USER MOD reduce.3.24.130724 H: found=0, std=0, add=1307, rem=0, adj=45 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= 0.104 K(o=-0.071,f=-3.7!) USER MOD Set 1.2: B 60 CYS SG : rot -130:sc= 0 USER MOD Set 1.3: B 97 MET CE :methyl -167:sc= -0.175 (180deg=-0.432) USER MOD Set 2.1: A 56 HIS : no HD1:sc= 0.01 K(o=-0.43,f=-3.4!) USER MOD Set 2.2: A 60 CYS SG : rot 150:sc= -0.31 USER MOD Set 2.3: A 97 MET CE :methyl 168:sc= -0.129 (180deg=-0.408) USER MOD Single : A 36 LYS NZ :NH3+ 178:sc= 1.26 (180deg=1.24) USER MOD Single : A 38 SER OG : rot 150:sc= -1.87! USER MOD Single : A 40 TYR OH : rot 180:sc= -0.245 USER MOD Single : A 43 ASN : amide:sc= -3.09! K(o=-3.1!,f=-0.48) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot -172:sc= -0.931! USER MOD Single : A 49 THR OG1 : rot 180:sc= 0.0098 USER MOD Single : A 51 GLN : amide:sc= 0 X(o=0,f=0) 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 : amide:sc= -1.14 K(o=-1.1,f=-6.7!) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 CYS SG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ -157:sc= 1.22 (180deg=1.1) USER MOD Single : A 74 SER OG : rot -44:sc= 0.329 USER MOD Single : A 76 HIS : no HD1:sc= 0 X(o=0,f=-0.0069) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 TYR OH : rot 180:sc= 0.0161 USER MOD Single : A 82 TYR OH : rot -106:sc= 0.0502 USER MOD Single : A 89 ASN : amide:sc= -1.84! K(o=-1.8!,f=-0.84) USER MOD Single : A 90 SER OG : rot 180:sc= -1.05 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ 178:sc= 0.853 (180deg=0.851) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 GLN : amide:sc= 0.527 K(o=0.53,f=-0.4) USER MOD Single : B 27 SER OG : rot 134:sc= 0.496 USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 LYS NZ :NH3+ -169:sc= 0.878 (180deg=0.595) USER MOD Single : B 36 LYS NZ :NH3+ -164:sc= 1.24 (180deg=1.11) USER MOD Single : B 38 SER OG : rot 44:sc= -0.478 USER MOD Single : B 40 TYR OH : rot 180:sc= -0.254 USER MOD Single : B 43 ASN : amide:sc= 0.728 K(o=0.73,f=-0.93) USER MOD Single : B 46 TYR OH : rot 180:sc= -0.0323 USER MOD Single : B 48 SER OG : rot -60:sc= -0.912 USER MOD Single : B 49 THR OG1 : rot -86:sc= 1.52 USER MOD Single : B 51 GLN : amide:sc= -0.0583 X(o=-0.058,f=0) USER MOD Single : B 58 SER OG : rot 180:sc= 0 USER MOD Single : B 59 SER OG : rot 180:sc= 0 USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 64 ASN : amide:sc= -1.72! C(o=-1.7!,f=-2.8!) USER MOD Single : B 67 THR OG1 : rot 180:sc=-0.00927 USER MOD Single : B 70 CYS SG : rot 180:sc= 0 USER MOD Single : B 72 LYS NZ :NH3+ -156:sc= 1.28 (180deg=1.1) USER MOD Single : B 74 SER OG : rot 180:sc= 0 USER MOD Single : B 76 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 80 TYR OH : rot 180:sc= 0 USER MOD Single : B 82 TYR OH : rot -92:sc= 0.285 USER MOD Single : B 89 ASN : amide:sc= -1.76! K(o=-1.8!,f=-0.87) USER MOD Single : B 90 SER OG : rot 173:sc= -1.33! USER MOD Single : B 100 THR OG1 : rot -27:sc= 0.945 USER MOD Single : B 106 THR OG1 : rot 180:sc= 0 USER MOD Single : B 108 LYS NZ :NH3+ 167:sc= 1.04 (180deg=0.918) USER MOD Single : B 112 LYS NZ :NH3+ -157:sc= -3.04! (180deg=-4.26!) USER MOD ----------------------------------------------------------------- ATOM 468 N GLU A 33 -15.919 10.449 7.784 1.00 51.35 N ATOM 469 CA GLU A 33 -16.462 10.650 6.469 1.00 72.05 C ATOM 470 C GLU A 33 -15.864 9.650 5.465 1.00 1.35 C ATOM 471 O GLU A 33 -16.594 9.029 4.693 1.00 42.54 O ATOM 472 CB GLU A 33 -16.188 12.108 6.092 1.00 73.45 C ATOM 473 CG GLU A 33 -17.061 12.713 5.015 1.00 72.13 C ATOM 474 CD GLU A 33 -18.540 12.398 5.147 1.00 44.43 C ATOM 475 OE1 GLU A 33 -19.091 12.440 6.267 1.00 20.43 O ATOM 476 OE2 GLU A 33 -19.187 12.145 4.110 1.00 41.33 O ATOM 0 HA GLU A 33 -17.536 10.465 6.451 1.00 72.05 H new ATOM 0 HB2 GLU A 33 -16.289 12.715 6.991 1.00 73.45 H new ATOM 0 HB3 GLU A 33 -15.150 12.186 5.770 1.00 73.45 H new ATOM 0 HG2 GLU A 33 -16.931 13.795 5.026 1.00 72.13 H new ATOM 0 HG3 GLU A 33 -16.713 12.361 4.044 1.00 72.13 H new ATOM 483 N ILE A 34 -14.547 9.480 5.502 1.00 44.04 N ATOM 484 CA ILE A 34 -13.875 8.574 4.571 1.00 72.45 C ATOM 485 C ILE A 34 -14.162 7.094 4.883 1.00 41.31 C ATOM 486 O ILE A 34 -14.379 6.289 3.971 1.00 70.34 O ATOM 487 CB ILE A 34 -12.347 8.842 4.451 1.00 71.32 C ATOM 488 CG1 ILE A 34 -11.600 8.563 5.770 1.00 34.44 C ATOM 489 CG2 ILE A 34 -12.097 10.272 3.979 1.00 34.53 C ATOM 490 CD1 ILE A 34 -10.115 8.873 5.717 1.00 54.42 C ATOM 0 H ILE A 34 -13.926 9.952 6.159 1.00 44.04 H new ATOM 0 HA ILE A 34 -14.306 8.792 3.594 1.00 72.45 H new ATOM 0 HB ILE A 34 -11.950 8.148 3.710 1.00 71.32 H new ATOM 0 HG12 ILE A 34 -12.056 9.153 6.565 1.00 34.44 H new ATOM 0 HG13 ILE A 34 -11.732 7.514 6.036 1.00 34.44 H new ATOM 0 HG21 ILE A 34 -11.024 10.446 3.899 1.00 34.53 H new ATOM 0 HG22 ILE A 34 -12.562 10.420 3.004 1.00 34.53 H new ATOM 0 HG23 ILE A 34 -12.526 10.972 4.696 1.00 34.53 H new ATOM 0 HD11 ILE A 34 -9.662 8.650 6.683 1.00 54.42 H new ATOM 0 HD12 ILE A 34 -9.643 8.264 4.946 1.00 54.42 H new ATOM 0 HD13 ILE A 34 -9.972 9.928 5.484 1.00 54.42 H new ATOM 502 N ASP A 35 -14.226 6.767 6.176 1.00 44.21 N ATOM 503 CA ASP A 35 -14.429 5.383 6.644 1.00 32.25 C ATOM 504 C ASP A 35 -15.801 4.852 6.240 1.00 3.22 C ATOM 505 O ASP A 35 -15.944 3.677 5.921 1.00 11.05 O ATOM 506 CB ASP A 35 -14.216 5.306 8.160 1.00 72.40 C ATOM 507 CG ASP A 35 -14.434 3.929 8.750 1.00 54.21 C ATOM 508 OD1 ASP A 35 -13.569 3.028 8.546 1.00 32.11 O ATOM 509 OD2 ASP A 35 -15.413 3.755 9.471 1.00 75.42 O ATOM 0 H ASP A 35 -14.139 7.448 6.930 1.00 44.21 H new ATOM 0 HA ASP A 35 -13.691 4.743 6.161 1.00 32.25 H new ATOM 0 HB2 ASP A 35 -13.201 5.630 8.390 1.00 72.40 H new ATOM 0 HB3 ASP A 35 -14.893 6.008 8.646 1.00 72.40 H new ATOM 514 N LYS A 36 -16.788 5.761 6.180 1.00 13.44 N ATOM 515 CA LYS A 36 -18.174 5.427 5.758 1.00 12.21 C ATOM 516 C LYS A 36 -18.191 4.796 4.370 1.00 72.23 C ATOM 517 O LYS A 36 -19.115 4.063 4.007 1.00 1.51 O ATOM 518 CB LYS A 36 -19.026 6.702 5.645 1.00 34.34 C ATOM 519 CG LYS A 36 -19.294 7.457 6.914 1.00 71.51 C ATOM 520 CD LYS A 36 -19.995 8.764 6.585 1.00 70.31 C ATOM 521 CE LYS A 36 -20.337 9.557 7.824 1.00 73.12 C ATOM 522 NZ LYS A 36 -20.929 10.871 7.479 1.00 12.13 N ATOM 0 H LYS A 36 -16.657 6.744 6.419 1.00 13.44 H new ATOM 0 HA LYS A 36 -18.567 4.741 6.508 1.00 12.21 H new ATOM 0 HB2 LYS A 36 -18.533 7.378 4.946 1.00 34.34 H new ATOM 0 HB3 LYS A 36 -19.985 6.431 5.203 1.00 34.34 H new ATOM 0 HG2 LYS A 36 -19.912 6.858 7.583 1.00 71.51 H new ATOM 0 HG3 LYS A 36 -18.358 7.655 7.437 1.00 71.51 H new ATOM 0 HD2 LYS A 36 -19.356 9.364 5.937 1.00 70.31 H new ATOM 0 HD3 LYS A 36 -20.907 8.554 6.027 1.00 70.31 H new ATOM 0 HE2 LYS A 36 -21.037 8.991 8.438 1.00 73.12 H new ATOM 0 HE3 LYS A 36 -19.438 9.707 8.421 1.00 73.12 H new ATOM 0 HZ1 LYS A 36 -21.184 11.377 8.351 1.00 12.13 H new ATOM 0 HZ2 LYS A 36 -20.238 11.433 6.942 1.00 12.13 H new ATOM 0 HZ3 LYS A 36 -21.781 10.727 6.901 1.00 12.13 H new ATOM 536 N ARG A 37 -17.194 5.116 3.585 1.00 51.14 N ATOM 537 CA ARG A 37 -17.162 4.736 2.217 1.00 52.53 C ATOM 538 C ARG A 37 -16.011 3.791 1.936 1.00 53.32 C ATOM 539 O ARG A 37 -15.655 3.574 0.773 1.00 62.21 O ATOM 540 CB ARG A 37 -16.993 6.007 1.427 1.00 52.54 C ATOM 541 CG ARG A 37 -18.017 7.048 1.816 1.00 31.33 C ATOM 542 CD ARG A 37 -17.812 8.335 1.104 1.00 41.10 C ATOM 543 NE ARG A 37 -16.509 8.950 1.369 1.00 22.21 N ATOM 544 CZ ARG A 37 -16.315 10.267 1.505 1.00 31.44 C ATOM 545 NH1 ARG A 37 -17.357 11.097 1.534 1.00 21.23 N ATOM 546 NH2 ARG A 37 -15.079 10.752 1.621 1.00 73.43 N ATOM 0 H ARG A 37 -16.381 5.652 3.890 1.00 51.14 H new ATOM 0 HA ARG A 37 -18.077 4.210 1.944 1.00 52.53 H new ATOM 0 HB2 ARG A 37 -15.991 6.405 1.588 1.00 52.54 H new ATOM 0 HB3 ARG A 37 -17.082 5.789 0.363 1.00 52.54 H new ATOM 0 HG2 ARG A 37 -19.016 6.670 1.599 1.00 31.33 H new ATOM 0 HG3 ARG A 37 -17.968 7.219 2.891 1.00 31.33 H new ATOM 0 HD2 ARG A 37 -17.914 8.168 0.032 1.00 41.10 H new ATOM 0 HD3 ARG A 37 -18.599 9.031 1.395 1.00 41.10 H new ATOM 0 HE ARG A 37 -15.699 8.336 1.455 1.00 22.21 H new ATOM 0 HH11 ARG A 37 -18.305 10.729 1.452 1.00 21.23 H new ATOM 0 HH12 ARG A 37 -17.207 12.101 1.638 1.00 21.23 H new ATOM 0 HH21 ARG A 37 -14.279 10.119 1.606 1.00 73.43 H new ATOM 0 HH22 ARG A 37 -14.933 11.756 1.725 1.00 73.43 H new ATOM 560 N SER A 38 -15.444 3.223 2.977 1.00 70.15 N ATOM 561 CA SER A 38 -14.319 2.351 2.816 1.00 74.44 C ATOM 562 C SER A 38 -14.785 0.889 2.769 1.00 4.51 C ATOM 563 O SER A 38 -15.732 0.487 3.461 1.00 14.42 O ATOM 564 CB SER A 38 -13.351 2.557 3.973 1.00 22.42 C ATOM 565 OG SER A 38 -12.094 1.925 3.725 1.00 51.13 O ATOM 0 H SER A 38 -15.749 3.354 3.941 1.00 70.15 H new ATOM 0 HA SER A 38 -13.814 2.583 1.878 1.00 74.44 H new ATOM 0 HB2 SER A 38 -13.197 3.624 4.134 1.00 22.42 H new ATOM 0 HB3 SER A 38 -13.786 2.156 4.888 1.00 22.42 H new ATOM 0 HG SER A 38 -11.382 2.424 4.177 1.00 51.13 H new ATOM 571 N VAL A 39 -14.117 0.106 1.957 1.00 15.13 N ATOM 572 CA VAL A 39 -14.496 -1.262 1.723 1.00 3.20 C ATOM 573 C VAL A 39 -13.301 -2.164 1.957 1.00 51.52 C ATOM 574 O VAL A 39 -12.161 -1.759 1.719 1.00 3.24 O ATOM 575 CB VAL A 39 -14.919 -1.457 0.227 1.00 42.24 C ATOM 576 CG1 VAL A 39 -15.583 -2.803 -0.036 1.00 25.10 C ATOM 577 CG2 VAL A 39 -15.757 -0.315 -0.284 1.00 20.32 C ATOM 0 H VAL A 39 -13.291 0.404 1.438 1.00 15.13 H new ATOM 0 HA VAL A 39 -15.319 -1.505 2.394 1.00 3.20 H new ATOM 0 HB VAL A 39 -13.990 -1.456 -0.343 1.00 42.24 H new ATOM 0 HG11 VAL A 39 -15.852 -2.876 -1.090 1.00 25.10 H new ATOM 0 HG12 VAL A 39 -14.891 -3.606 0.218 1.00 25.10 H new ATOM 0 HG13 VAL A 39 -16.481 -2.891 0.575 1.00 25.10 H new ATOM 0 HG21 VAL A 39 -16.025 -0.497 -1.325 1.00 20.32 H new ATOM 0 HG22 VAL A 39 -16.664 -0.233 0.315 1.00 20.32 H new ATOM 0 HG23 VAL A 39 -15.190 0.613 -0.212 1.00 20.32 H new ATOM 587 N TYR A 40 -13.565 -3.362 2.410 1.00 54.34 N ATOM 588 CA TYR A 40 -12.567 -4.410 2.464 1.00 22.11 C ATOM 589 C TYR A 40 -12.722 -5.269 1.216 1.00 10.42 C ATOM 590 O TYR A 40 -13.818 -5.754 0.935 1.00 2.11 O ATOM 591 CB TYR A 40 -12.743 -5.309 3.703 1.00 51.31 C ATOM 592 CG TYR A 40 -11.953 -6.626 3.616 1.00 44.31 C ATOM 593 CD1 TYR A 40 -10.643 -6.701 3.993 1.00 62.31 C ATOM 594 CD2 TYR A 40 -12.555 -7.789 3.130 1.00 0.32 C ATOM 595 CE1 TYR A 40 -9.948 -7.880 3.895 1.00 42.22 C ATOM 596 CE2 TYR A 40 -11.880 -8.967 3.026 1.00 2.35 C ATOM 597 CZ TYR A 40 -10.570 -9.017 3.410 1.00 2.53 C ATOM 598 OH TYR A 40 -9.868 -10.209 3.311 1.00 2.33 O ATOM 0 H TYR A 40 -14.482 -3.644 2.755 1.00 54.34 H new ATOM 0 HA TYR A 40 -11.581 -3.948 2.521 1.00 22.11 H new ATOM 0 HB2 TYR A 40 -12.425 -4.760 4.590 1.00 51.31 H new ATOM 0 HB3 TYR A 40 -13.801 -5.536 3.831 1.00 51.31 H new ATOM 0 HD1 TYR A 40 -10.147 -5.820 4.374 1.00 62.31 H new ATOM 0 HD2 TYR A 40 -13.591 -7.753 2.826 1.00 0.32 H new ATOM 0 HE1 TYR A 40 -8.912 -7.921 4.197 1.00 42.22 H new ATOM 0 HE2 TYR A 40 -12.373 -9.849 2.645 1.00 2.35 H new ATOM 0 HH TYR A 40 -10.456 -10.906 2.952 1.00 2.33 H new ATOM 608 N VAL A 41 -11.663 -5.425 0.469 1.00 12.35 N ATOM 609 CA VAL A 41 -11.620 -6.300 -0.685 1.00 42.40 C ATOM 610 C VAL A 41 -10.566 -7.357 -0.415 1.00 54.54 C ATOM 611 O VAL A 41 -9.393 -7.045 -0.339 1.00 53.20 O ATOM 612 CB VAL A 41 -11.189 -5.512 -1.940 1.00 24.11 C ATOM 613 CG1 VAL A 41 -11.167 -6.395 -3.188 1.00 23.43 C ATOM 614 CG2 VAL A 41 -12.064 -4.293 -2.138 1.00 50.13 C ATOM 0 H VAL A 41 -10.783 -4.939 0.644 1.00 12.35 H new ATOM 0 HA VAL A 41 -12.605 -6.736 -0.853 1.00 42.40 H new ATOM 0 HB VAL A 41 -10.167 -5.169 -1.778 1.00 24.11 H new ATOM 0 HG11 VAL A 41 -10.858 -5.801 -4.048 1.00 23.43 H new ATOM 0 HG12 VAL A 41 -10.463 -7.214 -3.042 1.00 23.43 H new ATOM 0 HG13 VAL A 41 -12.163 -6.800 -3.365 1.00 23.43 H new ATOM 0 HG21 VAL A 41 -11.741 -3.754 -3.029 1.00 50.13 H new ATOM 0 HG22 VAL A 41 -13.101 -4.605 -2.259 1.00 50.13 H new ATOM 0 HG23 VAL A 41 -11.981 -3.640 -1.269 1.00 50.13 H new ATOM 624 N GLY A 42 -10.963 -8.572 -0.250 1.00 35.31 N ATOM 625 CA GLY A 42 -10.009 -9.592 0.062 1.00 75.54 C ATOM 626 C GLY A 42 -9.757 -10.547 -1.060 1.00 44.21 C ATOM 627 O GLY A 42 -10.542 -10.631 -2.002 1.00 20.44 O ATOM 0 H GLY A 42 -11.931 -8.886 -0.324 1.00 35.31 H new ATOM 0 HA2 GLY A 42 -9.067 -9.121 0.344 1.00 75.54 H new ATOM 0 HA3 GLY A 42 -10.359 -10.150 0.930 1.00 75.54 H new ATOM 631 N ASN A 43 -8.662 -11.276 -0.918 1.00 21.02 N ATOM 632 CA ASN A 43 -8.188 -12.299 -1.864 1.00 71.31 C ATOM 633 C ASN A 43 -8.003 -11.750 -3.306 1.00 51.35 C ATOM 634 O ASN A 43 -8.166 -12.465 -4.294 1.00 41.42 O ATOM 635 CB ASN A 43 -9.103 -13.558 -1.775 1.00 3.42 C ATOM 636 CG ASN A 43 -8.591 -14.763 -2.567 1.00 5.02 C ATOM 637 OD1 ASN A 43 -7.735 -15.514 -2.099 1.00 71.22 O ATOM 638 ND2 ASN A 43 -9.152 -15.005 -3.706 1.00 24.40 N ATOM 0 H ASN A 43 -8.047 -11.175 -0.111 1.00 21.02 H new ATOM 0 HA ASN A 43 -7.183 -12.605 -1.574 1.00 71.31 H new ATOM 0 HB2 ASN A 43 -9.208 -13.844 -0.728 1.00 3.42 H new ATOM 0 HB3 ASN A 43 -10.098 -13.297 -2.136 1.00 3.42 H new ATOM 0 HD21 ASN A 43 -8.888 -15.834 -4.239 1.00 24.40 H new ATOM 0 HD22 ASN A 43 -9.859 -14.367 -4.072 1.00 24.40 H new ATOM 645 N VAL A 44 -7.630 -10.470 -3.398 1.00 31.43 N ATOM 646 CA VAL A 44 -7.272 -9.868 -4.687 1.00 3.53 C ATOM 647 C VAL A 44 -6.163 -10.674 -5.333 1.00 64.34 C ATOM 648 O VAL A 44 -5.175 -11.052 -4.685 1.00 24.44 O ATOM 649 CB VAL A 44 -6.894 -8.348 -4.580 1.00 64.41 C ATOM 650 CG1 VAL A 44 -5.718 -8.112 -3.661 1.00 10.13 C ATOM 651 CG2 VAL A 44 -6.620 -7.766 -5.953 1.00 32.44 C ATOM 0 H VAL A 44 -7.568 -9.835 -2.603 1.00 31.43 H new ATOM 0 HA VAL A 44 -8.158 -9.900 -5.320 1.00 3.53 H new ATOM 0 HB VAL A 44 -7.752 -7.837 -4.143 1.00 64.41 H new ATOM 0 HG11 VAL A 44 -5.496 -7.046 -3.621 1.00 10.13 H new ATOM 0 HG12 VAL A 44 -5.960 -8.470 -2.660 1.00 10.13 H new ATOM 0 HG13 VAL A 44 -4.848 -8.650 -4.038 1.00 10.13 H new ATOM 0 HG21 VAL A 44 -6.360 -6.712 -5.856 1.00 32.44 H new ATOM 0 HG22 VAL A 44 -5.793 -8.303 -6.417 1.00 32.44 H new ATOM 0 HG23 VAL A 44 -7.510 -7.864 -6.574 1.00 32.44 H new ATOM 661 N ASP A 45 -6.356 -10.969 -6.597 1.00 23.42 N ATOM 662 CA ASP A 45 -5.458 -11.816 -7.330 1.00 13.34 C ATOM 663 C ASP A 45 -4.165 -11.095 -7.524 1.00 13.13 C ATOM 664 O ASP A 45 -4.164 -9.876 -7.770 1.00 34.44 O ATOM 665 CB ASP A 45 -6.064 -12.171 -8.689 1.00 45.24 C ATOM 666 CG ASP A 45 -5.223 -13.161 -9.463 1.00 72.32 C ATOM 667 OD1 ASP A 45 -4.202 -12.771 -10.054 1.00 10.20 O ATOM 668 OD2 ASP A 45 -5.578 -14.346 -9.487 1.00 3.12 O ATOM 0 H ASP A 45 -7.145 -10.625 -7.144 1.00 23.42 H new ATOM 0 HA ASP A 45 -5.287 -12.738 -6.773 1.00 13.34 H new ATOM 0 HB2 ASP A 45 -7.061 -12.586 -8.540 1.00 45.24 H new ATOM 0 HB3 ASP A 45 -6.182 -11.262 -9.278 1.00 45.24 H new ATOM 673 N TYR A 46 -3.066 -11.806 -7.418 1.00 1.41 N ATOM 674 CA TYR A 46 -1.801 -11.180 -7.581 1.00 2.01 C ATOM 675 C TYR A 46 -1.590 -10.913 -9.049 1.00 54.33 C ATOM 676 O TYR A 46 -1.167 -11.778 -9.815 1.00 43.34 O ATOM 677 CB TYR A 46 -0.665 -11.997 -7.016 1.00 1.43 C ATOM 678 CG TYR A 46 0.369 -11.126 -6.367 1.00 32.44 C ATOM 679 CD1 TYR A 46 1.122 -10.209 -7.093 1.00 2.41 C ATOM 680 CD2 TYR A 46 0.562 -11.196 -5.014 1.00 1.02 C ATOM 681 CE1 TYR A 46 2.043 -9.397 -6.460 1.00 22.22 C ATOM 682 CE2 TYR A 46 1.468 -10.396 -4.379 1.00 0.34 C ATOM 683 CZ TYR A 46 2.208 -9.498 -5.096 1.00 1.24 C ATOM 684 OH TYR A 46 3.109 -8.690 -4.444 1.00 22.41 O ATOM 0 H TYR A 46 -3.035 -12.806 -7.222 1.00 1.41 H new ATOM 0 HA TYR A 46 -1.804 -10.246 -7.018 1.00 2.01 H new ATOM 0 HB2 TYR A 46 -1.054 -12.707 -6.286 1.00 1.43 H new ATOM 0 HB3 TYR A 46 -0.203 -12.580 -7.813 1.00 1.43 H new ATOM 0 HD1 TYR A 46 0.985 -10.131 -8.161 1.00 2.41 H new ATOM 0 HD2 TYR A 46 -0.016 -11.901 -4.435 1.00 1.02 H new ATOM 0 HE1 TYR A 46 2.628 -8.690 -7.029 1.00 22.22 H new ATOM 0 HE2 TYR A 46 1.600 -10.473 -3.310 1.00 0.34 H new ATOM 0 HH TYR A 46 3.097 -8.893 -3.485 1.00 22.41 H new ATOM 694 N GLY A 47 -1.951 -9.738 -9.427 1.00 51.53 N ATOM 695 CA GLY A 47 -1.927 -9.339 -10.783 1.00 3.41 C ATOM 696 C GLY A 47 -3.003 -8.333 -11.013 1.00 74.21 C ATOM 697 O GLY A 47 -2.941 -7.545 -11.954 1.00 22.43 O ATOM 0 H GLY A 47 -2.278 -9.015 -8.786 1.00 51.53 H new ATOM 0 HA2 GLY A 47 -0.955 -8.914 -11.033 1.00 3.41 H new ATOM 0 HA3 GLY A 47 -2.074 -10.202 -11.432 1.00 3.41 H new ATOM 701 N SER A 48 -4.001 -8.318 -10.124 1.00 73.32 N ATOM 702 CA SER A 48 -5.029 -7.358 -10.233 1.00 44.02 C ATOM 703 C SER A 48 -4.677 -6.149 -9.419 1.00 63.31 C ATOM 704 O SER A 48 -5.068 -6.007 -8.266 1.00 44.25 O ATOM 705 CB SER A 48 -6.374 -7.927 -9.852 1.00 2.31 C ATOM 706 OG SER A 48 -6.745 -8.943 -10.766 1.00 54.45 O ATOM 0 H SER A 48 -4.092 -8.964 -9.340 1.00 73.32 H new ATOM 0 HA SER A 48 -5.116 -7.057 -11.277 1.00 44.02 H new ATOM 0 HB2 SER A 48 -6.334 -8.333 -8.841 1.00 2.31 H new ATOM 0 HB3 SER A 48 -7.125 -7.137 -9.849 1.00 2.31 H new ATOM 0 HG SER A 48 -7.666 -9.224 -10.586 1.00 54.45 H new ATOM 712 N THR A 49 -3.815 -5.351 -9.984 1.00 61.44 N ATOM 713 CA THR A 49 -3.364 -4.127 -9.431 1.00 60.15 C ATOM 714 C THR A 49 -4.455 -3.090 -9.316 1.00 13.40 C ATOM 715 O THR A 49 -5.613 -3.341 -9.649 1.00 4.15 O ATOM 716 CB THR A 49 -2.211 -3.607 -10.272 1.00 64.24 C ATOM 717 OG1 THR A 49 -2.633 -3.491 -11.637 1.00 12.25 O ATOM 718 CG2 THR A 49 -1.062 -4.571 -10.192 1.00 51.50 C ATOM 0 H THR A 49 -3.393 -5.557 -10.889 1.00 61.44 H new ATOM 0 HA THR A 49 -3.033 -4.321 -8.411 1.00 60.15 H new ATOM 0 HB THR A 49 -1.899 -2.631 -9.899 1.00 64.24 H new ATOM 0 HG1 THR A 49 -1.891 -3.154 -12.181 1.00 12.25 H new ATOM 0 HG21 THR A 49 -0.233 -4.200 -10.795 1.00 51.50 H new ATOM 0 HG22 THR A 49 -0.741 -4.669 -9.155 1.00 51.50 H new ATOM 0 HG23 THR A 49 -1.377 -5.544 -10.568 1.00 51.50 H new ATOM 726 N ALA A 50 -4.070 -1.925 -8.845 1.00 61.55 N ATOM 727 CA ALA A 50 -4.975 -0.856 -8.540 1.00 10.53 C ATOM 728 C ALA A 50 -5.920 -0.548 -9.707 1.00 61.42 C ATOM 729 O ALA A 50 -7.105 -0.481 -9.515 1.00 44.24 O ATOM 730 CB ALA A 50 -4.174 0.365 -8.128 1.00 25.24 C ATOM 0 H ALA A 50 -3.093 -1.696 -8.661 1.00 61.55 H new ATOM 0 HA ALA A 50 -5.615 -1.162 -7.712 1.00 10.53 H new ATOM 0 HB1 ALA A 50 -4.854 1.184 -7.894 1.00 25.24 H new ATOM 0 HB2 ALA A 50 -3.575 0.128 -7.249 1.00 25.24 H new ATOM 0 HB3 ALA A 50 -3.517 0.662 -8.945 1.00 25.24 H new ATOM 736 N GLN A 51 -5.378 -0.406 -10.918 1.00 2.20 N ATOM 737 CA GLN A 51 -6.201 -0.126 -12.113 1.00 4.03 C ATOM 738 C GLN A 51 -7.229 -1.226 -12.394 1.00 75.32 C ATOM 739 O GLN A 51 -8.370 -0.936 -12.784 1.00 13.42 O ATOM 740 CB GLN A 51 -5.337 0.085 -13.343 1.00 73.21 C ATOM 741 CG GLN A 51 -4.395 1.257 -13.242 1.00 22.03 C ATOM 742 CD GLN A 51 -3.632 1.474 -14.517 1.00 52.34 C ATOM 743 OE1 GLN A 51 -4.076 2.200 -15.396 1.00 33.13 O ATOM 744 NE2 GLN A 51 -2.490 0.853 -14.636 1.00 40.01 N ATOM 0 H GLN A 51 -4.378 -0.479 -11.105 1.00 2.20 H new ATOM 0 HA GLN A 51 -6.745 0.792 -11.892 1.00 4.03 H new ATOM 0 HB2 GLN A 51 -4.756 -0.819 -13.525 1.00 73.21 H new ATOM 0 HB3 GLN A 51 -5.985 0.227 -14.208 1.00 73.21 H new ATOM 0 HG2 GLN A 51 -4.960 2.157 -12.999 1.00 22.03 H new ATOM 0 HG3 GLN A 51 -3.695 1.090 -12.424 1.00 22.03 H new ATOM 0 HE21 GLN A 51 -2.153 0.256 -13.881 1.00 40.01 H new ATOM 0 HE22 GLN A 51 -1.935 0.965 -15.484 1.00 40.01 H new ATOM 753 N ASP A 52 -6.816 -2.471 -12.183 1.00 44.51 N ATOM 754 CA ASP A 52 -7.665 -3.661 -12.408 1.00 53.20 C ATOM 755 C ASP A 52 -8.834 -3.588 -11.428 1.00 33.12 C ATOM 756 O ASP A 52 -10.003 -3.867 -11.764 1.00 33.23 O ATOM 757 CB ASP A 52 -6.826 -4.921 -12.117 1.00 1.25 C ATOM 758 CG ASP A 52 -6.963 -6.026 -13.147 1.00 1.13 C ATOM 759 OD1 ASP A 52 -6.403 -5.883 -14.259 1.00 31.32 O ATOM 760 OD2 ASP A 52 -7.582 -7.067 -12.850 1.00 65.42 O ATOM 0 H ASP A 52 -5.879 -2.696 -11.849 1.00 44.51 H new ATOM 0 HA ASP A 52 -8.033 -3.698 -13.433 1.00 53.20 H new ATOM 0 HB2 ASP A 52 -5.777 -4.634 -12.049 1.00 1.25 H new ATOM 0 HB3 ASP A 52 -7.113 -5.314 -11.142 1.00 1.25 H new ATOM 765 N LEU A 53 -8.499 -3.161 -10.227 1.00 74.31 N ATOM 766 CA LEU A 53 -9.443 -2.978 -9.160 1.00 44.20 C ATOM 767 C LEU A 53 -10.331 -1.772 -9.406 1.00 35.21 C ATOM 768 O LEU A 53 -11.549 -1.858 -9.201 1.00 12.42 O ATOM 769 CB LEU A 53 -8.720 -2.875 -7.810 1.00 11.24 C ATOM 770 CG LEU A 53 -8.045 -4.152 -7.323 1.00 25.35 C ATOM 771 CD1 LEU A 53 -7.256 -3.871 -6.058 1.00 71.33 C ATOM 772 CD2 LEU A 53 -9.098 -5.230 -7.059 1.00 13.11 C ATOM 0 H LEU A 53 -7.540 -2.929 -9.967 1.00 74.31 H new ATOM 0 HA LEU A 53 -10.091 -3.854 -9.130 1.00 44.20 H new ATOM 0 HB2 LEU A 53 -7.966 -2.092 -7.882 1.00 11.24 H new ATOM 0 HB3 LEU A 53 -9.440 -2.556 -7.056 1.00 11.24 H new ATOM 0 HG LEU A 53 -7.360 -4.509 -8.093 1.00 25.35 H new ATOM 0 HD11 LEU A 53 -6.777 -4.789 -5.717 1.00 71.33 H new ATOM 0 HD12 LEU A 53 -6.494 -3.119 -6.264 1.00 71.33 H new ATOM 0 HD13 LEU A 53 -7.929 -3.503 -5.283 1.00 71.33 H new ATOM 0 HD21 LEU A 53 -8.608 -6.140 -6.711 1.00 13.11 H new ATOM 0 HD22 LEU A 53 -9.795 -4.879 -6.298 1.00 13.11 H new ATOM 0 HD23 LEU A 53 -9.642 -5.440 -7.980 1.00 13.11 H new ATOM 784 N GLU A 54 -9.741 -0.643 -9.864 1.00 32.21 N ATOM 785 CA GLU A 54 -10.520 0.558 -10.132 1.00 1.32 C ATOM 786 C GLU A 54 -11.594 0.282 -11.122 1.00 73.42 C ATOM 787 O GLU A 54 -12.703 0.610 -10.881 1.00 44.32 O ATOM 788 CB GLU A 54 -9.687 1.682 -10.748 1.00 12.20 C ATOM 789 CG GLU A 54 -8.519 2.223 -9.971 1.00 71.54 C ATOM 790 CD GLU A 54 -7.871 3.356 -10.744 1.00 3.02 C ATOM 791 OE1 GLU A 54 -7.245 3.087 -11.792 1.00 1.13 O ATOM 792 OE2 GLU A 54 -8.016 4.546 -10.336 1.00 22.32 O ATOM 0 H GLU A 54 -8.742 -0.552 -10.049 1.00 32.21 H new ATOM 0 HA GLU A 54 -10.912 0.860 -9.161 1.00 1.32 H new ATOM 0 HB2 GLU A 54 -9.310 1.327 -11.707 1.00 12.20 H new ATOM 0 HB3 GLU A 54 -10.359 2.514 -10.958 1.00 12.20 H new ATOM 0 HG2 GLU A 54 -8.852 2.579 -8.996 1.00 71.54 H new ATOM 0 HG3 GLU A 54 -7.792 1.431 -9.790 1.00 71.54 H new ATOM 799 N ALA A 55 -11.254 -0.352 -12.225 1.00 53.14 N ATOM 800 CA ALA A 55 -12.226 -0.611 -13.281 1.00 4.03 C ATOM 801 C ALA A 55 -13.410 -1.415 -12.760 1.00 64.51 C ATOM 802 O ALA A 55 -14.599 -1.020 -12.930 1.00 50.20 O ATOM 803 CB ALA A 55 -11.560 -1.327 -14.445 1.00 24.32 C ATOM 0 H ALA A 55 -10.315 -0.699 -12.419 1.00 53.14 H new ATOM 0 HA ALA A 55 -12.608 0.348 -13.632 1.00 4.03 H new ATOM 0 HB1 ALA A 55 -12.297 -1.514 -15.226 1.00 24.32 H new ATOM 0 HB2 ALA A 55 -10.758 -0.706 -14.844 1.00 24.32 H new ATOM 0 HB3 ALA A 55 -11.147 -2.275 -14.101 1.00 24.32 H new ATOM 809 N HIS A 56 -13.099 -2.480 -12.049 1.00 43.02 N ATOM 810 CA HIS A 56 -14.111 -3.371 -11.550 1.00 45.14 C ATOM 811 C HIS A 56 -14.993 -2.669 -10.494 1.00 62.23 C ATOM 812 O HIS A 56 -16.199 -2.866 -10.456 1.00 71.02 O ATOM 813 CB HIS A 56 -13.467 -4.653 -11.003 1.00 14.32 C ATOM 814 CG HIS A 56 -14.443 -5.744 -10.683 1.00 35.42 C ATOM 815 ND1 HIS A 56 -14.782 -6.731 -11.581 1.00 71.52 N ATOM 816 CD2 HIS A 56 -15.142 -6.010 -9.566 1.00 74.45 C ATOM 817 CE1 HIS A 56 -15.642 -7.553 -11.030 1.00 31.34 C ATOM 818 NE2 HIS A 56 -15.884 -7.141 -9.803 1.00 34.34 N ATOM 0 H HIS A 56 -12.145 -2.745 -11.806 1.00 43.02 H new ATOM 0 HA HIS A 56 -14.767 -3.655 -12.373 1.00 45.14 H new ATOM 0 HB2 HIS A 56 -12.750 -5.026 -11.734 1.00 14.32 H new ATOM 0 HB3 HIS A 56 -12.905 -4.408 -10.102 1.00 14.32 H new ATOM 0 HD2 HIS A 56 -15.123 -5.439 -8.650 1.00 74.45 H new ATOM 0 HE1 HIS A 56 -16.078 -8.421 -11.502 1.00 31.34 H new ATOM 0 HE2 HIS A 56 -16.517 -7.587 -9.139 1.00 34.34 H new ATOM 827 N PHE A 57 -14.382 -1.851 -9.650 1.00 1.31 N ATOM 828 CA PHE A 57 -15.113 -1.094 -8.636 1.00 43.34 C ATOM 829 C PHE A 57 -15.754 0.167 -9.162 1.00 5.54 C ATOM 830 O PHE A 57 -16.710 0.669 -8.585 1.00 21.33 O ATOM 831 CB PHE A 57 -14.283 -0.821 -7.413 1.00 31.31 C ATOM 832 CG PHE A 57 -14.148 -2.008 -6.537 1.00 13.21 C ATOM 833 CD1 PHE A 57 -15.137 -2.308 -5.642 1.00 2.24 C ATOM 834 CD2 PHE A 57 -13.051 -2.814 -6.602 1.00 60.41 C ATOM 835 CE1 PHE A 57 -15.031 -3.397 -4.822 1.00 72.52 C ATOM 836 CE2 PHE A 57 -12.926 -3.899 -5.793 1.00 10.03 C ATOM 837 CZ PHE A 57 -13.916 -4.190 -4.900 1.00 30.13 C ATOM 0 H PHE A 57 -13.375 -1.692 -9.645 1.00 1.31 H new ATOM 0 HA PHE A 57 -15.933 -1.746 -8.337 1.00 43.34 H new ATOM 0 HB2 PHE A 57 -13.292 -0.486 -7.719 1.00 31.31 H new ATOM 0 HB3 PHE A 57 -14.735 -0.006 -6.847 1.00 31.31 H new ATOM 0 HD1 PHE A 57 -16.012 -1.678 -5.582 1.00 2.24 H new ATOM 0 HD2 PHE A 57 -12.267 -2.587 -7.309 1.00 60.41 H new ATOM 0 HE1 PHE A 57 -15.818 -3.630 -4.120 1.00 72.52 H new ATOM 0 HE2 PHE A 57 -12.049 -4.526 -5.856 1.00 10.03 H new ATOM 0 HZ PHE A 57 -13.820 -5.049 -4.252 1.00 30.13 H new ATOM 847 N SER A 58 -15.237 0.662 -10.255 1.00 64.32 N ATOM 848 CA SER A 58 -15.713 1.896 -10.858 1.00 64.34 C ATOM 849 C SER A 58 -17.091 1.663 -11.406 1.00 10.44 C ATOM 850 O SER A 58 -17.898 2.591 -11.528 1.00 42.35 O ATOM 851 CB SER A 58 -14.758 2.390 -11.964 1.00 4.51 C ATOM 852 OG SER A 58 -15.188 3.618 -12.529 1.00 22.32 O ATOM 0 H SER A 58 -14.468 0.223 -10.762 1.00 64.32 H new ATOM 0 HA SER A 58 -15.746 2.676 -10.097 1.00 64.34 H new ATOM 0 HB2 SER A 58 -13.757 2.512 -11.550 1.00 4.51 H new ATOM 0 HB3 SER A 58 -14.689 1.635 -12.747 1.00 4.51 H new ATOM 0 HG SER A 58 -14.556 3.897 -13.224 1.00 22.32 H new ATOM 858 N SER A 59 -17.384 0.415 -11.727 1.00 1.41 N ATOM 859 CA SER A 59 -18.701 0.056 -12.139 1.00 52.12 C ATOM 860 C SER A 59 -19.710 0.332 -10.992 1.00 73.23 C ATOM 861 O SER A 59 -20.883 0.589 -11.234 1.00 13.14 O ATOM 862 CB SER A 59 -18.696 -1.413 -12.508 1.00 41.14 C ATOM 863 OG SER A 59 -17.693 -1.674 -13.484 1.00 24.14 O ATOM 0 H SER A 59 -16.717 -0.357 -11.706 1.00 1.41 H new ATOM 0 HA SER A 59 -19.005 0.650 -13.001 1.00 52.12 H new ATOM 0 HB2 SER A 59 -18.514 -2.018 -11.619 1.00 41.14 H new ATOM 0 HB3 SER A 59 -19.673 -1.701 -12.895 1.00 41.14 H new ATOM 0 HG SER A 59 -17.699 -2.627 -13.713 1.00 24.14 H new ATOM 869 N CYS A 60 -19.237 0.260 -9.753 1.00 15.41 N ATOM 870 CA CYS A 60 -20.063 0.520 -8.583 1.00 53.03 C ATOM 871 C CYS A 60 -19.940 1.981 -8.068 1.00 25.02 C ATOM 872 O CYS A 60 -20.606 2.353 -7.097 1.00 54.44 O ATOM 873 CB CYS A 60 -19.677 -0.453 -7.470 1.00 54.25 C ATOM 874 SG CYS A 60 -19.788 -2.199 -7.941 1.00 35.11 S ATOM 0 H CYS A 60 -18.270 0.020 -9.533 1.00 15.41 H new ATOM 0 HA CYS A 60 -21.102 0.376 -8.879 1.00 53.03 H new ATOM 0 HB2 CYS A 60 -18.657 -0.238 -7.152 1.00 54.25 H new ATOM 0 HB3 CYS A 60 -20.323 -0.278 -6.609 1.00 54.25 H new ATOM 0 HG CYS A 60 -18.908 -2.885 -7.274 1.00 35.11 H new ATOM 880 N GLY A 61 -19.133 2.809 -8.723 1.00 21.31 N ATOM 881 CA GLY A 61 -18.986 4.179 -8.240 1.00 41.54 C ATOM 882 C GLY A 61 -17.643 4.828 -8.520 1.00 62.04 C ATOM 883 O GLY A 61 -16.912 4.406 -9.401 1.00 13.41 O ATOM 0 H GLY A 61 -18.591 2.572 -9.554 1.00 21.31 H new ATOM 0 HA2 GLY A 61 -19.767 4.791 -8.691 1.00 41.54 H new ATOM 0 HA3 GLY A 61 -19.157 4.187 -7.163 1.00 41.54 H new ATOM 887 N SER A 62 -17.326 5.866 -7.752 1.00 0.12 N ATOM 888 CA SER A 62 -16.116 6.649 -7.955 1.00 25.14 C ATOM 889 C SER A 62 -15.144 6.464 -6.788 1.00 31.14 C ATOM 890 O SER A 62 -15.519 6.635 -5.625 1.00 51.42 O ATOM 891 CB SER A 62 -16.501 8.108 -8.073 1.00 53.43 C ATOM 892 OG SER A 62 -17.519 8.264 -9.053 1.00 3.23 O ATOM 0 H SER A 62 -17.901 6.186 -6.973 1.00 0.12 H new ATOM 0 HA SER A 62 -15.619 6.312 -8.865 1.00 25.14 H new ATOM 0 HB2 SER A 62 -16.852 8.479 -7.110 1.00 53.43 H new ATOM 0 HB3 SER A 62 -15.629 8.702 -8.345 1.00 53.43 H new ATOM 0 HG SER A 62 -17.764 9.210 -9.122 1.00 3.23 H new ATOM 898 N ILE A 63 -13.918 6.126 -7.113 1.00 3.11 N ATOM 899 CA ILE A 63 -12.874 5.847 -6.132 1.00 74.21 C ATOM 900 C ILE A 63 -12.074 7.110 -5.715 1.00 72.03 C ATOM 901 O ILE A 63 -11.680 7.923 -6.557 1.00 41.40 O ATOM 902 CB ILE A 63 -11.917 4.773 -6.696 1.00 74.15 C ATOM 903 CG1 ILE A 63 -12.692 3.473 -6.956 1.00 72.11 C ATOM 904 CG2 ILE A 63 -10.722 4.539 -5.776 1.00 2.13 C ATOM 905 CD1 ILE A 63 -11.864 2.375 -7.563 1.00 70.44 C ATOM 0 H ILE A 63 -13.605 6.033 -8.079 1.00 3.11 H new ATOM 0 HA ILE A 63 -13.366 5.483 -5.230 1.00 74.21 H new ATOM 0 HB ILE A 63 -11.513 5.134 -7.642 1.00 74.15 H new ATOM 0 HG12 ILE A 63 -13.112 3.119 -6.015 1.00 72.11 H new ATOM 0 HG13 ILE A 63 -13.531 3.689 -7.618 1.00 72.11 H new ATOM 0 HG21 ILE A 63 -10.074 3.777 -6.208 1.00 2.13 H new ATOM 0 HG22 ILE A 63 -10.164 5.468 -5.661 1.00 2.13 H new ATOM 0 HG23 ILE A 63 -11.074 4.205 -4.800 1.00 2.13 H new ATOM 0 HD11 ILE A 63 -12.485 1.492 -7.715 1.00 70.44 H new ATOM 0 HD12 ILE A 63 -11.465 2.707 -8.522 1.00 70.44 H new ATOM 0 HD13 ILE A 63 -11.040 2.128 -6.893 1.00 70.44 H new ATOM 917 N ASN A 64 -11.876 7.251 -4.410 1.00 34.34 N ATOM 918 CA ASN A 64 -11.090 8.345 -3.793 1.00 54.24 C ATOM 919 C ASN A 64 -9.682 7.880 -3.387 1.00 13.12 C ATOM 920 O ASN A 64 -8.684 8.559 -3.638 1.00 10.22 O ATOM 921 CB ASN A 64 -11.849 8.903 -2.578 1.00 13.32 C ATOM 922 CG ASN A 64 -13.033 9.765 -2.972 1.00 51.15 C ATOM 923 OD1 ASN A 64 -13.548 9.664 -4.077 1.00 30.12 O ATOM 924 ND2 ASN A 64 -13.522 10.549 -2.053 1.00 31.04 N ATOM 0 H ASN A 64 -12.260 6.600 -3.725 1.00 34.34 H new ATOM 0 HA ASN A 64 -10.964 9.133 -4.535 1.00 54.24 H new ATOM 0 HB2 ASN A 64 -12.197 8.075 -1.961 1.00 13.32 H new ATOM 0 HB3 ASN A 64 -11.165 9.491 -1.966 1.00 13.32 H new ATOM 0 HD21 ASN A 64 -14.358 11.101 -2.245 1.00 31.04 H new ATOM 0 HD22 ASN A 64 -13.069 10.611 -1.141 1.00 31.04 H new ATOM 931 N ARG A 65 -9.613 6.723 -2.782 1.00 21.51 N ATOM 932 CA ARG A 65 -8.352 6.121 -2.333 1.00 42.42 C ATOM 933 C ARG A 65 -8.456 4.641 -2.496 1.00 35.54 C ATOM 934 O ARG A 65 -9.559 4.076 -2.475 1.00 50.22 O ATOM 935 CB ARG A 65 -8.067 6.408 -0.854 1.00 3.20 C ATOM 936 CG ARG A 65 -7.738 7.850 -0.537 1.00 63.43 C ATOM 937 CD ARG A 65 -7.543 8.062 0.939 1.00 14.22 C ATOM 938 NE ARG A 65 -6.186 7.902 1.330 1.00 1.11 N ATOM 939 CZ ARG A 65 -5.753 7.096 2.293 1.00 54.13 C ATOM 940 NH1 ARG A 65 -6.569 6.192 2.851 1.00 0.51 N ATOM 941 NH2 ARG A 65 -4.487 7.170 2.673 1.00 14.45 N ATOM 0 H ARG A 65 -10.433 6.152 -2.577 1.00 21.51 H new ATOM 0 HA ARG A 65 -7.546 6.549 -2.929 1.00 42.42 H new ATOM 0 HB2 ARG A 65 -8.936 6.111 -0.267 1.00 3.20 H new ATOM 0 HB3 ARG A 65 -7.236 5.781 -0.531 1.00 3.20 H new ATOM 0 HG2 ARG A 65 -6.833 8.143 -1.070 1.00 63.43 H new ATOM 0 HG3 ARG A 65 -8.541 8.494 -0.895 1.00 63.43 H new ATOM 0 HD2 ARG A 65 -7.881 9.063 1.208 1.00 14.22 H new ATOM 0 HD3 ARG A 65 -8.164 7.356 1.491 1.00 14.22 H new ATOM 0 HE ARG A 65 -5.487 8.451 0.830 1.00 1.11 H new ATOM 0 HH11 ARG A 65 -7.537 6.116 2.537 1.00 0.51 H new ATOM 0 HH12 ARG A 65 -6.223 5.580 3.590 1.00 0.51 H new ATOM 0 HH21 ARG A 65 -3.859 7.839 2.228 1.00 14.45 H new ATOM 0 HH22 ARG A 65 -4.139 6.558 3.411 1.00 14.45 H new ATOM 955 N ILE A 66 -7.349 4.021 -2.678 1.00 52.11 N ATOM 956 CA ILE A 66 -7.260 2.606 -2.803 1.00 62.21 C ATOM 957 C ILE A 66 -5.939 2.126 -2.263 1.00 2.25 C ATOM 958 O ILE A 66 -4.885 2.702 -2.554 1.00 63.32 O ATOM 959 CB ILE A 66 -7.589 2.081 -4.249 1.00 31.35 C ATOM 960 CG1 ILE A 66 -7.083 0.657 -4.548 1.00 51.13 C ATOM 961 CG2 ILE A 66 -7.369 3.066 -5.349 1.00 53.22 C ATOM 962 CD1 ILE A 66 -7.373 0.177 -5.964 1.00 71.30 C ATOM 0 H ILE A 66 -6.449 4.496 -2.747 1.00 52.11 H new ATOM 0 HA ILE A 66 -8.045 2.163 -2.190 1.00 62.21 H new ATOM 0 HB ILE A 66 -8.673 1.971 -4.230 1.00 31.35 H new ATOM 0 HG12 ILE A 66 -6.007 0.622 -4.378 1.00 51.13 H new ATOM 0 HG13 ILE A 66 -7.540 -0.035 -3.841 1.00 51.13 H new ATOM 0 HG21 ILE A 66 -7.624 2.608 -6.304 1.00 53.22 H new ATOM 0 HG22 ILE A 66 -7.999 3.940 -5.186 1.00 53.22 H new ATOM 0 HG23 ILE A 66 -6.322 3.370 -5.361 1.00 53.22 H new ATOM 0 HD11 ILE A 66 -6.985 -0.833 -6.092 1.00 71.30 H new ATOM 0 HD12 ILE A 66 -8.450 0.176 -6.135 1.00 71.30 H new ATOM 0 HD13 ILE A 66 -6.893 0.844 -6.680 1.00 71.30 H new ATOM 974 N THR A 67 -6.011 1.115 -1.460 1.00 32.22 N ATOM 975 CA THR A 67 -4.869 0.567 -0.794 1.00 2.45 C ATOM 976 C THR A 67 -4.816 -0.892 -1.136 1.00 44.44 C ATOM 977 O THR A 67 -5.815 -1.572 -0.998 1.00 24.24 O ATOM 978 CB THR A 67 -5.039 0.711 0.739 1.00 21.23 C ATOM 979 OG1 THR A 67 -5.280 2.083 1.069 1.00 53.44 O ATOM 980 CG2 THR A 67 -3.801 0.221 1.487 1.00 32.22 C ATOM 0 H THR A 67 -6.884 0.635 -1.242 1.00 32.22 H new ATOM 0 HA THR A 67 -3.961 1.085 -1.102 1.00 2.45 H new ATOM 0 HB THR A 67 -5.887 0.097 1.043 1.00 21.23 H new ATOM 0 HG1 THR A 67 -5.389 2.172 2.039 1.00 53.44 H new ATOM 0 HG21 THR A 67 -3.955 0.337 2.560 1.00 32.22 H new ATOM 0 HG22 THR A 67 -3.629 -0.830 1.256 1.00 32.22 H new ATOM 0 HG23 THR A 67 -2.935 0.807 1.179 1.00 32.22 H new ATOM 988 N ILE A 68 -3.691 -1.381 -1.584 1.00 11.53 N ATOM 989 CA ILE A 68 -3.597 -2.774 -1.929 1.00 15.53 C ATOM 990 C ILE A 68 -2.406 -3.308 -1.204 1.00 12.04 C ATOM 991 O ILE A 68 -1.311 -2.801 -1.381 1.00 42.44 O ATOM 992 CB ILE A 68 -3.368 -3.062 -3.470 1.00 72.22 C ATOM 993 CG1 ILE A 68 -4.207 -2.162 -4.381 1.00 50.44 C ATOM 994 CG2 ILE A 68 -3.676 -4.520 -3.790 1.00 4.11 C ATOM 995 CD1 ILE A 68 -3.594 -0.794 -4.612 1.00 73.20 C ATOM 0 H ILE A 68 -2.835 -0.842 -1.718 1.00 11.53 H new ATOM 0 HA ILE A 68 -4.546 -3.239 -1.661 1.00 15.53 H new ATOM 0 HB ILE A 68 -2.319 -2.843 -3.667 1.00 72.22 H new ATOM 0 HG12 ILE A 68 -4.343 -2.657 -5.342 1.00 50.44 H new ATOM 0 HG13 ILE A 68 -5.198 -2.038 -3.943 1.00 50.44 H new ATOM 0 HG21 ILE A 68 -3.514 -4.701 -4.852 1.00 4.11 H new ATOM 0 HG22 ILE A 68 -3.020 -5.167 -3.207 1.00 4.11 H new ATOM 0 HG23 ILE A 68 -4.715 -4.736 -3.540 1.00 4.11 H new ATOM 0 HD11 ILE A 68 -4.242 -0.211 -5.266 1.00 73.20 H new ATOM 0 HD12 ILE A 68 -3.483 -0.279 -3.658 1.00 73.20 H new ATOM 0 HD13 ILE A 68 -2.615 -0.908 -5.078 1.00 73.20 H new ATOM 1007 N LEU A 69 -2.600 -4.263 -0.369 1.00 45.25 N ATOM 1008 CA LEU A 69 -1.486 -4.861 0.291 1.00 74.40 C ATOM 1009 C LEU A 69 -1.386 -6.333 0.011 1.00 64.14 C ATOM 1010 O LEU A 69 -2.370 -7.075 0.099 1.00 4.31 O ATOM 1011 CB LEU A 69 -1.261 -4.467 1.778 1.00 43.34 C ATOM 1012 CG LEU A 69 -2.394 -4.623 2.775 1.00 1.31 C ATOM 1013 CD1 LEU A 69 -1.818 -4.470 4.182 1.00 20.34 C ATOM 1014 CD2 LEU A 69 -3.459 -3.547 2.565 1.00 62.23 C ATOM 0 H LEU A 69 -3.512 -4.649 -0.124 1.00 45.25 H new ATOM 0 HA LEU A 69 -0.619 -4.393 -0.176 1.00 74.40 H new ATOM 0 HB2 LEU A 69 -0.419 -5.053 2.147 1.00 43.34 H new ATOM 0 HB3 LEU A 69 -0.953 -3.421 1.795 1.00 43.34 H new ATOM 0 HG LEU A 69 -2.855 -5.601 2.639 1.00 1.31 H new ATOM 0 HD11 LEU A 69 -2.617 -4.579 4.916 1.00 20.34 H new ATOM 0 HD12 LEU A 69 -1.063 -5.237 4.351 1.00 20.34 H new ATOM 0 HD13 LEU A 69 -1.363 -3.485 4.284 1.00 20.34 H new ATOM 0 HD21 LEU A 69 -4.260 -3.681 3.292 1.00 62.23 H new ATOM 0 HD22 LEU A 69 -3.011 -2.562 2.696 1.00 62.23 H new ATOM 0 HD23 LEU A 69 -3.866 -3.630 1.557 1.00 62.23 H new ATOM 1026 N CYS A 70 -0.222 -6.735 -0.350 1.00 0.44 N ATOM 1027 CA CYS A 70 0.081 -8.057 -0.739 1.00 72.43 C ATOM 1028 C CYS A 70 1.018 -8.670 0.296 1.00 31.32 C ATOM 1029 O CYS A 70 2.095 -8.176 0.518 1.00 72.12 O ATOM 1030 CB CYS A 70 0.755 -7.990 -2.095 1.00 32.40 C ATOM 1031 SG CYS A 70 -0.234 -7.183 -3.379 1.00 14.42 S ATOM 0 H CYS A 70 0.586 -6.114 -0.382 1.00 0.44 H new ATOM 0 HA CYS A 70 -0.816 -8.672 -0.803 1.00 72.43 H new ATOM 0 HB2 CYS A 70 1.700 -7.457 -1.992 1.00 32.40 H new ATOM 0 HB3 CYS A 70 0.994 -9.003 -2.420 1.00 32.40 H new ATOM 0 HG CYS A 70 0.429 -7.175 -4.497 1.00 14.42 H new ATOM 1037 N ASP A 71 0.587 -9.714 0.927 1.00 73.50 N ATOM 1038 CA ASP A 71 1.340 -10.355 2.001 1.00 20.04 C ATOM 1039 C ASP A 71 1.729 -11.777 1.590 1.00 35.34 C ATOM 1040 O ASP A 71 0.889 -12.611 1.397 1.00 0.44 O ATOM 1041 CB ASP A 71 0.448 -10.390 3.235 1.00 2.12 C ATOM 1042 CG ASP A 71 1.063 -10.998 4.460 1.00 72.22 C ATOM 1043 OD1 ASP A 71 1.611 -12.117 4.387 1.00 32.22 O ATOM 1044 OD2 ASP A 71 0.931 -10.385 5.512 1.00 44.45 O ATOM 0 H ASP A 71 -0.305 -10.164 0.723 1.00 73.50 H new ATOM 0 HA ASP A 71 2.255 -9.801 2.210 1.00 20.04 H new ATOM 0 HB2 ASP A 71 0.144 -9.370 3.471 1.00 2.12 H new ATOM 0 HB3 ASP A 71 -0.458 -10.945 2.991 1.00 2.12 H new ATOM 1049 N LYS A 72 2.974 -12.038 1.516 1.00 52.34 N ATOM 1050 CA LYS A 72 3.500 -13.294 1.043 1.00 2.34 C ATOM 1051 C LYS A 72 4.237 -14.043 2.185 1.00 61.21 C ATOM 1052 O LYS A 72 4.975 -15.000 1.923 1.00 15.43 O ATOM 1053 CB LYS A 72 4.475 -12.994 -0.122 1.00 52.35 C ATOM 1054 CG LYS A 72 4.987 -14.210 -0.897 1.00 11.24 C ATOM 1055 CD LYS A 72 6.091 -13.835 -1.892 1.00 33.20 C ATOM 1056 CE LYS A 72 5.619 -12.840 -2.941 1.00 35.44 C ATOM 1057 NZ LYS A 72 6.699 -12.490 -3.896 1.00 52.44 N ATOM 0 H LYS A 72 3.697 -11.372 1.788 1.00 52.34 H new ATOM 0 HA LYS A 72 2.687 -13.934 0.700 1.00 2.34 H new ATOM 0 HB2 LYS A 72 3.977 -12.324 -0.823 1.00 52.35 H new ATOM 0 HB3 LYS A 72 5.334 -12.455 0.278 1.00 52.35 H new ATOM 0 HG2 LYS A 72 5.368 -14.952 -0.196 1.00 11.24 H new ATOM 0 HG3 LYS A 72 4.159 -14.673 -1.433 1.00 11.24 H new ATOM 0 HD2 LYS A 72 6.936 -13.412 -1.349 1.00 33.20 H new ATOM 0 HD3 LYS A 72 6.450 -14.737 -2.388 1.00 33.20 H new ATOM 0 HE2 LYS A 72 4.774 -13.261 -3.486 1.00 35.44 H new ATOM 0 HE3 LYS A 72 5.262 -11.935 -2.449 1.00 35.44 H new ATOM 0 HZ1 LYS A 72 6.493 -11.568 -4.330 1.00 52.44 H new ATOM 0 HZ2 LYS A 72 7.607 -12.440 -3.391 1.00 52.44 H new ATOM 0 HZ3 LYS A 72 6.756 -13.217 -4.638 1.00 52.44 H new ATOM 1071 N PHE A 73 4.015 -13.654 3.455 1.00 11.12 N ATOM 1072 CA PHE A 73 4.768 -14.293 4.553 1.00 73.13 C ATOM 1073 C PHE A 73 4.474 -15.796 4.680 1.00 51.11 C ATOM 1074 O PHE A 73 5.293 -16.554 5.195 1.00 15.23 O ATOM 1075 CB PHE A 73 4.652 -13.552 5.945 1.00 32.23 C ATOM 1076 CG PHE A 73 3.320 -13.603 6.708 1.00 44.13 C ATOM 1077 CD1 PHE A 73 2.714 -14.810 7.043 1.00 54.02 C ATOM 1078 CD2 PHE A 73 2.717 -12.431 7.133 1.00 13.45 C ATOM 1079 CE1 PHE A 73 1.539 -14.842 7.767 1.00 43.23 C ATOM 1080 CE2 PHE A 73 1.535 -12.459 7.854 1.00 2.31 C ATOM 1081 CZ PHE A 73 0.948 -13.665 8.171 1.00 42.15 C ATOM 0 H PHE A 73 3.352 -12.933 3.740 1.00 11.12 H new ATOM 0 HA PHE A 73 5.812 -14.190 4.257 1.00 73.13 H new ATOM 0 HB2 PHE A 73 5.422 -13.960 6.600 1.00 32.23 H new ATOM 0 HB3 PHE A 73 4.897 -12.503 5.780 1.00 32.23 H new ATOM 0 HD1 PHE A 73 3.171 -15.738 6.731 1.00 54.02 H new ATOM 0 HD2 PHE A 73 3.175 -11.481 6.899 1.00 13.45 H new ATOM 0 HE1 PHE A 73 1.083 -15.789 8.016 1.00 43.23 H new ATOM 0 HE2 PHE A 73 1.073 -11.535 8.168 1.00 2.31 H new ATOM 0 HZ PHE A 73 0.027 -13.687 8.735 1.00 42.15 H new ATOM 1091 N SER A 74 3.321 -16.215 4.194 1.00 61.41 N ATOM 1092 CA SER A 74 2.908 -17.596 4.278 1.00 75.34 C ATOM 1093 C SER A 74 3.334 -18.379 3.004 1.00 13.51 C ATOM 1094 O SER A 74 2.904 -19.510 2.772 1.00 74.22 O ATOM 1095 CB SER A 74 1.376 -17.647 4.491 1.00 64.22 C ATOM 1096 OG SER A 74 0.903 -18.966 4.744 1.00 32.51 O ATOM 0 H SER A 74 2.647 -15.605 3.731 1.00 61.41 H new ATOM 0 HA SER A 74 3.400 -18.076 5.124 1.00 75.34 H new ATOM 0 HB2 SER A 74 1.107 -17.002 5.327 1.00 64.22 H new ATOM 0 HB3 SER A 74 0.876 -17.249 3.608 1.00 64.22 H new ATOM 0 HG SER A 74 1.325 -19.591 4.118 1.00 32.51 H new ATOM 1102 N GLY A 75 4.175 -17.778 2.183 1.00 65.15 N ATOM 1103 CA GLY A 75 4.654 -18.458 0.990 1.00 10.40 C ATOM 1104 C GLY A 75 3.845 -18.080 -0.215 1.00 34.45 C ATOM 1105 O GLY A 75 4.381 -17.656 -1.230 1.00 35.12 O ATOM 0 H GLY A 75 4.537 -16.834 2.315 1.00 65.15 H new ATOM 0 HA2 GLY A 75 5.701 -18.206 0.821 1.00 10.40 H new ATOM 0 HA3 GLY A 75 4.605 -19.537 1.139 1.00 10.40 H new ATOM 1109 N HIS A 76 2.551 -18.218 -0.098 1.00 33.25 N ATOM 1110 CA HIS A 76 1.659 -17.805 -1.154 1.00 35.14 C ATOM 1111 C HIS A 76 1.292 -16.378 -0.908 1.00 54.13 C ATOM 1112 O HIS A 76 0.866 -16.033 0.197 1.00 21.24 O ATOM 1113 CB HIS A 76 0.399 -18.675 -1.260 1.00 53.33 C ATOM 1114 CG HIS A 76 0.649 -20.072 -1.727 1.00 35.44 C ATOM 1115 ND1 HIS A 76 0.529 -21.167 -0.919 1.00 51.23 N ATOM 1116 CD2 HIS A 76 0.982 -20.551 -2.948 1.00 61.13 C ATOM 1117 CE1 HIS A 76 0.777 -22.251 -1.606 1.00 51.42 C ATOM 1118 NE2 HIS A 76 1.055 -21.909 -2.841 1.00 5.31 N ATOM 0 H HIS A 76 2.088 -18.614 0.720 1.00 33.25 H new ATOM 0 HA HIS A 76 2.175 -17.923 -2.107 1.00 35.14 H new ATOM 0 HB2 HIS A 76 -0.085 -18.713 -0.284 1.00 53.33 H new ATOM 0 HB3 HIS A 76 -0.301 -18.196 -1.944 1.00 53.33 H new ATOM 0 HD2 HIS A 76 1.157 -19.968 -3.840 1.00 61.13 H new ATOM 0 HE1 HIS A 76 0.756 -23.260 -1.221 1.00 51.42 H new ATOM 0 HE2 HIS A 76 1.288 -22.553 -3.597 1.00 5.31 H new ATOM 1127 N PRO A 77 1.473 -15.517 -1.893 1.00 21.22 N ATOM 1128 CA PRO A 77 1.212 -14.115 -1.724 1.00 72.55 C ATOM 1129 C PRO A 77 -0.268 -13.813 -1.655 1.00 3.01 C ATOM 1130 O PRO A 77 -1.044 -14.123 -2.575 1.00 44.45 O ATOM 1131 CB PRO A 77 1.871 -13.489 -2.938 1.00 72.41 C ATOM 1132 CG PRO A 77 1.808 -14.538 -3.986 1.00 61.41 C ATOM 1133 CD PRO A 77 1.935 -15.841 -3.263 1.00 33.10 C ATOM 0 HA PRO A 77 1.602 -13.723 -0.785 1.00 72.55 H new ATOM 0 HB2 PRO A 77 1.347 -12.585 -3.251 1.00 72.41 H new ATOM 0 HB3 PRO A 77 2.901 -13.203 -2.726 1.00 72.41 H new ATOM 0 HG2 PRO A 77 0.869 -14.486 -4.536 1.00 61.41 H new ATOM 0 HG3 PRO A 77 2.611 -14.414 -4.713 1.00 61.41 H new ATOM 0 HD2 PRO A 77 1.322 -16.617 -3.721 1.00 33.10 H new ATOM 0 HD3 PRO A 77 2.963 -16.204 -3.266 1.00 33.10 H new ATOM 1141 N LYS A 78 -0.663 -13.273 -0.543 1.00 73.35 N ATOM 1142 CA LYS A 78 -2.005 -12.885 -0.296 1.00 54.20 C ATOM 1143 C LYS A 78 -2.195 -11.485 -0.736 1.00 25.32 C ATOM 1144 O LYS A 78 -1.234 -10.790 -1.066 1.00 3.34 O ATOM 1145 CB LYS A 78 -2.311 -13.009 1.218 1.00 53.11 C ATOM 1146 CG LYS A 78 -1.951 -14.393 1.751 1.00 24.15 C ATOM 1147 CD LYS A 78 -2.413 -14.685 3.176 1.00 34.13 C ATOM 1148 CE LYS A 78 -2.316 -13.509 4.113 1.00 3.21 C ATOM 1149 NZ LYS A 78 -2.561 -13.933 5.504 1.00 65.44 N ATOM 0 H LYS A 78 -0.035 -13.087 0.239 1.00 73.35 H new ATOM 0 HA LYS A 78 -2.684 -13.534 -0.849 1.00 54.20 H new ATOM 0 HB2 LYS A 78 -1.752 -12.250 1.766 1.00 53.11 H new ATOM 0 HB3 LYS A 78 -3.369 -12.815 1.393 1.00 53.11 H new ATOM 0 HG2 LYS A 78 -2.381 -15.143 1.087 1.00 24.15 H new ATOM 0 HG3 LYS A 78 -0.868 -14.511 1.707 1.00 24.15 H new ATOM 0 HD2 LYS A 78 -3.448 -15.027 3.147 1.00 34.13 H new ATOM 0 HD3 LYS A 78 -1.817 -15.505 3.578 1.00 34.13 H new ATOM 0 HE2 LYS A 78 -1.328 -13.055 4.034 1.00 3.21 H new ATOM 0 HE3 LYS A 78 -3.041 -12.747 3.826 1.00 3.21 H new ATOM 0 HZ1 LYS A 78 -2.490 -13.110 6.135 1.00 65.44 H new ATOM 0 HZ2 LYS A 78 -3.513 -14.346 5.579 1.00 65.44 H new ATOM 0 HZ3 LYS A 78 -1.853 -14.643 5.780 1.00 65.44 H new ATOM 1163 N GLY A 79 -3.391 -11.058 -0.695 1.00 11.15 N ATOM 1164 CA GLY A 79 -3.691 -9.773 -1.119 1.00 21.23 C ATOM 1165 C GLY A 79 -5.013 -9.347 -0.627 1.00 25.22 C ATOM 1166 O GLY A 79 -5.967 -10.133 -0.606 1.00 4.00 O ATOM 0 H GLY A 79 -4.189 -11.600 -0.363 1.00 11.15 H new ATOM 0 HA2 GLY A 79 -2.927 -9.082 -0.763 1.00 21.23 H new ATOM 0 HA3 GLY A 79 -3.675 -9.733 -2.208 1.00 21.23 H new ATOM 1170 N TYR A 80 -5.064 -8.151 -0.194 1.00 43.21 N ATOM 1171 CA TYR A 80 -6.270 -7.519 0.197 1.00 74.22 C ATOM 1172 C TYR A 80 -6.173 -6.043 -0.032 1.00 21.20 C ATOM 1173 O TYR A 80 -5.102 -5.447 0.118 1.00 5.24 O ATOM 1174 CB TYR A 80 -6.810 -7.937 1.610 1.00 3.12 C ATOM 1175 CG TYR A 80 -5.871 -7.845 2.822 1.00 40.14 C ATOM 1176 CD1 TYR A 80 -4.576 -7.410 2.732 1.00 13.21 C ATOM 1177 CD2 TYR A 80 -6.319 -8.238 4.062 1.00 25.12 C ATOM 1178 CE1 TYR A 80 -3.766 -7.367 3.851 1.00 24.33 C ATOM 1179 CE2 TYR A 80 -5.518 -8.180 5.174 1.00 60.13 C ATOM 1180 CZ TYR A 80 -4.248 -7.742 5.062 1.00 5.53 C ATOM 1181 OH TYR A 80 -3.429 -7.708 6.172 1.00 65.14 O ATOM 0 H TYR A 80 -4.240 -7.558 -0.096 1.00 43.21 H new ATOM 0 HA TYR A 80 -7.059 -7.896 -0.453 1.00 74.22 H new ATOM 0 HB2 TYR A 80 -7.684 -7.322 1.823 1.00 3.12 H new ATOM 0 HB3 TYR A 80 -7.155 -8.968 1.539 1.00 3.12 H new ATOM 0 HD1 TYR A 80 -4.183 -7.097 1.776 1.00 13.21 H new ATOM 0 HD2 TYR A 80 -7.331 -8.603 4.163 1.00 25.12 H new ATOM 0 HE1 TYR A 80 -2.743 -7.033 3.761 1.00 24.33 H new ATOM 0 HE2 TYR A 80 -5.903 -8.484 6.136 1.00 60.13 H new ATOM 0 HH TYR A 80 -3.931 -8.007 6.958 1.00 65.14 H new ATOM 1191 N ALA A 81 -7.250 -5.470 -0.427 1.00 51.03 N ATOM 1192 CA ALA A 81 -7.289 -4.112 -0.813 1.00 60.41 C ATOM 1193 C ALA A 81 -8.429 -3.433 -0.135 1.00 1.54 C ATOM 1194 O ALA A 81 -9.426 -4.044 0.157 1.00 65.13 O ATOM 1195 CB ALA A 81 -7.438 -4.005 -2.323 1.00 53.12 C ATOM 0 H ALA A 81 -8.150 -5.946 -0.492 1.00 51.03 H new ATOM 0 HA ALA A 81 -6.358 -3.627 -0.518 1.00 60.41 H new ATOM 0 HB1 ALA A 81 -7.467 -2.954 -2.612 1.00 53.12 H new ATOM 0 HB2 ALA A 81 -6.591 -4.491 -2.808 1.00 53.12 H new ATOM 0 HB3 ALA A 81 -8.362 -4.492 -2.633 1.00 53.12 H new ATOM 1201 N TYR A 82 -8.261 -2.205 0.156 1.00 65.44 N ATOM 1202 CA TYR A 82 -9.294 -1.420 0.746 1.00 73.01 C ATOM 1203 C TYR A 82 -9.553 -0.236 -0.147 1.00 30.35 C ATOM 1204 O TYR A 82 -8.639 0.556 -0.416 1.00 21.45 O ATOM 1205 CB TYR A 82 -8.890 -0.990 2.160 1.00 22.11 C ATOM 1206 CG TYR A 82 -8.733 -2.152 3.141 1.00 60.14 C ATOM 1207 CD1 TYR A 82 -7.567 -2.910 3.177 1.00 50.12 C ATOM 1208 CD2 TYR A 82 -9.750 -2.473 4.042 1.00 2.50 C ATOM 1209 CE1 TYR A 82 -7.416 -3.945 4.079 1.00 41.45 C ATOM 1210 CE2 TYR A 82 -9.609 -3.518 4.952 1.00 1.13 C ATOM 1211 CZ TYR A 82 -8.426 -4.246 4.957 1.00 32.31 C ATOM 1212 OH TYR A 82 -8.244 -5.264 5.855 1.00 14.22 O ATOM 0 H TYR A 82 -7.391 -1.698 -0.007 1.00 65.44 H new ATOM 0 HA TYR A 82 -10.212 -2.000 0.841 1.00 73.01 H new ATOM 0 HB2 TYR A 82 -7.949 -0.442 2.107 1.00 22.11 H new ATOM 0 HB3 TYR A 82 -9.639 -0.300 2.547 1.00 22.11 H new ATOM 0 HD1 TYR A 82 -6.766 -2.685 2.488 1.00 50.12 H new ATOM 0 HD2 TYR A 82 -10.665 -1.899 4.033 1.00 2.50 H new ATOM 0 HE1 TYR A 82 -6.501 -4.518 4.093 1.00 41.45 H new ATOM 0 HE2 TYR A 82 -10.405 -3.758 5.641 1.00 1.13 H new ATOM 0 HH TYR A 82 -8.765 -6.045 5.574 1.00 14.22 H new ATOM 1222 N ILE A 83 -10.761 -0.133 -0.646 1.00 42.23 N ATOM 1223 CA ILE A 83 -11.097 0.917 -1.591 1.00 11.34 C ATOM 1224 C ILE A 83 -12.004 1.910 -0.879 1.00 52.20 C ATOM 1225 O ILE A 83 -12.900 1.503 -0.144 1.00 42.30 O ATOM 1226 CB ILE A 83 -11.905 0.343 -2.811 1.00 70.35 C ATOM 1227 CG1 ILE A 83 -11.380 -1.007 -3.332 1.00 22.33 C ATOM 1228 CG2 ILE A 83 -12.013 1.349 -3.939 1.00 62.04 C ATOM 1229 CD1 ILE A 83 -9.991 -0.992 -3.881 1.00 31.41 C ATOM 0 H ILE A 83 -11.531 -0.761 -0.417 1.00 42.23 H new ATOM 0 HA ILE A 83 -10.175 1.374 -1.950 1.00 11.34 H new ATOM 0 HB ILE A 83 -12.904 0.149 -2.420 1.00 70.35 H new ATOM 0 HG12 ILE A 83 -11.422 -1.731 -2.518 1.00 22.33 H new ATOM 0 HG13 ILE A 83 -12.055 -1.363 -4.110 1.00 22.33 H new ATOM 0 HG21 ILE A 83 -12.579 0.913 -4.762 1.00 62.04 H new ATOM 0 HG22 ILE A 83 -12.524 2.243 -3.581 1.00 62.04 H new ATOM 0 HG23 ILE A 83 -11.015 1.616 -4.286 1.00 62.04 H new ATOM 0 HD11 ILE A 83 -9.723 -1.993 -4.219 1.00 31.41 H new ATOM 0 HD12 ILE A 83 -9.939 -0.299 -4.721 1.00 31.41 H new ATOM 0 HD13 ILE A 83 -9.296 -0.673 -3.104 1.00 31.41 H new ATOM 1241 N GLU A 84 -11.759 3.174 -1.057 1.00 51.42 N ATOM 1242 CA GLU A 84 -12.608 4.201 -0.495 1.00 11.13 C ATOM 1243 C GLU A 84 -13.297 4.954 -1.628 1.00 74.12 C ATOM 1244 O GLU A 84 -12.630 5.453 -2.544 1.00 2.13 O ATOM 1245 CB GLU A 84 -11.778 5.165 0.363 1.00 61.31 C ATOM 1246 CG GLU A 84 -11.078 4.497 1.545 1.00 34.53 C ATOM 1247 CD GLU A 84 -10.228 5.457 2.345 1.00 12.24 C ATOM 1248 OE1 GLU A 84 -10.763 6.169 3.179 1.00 64.40 O ATOM 1249 OE2 GLU A 84 -9.021 5.517 2.125 1.00 21.12 O ATOM 0 H GLU A 84 -10.968 3.530 -1.594 1.00 51.42 H new ATOM 0 HA GLU A 84 -13.362 3.741 0.144 1.00 11.13 H new ATOM 0 HB2 GLU A 84 -11.028 5.643 -0.267 1.00 61.31 H new ATOM 0 HB3 GLU A 84 -12.429 5.954 0.738 1.00 61.31 H new ATOM 0 HG2 GLU A 84 -11.827 4.051 2.199 1.00 34.53 H new ATOM 0 HG3 GLU A 84 -10.451 3.684 1.178 1.00 34.53 H new ATOM 1256 N PHE A 85 -14.610 5.013 -1.588 1.00 53.15 N ATOM 1257 CA PHE A 85 -15.384 5.695 -2.619 1.00 33.23 C ATOM 1258 C PHE A 85 -15.755 7.107 -2.204 1.00 44.05 C ATOM 1259 O PHE A 85 -15.640 7.463 -1.040 1.00 65.11 O ATOM 1260 CB PHE A 85 -16.666 4.927 -2.950 1.00 14.35 C ATOM 1261 CG PHE A 85 -16.463 3.605 -3.623 1.00 10.31 C ATOM 1262 CD1 PHE A 85 -16.335 3.538 -5.000 1.00 13.25 C ATOM 1263 CD2 PHE A 85 -16.420 2.433 -2.896 1.00 33.01 C ATOM 1264 CE1 PHE A 85 -16.166 2.335 -5.636 1.00 41.54 C ATOM 1265 CE2 PHE A 85 -16.252 1.224 -3.533 1.00 74.04 C ATOM 1266 CZ PHE A 85 -16.126 1.178 -4.899 1.00 40.51 C ATOM 0 H PHE A 85 -15.174 4.595 -0.848 1.00 53.15 H new ATOM 0 HA PHE A 85 -14.747 5.740 -3.502 1.00 33.23 H new ATOM 0 HB2 PHE A 85 -17.222 4.765 -2.026 1.00 14.35 H new ATOM 0 HB3 PHE A 85 -17.289 5.551 -3.591 1.00 14.35 H new ATOM 0 HD1 PHE A 85 -16.369 4.447 -5.582 1.00 13.25 H new ATOM 0 HD2 PHE A 85 -16.519 2.464 -1.821 1.00 33.01 H new ATOM 0 HE1 PHE A 85 -16.065 2.298 -6.711 1.00 41.54 H new ATOM 0 HE2 PHE A 85 -16.219 0.311 -2.957 1.00 74.04 H new ATOM 0 HZ PHE A 85 -15.995 0.228 -5.396 1.00 40.51 H new ATOM 1276 N ALA A 86 -16.167 7.910 -3.175 1.00 34.45 N ATOM 1277 CA ALA A 86 -16.661 9.266 -2.914 1.00 53.34 C ATOM 1278 C ALA A 86 -18.059 9.222 -2.315 1.00 23.20 C ATOM 1279 O ALA A 86 -18.385 9.977 -1.397 1.00 61.51 O ATOM 1280 CB ALA A 86 -16.676 10.079 -4.200 1.00 1.22 C ATOM 0 H ALA A 86 -16.171 7.648 -4.161 1.00 34.45 H new ATOM 0 HA ALA A 86 -15.989 9.742 -2.199 1.00 53.34 H new ATOM 0 HB1 ALA A 86 -17.045 11.083 -3.991 1.00 1.22 H new ATOM 0 HB2 ALA A 86 -15.665 10.140 -4.604 1.00 1.22 H new ATOM 0 HB3 ALA A 86 -17.329 9.597 -4.928 1.00 1.22 H new ATOM 1286 N GLU A 87 -18.887 8.356 -2.849 1.00 1.24 N ATOM 1287 CA GLU A 87 -20.233 8.197 -2.361 1.00 54.40 C ATOM 1288 C GLU A 87 -20.378 6.986 -1.486 1.00 51.44 C ATOM 1289 O GLU A 87 -19.754 5.946 -1.721 1.00 13.53 O ATOM 1290 CB GLU A 87 -21.235 8.151 -3.506 1.00 11.33 C ATOM 1291 CG GLU A 87 -21.430 9.481 -4.192 1.00 12.11 C ATOM 1292 CD GLU A 87 -21.994 10.505 -3.238 1.00 50.20 C ATOM 1293 OE1 GLU A 87 -23.219 10.507 -3.003 1.00 53.12 O ATOM 1294 OE2 GLU A 87 -21.238 11.302 -2.679 1.00 21.12 O ATOM 0 H GLU A 87 -18.647 7.745 -3.630 1.00 1.24 H new ATOM 0 HA GLU A 87 -20.449 9.073 -1.749 1.00 54.40 H new ATOM 0 HB2 GLU A 87 -20.901 7.418 -4.241 1.00 11.33 H new ATOM 0 HB3 GLU A 87 -22.195 7.805 -3.124 1.00 11.33 H new ATOM 0 HG2 GLU A 87 -20.477 9.833 -4.587 1.00 12.11 H new ATOM 0 HG3 GLU A 87 -22.103 9.361 -5.041 1.00 12.11 H new ATOM 1301 N ARG A 88 -21.213 7.114 -0.483 1.00 65.42 N ATOM 1302 CA ARG A 88 -21.476 6.040 0.444 1.00 40.31 C ATOM 1303 C ARG A 88 -22.372 5.024 -0.281 1.00 65.23 C ATOM 1304 O ARG A 88 -22.370 3.841 0.014 1.00 23.11 O ATOM 1305 CB ARG A 88 -22.189 6.601 1.697 1.00 74.34 C ATOM 1306 CG ARG A 88 -21.889 5.875 3.031 1.00 13.42 C ATOM 1307 CD ARG A 88 -22.223 4.385 3.035 1.00 53.21 C ATOM 1308 NE ARG A 88 -23.648 4.112 2.841 1.00 75.43 N ATOM 1309 CZ ARG A 88 -24.185 2.884 2.721 1.00 1.42 C ATOM 1310 NH1 ARG A 88 -23.412 1.801 2.793 1.00 31.41 N ATOM 1311 NH2 ARG A 88 -25.490 2.747 2.539 1.00 53.34 N ATOM 0 H ARG A 88 -21.731 7.970 -0.286 1.00 65.42 H new ATOM 0 HA ARG A 88 -20.552 5.562 0.770 1.00 40.31 H new ATOM 0 HB2 ARG A 88 -21.915 7.650 1.808 1.00 74.34 H new ATOM 0 HB3 ARG A 88 -23.265 6.570 1.523 1.00 74.34 H new ATOM 0 HG2 ARG A 88 -20.832 5.997 3.266 1.00 13.42 H new ATOM 0 HG3 ARG A 88 -22.451 6.362 3.828 1.00 13.42 H new ATOM 0 HD2 ARG A 88 -21.655 3.890 2.248 1.00 53.21 H new ATOM 0 HD3 ARG A 88 -21.902 3.950 3.982 1.00 53.21 H new ATOM 0 HE ARG A 88 -24.280 4.911 2.793 1.00 75.43 H new ATOM 0 HH11 ARG A 88 -22.408 1.900 2.940 1.00 31.41 H new ATOM 0 HH12 ARG A 88 -23.825 0.873 2.701 1.00 31.41 H new ATOM 0 HH21 ARG A 88 -26.087 3.572 2.490 1.00 53.34 H new ATOM 0 HH22 ARG A 88 -25.897 1.816 2.448 1.00 53.34 H new ATOM 1325 N ASN A 89 -23.109 5.499 -1.260 1.00 11.11 N ATOM 1326 CA ASN A 89 -23.961 4.610 -2.034 1.00 71.32 C ATOM 1327 C ASN A 89 -23.133 3.725 -2.960 1.00 63.04 C ATOM 1328 O ASN A 89 -23.593 2.663 -3.383 1.00 15.44 O ATOM 1329 CB ASN A 89 -25.054 5.354 -2.833 1.00 23.01 C ATOM 1330 CG ASN A 89 -24.521 6.356 -3.837 1.00 14.13 C ATOM 1331 OD1 ASN A 89 -24.224 6.013 -4.986 1.00 51.45 O ATOM 1332 ND2 ASN A 89 -24.426 7.598 -3.428 1.00 72.43 N ATOM 0 H ASN A 89 -23.140 6.479 -1.540 1.00 11.11 H new ATOM 0 HA ASN A 89 -24.477 3.982 -1.308 1.00 71.32 H new ATOM 0 HB2 ASN A 89 -25.665 4.621 -3.359 1.00 23.01 H new ATOM 0 HB3 ASN A 89 -25.709 5.872 -2.133 1.00 23.01 H new ATOM 0 HD21 ASN A 89 -24.097 8.322 -4.067 1.00 72.43 H new ATOM 0 HD22 ASN A 89 -24.681 7.841 -2.471 1.00 72.43 H new ATOM 1339 N SER A 90 -21.901 4.139 -3.266 1.00 42.25 N ATOM 1340 CA SER A 90 -21.036 3.371 -4.130 1.00 21.23 C ATOM 1341 C SER A 90 -20.545 2.105 -3.414 1.00 51.23 C ATOM 1342 O SER A 90 -20.484 1.032 -4.010 1.00 34.40 O ATOM 1343 CB SER A 90 -19.851 4.228 -4.549 1.00 54.12 C ATOM 1344 OG SER A 90 -20.278 5.466 -5.101 1.00 34.02 O ATOM 0 H SER A 90 -21.490 5.006 -2.921 1.00 42.25 H new ATOM 0 HA SER A 90 -21.596 3.068 -5.015 1.00 21.23 H new ATOM 0 HB2 SER A 90 -19.211 4.414 -3.687 1.00 54.12 H new ATOM 0 HB3 SER A 90 -19.251 3.689 -5.282 1.00 54.12 H new ATOM 0 HG SER A 90 -19.495 5.996 -5.360 1.00 34.02 H new ATOM 1350 N VAL A 91 -20.221 2.231 -2.118 1.00 42.21 N ATOM 1351 CA VAL A 91 -19.785 1.067 -1.351 1.00 1.23 C ATOM 1352 C VAL A 91 -20.927 0.106 -1.188 1.00 1.23 C ATOM 1353 O VAL A 91 -20.757 -1.102 -1.329 1.00 32.15 O ATOM 1354 CB VAL A 91 -19.105 1.421 0.039 1.00 22.32 C ATOM 1355 CG1 VAL A 91 -19.950 2.368 0.852 1.00 14.44 C ATOM 1356 CG2 VAL A 91 -18.895 0.153 0.867 1.00 52.42 C ATOM 0 H VAL A 91 -20.253 3.106 -1.595 1.00 42.21 H new ATOM 0 HA VAL A 91 -18.993 0.590 -1.928 1.00 1.23 H new ATOM 0 HB VAL A 91 -18.151 1.896 -0.191 1.00 22.32 H new ATOM 0 HG11 VAL A 91 -19.449 2.585 1.795 1.00 14.44 H new ATOM 0 HG12 VAL A 91 -20.095 3.295 0.297 1.00 14.44 H new ATOM 0 HG13 VAL A 91 -20.919 1.910 1.053 1.00 14.44 H new ATOM 0 HG21 VAL A 91 -18.428 0.412 1.817 1.00 52.42 H new ATOM 0 HG22 VAL A 91 -19.858 -0.323 1.054 1.00 52.42 H new ATOM 0 HG23 VAL A 91 -18.250 -0.535 0.321 1.00 52.42 H new ATOM 1366 N ASP A 92 -22.110 0.652 -0.963 1.00 23.04 N ATOM 1367 CA ASP A 92 -23.309 -0.138 -0.789 1.00 23.21 C ATOM 1368 C ASP A 92 -23.600 -0.947 -2.064 1.00 74.43 C ATOM 1369 O ASP A 92 -24.108 -2.058 -2.004 1.00 52.25 O ATOM 1370 CB ASP A 92 -24.476 0.792 -0.458 1.00 50.44 C ATOM 1371 CG ASP A 92 -25.711 0.061 0.005 1.00 42.45 C ATOM 1372 OD1 ASP A 92 -25.830 -0.186 1.221 1.00 15.30 O ATOM 1373 OD2 ASP A 92 -26.587 -0.253 -0.823 1.00 34.22 O ATOM 0 H ASP A 92 -22.263 1.658 -0.896 1.00 23.04 H new ATOM 0 HA ASP A 92 -23.170 -0.842 0.032 1.00 23.21 H new ATOM 0 HB2 ASP A 92 -24.165 1.492 0.318 1.00 50.44 H new ATOM 0 HB3 ASP A 92 -24.722 1.383 -1.340 1.00 50.44 H new ATOM 1378 N ALA A 93 -23.245 -0.380 -3.213 1.00 23.40 N ATOM 1379 CA ALA A 93 -23.401 -1.057 -4.491 1.00 42.23 C ATOM 1380 C ALA A 93 -22.348 -2.167 -4.667 1.00 60.42 C ATOM 1381 O ALA A 93 -22.637 -3.231 -5.221 1.00 55.43 O ATOM 1382 CB ALA A 93 -23.317 -0.058 -5.638 1.00 50.30 C ATOM 0 H ALA A 93 -22.844 0.555 -3.282 1.00 23.40 H new ATOM 0 HA ALA A 93 -24.386 -1.523 -4.504 1.00 42.23 H new ATOM 0 HB1 ALA A 93 -23.436 -0.582 -6.586 1.00 50.30 H new ATOM 0 HB2 ALA A 93 -24.108 0.685 -5.532 1.00 50.30 H new ATOM 0 HB3 ALA A 93 -22.347 0.439 -5.617 1.00 50.30 H new ATOM 1388 N ALA A 94 -21.145 -1.924 -4.150 1.00 42.02 N ATOM 1389 CA ALA A 94 -20.028 -2.860 -4.323 1.00 10.12 C ATOM 1390 C ALA A 94 -20.174 -4.071 -3.405 1.00 43.53 C ATOM 1391 O ALA A 94 -19.870 -5.182 -3.793 1.00 73.14 O ATOM 1392 CB ALA A 94 -18.665 -2.169 -4.123 1.00 4.33 C ATOM 0 H ALA A 94 -20.916 -1.090 -3.609 1.00 42.02 H new ATOM 0 HA ALA A 94 -20.062 -3.215 -5.353 1.00 10.12 H new ATOM 0 HB1 ALA A 94 -17.865 -2.896 -4.260 1.00 4.33 H new ATOM 0 HB2 ALA A 94 -18.554 -1.366 -4.852 1.00 4.33 H new ATOM 0 HB3 ALA A 94 -18.611 -1.755 -3.116 1.00 4.33 H new ATOM 1398 N VAL A 95 -20.654 -3.841 -2.188 1.00 14.43 N ATOM 1399 CA VAL A 95 -20.856 -4.926 -1.197 1.00 73.10 C ATOM 1400 C VAL A 95 -21.776 -6.064 -1.689 1.00 3.11 C ATOM 1401 O VAL A 95 -21.725 -7.177 -1.176 1.00 41.32 O ATOM 1402 CB VAL A 95 -21.323 -4.438 0.195 1.00 22.24 C ATOM 1403 CG1 VAL A 95 -20.370 -3.381 0.708 1.00 33.00 C ATOM 1404 CG2 VAL A 95 -22.741 -3.896 0.150 1.00 60.24 C ATOM 0 H VAL A 95 -20.915 -2.915 -1.850 1.00 14.43 H new ATOM 0 HA VAL A 95 -19.852 -5.334 -1.082 1.00 73.10 H new ATOM 0 HB VAL A 95 -21.321 -5.290 0.875 1.00 22.24 H new ATOM 0 HG11 VAL A 95 -20.700 -3.038 1.689 1.00 33.00 H new ATOM 0 HG12 VAL A 95 -19.368 -3.803 0.790 1.00 33.00 H new ATOM 0 HG13 VAL A 95 -20.354 -2.539 0.016 1.00 33.00 H new ATOM 0 HG21 VAL A 95 -23.035 -3.563 1.145 1.00 60.24 H new ATOM 0 HG22 VAL A 95 -22.787 -3.056 -0.543 1.00 60.24 H new ATOM 0 HG23 VAL A 95 -23.420 -4.680 -0.185 1.00 60.24 H new ATOM 1414 N ALA A 96 -22.610 -5.780 -2.677 1.00 62.13 N ATOM 1415 CA ALA A 96 -23.524 -6.795 -3.238 1.00 24.21 C ATOM 1416 C ALA A 96 -22.737 -7.830 -4.056 1.00 40.22 C ATOM 1417 O ALA A 96 -23.244 -8.894 -4.424 1.00 14.12 O ATOM 1418 CB ALA A 96 -24.563 -6.127 -4.109 1.00 14.24 C ATOM 0 H ALA A 96 -22.682 -4.861 -3.114 1.00 62.13 H new ATOM 0 HA ALA A 96 -24.024 -7.308 -2.417 1.00 24.21 H new ATOM 0 HB1 ALA A 96 -25.234 -6.882 -4.519 1.00 14.24 H new ATOM 0 HB2 ALA A 96 -25.137 -5.418 -3.512 1.00 14.24 H new ATOM 0 HB3 ALA A 96 -24.069 -5.599 -4.924 1.00 14.24 H new ATOM 1424 N MET A 97 -21.499 -7.507 -4.302 1.00 0.31 N ATOM 1425 CA MET A 97 -20.617 -8.306 -5.109 1.00 70.21 C ATOM 1426 C MET A 97 -19.694 -9.101 -4.181 1.00 64.13 C ATOM 1427 O MET A 97 -18.778 -9.765 -4.646 1.00 41.44 O ATOM 1428 CB MET A 97 -19.806 -7.327 -5.976 1.00 20.03 C ATOM 1429 CG MET A 97 -19.220 -7.871 -7.237 1.00 55.54 C ATOM 1430 SD MET A 97 -18.513 -6.565 -8.300 1.00 31.43 S ATOM 1431 CE MET A 97 -17.663 -5.489 -7.126 1.00 21.41 C ATOM 0 H MET A 97 -21.063 -6.660 -3.938 1.00 0.31 H new ATOM 0 HA MET A 97 -21.158 -9.010 -5.741 1.00 70.21 H new ATOM 0 HB2 MET A 97 -20.452 -6.488 -6.236 1.00 20.03 H new ATOM 0 HB3 MET A 97 -18.994 -6.928 -5.368 1.00 20.03 H new ATOM 0 HG2 MET A 97 -18.443 -8.594 -6.990 1.00 55.54 H new ATOM 0 HG3 MET A 97 -19.991 -8.408 -7.790 1.00 55.54 H new ATOM 0 HE1 MET A 97 -17.025 -4.791 -7.668 1.00 21.41 H new ATOM 0 HE2 MET A 97 -18.398 -4.933 -6.544 1.00 21.41 H new ATOM 0 HE3 MET A 97 -17.052 -6.093 -6.456 1.00 21.41 H new ATOM 1441 N ASP A 98 -19.956 -8.992 -2.839 1.00 13.45 N ATOM 1442 CA ASP A 98 -19.149 -9.639 -1.763 1.00 12.34 C ATOM 1443 C ASP A 98 -18.645 -11.010 -2.094 1.00 53.21 C ATOM 1444 O ASP A 98 -17.525 -11.326 -1.755 1.00 44.22 O ATOM 1445 CB ASP A 98 -19.853 -9.651 -0.398 1.00 50.51 C ATOM 1446 CG ASP A 98 -20.859 -10.762 -0.213 1.00 22.35 C ATOM 1447 OD1 ASP A 98 -21.980 -10.676 -0.761 1.00 72.10 O ATOM 1448 OD2 ASP A 98 -20.546 -11.737 0.515 1.00 20.53 O ATOM 0 H ASP A 98 -20.739 -8.448 -2.477 1.00 13.45 H new ATOM 0 HA ASP A 98 -18.274 -8.992 -1.693 1.00 12.34 H new ATOM 0 HB2 ASP A 98 -19.098 -9.730 0.384 1.00 50.51 H new ATOM 0 HB3 ASP A 98 -20.358 -8.695 -0.257 1.00 50.51 H new ATOM 1453 N GLU A 99 -19.456 -11.839 -2.700 1.00 4.20 N ATOM 1454 CA GLU A 99 -18.991 -13.094 -3.138 1.00 34.23 C ATOM 1455 C GLU A 99 -19.104 -13.185 -4.654 1.00 22.34 C ATOM 1456 O GLU A 99 -20.201 -13.311 -5.223 1.00 25.32 O ATOM 1457 CB GLU A 99 -19.716 -14.236 -2.438 1.00 32.35 C ATOM 1458 CG GLU A 99 -19.229 -15.606 -2.848 1.00 20.15 C ATOM 1459 CD GLU A 99 -19.928 -16.716 -2.119 1.00 70.20 C ATOM 1460 OE1 GLU A 99 -21.137 -16.950 -2.381 1.00 72.13 O ATOM 1461 OE2 GLU A 99 -19.283 -17.402 -1.295 1.00 11.21 O ATOM 0 H GLU A 99 -20.440 -11.651 -2.893 1.00 4.20 H new ATOM 0 HA GLU A 99 -17.939 -13.192 -2.869 1.00 34.23 H new ATOM 0 HB2 GLU A 99 -19.596 -14.125 -1.360 1.00 32.35 H new ATOM 0 HB3 GLU A 99 -20.783 -14.161 -2.649 1.00 32.35 H new ATOM 0 HG2 GLU A 99 -19.377 -15.733 -3.920 1.00 20.15 H new ATOM 0 HG3 GLU A 99 -18.157 -15.675 -2.664 1.00 20.15 H new ATOM 1468 N THR A 100 -17.983 -13.064 -5.270 1.00 1.22 N ATOM 1469 CA THR A 100 -17.854 -13.173 -6.689 1.00 53.01 C ATOM 1470 C THR A 100 -16.488 -13.777 -7.005 1.00 65.14 C ATOM 1471 O THR A 100 -15.606 -13.813 -6.138 1.00 34.21 O ATOM 1472 CB THR A 100 -18.044 -11.790 -7.401 1.00 20.41 C ATOM 1473 OG1 THR A 100 -18.127 -11.967 -8.823 1.00 33.31 O ATOM 1474 CG2 THR A 100 -16.898 -10.837 -7.087 1.00 1.24 C ATOM 0 H THR A 100 -17.101 -12.881 -4.792 1.00 1.22 H new ATOM 0 HA THR A 100 -18.642 -13.822 -7.071 1.00 53.01 H new ATOM 0 HB THR A 100 -18.972 -11.358 -7.026 1.00 20.41 H new ATOM 0 HG1 THR A 100 -18.247 -11.095 -9.255 1.00 33.31 H new ATOM 0 HG21 THR A 100 -17.063 -9.888 -7.598 1.00 1.24 H new ATOM 0 HG22 THR A 100 -16.851 -10.667 -6.011 1.00 1.24 H new ATOM 0 HG23 THR A 100 -15.959 -11.273 -7.427 1.00 1.24 H new ATOM 1482 N VAL A 101 -16.297 -14.227 -8.212 1.00 50.14 N ATOM 1483 CA VAL A 101 -15.065 -14.850 -8.575 1.00 1.22 C ATOM 1484 C VAL A 101 -14.324 -13.970 -9.585 1.00 73.03 C ATOM 1485 O VAL A 101 -14.737 -13.797 -10.736 1.00 61.32 O ATOM 1486 CB VAL A 101 -15.273 -16.314 -9.070 1.00 31.41 C ATOM 1487 CG1 VAL A 101 -16.203 -16.379 -10.257 1.00 5.23 C ATOM 1488 CG2 VAL A 101 -13.950 -16.994 -9.367 1.00 44.55 C ATOM 0 H VAL A 101 -16.986 -14.172 -8.963 1.00 50.14 H new ATOM 0 HA VAL A 101 -14.437 -14.939 -7.689 1.00 1.22 H new ATOM 0 HB VAL A 101 -15.749 -16.861 -8.257 1.00 31.41 H new ATOM 0 HG11 VAL A 101 -16.321 -17.416 -10.570 1.00 5.23 H new ATOM 0 HG12 VAL A 101 -17.175 -15.971 -9.980 1.00 5.23 H new ATOM 0 HG13 VAL A 101 -15.786 -15.797 -11.079 1.00 5.23 H new ATOM 0 HG21 VAL A 101 -14.133 -18.012 -9.710 1.00 44.55 H new ATOM 0 HG22 VAL A 101 -13.422 -16.440 -10.143 1.00 44.55 H new ATOM 0 HG23 VAL A 101 -13.343 -17.019 -8.462 1.00 44.55 H new ATOM 1498 N PHE A 102 -13.252 -13.415 -9.134 1.00 62.50 N ATOM 1499 CA PHE A 102 -12.499 -12.450 -9.873 1.00 10.24 C ATOM 1500 C PHE A 102 -11.197 -13.087 -10.362 1.00 34.12 C ATOM 1501 O PHE A 102 -10.421 -13.613 -9.561 1.00 52.41 O ATOM 1502 CB PHE A 102 -12.247 -11.271 -8.931 1.00 12.22 C ATOM 1503 CG PHE A 102 -11.575 -10.084 -9.518 1.00 45.40 C ATOM 1504 CD1 PHE A 102 -12.257 -9.243 -10.377 1.00 44.23 C ATOM 1505 CD2 PHE A 102 -10.271 -9.791 -9.198 1.00 4.41 C ATOM 1506 CE1 PHE A 102 -11.643 -8.135 -10.904 1.00 23.13 C ATOM 1507 CE2 PHE A 102 -9.657 -8.684 -9.716 1.00 41.13 C ATOM 1508 CZ PHE A 102 -10.339 -7.851 -10.571 1.00 13.30 C ATOM 0 H PHE A 102 -12.861 -13.623 -8.215 1.00 62.50 H new ATOM 0 HA PHE A 102 -13.031 -12.101 -10.758 1.00 10.24 H new ATOM 0 HB2 PHE A 102 -13.205 -10.952 -8.520 1.00 12.22 H new ATOM 0 HB3 PHE A 102 -11.644 -11.625 -8.095 1.00 12.22 H new ATOM 0 HD1 PHE A 102 -13.283 -9.460 -10.636 1.00 44.23 H new ATOM 0 HD2 PHE A 102 -9.725 -10.442 -8.531 1.00 4.41 H new ATOM 0 HE1 PHE A 102 -12.182 -7.487 -11.579 1.00 23.13 H new ATOM 0 HE2 PHE A 102 -8.633 -8.464 -9.452 1.00 41.13 H new ATOM 0 HZ PHE A 102 -9.853 -6.977 -10.979 1.00 13.30 H new ATOM 1518 N ARG A 103 -10.980 -13.048 -11.683 1.00 43.42 N ATOM 1519 CA ARG A 103 -9.831 -13.673 -12.381 1.00 41.32 C ATOM 1520 C ARG A 103 -9.500 -15.106 -11.918 1.00 72.52 C ATOM 1521 O ARG A 103 -8.362 -15.562 -11.995 1.00 70.13 O ATOM 1522 CB ARG A 103 -8.625 -12.747 -12.355 1.00 40.05 C ATOM 1523 CG ARG A 103 -8.858 -11.478 -13.182 1.00 22.15 C ATOM 1524 CD ARG A 103 -7.651 -10.578 -13.183 1.00 34.23 C ATOM 1525 NE ARG A 103 -6.459 -11.245 -13.730 1.00 75.43 N ATOM 1526 CZ ARG A 103 -5.337 -11.456 -13.045 1.00 23.23 C ATOM 1527 NH1 ARG A 103 -5.257 -11.060 -11.799 1.00 71.03 N ATOM 1528 NH2 ARG A 103 -4.301 -12.068 -13.612 1.00 71.43 N ATOM 0 H ARG A 103 -11.614 -12.568 -12.322 1.00 43.42 H new ATOM 0 HA ARG A 103 -10.137 -13.806 -13.419 1.00 41.32 H new ATOM 0 HB2 ARG A 103 -8.401 -12.472 -11.324 1.00 40.05 H new ATOM 0 HB3 ARG A 103 -7.753 -13.276 -12.740 1.00 40.05 H new ATOM 0 HG2 ARG A 103 -9.106 -11.753 -14.207 1.00 22.15 H new ATOM 0 HG3 ARG A 103 -9.715 -10.936 -12.781 1.00 22.15 H new ATOM 0 HD2 ARG A 103 -7.867 -9.685 -13.770 1.00 34.23 H new ATOM 0 HD3 ARG A 103 -7.445 -10.248 -12.165 1.00 34.23 H new ATOM 0 HE ARG A 103 -6.495 -11.567 -14.697 1.00 75.43 H new ATOM 0 HH11 ARG A 103 -6.051 -10.594 -11.360 1.00 71.03 H new ATOM 0 HH12 ARG A 103 -4.401 -11.218 -11.268 1.00 71.03 H new ATOM 0 HH21 ARG A 103 -4.361 -12.381 -14.581 1.00 71.43 H new ATOM 0 HH22 ARG A 103 -3.446 -12.224 -13.078 1.00 71.43 H new ATOM 1542 N GLY A 104 -10.534 -15.812 -11.513 1.00 30.42 N ATOM 1543 CA GLY A 104 -10.412 -17.215 -11.189 1.00 74.13 C ATOM 1544 C GLY A 104 -10.412 -17.489 -9.700 1.00 12.24 C ATOM 1545 O GLY A 104 -10.351 -18.645 -9.281 1.00 54.34 O ATOM 0 H GLY A 104 -11.474 -15.433 -11.400 1.00 30.42 H new ATOM 0 HA2 GLY A 104 -11.235 -17.760 -11.652 1.00 74.13 H new ATOM 0 HA3 GLY A 104 -9.490 -17.602 -11.622 1.00 74.13 H new ATOM 1549 N ARG A 105 -10.431 -16.458 -8.896 1.00 51.05 N ATOM 1550 CA ARG A 105 -10.507 -16.641 -7.454 1.00 52.14 C ATOM 1551 C ARG A 105 -11.594 -15.803 -6.801 1.00 65.45 C ATOM 1552 O ARG A 105 -11.818 -14.657 -7.171 1.00 23.22 O ATOM 1553 CB ARG A 105 -9.146 -16.458 -6.777 1.00 12.34 C ATOM 1554 CG ARG A 105 -8.358 -15.250 -7.254 1.00 2.31 C ATOM 1555 CD ARG A 105 -7.084 -15.059 -6.448 1.00 15.43 C ATOM 1556 NE ARG A 105 -6.313 -16.311 -6.263 1.00 12.43 N ATOM 1557 CZ ARG A 105 -5.020 -16.476 -6.570 1.00 33.44 C ATOM 1558 NH1 ARG A 105 -4.441 -15.692 -7.453 1.00 51.13 N ATOM 1559 NH2 ARG A 105 -4.351 -17.506 -6.080 1.00 70.24 N ATOM 0 H ARG A 105 -10.396 -15.486 -9.204 1.00 51.05 H new ATOM 0 HA ARG A 105 -10.801 -17.679 -7.299 1.00 52.14 H new ATOM 0 HB2 ARG A 105 -9.299 -16.373 -5.701 1.00 12.34 H new ATOM 0 HB3 ARG A 105 -8.548 -17.354 -6.945 1.00 12.34 H new ATOM 0 HG2 ARG A 105 -8.108 -15.371 -8.308 1.00 2.31 H new ATOM 0 HG3 ARG A 105 -8.977 -14.356 -7.174 1.00 2.31 H new ATOM 0 HD2 ARG A 105 -6.454 -14.323 -6.947 1.00 15.43 H new ATOM 0 HD3 ARG A 105 -7.339 -14.650 -5.470 1.00 15.43 H new ATOM 0 HE ARG A 105 -6.807 -17.112 -5.870 1.00 12.43 H new ATOM 0 HH11 ARG A 105 -4.977 -14.953 -7.908 1.00 51.13 H new ATOM 0 HH12 ARG A 105 -3.456 -15.823 -7.683 1.00 51.13 H new ATOM 0 HH21 ARG A 105 -4.820 -18.174 -5.469 1.00 70.24 H new ATOM 0 HH22 ARG A 105 -3.366 -17.632 -6.314 1.00 70.24 H new ATOM 1573 N THR A 106 -12.268 -16.399 -5.847 1.00 11.30 N ATOM 1574 CA THR A 106 -13.368 -15.769 -5.142 1.00 55.23 C ATOM 1575 C THR A 106 -12.863 -14.678 -4.197 1.00 15.11 C ATOM 1576 O THR A 106 -12.022 -14.933 -3.338 1.00 13.20 O ATOM 1577 CB THR A 106 -14.135 -16.826 -4.329 1.00 53.24 C ATOM 1578 OG1 THR A 106 -14.509 -17.911 -5.207 1.00 5.11 O ATOM 1579 CG2 THR A 106 -15.396 -16.229 -3.700 1.00 60.50 C ATOM 0 H THR A 106 -12.068 -17.348 -5.531 1.00 11.30 H new ATOM 0 HA THR A 106 -14.028 -15.313 -5.880 1.00 55.23 H new ATOM 0 HB THR A 106 -13.490 -17.186 -3.528 1.00 53.24 H new ATOM 0 HG1 THR A 106 -14.997 -18.591 -4.697 1.00 5.11 H new ATOM 0 HG21 THR A 106 -15.918 -16.998 -3.131 1.00 60.50 H new ATOM 0 HG22 THR A 106 -15.119 -15.411 -3.035 1.00 60.50 H new ATOM 0 HG23 THR A 106 -16.051 -15.851 -4.485 1.00 60.50 H new ATOM 1587 N ILE A 107 -13.347 -13.472 -4.381 1.00 12.40 N ATOM 1588 CA ILE A 107 -12.971 -12.374 -3.502 1.00 34.54 C ATOM 1589 C ILE A 107 -14.083 -12.077 -2.502 1.00 43.10 C ATOM 1590 O ILE A 107 -15.183 -12.618 -2.603 1.00 1.14 O ATOM 1591 CB ILE A 107 -12.675 -11.056 -4.296 1.00 61.35 C ATOM 1592 CG1 ILE A 107 -13.948 -10.555 -5.033 1.00 64.02 C ATOM 1593 CG2 ILE A 107 -11.520 -11.271 -5.274 1.00 70.01 C ATOM 1594 CD1 ILE A 107 -13.806 -9.202 -5.737 1.00 61.23 C ATOM 0 H ILE A 107 -13.998 -13.221 -5.125 1.00 12.40 H new ATOM 0 HA ILE A 107 -12.065 -12.694 -2.986 1.00 34.54 H new ATOM 0 HB ILE A 107 -12.379 -10.284 -3.585 1.00 61.35 H new ATOM 0 HG12 ILE A 107 -14.238 -11.302 -5.772 1.00 64.02 H new ATOM 0 HG13 ILE A 107 -14.763 -10.487 -4.312 1.00 64.02 H new ATOM 0 HG21 ILE A 107 -11.327 -10.346 -5.818 1.00 70.01 H new ATOM 0 HG22 ILE A 107 -10.626 -11.561 -4.723 1.00 70.01 H new ATOM 0 HG23 ILE A 107 -11.783 -12.059 -5.980 1.00 70.01 H new ATOM 0 HD11 ILE A 107 -14.748 -8.943 -6.220 1.00 61.23 H new ATOM 0 HD12 ILE A 107 -13.551 -8.436 -5.005 1.00 61.23 H new ATOM 0 HD13 ILE A 107 -13.018 -9.263 -6.488 1.00 61.23 H new ATOM 1606 N LYS A 108 -13.769 -11.229 -1.539 1.00 1.44 N ATOM 1607 CA LYS A 108 -14.704 -10.760 -0.525 1.00 71.33 C ATOM 1608 C LYS A 108 -14.702 -9.274 -0.493 1.00 12.13 C ATOM 1609 O LYS A 108 -13.656 -8.674 -0.304 1.00 50.43 O ATOM 1610 CB LYS A 108 -14.356 -11.283 0.883 1.00 62.22 C ATOM 1611 CG LYS A 108 -14.797 -12.702 1.181 1.00 54.12 C ATOM 1612 CD LYS A 108 -16.327 -12.820 1.180 1.00 22.23 C ATOM 1613 CE LYS A 108 -16.982 -11.907 2.235 1.00 74.53 C ATOM 1614 NZ LYS A 108 -18.456 -12.088 2.298 1.00 1.34 N ATOM 0 H LYS A 108 -12.834 -10.836 -1.436 1.00 1.44 H new ATOM 0 HA LYS A 108 -15.688 -11.143 -0.795 1.00 71.33 H new ATOM 0 HB2 LYS A 108 -13.276 -11.221 1.018 1.00 62.22 H new ATOM 0 HB3 LYS A 108 -14.808 -10.619 1.620 1.00 62.22 H new ATOM 0 HG2 LYS A 108 -14.377 -13.380 0.438 1.00 54.12 H new ATOM 0 HG3 LYS A 108 -14.407 -13.011 2.151 1.00 54.12 H new ATOM 0 HD2 LYS A 108 -16.709 -12.563 0.192 1.00 22.23 H new ATOM 0 HD3 LYS A 108 -16.610 -13.855 1.372 1.00 22.23 H new ATOM 0 HE2 LYS A 108 -16.550 -12.117 3.213 1.00 74.53 H new ATOM 0 HE3 LYS A 108 -16.755 -10.866 2.003 1.00 74.53 H new ATOM 0 HZ1 LYS A 108 -18.849 -11.479 3.044 1.00 1.34 H new ATOM 0 HZ2 LYS A 108 -18.877 -11.830 1.383 1.00 1.34 H new ATOM 0 HZ3 LYS A 108 -18.675 -13.082 2.512 1.00 1.34 H new ATOM 1628 N VAL A 109 -15.848 -8.676 -0.685 1.00 51.23 N ATOM 1629 CA VAL A 109 -15.964 -7.244 -0.630 1.00 44.44 C ATOM 1630 C VAL A 109 -17.088 -6.852 0.316 1.00 42.40 C ATOM 1631 O VAL A 109 -18.240 -7.167 0.086 1.00 14.23 O ATOM 1632 CB VAL A 109 -16.090 -6.558 -2.038 1.00 60.43 C ATOM 1633 CG1 VAL A 109 -14.889 -6.857 -2.884 1.00 12.24 C ATOM 1634 CG2 VAL A 109 -17.333 -6.946 -2.797 1.00 42.13 C ATOM 0 H VAL A 109 -16.721 -9.164 -0.883 1.00 51.23 H new ATOM 0 HA VAL A 109 -15.024 -6.860 -0.233 1.00 44.44 H new ATOM 0 HB VAL A 109 -16.158 -5.490 -1.833 1.00 60.43 H new ATOM 0 HG11 VAL A 109 -14.998 -6.372 -3.854 1.00 12.24 H new ATOM 0 HG12 VAL A 109 -13.993 -6.482 -2.389 1.00 12.24 H new ATOM 0 HG13 VAL A 109 -14.802 -7.934 -3.024 1.00 12.24 H new ATOM 0 HG21 VAL A 109 -17.348 -6.432 -3.758 1.00 42.13 H new ATOM 0 HG22 VAL A 109 -17.337 -8.023 -2.962 1.00 42.13 H new ATOM 0 HG23 VAL A 109 -18.214 -6.664 -2.221 1.00 42.13 H new ATOM 1644 N LEU A 110 -16.757 -6.192 1.372 1.00 41.21 N ATOM 1645 CA LEU A 110 -17.749 -5.827 2.362 1.00 31.31 C ATOM 1646 C LEU A 110 -17.372 -4.488 2.958 1.00 13.03 C ATOM 1647 O LEU A 110 -16.205 -4.091 2.865 1.00 22.51 O ATOM 1648 CB LEU A 110 -18.024 -6.982 3.432 1.00 34.11 C ATOM 1649 CG LEU A 110 -16.928 -7.415 4.448 1.00 63.23 C ATOM 1650 CD1 LEU A 110 -15.665 -7.826 3.784 1.00 13.34 C ATOM 1651 CD2 LEU A 110 -16.680 -6.374 5.516 1.00 64.02 C ATOM 0 H LEU A 110 -15.808 -5.887 1.586 1.00 41.21 H new ATOM 0 HA LEU A 110 -18.719 -5.713 1.879 1.00 31.31 H new ATOM 0 HB2 LEU A 110 -18.894 -6.677 4.013 1.00 34.11 H new ATOM 0 HB3 LEU A 110 -18.310 -7.873 2.873 1.00 34.11 H new ATOM 0 HG LEU A 110 -17.324 -8.297 4.951 1.00 63.23 H new ATOM 0 HD11 LEU A 110 -14.935 -8.118 4.539 1.00 13.34 H new ATOM 0 HD12 LEU A 110 -15.860 -8.670 3.122 1.00 13.34 H new ATOM 0 HD13 LEU A 110 -15.272 -6.992 3.203 1.00 13.34 H new ATOM 0 HD21 LEU A 110 -15.906 -6.729 6.197 1.00 64.02 H new ATOM 0 HD22 LEU A 110 -16.354 -5.444 5.049 1.00 64.02 H new ATOM 0 HD23 LEU A 110 -17.600 -6.197 6.073 1.00 64.02 H new ATOM 1663 N PRO A 111 -18.303 -3.762 3.580 1.00 62.13 N ATOM 1664 CA PRO A 111 -18.025 -2.427 4.030 1.00 61.34 C ATOM 1665 C PRO A 111 -17.278 -2.434 5.335 1.00 3.12 C ATOM 1666 O PRO A 111 -17.549 -3.267 6.232 1.00 41.25 O ATOM 1667 CB PRO A 111 -19.420 -1.818 4.204 1.00 64.21 C ATOM 1668 CG PRO A 111 -20.306 -2.971 4.547 1.00 0.13 C ATOM 1669 CD PRO A 111 -19.667 -4.207 3.964 1.00 23.54 C ATOM 0 HA PRO A 111 -17.395 -1.870 3.337 1.00 61.34 H new ATOM 0 HB2 PRO A 111 -19.427 -1.067 4.994 1.00 64.21 H new ATOM 0 HB3 PRO A 111 -19.751 -1.324 3.291 1.00 64.21 H new ATOM 0 HG2 PRO A 111 -20.414 -3.066 5.627 1.00 0.13 H new ATOM 0 HG3 PRO A 111 -21.306 -2.824 4.138 1.00 0.13 H new ATOM 0 HD2 PRO A 111 -19.632 -5.018 4.691 1.00 23.54 H new ATOM 0 HD3 PRO A 111 -20.224 -4.575 3.102 1.00 23.54 H new ATOM 1677 N LYS A 112 -16.333 -1.562 5.465 1.00 33.41 N ATOM 1678 CA LYS A 112 -15.683 -1.466 6.708 1.00 3.34 C ATOM 1679 C LYS A 112 -16.617 -0.686 7.627 1.00 24.24 C ATOM 1680 O LYS A 112 -17.220 0.283 7.201 1.00 54.13 O ATOM 1681 CB LYS A 112 -14.335 -0.768 6.654 1.00 31.41 C ATOM 1682 CG LYS A 112 -13.232 -1.310 5.791 1.00 13.51 C ATOM 1683 CD LYS A 112 -11.901 -0.693 6.303 1.00 65.33 C ATOM 1684 CE LYS A 112 -12.042 0.820 6.558 1.00 20.14 C ATOM 1685 NZ LYS A 112 -10.832 1.445 7.124 1.00 24.31 N ATOM 0 H LYS A 112 -16.007 -0.924 4.739 1.00 33.41 H new ATOM 0 HA LYS A 112 -15.474 -2.475 7.062 1.00 3.34 H new ATOM 0 HB2 LYS A 112 -14.517 0.259 6.337 1.00 31.41 H new ATOM 0 HB3 LYS A 112 -13.954 -0.724 7.674 1.00 31.41 H new ATOM 0 HG2 LYS A 112 -13.198 -2.398 5.848 1.00 13.51 H new ATOM 0 HG3 LYS A 112 -13.399 -1.051 4.746 1.00 13.51 H new ATOM 0 HD2 LYS A 112 -11.598 -1.192 7.224 1.00 65.33 H new ATOM 0 HD3 LYS A 112 -11.112 -0.868 5.571 1.00 65.33 H new ATOM 0 HE2 LYS A 112 -12.290 1.315 5.619 1.00 20.14 H new ATOM 0 HE3 LYS A 112 -12.878 0.988 7.237 1.00 20.14 H new ATOM 0 HZ1 LYS A 112 -11.001 2.461 7.268 1.00 24.31 H new ATOM 0 HZ2 LYS A 112 -10.605 0.999 8.036 1.00 24.31 H new ATOM 0 HZ3 LYS A 112 -10.035 1.316 6.468 1.00 24.31 H new ATOM 2166 N GLY B 21 -11.190 -6.613 9.765 1.00 20.21 N ATOM 2167 CA GLY B 21 -12.312 -7.441 9.424 1.00 3.42 C ATOM 2168 C GLY B 21 -12.051 -8.909 9.636 1.00 4.44 C ATOM 2169 O GLY B 21 -12.166 -9.399 10.749 1.00 35.41 O ATOM 0 HA2 GLY B 21 -13.172 -7.141 10.023 1.00 3.42 H new ATOM 0 HA3 GLY B 21 -12.576 -7.272 8.380 1.00 3.42 H new ATOM 2173 N PRO B 22 -11.753 -9.634 8.555 1.00 55.15 N ATOM 2174 CA PRO B 22 -11.439 -11.074 8.572 1.00 62.14 C ATOM 2175 C PRO B 22 -10.467 -11.556 9.748 1.00 71.32 C ATOM 2176 O PRO B 22 -10.828 -12.469 10.505 1.00 22.11 O ATOM 2177 CB PRO B 22 -10.861 -11.322 7.139 1.00 11.11 C ATOM 2178 CG PRO B 22 -10.702 -9.938 6.554 1.00 33.33 C ATOM 2179 CD PRO B 22 -11.746 -9.121 7.187 1.00 22.24 C ATOM 0 HA PRO B 22 -12.323 -11.672 8.794 1.00 62.14 H new ATOM 0 HB2 PRO B 22 -9.907 -11.848 7.181 1.00 11.11 H new ATOM 0 HB3 PRO B 22 -11.536 -11.932 6.538 1.00 11.11 H new ATOM 0 HG2 PRO B 22 -9.710 -9.536 6.761 1.00 33.33 H new ATOM 0 HG3 PRO B 22 -10.820 -9.954 5.470 1.00 33.33 H new ATOM 0 HD2 PRO B 22 -11.508 -8.058 7.152 1.00 22.24 H new ATOM 0 HD3 PRO B 22 -12.713 -9.247 6.700 1.00 22.24 H new ATOM 2187 N PRO B 23 -9.242 -10.980 9.914 1.00 3.41 N ATOM 2188 CA PRO B 23 -8.346 -11.350 10.995 1.00 53.31 C ATOM 2189 C PRO B 23 -8.555 -10.472 12.229 1.00 22.22 C ATOM 2190 O PRO B 23 -9.257 -9.485 12.172 1.00 52.04 O ATOM 2191 CB PRO B 23 -6.995 -11.077 10.383 1.00 72.23 C ATOM 2192 CG PRO B 23 -7.212 -9.845 9.610 1.00 70.11 C ATOM 2193 CD PRO B 23 -8.604 -9.960 9.060 1.00 2.43 C ATOM 0 HA PRO B 23 -8.490 -12.373 11.343 1.00 53.31 H new ATOM 0 HB2 PRO B 23 -6.228 -10.942 11.146 1.00 72.23 H new ATOM 0 HB3 PRO B 23 -6.669 -11.899 9.745 1.00 72.23 H new ATOM 0 HG2 PRO B 23 -7.111 -8.962 10.241 1.00 70.11 H new ATOM 0 HG3 PRO B 23 -6.479 -9.750 8.809 1.00 70.11 H new ATOM 0 HD2 PRO B 23 -9.133 -9.009 9.111 1.00 2.43 H new ATOM 0 HD3 PRO B 23 -8.596 -10.264 8.013 1.00 2.43 H new ATOM 2201 N GLN B 24 -7.987 -10.872 13.340 1.00 74.35 N ATOM 2202 CA GLN B 24 -8.052 -10.090 14.565 1.00 64.20 C ATOM 2203 C GLN B 24 -6.642 -9.817 15.099 1.00 13.52 C ATOM 2204 O GLN B 24 -5.715 -10.572 14.764 1.00 15.25 O ATOM 2205 CB GLN B 24 -8.948 -10.779 15.602 1.00 72.03 C ATOM 2206 CG GLN B 24 -10.432 -10.717 15.259 1.00 24.12 C ATOM 2207 CD GLN B 24 -10.967 -9.282 15.259 1.00 62.33 C ATOM 2208 OE1 GLN B 24 -11.426 -8.782 16.290 1.00 52.24 O ATOM 2209 NE2 GLN B 24 -10.912 -8.625 14.137 1.00 64.32 N ATOM 0 H GLN B 24 -7.467 -11.745 13.428 1.00 74.35 H new ATOM 0 HA GLN B 24 -8.507 -9.124 14.347 1.00 64.20 H new ATOM 0 HB2 GLN B 24 -8.648 -11.823 15.694 1.00 72.03 H new ATOM 0 HB3 GLN B 24 -8.788 -10.314 16.575 1.00 72.03 H new ATOM 0 HG2 GLN B 24 -10.595 -11.164 14.278 1.00 24.12 H new ATOM 0 HG3 GLN B 24 -10.994 -11.313 15.978 1.00 24.12 H new ATOM 0 HE21 GLN B 24 -10.526 -9.070 13.304 1.00 64.32 H new ATOM 0 HE22 GLN B 24 -11.255 -7.665 14.091 1.00 64.32 H new ATOM 2218 N PRO B 25 -6.471 -8.711 15.905 1.00 22.10 N ATOM 2219 CA PRO B 25 -5.186 -8.229 16.458 1.00 32.11 C ATOM 2220 C PRO B 25 -4.106 -9.276 16.685 1.00 45.43 C ATOM 2221 O PRO B 25 -4.256 -10.213 17.484 1.00 23.11 O ATOM 2222 CB PRO B 25 -5.616 -7.621 17.771 1.00 22.32 C ATOM 2223 CG PRO B 25 -6.919 -6.981 17.451 1.00 13.41 C ATOM 2224 CD PRO B 25 -7.555 -7.799 16.334 1.00 23.44 C ATOM 0 HA PRO B 25 -4.699 -7.558 15.750 1.00 32.11 H new ATOM 0 HB2 PRO B 25 -5.722 -8.378 18.548 1.00 22.32 H new ATOM 0 HB3 PRO B 25 -4.890 -6.893 18.132 1.00 22.32 H new ATOM 0 HG2 PRO B 25 -7.564 -6.960 18.329 1.00 13.41 H new ATOM 0 HG3 PRO B 25 -6.774 -5.947 17.137 1.00 13.41 H new ATOM 0 HD2 PRO B 25 -8.426 -8.351 16.688 1.00 23.44 H new ATOM 0 HD3 PRO B 25 -7.892 -7.164 15.515 1.00 23.44 H new ATOM 2232 N LEU B 26 -3.038 -9.118 15.944 1.00 2.21 N ATOM 2233 CA LEU B 26 -1.860 -9.951 16.069 1.00 42.21 C ATOM 2234 C LEU B 26 -0.991 -9.553 17.281 1.00 43.53 C ATOM 2235 O LEU B 26 -1.249 -8.532 17.939 1.00 12.04 O ATOM 2236 CB LEU B 26 -1.041 -10.069 14.722 1.00 33.24 C ATOM 2237 CG LEU B 26 -0.476 -8.786 14.011 1.00 21.10 C ATOM 2238 CD1 LEU B 26 -1.558 -7.803 13.593 1.00 10.21 C ATOM 2239 CD2 LEU B 26 0.583 -8.097 14.836 1.00 63.02 C ATOM 0 H LEU B 26 -2.958 -8.398 15.226 1.00 2.21 H new ATOM 0 HA LEU B 26 -2.216 -10.961 16.273 1.00 42.21 H new ATOM 0 HB2 LEU B 26 -0.194 -10.726 14.918 1.00 33.24 H new ATOM 0 HB3 LEU B 26 -1.680 -10.580 14.002 1.00 33.24 H new ATOM 0 HG LEU B 26 -0.009 -9.149 13.095 1.00 21.10 H new ATOM 0 HD11 LEU B 26 -1.099 -6.941 13.109 1.00 10.21 H new ATOM 0 HD12 LEU B 26 -2.242 -8.289 12.897 1.00 10.21 H new ATOM 0 HD13 LEU B 26 -2.110 -7.473 14.473 1.00 10.21 H new ATOM 0 HD21 LEU B 26 0.943 -7.217 14.304 1.00 63.02 H new ATOM 0 HD22 LEU B 26 0.159 -7.794 15.793 1.00 63.02 H new ATOM 0 HD23 LEU B 26 1.413 -8.782 15.008 1.00 63.02 H new ATOM 2251 N SER B 27 0.008 -10.359 17.561 1.00 73.03 N ATOM 2252 CA SER B 27 0.871 -10.201 18.725 1.00 53.12 C ATOM 2253 C SER B 27 1.791 -8.967 18.654 1.00 72.23 C ATOM 2254 O SER B 27 2.220 -8.549 17.573 1.00 24.24 O ATOM 2255 CB SER B 27 1.733 -11.432 18.844 1.00 40.14 C ATOM 2256 OG SER B 27 0.956 -12.613 18.863 1.00 12.32 O ATOM 0 H SER B 27 0.254 -11.160 16.979 1.00 73.03 H new ATOM 0 HA SER B 27 0.221 -10.061 19.588 1.00 53.12 H new ATOM 0 HB2 SER B 27 2.432 -11.469 18.008 1.00 40.14 H new ATOM 0 HB3 SER B 27 2.328 -11.373 19.755 1.00 40.14 H new ATOM 0 HG SER B 27 1.354 -13.276 18.261 1.00 12.32 H new ATOM 2262 N ALA B 28 2.066 -8.402 19.828 1.00 20.20 N ATOM 2263 CA ALA B 28 3.015 -7.293 19.986 1.00 72.35 C ATOM 2264 C ALA B 28 4.357 -7.653 19.378 1.00 1.43 C ATOM 2265 O ALA B 28 4.905 -6.880 18.616 1.00 63.23 O ATOM 2266 CB ALA B 28 3.202 -6.943 21.454 1.00 54.45 C ATOM 0 H ALA B 28 1.636 -8.700 20.704 1.00 20.20 H new ATOM 0 HA ALA B 28 2.604 -6.427 19.467 1.00 72.35 H new ATOM 0 HB1 ALA B 28 3.910 -6.119 21.544 1.00 54.45 H new ATOM 0 HB2 ALA B 28 2.244 -6.648 21.882 1.00 54.45 H new ATOM 0 HB3 ALA B 28 3.586 -7.811 21.989 1.00 54.45 H new ATOM 2272 N GLU B 29 4.857 -8.837 19.669 1.00 10.40 N ATOM 2273 CA GLU B 29 6.137 -9.275 19.131 1.00 72.11 C ATOM 2274 C GLU B 29 6.096 -9.527 17.643 1.00 11.20 C ATOM 2275 O GLU B 29 7.117 -9.397 16.961 1.00 3.22 O ATOM 2276 CB GLU B 29 6.752 -10.420 19.909 1.00 50.32 C ATOM 2277 CG GLU B 29 7.265 -10.008 21.278 1.00 62.31 C ATOM 2278 CD GLU B 29 8.390 -9.029 21.203 1.00 0.45 C ATOM 2279 OE1 GLU B 29 9.419 -9.322 20.601 1.00 20.33 O ATOM 2280 OE2 GLU B 29 8.245 -7.927 21.723 1.00 54.11 O ATOM 0 H GLU B 29 4.399 -9.517 20.276 1.00 10.40 H new ATOM 0 HA GLU B 29 6.815 -8.433 19.270 1.00 72.11 H new ATOM 0 HB2 GLU B 29 6.010 -11.209 20.029 1.00 50.32 H new ATOM 0 HB3 GLU B 29 7.575 -10.842 19.332 1.00 50.32 H new ATOM 0 HG2 GLU B 29 6.447 -9.572 21.851 1.00 62.31 H new ATOM 0 HG3 GLU B 29 7.596 -10.894 21.819 1.00 62.31 H new ATOM 2287 N GLU B 30 4.943 -9.916 17.123 1.00 22.41 N ATOM 2288 CA GLU B 30 4.779 -10.013 15.683 1.00 50.23 C ATOM 2289 C GLU B 30 4.977 -8.661 15.032 1.00 51.22 C ATOM 2290 O GLU B 30 5.589 -8.569 13.975 1.00 62.42 O ATOM 2291 CB GLU B 30 3.421 -10.614 15.290 1.00 1.24 C ATOM 2292 CG GLU B 30 3.393 -12.133 15.152 1.00 12.21 C ATOM 2293 CD GLU B 30 3.778 -12.892 16.395 1.00 32.25 C ATOM 2294 OE1 GLU B 30 4.949 -12.926 16.734 1.00 41.33 O ATOM 2295 OE2 GLU B 30 2.911 -13.510 17.013 1.00 64.11 O ATOM 0 H GLU B 30 4.118 -10.166 17.668 1.00 22.41 H new ATOM 0 HA GLU B 30 5.547 -10.695 15.317 1.00 50.23 H new ATOM 0 HB2 GLU B 30 2.683 -10.320 16.037 1.00 1.24 H new ATOM 0 HB3 GLU B 30 3.109 -10.174 14.343 1.00 1.24 H new ATOM 0 HG2 GLU B 30 2.389 -12.437 14.855 1.00 12.21 H new ATOM 0 HG3 GLU B 30 4.066 -12.422 14.345 1.00 12.21 H new ATOM 2302 N LYS B 31 4.498 -7.604 15.707 1.00 12.34 N ATOM 2303 CA LYS B 31 4.652 -6.234 15.221 1.00 11.15 C ATOM 2304 C LYS B 31 6.132 -5.926 15.179 1.00 61.30 C ATOM 2305 O LYS B 31 6.657 -5.481 14.177 1.00 73.42 O ATOM 2306 CB LYS B 31 3.987 -5.236 16.193 1.00 41.31 C ATOM 2307 CG LYS B 31 2.515 -5.480 16.466 1.00 3.11 C ATOM 2308 CD LYS B 31 2.001 -4.546 17.554 1.00 3.41 C ATOM 2309 CE LYS B 31 0.539 -4.829 17.894 1.00 63.01 C ATOM 2310 NZ LYS B 31 0.061 -3.991 19.024 1.00 53.43 N ATOM 0 H LYS B 31 4.000 -7.678 16.594 1.00 12.34 H new ATOM 0 HA LYS B 31 4.187 -6.143 14.239 1.00 11.15 H new ATOM 0 HB2 LYS B 31 4.525 -5.264 17.141 1.00 41.31 H new ATOM 0 HB3 LYS B 31 4.103 -4.230 15.790 1.00 41.31 H new ATOM 0 HG2 LYS B 31 1.942 -5.329 15.551 1.00 3.11 H new ATOM 0 HG3 LYS B 31 2.364 -6.516 16.770 1.00 3.11 H new ATOM 0 HD2 LYS B 31 2.612 -4.659 18.450 1.00 3.41 H new ATOM 0 HD3 LYS B 31 2.105 -3.512 17.226 1.00 3.41 H new ATOM 0 HE2 LYS B 31 -0.080 -4.643 17.017 1.00 63.01 H new ATOM 0 HE3 LYS B 31 0.423 -5.882 18.149 1.00 63.01 H new ATOM 0 HZ1 LYS B 31 -0.935 -4.213 19.224 1.00 53.43 H new ATOM 0 HZ2 LYS B 31 0.635 -4.187 19.869 1.00 53.43 H new ATOM 0 HZ3 LYS B 31 0.148 -2.986 18.772 1.00 53.43 H new ATOM 2324 N LYS B 32 6.795 -6.208 16.302 1.00 1.42 N ATOM 2325 CA LYS B 32 8.228 -5.989 16.494 1.00 34.13 C ATOM 2326 C LYS B 32 9.031 -6.631 15.362 1.00 3.30 C ATOM 2327 O LYS B 32 9.902 -6.002 14.796 1.00 54.13 O ATOM 2328 CB LYS B 32 8.644 -6.660 17.819 1.00 73.13 C ATOM 2329 CG LYS B 32 7.752 -6.325 19.026 1.00 14.41 C ATOM 2330 CD LYS B 32 7.898 -4.925 19.510 1.00 64.32 C ATOM 2331 CE LYS B 32 9.149 -4.803 20.325 1.00 51.40 C ATOM 2332 NZ LYS B 32 9.040 -5.492 21.621 1.00 34.02 N ATOM 0 H LYS B 32 6.338 -6.605 17.123 1.00 1.42 H new ATOM 0 HA LYS B 32 8.426 -4.917 16.507 1.00 34.13 H new ATOM 0 HB2 LYS B 32 8.646 -7.741 17.677 1.00 73.13 H new ATOM 0 HB3 LYS B 32 9.668 -6.367 18.051 1.00 73.13 H new ATOM 0 HG2 LYS B 32 6.711 -6.500 18.756 1.00 14.41 H new ATOM 0 HG3 LYS B 32 7.989 -7.008 19.842 1.00 14.41 H new ATOM 0 HD2 LYS B 32 7.935 -4.239 18.664 1.00 64.32 H new ATOM 0 HD3 LYS B 32 7.032 -4.645 20.110 1.00 64.32 H new ATOM 0 HE2 LYS B 32 9.987 -5.218 19.765 1.00 51.40 H new ATOM 0 HE3 LYS B 32 9.369 -3.749 20.494 1.00 51.40 H new ATOM 0 HZ1 LYS B 32 9.846 -5.228 22.223 1.00 34.02 H new ATOM 0 HZ2 LYS B 32 8.153 -5.214 22.088 1.00 34.02 H new ATOM 0 HZ3 LYS B 32 9.044 -6.521 21.469 1.00 34.02 H new ATOM 2346 N GLU B 33 8.707 -7.877 15.038 1.00 21.15 N ATOM 2347 CA GLU B 33 9.396 -8.615 13.977 1.00 23.44 C ATOM 2348 C GLU B 33 9.177 -8.048 12.590 1.00 74.40 C ATOM 2349 O GLU B 33 10.140 -7.855 11.836 1.00 35.10 O ATOM 2350 CB GLU B 33 9.006 -10.091 13.959 1.00 13.13 C ATOM 2351 CG GLU B 33 9.808 -11.002 14.836 1.00 22.31 C ATOM 2352 CD GLU B 33 11.287 -10.907 14.580 1.00 60.14 C ATOM 2353 OE1 GLU B 33 11.781 -11.553 13.645 1.00 40.51 O ATOM 2354 OE2 GLU B 33 11.969 -10.190 15.292 1.00 70.20 O ATOM 0 H GLU B 33 7.965 -8.405 15.498 1.00 21.15 H new ATOM 0 HA GLU B 33 10.452 -8.508 14.224 1.00 23.44 H new ATOM 0 HB2 GLU B 33 7.959 -10.171 14.250 1.00 13.13 H new ATOM 0 HB3 GLU B 33 9.080 -10.452 12.933 1.00 13.13 H new ATOM 0 HG2 GLU B 33 9.609 -10.761 15.880 1.00 22.31 H new ATOM 0 HG3 GLU B 33 9.482 -12.030 14.678 1.00 22.31 H new ATOM 2361 N ILE B 34 7.935 -7.811 12.242 1.00 34.41 N ATOM 2362 CA ILE B 34 7.607 -7.373 10.888 1.00 12.24 C ATOM 2363 C ILE B 34 8.072 -5.947 10.622 1.00 34.32 C ATOM 2364 O ILE B 34 8.578 -5.638 9.535 1.00 62.54 O ATOM 2365 CB ILE B 34 6.110 -7.570 10.536 1.00 22.42 C ATOM 2366 CG1 ILE B 34 5.208 -6.796 11.501 1.00 63.34 C ATOM 2367 CG2 ILE B 34 5.771 -9.063 10.568 1.00 14.33 C ATOM 2368 CD1 ILE B 34 3.732 -6.938 11.216 1.00 3.23 C ATOM 0 H ILE B 34 7.134 -7.910 12.865 1.00 34.41 H new ATOM 0 HA ILE B 34 8.165 -8.025 10.215 1.00 12.24 H new ATOM 0 HB ILE B 34 5.933 -7.179 9.534 1.00 22.42 H new ATOM 0 HG12 ILE B 34 5.405 -7.137 12.517 1.00 63.34 H new ATOM 0 HG13 ILE B 34 5.474 -5.740 11.462 1.00 63.34 H new ATOM 0 HG21 ILE B 34 4.719 -9.203 10.321 1.00 14.33 H new ATOM 0 HG22 ILE B 34 6.388 -9.592 9.841 1.00 14.33 H new ATOM 0 HG23 ILE B 34 5.965 -9.459 11.565 1.00 14.33 H new ATOM 0 HD11 ILE B 34 3.164 -6.360 11.944 1.00 3.23 H new ATOM 0 HD12 ILE B 34 3.518 -6.569 10.213 1.00 3.23 H new ATOM 0 HD13 ILE B 34 3.447 -7.988 11.285 1.00 3.23 H new ATOM 2380 N ASP B 35 7.981 -5.112 11.643 1.00 61.50 N ATOM 2381 CA ASP B 35 8.378 -3.708 11.565 1.00 55.15 C ATOM 2382 C ASP B 35 9.871 -3.565 11.278 1.00 62.41 C ATOM 2383 O ASP B 35 10.280 -2.707 10.515 1.00 64.01 O ATOM 2384 CB ASP B 35 7.984 -2.993 12.853 1.00 40.22 C ATOM 2385 CG ASP B 35 8.611 -1.641 13.001 1.00 24.10 C ATOM 2386 OD1 ASP B 35 8.103 -0.659 12.439 1.00 24.04 O ATOM 2387 OD2 ASP B 35 9.633 -1.560 13.732 1.00 32.03 O ATOM 0 H ASP B 35 7.627 -5.387 12.559 1.00 61.50 H new ATOM 0 HA ASP B 35 7.853 -3.241 10.732 1.00 55.15 H new ATOM 0 HB2 ASP B 35 6.900 -2.887 12.883 1.00 40.22 H new ATOM 0 HB3 ASP B 35 8.268 -3.612 13.704 1.00 40.22 H new ATOM 2392 N LYS B 36 10.678 -4.472 11.850 1.00 72.32 N ATOM 2393 CA LYS B 36 12.147 -4.493 11.622 1.00 52.42 C ATOM 2394 C LYS B 36 12.461 -4.605 10.141 1.00 74.13 C ATOM 2395 O LYS B 36 13.526 -4.197 9.677 1.00 60.34 O ATOM 2396 CB LYS B 36 12.792 -5.716 12.293 1.00 25.02 C ATOM 2397 CG LYS B 36 12.682 -5.787 13.782 1.00 2.43 C ATOM 2398 CD LYS B 36 13.267 -7.086 14.303 1.00 64.21 C ATOM 2399 CE LYS B 36 13.125 -7.185 15.805 1.00 53.44 C ATOM 2400 NZ LYS B 36 13.632 -8.467 16.330 1.00 31.44 N ATOM 0 H LYS B 36 10.345 -5.205 12.476 1.00 72.32 H new ATOM 0 HA LYS B 36 12.539 -3.566 12.040 1.00 52.42 H new ATOM 0 HB2 LYS B 36 12.341 -6.615 11.873 1.00 25.02 H new ATOM 0 HB3 LYS B 36 13.849 -5.735 12.026 1.00 25.02 H new ATOM 0 HG2 LYS B 36 13.204 -4.942 14.231 1.00 2.43 H new ATOM 0 HG3 LYS B 36 11.636 -5.709 14.078 1.00 2.43 H new ATOM 0 HD2 LYS B 36 12.764 -7.930 13.831 1.00 64.21 H new ATOM 0 HD3 LYS B 36 14.320 -7.149 14.030 1.00 64.21 H new ATOM 0 HE2 LYS B 36 13.666 -6.363 16.274 1.00 53.44 H new ATOM 0 HE3 LYS B 36 12.076 -7.073 16.077 1.00 53.44 H new ATOM 0 HZ1 LYS B 36 13.278 -8.610 17.297 1.00 31.44 H new ATOM 0 HZ2 LYS B 36 13.304 -9.245 15.723 1.00 31.44 H new ATOM 0 HZ3 LYS B 36 14.672 -8.451 16.341 1.00 31.44 H new ATOM 2414 N ARG B 37 11.536 -5.160 9.412 1.00 74.12 N ATOM 2415 CA ARG B 37 11.721 -5.481 8.039 1.00 73.04 C ATOM 2416 C ARG B 37 10.849 -4.621 7.133 1.00 31.52 C ATOM 2417 O ARG B 37 10.717 -4.923 5.948 1.00 13.01 O ATOM 2418 CB ARG B 37 11.353 -6.939 7.880 1.00 23.30 C ATOM 2419 CG ARG B 37 12.257 -7.886 8.654 1.00 23.34 C ATOM 2420 CD ARG B 37 11.637 -9.261 8.759 1.00 32.43 C ATOM 2421 NE ARG B 37 12.551 -10.248 9.340 1.00 53.34 N ATOM 2422 CZ ARG B 37 12.565 -10.644 10.605 1.00 44.24 C ATOM 2423 NH1 ARG B 37 11.808 -10.044 11.493 1.00 62.13 N ATOM 2424 NH2 ARG B 37 13.359 -11.637 10.986 1.00 21.11 N ATOM 0 H ARG B 37 10.613 -5.405 9.771 1.00 74.12 H new ATOM 0 HA ARG B 37 12.754 -5.291 7.749 1.00 73.04 H new ATOM 0 HB2 ARG B 37 10.324 -7.083 8.209 1.00 23.30 H new ATOM 0 HB3 ARG B 37 11.389 -7.200 6.822 1.00 23.30 H new ATOM 0 HG2 ARG B 37 13.225 -7.957 8.159 1.00 23.34 H new ATOM 0 HG3 ARG B 37 12.438 -7.487 9.652 1.00 23.34 H new ATOM 0 HD2 ARG B 37 10.735 -9.203 9.368 1.00 32.43 H new ATOM 0 HD3 ARG B 37 11.331 -9.594 7.767 1.00 32.43 H new ATOM 0 HE ARG B 37 13.239 -10.668 8.715 1.00 53.34 H new ATOM 0 HH11 ARG B 37 11.206 -9.270 11.211 1.00 62.13 H new ATOM 0 HH12 ARG B 37 11.821 -10.351 12.466 1.00 62.13 H new ATOM 0 HH21 ARG B 37 13.961 -12.098 10.304 1.00 21.11 H new ATOM 0 HH22 ARG B 37 13.367 -11.939 11.960 1.00 21.11 H new ATOM 2438 N SER B 38 10.288 -3.547 7.666 1.00 71.14 N ATOM 2439 CA SER B 38 9.419 -2.694 6.879 1.00 25.13 C ATOM 2440 C SER B 38 10.202 -1.533 6.266 1.00 30.54 C ATOM 2441 O SER B 38 11.141 -0.998 6.868 1.00 63.42 O ATOM 2442 CB SER B 38 8.293 -2.144 7.763 1.00 63.13 C ATOM 2443 OG SER B 38 7.552 -3.190 8.364 1.00 12.54 O ATOM 0 H SER B 38 10.419 -3.249 8.633 1.00 71.14 H new ATOM 0 HA SER B 38 8.995 -3.290 6.071 1.00 25.13 H new ATOM 0 HB2 SER B 38 8.716 -1.504 8.537 1.00 63.13 H new ATOM 0 HB3 SER B 38 7.628 -1.522 7.163 1.00 63.13 H new ATOM 0 HG SER B 38 8.167 -3.876 8.699 1.00 12.54 H new ATOM 2449 N VAL B 39 9.826 -1.172 5.058 1.00 23.02 N ATOM 2450 CA VAL B 39 10.481 -0.120 4.311 1.00 31.25 C ATOM 2451 C VAL B 39 9.422 0.845 3.795 1.00 35.14 C ATOM 2452 O VAL B 39 8.279 0.443 3.568 1.00 60.54 O ATOM 2453 CB VAL B 39 11.198 -0.710 3.055 1.00 2.43 C ATOM 2454 CG1 VAL B 39 12.118 0.295 2.369 1.00 4.23 C ATOM 2455 CG2 VAL B 39 11.906 -2.008 3.350 1.00 3.32 C ATOM 0 H VAL B 39 9.048 -1.606 4.561 1.00 23.02 H new ATOM 0 HA VAL B 39 11.201 0.372 4.965 1.00 31.25 H new ATOM 0 HB VAL B 39 10.404 -0.937 2.343 1.00 2.43 H new ATOM 0 HG11 VAL B 39 12.587 -0.173 1.504 1.00 4.23 H new ATOM 0 HG12 VAL B 39 11.536 1.158 2.044 1.00 4.23 H new ATOM 0 HG13 VAL B 39 12.888 0.619 3.068 1.00 4.23 H new ATOM 0 HG21 VAL B 39 12.387 -2.374 2.443 1.00 3.32 H new ATOM 0 HG22 VAL B 39 12.660 -1.844 4.120 1.00 3.32 H new ATOM 0 HG23 VAL B 39 11.183 -2.745 3.700 1.00 3.32 H new ATOM 2465 N TYR B 40 9.805 2.088 3.597 1.00 44.54 N ATOM 2466 CA TYR B 40 8.963 3.084 2.977 1.00 35.35 C ATOM 2467 C TYR B 40 9.479 3.294 1.587 1.00 13.10 C ATOM 2468 O TYR B 40 10.660 3.572 1.412 1.00 24.20 O ATOM 2469 CB TYR B 40 9.002 4.436 3.739 1.00 43.51 C ATOM 2470 CG TYR B 40 8.475 5.638 2.910 1.00 21.42 C ATOM 2471 CD1 TYR B 40 7.144 5.989 2.893 1.00 60.22 C ATOM 2472 CD2 TYR B 40 9.351 6.404 2.138 1.00 25.12 C ATOM 2473 CE1 TYR B 40 6.699 7.067 2.134 1.00 54.14 C ATOM 2474 CE2 TYR B 40 8.929 7.464 1.388 1.00 73.23 C ATOM 2475 CZ TYR B 40 7.605 7.798 1.382 1.00 14.54 C ATOM 2476 OH TYR B 40 7.175 8.865 0.618 1.00 21.43 O ATOM 0 H TYR B 40 10.724 2.439 3.867 1.00 44.54 H new ATOM 0 HA TYR B 40 7.930 2.736 2.986 1.00 35.35 H new ATOM 0 HB2 TYR B 40 8.409 4.347 4.649 1.00 43.51 H new ATOM 0 HB3 TYR B 40 10.028 4.640 4.046 1.00 43.51 H new ATOM 0 HD1 TYR B 40 6.436 5.420 3.477 1.00 60.22 H new ATOM 0 HD2 TYR B 40 10.400 6.149 2.134 1.00 25.12 H new ATOM 0 HE1 TYR B 40 5.652 7.333 2.131 1.00 54.14 H new ATOM 0 HE2 TYR B 40 9.637 8.034 0.804 1.00 73.23 H new ATOM 0 HH TYR B 40 7.941 9.266 0.156 1.00 21.43 H new ATOM 2486 N VAL B 41 8.636 3.111 0.627 1.00 44.34 N ATOM 2487 CA VAL B 41 8.941 3.362 -0.755 1.00 14.54 C ATOM 2488 C VAL B 41 8.020 4.476 -1.228 1.00 53.45 C ATOM 2489 O VAL B 41 6.825 4.283 -1.305 1.00 70.13 O ATOM 2490 CB VAL B 41 8.632 2.102 -1.583 1.00 51.51 C ATOM 2491 CG1 VAL B 41 8.994 2.282 -3.051 1.00 34.13 C ATOM 2492 CG2 VAL B 41 9.312 0.884 -0.988 1.00 71.32 C ATOM 0 H VAL B 41 7.686 2.773 0.779 1.00 44.34 H new ATOM 0 HA VAL B 41 9.991 3.631 -0.871 1.00 14.54 H new ATOM 0 HB VAL B 41 7.555 1.940 -1.542 1.00 51.51 H new ATOM 0 HG11 VAL B 41 8.760 1.369 -3.598 1.00 34.13 H new ATOM 0 HG12 VAL B 41 8.423 3.112 -3.468 1.00 34.13 H new ATOM 0 HG13 VAL B 41 10.059 2.495 -3.140 1.00 34.13 H new ATOM 0 HG21 VAL B 41 9.079 0.006 -1.591 1.00 71.32 H new ATOM 0 HG22 VAL B 41 10.391 1.039 -0.976 1.00 71.32 H new ATOM 0 HG23 VAL B 41 8.956 0.730 0.031 1.00 71.32 H new ATOM 2502 N GLY B 42 8.544 5.622 -1.509 1.00 41.41 N ATOM 2503 CA GLY B 42 7.688 6.719 -1.894 1.00 10.13 C ATOM 2504 C GLY B 42 7.855 7.157 -3.324 1.00 34.41 C ATOM 2505 O GLY B 42 8.795 6.751 -3.988 1.00 74.32 O ATOM 0 H GLY B 42 9.542 5.832 -1.484 1.00 41.41 H new ATOM 0 HA2 GLY B 42 6.650 6.429 -1.733 1.00 10.13 H new ATOM 0 HA3 GLY B 42 7.887 7.568 -1.240 1.00 10.13 H new ATOM 2509 N ASN B 43 6.927 8.022 -3.766 1.00 60.54 N ATOM 2510 CA ASN B 43 6.873 8.633 -5.126 1.00 73.23 C ATOM 2511 C ASN B 43 6.676 7.587 -6.263 1.00 23.55 C ATOM 2512 O ASN B 43 6.880 7.878 -7.455 1.00 42.24 O ATOM 2513 CB ASN B 43 8.115 9.533 -5.364 1.00 34.43 C ATOM 2514 CG ASN B 43 8.027 10.394 -6.624 1.00 62.31 C ATOM 2515 OD1 ASN B 43 6.938 10.777 -7.063 1.00 23.44 O ATOM 2516 ND2 ASN B 43 9.156 10.721 -7.193 1.00 30.02 N ATOM 0 H ASN B 43 6.159 8.334 -3.171 1.00 60.54 H new ATOM 0 HA ASN B 43 5.983 9.261 -5.161 1.00 73.23 H new ATOM 0 HB2 ASN B 43 8.250 10.184 -4.500 1.00 34.43 H new ATOM 0 HB3 ASN B 43 9.001 8.902 -5.429 1.00 34.43 H new ATOM 0 HD21 ASN B 43 9.156 11.310 -8.026 1.00 30.02 H new ATOM 0 HD22 ASN B 43 10.038 10.388 -6.805 1.00 30.02 H new ATOM 2523 N VAL B 44 6.235 6.398 -5.891 1.00 71.40 N ATOM 2524 CA VAL B 44 5.939 5.339 -6.862 1.00 31.25 C ATOM 2525 C VAL B 44 4.814 5.790 -7.801 1.00 23.11 C ATOM 2526 O VAL B 44 3.793 6.338 -7.364 1.00 24.42 O ATOM 2527 CB VAL B 44 5.625 3.966 -6.160 1.00 52.43 C ATOM 2528 CG1 VAL B 44 4.404 4.033 -5.273 1.00 70.40 C ATOM 2529 CG2 VAL B 44 5.484 2.853 -7.165 1.00 62.05 C ATOM 0 H VAL B 44 6.071 6.133 -4.920 1.00 71.40 H new ATOM 0 HA VAL B 44 6.830 5.164 -7.465 1.00 31.25 H new ATOM 0 HB VAL B 44 6.480 3.749 -5.519 1.00 52.43 H new ATOM 0 HG11 VAL B 44 4.234 3.059 -4.814 1.00 70.40 H new ATOM 0 HG12 VAL B 44 4.561 4.779 -4.494 1.00 70.40 H new ATOM 0 HG13 VAL B 44 3.535 4.310 -5.870 1.00 70.40 H new ATOM 0 HG21 VAL B 44 5.267 1.919 -6.646 1.00 62.05 H new ATOM 0 HG22 VAL B 44 4.669 3.084 -7.852 1.00 62.05 H new ATOM 0 HG23 VAL B 44 6.413 2.749 -7.726 1.00 62.05 H new ATOM 2539 N ASP B 45 5.041 5.609 -9.088 1.00 61.31 N ATOM 2540 CA ASP B 45 4.112 6.058 -10.116 1.00 22.22 C ATOM 2541 C ASP B 45 2.922 5.117 -10.154 1.00 34.02 C ATOM 2542 O ASP B 45 3.041 3.964 -9.749 1.00 43.34 O ATOM 2543 CB ASP B 45 4.826 6.104 -11.489 1.00 65.10 C ATOM 2544 CG ASP B 45 3.960 6.642 -12.621 1.00 13.42 C ATOM 2545 OD1 ASP B 45 3.219 5.869 -13.231 1.00 13.41 O ATOM 2546 OD2 ASP B 45 4.026 7.856 -12.918 1.00 70.05 O ATOM 0 H ASP B 45 5.874 5.147 -9.454 1.00 61.31 H new ATOM 0 HA ASP B 45 3.760 7.063 -9.885 1.00 22.22 H new ATOM 0 HB2 ASP B 45 5.718 6.724 -11.402 1.00 65.10 H new ATOM 0 HB3 ASP B 45 5.160 5.099 -11.747 1.00 65.10 H new ATOM 2551 N TYR B 46 1.796 5.593 -10.653 1.00 1.13 N ATOM 2552 CA TYR B 46 0.572 4.796 -10.667 1.00 41.00 C ATOM 2553 C TYR B 46 0.721 3.621 -11.666 1.00 20.22 C ATOM 2554 O TYR B 46 -0.019 2.633 -11.624 1.00 72.13 O ATOM 2555 CB TYR B 46 -0.633 5.669 -11.040 1.00 23.31 C ATOM 2556 CG TYR B 46 -1.946 5.147 -10.491 1.00 52.44 C ATOM 2557 CD1 TYR B 46 -2.611 4.071 -11.063 1.00 24.22 C ATOM 2558 CD2 TYR B 46 -2.504 5.738 -9.377 1.00 45.54 C ATOM 2559 CE1 TYR B 46 -3.795 3.603 -10.527 1.00 15.23 C ATOM 2560 CE2 TYR B 46 -3.685 5.288 -8.838 1.00 1.54 C ATOM 2561 CZ TYR B 46 -4.327 4.215 -9.414 1.00 3.23 C ATOM 2562 OH TYR B 46 -5.500 3.745 -8.876 1.00 62.20 O ATOM 0 H TYR B 46 1.698 6.526 -11.055 1.00 1.13 H new ATOM 0 HA TYR B 46 0.403 4.391 -9.669 1.00 41.00 H new ATOM 0 HB2 TYR B 46 -0.469 6.680 -10.669 1.00 23.31 H new ATOM 0 HB3 TYR B 46 -0.702 5.735 -12.126 1.00 23.31 H new ATOM 0 HD1 TYR B 46 -2.197 3.593 -11.939 1.00 24.22 H new ATOM 0 HD2 TYR B 46 -2.000 6.575 -8.917 1.00 45.54 H new ATOM 0 HE1 TYR B 46 -4.301 2.762 -10.978 1.00 15.23 H new ATOM 0 HE2 TYR B 46 -4.106 5.772 -7.969 1.00 1.54 H new ATOM 0 HH TYR B 46 -5.741 4.285 -8.094 1.00 62.20 H new ATOM 2572 N GLY B 47 1.691 3.750 -12.560 1.00 22.24 N ATOM 2573 CA GLY B 47 1.966 2.723 -13.518 1.00 21.04 C ATOM 2574 C GLY B 47 2.827 1.628 -12.935 1.00 32.12 C ATOM 2575 O GLY B 47 2.969 0.553 -13.538 1.00 11.32 O ATOM 0 H GLY B 47 2.297 4.567 -12.631 1.00 22.24 H new ATOM 0 HA2 GLY B 47 1.028 2.297 -13.874 1.00 21.04 H new ATOM 0 HA3 GLY B 47 2.467 3.158 -14.383 1.00 21.04 H new ATOM 2579 N SER B 48 3.407 1.878 -11.770 1.00 42.24 N ATOM 2580 CA SER B 48 4.201 0.898 -11.128 1.00 70.55 C ATOM 2581 C SER B 48 3.288 0.021 -10.271 1.00 0.34 C ATOM 2582 O SER B 48 2.433 0.513 -9.540 1.00 64.31 O ATOM 2583 CB SER B 48 5.272 1.581 -10.312 1.00 23.21 C ATOM 2584 OG SER B 48 6.034 2.460 -11.140 1.00 71.44 O ATOM 0 H SER B 48 3.329 2.761 -11.266 1.00 42.24 H new ATOM 0 HA SER B 48 4.704 0.258 -11.853 1.00 70.55 H new ATOM 0 HB2 SER B 48 4.816 2.142 -9.496 1.00 23.21 H new ATOM 0 HB3 SER B 48 5.927 0.836 -9.860 1.00 23.21 H new ATOM 0 HG SER B 48 6.458 1.947 -11.859 1.00 71.44 H new ATOM 2590 N THR B 49 3.460 -1.260 -10.378 1.00 72.24 N ATOM 2591 CA THR B 49 2.575 -2.191 -9.745 1.00 14.52 C ATOM 2592 C THR B 49 3.265 -2.941 -8.623 1.00 74.11 C ATOM 2593 O THR B 49 4.453 -2.741 -8.390 1.00 31.10 O ATOM 2594 CB THR B 49 2.072 -3.202 -10.755 1.00 25.33 C ATOM 2595 OG1 THR B 49 3.181 -3.972 -11.292 1.00 63.41 O ATOM 2596 CG2 THR B 49 1.303 -2.523 -11.881 1.00 44.15 C ATOM 0 H THR B 49 4.218 -1.691 -10.907 1.00 72.24 H new ATOM 0 HA THR B 49 1.745 -1.618 -9.332 1.00 14.52 H new ATOM 0 HB THR B 49 1.388 -3.878 -10.242 1.00 25.33 H new ATOM 0 HG1 THR B 49 3.577 -3.491 -12.049 1.00 63.41 H new ATOM 0 HG21 THR B 49 0.955 -3.275 -12.589 1.00 44.15 H new ATOM 0 HG22 THR B 49 0.447 -1.991 -11.467 1.00 44.15 H new ATOM 0 HG23 THR B 49 1.956 -1.817 -12.393 1.00 44.15 H new ATOM 2604 N ALA B 50 2.527 -3.832 -7.933 1.00 63.43 N ATOM 2605 CA ALA B 50 3.102 -4.631 -6.878 1.00 70.01 C ATOM 2606 C ALA B 50 4.183 -5.542 -7.446 1.00 22.32 C ATOM 2607 O ALA B 50 5.254 -5.610 -6.910 1.00 53.43 O ATOM 2608 CB ALA B 50 2.014 -5.445 -6.169 1.00 71.03 C ATOM 0 H ALA B 50 1.535 -4.003 -8.100 1.00 63.43 H new ATOM 0 HA ALA B 50 3.560 -3.970 -6.142 1.00 70.01 H new ATOM 0 HB1 ALA B 50 2.465 -6.042 -5.376 1.00 71.03 H new ATOM 0 HB2 ALA B 50 1.276 -4.768 -5.739 1.00 71.03 H new ATOM 0 HB3 ALA B 50 1.527 -6.104 -6.887 1.00 71.03 H new ATOM 2614 N GLN B 51 3.870 -6.239 -8.547 1.00 23.53 N ATOM 2615 CA GLN B 51 4.860 -7.099 -9.228 1.00 11.42 C ATOM 2616 C GLN B 51 6.089 -6.304 -9.690 1.00 50.24 C ATOM 2617 O GLN B 51 7.218 -6.791 -9.595 1.00 42.05 O ATOM 2618 CB GLN B 51 4.232 -7.848 -10.396 1.00 5.24 C ATOM 2619 CG GLN B 51 3.094 -8.766 -9.988 1.00 22.52 C ATOM 2620 CD GLN B 51 2.548 -9.563 -11.149 1.00 2.24 C ATOM 2621 OE1 GLN B 51 3.014 -10.661 -11.433 1.00 11.20 O ATOM 2622 NE2 GLN B 51 1.567 -9.028 -11.820 1.00 75.32 N ATOM 0 H GLN B 51 2.949 -6.228 -8.985 1.00 23.53 H new ATOM 0 HA GLN B 51 5.199 -7.832 -8.496 1.00 11.42 H new ATOM 0 HB2 GLN B 51 3.862 -7.125 -11.123 1.00 5.24 H new ATOM 0 HB3 GLN B 51 5.002 -8.437 -10.895 1.00 5.24 H new ATOM 0 HG2 GLN B 51 3.443 -9.450 -9.214 1.00 22.52 H new ATOM 0 HG3 GLN B 51 2.292 -8.172 -9.550 1.00 22.52 H new ATOM 0 HE21 GLN B 51 1.206 -8.112 -11.553 1.00 75.32 H new ATOM 0 HE22 GLN B 51 1.160 -9.525 -12.612 1.00 75.32 H new ATOM 2631 N ASP B 52 5.855 -5.078 -10.195 1.00 53.20 N ATOM 2632 CA ASP B 52 6.964 -4.148 -10.552 1.00 23.03 C ATOM 2633 C ASP B 52 7.850 -3.930 -9.356 1.00 65.34 C ATOM 2634 O ASP B 52 9.080 -3.994 -9.437 1.00 53.22 O ATOM 2635 CB ASP B 52 6.429 -2.773 -10.992 1.00 4.04 C ATOM 2636 CG ASP B 52 6.126 -2.634 -12.455 1.00 74.04 C ATOM 2637 OD1 ASP B 52 5.063 -3.094 -12.901 1.00 62.33 O ATOM 2638 OD2 ASP B 52 6.921 -2.009 -13.167 1.00 12.15 O ATOM 0 H ASP B 52 4.922 -4.704 -10.367 1.00 53.20 H new ATOM 0 HA ASP B 52 7.516 -4.603 -11.375 1.00 23.03 H new ATOM 0 HB2 ASP B 52 5.520 -2.559 -10.429 1.00 4.04 H new ATOM 0 HB3 ASP B 52 7.161 -2.013 -10.717 1.00 4.04 H new ATOM 2643 N LEU B 53 7.207 -3.685 -8.247 1.00 54.55 N ATOM 2644 CA LEU B 53 7.872 -3.448 -7.006 1.00 64.20 C ATOM 2645 C LEU B 53 8.562 -4.691 -6.481 1.00 52.44 C ATOM 2646 O LEU B 53 9.714 -4.600 -6.035 1.00 31.31 O ATOM 2647 CB LEU B 53 6.899 -2.853 -5.989 1.00 24.31 C ATOM 2648 CG LEU B 53 6.400 -1.448 -6.314 1.00 2.13 C ATOM 2649 CD1 LEU B 53 5.312 -1.039 -5.341 1.00 64.14 C ATOM 2650 CD2 LEU B 53 7.568 -0.450 -6.277 1.00 72.30 C ATOM 0 H LEU B 53 6.190 -3.645 -8.185 1.00 54.55 H new ATOM 0 HA LEU B 53 8.663 -2.719 -7.180 1.00 64.20 H new ATOM 0 HB2 LEU B 53 6.038 -3.516 -5.902 1.00 24.31 H new ATOM 0 HB3 LEU B 53 7.385 -2.832 -5.014 1.00 24.31 H new ATOM 0 HG LEU B 53 5.978 -1.446 -7.319 1.00 2.13 H new ATOM 0 HD11 LEU B 53 4.965 -0.035 -5.584 1.00 64.14 H new ATOM 0 HD12 LEU B 53 4.479 -1.738 -5.412 1.00 64.14 H new ATOM 0 HD13 LEU B 53 5.709 -1.050 -4.326 1.00 64.14 H new ATOM 0 HD21 LEU B 53 7.200 0.549 -6.510 1.00 72.30 H new ATOM 0 HD22 LEU B 53 8.015 -0.449 -5.283 1.00 72.30 H new ATOM 0 HD23 LEU B 53 8.319 -0.741 -7.012 1.00 72.30 H new ATOM 2662 N GLU B 54 7.890 -5.864 -6.538 1.00 62.03 N ATOM 2663 CA GLU B 54 8.504 -7.095 -6.061 1.00 30.13 C ATOM 2664 C GLU B 54 9.775 -7.372 -6.781 1.00 75.03 C ATOM 2665 O GLU B 54 10.758 -7.589 -6.160 1.00 70.35 O ATOM 2666 CB GLU B 54 7.634 -8.320 -6.321 1.00 51.30 C ATOM 2667 CG GLU B 54 6.264 -8.362 -5.721 1.00 73.24 C ATOM 2668 CD GLU B 54 5.593 -9.664 -6.096 1.00 74.42 C ATOM 2669 OE1 GLU B 54 5.111 -9.789 -7.240 1.00 25.12 O ATOM 2670 OE2 GLU B 54 5.572 -10.600 -5.273 1.00 32.51 O ATOM 0 H GLU B 54 6.944 -5.970 -6.904 1.00 62.03 H new ATOM 0 HA GLU B 54 8.653 -6.938 -4.993 1.00 30.13 H new ATOM 0 HB2 GLU B 54 7.527 -8.428 -7.400 1.00 51.30 H new ATOM 0 HB3 GLU B 54 8.179 -9.195 -5.966 1.00 51.30 H new ATOM 0 HG2 GLU B 54 6.327 -8.271 -4.637 1.00 73.24 H new ATOM 0 HG3 GLU B 54 5.672 -7.519 -6.078 1.00 73.24 H new ATOM 2677 N ALA B 55 9.741 -7.323 -8.099 1.00 22.43 N ATOM 2678 CA ALA B 55 10.920 -7.619 -8.899 1.00 42.43 C ATOM 2679 C ALA B 55 12.095 -6.726 -8.520 1.00 61.11 C ATOM 2680 O ALA B 55 13.207 -7.213 -8.224 1.00 33.02 O ATOM 2681 CB ALA B 55 10.598 -7.491 -10.378 1.00 62.22 C ATOM 0 H ALA B 55 8.911 -7.081 -8.641 1.00 22.43 H new ATOM 0 HA ALA B 55 11.216 -8.648 -8.693 1.00 42.43 H new ATOM 0 HB1 ALA B 55 11.489 -7.715 -10.965 1.00 62.22 H new ATOM 0 HB2 ALA B 55 9.805 -8.192 -10.640 1.00 62.22 H new ATOM 0 HB3 ALA B 55 10.269 -6.474 -10.592 1.00 62.22 H new ATOM 2687 N HIS B 56 11.826 -5.448 -8.433 1.00 31.23 N ATOM 2688 CA HIS B 56 12.861 -4.477 -8.167 1.00 13.42 C ATOM 2689 C HIS B 56 13.420 -4.648 -6.745 1.00 55.44 C ATOM 2690 O HIS B 56 14.612 -4.484 -6.523 1.00 72.11 O ATOM 2691 CB HIS B 56 12.342 -3.055 -8.398 1.00 62.30 C ATOM 2692 CG HIS B 56 13.410 -1.999 -8.385 1.00 3.43 C ATOM 2693 ND1 HIS B 56 14.053 -1.577 -9.522 1.00 10.14 N ATOM 2694 CD2 HIS B 56 13.931 -1.272 -7.376 1.00 21.14 C ATOM 2695 CE1 HIS B 56 14.918 -0.645 -9.218 1.00 61.23 C ATOM 2696 NE2 HIS B 56 14.870 -0.435 -7.919 1.00 31.24 N ATOM 0 H HIS B 56 10.892 -5.052 -8.543 1.00 31.23 H new ATOM 0 HA HIS B 56 13.680 -4.649 -8.865 1.00 13.42 H new ATOM 0 HB2 HIS B 56 11.825 -3.021 -9.357 1.00 62.30 H new ATOM 0 HB3 HIS B 56 11.605 -2.820 -7.630 1.00 62.30 H new ATOM 0 HD2 HIS B 56 13.659 -1.337 -6.333 1.00 21.14 H new ATOM 0 HE1 HIS B 56 15.564 -0.133 -9.916 1.00 61.23 H new ATOM 0 HE2 HIS B 56 15.437 0.238 -7.403 1.00 31.24 H new ATOM 2705 N PHE B 57 12.555 -4.967 -5.794 1.00 53.34 N ATOM 2706 CA PHE B 57 12.973 -5.197 -4.418 1.00 11.12 C ATOM 2707 C PHE B 57 13.503 -6.596 -4.169 1.00 62.13 C ATOM 2708 O PHE B 57 14.268 -6.819 -3.241 1.00 75.03 O ATOM 2709 CB PHE B 57 11.898 -4.821 -3.429 1.00 3.15 C ATOM 2710 CG PHE B 57 11.799 -3.352 -3.223 1.00 31.24 C ATOM 2711 CD1 PHE B 57 12.639 -2.737 -2.336 1.00 15.45 C ATOM 2712 CD2 PHE B 57 10.887 -2.592 -3.904 1.00 30.41 C ATOM 2713 CE1 PHE B 57 12.568 -1.387 -2.125 1.00 41.34 C ATOM 2714 CE2 PHE B 57 10.803 -1.245 -3.699 1.00 42.34 C ATOM 2715 CZ PHE B 57 11.643 -0.648 -2.810 1.00 60.01 C ATOM 0 H PHE B 57 11.553 -5.073 -5.951 1.00 53.34 H new ATOM 0 HA PHE B 57 13.818 -4.528 -4.256 1.00 11.12 H new ATOM 0 HB2 PHE B 57 10.938 -5.200 -3.780 1.00 3.15 H new ATOM 0 HB3 PHE B 57 12.103 -5.305 -2.474 1.00 3.15 H new ATOM 0 HD1 PHE B 57 13.367 -3.324 -1.796 1.00 15.45 H new ATOM 0 HD2 PHE B 57 10.224 -3.065 -4.614 1.00 30.41 H new ATOM 0 HE1 PHE B 57 13.236 -0.909 -1.424 1.00 41.34 H new ATOM 0 HE2 PHE B 57 10.075 -0.657 -4.238 1.00 42.34 H new ATOM 0 HZ PHE B 57 11.579 0.417 -2.644 1.00 60.01 H new ATOM 2725 N SER B 58 13.105 -7.516 -5.013 1.00 3.41 N ATOM 2726 CA SER B 58 13.467 -8.923 -4.894 1.00 10.25 C ATOM 2727 C SER B 58 14.938 -9.069 -5.147 1.00 2.32 C ATOM 2728 O SER B 58 15.586 -9.985 -4.631 1.00 21.55 O ATOM 2729 CB SER B 58 12.652 -9.792 -5.881 1.00 23.53 C ATOM 2730 OG SER B 58 12.952 -11.177 -5.764 1.00 14.30 O ATOM 0 H SER B 58 12.511 -7.314 -5.817 1.00 3.41 H new ATOM 0 HA SER B 58 13.234 -9.270 -3.887 1.00 10.25 H new ATOM 0 HB2 SER B 58 11.588 -9.638 -5.702 1.00 23.53 H new ATOM 0 HB3 SER B 58 12.855 -9.465 -6.901 1.00 23.53 H new ATOM 0 HG SER B 58 12.412 -11.684 -6.406 1.00 14.30 H new ATOM 2736 N SER B 59 15.479 -8.159 -5.940 1.00 73.01 N ATOM 2737 CA SER B 59 16.886 -8.113 -6.179 1.00 74.02 C ATOM 2738 C SER B 59 17.662 -7.894 -4.849 1.00 32.02 C ATOM 2739 O SER B 59 18.832 -8.279 -4.727 1.00 53.32 O ATOM 2740 CB SER B 59 17.167 -6.993 -7.172 1.00 32.24 C ATOM 2741 OG SER B 59 16.385 -7.174 -8.352 1.00 72.00 O ATOM 0 H SER B 59 14.945 -7.440 -6.428 1.00 73.01 H new ATOM 0 HA SER B 59 17.225 -9.061 -6.595 1.00 74.02 H new ATOM 0 HB2 SER B 59 16.937 -6.029 -6.719 1.00 32.24 H new ATOM 0 HB3 SER B 59 18.227 -6.981 -7.427 1.00 32.24 H new ATOM 0 HG SER B 59 16.572 -6.448 -8.983 1.00 72.00 H new ATOM 2747 N CYS B 60 16.998 -7.283 -3.866 1.00 41.01 N ATOM 2748 CA CYS B 60 17.592 -7.021 -2.566 1.00 52.40 C ATOM 2749 C CYS B 60 17.130 -8.014 -1.478 1.00 2.45 C ATOM 2750 O CYS B 60 17.546 -7.897 -0.324 1.00 40.13 O ATOM 2751 CB CYS B 60 17.284 -5.587 -2.134 1.00 13.02 C ATOM 2752 SG CYS B 60 17.887 -4.324 -3.279 1.00 3.31 S ATOM 0 H CYS B 60 16.035 -6.959 -3.955 1.00 41.01 H new ATOM 0 HA CYS B 60 18.668 -7.156 -2.676 1.00 52.40 H new ATOM 0 HB2 CYS B 60 16.205 -5.476 -2.023 1.00 13.02 H new ATOM 0 HB3 CYS B 60 17.725 -5.412 -1.153 1.00 13.02 H new ATOM 0 HG CYS B 60 18.552 -3.422 -2.620 1.00 3.31 H new ATOM 2758 N GLY B 61 16.321 -9.002 -1.837 1.00 44.44 N ATOM 2759 CA GLY B 61 15.856 -9.943 -0.821 1.00 72.31 C ATOM 2760 C GLY B 61 14.483 -10.537 -1.078 1.00 45.11 C ATOM 2761 O GLY B 61 13.938 -10.411 -2.174 1.00 12.35 O ATOM 0 H GLY B 61 15.983 -9.172 -2.784 1.00 44.44 H new ATOM 0 HA2 GLY B 61 16.578 -10.756 -0.742 1.00 72.31 H new ATOM 0 HA3 GLY B 61 15.841 -9.435 0.143 1.00 72.31 H new ATOM 2765 N SER B 62 13.926 -11.190 -0.060 1.00 11.33 N ATOM 2766 CA SER B 62 12.651 -11.864 -0.181 1.00 10.32 C ATOM 2767 C SER B 62 11.538 -11.060 0.546 1.00 4.43 C ATOM 2768 O SER B 62 11.680 -10.700 1.716 1.00 40.45 O ATOM 2769 CB SER B 62 12.789 -13.278 0.407 1.00 31.53 C ATOM 2770 OG SER B 62 11.649 -14.074 0.150 1.00 22.41 O ATOM 0 H SER B 62 14.350 -11.262 0.865 1.00 11.33 H new ATOM 0 HA SER B 62 12.365 -11.935 -1.230 1.00 10.32 H new ATOM 0 HB2 SER B 62 13.671 -13.761 -0.015 1.00 31.53 H new ATOM 0 HB3 SER B 62 12.947 -13.209 1.483 1.00 31.53 H new ATOM 0 HG SER B 62 11.778 -14.965 0.538 1.00 22.41 H new ATOM 2776 N ILE B 63 10.450 -10.789 -0.167 1.00 63.44 N ATOM 2777 CA ILE B 63 9.327 -9.988 0.336 1.00 72.42 C ATOM 2778 C ILE B 63 8.274 -10.817 1.105 1.00 12.24 C ATOM 2779 O ILE B 63 7.852 -11.887 0.655 1.00 44.24 O ATOM 2780 CB ILE B 63 8.640 -9.252 -0.850 1.00 42.31 C ATOM 2781 CG1 ILE B 63 9.632 -8.296 -1.518 1.00 51.00 C ATOM 2782 CG2 ILE B 63 7.377 -8.514 -0.410 1.00 42.34 C ATOM 2783 CD1 ILE B 63 9.077 -7.568 -2.712 1.00 74.10 C ATOM 0 H ILE B 63 10.316 -11.121 -1.122 1.00 63.44 H new ATOM 0 HA ILE B 63 9.746 -9.275 1.046 1.00 72.42 H new ATOM 0 HB ILE B 63 8.329 -10.003 -1.577 1.00 42.31 H new ATOM 0 HG12 ILE B 63 9.965 -7.564 -0.783 1.00 51.00 H new ATOM 0 HG13 ILE B 63 10.512 -8.861 -1.827 1.00 51.00 H new ATOM 0 HG21 ILE B 63 6.930 -8.014 -1.269 1.00 42.34 H new ATOM 0 HG22 ILE B 63 6.665 -9.227 0.006 1.00 42.34 H new ATOM 0 HG23 ILE B 63 7.634 -7.773 0.347 1.00 42.34 H new ATOM 0 HD11 ILE B 63 9.842 -6.912 -3.126 1.00 74.10 H new ATOM 0 HD12 ILE B 63 8.770 -8.290 -3.468 1.00 74.10 H new ATOM 0 HD13 ILE B 63 8.216 -6.974 -2.408 1.00 74.10 H new ATOM 2795 N ASN B 64 7.866 -10.304 2.267 1.00 45.23 N ATOM 2796 CA ASN B 64 6.791 -10.894 3.060 1.00 21.41 C ATOM 2797 C ASN B 64 5.522 -10.117 2.937 1.00 22.35 C ATOM 2798 O ASN B 64 4.494 -10.678 2.970 1.00 62.00 O ATOM 2799 CB ASN B 64 7.098 -11.054 4.546 1.00 33.23 C ATOM 2800 CG ASN B 64 8.043 -12.171 4.864 1.00 62.21 C ATOM 2801 OD1 ASN B 64 8.189 -13.122 4.098 1.00 4.30 O ATOM 2802 ND2 ASN B 64 8.620 -12.119 6.036 1.00 71.30 N ATOM 0 H ASN B 64 8.273 -9.467 2.684 1.00 45.23 H new ATOM 0 HA ASN B 64 6.685 -11.892 2.635 1.00 21.41 H new ATOM 0 HB2 ASN B 64 7.518 -10.121 4.921 1.00 33.23 H new ATOM 0 HB3 ASN B 64 6.164 -11.221 5.082 1.00 33.23 H new ATOM 0 HD21 ASN B 64 9.217 -12.886 6.345 1.00 71.30 H new ATOM 0 HD22 ASN B 64 8.473 -11.311 6.642 1.00 71.30 H new ATOM 2809 N ARG B 65 5.596 -8.820 2.839 1.00 15.14 N ATOM 2810 CA ARG B 65 4.385 -8.013 2.674 1.00 11.44 C ATOM 2811 C ARG B 65 4.728 -6.792 1.866 1.00 50.13 C ATOM 2812 O ARG B 65 5.858 -6.373 1.838 1.00 42.03 O ATOM 2813 CB ARG B 65 3.743 -7.571 4.025 1.00 32.40 C ATOM 2814 CG ARG B 65 3.446 -8.687 5.029 1.00 72.20 C ATOM 2815 CD ARG B 65 2.785 -8.149 6.287 1.00 42.40 C ATOM 2816 NE ARG B 65 1.368 -7.858 6.086 1.00 13.31 N ATOM 2817 CZ ARG B 65 0.754 -6.746 6.432 1.00 24.04 C ATOM 2818 NH1 ARG B 65 1.449 -5.665 6.795 1.00 32.43 N ATOM 2819 NH2 ARG B 65 -0.574 -6.697 6.383 1.00 52.30 N ATOM 0 H ARG B 65 6.466 -8.288 2.868 1.00 15.14 H new ATOM 0 HA ARG B 65 3.648 -8.637 2.168 1.00 11.44 H new ATOM 0 HB2 ARG B 65 4.408 -6.850 4.501 1.00 32.40 H new ATOM 0 HB3 ARG B 65 2.811 -7.049 3.807 1.00 32.40 H new ATOM 0 HG2 ARG B 65 2.797 -9.430 4.566 1.00 72.20 H new ATOM 0 HG3 ARG B 65 4.373 -9.195 5.294 1.00 72.20 H new ATOM 0 HD2 ARG B 65 2.894 -8.876 7.092 1.00 42.40 H new ATOM 0 HD3 ARG B 65 3.299 -7.242 6.605 1.00 42.40 H new ATOM 0 HE ARG B 65 0.804 -8.580 5.638 1.00 13.31 H new ATOM 0 HH11 ARG B 65 2.469 -5.694 6.807 1.00 32.43 H new ATOM 0 HH12 ARG B 65 0.960 -4.810 7.061 1.00 32.43 H new ATOM 0 HH21 ARG B 65 -1.104 -7.514 6.080 1.00 52.30 H new ATOM 0 HH22 ARG B 65 -1.063 -5.842 6.648 1.00 52.30 H new ATOM 2833 N ILE B 66 3.782 -6.286 1.179 1.00 72.13 N ATOM 2834 CA ILE B 66 3.909 -5.094 0.397 1.00 41.31 C ATOM 2835 C ILE B 66 2.586 -4.375 0.340 1.00 13.12 C ATOM 2836 O ILE B 66 1.588 -4.965 0.081 1.00 42.14 O ATOM 2837 CB ILE B 66 4.559 -5.343 -1.024 1.00 43.32 C ATOM 2838 CG1 ILE B 66 4.092 -4.340 -2.092 1.00 12.14 C ATOM 2839 CG2 ILE B 66 4.437 -6.773 -1.493 1.00 41.55 C ATOM 2840 CD1 ILE B 66 4.731 -4.549 -3.454 1.00 21.01 C ATOM 0 H ILE B 66 2.851 -6.699 1.135 1.00 72.13 H new ATOM 0 HA ILE B 66 4.621 -4.437 0.896 1.00 41.31 H new ATOM 0 HB ILE B 66 5.624 -5.159 -0.881 1.00 43.32 H new ATOM 0 HG12 ILE B 66 3.009 -4.412 -2.195 1.00 12.14 H new ATOM 0 HG13 ILE B 66 4.314 -3.329 -1.749 1.00 12.14 H new ATOM 0 HG21 ILE B 66 4.903 -6.875 -2.473 1.00 41.55 H new ATOM 0 HG22 ILE B 66 4.936 -7.433 -0.783 1.00 41.55 H new ATOM 0 HG23 ILE B 66 3.384 -7.045 -1.562 1.00 41.55 H new ATOM 0 HD11 ILE B 66 4.351 -3.803 -4.152 1.00 21.01 H new ATOM 0 HD12 ILE B 66 5.813 -4.448 -3.368 1.00 21.01 H new ATOM 0 HD13 ILE B 66 4.488 -5.546 -3.821 1.00 21.01 H new ATOM 2852 N THR B 67 2.605 -3.123 0.595 1.00 75.21 N ATOM 2853 CA THR B 67 1.415 -2.322 0.648 1.00 1.42 C ATOM 2854 C THR B 67 1.609 -1.188 -0.309 1.00 2.14 C ATOM 2855 O THR B 67 2.616 -0.535 -0.244 1.00 21.33 O ATOM 2856 CB THR B 67 1.228 -1.751 2.076 1.00 5.53 C ATOM 2857 OG1 THR B 67 1.186 -2.827 3.026 1.00 71.41 O ATOM 2858 CG2 THR B 67 -0.046 -0.909 2.192 1.00 74.23 C ATOM 0 H THR B 67 3.462 -2.601 0.779 1.00 75.21 H new ATOM 0 HA THR B 67 0.538 -2.917 0.391 1.00 1.42 H new ATOM 0 HB THR B 67 2.076 -1.100 2.287 1.00 5.53 H new ATOM 0 HG1 THR B 67 1.069 -2.462 3.928 1.00 71.41 H new ATOM 0 HG21 THR B 67 -0.139 -0.528 3.209 1.00 74.23 H new ATOM 0 HG22 THR B 67 0.006 -0.073 1.494 1.00 74.23 H new ATOM 0 HG23 THR B 67 -0.913 -1.526 1.955 1.00 74.23 H new ATOM 2866 N ILE B 68 0.684 -0.959 -1.189 1.00 5.23 N ATOM 2867 CA ILE B 68 0.827 0.125 -2.118 1.00 43.42 C ATOM 2868 C ILE B 68 -0.414 0.950 -1.987 1.00 43.44 C ATOM 2869 O ILE B 68 -1.520 0.423 -2.141 1.00 64.12 O ATOM 2870 CB ILE B 68 0.915 -0.297 -3.641 1.00 4.02 C ATOM 2871 CG1 ILE B 68 1.716 -1.576 -3.911 1.00 25.50 C ATOM 2872 CG2 ILE B 68 1.523 0.830 -4.464 1.00 31.11 C ATOM 2873 CD1 ILE B 68 0.964 -2.848 -3.596 1.00 41.23 C ATOM 0 H ILE B 68 -0.174 -1.503 -1.286 1.00 5.23 H new ATOM 0 HA ILE B 68 1.762 0.629 -1.875 1.00 43.42 H new ATOM 0 HB ILE B 68 -0.115 -0.502 -3.933 1.00 4.02 H new ATOM 0 HG12 ILE B 68 2.014 -1.592 -4.959 1.00 25.50 H new ATOM 0 HG13 ILE B 68 2.632 -1.551 -3.320 1.00 25.50 H new ATOM 0 HG21 ILE B 68 1.578 0.528 -5.510 1.00 31.11 H new ATOM 0 HG22 ILE B 68 0.901 1.721 -4.376 1.00 31.11 H new ATOM 0 HG23 ILE B 68 2.525 1.049 -4.096 1.00 31.11 H new ATOM 0 HD11 ILE B 68 1.597 -3.708 -3.813 1.00 41.23 H new ATOM 0 HD12 ILE B 68 0.689 -2.857 -2.541 1.00 41.23 H new ATOM 0 HD13 ILE B 68 0.062 -2.898 -4.206 1.00 41.23 H new ATOM 2885 N LEU B 69 -0.273 2.190 -1.666 1.00 13.12 N ATOM 2886 CA LEU B 69 -1.420 3.038 -1.634 1.00 60.43 C ATOM 2887 C LEU B 69 -1.305 4.190 -2.563 1.00 31.14 C ATOM 2888 O LEU B 69 -0.266 4.873 -2.623 1.00 64.01 O ATOM 2889 CB LEU B 69 -2.019 3.402 -0.251 1.00 73.00 C ATOM 2890 CG LEU B 69 -1.155 4.040 0.833 1.00 61.13 C ATOM 2891 CD1 LEU B 69 -2.074 4.587 1.947 1.00 11.45 C ATOM 2892 CD2 LEU B 69 -0.153 3.011 1.420 1.00 60.53 C ATOM 0 H LEU B 69 0.611 2.637 -1.425 1.00 13.12 H new ATOM 0 HA LEU B 69 -2.201 2.381 -2.018 1.00 60.43 H new ATOM 0 HB2 LEU B 69 -2.855 4.077 -0.432 1.00 73.00 H new ATOM 0 HB3 LEU B 69 -2.434 2.486 0.169 1.00 73.00 H new ATOM 0 HG LEU B 69 -0.577 4.855 0.397 1.00 61.13 H new ATOM 0 HD11 LEU B 69 -1.467 5.045 2.727 1.00 11.45 H new ATOM 0 HD12 LEU B 69 -2.750 5.333 1.528 1.00 11.45 H new ATOM 0 HD13 LEU B 69 -2.655 3.769 2.373 1.00 11.45 H new ATOM 0 HD21 LEU B 69 0.451 3.490 2.190 1.00 60.53 H new ATOM 0 HD22 LEU B 69 -0.702 2.177 1.856 1.00 60.53 H new ATOM 0 HD23 LEU B 69 0.497 2.642 0.626 1.00 60.53 H new ATOM 2904 N CYS B 70 -2.343 4.388 -3.302 1.00 70.12 N ATOM 2905 CA CYS B 70 -2.425 5.407 -4.282 1.00 14.32 C ATOM 2906 C CYS B 70 -3.485 6.383 -3.835 1.00 13.43 C ATOM 2907 O CYS B 70 -4.655 6.005 -3.680 1.00 25.43 O ATOM 2908 CB CYS B 70 -2.844 4.761 -5.591 1.00 22.03 C ATOM 2909 SG CYS B 70 -1.726 3.445 -6.132 1.00 14.13 S ATOM 0 H CYS B 70 -3.188 3.821 -3.234 1.00 70.12 H new ATOM 0 HA CYS B 70 -1.473 5.922 -4.413 1.00 14.32 H new ATOM 0 HB2 CYS B 70 -3.848 4.352 -5.481 1.00 22.03 H new ATOM 0 HB3 CYS B 70 -2.895 5.526 -6.366 1.00 22.03 H new ATOM 0 HG CYS B 70 -2.154 2.945 -7.253 1.00 14.13 H new ATOM 2915 N ASP B 71 -3.122 7.616 -3.601 1.00 40.40 N ATOM 2916 CA ASP B 71 -4.107 8.549 -3.109 1.00 14.02 C ATOM 2917 C ASP B 71 -4.408 9.556 -4.173 1.00 4.35 C ATOM 2918 O ASP B 71 -3.530 10.315 -4.594 1.00 64.42 O ATOM 2919 CB ASP B 71 -3.601 9.188 -1.828 1.00 64.32 C ATOM 2920 CG ASP B 71 -4.471 10.231 -1.206 1.00 1.13 C ATOM 2921 OD1 ASP B 71 -4.432 11.399 -1.655 1.00 43.10 O ATOM 2922 OD2 ASP B 71 -5.123 9.922 -0.225 1.00 12.31 O ATOM 0 H ASP B 71 -2.184 7.992 -3.737 1.00 40.40 H new ATOM 0 HA ASP B 71 -5.039 8.037 -2.870 1.00 14.02 H new ATOM 0 HB2 ASP B 71 -3.441 8.398 -1.095 1.00 64.32 H new ATOM 0 HB3 ASP B 71 -2.628 9.635 -2.033 1.00 64.32 H new ATOM 2927 N LYS B 72 -5.646 9.525 -4.634 1.00 64.44 N ATOM 2928 CA LYS B 72 -6.128 10.402 -5.699 1.00 40.30 C ATOM 2929 C LYS B 72 -7.148 11.349 -5.076 1.00 43.23 C ATOM 2930 O LYS B 72 -7.780 12.162 -5.738 1.00 4.34 O ATOM 2931 CB LYS B 72 -6.809 9.538 -6.771 1.00 13.43 C ATOM 2932 CG LYS B 72 -7.057 10.236 -8.105 1.00 22.44 C ATOM 2933 CD LYS B 72 -7.900 9.381 -9.056 1.00 54.41 C ATOM 2934 CE LYS B 72 -7.281 8.008 -9.303 1.00 24.22 C ATOM 2935 NZ LYS B 72 -8.063 7.208 -10.291 1.00 35.32 N ATOM 0 H LYS B 72 -6.356 8.885 -4.279 1.00 64.44 H new ATOM 0 HA LYS B 72 -5.314 10.965 -6.156 1.00 40.30 H new ATOM 0 HB2 LYS B 72 -6.194 8.656 -6.949 1.00 13.43 H new ATOM 0 HB3 LYS B 72 -7.764 9.187 -6.380 1.00 13.43 H new ATOM 0 HG2 LYS B 72 -7.562 11.186 -7.928 1.00 22.44 H new ATOM 0 HG3 LYS B 72 -6.101 10.466 -8.576 1.00 22.44 H new ATOM 0 HD2 LYS B 72 -8.900 9.257 -8.640 1.00 54.41 H new ATOM 0 HD3 LYS B 72 -8.013 9.903 -10.006 1.00 54.41 H new ATOM 0 HE2 LYS B 72 -6.260 8.131 -9.664 1.00 24.22 H new ATOM 0 HE3 LYS B 72 -7.222 7.463 -8.361 1.00 24.22 H new ATOM 0 HZ1 LYS B 72 -7.881 6.195 -10.140 1.00 35.32 H new ATOM 0 HZ2 LYS B 72 -9.078 7.400 -10.167 1.00 35.32 H new ATOM 0 HZ3 LYS B 72 -7.776 7.471 -11.255 1.00 35.32 H new ATOM 2949 N PHE B 73 -7.274 11.203 -3.788 1.00 52.12 N ATOM 2950 CA PHE B 73 -8.184 11.922 -2.925 1.00 53.00 C ATOM 2951 C PHE B 73 -8.019 13.449 -2.986 1.00 63.12 C ATOM 2952 O PHE B 73 -8.935 14.194 -2.634 1.00 24.51 O ATOM 2953 CB PHE B 73 -7.957 11.359 -1.531 1.00 44.31 C ATOM 2954 CG PHE B 73 -8.589 12.046 -0.387 1.00 31.42 C ATOM 2955 CD1 PHE B 73 -9.942 11.958 -0.148 1.00 72.24 C ATOM 2956 CD2 PHE B 73 -7.803 12.763 0.471 1.00 55.21 C ATOM 2957 CE1 PHE B 73 -10.499 12.589 0.944 1.00 52.21 C ATOM 2958 CE2 PHE B 73 -8.338 13.390 1.560 1.00 50.22 C ATOM 2959 CZ PHE B 73 -9.693 13.307 1.805 1.00 44.34 C ATOM 0 H PHE B 73 -6.706 10.532 -3.271 1.00 52.12 H new ATOM 0 HA PHE B 73 -9.214 11.776 -3.251 1.00 53.00 H new ATOM 0 HB2 PHE B 73 -8.302 10.325 -1.530 1.00 44.31 H new ATOM 0 HB3 PHE B 73 -6.882 11.336 -1.353 1.00 44.31 H new ATOM 0 HD1 PHE B 73 -10.570 11.392 -0.819 1.00 72.24 H new ATOM 0 HD2 PHE B 73 -6.742 12.835 0.285 1.00 55.21 H new ATOM 0 HE1 PHE B 73 -11.562 12.522 1.125 1.00 52.21 H new ATOM 0 HE2 PHE B 73 -7.701 13.950 2.229 1.00 50.22 H new ATOM 0 HZ PHE B 73 -10.121 13.801 2.665 1.00 44.34 H new ATOM 2969 N SER B 74 -6.878 13.908 -3.412 1.00 51.20 N ATOM 2970 CA SER B 74 -6.656 15.323 -3.546 1.00 51.33 C ATOM 2971 C SER B 74 -6.573 15.730 -5.026 1.00 74.13 C ATOM 2972 O SER B 74 -6.163 16.844 -5.356 1.00 74.23 O ATOM 2973 CB SER B 74 -5.408 15.721 -2.771 1.00 72.21 C ATOM 2974 OG SER B 74 -5.556 15.341 -1.402 1.00 71.30 O ATOM 0 H SER B 74 -6.084 13.324 -3.674 1.00 51.20 H new ATOM 0 HA SER B 74 -7.503 15.862 -3.122 1.00 51.33 H new ATOM 0 HB2 SER B 74 -4.531 15.238 -3.201 1.00 72.21 H new ATOM 0 HB3 SER B 74 -5.248 16.797 -2.846 1.00 72.21 H new ATOM 0 HG SER B 74 -4.752 15.596 -0.903 1.00 71.30 H new ATOM 2980 N GLY B 75 -6.987 14.834 -5.907 1.00 1.33 N ATOM 2981 CA GLY B 75 -7.005 15.138 -7.314 1.00 1.40 C ATOM 2982 C GLY B 75 -6.033 14.297 -8.086 1.00 33.22 C ATOM 2983 O GLY B 75 -6.416 13.478 -8.917 1.00 71.30 O ATOM 0 H GLY B 75 -7.312 13.897 -5.667 1.00 1.33 H new ATOM 0 HA2 GLY B 75 -8.010 14.981 -7.705 1.00 1.40 H new ATOM 0 HA3 GLY B 75 -6.767 16.192 -7.460 1.00 1.40 H new ATOM 2987 N HIS B 76 -4.779 14.483 -7.810 1.00 70.02 N ATOM 2988 CA HIS B 76 -3.744 13.742 -8.504 1.00 0.13 C ATOM 2989 C HIS B 76 -3.337 12.553 -7.689 1.00 43.32 C ATOM 2990 O HIS B 76 -3.059 12.682 -6.496 1.00 11.14 O ATOM 2991 CB HIS B 76 -2.536 14.615 -8.849 1.00 14.34 C ATOM 2992 CG HIS B 76 -2.850 15.741 -9.777 1.00 34.33 C ATOM 2993 ND1 HIS B 76 -2.730 15.651 -11.145 1.00 44.21 N ATOM 2994 CD2 HIS B 76 -3.284 16.994 -9.526 1.00 30.30 C ATOM 2995 CE1 HIS B 76 -3.078 16.799 -11.688 1.00 50.45 C ATOM 2996 NE2 HIS B 76 -3.417 17.628 -10.725 1.00 45.22 N ATOM 0 H HIS B 76 -4.436 15.140 -7.109 1.00 70.02 H new ATOM 0 HA HIS B 76 -4.157 13.399 -9.453 1.00 0.13 H new ATOM 0 HB2 HIS B 76 -2.119 15.022 -7.928 1.00 14.34 H new ATOM 0 HB3 HIS B 76 -1.765 13.990 -9.299 1.00 14.34 H new ATOM 0 HD2 HIS B 76 -3.488 17.417 -8.553 1.00 30.30 H new ATOM 0 HE1 HIS B 76 -3.084 17.022 -12.745 1.00 50.45 H new ATOM 0 HE2 HIS B 76 -3.729 18.590 -10.855 1.00 45.22 H new ATOM 3005 N PRO B 77 -3.308 11.374 -8.295 1.00 31.22 N ATOM 3006 CA PRO B 77 -2.967 10.176 -7.583 1.00 12.20 C ATOM 3007 C PRO B 77 -1.465 10.063 -7.300 1.00 41.13 C ATOM 3008 O PRO B 77 -0.621 10.063 -8.214 1.00 74.22 O ATOM 3009 CB PRO B 77 -3.455 9.070 -8.509 1.00 62.00 C ATOM 3010 CG PRO B 77 -3.332 9.645 -9.875 1.00 65.20 C ATOM 3011 CD PRO B 77 -3.608 11.113 -9.726 1.00 22.45 C ATOM 0 HA PRO B 77 -3.421 10.138 -6.593 1.00 12.20 H new ATOM 0 HB2 PRO B 77 -2.852 8.168 -8.402 1.00 62.00 H new ATOM 0 HB3 PRO B 77 -4.485 8.792 -8.287 1.00 62.00 H new ATOM 0 HG2 PRO B 77 -2.336 9.474 -10.283 1.00 65.20 H new ATOM 0 HG3 PRO B 77 -4.042 9.181 -10.560 1.00 65.20 H new ATOM 0 HD2 PRO B 77 -2.977 11.710 -10.385 1.00 22.45 H new ATOM 0 HD3 PRO B 77 -4.642 11.355 -9.971 1.00 22.45 H new ATOM 3019 N LYS B 78 -1.161 10.027 -6.034 1.00 21.22 N ATOM 3020 CA LYS B 78 0.170 9.833 -5.499 1.00 41.34 C ATOM 3021 C LYS B 78 0.386 8.388 -5.210 1.00 50.40 C ATOM 3022 O LYS B 78 -0.524 7.575 -5.408 1.00 75.44 O ATOM 3023 CB LYS B 78 0.290 10.649 -4.215 1.00 71.14 C ATOM 3024 CG LYS B 78 0.298 12.124 -4.492 1.00 40.43 C ATOM 3025 CD LYS B 78 0.112 12.997 -3.251 1.00 61.02 C ATOM 3026 CE LYS B 78 0.882 12.533 -2.051 1.00 32.14 C ATOM 3027 NZ LYS B 78 0.679 13.441 -0.909 1.00 55.14 N ATOM 0 H LYS B 78 -1.866 10.137 -5.305 1.00 21.22 H new ATOM 0 HA LYS B 78 0.922 10.159 -6.218 1.00 41.34 H new ATOM 0 HB2 LYS B 78 -0.541 10.408 -3.552 1.00 71.14 H new ATOM 0 HB3 LYS B 78 1.206 10.372 -3.692 1.00 71.14 H new ATOM 0 HG2 LYS B 78 1.242 12.387 -4.969 1.00 40.43 H new ATOM 0 HG3 LYS B 78 -0.494 12.352 -5.205 1.00 40.43 H new ATOM 0 HD2 LYS B 78 0.413 14.017 -3.490 1.00 61.02 H new ATOM 0 HD3 LYS B 78 -0.948 13.029 -2.999 1.00 61.02 H new ATOM 0 HE2 LYS B 78 0.567 11.526 -1.780 1.00 32.14 H new ATOM 0 HE3 LYS B 78 1.943 12.480 -2.294 1.00 32.14 H new ATOM 0 HZ1 LYS B 78 1.223 13.098 -0.092 1.00 55.14 H new ATOM 0 HZ2 LYS B 78 1.002 14.396 -1.163 1.00 55.14 H new ATOM 0 HZ3 LYS B 78 -0.331 13.471 -0.665 1.00 55.14 H new ATOM 3041 N GLY B 79 1.539 8.062 -4.715 1.00 63.25 N ATOM 3042 CA GLY B 79 1.821 6.709 -4.471 1.00 3.33 C ATOM 3043 C GLY B 79 2.964 6.502 -3.544 1.00 3.43 C ATOM 3044 O GLY B 79 4.007 7.153 -3.653 1.00 44.44 O ATOM 0 H GLY B 79 2.284 8.717 -4.479 1.00 63.25 H new ATOM 0 HA2 GLY B 79 0.934 6.230 -4.055 1.00 3.33 H new ATOM 0 HA3 GLY B 79 2.037 6.214 -5.418 1.00 3.33 H new ATOM 3048 N TYR B 80 2.766 5.607 -2.640 1.00 51.22 N ATOM 3049 CA TYR B 80 3.782 5.147 -1.760 1.00 12.40 C ATOM 3050 C TYR B 80 3.503 3.726 -1.351 1.00 75.53 C ATOM 3051 O TYR B 80 2.340 3.315 -1.233 1.00 54.42 O ATOM 3052 CB TYR B 80 4.138 6.105 -0.576 1.00 53.21 C ATOM 3053 CG TYR B 80 3.010 6.636 0.289 1.00 33.53 C ATOM 3054 CD1 TYR B 80 2.038 5.822 0.808 1.00 73.32 C ATOM 3055 CD2 TYR B 80 2.971 7.974 0.626 1.00 5.13 C ATOM 3056 CE1 TYR B 80 1.052 6.328 1.633 1.00 31.02 C ATOM 3057 CE2 TYR B 80 1.984 8.479 1.439 1.00 62.22 C ATOM 3058 CZ TYR B 80 1.030 7.650 1.935 1.00 2.24 C ATOM 3059 OH TYR B 80 0.045 8.143 2.759 1.00 2.22 O ATOM 0 H TYR B 80 1.862 5.160 -2.488 1.00 51.22 H new ATOM 0 HA TYR B 80 4.713 5.158 -2.326 1.00 12.40 H new ATOM 0 HB2 TYR B 80 4.837 5.581 0.076 1.00 53.21 H new ATOM 0 HB3 TYR B 80 4.669 6.962 -0.991 1.00 53.21 H new ATOM 0 HD1 TYR B 80 2.043 4.769 0.569 1.00 73.32 H new ATOM 0 HD2 TYR B 80 3.732 8.638 0.243 1.00 5.13 H new ATOM 0 HE1 TYR B 80 0.298 5.670 2.038 1.00 31.02 H new ATOM 0 HE2 TYR B 80 1.968 9.531 1.682 1.00 62.22 H new ATOM 0 HH TYR B 80 0.170 9.108 2.878 1.00 2.22 H new ATOM 3069 N ALA B 81 4.539 2.985 -1.179 1.00 60.14 N ATOM 3070 CA ALA B 81 4.443 1.596 -0.902 1.00 3.11 C ATOM 3071 C ALA B 81 5.300 1.241 0.275 1.00 71.34 C ATOM 3072 O ALA B 81 6.301 1.869 0.525 1.00 10.15 O ATOM 3073 CB ALA B 81 4.855 0.785 -2.121 1.00 2.32 C ATOM 0 H ALA B 81 5.496 3.334 -1.228 1.00 60.14 H new ATOM 0 HA ALA B 81 3.407 1.359 -0.662 1.00 3.11 H new ATOM 0 HB1 ALA B 81 4.777 -0.278 -1.894 1.00 2.32 H new ATOM 0 HB2 ALA B 81 4.199 1.027 -2.958 1.00 2.32 H new ATOM 0 HB3 ALA B 81 5.885 1.024 -2.386 1.00 2.32 H new ATOM 3079 N TYR B 82 4.881 0.280 1.011 1.00 22.03 N ATOM 3080 CA TYR B 82 5.614 -0.199 2.144 1.00 24.40 C ATOM 3081 C TYR B 82 5.871 -1.657 1.969 1.00 11.52 C ATOM 3082 O TYR B 82 4.938 -2.448 1.875 1.00 24.22 O ATOM 3083 CB TYR B 82 4.838 0.095 3.430 1.00 32.34 C ATOM 3084 CG TYR B 82 4.722 1.567 3.699 1.00 31.42 C ATOM 3085 CD1 TYR B 82 3.752 2.336 3.068 1.00 31.21 C ATOM 3086 CD2 TYR B 82 5.597 2.194 4.565 1.00 43.51 C ATOM 3087 CE1 TYR B 82 3.660 3.679 3.289 1.00 10.40 C ATOM 3088 CE2 TYR B 82 5.511 3.531 4.797 1.00 60.31 C ATOM 3089 CZ TYR B 82 4.532 4.279 4.147 1.00 0.50 C ATOM 3090 OH TYR B 82 4.434 5.633 4.368 1.00 63.33 O ATOM 0 H TYR B 82 4.003 -0.212 0.848 1.00 22.03 H new ATOM 0 HA TYR B 82 6.573 0.313 2.221 1.00 24.40 H new ATOM 0 HB2 TYR B 82 3.841 -0.339 3.358 1.00 32.34 H new ATOM 0 HB3 TYR B 82 5.336 -0.388 4.271 1.00 32.34 H new ATOM 0 HD1 TYR B 82 3.058 1.862 2.390 1.00 31.21 H new ATOM 0 HD2 TYR B 82 6.359 1.615 5.064 1.00 43.51 H new ATOM 0 HE1 TYR B 82 2.902 4.262 2.788 1.00 10.40 H new ATOM 0 HE2 TYR B 82 6.197 4.010 5.480 1.00 60.31 H new ATOM 0 HH TYR B 82 5.013 6.110 3.738 1.00 63.33 H new ATOM 3100 N ILE B 83 7.121 -2.016 1.871 1.00 54.23 N ATOM 3101 CA ILE B 83 7.485 -3.394 1.618 1.00 22.10 C ATOM 3102 C ILE B 83 8.062 -3.968 2.908 1.00 73.11 C ATOM 3103 O ILE B 83 8.863 -3.317 3.562 1.00 31.00 O ATOM 3104 CB ILE B 83 8.618 -3.499 0.538 1.00 64.42 C ATOM 3105 CG1 ILE B 83 8.401 -2.525 -0.641 1.00 62.32 C ATOM 3106 CG2 ILE B 83 8.724 -4.919 0.004 1.00 2.11 C ATOM 3107 CD1 ILE B 83 7.150 -2.751 -1.453 1.00 52.21 C ATOM 0 H ILE B 83 7.911 -1.377 1.962 1.00 54.23 H new ATOM 0 HA ILE B 83 6.599 -3.925 1.271 1.00 22.10 H new ATOM 0 HB ILE B 83 9.547 -3.222 1.037 1.00 64.42 H new ATOM 0 HG12 ILE B 83 8.379 -1.508 -0.249 1.00 62.32 H new ATOM 0 HG13 ILE B 83 9.261 -2.592 -1.307 1.00 62.32 H new ATOM 0 HG21 ILE B 83 9.516 -4.968 -0.743 1.00 2.11 H new ATOM 0 HG22 ILE B 83 8.955 -5.600 0.823 1.00 2.11 H new ATOM 0 HG23 ILE B 83 7.777 -5.208 -0.451 1.00 2.11 H new ATOM 0 HD11 ILE B 83 7.097 -2.013 -2.253 1.00 52.21 H new ATOM 0 HD12 ILE B 83 7.172 -3.752 -1.884 1.00 52.21 H new ATOM 0 HD13 ILE B 83 6.276 -2.652 -0.810 1.00 52.21 H new ATOM 3119 N GLU B 84 7.639 -5.132 3.271 1.00 22.22 N ATOM 3120 CA GLU B 84 8.171 -5.837 4.408 1.00 63.20 C ATOM 3121 C GLU B 84 8.917 -7.059 3.901 1.00 11.55 C ATOM 3122 O GLU B 84 8.360 -7.856 3.144 1.00 71.04 O ATOM 3123 CB GLU B 84 7.037 -6.268 5.352 1.00 65.13 C ATOM 3124 CG GLU B 84 6.244 -5.110 5.959 1.00 23.03 C ATOM 3125 CD GLU B 84 5.094 -5.580 6.834 1.00 75.34 C ATOM 3126 OE1 GLU B 84 5.280 -6.503 7.615 1.00 63.31 O ATOM 3127 OE2 GLU B 84 3.987 -5.015 6.738 1.00 74.14 O ATOM 0 H GLU B 84 6.900 -5.637 2.782 1.00 22.22 H new ATOM 0 HA GLU B 84 8.845 -5.186 4.965 1.00 63.20 H new ATOM 0 HB2 GLU B 84 6.351 -6.914 4.804 1.00 65.13 H new ATOM 0 HB3 GLU B 84 7.461 -6.865 6.160 1.00 65.13 H new ATOM 0 HG2 GLU B 84 6.914 -4.487 6.551 1.00 23.03 H new ATOM 0 HG3 GLU B 84 5.852 -4.484 5.157 1.00 23.03 H new ATOM 3134 N PHE B 85 10.163 -7.196 4.279 1.00 44.50 N ATOM 3135 CA PHE B 85 10.979 -8.327 3.839 1.00 13.31 C ATOM 3136 C PHE B 85 11.002 -9.436 4.856 1.00 64.35 C ATOM 3137 O PHE B 85 10.543 -9.268 5.974 1.00 52.00 O ATOM 3138 CB PHE B 85 12.411 -7.908 3.535 1.00 64.40 C ATOM 3139 CG PHE B 85 12.565 -7.053 2.324 1.00 14.11 C ATOM 3140 CD1 PHE B 85 12.710 -7.638 1.080 1.00 45.21 C ATOM 3141 CD2 PHE B 85 12.583 -5.680 2.420 1.00 4.43 C ATOM 3142 CE1 PHE B 85 12.865 -6.870 -0.045 1.00 54.24 C ATOM 3143 CE2 PHE B 85 12.740 -4.907 1.294 1.00 4.11 C ATOM 3144 CZ PHE B 85 12.881 -5.504 0.065 1.00 44.12 C ATOM 0 H PHE B 85 10.647 -6.541 4.893 1.00 44.50 H new ATOM 0 HA PHE B 85 10.511 -8.693 2.925 1.00 13.31 H new ATOM 0 HB2 PHE B 85 12.809 -7.370 4.396 1.00 64.40 H new ATOM 0 HB3 PHE B 85 13.019 -8.804 3.410 1.00 64.40 H new ATOM 0 HD1 PHE B 85 12.701 -8.714 0.993 1.00 45.21 H new ATOM 0 HD2 PHE B 85 12.473 -5.207 3.385 1.00 4.43 H new ATOM 0 HE1 PHE B 85 12.974 -7.339 -1.012 1.00 54.24 H new ATOM 0 HE2 PHE B 85 12.752 -3.830 1.376 1.00 4.11 H new ATOM 0 HZ PHE B 85 13.005 -4.895 -0.818 1.00 44.12 H new ATOM 3154 N ALA B 86 11.487 -10.583 4.443 1.00 14.30 N ATOM 3155 CA ALA B 86 11.684 -11.694 5.338 1.00 11.22 C ATOM 3156 C ALA B 86 12.997 -11.548 6.103 1.00 75.31 C ATOM 3157 O ALA B 86 13.089 -11.893 7.278 1.00 31.22 O ATOM 3158 CB ALA B 86 11.643 -13.000 4.562 1.00 24.33 C ATOM 0 H ALA B 86 11.755 -10.770 3.477 1.00 14.30 H new ATOM 0 HA ALA B 86 10.876 -11.703 6.070 1.00 11.22 H new ATOM 0 HB1 ALA B 86 11.793 -13.835 5.247 1.00 24.33 H new ATOM 0 HB2 ALA B 86 10.675 -13.102 4.072 1.00 24.33 H new ATOM 0 HB3 ALA B 86 12.432 -13.001 3.810 1.00 24.33 H new ATOM 3164 N GLU B 87 14.005 -11.040 5.438 1.00 34.44 N ATOM 3165 CA GLU B 87 15.290 -10.827 6.070 1.00 12.21 C ATOM 3166 C GLU B 87 15.415 -9.360 6.490 1.00 22.12 C ATOM 3167 O GLU B 87 14.969 -8.467 5.765 1.00 34.54 O ATOM 3168 CB GLU B 87 16.455 -11.143 5.111 1.00 42.53 C ATOM 3169 CG GLU B 87 16.470 -12.524 4.440 1.00 61.22 C ATOM 3170 CD GLU B 87 15.358 -12.720 3.426 1.00 5.31 C ATOM 3171 OE1 GLU B 87 15.299 -11.946 2.425 1.00 33.13 O ATOM 3172 OE2 GLU B 87 14.556 -13.648 3.589 1.00 45.41 O ATOM 0 H GLU B 87 13.963 -10.765 4.457 1.00 34.44 H new ATOM 0 HA GLU B 87 15.345 -11.493 6.931 1.00 12.21 H new ATOM 0 HB2 GLU B 87 16.457 -10.388 4.325 1.00 42.53 H new ATOM 0 HB3 GLU B 87 17.387 -11.029 5.665 1.00 42.53 H new ATOM 0 HG2 GLU B 87 17.431 -12.668 3.945 1.00 61.22 H new ATOM 0 HG3 GLU B 87 16.389 -13.293 5.208 1.00 61.22 H new ATOM 3179 N ARG B 88 16.021 -9.101 7.649 1.00 1.33 N ATOM 3180 CA ARG B 88 16.233 -7.721 8.097 1.00 22.31 C ATOM 3181 C ARG B 88 17.393 -7.154 7.256 1.00 72.54 C ATOM 3182 O ARG B 88 17.490 -5.963 7.002 1.00 12.32 O ATOM 3183 CB ARG B 88 16.592 -7.689 9.611 1.00 23.25 C ATOM 3184 CG ARG B 88 16.170 -6.406 10.382 1.00 42.00 C ATOM 3185 CD ARG B 88 16.743 -5.104 9.826 1.00 53.04 C ATOM 3186 NE ARG B 88 18.206 -5.016 9.912 1.00 51.12 N ATOM 3187 CZ ARG B 88 18.920 -3.985 9.433 1.00 54.13 C ATOM 3188 NH1 ARG B 88 18.303 -2.970 8.836 1.00 1.35 N ATOM 3189 NH2 ARG B 88 20.238 -3.965 9.570 1.00 64.13 N ATOM 0 H ARG B 88 16.370 -9.816 8.288 1.00 1.33 H new ATOM 0 HA ARG B 88 15.329 -7.126 7.966 1.00 22.31 H new ATOM 0 HB2 ARG B 88 16.127 -8.549 10.093 1.00 23.25 H new ATOM 0 HB3 ARG B 88 17.670 -7.812 9.712 1.00 23.25 H new ATOM 0 HG2 ARG B 88 15.082 -6.338 10.378 1.00 42.00 H new ATOM 0 HG3 ARG B 88 16.479 -6.507 11.422 1.00 42.00 H new ATOM 0 HD2 ARG B 88 16.443 -5.002 8.783 1.00 53.04 H new ATOM 0 HD3 ARG B 88 16.305 -4.265 10.367 1.00 53.04 H new ATOM 0 HE ARG B 88 18.708 -5.782 10.361 1.00 51.12 H new ATOM 0 HH11 ARG B 88 17.287 -2.975 8.742 1.00 1.35 H new ATOM 0 HH12 ARG B 88 18.845 -2.187 8.472 1.00 1.35 H new ATOM 0 HH21 ARG B 88 20.714 -4.735 10.041 1.00 64.13 H new ATOM 0 HH22 ARG B 88 20.777 -3.180 9.205 1.00 64.13 H new ATOM 3203 N ASN B 89 18.249 -8.037 6.802 1.00 63.12 N ATOM 3204 CA ASN B 89 19.361 -7.642 5.960 1.00 44.33 C ATOM 3205 C ASN B 89 18.883 -7.227 4.568 1.00 61.03 C ATOM 3206 O ASN B 89 19.575 -6.494 3.865 1.00 44.22 O ATOM 3207 CB ASN B 89 20.448 -8.736 5.863 1.00 1.32 C ATOM 3208 CG ASN B 89 19.932 -10.054 5.322 1.00 52.32 C ATOM 3209 OD1 ASN B 89 19.874 -10.258 4.124 1.00 24.02 O ATOM 3210 ND2 ASN B 89 19.597 -10.971 6.208 1.00 4.24 N ATOM 0 H ASN B 89 18.200 -9.036 7.000 1.00 63.12 H new ATOM 0 HA ASN B 89 19.820 -6.777 6.439 1.00 44.33 H new ATOM 0 HB2 ASN B 89 21.254 -8.380 5.222 1.00 1.32 H new ATOM 0 HB3 ASN B 89 20.876 -8.901 6.852 1.00 1.32 H new ATOM 0 HD21 ASN B 89 19.276 -11.888 5.897 1.00 4.24 H new ATOM 0 HD22 ASN B 89 19.659 -10.764 7.205 1.00 4.24 H new ATOM 3217 N SER B 90 17.703 -7.679 4.172 1.00 71.32 N ATOM 3218 CA SER B 90 17.146 -7.329 2.885 1.00 31.31 C ATOM 3219 C SER B 90 16.685 -5.874 2.839 1.00 41.42 C ATOM 3220 O SER B 90 16.859 -5.198 1.826 1.00 50.21 O ATOM 3221 CB SER B 90 16.042 -8.300 2.521 1.00 4.43 C ATOM 3222 OG SER B 90 16.584 -9.608 2.469 1.00 73.42 O ATOM 0 H SER B 90 17.113 -8.294 4.732 1.00 71.32 H new ATOM 0 HA SER B 90 17.930 -7.414 2.132 1.00 31.31 H new ATOM 0 HB2 SER B 90 15.240 -8.253 3.257 1.00 4.43 H new ATOM 0 HB3 SER B 90 15.607 -8.033 1.558 1.00 4.43 H new ATOM 0 HG SER B 90 15.860 -10.258 2.354 1.00 73.42 H new ATOM 3228 N VAL B 91 16.125 -5.371 3.949 1.00 30.25 N ATOM 3229 CA VAL B 91 15.750 -3.967 3.986 1.00 52.33 C ATOM 3230 C VAL B 91 16.995 -3.112 3.960 1.00 25.33 C ATOM 3231 O VAL B 91 17.060 -2.119 3.241 1.00 61.22 O ATOM 3232 CB VAL B 91 14.788 -3.560 5.183 1.00 23.04 C ATOM 3233 CG1 VAL B 91 15.253 -4.121 6.500 1.00 44.10 C ATOM 3234 CG2 VAL B 91 14.683 -2.043 5.309 1.00 43.42 C ATOM 0 H VAL B 91 15.931 -5.900 4.799 1.00 30.25 H new ATOM 0 HA VAL B 91 15.151 -3.787 3.093 1.00 52.33 H new ATOM 0 HB VAL B 91 13.811 -3.982 4.947 1.00 23.04 H new ATOM 0 HG11 VAL B 91 14.565 -3.817 7.288 1.00 44.10 H new ATOM 0 HG12 VAL B 91 15.281 -5.209 6.443 1.00 44.10 H new ATOM 0 HG13 VAL B 91 16.251 -3.744 6.724 1.00 44.10 H new ATOM 0 HG21 VAL B 91 14.019 -1.792 6.136 1.00 43.42 H new ATOM 0 HG22 VAL B 91 15.672 -1.624 5.498 1.00 43.42 H new ATOM 0 HG23 VAL B 91 14.284 -1.628 4.384 1.00 43.42 H new ATOM 3244 N ASP B 92 18.010 -3.537 4.708 1.00 62.41 N ATOM 3245 CA ASP B 92 19.295 -2.845 4.772 1.00 70.22 C ATOM 3246 C ASP B 92 19.935 -2.761 3.368 1.00 55.31 C ATOM 3247 O ASP B 92 20.605 -1.792 3.037 1.00 63.00 O ATOM 3248 CB ASP B 92 20.210 -3.598 5.758 1.00 44.22 C ATOM 3249 CG ASP B 92 21.491 -2.857 6.115 1.00 51.15 C ATOM 3250 OD1 ASP B 92 21.411 -1.861 6.868 1.00 72.21 O ATOM 3251 OD2 ASP B 92 22.580 -3.276 5.691 1.00 2.12 O ATOM 0 H ASP B 92 17.964 -4.374 5.289 1.00 62.41 H new ATOM 0 HA ASP B 92 19.151 -1.824 5.124 1.00 70.22 H new ATOM 0 HB2 ASP B 92 19.652 -3.797 6.673 1.00 44.22 H new ATOM 0 HB3 ASP B 92 20.471 -4.565 5.327 1.00 44.22 H new ATOM 3256 N ALA B 93 19.706 -3.785 2.558 1.00 2.45 N ATOM 3257 CA ALA B 93 20.179 -3.801 1.174 1.00 41.35 C ATOM 3258 C ALA B 93 19.357 -2.856 0.276 1.00 32.50 C ATOM 3259 O ALA B 93 19.896 -2.231 -0.637 1.00 45.13 O ATOM 3260 CB ALA B 93 20.139 -5.211 0.616 1.00 3.04 C ATOM 0 H ALA B 93 19.193 -4.622 2.834 1.00 2.45 H new ATOM 0 HA ALA B 93 21.209 -3.445 1.179 1.00 41.35 H new ATOM 0 HB1 ALA B 93 20.494 -5.205 -0.414 1.00 3.04 H new ATOM 0 HB2 ALA B 93 20.779 -5.858 1.216 1.00 3.04 H new ATOM 0 HB3 ALA B 93 19.115 -5.585 0.645 1.00 3.04 H new ATOM 3266 N ALA B 94 18.069 -2.738 0.562 1.00 65.21 N ATOM 3267 CA ALA B 94 17.171 -1.935 -0.273 1.00 33.14 C ATOM 3268 C ALA B 94 17.356 -0.440 -0.004 1.00 31.42 C ATOM 3269 O ALA B 94 17.344 0.362 -0.919 1.00 65.03 O ATOM 3270 CB ALA B 94 15.705 -2.361 -0.106 1.00 74.51 C ATOM 0 H ALA B 94 17.618 -3.184 1.361 1.00 65.21 H new ATOM 0 HA ALA B 94 17.440 -2.120 -1.313 1.00 33.14 H new ATOM 0 HB1 ALA B 94 15.072 -1.742 -0.741 1.00 74.51 H new ATOM 0 HB2 ALA B 94 15.595 -3.407 -0.393 1.00 74.51 H new ATOM 0 HB3 ALA B 94 15.406 -2.237 0.935 1.00 74.51 H new ATOM 3276 N VAL B 95 17.543 -0.089 1.268 1.00 20.41 N ATOM 3277 CA VAL B 95 17.751 1.316 1.707 1.00 10.44 C ATOM 3278 C VAL B 95 18.940 2.000 1.003 1.00 44.00 C ATOM 3279 O VAL B 95 19.009 3.220 0.938 1.00 14.21 O ATOM 3280 CB VAL B 95 17.867 1.443 3.250 1.00 4.00 C ATOM 3281 CG1 VAL B 95 16.655 0.864 3.935 1.00 12.52 C ATOM 3282 CG2 VAL B 95 19.159 0.862 3.796 1.00 43.20 C ATOM 0 H VAL B 95 17.557 -0.762 2.034 1.00 20.41 H new ATOM 0 HA VAL B 95 16.852 1.850 1.399 1.00 10.44 H new ATOM 0 HB VAL B 95 17.902 2.509 3.476 1.00 4.00 H new ATOM 0 HG11 VAL B 95 16.764 0.967 5.015 1.00 12.52 H new ATOM 0 HG12 VAL B 95 15.763 1.397 3.608 1.00 12.52 H new ATOM 0 HG13 VAL B 95 16.561 -0.191 3.678 1.00 12.52 H new ATOM 0 HG21 VAL B 95 19.182 0.980 4.879 1.00 43.20 H new ATOM 0 HG22 VAL B 95 19.216 -0.197 3.545 1.00 43.20 H new ATOM 0 HG23 VAL B 95 20.008 1.385 3.356 1.00 43.20 H new ATOM 3292 N ALA B 96 19.871 1.205 0.478 1.00 41.02 N ATOM 3293 CA ALA B 96 21.019 1.739 -0.274 1.00 73.14 C ATOM 3294 C ALA B 96 20.566 2.316 -1.627 1.00 4.22 C ATOM 3295 O ALA B 96 21.325 2.980 -2.330 1.00 62.54 O ATOM 3296 CB ALA B 96 22.069 0.669 -0.477 1.00 15.14 C ATOM 0 H ALA B 96 19.858 0.188 0.556 1.00 41.02 H new ATOM 0 HA ALA B 96 21.460 2.547 0.310 1.00 73.14 H new ATOM 0 HB1 ALA B 96 22.909 1.084 -1.035 1.00 15.14 H new ATOM 0 HB2 ALA B 96 22.418 0.313 0.492 1.00 15.14 H new ATOM 0 HB3 ALA B 96 21.638 -0.162 -1.035 1.00 15.14 H new ATOM 3302 N MET B 97 19.333 2.035 -1.973 1.00 63.24 N ATOM 3303 CA MET B 97 18.710 2.578 -3.154 1.00 75.15 C ATOM 3304 C MET B 97 17.948 3.813 -2.834 1.00 70.23 C ATOM 3305 O MET B 97 17.419 4.377 -3.719 1.00 65.32 O ATOM 3306 CB MET B 97 17.706 1.597 -3.818 1.00 71.11 C ATOM 3307 CG MET B 97 18.247 0.680 -4.873 1.00 15.31 C ATOM 3308 SD MET B 97 16.948 -0.302 -5.700 1.00 51.13 S ATOM 3309 CE MET B 97 16.016 -0.984 -4.314 1.00 63.52 C ATOM 0 H MET B 97 18.727 1.415 -1.435 1.00 63.24 H new ATOM 0 HA MET B 97 19.532 2.779 -3.841 1.00 75.15 H new ATOM 0 HB2 MET B 97 17.261 0.985 -3.033 1.00 71.11 H new ATOM 0 HB3 MET B 97 16.901 2.184 -4.260 1.00 71.11 H new ATOM 0 HG2 MET B 97 18.780 1.269 -5.619 1.00 15.31 H new ATOM 0 HG3 MET B 97 18.973 0.004 -4.421 1.00 15.31 H new ATOM 0 HE1 MET B 97 15.354 -1.772 -4.673 1.00 63.52 H new ATOM 0 HE2 MET B 97 16.707 -1.397 -3.579 1.00 63.52 H new ATOM 0 HE3 MET B 97 15.423 -0.195 -3.851 1.00 63.52 H new ATOM 3319 N ASP B 98 17.924 4.246 -1.548 1.00 21.13 N ATOM 3320 CA ASP B 98 16.998 5.329 -1.056 1.00 25.22 C ATOM 3321 C ASP B 98 16.729 6.441 -2.034 1.00 62.33 C ATOM 3322 O ASP B 98 15.592 6.834 -2.174 1.00 45.12 O ATOM 3323 CB ASP B 98 17.381 5.904 0.304 1.00 33.23 C ATOM 3324 CG ASP B 98 18.546 6.855 0.272 1.00 34.42 C ATOM 3325 OD1 ASP B 98 19.695 6.404 0.381 1.00 52.14 O ATOM 3326 OD2 ASP B 98 18.315 8.080 0.164 1.00 12.34 O ATOM 0 H ASP B 98 18.533 3.868 -0.822 1.00 21.13 H new ATOM 0 HA ASP B 98 16.060 4.786 -0.940 1.00 25.22 H new ATOM 0 HB2 ASP B 98 16.517 6.421 0.722 1.00 33.23 H new ATOM 0 HB3 ASP B 98 17.618 5.081 0.979 1.00 33.23 H new ATOM 3331 N GLU B 99 17.731 6.973 -2.674 1.00 70.24 N ATOM 3332 CA GLU B 99 17.487 7.871 -3.757 1.00 64.10 C ATOM 3333 C GLU B 99 17.503 7.040 -5.041 1.00 45.11 C ATOM 3334 O GLU B 99 18.562 6.848 -5.665 1.00 44.55 O ATOM 3335 CB GLU B 99 18.554 8.960 -3.793 1.00 22.04 C ATOM 3336 CG GLU B 99 18.353 10.004 -4.864 1.00 45.54 C ATOM 3337 CD GLU B 99 19.486 10.976 -4.910 1.00 10.25 C ATOM 3338 OE1 GLU B 99 19.541 11.881 -4.061 1.00 42.44 O ATOM 3339 OE2 GLU B 99 20.361 10.837 -5.781 1.00 15.24 O ATOM 0 H GLU B 99 18.714 6.801 -2.465 1.00 70.24 H new ATOM 0 HA GLU B 99 16.525 8.371 -3.643 1.00 64.10 H new ATOM 0 HB2 GLU B 99 18.581 9.455 -2.822 1.00 22.04 H new ATOM 0 HB3 GLU B 99 19.527 8.492 -3.939 1.00 22.04 H new ATOM 0 HG2 GLU B 99 18.253 9.516 -5.833 1.00 45.54 H new ATOM 0 HG3 GLU B 99 17.422 10.540 -4.679 1.00 45.54 H new ATOM 3346 N THR B 100 16.368 6.457 -5.373 1.00 13.22 N ATOM 3347 CA THR B 100 16.317 5.574 -6.516 1.00 61.14 C ATOM 3348 C THR B 100 15.842 6.343 -7.722 1.00 63.53 C ATOM 3349 O THR B 100 14.914 7.134 -7.629 1.00 62.02 O ATOM 3350 CB THR B 100 15.328 4.398 -6.323 1.00 61.43 C ATOM 3351 OG1 THR B 100 15.283 3.977 -4.971 1.00 45.33 O ATOM 3352 CG2 THR B 100 15.760 3.205 -7.163 1.00 41.21 C ATOM 0 H THR B 100 15.485 6.577 -4.877 1.00 13.22 H new ATOM 0 HA THR B 100 17.324 5.177 -6.642 1.00 61.14 H new ATOM 0 HB THR B 100 14.344 4.753 -6.630 1.00 61.43 H new ATOM 0 HG1 THR B 100 16.140 4.175 -4.538 1.00 45.33 H new ATOM 0 HG21 THR B 100 15.057 2.385 -7.019 1.00 41.21 H new ATOM 0 HG22 THR B 100 15.776 3.488 -8.216 1.00 41.21 H new ATOM 0 HG23 THR B 100 16.757 2.887 -6.857 1.00 41.21 H new ATOM 3360 N VAL B 101 16.454 6.115 -8.829 1.00 52.20 N ATOM 3361 CA VAL B 101 15.998 6.693 -10.050 1.00 21.03 C ATOM 3362 C VAL B 101 15.198 5.625 -10.799 1.00 54.14 C ATOM 3363 O VAL B 101 15.747 4.659 -11.356 1.00 35.34 O ATOM 3364 CB VAL B 101 17.151 7.303 -10.890 1.00 30.25 C ATOM 3365 CG1 VAL B 101 18.254 6.294 -11.097 1.00 44.30 C ATOM 3366 CG2 VAL B 101 16.633 7.846 -12.222 1.00 2.43 C ATOM 0 H VAL B 101 17.282 5.526 -8.918 1.00 52.20 H new ATOM 0 HA VAL B 101 15.350 7.544 -9.841 1.00 21.03 H new ATOM 0 HB VAL B 101 17.568 8.143 -10.335 1.00 30.25 H new ATOM 0 HG11 VAL B 101 19.052 6.743 -11.688 1.00 44.30 H new ATOM 0 HG12 VAL B 101 18.650 5.984 -10.130 1.00 44.30 H new ATOM 0 HG13 VAL B 101 17.858 5.425 -11.622 1.00 44.30 H new ATOM 0 HG21 VAL B 101 17.462 8.268 -12.790 1.00 2.43 H new ATOM 0 HG22 VAL B 101 16.177 7.037 -12.792 1.00 2.43 H new ATOM 0 HG23 VAL B 101 15.890 8.621 -12.035 1.00 2.43 H new ATOM 3376 N PHE B 102 13.918 5.776 -10.752 1.00 34.35 N ATOM 3377 CA PHE B 102 13.010 4.804 -11.269 1.00 45.41 C ATOM 3378 C PHE B 102 11.946 5.495 -12.091 1.00 43.51 C ATOM 3379 O PHE B 102 11.279 6.407 -11.601 1.00 43.13 O ATOM 3380 CB PHE B 102 12.375 4.059 -10.069 1.00 2.23 C ATOM 3381 CG PHE B 102 11.386 2.972 -10.410 1.00 34.44 C ATOM 3382 CD1 PHE B 102 10.038 3.260 -10.548 1.00 63.43 C ATOM 3383 CD2 PHE B 102 11.803 1.665 -10.572 1.00 4.10 C ATOM 3384 CE1 PHE B 102 9.130 2.264 -10.846 1.00 34.03 C ATOM 3385 CE2 PHE B 102 10.895 0.665 -10.866 1.00 63.31 C ATOM 3386 CZ PHE B 102 9.559 0.967 -11.005 1.00 72.25 C ATOM 0 H PHE B 102 13.463 6.593 -10.346 1.00 34.35 H new ATOM 0 HA PHE B 102 13.527 4.092 -11.912 1.00 45.41 H new ATOM 0 HB2 PHE B 102 13.176 3.620 -9.475 1.00 2.23 H new ATOM 0 HB3 PHE B 102 11.874 4.792 -9.436 1.00 2.23 H new ATOM 0 HD1 PHE B 102 9.694 4.276 -10.421 1.00 63.43 H new ATOM 0 HD2 PHE B 102 12.850 1.422 -10.468 1.00 4.10 H new ATOM 0 HE1 PHE B 102 8.082 2.503 -10.954 1.00 34.03 H new ATOM 0 HE2 PHE B 102 11.234 -0.353 -10.987 1.00 63.31 H new ATOM 0 HZ PHE B 102 8.849 0.187 -11.238 1.00 72.25 H new ATOM 3396 N ARG B 103 11.818 5.080 -13.348 1.00 13.25 N ATOM 3397 CA ARG B 103 10.790 5.578 -14.275 1.00 55.34 C ATOM 3398 C ARG B 103 10.892 7.117 -14.459 1.00 53.13 C ATOM 3399 O ARG B 103 9.910 7.819 -14.705 1.00 35.25 O ATOM 3400 CB ARG B 103 9.418 5.111 -13.749 1.00 42.22 C ATOM 3401 CG ARG B 103 8.233 5.377 -14.644 1.00 3.21 C ATOM 3402 CD ARG B 103 7.010 4.681 -14.102 1.00 43.45 C ATOM 3403 NE ARG B 103 5.831 4.895 -14.930 1.00 35.31 N ATOM 3404 CZ ARG B 103 5.065 3.926 -15.436 1.00 41.41 C ATOM 3405 NH1 ARG B 103 5.453 2.650 -15.366 1.00 30.43 N ATOM 3406 NH2 ARG B 103 3.936 4.241 -16.049 1.00 11.40 N ATOM 0 H ARG B 103 12.431 4.378 -13.763 1.00 13.25 H new ATOM 0 HA ARG B 103 10.937 5.169 -15.274 1.00 55.34 H new ATOM 0 HB2 ARG B 103 9.471 4.039 -13.561 1.00 42.22 H new ATOM 0 HB3 ARG B 103 9.237 5.595 -12.789 1.00 42.22 H new ATOM 0 HG2 ARG B 103 8.051 6.450 -14.711 1.00 3.21 H new ATOM 0 HG3 ARG B 103 8.444 5.026 -15.654 1.00 3.21 H new ATOM 0 HD2 ARG B 103 7.208 3.612 -14.028 1.00 43.45 H new ATOM 0 HD3 ARG B 103 6.810 5.039 -13.092 1.00 43.45 H new ATOM 0 HE ARG B 103 5.571 5.859 -15.139 1.00 35.31 H new ATOM 0 HH11 ARG B 103 6.340 2.410 -14.924 1.00 30.43 H new ATOM 0 HH12 ARG B 103 4.862 1.915 -15.755 1.00 30.43 H new ATOM 0 HH21 ARG B 103 3.656 5.218 -16.132 1.00 11.40 H new ATOM 0 HH22 ARG B 103 3.345 3.507 -16.438 1.00 11.40 H new ATOM 3420 N GLY B 104 12.116 7.601 -14.402 1.00 4.10 N ATOM 3421 CA GLY B 104 12.391 9.019 -14.576 1.00 75.22 C ATOM 3422 C GLY B 104 12.090 9.826 -13.329 1.00 65.44 C ATOM 3423 O GLY B 104 12.202 11.056 -13.324 1.00 61.45 O ATOM 0 H GLY B 104 12.945 7.030 -14.235 1.00 4.10 H new ATOM 0 HA2 GLY B 104 13.438 9.152 -14.847 1.00 75.22 H new ATOM 0 HA3 GLY B 104 11.796 9.402 -15.405 1.00 75.22 H new ATOM 3427 N ARG B 105 11.686 9.148 -12.290 1.00 2.15 N ATOM 3428 CA ARG B 105 11.422 9.769 -11.030 1.00 3.44 C ATOM 3429 C ARG B 105 12.467 9.369 -10.049 1.00 33.12 C ATOM 3430 O ARG B 105 13.199 8.398 -10.261 1.00 75.33 O ATOM 3431 CB ARG B 105 10.076 9.345 -10.461 1.00 12.22 C ATOM 3432 CG ARG B 105 8.866 9.797 -11.222 1.00 20.45 C ATOM 3433 CD ARG B 105 7.624 9.358 -10.487 1.00 10.42 C ATOM 3434 NE ARG B 105 6.406 9.838 -11.110 1.00 4.33 N ATOM 3435 CZ ARG B 105 5.229 9.927 -10.490 1.00 35.31 C ATOM 3436 NH1 ARG B 105 5.110 9.539 -9.224 1.00 32.23 N ATOM 3437 NH2 ARG B 105 4.174 10.398 -11.137 1.00 62.44 N ATOM 0 H ARG B 105 11.531 8.140 -12.299 1.00 2.15 H new ATOM 0 HA ARG B 105 11.419 10.846 -11.196 1.00 3.44 H new ATOM 0 HB2 ARG B 105 10.057 8.257 -10.401 1.00 12.22 H new ATOM 0 HB3 ARG B 105 10.001 9.722 -9.441 1.00 12.22 H new ATOM 0 HG2 ARG B 105 8.874 10.882 -11.331 1.00 20.45 H new ATOM 0 HG3 ARG B 105 8.876 9.376 -12.227 1.00 20.45 H new ATOM 0 HD2 ARG B 105 7.599 8.269 -10.442 1.00 10.42 H new ATOM 0 HD3 ARG B 105 7.668 9.719 -9.459 1.00 10.42 H new ATOM 0 HE ARG B 105 6.453 10.127 -12.087 1.00 4.33 H new ATOM 0 HH11 ARG B 105 5.920 9.172 -8.725 1.00 32.23 H new ATOM 0 HH12 ARG B 105 4.208 9.608 -8.752 1.00 32.23 H new ATOM 0 HH21 ARG B 105 4.262 10.693 -12.110 1.00 62.44 H new ATOM 0 HH22 ARG B 105 3.273 10.466 -10.663 1.00 62.44 H new ATOM 3451 N THR B 106 12.546 10.090 -8.997 1.00 61.42 N ATOM 3452 CA THR B 106 13.386 9.725 -7.933 1.00 2.52 C ATOM 3453 C THR B 106 12.492 9.267 -6.801 1.00 54.04 C ATOM 3454 O THR B 106 11.658 10.036 -6.299 1.00 23.42 O ATOM 3455 CB THR B 106 14.234 10.925 -7.491 1.00 33.31 C ATOM 3456 OG1 THR B 106 14.965 11.413 -8.629 1.00 3.32 O ATOM 3457 CG2 THR B 106 15.212 10.528 -6.399 1.00 5.21 C ATOM 0 H THR B 106 12.025 10.955 -8.852 1.00 61.42 H new ATOM 0 HA THR B 106 14.070 8.931 -8.232 1.00 2.52 H new ATOM 0 HB THR B 106 13.575 11.698 -7.095 1.00 33.31 H new ATOM 0 HG1 THR B 106 15.511 12.182 -8.362 1.00 3.32 H new ATOM 0 HG21 THR B 106 15.800 11.397 -6.104 1.00 5.21 H new ATOM 0 HG22 THR B 106 14.661 10.153 -5.536 1.00 5.21 H new ATOM 0 HG23 THR B 106 15.877 9.749 -6.772 1.00 5.21 H new ATOM 3465 N ILE B 107 12.632 8.045 -6.407 1.00 20.12 N ATOM 3466 CA ILE B 107 11.810 7.539 -5.336 1.00 51.32 C ATOM 3467 C ILE B 107 12.620 7.476 -4.078 1.00 41.51 C ATOM 3468 O ILE B 107 13.830 7.694 -4.112 1.00 43.43 O ATOM 3469 CB ILE B 107 11.161 6.140 -5.628 1.00 43.34 C ATOM 3470 CG1 ILE B 107 12.224 5.079 -5.836 1.00 23.20 C ATOM 3471 CG2 ILE B 107 10.252 6.224 -6.857 1.00 74.34 C ATOM 3472 CD1 ILE B 107 11.708 3.645 -5.865 1.00 74.43 C ATOM 0 H ILE B 107 13.297 7.378 -6.799 1.00 20.12 H new ATOM 0 HA ILE B 107 10.977 8.234 -5.230 1.00 51.32 H new ATOM 0 HB ILE B 107 10.563 5.857 -4.762 1.00 43.34 H new ATOM 0 HG12 ILE B 107 12.740 5.282 -6.774 1.00 23.20 H new ATOM 0 HG13 ILE B 107 12.964 5.167 -5.040 1.00 23.20 H new ATOM 0 HG21 ILE B 107 9.808 5.247 -7.049 1.00 74.34 H new ATOM 0 HG22 ILE B 107 9.462 6.952 -6.676 1.00 74.34 H new ATOM 0 HG23 ILE B 107 10.838 6.532 -7.723 1.00 74.34 H new ATOM 0 HD11 ILE B 107 12.543 2.961 -6.018 1.00 74.43 H new ATOM 0 HD12 ILE B 107 11.220 3.415 -4.918 1.00 74.43 H new ATOM 0 HD13 ILE B 107 10.992 3.532 -6.679 1.00 74.43 H new ATOM 3484 N LYS B 108 11.969 7.199 -2.989 1.00 13.34 N ATOM 3485 CA LYS B 108 12.614 7.149 -1.698 1.00 34.35 C ATOM 3486 C LYS B 108 12.357 5.843 -1.054 1.00 43.54 C ATOM 3487 O LYS B 108 11.211 5.451 -0.919 1.00 5.22 O ATOM 3488 CB LYS B 108 12.134 8.273 -0.767 1.00 41.03 C ATOM 3489 CG LYS B 108 12.725 9.651 -1.025 1.00 74.42 C ATOM 3490 CD LYS B 108 14.242 9.677 -0.770 1.00 55.02 C ATOM 3491 CE LYS B 108 14.613 9.196 0.649 1.00 72.21 C ATOM 3492 NZ LYS B 108 16.059 9.363 0.948 1.00 31.31 N ATOM 0 H LYS B 108 10.969 6.999 -2.964 1.00 13.34 H new ATOM 0 HA LYS B 108 13.682 7.283 -1.867 1.00 34.35 H new ATOM 0 HB2 LYS B 108 11.049 8.344 -0.846 1.00 41.03 H new ATOM 0 HB3 LYS B 108 12.361 7.989 0.260 1.00 41.03 H new ATOM 0 HG2 LYS B 108 12.524 9.946 -2.055 1.00 74.42 H new ATOM 0 HG3 LYS B 108 12.235 10.383 -0.383 1.00 74.42 H new ATOM 0 HD2 LYS B 108 14.741 9.046 -1.506 1.00 55.02 H new ATOM 0 HD3 LYS B 108 14.614 10.691 -0.915 1.00 55.02 H new ATOM 0 HE2 LYS B 108 14.028 9.751 1.382 1.00 72.21 H new ATOM 0 HE3 LYS B 108 14.343 8.145 0.755 1.00 72.21 H new ATOM 0 HZ1 LYS B 108 16.219 9.237 1.968 1.00 31.31 H new ATOM 0 HZ2 LYS B 108 16.607 8.653 0.421 1.00 31.31 H new ATOM 0 HZ3 LYS B 108 16.364 10.316 0.665 1.00 31.31 H new ATOM 3506 N VAL B 109 13.402 5.171 -0.667 1.00 4.50 N ATOM 3507 CA VAL B 109 13.275 3.923 0.030 1.00 21.11 C ATOM 3508 C VAL B 109 14.101 3.962 1.310 1.00 74.22 C ATOM 3509 O VAL B 109 15.305 4.061 1.270 1.00 53.31 O ATOM 3510 CB VAL B 109 13.586 2.650 -0.833 1.00 30.32 C ATOM 3511 CG1 VAL B 109 12.634 2.568 -1.996 1.00 33.31 C ATOM 3512 CG2 VAL B 109 14.990 2.609 -1.364 1.00 11.43 C ATOM 0 H VAL B 109 14.364 5.471 -0.825 1.00 4.50 H new ATOM 0 HA VAL B 109 12.219 3.816 0.279 1.00 21.11 H new ATOM 0 HB VAL B 109 13.464 1.800 -0.162 1.00 30.32 H new ATOM 0 HG11 VAL B 109 12.859 1.681 -2.588 1.00 33.31 H new ATOM 0 HG12 VAL B 109 11.611 2.507 -1.625 1.00 33.31 H new ATOM 0 HG13 VAL B 109 12.742 3.457 -2.618 1.00 33.31 H new ATOM 0 HG21 VAL B 109 15.131 1.701 -1.950 1.00 11.43 H new ATOM 0 HG22 VAL B 109 15.166 3.480 -1.996 1.00 11.43 H new ATOM 0 HG23 VAL B 109 15.694 2.616 -0.532 1.00 11.43 H new ATOM 3522 N LEU B 110 13.461 3.882 2.432 1.00 25.40 N ATOM 3523 CA LEU B 110 14.177 3.990 3.694 1.00 51.34 C ATOM 3524 C LEU B 110 13.498 3.095 4.720 1.00 73.05 C ATOM 3525 O LEU B 110 12.318 2.760 4.547 1.00 2.45 O ATOM 3526 CB LEU B 110 14.404 5.499 4.166 1.00 12.31 C ATOM 3527 CG LEU B 110 13.216 6.383 4.653 1.00 2.41 C ATOM 3528 CD1 LEU B 110 12.096 6.460 3.671 1.00 63.42 C ATOM 3529 CD2 LEU B 110 12.721 5.994 6.024 1.00 12.20 C ATOM 0 H LEU B 110 12.454 3.744 2.517 1.00 25.40 H new ATOM 0 HA LEU B 110 15.197 3.629 3.563 1.00 51.34 H new ATOM 0 HB2 LEU B 110 15.133 5.472 4.976 1.00 12.31 H new ATOM 0 HB3 LEU B 110 14.871 6.025 3.334 1.00 12.31 H new ATOM 0 HG LEU B 110 13.628 7.389 4.734 1.00 2.41 H new ATOM 0 HD11 LEU B 110 11.303 7.090 4.073 1.00 63.42 H new ATOM 0 HD12 LEU B 110 12.460 6.886 2.736 1.00 63.42 H new ATOM 0 HD13 LEU B 110 11.705 5.459 3.485 1.00 63.42 H new ATOM 0 HD21 LEU B 110 11.894 6.644 6.310 1.00 12.20 H new ATOM 0 HD22 LEU B 110 12.380 4.959 6.008 1.00 12.20 H new ATOM 0 HD23 LEU B 110 13.531 6.098 6.746 1.00 12.20 H new ATOM 3541 N PRO B 111 14.191 2.689 5.793 1.00 53.34 N ATOM 3542 CA PRO B 111 13.656 1.710 6.711 1.00 62.41 C ATOM 3543 C PRO B 111 12.614 2.266 7.671 1.00 62.40 C ATOM 3544 O PRO B 111 12.646 3.432 8.075 1.00 14.40 O ATOM 3545 CB PRO B 111 14.888 1.211 7.462 1.00 34.42 C ATOM 3546 CG PRO B 111 15.841 2.354 7.446 1.00 74.15 C ATOM 3547 CD PRO B 111 15.523 3.179 6.226 1.00 11.44 C ATOM 0 HA PRO B 111 13.117 0.927 6.178 1.00 62.41 H new ATOM 0 HB2 PRO B 111 14.637 0.921 8.482 1.00 34.42 H new ATOM 0 HB3 PRO B 111 15.316 0.334 6.978 1.00 34.42 H new ATOM 0 HG2 PRO B 111 15.741 2.952 8.352 1.00 74.15 H new ATOM 0 HG3 PRO B 111 16.870 1.997 7.412 1.00 74.15 H new ATOM 0 HD2 PRO B 111 15.499 4.243 6.460 1.00 11.44 H new ATOM 0 HD3 PRO B 111 16.271 3.041 5.446 1.00 11.44 H new ATOM 3555 N LYS B 112 11.683 1.437 7.988 1.00 54.24 N ATOM 3556 CA LYS B 112 10.658 1.733 8.933 1.00 14.14 C ATOM 3557 C LYS B 112 10.945 0.923 10.169 1.00 20.11 C ATOM 3558 O LYS B 112 11.374 -0.215 10.052 1.00 54.54 O ATOM 3559 CB LYS B 112 9.288 1.431 8.288 1.00 53.30 C ATOM 3560 CG LYS B 112 8.045 1.634 9.153 1.00 31.42 C ATOM 3561 CD LYS B 112 7.952 3.002 9.853 1.00 55.20 C ATOM 3562 CE LYS B 112 8.050 4.194 8.903 1.00 32.42 C ATOM 3563 NZ LYS B 112 9.447 4.533 8.506 1.00 5.31 N ATOM 0 H LYS B 112 11.609 0.503 7.585 1.00 54.24 H new ATOM 0 HA LYS B 112 10.633 2.783 9.223 1.00 14.14 H new ATOM 0 HB2 LYS B 112 9.188 2.057 7.401 1.00 53.30 H new ATOM 0 HB3 LYS B 112 9.297 0.395 7.948 1.00 53.30 H new ATOM 0 HG2 LYS B 112 7.161 1.502 8.528 1.00 31.42 H new ATOM 0 HG3 LYS B 112 8.018 0.852 9.912 1.00 31.42 H new ATOM 0 HD2 LYS B 112 7.007 3.058 10.394 1.00 55.20 H new ATOM 0 HD3 LYS B 112 8.748 3.074 10.594 1.00 55.20 H new ATOM 0 HE2 LYS B 112 7.469 3.981 8.006 1.00 32.42 H new ATOM 0 HE3 LYS B 112 7.596 5.064 9.378 1.00 32.42 H new ATOM 0 HZ1 LYS B 112 9.491 5.528 8.206 1.00 5.31 H new ATOM 0 HZ2 LYS B 112 10.083 4.387 9.316 1.00 5.31 H new ATOM 0 HZ3 LYS B 112 9.742 3.921 7.719 1.00 5.31 H new