 1.00 52.30 C ATOM 2695 CE1 HIS B 56 15.209 -1.018 -8.489 1.00 24.02 C ATOM 2696 NE2 HIS B 56 14.779 -0.532 -7.345 1.00 74.25 N ATOM 0 H HIS B 56 11.154 -5.437 -7.915 1.00 2.52 H new ATOM 0 HA HIS B 56 13.947 -4.967 -8.189 1.00 44.23 H new ATOM 0 HB2 HIS B 56 12.108 -3.421 -8.872 1.00 3.12 H new ATOM 0 HB3 HIS B 56 11.727 -3.164 -7.181 1.00 3.12 H new ATOM 0 HD2 HIS B 56 13.181 -1.160 -5.985 1.00 52.30 H new ATOM 0 HE1 HIS B 56 16.022 -0.621 -9.079 1.00 24.02 H new ATOM 0 HE2 HIS B 56 15.158 0.286 -6.868 1.00 74.25 H new ATOM 2705 N PHE B 57 12.732 -5.110 -5.158 1.00 21.12 N ATOM 2706 CA PHE B 57 13.115 -5.225 -3.767 1.00 24.13 C ATOM 2707 C PHE B 57 13.632 -6.590 -3.356 1.00 61.11 C ATOM 2708 O PHE B 57 14.359 -6.711 -2.383 1.00 23.52 O ATOM 2709 CB PHE B 57 12.069 -4.678 -2.826 1.00 73.33 C ATOM 2710 CG PHE B 57 12.045 -3.195 -2.858 1.00 10.41 C ATOM 2711 CD1 PHE B 57 13.023 -2.490 -2.203 1.00 3.23 C ATOM 2712 CD2 PHE B 57 11.079 -2.503 -3.551 1.00 33.40 C ATOM 2713 CE1 PHE B 57 13.042 -1.122 -2.229 1.00 53.01 C ATOM 2714 CE2 PHE B 57 11.099 -1.129 -3.582 1.00 61.34 C ATOM 2715 CZ PHE B 57 12.082 -0.445 -2.921 1.00 21.35 C ATOM 0 H PHE B 57 11.735 -5.234 -5.333 1.00 21.12 H new ATOM 0 HA PHE B 57 13.987 -4.577 -3.673 1.00 24.13 H new ATOM 0 HB2 PHE B 57 11.089 -5.067 -3.101 1.00 73.33 H new ATOM 0 HB3 PHE B 57 12.274 -5.020 -1.811 1.00 73.33 H new ATOM 0 HD1 PHE B 57 13.789 -3.023 -1.659 1.00 3.23 H new ATOM 0 HD2 PHE B 57 10.302 -3.041 -4.073 1.00 33.40 H new ATOM 0 HE1 PHE B 57 13.815 -0.581 -1.703 1.00 53.01 H new ATOM 0 HE2 PHE B 57 10.339 -0.590 -4.128 1.00 61.34 H new ATOM 0 HZ PHE B 57 12.098 0.635 -2.947 1.00 21.35 H new ATOM 2725 N SER B 58 13.267 -7.607 -4.103 1.00 13.43 N ATOM 2726 CA SER B 58 13.650 -8.967 -3.777 1.00 53.25 C ATOM 2727 C SER B 58 15.112 -9.169 -4.048 1.00 15.13 C ATOM 2728 O SER B 58 15.749 -10.026 -3.437 1.00 40.24 O ATOM 2729 CB SER B 58 12.813 -10.007 -4.533 1.00 44.04 C ATOM 2730 OG SER B 58 13.163 -11.337 -4.156 1.00 31.53 O ATOM 0 H SER B 58 12.701 -7.519 -4.947 1.00 13.43 H new ATOM 0 HA SER B 58 13.455 -9.115 -2.715 1.00 53.25 H new ATOM 0 HB2 SER B 58 11.755 -9.838 -4.333 1.00 44.04 H new ATOM 0 HB3 SER B 58 12.959 -9.882 -5.606 1.00 44.04 H new ATOM 0 HG SER B 58 12.610 -11.975 -4.655 1.00 31.53 H new ATOM 2736 N SER B 59 15.667 -8.405 -4.968 1.00 33.50 N ATOM 2737 CA SER B 59 17.084 -8.472 -5.181 1.00 2.53 C ATOM 2738 C SER B 59 17.820 -7.982 -3.909 1.00 11.04 C ATOM 2739 O SER B 59 18.930 -8.416 -3.603 1.00 2.25 O ATOM 2740 CB SER B 59 17.436 -7.629 -6.392 1.00 34.32 C ATOM 2741 OG SER B 59 16.654 -8.048 -7.513 1.00 10.41 O ATOM 0 H SER B 59 15.165 -7.747 -5.564 1.00 33.50 H new ATOM 0 HA SER B 59 17.398 -9.498 -5.372 1.00 2.53 H new ATOM 0 HB2 SER B 59 17.251 -6.576 -6.180 1.00 34.32 H new ATOM 0 HB3 SER B 59 18.497 -7.727 -6.620 1.00 34.32 H new ATOM 0 HG SER B 59 15.750 -7.677 -7.438 1.00 10.41 H new ATOM 2747 N CYS B 60 17.153 -7.119 -3.156 1.00 2.22 N ATOM 2748 CA CYS B 60 17.695 -6.559 -1.938 1.00 11.14 C ATOM 2749 C CYS B 60 17.238 -7.342 -0.686 1.00 64.24 C ATOM 2750 O CYS B 60 17.491 -6.908 0.430 1.00 32.14 O ATOM 2751 CB CYS B 60 17.239 -5.109 -1.820 1.00 61.22 C ATOM 2752 SG CYS B 60 17.633 -4.102 -3.264 1.00 35.24 S ATOM 0 H CYS B 60 16.214 -6.789 -3.379 1.00 2.22 H new ATOM 0 HA CYS B 60 18.782 -6.623 -1.988 1.00 11.14 H new ATOM 0 HB2 CYS B 60 16.161 -5.089 -1.658 1.00 61.22 H new ATOM 0 HB3 CYS B 60 17.702 -4.663 -0.940 1.00 61.22 H new ATOM 0 HG CYS B 60 18.218 -3.006 -2.882 1.00 35.24 H new ATOM 2758 N GLY B 61 16.594 -8.496 -0.870 1.00 72.03 N ATOM 2759 CA GLY B 61 16.151 -9.242 0.300 1.00 4.44 C ATOM 2760 C GLY B 61 14.972 -10.169 0.084 1.00 31.22 C ATOM 2761 O GLY B 61 14.580 -10.460 -1.046 1.00 74.33 O ATOM 0 H GLY B 61 16.377 -8.916 -1.774 1.00 72.03 H new ATOM 0 HA2 GLY B 61 16.990 -9.832 0.670 1.00 4.44 H new ATOM 0 HA3 GLY B 61 15.891 -8.531 1.084 1.00 4.44 H new ATOM 2765 N SER B 62 14.417 -10.636 1.173 1.00 24.10 N ATOM 2766 CA SER B 62 13.309 -11.558 1.151 1.00 51.44 C ATOM 2767 C SER B 62 12.034 -10.830 1.600 1.00 22.03 C ATOM 2768 O SER B 62 11.947 -10.356 2.741 1.00 33.13 O ATOM 2769 CB SER B 62 13.623 -12.721 2.096 1.00 24.42 C ATOM 2770 OG SER B 62 14.876 -13.320 1.762 1.00 24.34 O ATOM 0 H SER B 62 14.725 -10.384 2.112 1.00 24.10 H new ATOM 0 HA SER B 62 13.153 -11.944 0.144 1.00 51.44 H new ATOM 0 HB2 SER B 62 13.649 -12.363 3.125 1.00 24.42 H new ATOM 0 HB3 SER B 62 12.831 -13.467 2.038 1.00 24.42 H new ATOM 0 HG SER B 62 15.060 -14.060 2.378 1.00 24.34 H new ATOM 2776 N ILE B 63 11.070 -10.725 0.708 1.00 24.25 N ATOM 2777 CA ILE B 63 9.838 -10.003 0.987 1.00 63.45 C ATOM 2778 C ILE B 63 8.760 -10.929 1.567 1.00 61.32 C ATOM 2779 O ILE B 63 8.407 -11.949 0.968 1.00 53.44 O ATOM 2780 CB ILE B 63 9.299 -9.318 -0.287 1.00 4.31 C ATOM 2781 CG1 ILE B 63 10.369 -8.390 -0.872 1.00 62.14 C ATOM 2782 CG2 ILE B 63 8.029 -8.538 0.026 1.00 72.11 C ATOM 2783 CD1 ILE B 63 9.971 -7.735 -2.167 1.00 73.42 C ATOM 0 H ILE B 63 11.114 -11.133 -0.226 1.00 24.25 H new ATOM 0 HA ILE B 63 10.076 -9.241 1.729 1.00 63.45 H new ATOM 0 HB ILE B 63 9.057 -10.083 -1.024 1.00 4.31 H new ATOM 0 HG12 ILE B 63 10.602 -7.615 -0.142 1.00 62.14 H new ATOM 0 HG13 ILE B 63 11.283 -8.962 -1.032 1.00 62.14 H new ATOM 0 HG21 ILE B 63 7.662 -8.061 -0.883 1.00 72.11 H new ATOM 0 HG22 ILE B 63 7.270 -9.219 0.411 1.00 72.11 H new ATOM 0 HG23 ILE B 63 8.245 -7.775 0.774 1.00 72.11 H new ATOM 0 HD11 ILE B 63 10.782 -7.095 -2.515 1.00 73.42 H new ATOM 0 HD12 ILE B 63 9.767 -8.501 -2.915 1.00 73.42 H new ATOM 0 HD13 ILE B 63 9.075 -7.134 -2.010 1.00 73.42 H new ATOM 2795 N ASN B 64 8.273 -10.572 2.728 1.00 13.52 N ATOM 2796 CA ASN B 64 7.214 -11.328 3.405 1.00 10.24 C ATOM 2797 C ASN B 64 5.855 -10.756 3.132 1.00 32.33 C ATOM 2798 O ASN B 64 4.872 -11.480 3.043 1.00 71.02 O ATOM 2799 CB ASN B 64 7.408 -11.311 4.922 1.00 21.42 C ATOM 2800 CG ASN B 64 8.539 -12.163 5.424 1.00 3.42 C ATOM 2801 OD1 ASN B 64 8.852 -13.199 4.864 1.00 43.40 O ATOM 2802 ND2 ASN B 64 9.163 -11.731 6.477 1.00 61.03 N ATOM 0 H ASN B 64 8.590 -9.751 3.243 1.00 13.52 H new ATOM 0 HA ASN B 64 7.278 -12.344 3.015 1.00 10.24 H new ATOM 0 HB2 ASN B 64 7.578 -10.283 5.241 1.00 21.42 H new ATOM 0 HB3 ASN B 64 6.484 -11.643 5.396 1.00 21.42 H new ATOM 0 HD21 ASN B 64 9.943 -12.264 6.862 1.00 61.03 H new ATOM 0 HD22 ASN B 64 8.873 -10.859 6.920 1.00 61.03 H new ATOM 2809 N ARG B 65 5.792 -9.471 3.007 1.00 33.41 N ATOM 2810 CA ARG B 65 4.526 -8.804 2.960 1.00 24.33 C ATOM 2811 C ARG B 65 4.739 -7.459 2.275 1.00 4.20 C ATOM 2812 O ARG B 65 5.843 -6.952 2.292 1.00 25.34 O ATOM 2813 CB ARG B 65 4.177 -8.603 4.439 1.00 30.21 C ATOM 2814 CG ARG B 65 2.774 -8.904 4.892 1.00 24.52 C ATOM 2815 CD ARG B 65 1.771 -7.933 4.395 1.00 35.21 C ATOM 2816 NE ARG B 65 0.544 -8.083 5.166 1.00 62.34 N ATOM 2817 CZ ARG B 65 -0.033 -7.092 5.836 1.00 70.22 C ATOM 2818 NH1 ARG B 65 0.568 -5.894 5.897 1.00 62.02 N ATOM 2819 NH2 ARG B 65 -1.170 -7.311 6.510 1.00 12.51 N ATOM 0 H ARG B 65 6.604 -8.857 2.935 1.00 33.41 H new ATOM 0 HA ARG B 65 3.745 -9.341 2.422 1.00 24.33 H new ATOM 0 HB2 ARG B 65 4.855 -9.222 5.027 1.00 30.21 H new ATOM 0 HB3 ARG B 65 4.392 -7.565 4.692 1.00 30.21 H new ATOM 0 HG2 ARG B 65 2.498 -9.903 4.555 1.00 24.52 H new ATOM 0 HG3 ARG B 65 2.747 -8.916 5.982 1.00 24.52 H new ATOM 0 HD2 ARG B 65 2.153 -6.916 4.488 1.00 35.21 H new ATOM 0 HD3 ARG B 65 1.574 -8.103 3.337 1.00 35.21 H new ATOM 0 HE ARG B 65 0.103 -9.002 5.193 1.00 62.34 H new ATOM 0 HH11 ARG B 65 1.463 -5.748 5.430 1.00 62.02 H new ATOM 0 HH12 ARG B 65 0.130 -5.129 6.410 1.00 62.02 H new ATOM 0 HH21 ARG B 65 -1.593 -8.239 6.509 1.00 12.51 H new ATOM 0 HH22 ARG B 65 -1.613 -6.550 7.024 1.00 12.51 H new ATOM 2833 N ILE B 66 3.723 -6.910 1.647 1.00 31.21 N ATOM 2834 CA ILE B 66 3.823 -5.569 1.062 1.00 34.52 C ATOM 2835 C ILE B 66 2.473 -4.901 1.125 1.00 15.20 C ATOM 2836 O ILE B 66 1.439 -5.554 0.988 1.00 2.13 O ATOM 2837 CB ILE B 66 4.369 -5.491 -0.429 1.00 42.45 C ATOM 2838 CG1 ILE B 66 3.498 -6.197 -1.440 1.00 42.14 C ATOM 2839 CG2 ILE B 66 5.804 -5.944 -0.570 1.00 44.05 C ATOM 2840 CD1 ILE B 66 4.031 -6.065 -2.861 1.00 70.13 C ATOM 0 H ILE B 66 2.816 -7.360 1.523 1.00 31.21 H new ATOM 0 HA ILE B 66 4.574 -5.058 1.664 1.00 34.52 H new ATOM 0 HB ILE B 66 4.331 -4.426 -0.657 1.00 42.45 H new ATOM 0 HG12 ILE B 66 3.426 -7.253 -1.179 1.00 42.14 H new ATOM 0 HG13 ILE B 66 2.489 -5.788 -1.394 1.00 42.14 H new ATOM 0 HG21 ILE B 66 6.110 -5.864 -1.613 1.00 44.05 H new ATOM 0 HG22 ILE B 66 6.446 -5.315 0.046 1.00 44.05 H new ATOM 0 HG23 ILE B 66 5.892 -6.981 -0.244 1.00 44.05 H new ATOM 0 HD11 ILE B 66 3.368 -6.590 -3.549 1.00 70.13 H new ATOM 0 HD12 ILE B 66 4.078 -5.011 -3.136 1.00 70.13 H new ATOM 0 HD13 ILE B 66 5.029 -6.499 -2.917 1.00 70.13 H new ATOM 2852 N THR B 67 2.484 -3.634 1.351 1.00 72.24 N ATOM 2853 CA THR B 67 1.282 -2.843 1.403 1.00 3.32 C ATOM 2854 C THR B 67 1.467 -1.707 0.410 1.00 3.24 C ATOM 2855 O THR B 67 2.440 -0.980 0.501 1.00 34.52 O ATOM 2856 CB THR B 67 1.086 -2.257 2.818 1.00 52.04 C ATOM 2857 OG1 THR B 67 1.129 -3.327 3.791 1.00 4.11 O ATOM 2858 CG2 THR B 67 -0.254 -1.537 2.929 1.00 45.21 C ATOM 0 H THR B 67 3.338 -3.099 1.509 1.00 72.24 H new ATOM 0 HA THR B 67 0.409 -3.451 1.164 1.00 3.32 H new ATOM 0 HB THR B 67 1.885 -1.541 3.008 1.00 52.04 H new ATOM 0 HG1 THR B 67 2.049 -3.652 3.880 1.00 4.11 H new ATOM 0 HG21 THR B 67 -0.368 -1.133 3.935 1.00 45.21 H new ATOM 0 HG22 THR B 67 -0.291 -0.723 2.205 1.00 45.21 H new ATOM 0 HG23 THR B 67 -1.062 -2.240 2.726 1.00 45.21 H new ATOM 2866 N ILE B 68 0.571 -1.556 -0.523 1.00 22.34 N ATOM 2867 CA ILE B 68 0.712 -0.530 -1.523 1.00 61.22 C ATOM 2868 C ILE B 68 -0.513 0.326 -1.416 1.00 55.54 C ATOM 2869 O ILE B 68 -1.614 -0.181 -1.510 1.00 21.43 O ATOM 2870 CB ILE B 68 0.775 -1.066 -3.007 1.00 1.12 C ATOM 2871 CG1 ILE B 68 1.618 -2.336 -3.205 1.00 23.13 C ATOM 2872 CG2 ILE B 68 1.275 0.015 -3.955 1.00 21.42 C ATOM 2873 CD1 ILE B 68 0.934 -3.602 -2.742 1.00 11.11 C ATOM 0 H ILE B 68 -0.267 -2.130 -0.614 1.00 22.34 H new ATOM 0 HA ILE B 68 1.653 -0.013 -1.336 1.00 61.22 H new ATOM 0 HB ILE B 68 -0.254 -1.341 -3.238 1.00 1.12 H new ATOM 0 HG12 ILE B 68 1.867 -2.434 -4.262 1.00 23.13 H new ATOM 0 HG13 ILE B 68 2.558 -2.224 -2.665 1.00 23.13 H new ATOM 0 HG21 ILE B 68 1.309 -0.379 -4.971 1.00 21.42 H new ATOM 0 HG22 ILE B 68 0.600 0.870 -3.920 1.00 21.42 H new ATOM 0 HG23 ILE B 68 2.274 0.329 -3.654 1.00 21.42 H new ATOM 0 HD11 ILE B 68 1.591 -4.454 -2.914 1.00 11.11 H new ATOM 0 HD12 ILE B 68 0.710 -3.526 -1.678 1.00 11.11 H new ATOM 0 HD13 ILE B 68 0.007 -3.740 -3.299 1.00 11.11 H new ATOM 2885 N LEU B 69 -0.350 1.569 -1.173 1.00 1.40 N ATOM 2886 CA LEU B 69 -1.482 2.441 -1.072 1.00 72.12 C ATOM 2887 C LEU B 69 -1.433 3.559 -2.080 1.00 40.40 C ATOM 2888 O LEU B 69 -0.409 4.231 -2.241 1.00 40.11 O ATOM 2889 CB LEU B 69 -1.782 2.940 0.371 1.00 31.33 C ATOM 2890 CG LEU B 69 -0.652 3.597 1.185 1.00 43.32 C ATOM 2891 CD1 LEU B 69 -1.248 4.263 2.405 1.00 20.43 C ATOM 2892 CD2 LEU B 69 0.348 2.548 1.657 1.00 52.02 C ATOM 0 H LEU B 69 0.555 2.019 -1.038 1.00 1.40 H new ATOM 0 HA LEU B 69 -2.341 1.821 -1.328 1.00 72.12 H new ATOM 0 HB2 LEU B 69 -2.601 3.657 0.308 1.00 31.33 H new ATOM 0 HB3 LEU B 69 -2.148 2.088 0.944 1.00 31.33 H new ATOM 0 HG LEU B 69 -0.144 4.324 0.552 1.00 43.32 H new ATOM 0 HD11 LEU B 69 -0.455 4.731 2.988 1.00 20.43 H new ATOM 0 HD12 LEU B 69 -1.965 5.022 2.092 1.00 20.43 H new ATOM 0 HD13 LEU B 69 -1.755 3.516 3.016 1.00 20.43 H new ATOM 0 HD21 LEU B 69 1.139 3.031 2.230 1.00 52.02 H new ATOM 0 HD22 LEU B 69 -0.161 1.817 2.285 1.00 52.02 H new ATOM 0 HD23 LEU B 69 0.782 2.044 0.793 1.00 52.02 H new ATOM 2904 N CYS B 70 -2.515 3.741 -2.772 1.00 31.51 N ATOM 2905 CA CYS B 70 -2.635 4.785 -3.736 1.00 24.23 C ATOM 2906 C CYS B 70 -3.650 5.781 -3.230 1.00 50.32 C ATOM 2907 O CYS B 70 -4.840 5.474 -3.102 1.00 50.40 O ATOM 2908 CB CYS B 70 -3.046 4.218 -5.093 1.00 34.22 C ATOM 2909 SG CYS B 70 -1.874 3.013 -5.762 1.00 21.25 S ATOM 0 H CYS B 70 -3.349 3.160 -2.680 1.00 31.51 H new ATOM 0 HA CYS B 70 -1.675 5.282 -3.873 1.00 24.23 H new ATOM 0 HB2 CYS B 70 -4.024 3.747 -4.999 1.00 34.22 H new ATOM 0 HB3 CYS B 70 -3.155 5.039 -5.802 1.00 34.22 H new ATOM 0 HG CYS B 70 -2.302 2.583 -6.912 1.00 21.25 H new ATOM 2915 N ASP B 71 -3.183 6.936 -2.903 1.00 2.31 N ATOM 2916 CA ASP B 71 -3.999 7.963 -2.341 1.00 3.41 C ATOM 2917 C ASP B 71 -4.331 8.948 -3.429 1.00 43.24 C ATOM 2918 O ASP B 71 -3.440 9.578 -3.991 1.00 45.22 O ATOM 2919 CB ASP B 71 -3.213 8.657 -1.256 1.00 50.24 C ATOM 2920 CG ASP B 71 -4.022 9.582 -0.433 1.00 21.22 C ATOM 2921 OD1 ASP B 71 -4.390 10.684 -0.915 1.00 51.01 O ATOM 2922 OD2 ASP B 71 -4.261 9.234 0.724 1.00 44.14 O ATOM 0 H ASP B 71 -2.205 7.201 -3.020 1.00 2.31 H new ATOM 0 HA ASP B 71 -4.916 7.548 -1.923 1.00 3.41 H new ATOM 0 HB2 ASP B 71 -2.765 7.905 -0.607 1.00 50.24 H new ATOM 0 HB3 ASP B 71 -2.394 9.213 -1.712 1.00 50.24 H new ATOM 2927 N LYS B 72 -5.583 9.067 -3.755 1.00 0.31 N ATOM 2928 CA LYS B 72 -5.974 9.944 -4.823 1.00 13.22 C ATOM 2929 C LYS B 72 -6.767 11.122 -4.284 1.00 25.14 C ATOM 2930 O LYS B 72 -7.248 11.954 -5.058 1.00 42.43 O ATOM 2931 CB LYS B 72 -6.798 9.185 -5.875 1.00 11.14 C ATOM 2932 CG LYS B 72 -6.121 7.924 -6.405 1.00 11.03 C ATOM 2933 CD LYS B 72 -6.974 7.209 -7.450 1.00 41.22 C ATOM 2934 CE LYS B 72 -7.025 7.972 -8.764 1.00 4.43 C ATOM 2935 NZ LYS B 72 -7.950 7.347 -9.727 1.00 31.30 N ATOM 0 H LYS B 72 -6.350 8.571 -3.301 1.00 0.31 H new ATOM 0 HA LYS B 72 -5.070 10.323 -5.299 1.00 13.22 H new ATOM 0 HB2 LYS B 72 -7.760 8.913 -5.441 1.00 11.14 H new ATOM 0 HB3 LYS B 72 -7.004 9.853 -6.711 1.00 11.14 H new ATOM 0 HG2 LYS B 72 -5.158 8.187 -6.842 1.00 11.03 H new ATOM 0 HG3 LYS B 72 -5.920 7.245 -5.576 1.00 11.03 H new ATOM 0 HD2 LYS B 72 -6.571 6.211 -7.626 1.00 41.22 H new ATOM 0 HD3 LYS B 72 -7.986 7.081 -7.066 1.00 41.22 H new ATOM 0 HE2 LYS B 72 -7.337 8.999 -8.575 1.00 4.43 H new ATOM 0 HE3 LYS B 72 -6.026 8.017 -9.197 1.00 4.43 H new ATOM 0 HZ1 LYS B 72 -8.047 7.959 -10.562 1.00 31.30 H new ATOM 0 HZ2 LYS B 72 -7.575 6.421 -10.017 1.00 31.30 H new ATOM 0 HZ3 LYS B 72 -8.881 7.219 -9.281 1.00 31.30 H new ATOM 2949 N PHE B 73 -6.894 11.225 -2.947 1.00 64.45 N ATOM 2950 CA PHE B 73 -7.663 12.327 -2.387 1.00 74.34 C ATOM 2951 C PHE B 73 -6.832 13.596 -2.347 1.00 41.00 C ATOM 2952 O PHE B 73 -7.321 14.677 -2.045 1.00 40.31 O ATOM 2953 CB PHE B 73 -8.361 12.011 -1.030 1.00 23.33 C ATOM 2954 CG PHE B 73 -7.498 11.744 0.186 1.00 53.01 C ATOM 2955 CD1 PHE B 73 -6.727 12.749 0.754 1.00 24.00 C ATOM 2956 CD2 PHE B 73 -7.512 10.503 0.795 1.00 30.33 C ATOM 2957 CE1 PHE B 73 -5.990 12.520 1.894 1.00 72.52 C ATOM 2958 CE2 PHE B 73 -6.769 10.265 1.935 1.00 10.42 C ATOM 2959 CZ PHE B 73 -6.007 11.277 2.486 1.00 64.23 C ATOM 0 H PHE B 73 -6.488 10.582 -2.267 1.00 64.45 H new ATOM 0 HA PHE B 73 -8.498 12.491 -3.068 1.00 74.34 H new ATOM 0 HB2 PHE B 73 -9.017 12.849 -0.793 1.00 23.33 H new ATOM 0 HB3 PHE B 73 -8.998 11.140 -1.181 1.00 23.33 H new ATOM 0 HD1 PHE B 73 -6.705 13.726 0.294 1.00 24.00 H new ATOM 0 HD2 PHE B 73 -8.112 9.709 0.374 1.00 30.33 H new ATOM 0 HE1 PHE B 73 -5.399 13.315 2.324 1.00 72.52 H new ATOM 0 HE2 PHE B 73 -6.784 9.288 2.395 1.00 10.42 H new ATOM 0 HZ PHE B 73 -5.427 11.094 3.378 1.00 64.23 H new ATOM 2969 N SER B 74 -5.572 13.442 -2.681 1.00 61.22 N ATOM 2970 CA SER B 74 -4.660 14.550 -2.836 1.00 70.04 C ATOM 2971 C SER B 74 -4.876 15.182 -4.243 1.00 51.24 C ATOM 2972 O SER B 74 -4.111 16.031 -4.691 1.00 5.21 O ATOM 2973 CB SER B 74 -3.211 14.040 -2.663 1.00 43.44 C ATOM 2974 OG SER B 74 -2.254 15.091 -2.725 1.00 62.23 O ATOM 0 H SER B 74 -5.146 12.531 -2.855 1.00 61.22 H new ATOM 0 HA SER B 74 -4.844 15.314 -2.081 1.00 70.04 H new ATOM 0 HB2 SER B 74 -3.121 13.527 -1.705 1.00 43.44 H new ATOM 0 HB3 SER B 74 -2.992 13.307 -3.439 1.00 43.44 H new ATOM 0 HG SER B 74 -2.590 15.806 -3.305 1.00 62.23 H new ATOM 2980 N GLY B 75 -5.918 14.714 -4.927 1.00 35.25 N ATOM 2981 CA GLY B 75 -6.288 15.218 -6.233 1.00 72.23 C ATOM 2982 C GLY B 75 -5.645 14.404 -7.305 1.00 22.32 C ATOM 2983 O GLY B 75 -6.308 13.805 -8.150 1.00 12.03 O ATOM 0 H GLY B 75 -6.527 13.972 -4.583 1.00 35.25 H new ATOM 0 HA2 GLY B 75 -7.372 15.190 -6.347 1.00 72.23 H new ATOM 0 HA3 GLY B 75 -5.984 16.261 -6.327 1.00 72.23 H new ATOM 2987 N HIS B 76 -4.362 14.377 -7.257 1.00 74.24 N ATOM 2988 CA HIS B 76 -3.598 13.574 -8.157 1.00 43.53 C ATOM 2989 C HIS B 76 -3.251 12.292 -7.477 1.00 53.43 C ATOM 2990 O HIS B 76 -2.932 12.305 -6.285 1.00 12.54 O ATOM 2991 CB HIS B 76 -2.377 14.300 -8.724 1.00 45.20 C ATOM 2992 CG HIS B 76 -2.757 15.418 -9.645 1.00 73.35 C ATOM 2993 ND1 HIS B 76 -2.154 16.650 -9.651 1.00 5.54 N ATOM 2994 CD2 HIS B 76 -3.675 15.452 -10.627 1.00 2.41 C ATOM 2995 CE1 HIS B 76 -2.692 17.392 -10.595 1.00 2.34 C ATOM 2996 NE2 HIS B 76 -3.617 16.686 -11.206 1.00 30.32 N ATOM 0 H HIS B 76 -3.805 14.912 -6.591 1.00 74.24 H new ATOM 0 HA HIS B 76 -4.206 13.356 -9.035 1.00 43.53 H new ATOM 0 HB2 HIS B 76 -1.779 14.696 -7.903 1.00 45.20 H new ATOM 0 HB3 HIS B 76 -1.750 13.588 -9.260 1.00 45.20 H new ATOM 0 HD2 HIS B 76 -4.339 14.647 -10.907 1.00 2.41 H new ATOM 0 HE1 HIS B 76 -2.419 18.411 -10.829 1.00 2.34 H new ATOM 0 HE2 HIS B 76 -4.195 17.007 -11.983 1.00 30.32 H new ATOM 3005 N PRO B 77 -3.357 11.156 -8.185 1.00 22.13 N ATOM 3006 CA PRO B 77 -3.061 9.864 -7.599 1.00 63.51 C ATOM 3007 C PRO B 77 -1.629 9.780 -7.140 1.00 54.00 C ATOM 3008 O PRO B 77 -0.701 9.932 -7.932 1.00 34.12 O ATOM 3009 CB PRO B 77 -3.293 8.870 -8.747 1.00 34.14 C ATOM 3010 CG PRO B 77 -3.302 9.689 -9.993 1.00 14.41 C ATOM 3011 CD PRO B 77 -3.776 11.051 -9.593 1.00 63.22 C ATOM 0 HA PRO B 77 -3.678 9.669 -6.722 1.00 63.51 H new ATOM 0 HB2 PRO B 77 -2.505 8.117 -8.779 1.00 34.14 H new ATOM 0 HB3 PRO B 77 -4.236 8.339 -8.621 1.00 34.14 H new ATOM 0 HG2 PRO B 77 -2.307 9.737 -10.435 1.00 14.41 H new ATOM 0 HG3 PRO B 77 -3.962 9.251 -10.742 1.00 14.41 H new ATOM 0 HD2 PRO B 77 -3.324 11.830 -10.206 1.00 63.22 H new ATOM 0 HD3 PRO B 77 -4.856 11.148 -9.699 1.00 63.22 H new ATOM 3019 N LYS B 78 -1.453 9.595 -5.872 1.00 44.44 N ATOM 3020 CA LYS B 78 -0.165 9.410 -5.300 1.00 14.03 C ATOM 3021 C LYS B 78 -0.030 7.973 -4.871 1.00 3.12 C ATOM 3022 O LYS B 78 -0.976 7.387 -4.366 1.00 12.03 O ATOM 3023 CB LYS B 78 -0.048 10.308 -4.075 1.00 23.14 C ATOM 3024 CG LYS B 78 -0.279 11.797 -4.352 1.00 24.22 C ATOM 3025 CD LYS B 78 0.784 12.400 -5.263 1.00 13.45 C ATOM 3026 CE LYS B 78 2.163 12.277 -4.646 1.00 64.32 C ATOM 3027 NZ LYS B 78 2.210 12.878 -3.291 1.00 43.54 N ATOM 0 H LYS B 78 -2.216 9.568 -5.195 1.00 44.44 H new ATOM 0 HA LYS B 78 0.613 9.657 -6.022 1.00 14.03 H new ATOM 0 HB2 LYS B 78 -0.767 9.975 -3.327 1.00 23.14 H new ATOM 0 HB3 LYS B 78 0.944 10.182 -3.642 1.00 23.14 H new ATOM 0 HG2 LYS B 78 -1.260 11.929 -4.809 1.00 24.22 H new ATOM 0 HG3 LYS B 78 -0.292 12.340 -3.407 1.00 24.22 H new ATOM 0 HD2 LYS B 78 0.768 11.896 -6.229 1.00 13.45 H new ATOM 0 HD3 LYS B 78 0.557 13.450 -5.447 1.00 13.45 H new ATOM 0 HE2 LYS B 78 2.444 11.225 -4.588 1.00 64.32 H new ATOM 0 HE3 LYS B 78 2.895 12.768 -5.288 1.00 64.32 H new ATOM 0 HZ1 LYS B 78 3.201 12.992 -2.996 1.00 43.54 H new ATOM 0 HZ2 LYS B 78 1.744 13.808 -3.307 1.00 43.54 H new ATOM 0 HZ3 LYS B 78 1.718 12.256 -2.618 1.00 43.54 H new ATOM 3041 N GLY B 79 1.107 7.419 -5.070 1.00 31.03 N ATOM 3042 CA GLY B 79 1.324 6.076 -4.697 1.00 14.33 C ATOM 3043 C GLY B 79 2.551 5.907 -3.853 1.00 5.30 C ATOM 3044 O GLY B 79 3.609 6.516 -4.110 1.00 55.31 O ATOM 0 H GLY B 79 1.910 7.883 -5.495 1.00 31.03 H new ATOM 0 HA2 GLY B 79 0.456 5.710 -4.149 1.00 14.33 H new ATOM 0 HA3 GLY B 79 1.416 5.463 -5.594 1.00 14.33 H new ATOM 3048 N TYR B 80 2.415 5.102 -2.864 1.00 2.52 N ATOM 3049 CA TYR B 80 3.469 4.765 -1.970 1.00 64.41 C ATOM 3050 C TYR B 80 3.209 3.429 -1.367 1.00 43.41 C ATOM 3051 O TYR B 80 2.059 3.037 -1.171 1.00 45.01 O ATOM 3052 CB TYR B 80 3.822 5.887 -0.941 1.00 34.34 C ATOM 3053 CG TYR B 80 2.678 6.495 -0.152 1.00 54.54 C ATOM 3054 CD1 TYR B 80 1.774 7.337 -0.772 1.00 33.32 C ATOM 3055 CD2 TYR B 80 2.530 6.259 1.210 1.00 54.21 C ATOM 3056 CE1 TYR B 80 0.742 7.930 -0.070 1.00 73.20 C ATOM 3057 CE2 TYR B 80 1.493 6.848 1.929 1.00 35.31 C ATOM 3058 CZ TYR B 80 0.605 7.684 1.276 1.00 21.23 C ATOM 3059 OH TYR B 80 -0.429 8.271 1.974 1.00 73.35 O ATOM 0 H TYR B 80 1.533 4.640 -2.643 1.00 2.52 H new ATOM 0 HA TYR B 80 4.389 4.688 -2.550 1.00 64.41 H new ATOM 0 HB2 TYR B 80 4.541 5.479 -0.231 1.00 34.34 H new ATOM 0 HB3 TYR B 80 4.325 6.691 -1.478 1.00 34.34 H new ATOM 0 HD1 TYR B 80 1.877 7.536 -1.829 1.00 33.32 H new ATOM 0 HD2 TYR B 80 3.229 5.610 1.717 1.00 54.21 H new ATOM 0 HE1 TYR B 80 0.047 8.583 -0.576 1.00 73.20 H new ATOM 0 HE2 TYR B 80 1.383 6.654 2.986 1.00 35.31 H new ATOM 0 HH TYR B 80 -0.387 7.996 2.914 1.00 73.35 H new ATOM 3069 N ALA B 81 4.243 2.721 -1.106 1.00 42.21 N ATOM 3070 CA ALA B 81 4.130 1.381 -0.682 1.00 12.52 C ATOM 3071 C ALA B 81 5.096 1.090 0.409 1.00 61.01 C ATOM 3072 O ALA B 81 6.129 1.731 0.523 1.00 3.12 O ATOM 3073 CB ALA B 81 4.360 0.431 -1.850 1.00 64.41 C ATOM 0 H ALA B 81 5.202 3.061 -1.182 1.00 42.21 H new ATOM 0 HA ALA B 81 3.120 1.231 -0.300 1.00 12.52 H new ATOM 0 HB1 ALA B 81 4.269 -0.599 -1.505 1.00 64.41 H new ATOM 0 HB2 ALA B 81 3.617 0.621 -2.625 1.00 64.41 H new ATOM 0 HB3 ALA B 81 5.358 0.590 -2.257 1.00 64.41 H new ATOM 3079 N TYR B 82 4.764 0.169 1.211 1.00 74.44 N ATOM 3080 CA TYR B 82 5.622 -0.266 2.234 1.00 74.20 C ATOM 3081 C TYR B 82 5.935 -1.700 2.009 1.00 34.15 C ATOM 3082 O TYR B 82 5.046 -2.559 2.030 1.00 42.54 O ATOM 3083 CB TYR B 82 5.026 0.012 3.615 1.00 34.33 C ATOM 3084 CG TYR B 82 5.001 1.493 3.941 1.00 14.15 C ATOM 3085 CD1 TYR B 82 4.039 2.340 3.409 1.00 33.14 C ATOM 3086 CD2 TYR B 82 5.965 2.044 4.758 1.00 60.35 C ATOM 3087 CE1 TYR B 82 4.047 3.693 3.694 1.00 53.32 C ATOM 3088 CE2 TYR B 82 5.986 3.388 5.042 1.00 45.30 C ATOM 3089 CZ TYR B 82 5.040 4.203 4.519 1.00 45.44 C ATOM 3090 OH TYR B 82 5.120 5.535 4.787 1.00 53.14 O ATOM 0 H TYR B 82 3.868 -0.318 1.178 1.00 74.44 H new ATOM 0 HA TYR B 82 6.556 0.295 2.207 1.00 74.20 H new ATOM 0 HB2 TYR B 82 4.012 -0.385 3.658 1.00 34.33 H new ATOM 0 HB3 TYR B 82 5.606 -0.515 4.372 1.00 34.33 H new ATOM 0 HD1 TYR B 82 3.273 1.937 2.763 1.00 33.14 H new ATOM 0 HD2 TYR B 82 6.722 1.403 5.185 1.00 60.35 H new ATOM 0 HE1 TYR B 82 3.291 4.344 3.280 1.00 53.32 H new ATOM 0 HE2 TYR B 82 6.756 3.794 5.681 1.00 45.30 H new ATOM 0 HH TYR B 82 5.933 5.902 4.381 1.00 53.14 H new ATOM 3100 N ILE B 83 7.180 -1.957 1.749 1.00 35.23 N ATOM 3101 CA ILE B 83 7.642 -3.273 1.441 1.00 12.40 C ATOM 3102 C ILE B 83 8.149 -3.868 2.734 1.00 44.32 C ATOM 3103 O ILE B 83 9.059 -3.320 3.357 1.00 60.51 O ATOM 3104 CB ILE B 83 8.800 -3.214 0.402 1.00 14.33 C ATOM 3105 CG1 ILE B 83 8.391 -2.363 -0.827 1.00 23.54 C ATOM 3106 CG2 ILE B 83 9.191 -4.609 -0.056 1.00 31.44 C ATOM 3107 CD1 ILE B 83 7.187 -2.871 -1.598 1.00 74.20 C ATOM 0 H ILE B 83 7.913 -1.248 1.745 1.00 35.23 H new ATOM 0 HA ILE B 83 6.840 -3.873 1.012 1.00 12.40 H new ATOM 0 HB ILE B 83 9.657 -2.749 0.890 1.00 14.33 H new ATOM 0 HG12 ILE B 83 8.184 -1.347 -0.491 1.00 23.54 H new ATOM 0 HG13 ILE B 83 9.240 -2.307 -1.508 1.00 23.54 H new ATOM 0 HG21 ILE B 83 10.002 -4.540 -0.781 1.00 31.44 H new ATOM 0 HG22 ILE B 83 9.521 -5.195 0.802 1.00 31.44 H new ATOM 0 HG23 ILE B 83 8.331 -5.095 -0.518 1.00 31.44 H new ATOM 0 HD11 ILE B 83 6.985 -2.205 -2.437 1.00 74.20 H new ATOM 0 HD12 ILE B 83 7.391 -3.874 -1.972 1.00 74.20 H new ATOM 0 HD13 ILE B 83 6.319 -2.899 -0.940 1.00 74.20 H new ATOM 3119 N GLU B 84 7.547 -4.938 3.154 1.00 3.10 N ATOM 3120 CA GLU B 84 7.865 -5.529 4.424 1.00 63.43 C ATOM 3121 C GLU B 84 8.758 -6.781 4.199 1.00 54.31 C ATOM 3122 O GLU B 84 8.344 -7.765 3.548 1.00 54.13 O ATOM 3123 CB GLU B 84 6.505 -5.846 5.118 1.00 60.13 C ATOM 3124 CG GLU B 84 5.566 -4.587 5.116 1.00 1.12 C ATOM 3125 CD GLU B 84 4.169 -4.744 5.743 1.00 33.33 C ATOM 3126 OE1 GLU B 84 3.244 -5.304 5.081 1.00 21.54 O ATOM 3127 OE2 GLU B 84 3.948 -4.217 6.864 1.00 1.02 O ATOM 0 H GLU B 84 6.822 -5.428 2.630 1.00 3.10 H new ATOM 0 HA GLU B 84 8.440 -4.867 5.071 1.00 63.43 H new ATOM 0 HB2 GLU B 84 6.014 -6.672 4.603 1.00 60.13 H new ATOM 0 HB3 GLU B 84 6.683 -6.170 6.143 1.00 60.13 H new ATOM 0 HG2 GLU B 84 6.081 -3.782 5.639 1.00 1.12 H new ATOM 0 HG3 GLU B 84 5.437 -4.265 4.083 1.00 1.12 H new ATOM 3134 N PHE B 85 9.979 -6.740 4.727 1.00 53.25 N ATOM 3135 CA PHE B 85 10.961 -7.794 4.498 1.00 14.45 C ATOM 3136 C PHE B 85 11.116 -8.705 5.699 1.00 71.34 C ATOM 3137 O PHE B 85 10.609 -8.436 6.782 1.00 11.12 O ATOM 3138 CB PHE B 85 12.349 -7.210 4.193 1.00 51.51 C ATOM 3139 CG PHE B 85 12.460 -6.341 2.982 1.00 33.24 C ATOM 3140 CD1 PHE B 85 12.678 -6.896 1.732 1.00 0.22 C ATOM 3141 CD2 PHE B 85 12.381 -4.969 3.095 1.00 60.55 C ATOM 3142 CE1 PHE B 85 12.809 -6.092 0.621 1.00 73.51 C ATOM 3143 CE2 PHE B 85 12.517 -4.164 1.992 1.00 42.23 C ATOM 3144 CZ PHE B 85 12.729 -4.722 0.754 1.00 50.34 C ATOM 0 H PHE B 85 10.313 -5.981 5.321 1.00 53.25 H new ATOM 0 HA PHE B 85 10.584 -8.362 3.647 1.00 14.45 H new ATOM 0 HB2 PHE B 85 12.672 -6.631 5.058 1.00 51.51 H new ATOM 0 HB3 PHE B 85 13.050 -8.038 4.083 1.00 51.51 H new ATOM 0 HD1 PHE B 85 12.746 -7.969 1.627 1.00 0.22 H new ATOM 0 HD2 PHE B 85 12.210 -4.523 4.063 1.00 60.55 H new ATOM 0 HE1 PHE B 85 12.974 -6.533 -0.351 1.00 73.51 H new ATOM 0 HE2 PHE B 85 12.457 -3.091 2.097 1.00 42.23 H new ATOM 0 HZ PHE B 85 12.833 -4.088 -0.114 1.00 50.34 H new ATOM 3154 N ALA B 86 11.806 -9.802 5.470 1.00 70.44 N ATOM 3155 CA ALA B 86 12.158 -10.741 6.512 1.00 63.35 C ATOM 3156 C ALA B 86 13.381 -10.282 7.298 1.00 34.23 C ATOM 3157 O ALA B 86 13.481 -10.533 8.495 1.00 34.12 O ATOM 3158 CB ALA B 86 12.421 -12.115 5.905 1.00 41.23 C ATOM 0 H ALA B 86 12.142 -10.069 4.545 1.00 70.44 H new ATOM 0 HA ALA B 86 11.318 -10.798 7.205 1.00 63.35 H new ATOM 0 HB1 ALA B 86 12.686 -12.817 6.695 1.00 41.23 H new ATOM 0 HB2 ALA B 86 11.524 -12.465 5.394 1.00 41.23 H new ATOM 0 HB3 ALA B 86 13.242 -12.046 5.191 1.00 41.23 H new ATOM 3164 N GLU B 87 14.314 -9.635 6.635 1.00 3.24 N ATOM 3165 CA GLU B 87 15.544 -9.225 7.293 1.00 31.21 C ATOM 3166 C GLU B 87 15.678 -7.713 7.426 1.00 45.32 C ATOM 3167 O GLU B 87 15.195 -6.952 6.591 1.00 44.22 O ATOM 3168 CB GLU B 87 16.741 -9.704 6.487 1.00 4.13 C ATOM 3169 CG GLU B 87 16.829 -11.189 6.253 1.00 1.41 C ATOM 3170 CD GLU B 87 18.008 -11.524 5.379 1.00 45.34 C ATOM 3171 OE1 GLU B 87 17.863 -11.496 4.149 1.00 74.42 O ATOM 3172 OE2 GLU B 87 19.104 -11.801 5.912 1.00 24.13 O ATOM 0 H GLU B 87 14.250 -9.381 5.649 1.00 3.24 H new ATOM 0 HA GLU B 87 15.511 -9.665 8.290 1.00 31.21 H new ATOM 0 HB2 GLU B 87 16.725 -9.204 5.518 1.00 4.13 H new ATOM 0 HB3 GLU B 87 17.649 -9.382 6.997 1.00 4.13 H new ATOM 0 HG2 GLU B 87 16.919 -11.707 7.208 1.00 1.41 H new ATOM 0 HG3 GLU B 87 15.911 -11.543 5.784 1.00 1.41 H new ATOM 3179 N ARG B 88 16.369 -7.299 8.484 1.00 34.33 N ATOM 3180 CA ARG B 88 16.819 -5.917 8.656 1.00 24.45 C ATOM 3181 C ARG B 88 17.865 -5.646 7.606 1.00 22.32 C ATOM 3182 O ARG B 88 18.021 -4.523 7.119 1.00 64.54 O ATOM 3183 CB ARG B 88 17.461 -5.748 10.034 1.00 14.21 C ATOM 3184 CG ARG B 88 16.504 -5.622 11.191 1.00 2.42 C ATOM 3185 CD ARG B 88 15.866 -4.240 11.200 1.00 43.14 C ATOM 3186 NE ARG B 88 16.890 -3.190 11.373 1.00 43.11 N ATOM 3187 CZ ARG B 88 16.676 -1.969 11.869 1.00 20.25 C ATOM 3188 NH1 ARG B 88 15.454 -1.584 12.208 1.00 41.23 N ATOM 3189 NH2 ARG B 88 17.691 -1.128 12.011 1.00 63.11 N ATOM 0 H ARG B 88 16.635 -7.915 9.252 1.00 34.33 H new ATOM 0 HA ARG B 88 15.975 -5.233 8.566 1.00 24.45 H new ATOM 0 HB2 ARG B 88 18.113 -6.602 10.218 1.00 14.21 H new ATOM 0 HB3 ARG B 88 18.095 -4.861 10.013 1.00 14.21 H new ATOM 0 HG2 ARG B 88 15.731 -6.387 11.117 1.00 2.42 H new ATOM 0 HG3 ARG B 88 17.032 -5.792 12.129 1.00 2.42 H new ATOM 0 HD2 ARG B 88 15.326 -4.078 10.267 1.00 43.14 H new ATOM 0 HD3 ARG B 88 15.135 -4.177 12.006 1.00 43.14 H new ATOM 0 HE ARG B 88 17.843 -3.417 11.089 1.00 43.11 H new ATOM 0 HH11 ARG B 88 14.667 -2.222 12.091 1.00 41.23 H new ATOM 0 HH12 ARG B 88 15.300 -0.649 12.586 1.00 41.23 H new ATOM 0 HH21 ARG B 88 18.632 -1.414 11.742 1.00 63.11 H new ATOM 0 HH22 ARG B 88 17.531 -0.195 12.390 1.00 63.11 H new ATOM 3203 N ASN B 89 18.575 -6.710 7.272 1.00 25.40 N ATOM 3204 CA ASN B 89 19.608 -6.713 6.250 1.00 64.45 C ATOM 3205 C ASN B 89 19.029 -6.244 4.941 1.00 44.53 C ATOM 3206 O ASN B 89 19.642 -5.459 4.219 1.00 5.13 O ATOM 3207 CB ASN B 89 20.152 -8.133 6.053 1.00 15.03 C ATOM 3208 CG ASN B 89 20.729 -8.752 7.311 1.00 71.10 C ATOM 3209 OD1 ASN B 89 21.260 -8.060 8.178 1.00 75.03 O ATOM 3210 ND2 ASN B 89 20.600 -10.056 7.441 1.00 33.42 N ATOM 0 H ASN B 89 18.446 -7.619 7.716 1.00 25.40 H new ATOM 0 HA ASN B 89 20.411 -6.049 6.569 1.00 64.45 H new ATOM 0 HB2 ASN B 89 19.349 -8.770 5.682 1.00 15.03 H new ATOM 0 HB3 ASN B 89 20.924 -8.112 5.284 1.00 15.03 H new ATOM 0 HD21 ASN B 89 20.946 -10.522 8.280 1.00 33.42 H new ATOM 0 HD22 ASN B 89 20.154 -10.601 6.703 1.00 33.42 H new ATOM 3217 N SER B 90 17.823 -6.705 4.639 1.00 72.14 N ATOM 3218 CA SER B 90 17.158 -6.377 3.421 1.00 22.45 C ATOM 3219 C SER B 90 16.820 -4.895 3.356 1.00 44.40 C ATOM 3220 O SER B 90 16.963 -4.270 2.305 1.00 71.21 O ATOM 3221 CB SER B 90 15.883 -7.197 3.330 1.00 72.15 C ATOM 3222 OG SER B 90 16.154 -8.582 3.503 1.00 61.22 O ATOM 0 H SER B 90 17.288 -7.322 5.250 1.00 72.14 H new ATOM 0 HA SER B 90 17.820 -6.604 2.585 1.00 22.45 H new ATOM 0 HB2 SER B 90 15.177 -6.863 4.090 1.00 72.15 H new ATOM 0 HB3 SER B 90 15.410 -7.034 2.362 1.00 72.15 H new ATOM 0 HG SER B 90 15.310 -9.071 3.602 1.00 61.22 H new ATOM 3228 N VAL B 91 16.394 -4.312 4.490 1.00 60.31 N ATOM 3229 CA VAL B 91 16.030 -2.908 4.478 1.00 52.41 C ATOM 3230 C VAL B 91 17.262 -2.093 4.254 1.00 11.32 C ATOM 3231 O VAL B 91 17.240 -1.146 3.512 1.00 62.23 O ATOM 3232 CB VAL B 91 15.247 -2.403 5.752 1.00 71.42 C ATOM 3233 CG1 VAL B 91 14.169 -3.357 6.151 1.00 24.12 C ATOM 3234 CG2 VAL B 91 16.121 -1.982 6.942 1.00 65.45 C ATOM 0 H VAL B 91 16.299 -4.782 5.391 1.00 60.31 H new ATOM 0 HA VAL B 91 15.319 -2.782 3.661 1.00 52.41 H new ATOM 0 HB VAL B 91 14.779 -1.472 5.432 1.00 71.42 H new ATOM 0 HG11 VAL B 91 13.653 -2.975 7.032 1.00 24.12 H new ATOM 0 HG12 VAL B 91 13.458 -3.466 5.332 1.00 24.12 H new ATOM 0 HG13 VAL B 91 14.609 -4.327 6.381 1.00 24.12 H new ATOM 0 HG21 VAL B 91 15.484 -1.652 7.763 1.00 65.45 H new ATOM 0 HG22 VAL B 91 16.724 -2.829 7.268 1.00 65.45 H new ATOM 0 HG23 VAL B 91 16.777 -1.165 6.641 1.00 65.45 H new ATOM 3244 N ASP B 92 18.358 -2.525 4.868 1.00 70.20 N ATOM 3245 CA ASP B 92 19.649 -1.861 4.776 1.00 51.23 C ATOM 3246 C ASP B 92 20.103 -1.782 3.315 1.00 14.31 C ATOM 3247 O ASP B 92 20.672 -0.776 2.871 1.00 13.30 O ATOM 3248 CB ASP B 92 20.656 -2.664 5.598 1.00 40.33 C ATOM 3249 CG ASP B 92 21.986 -1.979 5.773 1.00 2.23 C ATOM 3250 OD1 ASP B 92 22.848 -2.099 4.894 1.00 2.43 O ATOM 3251 OD2 ASP B 92 22.190 -1.333 6.824 1.00 71.20 O ATOM 0 H ASP B 92 18.372 -3.361 5.453 1.00 70.20 H new ATOM 0 HA ASP B 92 19.575 -0.844 5.161 1.00 51.23 H new ATOM 0 HB2 ASP B 92 20.230 -2.865 6.581 1.00 40.33 H new ATOM 0 HB3 ASP B 92 20.816 -3.629 5.117 1.00 40.33 H new ATOM 3256 N ALA B 93 19.839 -2.844 2.577 1.00 52.12 N ATOM 3257 CA ALA B 93 20.153 -2.914 1.167 1.00 53.10 C ATOM 3258 C ALA B 93 19.175 -2.063 0.335 1.00 63.24 C ATOM 3259 O ALA B 93 19.565 -1.421 -0.637 1.00 11.34 O ATOM 3260 CB ALA B 93 20.136 -4.362 0.698 1.00 42.53 C ATOM 0 H ALA B 93 19.397 -3.687 2.944 1.00 52.12 H new ATOM 0 HA ALA B 93 21.154 -2.508 1.020 1.00 53.10 H new ATOM 0 HB1 ALA B 93 20.374 -4.403 -0.365 1.00 42.53 H new ATOM 0 HB2 ALA B 93 20.876 -4.934 1.258 1.00 42.53 H new ATOM 0 HB3 ALA B 93 19.146 -4.787 0.865 1.00 42.53 H new ATOM 3266 N ALA B 94 17.913 -2.050 0.744 1.00 52.23 N ATOM 3267 CA ALA B 94 16.861 -1.342 0.009 1.00 14.14 C ATOM 3268 C ALA B 94 16.966 0.169 0.201 1.00 62.05 C ATOM 3269 O ALA B 94 16.858 0.930 -0.747 1.00 54.55 O ATOM 3270 CB ALA B 94 15.490 -1.845 0.443 1.00 63.31 C ATOM 0 H ALA B 94 17.587 -2.524 1.586 1.00 52.23 H new ATOM 0 HA ALA B 94 16.993 -1.548 -1.053 1.00 14.14 H new ATOM 0 HB1 ALA B 94 14.716 -1.312 -0.109 1.00 63.31 H new ATOM 0 HB2 ALA B 94 15.413 -2.913 0.238 1.00 63.31 H new ATOM 0 HB3 ALA B 94 15.360 -1.670 1.511 1.00 63.31 H new ATOM 3276 N VAL B 95 17.171 0.581 1.436 1.00 4.20 N ATOM 3277 CA VAL B 95 17.343 1.997 1.810 1.00 14.35 C ATOM 3278 C VAL B 95 18.517 2.648 1.090 1.00 51.11 C ATOM 3279 O VAL B 95 18.562 3.857 0.958 1.00 43.45 O ATOM 3280 CB VAL B 95 17.443 2.207 3.346 1.00 51.03 C ATOM 3281 CG1 VAL B 95 16.217 1.673 4.048 1.00 52.11 C ATOM 3282 CG2 VAL B 95 18.723 1.626 3.932 1.00 20.15 C ATOM 0 H VAL B 95 17.226 -0.057 2.230 1.00 4.20 H new ATOM 0 HA VAL B 95 16.435 2.500 1.478 1.00 14.35 H new ATOM 0 HB VAL B 95 17.487 3.282 3.518 1.00 51.03 H new ATOM 0 HG11 VAL B 95 16.314 1.833 5.122 1.00 52.11 H new ATOM 0 HG12 VAL B 95 15.332 2.194 3.682 1.00 52.11 H new ATOM 0 HG13 VAL B 95 16.119 0.606 3.848 1.00 52.11 H new ATOM 0 HG21 VAL B 95 18.742 1.800 5.008 1.00 20.15 H new ATOM 0 HG22 VAL B 95 18.759 0.554 3.737 1.00 20.15 H new ATOM 0 HG23 VAL B 95 19.585 2.107 3.471 1.00 20.15 H new ATOM 3292 N ALA B 96 19.459 1.828 0.623 1.00 60.10 N ATOM 3293 CA ALA B 96 20.606 2.314 -0.144 1.00 23.41 C ATOM 3294 C ALA B 96 20.149 2.815 -1.524 1.00 22.14 C ATOM 3295 O ALA B 96 20.889 3.507 -2.228 1.00 73.44 O ATOM 3296 CB ALA B 96 21.641 1.213 -0.294 1.00 3.02 C ATOM 0 H ALA B 96 19.449 0.818 0.764 1.00 60.10 H new ATOM 0 HA ALA B 96 21.061 3.146 0.393 1.00 23.41 H new ATOM 0 HB1 ALA B 96 22.490 1.587 -0.867 1.00 3.02 H new ATOM 0 HB2 ALA B 96 21.980 0.896 0.692 1.00 3.02 H new ATOM 0 HB3 ALA B 96 21.197 0.365 -0.815 1.00 3.02 H new ATOM 3302 N MET B 97 18.925 2.456 -1.886 1.00 72.31 N ATOM 3303 CA MET B 97 18.317 2.877 -3.140 1.00 22.22 C ATOM 3304 C MET B 97 17.381 4.058 -2.900 1.00 11.13 C ATOM 3305 O MET B 97 16.573 4.386 -3.771 1.00 35.42 O ATOM 3306 CB MET B 97 17.507 1.739 -3.797 1.00 54.20 C ATOM 3307 CG MET B 97 18.294 0.498 -4.183 1.00 31.02 C ATOM 3308 SD MET B 97 17.292 -0.652 -5.172 1.00 11.12 S ATOM 3309 CE MET B 97 15.984 -1.104 -4.024 1.00 31.31 C ATOM 0 H MET B 97 18.323 1.862 -1.315 1.00 72.31 H new ATOM 0 HA MET B 97 19.129 3.162 -3.809 1.00 22.22 H new ATOM 0 HB2 MET B 97 16.713 1.443 -3.112 1.00 54.20 H new ATOM 0 HB3 MET B 97 17.025 2.133 -4.692 1.00 54.20 H new ATOM 0 HG2 MET B 97 19.179 0.789 -4.749 1.00 31.02 H new ATOM 0 HG3 MET B 97 18.644 -0.006 -3.282 1.00 31.02 H new ATOM 0 HE1 MET B 97 15.667 -2.129 -4.219 1.00 31.31 H new ATOM 0 HE2 MET B 97 16.354 -1.027 -3.002 1.00 31.31 H new ATOM 0 HE3 MET B 97 15.137 -0.431 -4.155 1.00 31.31 H new ATOM 3319 N ASP B 98 17.489 4.675 -1.701 1.00 74.41 N ATOM 3320 CA ASP B 98 16.657 5.834 -1.277 1.00 4.32 C ATOM 3321 C ASP B 98 16.331 6.807 -2.390 1.00 14.34 C ATOM 3322 O ASP B 98 15.168 7.074 -2.615 1.00 63.42 O ATOM 3323 CB ASP B 98 17.277 6.584 -0.066 1.00 61.35 C ATOM 3324 CG ASP B 98 18.597 7.282 -0.350 1.00 14.04 C ATOM 3325 OD1 ASP B 98 19.630 6.599 -0.479 1.00 35.30 O ATOM 3326 OD2 ASP B 98 18.620 8.538 -0.413 1.00 42.00 O ATOM 0 H ASP B 98 18.161 4.383 -0.991 1.00 74.41 H new ATOM 0 HA ASP B 98 15.709 5.392 -0.970 1.00 4.32 H new ATOM 0 HB2 ASP B 98 16.561 7.325 0.289 1.00 61.35 H new ATOM 0 HB3 ASP B 98 17.427 5.872 0.745 1.00 61.35 H new ATOM 3331 N GLU B 99 17.318 7.346 -3.062 1.00 3.23 N ATOM 3332 CA GLU B 99 17.057 8.210 -4.175 1.00 74.23 C ATOM 3333 C GLU B 99 17.393 7.496 -5.491 1.00 25.35 C ATOM 3334 O GLU B 99 18.554 7.479 -5.946 1.00 24.43 O ATOM 3335 CB GLU B 99 17.820 9.531 -4.012 1.00 10.12 C ATOM 3336 CG GLU B 99 17.540 10.573 -5.079 1.00 52.43 C ATOM 3337 CD GLU B 99 18.226 11.880 -4.777 1.00 45.22 C ATOM 3338 OE1 GLU B 99 17.679 12.677 -3.988 1.00 52.25 O ATOM 3339 OE2 GLU B 99 19.322 12.140 -5.314 1.00 71.44 O ATOM 0 H GLU B 99 18.306 7.199 -2.855 1.00 3.23 H new ATOM 0 HA GLU B 99 15.995 8.455 -4.205 1.00 74.23 H new ATOM 0 HB2 GLU B 99 17.576 9.956 -3.038 1.00 10.12 H new ATOM 0 HB3 GLU B 99 18.889 9.317 -4.007 1.00 10.12 H new ATOM 0 HG2 GLU B 99 17.876 10.201 -6.047 1.00 52.43 H new ATOM 0 HG3 GLU B 99 16.465 10.736 -5.155 1.00 52.43 H new ATOM 3346 N THR B 100 16.395 6.854 -6.041 1.00 74.53 N ATOM 3347 CA THR B 100 16.520 6.145 -7.309 1.00 1.52 C ATOM 3348 C THR B 100 15.348 6.427 -8.224 1.00 73.32 C ATOM 3349 O THR B 100 14.348 7.004 -7.805 1.00 2.52 O ATOM 3350 CB THR B 100 16.707 4.608 -7.143 1.00 22.54 C ATOM 3351 OG1 THR B 100 15.685 4.050 -6.294 1.00 32.04 O ATOM 3352 CG2 THR B 100 18.094 4.254 -6.616 1.00 13.22 C ATOM 0 H THR B 100 15.464 6.802 -5.628 1.00 74.53 H new ATOM 0 HA THR B 100 17.431 6.532 -7.766 1.00 1.52 H new ATOM 0 HB THR B 100 16.611 4.167 -8.135 1.00 22.54 H new ATOM 0 HG1 THR B 100 15.828 4.348 -5.371 1.00 32.04 H new ATOM 0 HG21 THR B 100 18.180 3.172 -6.516 1.00 13.22 H new ATOM 0 HG22 THR B 100 18.851 4.615 -7.312 1.00 13.22 H new ATOM 0 HG23 THR B 100 18.244 4.722 -5.643 1.00 13.22 H new ATOM 3360 N VAL B 101 15.466 6.020 -9.459 1.00 73.33 N ATOM 3361 CA VAL B 101 14.426 6.229 -10.416 1.00 3.43 C ATOM 3362 C VAL B 101 13.667 4.921 -10.613 1.00 33.45 C ATOM 3363 O VAL B 101 14.261 3.837 -10.608 1.00 74.41 O ATOM 3364 CB VAL B 101 14.995 6.756 -11.777 1.00 53.53 C ATOM 3365 CG1 VAL B 101 15.948 5.762 -12.417 1.00 51.13 C ATOM 3366 CG2 VAL B 101 13.882 7.136 -12.738 1.00 43.14 C ATOM 0 H VAL B 101 16.286 5.536 -9.825 1.00 73.33 H new ATOM 0 HA VAL B 101 13.746 6.994 -10.040 1.00 3.43 H new ATOM 0 HB VAL B 101 15.565 7.657 -11.551 1.00 53.53 H new ATOM 0 HG11 VAL B 101 16.319 6.168 -13.358 1.00 51.13 H new ATOM 0 HG12 VAL B 101 16.787 5.578 -11.746 1.00 51.13 H new ATOM 0 HG13 VAL B 101 15.423 4.826 -12.607 1.00 51.13 H new ATOM 0 HG21 VAL B 101 14.314 7.497 -13.671 1.00 43.14 H new ATOM 0 HG22 VAL B 101 13.261 6.263 -12.940 1.00 43.14 H new ATOM 0 HG23 VAL B 101 13.270 7.921 -12.294 1.00 43.14 H new ATOM 3376 N PHE B 102 12.383 5.008 -10.703 1.00 40.34 N ATOM 3377 CA PHE B 102 11.574 3.854 -10.936 1.00 20.14 C ATOM 3378 C PHE B 102 10.461 4.257 -11.886 1.00 25.11 C ATOM 3379 O PHE B 102 9.672 5.131 -11.567 1.00 11.55 O ATOM 3380 CB PHE B 102 11.025 3.356 -9.592 1.00 75.34 C ATOM 3381 CG PHE B 102 10.348 2.021 -9.626 1.00 42.51 C ATOM 3382 CD1 PHE B 102 11.102 0.859 -9.675 1.00 51.23 C ATOM 3383 CD2 PHE B 102 8.974 1.919 -9.582 1.00 1.23 C ATOM 3384 CE1 PHE B 102 10.496 -0.377 -9.681 1.00 62.01 C ATOM 3385 CE2 PHE B 102 8.363 0.685 -9.591 1.00 71.40 C ATOM 3386 CZ PHE B 102 9.124 -0.464 -9.640 1.00 70.20 C ATOM 0 H PHE B 102 11.862 5.881 -10.617 1.00 40.34 H new ATOM 0 HA PHE B 102 12.144 3.040 -11.385 1.00 20.14 H new ATOM 0 HB2 PHE B 102 11.848 3.308 -8.879 1.00 75.34 H new ATOM 0 HB3 PHE B 102 10.317 4.093 -9.213 1.00 75.34 H new ATOM 0 HD1 PHE B 102 12.179 0.924 -9.709 1.00 51.23 H new ATOM 0 HD2 PHE B 102 8.372 2.814 -9.540 1.00 1.23 H new ATOM 0 HE1 PHE B 102 11.095 -1.275 -9.718 1.00 62.01 H new ATOM 0 HE2 PHE B 102 7.286 0.617 -9.560 1.00 71.40 H new ATOM 0 HZ PHE B 102 8.643 -1.431 -9.646 1.00 70.20 H new ATOM 3396 N ARG B 103 10.448 3.659 -13.072 1.00 34.10 N ATOM 3397 CA ARG B 103 9.487 3.969 -14.152 1.00 13.20 C ATOM 3398 C ARG B 103 9.531 5.483 -14.523 1.00 35.45 C ATOM 3399 O ARG B 103 8.537 6.102 -14.925 1.00 54.23 O ATOM 3400 CB ARG B 103 8.070 3.501 -13.776 1.00 30.45 C ATOM 3401 CG ARG B 103 7.110 3.527 -14.955 1.00 62.42 C ATOM 3402 CD ARG B 103 5.783 2.908 -14.626 1.00 30.22 C ATOM 3403 NE ARG B 103 4.916 2.864 -15.807 1.00 24.20 N ATOM 3404 CZ ARG B 103 4.271 1.769 -16.230 1.00 33.15 C ATOM 3405 NH1 ARG B 103 4.491 0.594 -15.645 1.00 61.15 N ATOM 3406 NH2 ARG B 103 3.450 1.839 -17.273 1.00 71.41 N ATOM 0 H ARG B 103 11.114 2.929 -13.326 1.00 34.10 H new ATOM 0 HA ARG B 103 9.781 3.416 -15.044 1.00 13.20 H new ATOM 0 HB2 ARG B 103 8.121 2.488 -13.377 1.00 30.45 H new ATOM 0 HB3 ARG B 103 7.681 4.138 -12.982 1.00 30.45 H new ATOM 0 HG2 ARG B 103 6.958 4.558 -15.273 1.00 62.42 H new ATOM 0 HG3 ARG B 103 7.557 2.996 -15.796 1.00 62.42 H new ATOM 0 HD2 ARG B 103 5.934 1.899 -14.243 1.00 30.22 H new ATOM 0 HD3 ARG B 103 5.297 3.480 -13.835 1.00 30.22 H new ATOM 0 HE ARG B 103 4.796 3.724 -16.342 1.00 24.20 H new ATOM 0 HH11 ARG B 103 5.153 0.525 -14.872 1.00 61.15 H new ATOM 0 HH12 ARG B 103 3.998 -0.238 -15.970 1.00 61.15 H new ATOM 0 HH21 ARG B 103 3.310 2.728 -17.753 1.00 71.41 H new ATOM 0 HH22 ARG B 103 2.960 1.004 -17.593 1.00 71.41 H new ATOM 3420 N GLY B 104 10.716 6.041 -14.418 1.00 52.20 N ATOM 3421 CA GLY B 104 10.947 7.424 -14.809 1.00 71.14 C ATOM 3422 C GLY B 104 10.625 8.444 -13.723 1.00 75.13 C ATOM 3423 O GLY B 104 10.715 9.654 -13.949 1.00 52.14 O ATOM 0 H GLY B 104 11.543 5.560 -14.064 1.00 52.20 H new ATOM 0 HA2 GLY B 104 11.991 7.538 -15.100 1.00 71.14 H new ATOM 0 HA3 GLY B 104 10.345 7.646 -15.690 1.00 71.14 H new ATOM 3427 N ARG B 105 10.236 7.979 -12.570 1.00 11.04 N ATOM 3428 CA ARG B 105 9.951 8.866 -11.463 1.00 33.12 C ATOM 3429 C ARG B 105 10.871 8.532 -10.297 1.00 25.23 C ATOM 3430 O ARG B 105 11.123 7.360 -10.020 1.00 53.52 O ATOM 3431 CB ARG B 105 8.451 8.797 -11.098 1.00 32.14 C ATOM 3432 CG ARG B 105 7.948 7.403 -10.760 1.00 21.43 C ATOM 3433 CD ARG B 105 6.432 7.341 -10.679 1.00 41.13 C ATOM 3434 NE ARG B 105 5.801 7.713 -11.953 1.00 53.03 N ATOM 3435 CZ ARG B 105 4.727 7.124 -12.494 1.00 1.25 C ATOM 3436 NH1 ARG B 105 4.189 6.042 -11.931 1.00 12.12 N ATOM 3437 NH2 ARG B 105 4.213 7.605 -13.613 1.00 12.50 N ATOM 0 H ARG B 105 10.107 6.988 -12.365 1.00 11.04 H new ATOM 0 HA ARG B 105 10.151 9.900 -11.743 1.00 33.12 H new ATOM 0 HB2 ARG B 105 8.267 9.452 -10.247 1.00 32.14 H new ATOM 0 HB3 ARG B 105 7.869 9.187 -11.933 1.00 32.14 H new ATOM 0 HG2 ARG B 105 8.298 6.700 -11.515 1.00 21.43 H new ATOM 0 HG3 ARG B 105 8.374 7.086 -9.808 1.00 21.43 H new ATOM 0 HD2 ARG B 105 6.124 6.333 -10.402 1.00 41.13 H new ATOM 0 HD3 ARG B 105 6.083 8.009 -9.892 1.00 41.13 H new ATOM 0 HE ARG B 105 6.217 8.487 -12.470 1.00 53.03 H new ATOM 0 HH11 ARG B 105 4.595 5.655 -11.079 1.00 12.12 H new ATOM 0 HH12 ARG B 105 3.371 5.602 -12.352 1.00 12.12 H new ATOM 0 HH21 ARG B 105 4.634 8.420 -14.059 1.00 12.50 H new ATOM 0 HH22 ARG B 105 3.395 7.161 -14.031 1.00 12.50 H new ATOM 3451 N THR B 106 11.400 9.543 -9.657 1.00 32.10 N ATOM 3452 CA THR B 106 12.351 9.347 -8.578 1.00 74.45 C ATOM 3453 C THR B 106 11.608 8.960 -7.310 1.00 2.44 C ATOM 3454 O THR B 106 10.764 9.703 -6.843 1.00 4.43 O ATOM 3455 CB THR B 106 13.152 10.644 -8.332 1.00 63.31 C ATOM 3456 OG1 THR B 106 13.715 11.097 -9.580 1.00 51.32 O ATOM 3457 CG2 THR B 106 14.283 10.408 -7.329 1.00 43.13 C ATOM 0 H THR B 106 11.190 10.520 -9.862 1.00 32.10 H new ATOM 0 HA THR B 106 13.042 8.551 -8.855 1.00 74.45 H new ATOM 0 HB THR B 106 12.477 11.396 -7.924 1.00 63.31 H new ATOM 0 HG1 THR B 106 14.223 11.921 -9.430 1.00 51.32 H new ATOM 0 HG21 THR B 106 14.831 11.337 -7.174 1.00 43.13 H new ATOM 0 HG22 THR B 106 13.864 10.071 -6.381 1.00 43.13 H new ATOM 0 HG23 THR B 106 14.961 9.647 -7.717 1.00 43.13 H new ATOM 3465 N ILE B 107 11.915 7.814 -6.763 1.00 11.21 N ATOM 3466 CA ILE B 107 11.212 7.353 -5.588 1.00 54.15 C ATOM 3467 C ILE B 107 12.025 7.554 -4.343 1.00 63.14 C ATOM 3468 O ILE B 107 13.211 7.849 -4.410 1.00 33.50 O ATOM 3469 CB ILE B 107 10.804 5.853 -5.686 1.00 74.33 C ATOM 3470 CG1 ILE B 107 12.052 4.956 -5.848 1.00 73.10 C ATOM 3471 CG2 ILE B 107 9.819 5.636 -6.838 1.00 23.32 C ATOM 3472 CD1 ILE B 107 11.757 3.468 -5.842 1.00 53.24 C ATOM 0 H ILE B 107 12.641 7.184 -7.106 1.00 11.21 H new ATOM 0 HA ILE B 107 10.306 7.956 -5.533 1.00 54.15 H new ATOM 0 HB ILE B 107 10.306 5.572 -4.758 1.00 74.33 H new ATOM 0 HG12 ILE B 107 12.550 5.212 -6.783 1.00 73.10 H new ATOM 0 HG13 ILE B 107 12.752 5.179 -5.043 1.00 73.10 H new ATOM 0 HG21 ILE B 107 9.546 4.582 -6.890 1.00 23.32 H new ATOM 0 HG22 ILE B 107 8.924 6.235 -6.669 1.00 23.32 H new ATOM 0 HG23 ILE B 107 10.285 5.937 -7.776 1.00 23.32 H new ATOM 0 HD11 ILE B 107 12.687 2.912 -5.961 1.00 53.24 H new ATOM 0 HD12 ILE B 107 11.288 3.194 -4.897 1.00 53.24 H new ATOM 0 HD13 ILE B 107 11.083 3.227 -6.664 1.00 53.24 H new ATOM 3484 N LYS B 108 11.361 7.407 -3.214 1.00 51.53 N ATOM 3485 CA LYS B 108 11.977 7.559 -1.921 1.00 71.43 C ATOM 3486 C LYS B 108 11.871 6.242 -1.157 1.00 2.12 C ATOM 3487 O LYS B 108 10.771 5.705 -1.019 1.00 24.52 O ATOM 3488 CB LYS B 108 11.290 8.728 -1.158 1.00 30.12 C ATOM 3489 CG LYS B 108 11.718 8.932 0.261 1.00 4.44 C ATOM 3490 CD LYS B 108 13.172 9.027 0.355 1.00 33.54 C ATOM 3491 CE LYS B 108 13.605 9.287 1.748 1.00 63.10 C ATOM 3492 NZ LYS B 108 13.250 10.642 2.229 1.00 11.43 N ATOM 0 H LYS B 108 10.368 7.176 -3.173 1.00 51.53 H new ATOM 0 HA LYS B 108 13.034 7.803 -2.026 1.00 71.43 H new ATOM 0 HB2 LYS B 108 11.474 9.651 -1.708 1.00 30.12 H new ATOM 0 HB3 LYS B 108 10.213 8.559 -1.170 1.00 30.12 H new ATOM 0 HG2 LYS B 108 11.263 9.841 0.656 1.00 4.44 H new ATOM 0 HG3 LYS B 108 11.363 8.105 0.875 1.00 4.44 H new ATOM 0 HD2 LYS B 108 13.623 8.101 -0.002 1.00 33.54 H new ATOM 0 HD3 LYS B 108 13.529 9.826 -0.294 1.00 33.54 H new ATOM 0 HE2 LYS B 108 13.152 8.545 2.406 1.00 63.10 H new ATOM 0 HE3 LYS B 108 14.685 9.156 1.816 1.00 63.10 H new ATOM 0 HZ1 LYS B 108 13.749 10.836 3.120 1.00 11.43 H new ATOM 0 HZ2 LYS B 108 13.527 11.347 1.516 1.00 11.43 H new ATOM 0 HZ3 LYS B 108 12.224 10.696 2.388 1.00 11.43 H new ATOM 3506 N VAL B 109 13.009 5.726 -0.676 1.00 12.24 N ATOM 3507 CA VAL B 109 13.037 4.480 0.088 1.00 12.01 C ATOM 3508 C VAL B 109 13.708 4.766 1.433 1.00 73.00 C ATOM 3509 O VAL B 109 14.832 5.245 1.487 1.00 52.10 O ATOM 3510 CB VAL B 109 13.804 3.332 -0.627 1.00 31.01 C ATOM 3511 CG1 VAL B 109 13.625 2.018 0.123 1.00 51.34 C ATOM 3512 CG2 VAL B 109 13.366 3.175 -2.066 1.00 64.14 C ATOM 0 H VAL B 109 13.924 6.157 -0.805 1.00 12.24 H new ATOM 0 HA VAL B 109 12.008 4.141 0.205 1.00 12.01 H new ATOM 0 HB VAL B 109 14.861 3.599 -0.628 1.00 31.01 H new ATOM 0 HG11 VAL B 109 14.169 1.227 -0.393 1.00 51.34 H new ATOM 0 HG12 VAL B 109 14.011 2.122 1.137 1.00 51.34 H new ATOM 0 HG13 VAL B 109 12.566 1.763 0.163 1.00 51.34 H new ATOM 0 HG21 VAL B 109 13.926 2.363 -2.530 1.00 64.14 H new ATOM 0 HG22 VAL B 109 12.301 2.947 -2.099 1.00 64.14 H new ATOM 0 HG23 VAL B 109 13.556 4.102 -2.607 1.00 64.14 H new ATOM 3522 N LEU B 110 13.005 4.495 2.473 1.00 20.33 N ATOM 3523 CA LEU B 110 13.370 4.828 3.841 1.00 53.25 C ATOM 3524 C LEU B 110 12.807 3.690 4.712 1.00 55.04 C ATOM 3525 O LEU B 110 11.788 3.176 4.369 1.00 21.33 O ATOM 3526 CB LEU B 110 12.677 6.225 3.995 1.00 23.04 C ATOM 3527 CG LEU B 110 12.256 6.925 5.286 1.00 75.21 C ATOM 3528 CD1 LEU B 110 11.495 8.158 4.871 1.00 43.20 C ATOM 3529 CD2 LEU B 110 11.370 6.090 6.150 1.00 34.14 C ATOM 0 H LEU B 110 12.110 4.010 2.411 1.00 20.33 H new ATOM 0 HA LEU B 110 14.422 4.904 4.116 1.00 53.25 H new ATOM 0 HB2 LEU B 110 13.340 6.929 3.492 1.00 23.04 H new ATOM 0 HB3 LEU B 110 11.768 6.160 3.397 1.00 23.04 H new ATOM 0 HG LEU B 110 13.148 7.141 5.873 1.00 75.21 H new ATOM 0 HD11 LEU B 110 11.168 8.700 5.759 1.00 43.20 H new ATOM 0 HD12 LEU B 110 12.141 8.800 4.271 1.00 43.20 H new ATOM 0 HD13 LEU B 110 10.625 7.868 4.282 1.00 43.20 H new ATOM 0 HD21 LEU B 110 11.109 6.647 7.050 1.00 34.14 H new ATOM 0 HD22 LEU B 110 10.462 5.838 5.603 1.00 34.14 H new ATOM 0 HD23 LEU B 110 11.892 5.175 6.429 1.00 34.14 H new ATOM 3541 N PRO B 111 13.468 3.238 5.808 1.00 1.34 N ATOM 3542 CA PRO B 111 12.941 2.118 6.598 1.00 63.42 C ATOM 3543 C PRO B 111 11.613 2.482 7.295 1.00 14.03 C ATOM 3544 O PRO B 111 11.483 3.556 7.866 1.00 65.33 O ATOM 3545 CB PRO B 111 14.060 1.775 7.591 1.00 63.52 C ATOM 3546 CG PRO B 111 14.978 2.955 7.609 1.00 0.03 C ATOM 3547 CD PRO B 111 14.729 3.765 6.351 1.00 71.41 C ATOM 0 HA PRO B 111 12.689 1.259 5.977 1.00 63.42 H new ATOM 0 HB2 PRO B 111 13.654 1.583 8.584 1.00 63.52 H new ATOM 0 HB3 PRO B 111 14.590 0.874 7.284 1.00 63.52 H new ATOM 0 HG2 PRO B 111 14.798 3.564 8.495 1.00 0.03 H new ATOM 0 HG3 PRO B 111 16.017 2.628 7.652 1.00 0.03 H new ATOM 0 HD2 PRO B 111 14.649 4.829 6.575 1.00 71.41 H new ATOM 0 HD3 PRO B 111 15.545 3.650 5.638 1.00 71.41 H new ATOM 3555 N LYS B 112 10.640 1.560 7.247 1.00 1.21 N ATOM 3556 CA LYS B 112 9.256 1.816 7.706 1.00 41.01 C ATOM 3557 C LYS B 112 9.235 2.294 9.139 1.00 41.20 C ATOM 3558 O LYS B 112 8.624 3.327 9.456 1.00 50.22 O ATOM 3559 CB LYS B 112 8.404 0.539 7.575 1.00 53.14 C ATOM 3560 CG LYS B 112 6.917 0.697 7.916 1.00 1.33 C ATOM 3561 CD LYS B 112 6.188 -0.649 7.836 1.00 62.55 C ATOM 3562 CE LYS B 112 4.696 -0.514 8.094 1.00 22.24 C ATOM 3563 NZ LYS B 112 4.015 -1.839 8.159 1.00 34.13 N ATOM 0 H LYS B 112 10.785 0.615 6.890 1.00 1.21 H new ATOM 0 HA LYS B 112 8.836 2.598 7.074 1.00 41.01 H new ATOM 0 HB2 LYS B 112 8.487 0.172 6.552 1.00 53.14 H new ATOM 0 HB3 LYS B 112 8.828 -0.227 8.224 1.00 53.14 H new ATOM 0 HG2 LYS B 112 6.812 1.112 8.918 1.00 1.33 H new ATOM 0 HG3 LYS B 112 6.456 1.406 7.228 1.00 1.33 H new ATOM 0 HD2 LYS B 112 6.346 -1.087 6.850 1.00 62.55 H new ATOM 0 HD3 LYS B 112 6.619 -1.337 8.563 1.00 62.55 H new ATOM 0 HE2 LYS B 112 4.538 0.021 9.031 1.00 22.24 H new ATOM 0 HE3 LYS B 112 4.245 0.086 7.304 1.00 22.24 H new ATOM 0 HZ1 LYS B 112 2.988 -1.706 8.064 1.00 34.13 H new ATOM 0 HZ2 LYS B 112 4.359 -2.444 7.387 1.00 34.13 H new ATOM 0 HZ3 LYS B 112 4.222 -2.292 9.072 1.00 34.13 H new