USER MOD reduce.3.24.130724 H: found=0, std=0, add=1074, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1074 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: A 155 HIS : no HD1:sc= 0 X(o=1.1,f=1) USER MOD Set 1.2: A 159 THR OG1 : rot 81:sc= 1.11 USER MOD Set 2.1: A 91 CYS SG : rot -160:sc= -3.44! USER MOD Set 2.2: A 93 THR OG1 : rot 83:sc= 0.101 USER MOD Set 3.1: A 87 TYR OH : rot 30:sc= -0.117 USER MOD Set 3.2: A 114 HIS : +bothHN:sc= -5.84! C(o=-6!,f=-20!) USER MOD Set 4.1: A 67 HIS : no HE2:sc= -0.24 K(o=-1.6,f=-3.4) USER MOD Set 4.2: A 98 CYS SG : rot -33:sc= -0.863! USER MOD Set 4.3: A 101 CYS SG : rot -130:sc= -0.469 USER MOD Single : A 31 CYS SG : rot 180:sc= -1.86 USER MOD Single : A 32 TYR OH : rot 50:sc= -1.3 USER MOD Single : A 37 MET CE :methyl 157:sc= -2.16 (180deg=-4.51!) USER MOD Single : A 38 HIS : no HD1:sc= -0.035 X(o=-0.035,f=0) USER MOD Single : A 39 ASN : amide:sc= -5.82! C(o=-5.8!,f=-11!) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.00254 USER MOD Single : A 71 CYS SG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ -131:sc= 0.444 (180deg=-0.949) USER MOD Single : A 85 GLN : amide:sc= -7.37! C(o=-7.4!,f=-21!) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0.0323 USER MOD Single : A 96 SER OG : rot 170:sc= -1.67 USER MOD Single : A 100 SER OG : rot 86:sc= -0.915! USER MOD Single : A 103 GLN : amide:sc= -0.236 X(o=-0.24,f=0) USER MOD Single : A 105 MET CE :methyl -134:sc= -5.05! (180deg=-12.4!) USER MOD Single : A 107 LYS NZ :NH3+ 158:sc= -0.0436 (180deg=-0.404) USER MOD Single : A 110 SER OG : rot 180:sc= -0.656 USER MOD Single : A 111 LYS NZ :NH3+ -108:sc= -0.672 (180deg=-1.65!) USER MOD Single : A 112 ASN : amide:sc= -1.34 K(o=-1.3,f=-2.4!) USER MOD Single : A 113 LYS NZ :NH3+ -153:sc= -0.0285 (180deg=-0.81) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 118 CYS SG : rot 180:sc=-0.00977 USER MOD Single : A 121 THR OG1 : rot 180:sc= -1.01 USER MOD Single : A 125 TYR OH : rot -175:sc= -3! USER MOD Single : A 132 GLN : amide:sc= -4.38! C(o=-4.4!,f=-4.5!) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ -160:sc= -0.0366 (180deg=-0.612) USER MOD Single : A 146 SER OG : rot 58:sc= 0.469 USER MOD Single : A 148 MET CE :methyl -123:sc= -0.0134 (180deg=-1.3) USER MOD Single : A 149 THR OG1 : rot 180:sc= 0.0364 USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot -93:sc= 0.0521 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 CYS SG : rot 180:sc= -0.314 USER MOD Single : A 163 HIS :FLIP no HD1:sc= -4.82! C(o=-5.4!,f=-4.8!) USER MOD Single : A 164 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 166 CYS SG : rot -99:sc= -4.85! USER MOD Single : A 169 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 177 HIS :FLIP no HD1:sc= -1.44! C(o=-5.5!,f=-1.4!) USER MOD Single : A 178 SER OG : rot -150:sc= -0.989 USER MOD Single : A 179 GLN : amide:sc= 0 X(o=0,f=-0.061) USER MOD Single : A 182 SER OG : rot 180:sc= 0 USER MOD Single : A 190 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 191 ASN : amide:sc= -2.9! C(o=-2.9!,f=-6!) USER MOD Single : A 192 GLN : amide:sc= -0.995 X(o=-0.99,f=-0.99) USER MOD Single : A 194 ASN : amide:sc= 0.359 K(o=0.36,f=-2.3!) USER MOD ----------------------------------------------------------------- ATOM 489 N LEU A 30 3.943 -5.590 -4.667 1.00 0.00 N ATOM 490 CA LEU A 30 3.808 -4.738 -3.487 1.00 0.00 C ATOM 491 C LEU A 30 3.663 -5.593 -2.232 1.00 0.00 C ATOM 492 O LEU A 30 3.861 -6.802 -2.276 1.00 0.00 O ATOM 493 CB LEU A 30 2.582 -3.826 -3.649 1.00 0.00 C ATOM 494 CG LEU A 30 1.314 -4.670 -3.906 1.00 0.00 C ATOM 495 CD1 LEU A 30 0.419 -4.687 -2.660 1.00 0.00 C ATOM 496 CD2 LEU A 30 0.524 -4.058 -5.060 1.00 0.00 C ATOM 0 HA LEU A 30 4.703 -4.124 -3.386 1.00 0.00 H new ATOM 0 HB2 LEU A 30 2.449 -3.222 -2.752 1.00 0.00 H new ATOM 0 HB3 LEU A 30 2.741 -3.136 -4.477 1.00 0.00 H new ATOM 0 HG LEU A 30 1.619 -5.688 -4.148 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.470 -5.286 -2.859 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.968 -5.119 -1.823 1.00 0.00 H new ATOM 0 HD13 LEU A 30 0.122 -3.668 -2.412 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.371 -4.652 -5.243 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.237 -3.038 -4.804 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.142 -4.046 -5.958 1.00 0.00 H new ATOM 508 N CYS A 31 3.311 -4.970 -1.113 1.00 0.00 N ATOM 509 CA CYS A 31 3.134 -5.714 0.130 1.00 0.00 C ATOM 510 C CYS A 31 1.798 -5.338 0.744 1.00 0.00 C ATOM 511 O CYS A 31 1.370 -4.188 0.648 1.00 0.00 O ATOM 512 CB CYS A 31 4.268 -5.395 1.112 1.00 0.00 C ATOM 513 SG CYS A 31 3.752 -5.819 2.799 1.00 0.00 S ATOM 0 H CYS A 31 3.144 -3.966 -1.040 1.00 0.00 H new ATOM 0 HA CYS A 31 3.156 -6.783 -0.084 1.00 0.00 H new ATOM 0 HB2 CYS A 31 5.163 -5.956 0.843 1.00 0.00 H new ATOM 0 HB3 CYS A 31 4.525 -4.337 1.055 1.00 0.00 H new ATOM 0 HG CYS A 31 4.716 -5.549 3.628 1.00 0.00 H new ATOM 519 N TYR A 32 1.131 -6.301 1.366 1.00 0.00 N ATOM 520 CA TYR A 32 -0.163 -6.024 1.971 1.00 0.00 C ATOM 521 C TYR A 32 -0.304 -6.785 3.283 1.00 0.00 C ATOM 522 O TYR A 32 -0.066 -7.990 3.351 1.00 0.00 O ATOM 523 CB TYR A 32 -1.281 -6.398 0.969 1.00 0.00 C ATOM 524 CG TYR A 32 -2.216 -7.439 1.543 1.00 0.00 C ATOM 525 CD1 TYR A 32 -1.803 -8.772 1.653 1.00 0.00 C ATOM 526 CD2 TYR A 32 -3.496 -7.067 1.962 1.00 0.00 C ATOM 527 CE1 TYR A 32 -2.671 -9.733 2.181 1.00 0.00 C ATOM 528 CE2 TYR A 32 -4.364 -8.027 2.490 1.00 0.00 C ATOM 529 CZ TYR A 32 -3.953 -9.360 2.600 1.00 0.00 C ATOM 530 OH TYR A 32 -4.811 -10.306 3.119 1.00 0.00 O ATOM 0 H TYR A 32 1.457 -7.263 1.464 1.00 0.00 H new ATOM 0 HA TYR A 32 -0.248 -4.962 2.201 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -1.848 -5.505 0.705 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -0.835 -6.776 0.049 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -0.813 -9.059 1.330 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -3.814 -6.038 1.878 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -2.352 -10.761 2.265 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -5.353 -7.739 2.814 1.00 0.00 H new ATOM 0 HH TYR A 32 -4.350 -10.820 3.815 1.00 0.00 H new ATOM 540 N GLU A 33 -0.683 -6.059 4.321 1.00 0.00 N ATOM 541 CA GLU A 33 -0.851 -6.640 5.636 1.00 0.00 C ATOM 542 C GLU A 33 -2.207 -6.250 6.206 1.00 0.00 C ATOM 543 O GLU A 33 -2.506 -5.067 6.355 1.00 0.00 O ATOM 544 CB GLU A 33 0.267 -6.107 6.529 1.00 0.00 C ATOM 545 CG GLU A 33 1.606 -6.730 6.112 1.00 0.00 C ATOM 546 CD GLU A 33 2.506 -6.908 7.332 1.00 0.00 C ATOM 547 OE1 GLU A 33 2.030 -7.443 8.320 1.00 0.00 O ATOM 548 OE2 GLU A 33 3.656 -6.506 7.262 1.00 0.00 O ATOM 0 H GLU A 33 -0.881 -5.059 4.274 1.00 0.00 H new ATOM 0 HA GLU A 33 -0.805 -7.728 5.581 1.00 0.00 H new ATOM 0 HB2 GLU A 33 0.321 -5.021 6.451 1.00 0.00 H new ATOM 0 HB3 GLU A 33 0.055 -6.342 7.572 1.00 0.00 H new ATOM 0 HG2 GLU A 33 1.434 -7.694 5.634 1.00 0.00 H new ATOM 0 HG3 GLU A 33 2.099 -6.093 5.377 1.00 0.00 H new ATOM 555 N VAL A 34 -3.030 -7.248 6.526 1.00 0.00 N ATOM 556 CA VAL A 34 -4.353 -6.969 7.075 1.00 0.00 C ATOM 557 C VAL A 34 -4.574 -7.668 8.403 1.00 0.00 C ATOM 558 O VAL A 34 -4.073 -8.767 8.641 1.00 0.00 O ATOM 559 CB VAL A 34 -5.455 -7.404 6.105 1.00 0.00 C ATOM 560 CG1 VAL A 34 -5.258 -8.866 5.699 1.00 0.00 C ATOM 561 CG2 VAL A 34 -6.816 -7.244 6.797 1.00 0.00 C ATOM 0 H VAL A 34 -2.809 -8.238 6.417 1.00 0.00 H new ATOM 0 HA VAL A 34 -4.400 -5.891 7.230 1.00 0.00 H new ATOM 0 HB VAL A 34 -5.413 -6.784 5.210 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -6.049 -9.162 5.009 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -4.290 -8.981 5.212 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -5.295 -9.498 6.586 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -7.609 -7.551 6.115 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -6.845 -7.867 7.691 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -6.962 -6.201 7.077 1.00 0.00 H new ATOM 571 N GLU A 35 -5.357 -7.017 9.255 1.00 0.00 N ATOM 572 CA GLU A 35 -5.691 -7.559 10.558 1.00 0.00 C ATOM 573 C GLU A 35 -7.197 -7.581 10.731 1.00 0.00 C ATOM 574 O GLU A 35 -7.897 -6.666 10.299 1.00 0.00 O ATOM 575 CB GLU A 35 -5.050 -6.720 11.664 1.00 0.00 C ATOM 576 CG GLU A 35 -3.527 -6.809 11.547 1.00 0.00 C ATOM 577 CD GLU A 35 -2.883 -6.676 12.923 1.00 0.00 C ATOM 578 OE1 GLU A 35 -3.363 -5.872 13.705 1.00 0.00 O ATOM 579 OE2 GLU A 35 -1.919 -7.380 13.174 1.00 0.00 O ATOM 0 H GLU A 35 -5.773 -6.106 9.061 1.00 0.00 H new ATOM 0 HA GLU A 35 -5.306 -8.576 10.626 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -5.373 -5.682 11.582 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -5.373 -7.078 12.642 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -3.245 -7.760 11.096 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -3.159 -6.022 10.888 1.00 0.00 H new ATOM 586 N ARG A 36 -7.690 -8.640 11.352 1.00 0.00 N ATOM 587 CA ARG A 36 -9.123 -8.788 11.564 1.00 0.00 C ATOM 588 C ARG A 36 -9.494 -8.512 13.015 1.00 0.00 C ATOM 589 O ARG A 36 -8.710 -8.757 13.936 1.00 0.00 O ATOM 590 CB ARG A 36 -9.559 -10.205 11.184 1.00 0.00 C ATOM 591 CG ARG A 36 -8.430 -11.190 11.492 1.00 0.00 C ATOM 592 CD ARG A 36 -8.950 -12.622 11.349 1.00 0.00 C ATOM 593 NE ARG A 36 -10.112 -12.824 12.208 1.00 0.00 N ATOM 594 CZ ARG A 36 -11.023 -13.750 11.928 1.00 0.00 C ATOM 595 NH1 ARG A 36 -10.891 -14.497 10.866 1.00 0.00 N ATOM 596 NH2 ARG A 36 -12.052 -13.911 12.715 1.00 0.00 N ATOM 0 H ARG A 36 -7.124 -9.406 11.717 1.00 0.00 H new ATOM 0 HA ARG A 36 -9.637 -8.063 10.933 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -10.457 -10.481 11.737 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -9.812 -10.246 10.125 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -7.594 -11.026 10.812 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -8.056 -11.027 12.503 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -9.218 -12.817 10.311 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -8.165 -13.330 11.614 1.00 0.00 H new ATOM 0 HE ARG A 36 -10.227 -12.244 13.039 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -10.088 -14.370 10.250 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -11.591 -15.208 10.652 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -12.156 -13.326 13.544 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -12.752 -14.622 12.501 1.00 0.00 H new ATOM 610 N MET A 37 -10.709 -8.016 13.206 1.00 0.00 N ATOM 611 CA MET A 37 -11.212 -7.727 14.538 1.00 0.00 C ATOM 612 C MET A 37 -12.215 -8.792 14.933 1.00 0.00 C ATOM 613 O MET A 37 -13.039 -9.198 14.115 1.00 0.00 O ATOM 614 CB MET A 37 -11.884 -6.362 14.577 1.00 0.00 C ATOM 615 CG MET A 37 -10.852 -5.269 14.277 1.00 0.00 C ATOM 616 SD MET A 37 -11.534 -3.650 14.711 1.00 0.00 S ATOM 617 CE MET A 37 -11.790 -3.985 16.467 1.00 0.00 C ATOM 0 H MET A 37 -11.364 -7.806 12.453 1.00 0.00 H new ATOM 0 HA MET A 37 -10.374 -7.722 15.235 1.00 0.00 H new ATOM 0 HB2 MET A 37 -12.692 -6.323 13.847 1.00 0.00 H new ATOM 0 HB3 MET A 37 -12.331 -6.194 15.557 1.00 0.00 H new ATOM 0 HG2 MET A 37 -9.939 -5.453 14.843 1.00 0.00 H new ATOM 0 HG3 MET A 37 -10.583 -5.290 13.221 1.00 0.00 H new ATOM 0 HE1 MET A 37 -11.815 -3.044 17.017 1.00 0.00 H new ATOM 0 HE2 MET A 37 -12.736 -4.510 16.603 1.00 0.00 H new ATOM 0 HE3 MET A 37 -10.975 -4.603 16.842 1.00 0.00 H new ATOM 627 N HIS A 38 -12.150 -9.232 16.186 1.00 0.00 N ATOM 628 CA HIS A 38 -13.063 -10.252 16.678 1.00 0.00 C ATOM 629 C HIS A 38 -14.009 -9.627 17.675 1.00 0.00 C ATOM 630 O HIS A 38 -13.637 -9.361 18.809 1.00 0.00 O ATOM 631 CB HIS A 38 -12.275 -11.379 17.351 1.00 0.00 C ATOM 632 CG HIS A 38 -13.220 -12.465 17.787 1.00 0.00 C ATOM 633 ND1 HIS A 38 -12.973 -13.257 18.898 1.00 0.00 N ATOM 634 CD2 HIS A 38 -14.415 -12.904 17.272 1.00 0.00 C ATOM 635 CE1 HIS A 38 -13.997 -14.122 19.014 1.00 0.00 C ATOM 636 NE2 HIS A 38 -14.903 -13.950 18.048 1.00 0.00 N ATOM 0 H HIS A 38 -11.476 -8.898 16.875 1.00 0.00 H new ATOM 0 HA HIS A 38 -13.628 -10.667 15.844 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -11.535 -11.783 16.659 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -11.729 -10.991 18.211 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -14.902 -12.499 16.397 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -14.077 -14.865 19.794 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -15.767 -14.473 17.909 1.00 0.00 H new ATOM 645 N ASN A 39 -15.225 -9.363 17.251 1.00 0.00 N ATOM 646 CA ASN A 39 -16.169 -8.740 18.148 1.00 0.00 C ATOM 647 C ASN A 39 -15.683 -7.340 18.492 1.00 0.00 C ATOM 648 O ASN A 39 -14.875 -6.749 17.777 1.00 0.00 O ATOM 649 CB ASN A 39 -16.285 -9.560 19.437 1.00 0.00 C ATOM 650 CG ASN A 39 -17.593 -9.249 20.138 1.00 0.00 C ATOM 651 OD1 ASN A 39 -18.363 -8.403 19.682 1.00 0.00 O ATOM 652 ND2 ASN A 39 -17.890 -9.889 21.230 1.00 0.00 N ATOM 0 H ASN A 39 -15.576 -9.564 16.315 1.00 0.00 H new ATOM 0 HA ASN A 39 -17.144 -8.689 17.663 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -16.231 -10.624 19.206 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -15.447 -9.334 20.097 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -18.766 -9.692 21.715 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -17.248 -10.588 21.602 1.00 0.00 H new ATOM 659 N ASP A 40 -16.190 -6.826 19.590 1.00 0.00 N ATOM 660 CA ASP A 40 -15.831 -5.498 20.059 1.00 0.00 C ATOM 661 C ASP A 40 -14.323 -5.325 20.259 1.00 0.00 C ATOM 662 O ASP A 40 -13.911 -4.341 20.875 1.00 0.00 O ATOM 663 CB ASP A 40 -16.527 -5.232 21.393 1.00 0.00 C ATOM 664 CG ASP A 40 -17.973 -4.808 21.153 1.00 0.00 C ATOM 665 OD1 ASP A 40 -18.195 -3.627 20.939 1.00 0.00 O ATOM 666 OD2 ASP A 40 -18.835 -5.670 21.186 1.00 0.00 O ATOM 0 H ASP A 40 -16.861 -7.312 20.185 1.00 0.00 H new ATOM 0 HA ASP A 40 -16.149 -4.792 19.292 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -16.501 -6.129 22.011 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -15.997 -4.452 21.940 1.00 0.00 H new ATOM 671 N THR A 41 -13.487 -6.262 19.790 1.00 0.00 N ATOM 672 CA THR A 41 -12.056 -6.122 20.006 1.00 0.00 C ATOM 673 C THR A 41 -11.251 -6.375 18.747 1.00 0.00 C ATOM 674 O THR A 41 -11.791 -6.734 17.703 1.00 0.00 O ATOM 675 CB THR A 41 -11.629 -7.047 21.137 1.00 0.00 C ATOM 676 OG1 THR A 41 -10.487 -6.504 21.785 1.00 0.00 O ATOM 677 CG2 THR A 41 -11.302 -8.438 20.603 1.00 0.00 C ATOM 0 H THR A 41 -13.772 -7.096 19.276 1.00 0.00 H new ATOM 0 HA THR A 41 -11.851 -5.089 20.286 1.00 0.00 H new ATOM 0 HB THR A 41 -12.451 -7.134 21.847 1.00 0.00 H new ATOM 0 HG1 THR A 41 -10.212 -7.098 22.515 1.00 0.00 H new ATOM 0 HG21 THR A 41 -10.999 -9.083 21.428 1.00 0.00 H new ATOM 0 HG22 THR A 41 -12.183 -8.858 20.119 1.00 0.00 H new ATOM 0 HG23 THR A 41 -10.489 -8.368 19.880 1.00 0.00 H new ATOM 685 N TRP A 42 -9.952 -6.144 18.863 1.00 0.00 N ATOM 686 CA TRP A 42 -9.042 -6.296 17.731 1.00 0.00 C ATOM 687 C TRP A 42 -8.062 -7.447 17.915 1.00 0.00 C ATOM 688 O TRP A 42 -7.605 -7.726 19.024 1.00 0.00 O ATOM 689 CB TRP A 42 -8.257 -4.999 17.540 1.00 0.00 C ATOM 690 CG TRP A 42 -7.735 -4.530 18.860 1.00 0.00 C ATOM 691 CD1 TRP A 42 -6.712 -5.100 19.539 1.00 0.00 C ATOM 692 CD2 TRP A 42 -8.189 -3.409 19.672 1.00 0.00 C ATOM 693 NE1 TRP A 42 -6.514 -4.400 20.716 1.00 0.00 N ATOM 694 CE2 TRP A 42 -7.398 -3.351 20.842 1.00 0.00 C ATOM 695 CE3 TRP A 42 -9.202 -2.446 19.510 1.00 0.00 C ATOM 696 CZ2 TRP A 42 -7.598 -2.379 21.815 1.00 0.00 C ATOM 697 CZ3 TRP A 42 -9.408 -1.460 20.490 1.00 0.00 C ATOM 698 CH2 TRP A 42 -8.608 -1.428 21.642 1.00 0.00 C ATOM 0 H TRP A 42 -9.501 -5.850 19.729 1.00 0.00 H new ATOM 0 HA TRP A 42 -9.649 -6.520 16.854 1.00 0.00 H new ATOM 0 HB2 TRP A 42 -7.431 -5.161 16.847 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -8.898 -4.236 17.099 1.00 0.00 H new ATOM 0 HD1 TRP A 42 -6.144 -5.960 19.215 1.00 0.00 H new ATOM 0 HE1 TRP A 42 -5.800 -4.632 21.407 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -9.825 -2.465 18.628 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 -6.977 -2.358 22.699 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -10.186 -0.723 20.356 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -8.772 -0.670 22.394 1.00 0.00 H new ATOM 709 N VAL A 43 -7.721 -8.090 16.798 1.00 0.00 N ATOM 710 CA VAL A 43 -6.764 -9.191 16.804 1.00 0.00 C ATOM 711 C VAL A 43 -5.542 -8.784 15.987 1.00 0.00 C ATOM 712 O VAL A 43 -5.654 -8.001 15.044 1.00 0.00 O ATOM 713 CB VAL A 43 -7.395 -10.451 16.205 1.00 0.00 C ATOM 714 CG1 VAL A 43 -6.745 -11.695 16.816 1.00 0.00 C ATOM 715 CG2 VAL A 43 -8.894 -10.458 16.507 1.00 0.00 C ATOM 0 H VAL A 43 -8.096 -7.865 15.876 1.00 0.00 H new ATOM 0 HA VAL A 43 -6.470 -9.410 17.830 1.00 0.00 H new ATOM 0 HB VAL A 43 -7.238 -10.457 15.126 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -7.197 -12.589 16.387 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -5.676 -11.690 16.601 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -6.898 -11.693 17.895 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -9.347 -11.354 16.082 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -9.048 -10.451 17.586 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -9.358 -9.574 16.069 1.00 0.00 H new ATOM 1080 N ARG A 66 -6.336 -4.644 -10.410 1.00 0.00 N ATOM 1081 CA ARG A 66 -6.604 -4.464 -8.988 1.00 0.00 C ATOM 1082 C ARG A 66 -5.347 -3.994 -8.262 1.00 0.00 C ATOM 1083 O ARG A 66 -4.327 -4.685 -8.250 1.00 0.00 O ATOM 1084 CB ARG A 66 -7.093 -5.784 -8.374 1.00 0.00 C ATOM 1085 CG ARG A 66 -8.622 -5.857 -8.440 1.00 0.00 C ATOM 1086 CD ARG A 66 -9.105 -7.101 -7.695 1.00 0.00 C ATOM 1087 NE ARG A 66 -10.450 -7.459 -8.127 1.00 0.00 N ATOM 1088 CZ ARG A 66 -11.091 -8.492 -7.591 1.00 0.00 C ATOM 1089 NH1 ARG A 66 -10.516 -9.201 -6.658 1.00 0.00 N ATOM 1090 NH2 ARG A 66 -12.294 -8.796 -7.995 1.00 0.00 N ATOM 0 HA ARG A 66 -7.379 -3.705 -8.876 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -6.657 -6.627 -8.909 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -6.761 -5.858 -7.338 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -9.059 -4.962 -7.997 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -8.951 -5.891 -9.479 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -8.423 -7.931 -7.880 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -9.098 -6.916 -6.621 1.00 0.00 H new ATOM 0 HE ARG A 66 -10.907 -6.907 -8.853 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -9.576 -8.962 -6.342 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -11.006 -9.994 -6.245 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -12.743 -8.240 -8.723 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -12.785 -9.589 -7.583 1.00 0.00 H new ATOM 1104 N HIS A 67 -5.431 -2.817 -7.651 1.00 0.00 N ATOM 1105 CA HIS A 67 -4.307 -2.262 -6.916 1.00 0.00 C ATOM 1106 C HIS A 67 -4.448 -2.592 -5.432 1.00 0.00 C ATOM 1107 O HIS A 67 -5.554 -2.819 -4.943 1.00 0.00 O ATOM 1108 CB HIS A 67 -4.269 -0.745 -7.123 1.00 0.00 C ATOM 1109 CG HIS A 67 -3.730 -0.404 -8.490 1.00 0.00 C ATOM 1110 ND1 HIS A 67 -3.887 0.862 -9.037 1.00 0.00 N ATOM 1111 CD2 HIS A 67 -3.047 -1.136 -9.437 1.00 0.00 C ATOM 1112 CE1 HIS A 67 -3.313 0.853 -10.254 1.00 0.00 C ATOM 1113 NE2 HIS A 67 -2.787 -0.337 -10.546 1.00 0.00 N ATOM 0 H HIS A 67 -6.266 -2.232 -7.652 1.00 0.00 H new ATOM 0 HA HIS A 67 -3.377 -2.696 -7.282 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -5.272 -0.333 -7.009 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -3.646 -0.284 -6.356 1.00 0.00 H new ATOM 0 HD1 HIS A 67 -4.353 1.655 -8.596 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -2.758 -2.171 -9.334 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -3.282 1.707 -10.915 1.00 0.00 H new ATOM 1121 N ALA A 68 -3.322 -2.630 -4.729 1.00 0.00 N ATOM 1122 CA ALA A 68 -3.321 -2.946 -3.302 1.00 0.00 C ATOM 1123 C ALA A 68 -4.605 -2.458 -2.627 1.00 0.00 C ATOM 1124 O ALA A 68 -5.163 -3.130 -1.757 1.00 0.00 O ATOM 1125 CB ALA A 68 -2.103 -2.303 -2.640 1.00 0.00 C ATOM 0 H ALA A 68 -2.399 -2.447 -5.121 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.273 -4.029 -3.186 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -2.101 -2.538 -1.576 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -1.193 -2.690 -3.099 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -2.145 -1.222 -2.773 1.00 0.00 H new ATOM 1131 N GLU A 69 -5.073 -1.288 -3.039 1.00 0.00 N ATOM 1132 CA GLU A 69 -6.298 -0.729 -2.473 1.00 0.00 C ATOM 1133 C GLU A 69 -7.448 -1.728 -2.637 1.00 0.00 C ATOM 1134 O GLU A 69 -7.991 -2.242 -1.656 1.00 0.00 O ATOM 1135 CB GLU A 69 -6.650 0.610 -3.158 1.00 0.00 C ATOM 1136 CG GLU A 69 -5.631 0.905 -4.261 1.00 0.00 C ATOM 1137 CD GLU A 69 -4.269 1.199 -3.641 1.00 0.00 C ATOM 1138 OE1 GLU A 69 -4.242 1.675 -2.518 1.00 0.00 O ATOM 1139 OE2 GLU A 69 -3.273 0.942 -4.297 1.00 0.00 O ATOM 0 H GLU A 69 -4.631 -0.711 -3.755 1.00 0.00 H new ATOM 0 HA GLU A 69 -6.140 -0.539 -1.411 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -7.654 0.562 -3.580 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -6.651 1.416 -2.425 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -5.557 0.053 -4.937 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -5.961 1.757 -4.856 1.00 0.00 H new ATOM 1146 N LEU A 70 -7.802 -1.998 -3.890 1.00 0.00 N ATOM 1147 CA LEU A 70 -8.880 -2.935 -4.192 1.00 0.00 C ATOM 1148 C LEU A 70 -8.503 -4.343 -3.739 1.00 0.00 C ATOM 1149 O LEU A 70 -9.370 -5.198 -3.552 1.00 0.00 O ATOM 1150 CB LEU A 70 -9.187 -2.949 -5.693 1.00 0.00 C ATOM 1151 CG LEU A 70 -9.232 -1.516 -6.254 1.00 0.00 C ATOM 1152 CD1 LEU A 70 -10.025 -0.595 -5.308 1.00 0.00 C ATOM 1153 CD2 LEU A 70 -7.803 -0.970 -6.443 1.00 0.00 C ATOM 0 H LEU A 70 -7.360 -1.583 -4.710 1.00 0.00 H new ATOM 0 HA LEU A 70 -9.769 -2.607 -3.653 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -8.427 -3.527 -6.219 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -10.142 -3.444 -5.869 1.00 0.00 H new ATOM 0 HG LEU A 70 -9.731 -1.540 -7.223 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -10.048 0.415 -5.718 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -11.044 -0.969 -5.206 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -9.545 -0.578 -4.330 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -7.850 0.044 -6.840 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -7.287 -0.960 -5.483 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -7.259 -1.608 -7.140 1.00 0.00 H new ATOM 1165 N CYS A 71 -7.204 -4.582 -3.582 1.00 0.00 N ATOM 1166 CA CYS A 71 -6.722 -5.902 -3.167 1.00 0.00 C ATOM 1167 C CYS A 71 -7.336 -6.341 -1.834 1.00 0.00 C ATOM 1168 O CYS A 71 -8.092 -7.318 -1.782 1.00 0.00 O ATOM 1169 CB CYS A 71 -5.194 -5.910 -3.059 1.00 0.00 C ATOM 1170 SG CYS A 71 -4.629 -7.606 -2.787 1.00 0.00 S ATOM 0 H CYS A 71 -6.471 -3.889 -3.733 1.00 0.00 H new ATOM 0 HA CYS A 71 -7.034 -6.612 -3.933 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -4.751 -5.507 -3.970 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -4.872 -5.270 -2.238 1.00 0.00 H new ATOM 0 HG CYS A 71 -3.332 -7.622 -2.696 1.00 0.00 H new ATOM 1176 N PHE A 72 -7.035 -5.630 -0.747 1.00 0.00 N ATOM 1177 CA PHE A 72 -7.615 -6.024 0.532 1.00 0.00 C ATOM 1178 C PHE A 72 -9.115 -5.864 0.440 1.00 0.00 C ATOM 1179 O PHE A 72 -9.879 -6.716 0.882 1.00 0.00 O ATOM 1180 CB PHE A 72 -7.057 -5.212 1.700 1.00 0.00 C ATOM 1181 CG PHE A 72 -7.077 -3.737 1.391 1.00 0.00 C ATOM 1182 CD1 PHE A 72 -8.276 -3.014 1.466 1.00 0.00 C ATOM 1183 CD2 PHE A 72 -5.887 -3.083 1.054 1.00 0.00 C ATOM 1184 CE1 PHE A 72 -8.280 -1.649 1.197 1.00 0.00 C ATOM 1185 CE2 PHE A 72 -5.896 -1.718 0.791 1.00 0.00 C ATOM 1186 CZ PHE A 72 -7.090 -1.005 0.861 1.00 0.00 C ATOM 0 H PHE A 72 -6.422 -4.815 -0.724 1.00 0.00 H new ATOM 0 HA PHE A 72 -7.352 -7.063 0.731 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -7.645 -5.407 2.597 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -6.036 -5.529 1.913 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -9.195 -3.516 1.732 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -4.962 -3.638 0.998 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -9.202 -1.090 1.248 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -4.978 -1.211 0.533 1.00 0.00 H new ATOM 0 HZ PHE A 72 -7.094 0.055 0.653 1.00 0.00 H new ATOM 1196 N LEU A 73 -9.532 -4.785 -0.191 1.00 0.00 N ATOM 1197 CA LEU A 73 -10.941 -4.544 -0.404 1.00 0.00 C ATOM 1198 C LEU A 73 -11.627 -5.867 -0.746 1.00 0.00 C ATOM 1199 O LEU A 73 -12.807 -6.071 -0.463 1.00 0.00 O ATOM 1200 CB LEU A 73 -11.044 -3.576 -1.570 1.00 0.00 C ATOM 1201 CG LEU A 73 -12.262 -2.668 -1.427 1.00 0.00 C ATOM 1202 CD1 LEU A 73 -12.062 -1.690 -0.251 1.00 0.00 C ATOM 1203 CD2 LEU A 73 -12.429 -1.891 -2.739 1.00 0.00 C ATOM 0 H LEU A 73 -8.915 -4.063 -0.564 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.422 -4.130 0.482 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -10.140 -2.970 -1.624 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -11.110 -4.134 -2.504 1.00 0.00 H new ATOM 0 HG LEU A 73 -13.153 -3.262 -1.224 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -12.938 -1.047 -0.159 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -11.927 -2.254 0.672 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -11.180 -1.077 -0.434 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -13.294 -1.233 -2.664 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -11.535 -1.296 -2.926 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -12.576 -2.592 -3.561 1.00 0.00 H new ATOM 1215 N ASP A 74 -10.849 -6.756 -1.365 1.00 0.00 N ATOM 1216 CA ASP A 74 -11.342 -8.071 -1.766 1.00 0.00 C ATOM 1217 C ASP A 74 -11.040 -9.142 -0.719 1.00 0.00 C ATOM 1218 O ASP A 74 -11.701 -10.178 -0.696 1.00 0.00 O ATOM 1219 CB ASP A 74 -10.715 -8.474 -3.101 1.00 0.00 C ATOM 1220 CG ASP A 74 -11.468 -9.661 -3.692 1.00 0.00 C ATOM 1221 OD1 ASP A 74 -12.662 -9.533 -3.907 1.00 0.00 O ATOM 1222 OD2 ASP A 74 -10.840 -10.681 -3.921 1.00 0.00 O ATOM 0 H ASP A 74 -9.871 -6.587 -1.600 1.00 0.00 H new ATOM 0 HA ASP A 74 -12.425 -7.997 -1.865 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -10.743 -7.633 -3.794 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -9.666 -8.733 -2.956 1.00 0.00 H new ATOM 1227 N VAL A 75 -10.046 -8.922 0.147 1.00 0.00 N ATOM 1228 CA VAL A 75 -9.734 -9.928 1.152 1.00 0.00 C ATOM 1229 C VAL A 75 -10.797 -9.974 2.257 1.00 0.00 C ATOM 1230 O VAL A 75 -11.277 -11.025 2.631 1.00 0.00 O ATOM 1231 CB VAL A 75 -8.362 -9.689 1.781 1.00 0.00 C ATOM 1232 CG1 VAL A 75 -8.449 -8.665 2.918 1.00 0.00 C ATOM 1233 CG2 VAL A 75 -7.896 -11.017 2.343 1.00 0.00 C ATOM 0 H VAL A 75 -9.464 -8.084 0.170 1.00 0.00 H new ATOM 0 HA VAL A 75 -9.723 -10.887 0.634 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.671 -9.300 1.033 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -7.459 -8.514 3.348 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -8.824 -7.719 2.528 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -9.127 -9.033 3.688 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -6.916 -10.893 2.804 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -8.608 -11.365 3.092 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.829 -11.749 1.538 1.00 0.00 H new ATOM 1243 N ILE A 76 -11.136 -8.826 2.803 1.00 0.00 N ATOM 1244 CA ILE A 76 -12.128 -8.775 3.887 1.00 0.00 C ATOM 1245 C ILE A 76 -13.267 -9.797 3.665 1.00 0.00 C ATOM 1246 O ILE A 76 -13.543 -10.600 4.556 1.00 0.00 O ATOM 1247 CB ILE A 76 -12.708 -7.352 4.049 1.00 0.00 C ATOM 1248 CG1 ILE A 76 -11.786 -6.321 3.394 1.00 0.00 C ATOM 1249 CG2 ILE A 76 -12.855 -7.002 5.526 1.00 0.00 C ATOM 1250 CD1 ILE A 76 -10.452 -6.262 4.149 1.00 0.00 C ATOM 0 H ILE A 76 -10.753 -7.921 2.529 1.00 0.00 H new ATOM 0 HA ILE A 76 -11.609 -9.042 4.808 1.00 0.00 H new ATOM 0 HB ILE A 76 -13.685 -7.332 3.566 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -11.612 -6.586 2.351 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -12.261 -5.340 3.399 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -13.265 -5.997 5.623 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -13.527 -7.715 6.004 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -11.879 -7.044 6.009 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -9.800 -5.526 3.678 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -10.633 -5.976 5.185 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -9.974 -7.241 4.121 1.00 0.00 H new ATOM 1262 N PRO A 77 -13.926 -9.805 2.518 1.00 0.00 N ATOM 1263 CA PRO A 77 -15.032 -10.775 2.235 1.00 0.00 C ATOM 1264 C PRO A 77 -14.494 -12.190 2.067 1.00 0.00 C ATOM 1265 O PRO A 77 -15.245 -13.147 1.883 1.00 0.00 O ATOM 1266 CB PRO A 77 -15.633 -10.256 0.925 1.00 0.00 C ATOM 1267 CG PRO A 77 -14.524 -9.546 0.253 1.00 0.00 C ATOM 1268 CD PRO A 77 -13.705 -8.914 1.369 1.00 0.00 C ATOM 0 HA PRO A 77 -15.760 -10.835 3.044 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -16.008 -11.075 0.311 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -16.473 -9.588 1.113 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -13.918 -10.234 -0.336 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -14.903 -8.788 -0.433 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -12.649 -8.856 1.106 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -14.037 -7.898 1.582 1.00 0.00 H new ATOM 1276 N PHE A 78 -13.177 -12.291 2.126 1.00 0.00 N ATOM 1277 CA PHE A 78 -12.481 -13.574 1.983 1.00 0.00 C ATOM 1278 C PHE A 78 -12.601 -14.409 3.255 1.00 0.00 C ATOM 1279 O PHE A 78 -12.771 -15.626 3.188 1.00 0.00 O ATOM 1280 CB PHE A 78 -11.006 -13.314 1.670 1.00 0.00 C ATOM 1281 CG PHE A 78 -10.348 -14.524 1.081 1.00 0.00 C ATOM 1282 CD1 PHE A 78 -10.660 -14.918 -0.217 1.00 0.00 C ATOM 1283 CD2 PHE A 78 -9.416 -15.241 1.835 1.00 0.00 C ATOM 1284 CE1 PHE A 78 -10.044 -16.047 -0.772 1.00 0.00 C ATOM 1285 CE2 PHE A 78 -8.796 -16.369 1.285 1.00 0.00 C ATOM 1286 CZ PHE A 78 -9.112 -16.774 -0.019 1.00 0.00 C ATOM 0 H PHE A 78 -12.556 -11.495 2.273 1.00 0.00 H new ATOM 0 HA PHE A 78 -12.942 -14.132 1.168 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -10.922 -12.478 0.975 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -10.485 -13.023 2.582 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -11.376 -14.354 -0.796 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -9.174 -14.926 2.839 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -10.287 -16.357 -1.778 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -8.075 -16.926 1.865 1.00 0.00 H new ATOM 0 HZ PHE A 78 -8.637 -17.646 -0.444 1.00 0.00 H new ATOM 1296 N TRP A 79 -12.516 -13.758 4.416 1.00 0.00 N ATOM 1297 CA TRP A 79 -12.623 -14.484 5.675 1.00 0.00 C ATOM 1298 C TRP A 79 -14.095 -14.711 6.032 1.00 0.00 C ATOM 1299 O TRP A 79 -14.433 -15.646 6.759 1.00 0.00 O ATOM 1300 CB TRP A 79 -11.949 -13.711 6.814 1.00 0.00 C ATOM 1301 CG TRP A 79 -10.865 -12.808 6.313 1.00 0.00 C ATOM 1302 CD1 TRP A 79 -9.941 -13.102 5.369 1.00 0.00 C ATOM 1303 CD2 TRP A 79 -10.582 -11.457 6.754 1.00 0.00 C ATOM 1304 NE1 TRP A 79 -9.106 -12.002 5.208 1.00 0.00 N ATOM 1305 CE2 TRP A 79 -9.467 -10.959 6.045 1.00 0.00 C ATOM 1306 CE3 TRP A 79 -11.194 -10.627 7.699 1.00 0.00 C ATOM 1307 CZ2 TRP A 79 -8.974 -9.666 6.278 1.00 0.00 C ATOM 1308 CZ3 TRP A 79 -10.710 -9.335 7.935 1.00 0.00 C ATOM 1309 CH2 TRP A 79 -9.605 -8.854 7.230 1.00 0.00 C ATOM 0 H TRP A 79 -12.376 -12.752 4.508 1.00 0.00 H new ATOM 0 HA TRP A 79 -12.120 -15.443 5.549 1.00 0.00 H new ATOM 0 HB2 TRP A 79 -12.697 -13.121 7.344 1.00 0.00 H new ATOM 0 HB3 TRP A 79 -11.531 -14.416 7.533 1.00 0.00 H new ATOM 0 HD1 TRP A 79 -9.865 -14.035 4.831 1.00 0.00 H new ATOM 0 HE1 TRP A 79 -8.324 -11.967 4.554 1.00 0.00 H new ATOM 0 HE3 TRP A 79 -12.049 -10.987 8.252 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 -8.118 -9.301 5.730 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 -11.194 -8.706 8.667 1.00 0.00 H new ATOM 0 HH2 TRP A 79 -9.237 -7.856 7.418 1.00 0.00 H new ATOM 1320 N LYS A 80 -14.960 -13.850 5.508 1.00 0.00 N ATOM 1321 CA LYS A 80 -16.391 -13.943 5.756 1.00 0.00 C ATOM 1322 C LYS A 80 -16.717 -13.965 7.255 1.00 0.00 C ATOM 1323 O LYS A 80 -17.362 -14.895 7.742 1.00 0.00 O ATOM 1324 CB LYS A 80 -16.957 -15.193 5.073 1.00 0.00 C ATOM 1325 CG LYS A 80 -16.029 -15.632 3.942 1.00 0.00 C ATOM 1326 CD LYS A 80 -16.814 -16.484 2.942 1.00 0.00 C ATOM 1327 CE LYS A 80 -15.884 -16.938 1.815 1.00 0.00 C ATOM 1328 NZ LYS A 80 -15.297 -15.744 1.144 1.00 0.00 N ATOM 0 H LYS A 80 -14.690 -13.074 4.904 1.00 0.00 H new ATOM 0 HA LYS A 80 -16.858 -13.052 5.336 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -17.065 -15.998 5.800 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -17.952 -14.984 4.679 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -15.609 -14.759 3.442 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -15.192 -16.203 4.344 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -17.243 -17.351 3.445 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -17.645 -15.910 2.533 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -15.091 -17.570 2.216 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -16.437 -17.539 1.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -15.403 -15.838 0.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -15.790 -14.887 1.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -14.287 -15.673 1.383 1.00 0.00 H new ATOM 1342 N LEU A 81 -16.287 -12.936 7.986 1.00 0.00 N ATOM 1343 CA LEU A 81 -16.569 -12.870 9.416 1.00 0.00 C ATOM 1344 C LEU A 81 -18.051 -12.724 9.677 1.00 0.00 C ATOM 1345 O LEU A 81 -18.902 -13.205 8.929 1.00 0.00 O ATOM 1346 CB LEU A 81 -15.898 -11.662 10.053 1.00 0.00 C ATOM 1347 CG LEU A 81 -14.533 -11.430 9.415 1.00 0.00 C ATOM 1348 CD1 LEU A 81 -14.674 -10.647 8.094 1.00 0.00 C ATOM 1349 CD2 LEU A 81 -13.664 -10.659 10.413 1.00 0.00 C ATOM 0 H LEU A 81 -15.751 -12.150 7.617 1.00 0.00 H new ATOM 0 HA LEU A 81 -16.189 -13.798 9.843 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -16.523 -10.778 9.926 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -15.786 -11.821 11.125 1.00 0.00 H new ATOM 0 HG LEU A 81 -14.066 -12.386 9.177 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -13.688 -10.492 7.656 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -15.295 -11.213 7.400 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -15.139 -9.681 8.291 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -12.681 -10.481 9.978 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -14.136 -9.704 10.645 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -13.556 -11.242 11.328 1.00 0.00 H new ATOM 1361 N ASP A 82 -18.316 -11.986 10.738 1.00 0.00 N ATOM 1362 CA ASP A 82 -19.660 -11.656 11.146 1.00 0.00 C ATOM 1363 C ASP A 82 -19.806 -10.144 11.053 1.00 0.00 C ATOM 1364 O ASP A 82 -18.996 -9.471 10.416 1.00 0.00 O ATOM 1365 CB ASP A 82 -19.916 -12.126 12.584 1.00 0.00 C ATOM 1366 CG ASP A 82 -20.452 -13.555 12.580 1.00 0.00 C ATOM 1367 OD1 ASP A 82 -21.500 -13.773 11.993 1.00 0.00 O ATOM 1368 OD2 ASP A 82 -19.808 -14.410 13.164 1.00 0.00 O ATOM 0 H ASP A 82 -17.594 -11.597 11.344 1.00 0.00 H new ATOM 0 HA ASP A 82 -20.386 -12.153 10.502 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -18.992 -12.077 13.161 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -20.631 -11.462 13.070 1.00 0.00 H new ATOM 1373 N LEU A 83 -20.826 -9.618 11.687 1.00 0.00 N ATOM 1374 CA LEU A 83 -21.067 -8.186 11.677 1.00 0.00 C ATOM 1375 C LEU A 83 -20.401 -7.523 12.883 1.00 0.00 C ATOM 1376 O LEU A 83 -19.639 -6.566 12.741 1.00 0.00 O ATOM 1377 CB LEU A 83 -22.578 -7.940 11.712 1.00 0.00 C ATOM 1378 CG LEU A 83 -22.929 -6.576 11.119 1.00 0.00 C ATOM 1379 CD1 LEU A 83 -22.167 -5.481 11.859 1.00 0.00 C ATOM 1380 CD2 LEU A 83 -22.568 -6.549 9.632 1.00 0.00 C ATOM 0 H LEU A 83 -21.508 -10.158 12.220 1.00 0.00 H new ATOM 0 HA LEU A 83 -20.641 -7.753 10.772 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -23.090 -8.725 11.155 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -22.934 -7.995 12.741 1.00 0.00 H new ATOM 0 HG LEU A 83 -23.999 -6.402 11.228 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -22.420 -4.510 11.433 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -22.440 -5.497 12.914 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -21.095 -5.653 11.759 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -22.820 -5.574 9.214 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -21.500 -6.729 9.514 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -23.127 -7.324 9.108 1.00 0.00 H new ATOM 1392 N ASP A 84 -20.701 -8.042 14.067 1.00 0.00 N ATOM 1393 CA ASP A 84 -20.144 -7.498 15.302 1.00 0.00 C ATOM 1394 C ASP A 84 -18.626 -7.386 15.219 1.00 0.00 C ATOM 1395 O ASP A 84 -17.994 -6.757 16.067 1.00 0.00 O ATOM 1396 CB ASP A 84 -20.526 -8.396 16.481 1.00 0.00 C ATOM 1397 CG ASP A 84 -20.199 -7.697 17.796 1.00 0.00 C ATOM 1398 OD1 ASP A 84 -19.644 -6.611 17.745 1.00 0.00 O ATOM 1399 OD2 ASP A 84 -20.509 -8.256 18.834 1.00 0.00 O ATOM 0 H ASP A 84 -21.326 -8.837 14.200 1.00 0.00 H new ATOM 0 HA ASP A 84 -20.555 -6.499 15.449 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -21.589 -8.632 16.440 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -19.987 -9.341 16.418 1.00 0.00 H new ATOM 1404 N GLN A 85 -18.045 -8.006 14.199 1.00 0.00 N ATOM 1405 CA GLN A 85 -16.596 -7.974 14.027 1.00 0.00 C ATOM 1406 C GLN A 85 -16.181 -6.772 13.168 1.00 0.00 C ATOM 1407 O GLN A 85 -17.031 -5.995 12.732 1.00 0.00 O ATOM 1408 CB GLN A 85 -16.115 -9.280 13.374 1.00 0.00 C ATOM 1409 CG GLN A 85 -17.188 -10.361 13.506 1.00 0.00 C ATOM 1410 CD GLN A 85 -17.464 -10.651 14.979 1.00 0.00 C ATOM 1411 OE1 GLN A 85 -17.785 -9.743 15.745 1.00 0.00 O ATOM 1412 NE2 GLN A 85 -17.354 -11.872 15.424 1.00 0.00 N ATOM 0 H GLN A 85 -18.548 -8.532 13.485 1.00 0.00 H new ATOM 0 HA GLN A 85 -16.132 -7.874 15.008 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -15.889 -9.108 12.322 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -15.192 -9.614 13.848 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -18.105 -10.036 13.014 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -16.861 -11.271 13.003 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -17.088 -12.624 14.789 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -17.534 -12.075 16.407 1.00 0.00 H new ATOM 1421 N ASP A 86 -14.873 -6.613 12.937 1.00 0.00 N ATOM 1422 CA ASP A 86 -14.383 -5.488 12.137 1.00 0.00 C ATOM 1423 C ASP A 86 -13.065 -5.843 11.433 1.00 0.00 C ATOM 1424 O ASP A 86 -12.521 -6.927 11.635 1.00 0.00 O ATOM 1425 CB ASP A 86 -14.182 -4.266 13.050 1.00 0.00 C ATOM 1426 CG ASP A 86 -15.368 -3.309 12.937 1.00 0.00 C ATOM 1427 OD1 ASP A 86 -15.486 -2.662 11.911 1.00 0.00 O ATOM 1428 OD2 ASP A 86 -16.140 -3.240 13.880 1.00 0.00 O ATOM 0 H ASP A 86 -14.147 -7.238 13.286 1.00 0.00 H new ATOM 0 HA ASP A 86 -15.121 -5.257 11.369 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -14.068 -4.592 14.084 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -13.263 -3.748 12.776 1.00 0.00 H new ATOM 1433 N TYR A 87 -12.557 -4.923 10.608 1.00 0.00 N ATOM 1434 CA TYR A 87 -11.300 -5.159 9.889 1.00 0.00 C ATOM 1435 C TYR A 87 -10.402 -3.919 9.915 1.00 0.00 C ATOM 1436 O TYR A 87 -10.809 -2.832 9.506 1.00 0.00 O ATOM 1437 CB TYR A 87 -11.574 -5.545 8.419 1.00 0.00 C ATOM 1438 CG TYR A 87 -13.055 -5.698 8.187 1.00 0.00 C ATOM 1439 CD1 TYR A 87 -13.708 -6.885 8.538 1.00 0.00 C ATOM 1440 CD2 TYR A 87 -13.772 -4.654 7.601 1.00 0.00 C ATOM 1441 CE1 TYR A 87 -15.079 -7.024 8.301 1.00 0.00 C ATOM 1442 CE2 TYR A 87 -15.142 -4.790 7.365 1.00 0.00 C ATOM 1443 CZ TYR A 87 -15.797 -5.975 7.714 1.00 0.00 C ATOM 1444 OH TYR A 87 -17.149 -6.113 7.478 1.00 0.00 O ATOM 0 H TYR A 87 -12.990 -4.018 10.422 1.00 0.00 H new ATOM 0 HA TYR A 87 -10.791 -5.979 10.395 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -11.172 -4.781 7.754 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -11.063 -6.477 8.179 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -13.153 -7.693 8.992 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -13.267 -3.739 7.329 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -15.584 -7.940 8.571 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -15.695 -3.980 6.913 1.00 0.00 H new ATOM 0 HH TYR A 87 -17.539 -6.712 8.148 1.00 0.00 H new ATOM 1454 N ARG A 88 -9.162 -4.116 10.348 1.00 0.00 N ATOM 1455 CA ARG A 88 -8.175 -3.039 10.373 1.00 0.00 C ATOM 1456 C ARG A 88 -7.084 -3.404 9.378 1.00 0.00 C ATOM 1457 O ARG A 88 -6.141 -4.122 9.707 1.00 0.00 O ATOM 1458 CB ARG A 88 -7.580 -2.881 11.773 1.00 0.00 C ATOM 1459 CG ARG A 88 -8.594 -2.192 12.688 1.00 0.00 C ATOM 1460 CD ARG A 88 -8.030 -2.108 14.106 1.00 0.00 C ATOM 1461 NE ARG A 88 -6.682 -1.550 14.079 1.00 0.00 N ATOM 1462 CZ ARG A 88 -5.943 -1.477 15.182 1.00 0.00 C ATOM 1463 NH1 ARG A 88 -6.417 -1.913 16.317 1.00 0.00 N ATOM 1464 NH2 ARG A 88 -4.743 -0.969 15.129 1.00 0.00 N ATOM 0 H ARG A 88 -8.814 -5.013 10.687 1.00 0.00 H new ATOM 0 HA ARG A 88 -8.643 -2.091 10.108 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -7.314 -3.857 12.178 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -6.662 -2.295 11.725 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -8.816 -1.192 12.314 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -9.532 -2.747 12.691 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -8.676 -1.487 14.726 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -8.012 -3.100 14.558 1.00 0.00 H new ATOM 0 HE ARG A 88 -6.299 -1.209 13.197 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -7.355 -2.310 16.359 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -5.849 -1.856 17.162 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -4.372 -0.628 14.242 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -4.175 -0.913 15.975 1.00 0.00 H new ATOM 1478 N VAL A 89 -7.262 -2.962 8.142 1.00 0.00 N ATOM 1479 CA VAL A 89 -6.334 -3.304 7.072 1.00 0.00 C ATOM 1480 C VAL A 89 -5.151 -2.335 6.957 1.00 0.00 C ATOM 1481 O VAL A 89 -5.240 -1.164 7.330 1.00 0.00 O ATOM 1482 CB VAL A 89 -7.103 -3.354 5.755 1.00 0.00 C ATOM 1483 CG1 VAL A 89 -6.460 -4.363 4.793 1.00 0.00 C ATOM 1484 CG2 VAL A 89 -8.559 -3.758 6.031 1.00 0.00 C ATOM 0 H VAL A 89 -8.039 -2.367 7.854 1.00 0.00 H new ATOM 0 HA VAL A 89 -5.903 -4.277 7.310 1.00 0.00 H new ATOM 0 HB VAL A 89 -7.075 -2.367 5.292 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -7.022 -4.385 3.859 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -5.431 -4.067 4.590 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -6.470 -5.355 5.246 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -9.111 -3.794 5.092 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -8.581 -4.740 6.503 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -9.020 -3.026 6.694 1.00 0.00 H new ATOM 1494 N THR A 90 -4.038 -2.859 6.429 1.00 0.00 N ATOM 1495 CA THR A 90 -2.817 -2.082 6.253 1.00 0.00 C ATOM 1496 C THR A 90 -2.121 -2.474 4.942 1.00 0.00 C ATOM 1497 O THR A 90 -1.901 -3.654 4.672 1.00 0.00 O ATOM 1498 CB THR A 90 -1.892 -2.335 7.458 1.00 0.00 C ATOM 1499 OG1 THR A 90 -2.229 -1.430 8.498 1.00 0.00 O ATOM 1500 CG2 THR A 90 -0.417 -2.140 7.081 1.00 0.00 C ATOM 0 H THR A 90 -3.964 -3.827 6.116 1.00 0.00 H new ATOM 0 HA THR A 90 -3.058 -1.020 6.198 1.00 0.00 H new ATOM 0 HB THR A 90 -2.028 -3.366 7.786 1.00 0.00 H new ATOM 0 HG1 THR A 90 -1.645 -1.586 9.270 1.00 0.00 H new ATOM 0 HG21 THR A 90 0.209 -2.326 7.954 1.00 0.00 H new ATOM 0 HG22 THR A 90 -0.149 -2.837 6.287 1.00 0.00 H new ATOM 0 HG23 THR A 90 -0.262 -1.118 6.734 1.00 0.00 H new ATOM 1508 N CYS A 91 -1.768 -1.476 4.141 1.00 0.00 N ATOM 1509 CA CYS A 91 -1.085 -1.712 2.870 1.00 0.00 C ATOM 1510 C CYS A 91 0.330 -1.140 2.909 1.00 0.00 C ATOM 1511 O CYS A 91 0.570 -0.106 3.533 1.00 0.00 O ATOM 1512 CB CYS A 91 -1.858 -1.051 1.723 1.00 0.00 C ATOM 1513 SG CYS A 91 -0.978 -1.340 0.168 1.00 0.00 S ATOM 0 H CYS A 91 -1.943 -0.493 4.348 1.00 0.00 H new ATOM 0 HA CYS A 91 -1.035 -2.789 2.707 1.00 0.00 H new ATOM 0 HB2 CYS A 91 -2.867 -1.460 1.665 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -1.958 0.019 1.905 1.00 0.00 H new ATOM 0 HG CYS A 91 -1.361 -0.467 -0.716 1.00 0.00 H new ATOM 1519 N PHE A 92 1.263 -1.808 2.228 1.00 0.00 N ATOM 1520 CA PHE A 92 2.650 -1.340 2.184 1.00 0.00 C ATOM 1521 C PHE A 92 3.177 -1.347 0.755 1.00 0.00 C ATOM 1522 O PHE A 92 3.518 -2.400 0.217 1.00 0.00 O ATOM 1523 CB PHE A 92 3.564 -2.232 3.028 1.00 0.00 C ATOM 1524 CG PHE A 92 3.299 -2.052 4.506 1.00 0.00 C ATOM 1525 CD1 PHE A 92 3.778 -0.918 5.168 1.00 0.00 C ATOM 1526 CD2 PHE A 92 2.606 -3.034 5.223 1.00 0.00 C ATOM 1527 CE1 PHE A 92 3.559 -0.760 6.541 1.00 0.00 C ATOM 1528 CE2 PHE A 92 2.391 -2.877 6.599 1.00 0.00 C ATOM 1529 CZ PHE A 92 2.866 -1.740 7.256 1.00 0.00 C ATOM 0 H PHE A 92 1.087 -2.666 1.705 1.00 0.00 H new ATOM 0 HA PHE A 92 2.654 -0.326 2.583 1.00 0.00 H new ATOM 0 HB2 PHE A 92 3.411 -3.276 2.754 1.00 0.00 H new ATOM 0 HB3 PHE A 92 4.606 -1.996 2.812 1.00 0.00 H new ATOM 0 HD1 PHE A 92 4.319 -0.162 4.618 1.00 0.00 H new ATOM 0 HD2 PHE A 92 2.237 -3.913 4.716 1.00 0.00 H new ATOM 0 HE1 PHE A 92 3.926 0.120 7.048 1.00 0.00 H new ATOM 0 HE2 PHE A 92 1.857 -3.636 7.152 1.00 0.00 H new ATOM 0 HZ PHE A 92 2.698 -1.618 8.316 1.00 0.00 H new ATOM 1539 N THR A 93 3.264 -0.167 0.150 1.00 0.00 N ATOM 1540 CA THR A 93 3.782 -0.063 -1.212 1.00 0.00 C ATOM 1541 C THR A 93 4.549 1.243 -1.394 1.00 0.00 C ATOM 1542 O THR A 93 4.546 2.097 -0.511 1.00 0.00 O ATOM 1543 CB THR A 93 2.641 -0.148 -2.230 1.00 0.00 C ATOM 1544 OG1 THR A 93 1.657 -1.061 -1.763 1.00 0.00 O ATOM 1545 CG2 THR A 93 3.192 -0.631 -3.577 1.00 0.00 C ATOM 0 H THR A 93 2.987 0.719 0.572 1.00 0.00 H new ATOM 0 HA THR A 93 4.464 -0.896 -1.381 1.00 0.00 H new ATOM 0 HB THR A 93 2.191 0.837 -2.355 1.00 0.00 H new ATOM 0 HG1 THR A 93 1.057 -0.604 -1.137 1.00 0.00 H new ATOM 0 HG21 THR A 93 2.380 -0.692 -4.302 1.00 0.00 H new ATOM 0 HG22 THR A 93 3.946 0.071 -3.934 1.00 0.00 H new ATOM 0 HG23 THR A 93 3.642 -1.616 -3.454 1.00 0.00 H new ATOM 1553 N SER A 94 5.222 1.383 -2.532 1.00 0.00 N ATOM 1554 CA SER A 94 6.007 2.583 -2.802 1.00 0.00 C ATOM 1555 C SER A 94 5.163 3.686 -3.438 1.00 0.00 C ATOM 1556 O SER A 94 5.590 4.839 -3.490 1.00 0.00 O ATOM 1557 CB SER A 94 7.169 2.240 -3.733 1.00 0.00 C ATOM 1558 OG SER A 94 6.714 1.345 -4.736 1.00 0.00 O ATOM 0 H SER A 94 5.240 0.686 -3.277 1.00 0.00 H new ATOM 0 HA SER A 94 6.382 2.952 -1.847 1.00 0.00 H new ATOM 0 HB2 SER A 94 7.564 3.147 -4.190 1.00 0.00 H new ATOM 0 HB3 SER A 94 7.983 1.787 -3.167 1.00 0.00 H new ATOM 0 HG SER A 94 7.455 1.123 -5.337 1.00 0.00 H new ATOM 1564 N TRP A 95 3.975 3.341 -3.937 1.00 0.00 N ATOM 1565 CA TRP A 95 3.116 4.344 -4.575 1.00 0.00 C ATOM 1566 C TRP A 95 1.745 4.428 -3.912 1.00 0.00 C ATOM 1567 O TRP A 95 1.235 3.452 -3.362 1.00 0.00 O ATOM 1568 CB TRP A 95 2.941 4.026 -6.067 1.00 0.00 C ATOM 1569 CG TRP A 95 2.697 2.569 -6.255 1.00 0.00 C ATOM 1570 CD1 TRP A 95 3.622 1.615 -6.066 1.00 0.00 C ATOM 1571 CD2 TRP A 95 1.480 1.883 -6.678 1.00 0.00 C ATOM 1572 NE1 TRP A 95 3.057 0.379 -6.327 1.00 0.00 N ATOM 1573 CE2 TRP A 95 1.740 0.495 -6.709 1.00 0.00 C ATOM 1574 CE3 TRP A 95 0.188 2.317 -7.030 1.00 0.00 C ATOM 1575 CZ2 TRP A 95 0.764 -0.425 -7.072 1.00 0.00 C ATOM 1576 CZ3 TRP A 95 -0.799 1.384 -7.396 1.00 0.00 C ATOM 1577 CH2 TRP A 95 -0.508 0.018 -7.416 1.00 0.00 C ATOM 0 H TRP A 95 3.590 2.397 -3.914 1.00 0.00 H new ATOM 0 HA TRP A 95 3.609 5.309 -4.457 1.00 0.00 H new ATOM 0 HB2 TRP A 95 2.106 4.598 -6.473 1.00 0.00 H new ATOM 0 HB3 TRP A 95 3.832 4.327 -6.618 1.00 0.00 H new ATOM 0 HD1 TRP A 95 4.644 1.785 -5.759 1.00 0.00 H new ATOM 0 HE1 TRP A 95 3.555 -0.508 -6.246 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -0.047 3.371 -7.019 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 0.993 -1.480 -7.087 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -1.788 1.726 -7.663 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -1.270 -0.693 -7.698 1.00 0.00 H new ATOM 1588 N SER A 96 1.161 5.618 -3.991 1.00 0.00 N ATOM 1589 CA SER A 96 -0.158 5.889 -3.432 1.00 0.00 C ATOM 1590 C SER A 96 -1.226 5.267 -4.349 1.00 0.00 C ATOM 1591 O SER A 96 -0.874 4.475 -5.221 1.00 0.00 O ATOM 1592 CB SER A 96 -0.317 7.403 -3.290 1.00 0.00 C ATOM 1593 OG SER A 96 -0.913 7.939 -4.466 1.00 0.00 O ATOM 0 H SER A 96 1.590 6.424 -4.446 1.00 0.00 H new ATOM 0 HA SER A 96 -0.277 5.443 -2.444 1.00 0.00 H new ATOM 0 HB2 SER A 96 -0.934 7.633 -2.422 1.00 0.00 H new ATOM 0 HB3 SER A 96 0.655 7.865 -3.121 1.00 0.00 H new ATOM 0 HG SER A 96 -1.160 8.874 -4.310 1.00 0.00 H new ATOM 1599 N PRO A 97 -2.506 5.541 -4.179 1.00 0.00 N ATOM 1600 CA PRO A 97 -3.553 4.907 -5.028 1.00 0.00 C ATOM 1601 C PRO A 97 -3.625 5.592 -6.390 1.00 0.00 C ATOM 1602 O PRO A 97 -2.590 5.982 -6.930 1.00 0.00 O ATOM 1603 CB PRO A 97 -4.820 5.087 -4.210 1.00 0.00 C ATOM 1604 CG PRO A 97 -4.614 6.360 -3.476 1.00 0.00 C ATOM 1605 CD PRO A 97 -3.112 6.481 -3.215 1.00 0.00 C ATOM 0 HA PRO A 97 -3.364 3.858 -5.256 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -5.701 5.136 -4.850 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -4.971 4.254 -3.524 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -4.974 7.206 -4.061 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -5.171 6.360 -2.539 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -2.760 7.500 -3.375 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -2.863 6.216 -2.188 1.00 0.00 H new ATOM 1613 N CYS A 98 -4.819 5.749 -6.962 1.00 0.00 N ATOM 1614 CA CYS A 98 -4.901 6.401 -8.265 1.00 0.00 C ATOM 1615 C CYS A 98 -6.239 7.102 -8.493 1.00 0.00 C ATOM 1616 O CYS A 98 -7.174 6.968 -7.709 1.00 0.00 O ATOM 1617 CB CYS A 98 -4.667 5.377 -9.375 1.00 0.00 C ATOM 1618 SG CYS A 98 -3.273 4.313 -8.934 1.00 0.00 S ATOM 0 H CYS A 98 -5.708 5.447 -6.563 1.00 0.00 H new ATOM 0 HA CYS A 98 -4.125 7.167 -8.285 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -5.564 4.776 -9.524 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -4.465 5.887 -10.317 1.00 0.00 H new ATOM 0 HG CYS A 98 -2.400 4.999 -8.258 1.00 0.00 H new ATOM 1623 N PHE A 99 -6.299 7.864 -9.584 1.00 0.00 N ATOM 1624 CA PHE A 99 -7.495 8.622 -9.948 1.00 0.00 C ATOM 1625 C PHE A 99 -8.780 7.841 -9.712 1.00 0.00 C ATOM 1626 O PHE A 99 -9.646 8.272 -8.953 1.00 0.00 O ATOM 1627 CB PHE A 99 -7.424 9.026 -11.425 1.00 0.00 C ATOM 1628 CG PHE A 99 -7.524 7.801 -12.302 1.00 0.00 C ATOM 1629 CD1 PHE A 99 -6.440 6.923 -12.396 1.00 0.00 C ATOM 1630 CD2 PHE A 99 -8.699 7.543 -13.021 1.00 0.00 C ATOM 1631 CE1 PHE A 99 -6.526 5.786 -13.208 1.00 0.00 C ATOM 1632 CE2 PHE A 99 -8.785 6.406 -13.834 1.00 0.00 C ATOM 1633 CZ PHE A 99 -7.699 5.528 -13.928 1.00 0.00 C ATOM 0 H PHE A 99 -5.524 7.973 -10.238 1.00 0.00 H new ATOM 0 HA PHE A 99 -7.518 9.503 -9.306 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -8.232 9.718 -11.660 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -6.488 9.549 -11.623 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -5.535 7.122 -11.841 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -9.537 8.220 -12.948 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -5.688 5.108 -13.279 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -9.690 6.206 -14.389 1.00 0.00 H new ATOM 0 HZ PHE A 99 -7.766 4.652 -14.556 1.00 0.00 H new ATOM 1643 N SER A 100 -8.924 6.711 -10.389 1.00 0.00 N ATOM 1644 CA SER A 100 -10.137 5.911 -10.257 1.00 0.00 C ATOM 1645 C SER A 100 -9.973 4.810 -9.217 1.00 0.00 C ATOM 1646 O SER A 100 -10.719 4.751 -8.242 1.00 0.00 O ATOM 1647 CB SER A 100 -10.499 5.289 -11.604 1.00 0.00 C ATOM 1648 OG SER A 100 -10.961 6.307 -12.481 1.00 0.00 O ATOM 0 H SER A 100 -8.227 6.329 -11.028 1.00 0.00 H new ATOM 0 HA SER A 100 -10.937 6.574 -9.927 1.00 0.00 H new ATOM 0 HB2 SER A 100 -9.630 4.790 -12.033 1.00 0.00 H new ATOM 0 HB3 SER A 100 -11.269 4.529 -11.472 1.00 0.00 H new ATOM 0 HG SER A 100 -10.196 6.727 -12.927 1.00 0.00 H new ATOM 1654 N CYS A 101 -9.004 3.928 -9.435 1.00 0.00 N ATOM 1655 CA CYS A 101 -8.770 2.827 -8.507 1.00 0.00 C ATOM 1656 C CYS A 101 -9.009 3.285 -7.076 1.00 0.00 C ATOM 1657 O CYS A 101 -9.390 2.493 -6.205 1.00 0.00 O ATOM 1658 CB CYS A 101 -7.329 2.295 -8.677 1.00 0.00 C ATOM 1659 SG CYS A 101 -6.272 2.777 -7.280 1.00 0.00 S ATOM 0 H CYS A 101 -8.374 3.952 -10.237 1.00 0.00 H new ATOM 0 HA CYS A 101 -9.468 2.019 -8.728 1.00 0.00 H new ATOM 0 HB2 CYS A 101 -7.349 1.208 -8.762 1.00 0.00 H new ATOM 0 HB3 CYS A 101 -6.905 2.679 -9.605 1.00 0.00 H new ATOM 0 HG CYS A 101 -5.174 3.309 -7.730 1.00 0.00 H new ATOM 1664 N ALA A 102 -8.800 4.573 -6.840 1.00 0.00 N ATOM 1665 CA ALA A 102 -9.006 5.108 -5.509 1.00 0.00 C ATOM 1666 C ALA A 102 -10.490 5.147 -5.220 1.00 0.00 C ATOM 1667 O ALA A 102 -10.951 4.666 -4.186 1.00 0.00 O ATOM 1668 CB ALA A 102 -8.414 6.517 -5.395 1.00 0.00 C ATOM 0 H ALA A 102 -8.495 5.251 -7.538 1.00 0.00 H new ATOM 0 HA ALA A 102 -8.503 4.468 -4.784 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -8.579 6.901 -4.388 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -7.344 6.479 -5.598 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -8.897 7.174 -6.118 1.00 0.00 H new ATOM 1674 N GLN A 103 -11.233 5.698 -6.162 1.00 0.00 N ATOM 1675 CA GLN A 103 -12.670 5.771 -6.028 1.00 0.00 C ATOM 1676 C GLN A 103 -13.209 4.409 -5.658 1.00 0.00 C ATOM 1677 O GLN A 103 -13.815 4.242 -4.600 1.00 0.00 O ATOM 1678 CB GLN A 103 -13.276 6.218 -7.349 1.00 0.00 C ATOM 1679 CG GLN A 103 -13.082 7.716 -7.486 1.00 0.00 C ATOM 1680 CD GLN A 103 -13.707 8.214 -8.784 1.00 0.00 C ATOM 1681 OE1 GLN A 103 -14.922 8.397 -8.859 1.00 0.00 O ATOM 1682 NE2 GLN A 103 -12.944 8.448 -9.817 1.00 0.00 N ATOM 0 H GLN A 103 -10.864 6.099 -7.024 1.00 0.00 H new ATOM 0 HA GLN A 103 -12.930 6.487 -5.248 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -12.800 5.697 -8.180 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -14.337 5.969 -7.383 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -13.535 8.227 -6.637 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -12.019 7.955 -7.472 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -11.937 8.296 -9.753 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -13.354 8.783 -10.689 1.00 0.00 H new ATOM 1691 N GLU A 104 -12.952 3.430 -6.528 1.00 0.00 N ATOM 1692 CA GLU A 104 -13.397 2.058 -6.278 1.00 0.00 C ATOM 1693 C GLU A 104 -13.312 1.783 -4.783 1.00 0.00 C ATOM 1694 O GLU A 104 -14.323 1.562 -4.106 1.00 0.00 O ATOM 1695 CB GLU A 104 -12.507 1.073 -7.048 1.00 0.00 C ATOM 1696 CG GLU A 104 -13.117 0.795 -8.425 1.00 0.00 C ATOM 1697 CD GLU A 104 -14.388 -0.033 -8.271 1.00 0.00 C ATOM 1698 OE1 GLU A 104 -14.310 -1.096 -7.678 1.00 0.00 O ATOM 1699 OE2 GLU A 104 -15.420 0.407 -8.750 1.00 0.00 O ATOM 0 H GLU A 104 -12.444 3.559 -7.403 1.00 0.00 H new ATOM 0 HA GLU A 104 -14.425 1.932 -6.617 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -11.504 1.485 -7.160 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -12.409 0.143 -6.488 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -13.343 1.735 -8.929 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -12.399 0.263 -9.050 1.00 0.00 H new ATOM 1706 N MET A 105 -12.095 1.848 -4.269 1.00 0.00 N ATOM 1707 CA MET A 105 -11.876 1.656 -2.859 1.00 0.00 C ATOM 1708 C MET A 105 -12.750 2.637 -2.070 1.00 0.00 C ATOM 1709 O MET A 105 -13.709 2.214 -1.439 1.00 0.00 O ATOM 1710 CB MET A 105 -10.376 1.828 -2.587 1.00 0.00 C ATOM 1711 CG MET A 105 -9.879 0.885 -1.481 1.00 0.00 C ATOM 1712 SD MET A 105 -10.031 1.695 0.125 1.00 0.00 S ATOM 1713 CE MET A 105 -8.809 2.989 -0.164 1.00 0.00 C ATOM 0 H MET A 105 -11.251 2.032 -4.811 1.00 0.00 H new ATOM 0 HA MET A 105 -12.164 0.656 -2.535 1.00 0.00 H new ATOM 0 HB2 MET A 105 -9.817 1.638 -3.503 1.00 0.00 H new ATOM 0 HB3 MET A 105 -10.176 2.860 -2.300 1.00 0.00 H new ATOM 0 HG2 MET A 105 -10.459 -0.038 -1.490 1.00 0.00 H new ATOM 0 HG3 MET A 105 -8.840 0.611 -1.664 1.00 0.00 H new ATOM 0 HE1 MET A 105 -8.154 3.071 0.703 1.00 0.00 H new ATOM 0 HE2 MET A 105 -8.217 2.740 -1.045 1.00 0.00 H new ATOM 0 HE3 MET A 105 -9.317 3.940 -0.325 1.00 0.00 H new ATOM 1723 N ALA A 106 -12.451 3.938 -2.121 1.00 0.00 N ATOM 1724 CA ALA A 106 -13.256 4.923 -1.383 1.00 0.00 C ATOM 1725 C ALA A 106 -14.719 4.485 -1.253 1.00 0.00 C ATOM 1726 O ALA A 106 -15.274 4.491 -0.170 1.00 0.00 O ATOM 1727 CB ALA A 106 -13.260 6.282 -2.078 1.00 0.00 C ATOM 0 H ALA A 106 -11.675 4.331 -2.653 1.00 0.00 H new ATOM 0 HA ALA A 106 -12.794 4.997 -0.399 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -13.865 6.983 -1.503 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -12.239 6.657 -2.149 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -13.679 6.178 -3.079 1.00 0.00 H new ATOM 1733 N LYS A 107 -15.368 4.109 -2.347 1.00 0.00 N ATOM 1734 CA LYS A 107 -16.754 3.692 -2.227 1.00 0.00 C ATOM 1735 C LYS A 107 -16.862 2.695 -1.109 1.00 0.00 C ATOM 1736 O LYS A 107 -17.403 2.971 -0.040 1.00 0.00 O ATOM 1737 CB LYS A 107 -17.207 3.006 -3.496 1.00 0.00 C ATOM 1738 CG LYS A 107 -17.485 4.049 -4.593 1.00 0.00 C ATOM 1739 CD LYS A 107 -16.702 3.690 -5.850 1.00 0.00 C ATOM 1740 CE LYS A 107 -17.300 2.432 -6.468 1.00 0.00 C ATOM 1741 NZ LYS A 107 -18.623 2.757 -7.073 1.00 0.00 N ATOM 0 H LYS A 107 -14.976 4.084 -3.289 1.00 0.00 H new ATOM 0 HA LYS A 107 -17.371 4.571 -2.039 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -16.442 2.307 -3.834 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -18.107 2.423 -3.302 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -18.552 4.083 -4.814 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -17.199 5.042 -4.246 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -16.738 4.513 -6.564 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -15.653 3.526 -5.605 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -16.629 2.033 -7.228 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -17.416 1.660 -5.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -18.860 2.045 -7.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -19.353 2.756 -6.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -18.581 3.697 -7.516 1.00 0.00 H new ATOM 1755 N PHE A 108 -16.320 1.531 -1.382 1.00 0.00 N ATOM 1756 CA PHE A 108 -16.326 0.453 -0.407 1.00 0.00 C ATOM 1757 C PHE A 108 -16.151 1.015 1.005 1.00 0.00 C ATOM 1758 O PHE A 108 -16.658 0.460 1.980 1.00 0.00 O ATOM 1759 CB PHE A 108 -15.191 -0.502 -0.740 1.00 0.00 C ATOM 1760 CG PHE A 108 -15.687 -1.466 -1.775 1.00 0.00 C ATOM 1761 CD1 PHE A 108 -15.984 -1.013 -3.063 1.00 0.00 C ATOM 1762 CD2 PHE A 108 -15.889 -2.798 -1.431 1.00 0.00 C ATOM 1763 CE1 PHE A 108 -16.485 -1.903 -4.013 1.00 0.00 C ATOM 1764 CE2 PHE A 108 -16.384 -3.695 -2.378 1.00 0.00 C ATOM 1765 CZ PHE A 108 -16.686 -3.250 -3.673 1.00 0.00 C ATOM 0 H PHE A 108 -15.869 1.302 -2.268 1.00 0.00 H new ATOM 0 HA PHE A 108 -17.278 -0.076 -0.444 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -14.327 0.048 -1.114 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -14.867 -1.035 0.154 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -15.826 0.023 -3.322 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -15.663 -3.138 -0.431 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -16.718 -1.556 -5.009 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -16.534 -4.731 -2.114 1.00 0.00 H new ATOM 0 HZ PHE A 108 -17.072 -3.942 -4.407 1.00 0.00 H new ATOM 1775 N ILE A 109 -15.418 2.121 1.088 1.00 0.00 N ATOM 1776 CA ILE A 109 -15.140 2.789 2.348 1.00 0.00 C ATOM 1777 C ILE A 109 -16.251 3.787 2.694 1.00 0.00 C ATOM 1778 O ILE A 109 -17.041 3.561 3.610 1.00 0.00 O ATOM 1779 CB ILE A 109 -13.804 3.505 2.167 1.00 0.00 C ATOM 1780 CG1 ILE A 109 -12.686 2.520 2.374 1.00 0.00 C ATOM 1781 CG2 ILE A 109 -13.644 4.651 3.134 1.00 0.00 C ATOM 1782 CD1 ILE A 109 -12.922 1.318 1.480 1.00 0.00 C ATOM 0 H ILE A 109 -15.000 2.578 0.278 1.00 0.00 H new ATOM 0 HA ILE A 109 -15.096 2.075 3.170 1.00 0.00 H new ATOM 0 HB ILE A 109 -13.775 3.914 1.157 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -11.727 2.982 2.139 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -12.644 2.211 3.418 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -12.680 5.133 2.971 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -14.443 5.375 2.975 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -13.693 4.274 4.156 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -12.118 0.596 1.621 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -13.875 0.855 1.737 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -12.944 1.638 0.438 1.00 0.00 H new ATOM 1794 N SER A 110 -16.302 4.886 1.947 1.00 0.00 N ATOM 1795 CA SER A 110 -17.307 5.918 2.160 1.00 0.00 C ATOM 1796 C SER A 110 -18.687 5.289 2.308 1.00 0.00 C ATOM 1797 O SER A 110 -19.502 5.726 3.120 1.00 0.00 O ATOM 1798 CB SER A 110 -17.306 6.888 0.973 1.00 0.00 C ATOM 1799 OG SER A 110 -18.546 6.795 0.280 1.00 0.00 O ATOM 0 H SER A 110 -15.654 5.084 1.185 1.00 0.00 H new ATOM 0 HA SER A 110 -17.068 6.461 3.075 1.00 0.00 H new ATOM 0 HB2 SER A 110 -17.149 7.908 1.324 1.00 0.00 H new ATOM 0 HB3 SER A 110 -16.482 6.653 0.299 1.00 0.00 H new ATOM 0 HG SER A 110 -18.545 7.417 -0.478 1.00 0.00 H new ATOM 1805 N LYS A 111 -18.932 4.256 1.512 1.00 0.00 N ATOM 1806 CA LYS A 111 -20.206 3.556 1.546 1.00 0.00 C ATOM 1807 C LYS A 111 -20.333 2.757 2.835 1.00 0.00 C ATOM 1808 O LYS A 111 -21.419 2.641 3.403 1.00 0.00 O ATOM 1809 CB LYS A 111 -20.309 2.599 0.360 1.00 0.00 C ATOM 1810 CG LYS A 111 -20.258 3.318 -1.006 1.00 0.00 C ATOM 1811 CD LYS A 111 -20.826 4.747 -0.958 1.00 0.00 C ATOM 1812 CE LYS A 111 -22.310 4.732 -0.552 1.00 0.00 C ATOM 1813 NZ LYS A 111 -22.558 5.817 0.439 1.00 0.00 N ATOM 0 H LYS A 111 -18.264 3.886 0.836 1.00 0.00 H new ATOM 0 HA LYS A 111 -21.006 4.295 1.494 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -19.496 1.875 0.413 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -21.240 2.038 0.434 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -19.225 3.356 -1.352 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -20.818 2.735 -1.738 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -20.256 5.346 -0.248 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -20.716 5.220 -1.934 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -22.941 4.874 -1.430 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -22.572 3.765 -0.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -22.711 5.400 1.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -21.735 6.452 0.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -23.401 6.358 0.158 1.00 0.00 H new ATOM 1827 N ASN A 112 -19.217 2.202 3.290 1.00 0.00 N ATOM 1828 CA ASN A 112 -19.212 1.408 4.513 1.00 0.00 C ATOM 1829 C ASN A 112 -17.944 1.659 5.328 1.00 0.00 C ATOM 1830 O ASN A 112 -16.949 0.951 5.180 1.00 0.00 O ATOM 1831 CB ASN A 112 -19.316 -0.079 4.169 1.00 0.00 C ATOM 1832 CG ASN A 112 -19.905 -0.847 5.349 1.00 0.00 C ATOM 1833 OD1 ASN A 112 -19.361 -1.874 5.755 1.00 0.00 O ATOM 1834 ND2 ASN A 112 -20.989 -0.406 5.926 1.00 0.00 N ATOM 0 H ASN A 112 -18.308 2.286 2.834 1.00 0.00 H new ATOM 0 HA ASN A 112 -20.071 1.706 5.114 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -19.943 -0.214 3.287 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -18.330 -0.474 3.923 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -21.388 -0.913 6.716 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -21.437 0.445 5.587 1.00 0.00 H new ATOM 1841 N LYS A 113 -17.994 2.671 6.188 1.00 0.00 N ATOM 1842 CA LYS A 113 -16.848 3.011 7.027 1.00 0.00 C ATOM 1843 C LYS A 113 -16.359 1.790 7.806 1.00 0.00 C ATOM 1844 O LYS A 113 -15.262 1.797 8.362 1.00 0.00 O ATOM 1845 CB LYS A 113 -17.214 4.120 8.017 1.00 0.00 C ATOM 1846 CG LYS A 113 -18.282 5.039 7.419 1.00 0.00 C ATOM 1847 CD LYS A 113 -17.812 5.570 6.061 1.00 0.00 C ATOM 1848 CE LYS A 113 -18.436 6.946 5.807 1.00 0.00 C ATOM 1849 NZ LYS A 113 -19.871 6.920 6.204 1.00 0.00 N ATOM 0 H LYS A 113 -18.810 3.268 6.323 1.00 0.00 H new ATOM 0 HA LYS A 113 -16.052 3.359 6.369 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -17.581 3.681 8.945 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -16.326 4.700 8.268 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -19.219 4.494 7.302 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -18.479 5.870 8.096 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -16.725 5.643 6.044 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -18.098 4.878 5.269 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -17.904 7.709 6.375 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -18.344 7.210 4.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -20.398 7.624 5.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -20.264 5.974 6.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -19.955 7.143 7.216 1.00 0.00 H new ATOM 1863 N HIS A 114 -17.185 0.747 7.847 1.00 0.00 N ATOM 1864 CA HIS A 114 -16.834 -0.474 8.570 1.00 0.00 C ATOM 1865 C HIS A 114 -15.412 -0.927 8.241 1.00 0.00 C ATOM 1866 O HIS A 114 -14.899 -1.870 8.842 1.00 0.00 O ATOM 1867 CB HIS A 114 -17.818 -1.589 8.215 1.00 0.00 C ATOM 1868 CG HIS A 114 -17.721 -2.687 9.238 1.00 0.00 C ATOM 1869 ND1 HIS A 114 -17.517 -4.012 8.884 1.00 0.00 N ATOM 1870 CD2 HIS A 114 -17.794 -2.671 10.609 1.00 0.00 C ATOM 1871 CE1 HIS A 114 -17.474 -4.733 10.020 1.00 0.00 C ATOM 1872 NE2 HIS A 114 -17.637 -3.964 11.100 1.00 0.00 N ATOM 0 H HIS A 114 -18.097 0.722 7.391 1.00 0.00 H new ATOM 0 HA HIS A 114 -16.887 -0.258 9.637 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -18.834 -1.196 8.183 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -17.597 -1.981 7.222 1.00 0.00 H new ATOM 0 HD1 HIS A 114 -17.418 -4.374 7.936 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -17.949 -1.790 11.214 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -17.326 -5.802 10.054 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -17.645 -4.261 12.076 1.00 0.00 H new ATOM 1881 N VAL A 115 -14.783 -0.257 7.280 1.00 0.00 N ATOM 1882 CA VAL A 115 -13.429 -0.600 6.870 1.00 0.00 C ATOM 1883 C VAL A 115 -12.450 0.502 7.280 1.00 0.00 C ATOM 1884 O VAL A 115 -12.798 1.683 7.293 1.00 0.00 O ATOM 1885 CB VAL A 115 -13.420 -0.812 5.340 1.00 0.00 C ATOM 1886 CG1 VAL A 115 -12.124 -0.308 4.728 1.00 0.00 C ATOM 1887 CG2 VAL A 115 -13.549 -2.298 5.014 1.00 0.00 C ATOM 0 H VAL A 115 -15.191 0.527 6.771 1.00 0.00 H new ATOM 0 HA VAL A 115 -13.110 -1.518 7.364 1.00 0.00 H new ATOM 0 HB VAL A 115 -14.262 -0.256 4.927 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -12.144 -0.469 3.650 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -12.014 0.757 4.934 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -11.283 -0.849 5.160 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -13.542 -2.435 3.933 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -12.713 -2.841 5.455 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -14.485 -2.680 5.422 1.00 0.00 H new ATOM 1897 N SER A 116 -11.219 0.101 7.593 1.00 0.00 N ATOM 1898 CA SER A 116 -10.186 1.057 7.977 1.00 0.00 C ATOM 1899 C SER A 116 -8.872 0.727 7.273 1.00 0.00 C ATOM 1900 O SER A 116 -8.179 -0.220 7.649 1.00 0.00 O ATOM 1901 CB SER A 116 -9.973 1.026 9.488 1.00 0.00 C ATOM 1902 OG SER A 116 -11.021 1.744 10.126 1.00 0.00 O ATOM 0 H SER A 116 -10.915 -0.873 7.588 1.00 0.00 H new ATOM 0 HA SER A 116 -10.513 2.054 7.680 1.00 0.00 H new ATOM 0 HB2 SER A 116 -9.954 -0.004 9.843 1.00 0.00 H new ATOM 0 HB3 SER A 116 -9.009 1.467 9.740 1.00 0.00 H new ATOM 0 HG SER A 116 -10.887 1.724 11.097 1.00 0.00 H new ATOM 1908 N LEU A 117 -8.533 1.508 6.249 1.00 0.00 N ATOM 1909 CA LEU A 117 -7.301 1.281 5.507 1.00 0.00 C ATOM 1910 C LEU A 117 -6.193 2.179 6.017 1.00 0.00 C ATOM 1911 O LEU A 117 -6.389 3.378 6.210 1.00 0.00 O ATOM 1912 CB LEU A 117 -7.464 1.603 4.019 1.00 0.00 C ATOM 1913 CG LEU A 117 -8.645 0.867 3.377 1.00 0.00 C ATOM 1914 CD1 LEU A 117 -8.850 -0.523 3.973 1.00 0.00 C ATOM 1915 CD2 LEU A 117 -9.905 1.684 3.559 1.00 0.00 C ATOM 0 H LEU A 117 -9.090 2.296 5.919 1.00 0.00 H new ATOM 0 HA LEU A 117 -7.058 0.227 5.645 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -7.602 2.677 3.898 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -6.547 1.338 3.492 1.00 0.00 H new ATOM 0 HG LEU A 117 -8.421 0.742 2.318 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -9.698 -1.006 3.487 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -7.953 -1.122 3.817 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -9.046 -0.435 5.042 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -10.746 1.162 3.103 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -10.098 1.823 4.623 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -9.780 2.656 3.083 1.00 0.00 H new ATOM 1927 N CYS A 118 -5.013 1.605 6.167 1.00 0.00 N ATOM 1928 CA CYS A 118 -3.855 2.368 6.579 1.00 0.00 C ATOM 1929 C CYS A 118 -2.771 2.138 5.540 1.00 0.00 C ATOM 1930 O CYS A 118 -2.018 1.168 5.619 1.00 0.00 O ATOM 1931 CB CYS A 118 -3.379 1.909 7.953 1.00 0.00 C ATOM 1932 SG CYS A 118 -4.386 2.693 9.236 1.00 0.00 S ATOM 0 H CYS A 118 -4.834 0.613 6.009 1.00 0.00 H new ATOM 0 HA CYS A 118 -4.099 3.428 6.652 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -3.452 0.824 8.031 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -2.329 2.168 8.091 1.00 0.00 H new ATOM 0 HG CYS A 118 -3.981 2.299 10.407 1.00 0.00 H new ATOM 1938 N ILE A 119 -2.733 3.006 4.535 1.00 0.00 N ATOM 1939 CA ILE A 119 -1.793 2.856 3.460 1.00 0.00 C ATOM 1940 C ILE A 119 -0.457 3.500 3.749 1.00 0.00 C ATOM 1941 O ILE A 119 -0.371 4.665 4.131 1.00 0.00 O ATOM 1942 CB ILE A 119 -2.394 3.477 2.221 1.00 0.00 C ATOM 1943 CG1 ILE A 119 -3.865 3.026 2.138 1.00 0.00 C ATOM 1944 CG2 ILE A 119 -1.591 3.021 1.001 1.00 0.00 C ATOM 1945 CD1 ILE A 119 -4.340 3.013 0.698 1.00 0.00 C ATOM 0 H ILE A 119 -3.347 3.816 4.453 1.00 0.00 H new ATOM 0 HA ILE A 119 -1.603 1.791 3.325 1.00 0.00 H new ATOM 0 HB ILE A 119 -2.359 4.566 2.255 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -3.971 2.031 2.570 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -4.490 3.697 2.727 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -2.016 3.463 0.100 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -0.554 3.340 1.108 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -1.630 1.934 0.925 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -5.381 2.692 0.661 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -4.254 4.015 0.278 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -3.727 2.323 0.119 1.00 0.00 H new ATOM 1957 N PHE A 120 0.588 2.723 3.515 1.00 0.00 N ATOM 1958 CA PHE A 120 1.946 3.192 3.698 1.00 0.00 C ATOM 1959 C PHE A 120 2.564 3.369 2.316 1.00 0.00 C ATOM 1960 O PHE A 120 2.930 2.397 1.654 1.00 0.00 O ATOM 1961 CB PHE A 120 2.736 2.163 4.528 1.00 0.00 C ATOM 1962 CG PHE A 120 3.165 2.766 5.847 1.00 0.00 C ATOM 1963 CD1 PHE A 120 2.224 3.402 6.667 1.00 0.00 C ATOM 1964 CD2 PHE A 120 4.503 2.684 6.251 1.00 0.00 C ATOM 1965 CE1 PHE A 120 2.622 3.958 7.889 1.00 0.00 C ATOM 1966 CE2 PHE A 120 4.900 3.239 7.472 1.00 0.00 C ATOM 1967 CZ PHE A 120 3.960 3.876 8.292 1.00 0.00 C ATOM 0 H PHE A 120 0.517 1.757 3.195 1.00 0.00 H new ATOM 0 HA PHE A 120 1.967 4.141 4.233 1.00 0.00 H new ATOM 0 HB2 PHE A 120 2.120 1.281 4.707 1.00 0.00 H new ATOM 0 HB3 PHE A 120 3.612 1.832 3.970 1.00 0.00 H new ATOM 0 HD1 PHE A 120 1.191 3.464 6.357 1.00 0.00 H new ATOM 0 HD2 PHE A 120 5.229 2.192 5.620 1.00 0.00 H new ATOM 0 HE1 PHE A 120 1.897 4.450 8.520 1.00 0.00 H new ATOM 0 HE2 PHE A 120 5.932 3.176 7.783 1.00 0.00 H new ATOM 0 HZ PHE A 120 4.267 4.304 9.235 1.00 0.00 H new ATOM 1977 N THR A 121 2.638 4.616 1.876 1.00 0.00 N ATOM 1978 CA THR A 121 3.166 4.933 0.554 1.00 0.00 C ATOM 1979 C THR A 121 4.390 5.842 0.682 1.00 0.00 C ATOM 1980 O THR A 121 4.526 6.571 1.665 1.00 0.00 O ATOM 1981 CB THR A 121 2.054 5.599 -0.281 1.00 0.00 C ATOM 1982 OG1 THR A 121 2.481 6.885 -0.706 1.00 0.00 O ATOM 1983 CG2 THR A 121 0.775 5.731 0.562 1.00 0.00 C ATOM 0 H THR A 121 2.339 5.428 2.415 1.00 0.00 H new ATOM 0 HA THR A 121 3.485 4.022 0.048 1.00 0.00 H new ATOM 0 HB THR A 121 1.844 4.981 -1.154 1.00 0.00 H new ATOM 0 HG1 THR A 121 1.773 7.306 -1.238 1.00 0.00 H new ATOM 0 HG21 THR A 121 -0.007 6.202 -0.034 1.00 0.00 H new ATOM 0 HG22 THR A 121 0.444 4.742 0.878 1.00 0.00 H new ATOM 0 HG23 THR A 121 0.980 6.343 1.441 1.00 0.00 H new ATOM 1991 N ALA A 122 5.307 5.763 -0.290 1.00 0.00 N ATOM 1992 CA ALA A 122 6.542 6.556 -0.230 1.00 0.00 C ATOM 1993 C ALA A 122 6.597 7.680 -1.266 1.00 0.00 C ATOM 1994 O ALA A 122 6.886 8.823 -0.911 1.00 0.00 O ATOM 1995 CB ALA A 122 7.750 5.638 -0.414 1.00 0.00 C ATOM 0 H ALA A 122 5.221 5.169 -1.115 1.00 0.00 H new ATOM 0 HA ALA A 122 6.559 7.031 0.751 1.00 0.00 H new ATOM 0 HB1 ALA A 122 8.665 6.228 -0.369 1.00 0.00 H new ATOM 0 HB2 ALA A 122 7.762 4.889 0.378 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.685 5.141 -1.382 1.00 0.00 H new ATOM 2001 N ARG A 123 6.356 7.380 -2.541 1.00 0.00 N ATOM 2002 CA ARG A 123 6.432 8.437 -3.552 1.00 0.00 C ATOM 2003 C ARG A 123 5.568 8.156 -4.775 1.00 0.00 C ATOM 2004 O ARG A 123 5.422 7.014 -5.211 1.00 0.00 O ATOM 2005 CB ARG A 123 7.881 8.629 -4.008 1.00 0.00 C ATOM 2006 CG ARG A 123 8.430 7.303 -4.564 1.00 0.00 C ATOM 2007 CD ARG A 123 9.703 7.546 -5.395 1.00 0.00 C ATOM 2008 NE ARG A 123 10.883 7.160 -4.632 1.00 0.00 N ATOM 2009 CZ ARG A 123 11.121 5.888 -4.335 1.00 0.00 C ATOM 2010 NH1 ARG A 123 10.275 4.964 -4.702 1.00 0.00 N ATOM 2011 NH2 ARG A 123 12.197 5.564 -3.674 1.00 0.00 N ATOM 0 H ARG A 123 6.116 6.453 -2.891 1.00 0.00 H new ATOM 0 HA ARG A 123 6.053 9.342 -3.077 1.00 0.00 H new ATOM 0 HB2 ARG A 123 7.932 9.404 -4.773 1.00 0.00 H new ATOM 0 HB3 ARG A 123 8.494 8.965 -3.172 1.00 0.00 H new ATOM 0 HG2 ARG A 123 8.651 6.622 -3.742 1.00 0.00 H new ATOM 0 HG3 ARG A 123 7.673 6.821 -5.182 1.00 0.00 H new ATOM 0 HD2 ARG A 123 9.656 6.973 -6.321 1.00 0.00 H new ATOM 0 HD3 ARG A 123 9.769 8.598 -5.674 1.00 0.00 H new ATOM 0 HE ARG A 123 11.537 7.879 -4.321 1.00 0.00 H new ATOM 0 HH11 ARG A 123 9.432 5.220 -5.216 1.00 0.00 H new ATOM 0 HH12 ARG A 123 10.457 3.987 -4.474 1.00 0.00 H new ATOM 0 HH21 ARG A 123 12.855 6.288 -3.385 1.00 0.00 H new ATOM 0 HH22 ARG A 123 12.380 4.587 -3.446 1.00 0.00 H new ATOM 2025 N ILE A 124 5.014 9.233 -5.327 1.00 0.00 N ATOM 2026 CA ILE A 124 4.175 9.152 -6.515 1.00 0.00 C ATOM 2027 C ILE A 124 4.563 10.243 -7.511 1.00 0.00 C ATOM 2028 O ILE A 124 4.431 11.433 -7.224 1.00 0.00 O ATOM 2029 CB ILE A 124 2.713 9.327 -6.123 1.00 0.00 C ATOM 2030 CG1 ILE A 124 2.554 10.656 -5.355 1.00 0.00 C ATOM 2031 CG2 ILE A 124 2.289 8.145 -5.247 1.00 0.00 C ATOM 2032 CD1 ILE A 124 1.379 10.578 -4.379 1.00 0.00 C ATOM 0 H ILE A 124 5.134 10.179 -4.965 1.00 0.00 H new ATOM 0 HA ILE A 124 4.318 8.176 -6.979 1.00 0.00 H new ATOM 0 HB ILE A 124 2.080 9.355 -7.010 1.00 0.00 H new ATOM 0 HG12 ILE A 124 3.471 10.879 -4.811 1.00 0.00 H new ATOM 0 HG13 ILE A 124 2.395 11.472 -6.060 1.00 0.00 H new ATOM 0 HG21 ILE A 124 1.244 8.261 -4.961 1.00 0.00 H new ATOM 0 HG22 ILE A 124 2.412 7.216 -5.804 1.00 0.00 H new ATOM 0 HG23 ILE A 124 2.909 8.115 -4.351 1.00 0.00 H new ATOM 0 HD11 ILE A 124 1.284 11.525 -3.848 1.00 0.00 H new ATOM 0 HD12 ILE A 124 0.460 10.378 -4.931 1.00 0.00 H new ATOM 0 HD13 ILE A 124 1.554 9.776 -3.662 1.00 0.00 H new ATOM 2044 N TYR A 125 5.046 9.829 -8.679 1.00 0.00 N ATOM 2045 CA TYR A 125 5.455 10.777 -9.712 1.00 0.00 C ATOM 2046 C TYR A 125 4.794 10.432 -11.044 1.00 0.00 C ATOM 2047 O TYR A 125 5.109 9.410 -11.654 1.00 0.00 O ATOM 2048 CB TYR A 125 6.974 10.738 -9.878 1.00 0.00 C ATOM 2049 CG TYR A 125 7.639 11.494 -8.753 1.00 0.00 C ATOM 2050 CD1 TYR A 125 7.809 10.888 -7.501 1.00 0.00 C ATOM 2051 CD2 TYR A 125 8.097 12.801 -8.964 1.00 0.00 C ATOM 2052 CE1 TYR A 125 8.437 11.588 -6.464 1.00 0.00 C ATOM 2053 CE2 TYR A 125 8.726 13.499 -7.928 1.00 0.00 C ATOM 2054 CZ TYR A 125 8.897 12.892 -6.679 1.00 0.00 C ATOM 2055 OH TYR A 125 9.523 13.578 -5.660 1.00 0.00 O ATOM 0 H TYR A 125 5.164 8.848 -8.934 1.00 0.00 H new ATOM 0 HA TYR A 125 5.144 11.776 -9.408 1.00 0.00 H new ATOM 0 HB2 TYR A 125 7.320 9.704 -9.886 1.00 0.00 H new ATOM 0 HB3 TYR A 125 7.254 11.176 -10.836 1.00 0.00 H new ATOM 0 HD1 TYR A 125 7.456 9.881 -7.336 1.00 0.00 H new ATOM 0 HD2 TYR A 125 7.964 13.270 -9.928 1.00 0.00 H new ATOM 0 HE1 TYR A 125 8.566 11.122 -5.498 1.00 0.00 H new ATOM 0 HE2 TYR A 125 9.080 14.506 -8.092 1.00 0.00 H new ATOM 0 HH TYR A 125 9.709 14.495 -5.950 1.00 0.00 H new ATOM 2065 N ASP A 126 3.876 11.286 -11.490 1.00 0.00 N ATOM 2066 CA ASP A 126 3.179 11.054 -12.753 1.00 0.00 C ATOM 2067 C ASP A 126 3.129 12.329 -13.589 1.00 0.00 C ATOM 2068 O ASP A 126 4.090 13.096 -13.627 1.00 0.00 O ATOM 2069 CB ASP A 126 1.756 10.562 -12.481 1.00 0.00 C ATOM 2070 CG ASP A 126 1.265 9.713 -13.648 1.00 0.00 C ATOM 2071 OD1 ASP A 126 1.618 8.547 -13.695 1.00 0.00 O ATOM 2072 OD2 ASP A 126 0.544 10.243 -14.478 1.00 0.00 O ATOM 0 H ASP A 126 3.599 12.137 -11.001 1.00 0.00 H new ATOM 0 HA ASP A 126 3.727 10.295 -13.311 1.00 0.00 H new ATOM 0 HB2 ASP A 126 1.734 9.978 -11.561 1.00 0.00 H new ATOM 0 HB3 ASP A 126 1.090 11.413 -12.334 1.00 0.00 H new ATOM 2148 N GLN A 132 -6.581 13.722 -8.516 1.00 0.00 N ATOM 2149 CA GLN A 132 -7.003 14.227 -7.217 1.00 0.00 C ATOM 2150 C GLN A 132 -8.457 13.857 -6.919 1.00 0.00 C ATOM 2151 O GLN A 132 -8.875 13.867 -5.762 1.00 0.00 O ATOM 2152 CB GLN A 132 -6.845 15.747 -7.185 1.00 0.00 C ATOM 2153 CG GLN A 132 -7.585 16.323 -5.974 1.00 0.00 C ATOM 2154 CD GLN A 132 -9.049 16.564 -6.326 1.00 0.00 C ATOM 2155 OE1 GLN A 132 -9.359 16.996 -7.436 1.00 0.00 O ATOM 2156 NE2 GLN A 132 -9.976 16.308 -5.442 1.00 0.00 N ATOM 0 HA GLN A 132 -6.374 13.769 -6.454 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -5.788 16.010 -7.136 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -7.239 16.182 -8.104 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -7.513 15.635 -5.132 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -7.118 17.258 -5.663 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -9.719 15.950 -4.522 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -10.957 16.466 -5.672 1.00 0.00 H new ATOM 2165 N GLU A 133 -9.231 13.544 -7.956 1.00 0.00 N ATOM 2166 CA GLU A 133 -10.631 13.193 -7.746 1.00 0.00 C ATOM 2167 C GLU A 133 -10.746 12.057 -6.732 1.00 0.00 C ATOM 2168 O GLU A 133 -11.192 12.261 -5.601 1.00 0.00 O ATOM 2169 CB GLU A 133 -11.294 12.792 -9.074 1.00 0.00 C ATOM 2170 CG GLU A 133 -10.249 12.253 -10.039 1.00 0.00 C ATOM 2171 CD GLU A 133 -10.930 11.584 -11.228 1.00 0.00 C ATOM 2172 OE1 GLU A 133 -11.425 12.298 -12.083 1.00 0.00 O ATOM 2173 OE2 GLU A 133 -10.947 10.364 -11.265 1.00 0.00 O ATOM 0 H GLU A 133 -8.921 13.526 -8.928 1.00 0.00 H new ATOM 0 HA GLU A 133 -11.150 14.067 -7.353 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -12.058 12.036 -8.894 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -11.796 13.654 -9.514 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -9.610 13.065 -10.386 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -9.606 11.537 -9.528 1.00 0.00 H new ATOM 2180 N GLY A 134 -10.321 10.867 -7.135 1.00 0.00 N ATOM 2181 CA GLY A 134 -10.369 9.715 -6.252 1.00 0.00 C ATOM 2182 C GLY A 134 -9.402 9.890 -5.090 1.00 0.00 C ATOM 2183 O GLY A 134 -9.761 9.687 -3.931 1.00 0.00 O ATOM 0 H GLY A 134 -9.942 10.677 -8.063 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -11.382 9.583 -5.872 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -10.117 8.812 -6.809 1.00 0.00 H new ATOM 2187 N LEU A 135 -8.172 10.270 -5.415 1.00 0.00 N ATOM 2188 CA LEU A 135 -7.148 10.474 -4.399 1.00 0.00 C ATOM 2189 C LEU A 135 -7.756 11.092 -3.144 1.00 0.00 C ATOM 2190 O LEU A 135 -7.739 10.498 -2.068 1.00 0.00 O ATOM 2191 CB LEU A 135 -6.049 11.405 -4.951 1.00 0.00 C ATOM 2192 CG LEU A 135 -4.663 10.777 -4.753 1.00 0.00 C ATOM 2193 CD1 LEU A 135 -3.606 11.659 -5.427 1.00 0.00 C ATOM 2194 CD2 LEU A 135 -4.352 10.664 -3.254 1.00 0.00 C ATOM 0 H LEU A 135 -7.861 10.442 -6.371 1.00 0.00 H new ATOM 0 HA LEU A 135 -6.715 9.508 -4.140 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -6.222 11.593 -6.011 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -6.093 12.369 -4.445 1.00 0.00 H new ATOM 0 HG LEU A 135 -4.651 9.782 -5.198 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -2.620 11.216 -5.288 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -3.822 11.736 -6.493 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -3.623 12.653 -4.980 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -3.367 10.217 -3.119 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -4.365 11.657 -2.804 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -5.103 10.038 -2.773 1.00 0.00 H new ATOM 2206 N ARG A 136 -8.266 12.306 -3.290 1.00 0.00 N ATOM 2207 CA ARG A 136 -8.852 13.017 -2.175 1.00 0.00 C ATOM 2208 C ARG A 136 -10.099 12.315 -1.640 1.00 0.00 C ATOM 2209 O ARG A 136 -10.429 12.446 -0.462 1.00 0.00 O ATOM 2210 CB ARG A 136 -9.216 14.440 -2.613 1.00 0.00 C ATOM 2211 CG ARG A 136 -9.658 15.263 -1.396 1.00 0.00 C ATOM 2212 CD ARG A 136 -11.188 15.311 -1.313 1.00 0.00 C ATOM 2213 NE ARG A 136 -11.743 15.874 -2.538 1.00 0.00 N ATOM 2214 CZ ARG A 136 -11.707 17.182 -2.766 1.00 0.00 C ATOM 2215 NH1 ARG A 136 -11.176 17.981 -1.883 1.00 0.00 N ATOM 2216 NH2 ARG A 136 -12.205 17.667 -3.871 1.00 0.00 N ATOM 0 H ARG A 136 -8.283 12.816 -4.173 1.00 0.00 H new ATOM 0 HA ARG A 136 -8.115 13.043 -1.372 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -8.358 14.913 -3.091 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -10.016 14.409 -3.352 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -9.251 14.824 -0.485 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -9.259 16.275 -1.468 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -11.582 14.307 -1.155 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -11.494 15.912 -0.457 1.00 0.00 H new ATOM 0 HE ARG A 136 -12.165 15.255 -3.230 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -10.789 17.601 -1.019 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -11.147 18.986 -2.056 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -12.622 17.041 -4.560 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -12.177 18.672 -4.045 1.00 0.00 H new ATOM 2230 N THR A 137 -10.802 11.595 -2.505 1.00 0.00 N ATOM 2231 CA THR A 137 -12.023 10.912 -2.092 1.00 0.00 C ATOM 2232 C THR A 137 -11.727 9.690 -1.220 1.00 0.00 C ATOM 2233 O THR A 137 -12.239 9.606 -0.119 1.00 0.00 O ATOM 2234 CB THR A 137 -12.855 10.583 -3.349 1.00 0.00 C ATOM 2235 OG1 THR A 137 -14.017 11.399 -3.357 1.00 0.00 O ATOM 2236 CG2 THR A 137 -13.280 9.119 -3.396 1.00 0.00 C ATOM 0 H THR A 137 -10.552 11.469 -3.486 1.00 0.00 H new ATOM 0 HA THR A 137 -12.616 11.568 -1.455 1.00 0.00 H new ATOM 0 HB THR A 137 -12.230 10.776 -4.221 1.00 0.00 H new ATOM 0 HG1 THR A 137 -14.552 11.199 -4.153 1.00 0.00 H new ATOM 0 HG21 THR A 137 -13.863 8.938 -4.299 1.00 0.00 H new ATOM 0 HG22 THR A 137 -12.395 8.483 -3.402 1.00 0.00 H new ATOM 0 HG23 THR A 137 -13.887 8.888 -2.520 1.00 0.00 H new ATOM 2244 N LEU A 138 -10.904 8.759 -1.677 1.00 0.00 N ATOM 2245 CA LEU A 138 -10.607 7.586 -0.849 1.00 0.00 C ATOM 2246 C LEU A 138 -9.748 7.967 0.364 1.00 0.00 C ATOM 2247 O LEU A 138 -9.797 7.293 1.390 1.00 0.00 O ATOM 2248 CB LEU A 138 -9.963 6.466 -1.711 1.00 0.00 C ATOM 2249 CG LEU A 138 -8.501 6.274 -1.359 1.00 0.00 C ATOM 2250 CD1 LEU A 138 -7.878 5.162 -2.227 1.00 0.00 C ATOM 2251 CD2 LEU A 138 -7.740 7.596 -1.575 1.00 0.00 C ATOM 0 H LEU A 138 -10.440 8.782 -2.585 1.00 0.00 H new ATOM 0 HA LEU A 138 -11.541 7.190 -0.451 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -10.502 5.531 -1.558 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -10.055 6.718 -2.767 1.00 0.00 H new ATOM 0 HG LEU A 138 -8.427 5.979 -0.312 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -6.828 5.038 -1.961 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -8.409 4.226 -2.055 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -7.956 5.435 -3.279 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -6.689 7.456 -1.322 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -7.824 7.898 -2.619 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -8.167 8.370 -0.938 1.00 0.00 H new ATOM 2263 N ALA A 139 -8.973 9.041 0.253 1.00 0.00 N ATOM 2264 CA ALA A 139 -8.127 9.464 1.362 1.00 0.00 C ATOM 2265 C ALA A 139 -8.967 10.123 2.448 1.00 0.00 C ATOM 2266 O ALA A 139 -8.694 9.967 3.638 1.00 0.00 O ATOM 2267 CB ALA A 139 -7.059 10.442 0.867 1.00 0.00 C ATOM 0 H ALA A 139 -8.913 9.626 -0.580 1.00 0.00 H new ATOM 0 HA ALA A 139 -7.638 8.584 1.780 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -6.433 10.751 1.704 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -6.441 9.955 0.112 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -7.541 11.317 0.432 1.00 0.00 H new ATOM 2273 N GLU A 140 -9.986 10.862 2.029 1.00 0.00 N ATOM 2274 CA GLU A 140 -10.860 11.543 2.969 1.00 0.00 C ATOM 2275 C GLU A 140 -12.048 10.687 3.320 1.00 0.00 C ATOM 2276 O GLU A 140 -12.507 10.666 4.463 1.00 0.00 O ATOM 2277 CB GLU A 140 -11.370 12.820 2.337 1.00 0.00 C ATOM 2278 CG GLU A 140 -10.213 13.791 2.173 1.00 0.00 C ATOM 2279 CD GLU A 140 -9.918 14.479 3.501 1.00 0.00 C ATOM 2280 OE1 GLU A 140 -9.396 13.818 4.384 1.00 0.00 O ATOM 2281 OE2 GLU A 140 -10.216 15.656 3.616 1.00 0.00 O ATOM 0 H GLU A 140 -10.225 11.004 1.048 1.00 0.00 H new ATOM 0 HA GLU A 140 -10.289 11.753 3.874 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -11.821 12.606 1.368 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -12.147 13.263 2.960 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -9.328 13.259 1.825 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -10.457 14.535 1.415 1.00 0.00 H new ATOM 2288 N ALA A 141 -12.556 10.006 2.321 1.00 0.00 N ATOM 2289 CA ALA A 141 -13.714 9.170 2.517 1.00 0.00 C ATOM 2290 C ALA A 141 -13.476 8.181 3.644 1.00 0.00 C ATOM 2291 O ALA A 141 -14.425 7.735 4.288 1.00 0.00 O ATOM 2292 CB ALA A 141 -14.070 8.447 1.227 1.00 0.00 C ATOM 0 H ALA A 141 -12.188 10.014 1.370 1.00 0.00 H new ATOM 0 HA ALA A 141 -14.555 9.804 2.797 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -14.946 7.820 1.391 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -14.288 9.178 0.448 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -13.231 7.824 0.916 1.00 0.00 H new ATOM 2298 N GLY A 142 -12.212 7.856 3.918 1.00 0.00 N ATOM 2299 CA GLY A 142 -11.941 6.937 5.018 1.00 0.00 C ATOM 2300 C GLY A 142 -10.594 6.227 4.914 1.00 0.00 C ATOM 2301 O GLY A 142 -10.196 5.540 5.855 1.00 0.00 O ATOM 0 H GLY A 142 -11.393 8.199 3.417 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -11.978 7.489 5.957 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -12.733 6.189 5.057 1.00 0.00 H new ATOM 2305 N ALA A 143 -9.879 6.372 3.801 1.00 0.00 N ATOM 2306 CA ALA A 143 -8.589 5.698 3.696 1.00 0.00 C ATOM 2307 C ALA A 143 -7.489 6.533 4.334 1.00 0.00 C ATOM 2308 O ALA A 143 -7.224 7.655 3.902 1.00 0.00 O ATOM 2309 CB ALA A 143 -8.222 5.430 2.240 1.00 0.00 C ATOM 0 H ALA A 143 -10.155 6.926 2.990 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.680 4.748 4.223 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -7.256 4.927 2.195 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -8.983 4.796 1.784 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -8.165 6.375 1.699 1.00 0.00 H new ATOM 2315 N LYS A 144 -6.840 5.979 5.355 1.00 0.00 N ATOM 2316 CA LYS A 144 -5.765 6.681 6.022 1.00 0.00 C ATOM 2317 C LYS A 144 -4.461 6.508 5.259 1.00 0.00 C ATOM 2318 O LYS A 144 -3.850 5.440 5.281 1.00 0.00 O ATOM 2319 CB LYS A 144 -5.606 6.155 7.425 1.00 0.00 C ATOM 2320 CG LYS A 144 -6.894 6.454 8.189 1.00 0.00 C ATOM 2321 CD LYS A 144 -6.964 5.585 9.426 1.00 0.00 C ATOM 2322 CE LYS A 144 -8.393 5.576 9.975 1.00 0.00 C ATOM 2323 NZ LYS A 144 -8.958 6.954 9.914 1.00 0.00 N ATOM 0 H LYS A 144 -7.043 5.053 5.731 1.00 0.00 H new ATOM 0 HA LYS A 144 -6.011 7.742 6.057 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -5.412 5.083 7.410 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -4.754 6.627 7.915 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -6.926 7.507 8.470 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -7.758 6.267 7.552 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -6.651 4.569 9.186 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -6.276 5.960 10.184 1.00 0.00 H new ATOM 0 HE2 LYS A 144 -9.012 4.892 9.395 1.00 0.00 H new ATOM 0 HE3 LYS A 144 -8.396 5.215 11.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 -9.760 7.030 10.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 -8.225 7.642 10.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 -9.283 7.153 8.946 1.00 0.00 H new ATOM 2337 N ILE A 145 -4.050 7.565 4.578 1.00 0.00 N ATOM 2338 CA ILE A 145 -2.824 7.532 3.796 1.00 0.00 C ATOM 2339 C ILE A 145 -1.658 8.072 4.617 1.00 0.00 C ATOM 2340 O ILE A 145 -1.824 9.000 5.410 1.00 0.00 O ATOM 2341 CB ILE A 145 -2.983 8.385 2.532 1.00 0.00 C ATOM 2342 CG1 ILE A 145 -4.423 8.331 2.011 1.00 0.00 C ATOM 2343 CG2 ILE A 145 -2.046 7.876 1.443 1.00 0.00 C ATOM 2344 CD1 ILE A 145 -4.937 6.885 1.994 1.00 0.00 C ATOM 0 H ILE A 145 -4.546 8.456 4.550 1.00 0.00 H new ATOM 0 HA ILE A 145 -2.622 6.498 3.517 1.00 0.00 H new ATOM 0 HB ILE A 145 -2.737 9.415 2.788 1.00 0.00 H new ATOM 0 HG12 ILE A 145 -5.067 8.944 2.641 1.00 0.00 H new ATOM 0 HG13 ILE A 145 -4.468 8.751 1.006 1.00 0.00 H new ATOM 0 HG21 ILE A 145 -2.164 8.486 0.547 1.00 0.00 H new ATOM 0 HG22 ILE A 145 -1.015 7.938 1.792 1.00 0.00 H new ATOM 0 HG23 ILE A 145 -2.288 6.839 1.210 1.00 0.00 H new ATOM 0 HD11 ILE A 145 -5.961 6.867 1.621 1.00 0.00 H new ATOM 0 HD12 ILE A 145 -4.304 6.281 1.344 1.00 0.00 H new ATOM 0 HD13 ILE A 145 -4.912 6.478 3.005 1.00 0.00 H new ATOM 2356 N SER A 146 -0.476 7.493 4.422 1.00 0.00 N ATOM 2357 CA SER A 146 0.704 7.933 5.148 1.00 0.00 C ATOM 2358 C SER A 146 1.902 8.066 4.210 1.00 0.00 C ATOM 2359 O SER A 146 2.165 7.190 3.385 1.00 0.00 O ATOM 2360 CB SER A 146 1.018 6.938 6.271 1.00 0.00 C ATOM 2361 OG SER A 146 0.274 5.746 6.060 1.00 0.00 O ATOM 0 H SER A 146 -0.314 6.724 3.772 1.00 0.00 H new ATOM 0 HA SER A 146 0.503 8.913 5.580 1.00 0.00 H new ATOM 0 HB2 SER A 146 2.085 6.717 6.289 1.00 0.00 H new ATOM 0 HB3 SER A 146 0.766 7.372 7.239 1.00 0.00 H new ATOM 0 HG SER A 146 0.497 5.373 5.182 1.00 0.00 H new ATOM 2367 N ILE A 147 2.626 9.166 4.362 1.00 0.00 N ATOM 2368 CA ILE A 147 3.806 9.425 3.555 1.00 0.00 C ATOM 2369 C ILE A 147 5.019 8.828 4.261 1.00 0.00 C ATOM 2370 O ILE A 147 5.358 9.233 5.374 1.00 0.00 O ATOM 2371 CB ILE A 147 4.012 10.942 3.369 1.00 0.00 C ATOM 2372 CG1 ILE A 147 2.817 11.645 2.643 1.00 0.00 C ATOM 2373 CG2 ILE A 147 5.304 11.188 2.564 1.00 0.00 C ATOM 2374 CD1 ILE A 147 1.674 10.693 2.268 1.00 0.00 C ATOM 0 H ILE A 147 2.414 9.896 5.042 1.00 0.00 H new ATOM 0 HA ILE A 147 3.678 8.972 2.572 1.00 0.00 H new ATOM 0 HB ILE A 147 4.080 11.375 4.367 1.00 0.00 H new ATOM 0 HG12 ILE A 147 2.425 12.432 3.287 1.00 0.00 H new ATOM 0 HG13 ILE A 147 3.187 12.128 1.738 1.00 0.00 H new ATOM 0 HG21 ILE A 147 5.452 12.260 2.431 1.00 0.00 H new ATOM 0 HG22 ILE A 147 6.154 10.769 3.103 1.00 0.00 H new ATOM 0 HG23 ILE A 147 5.221 10.710 1.588 1.00 0.00 H new ATOM 0 HD11 ILE A 147 0.883 11.253 1.769 1.00 0.00 H new ATOM 0 HD12 ILE A 147 2.050 9.920 1.598 1.00 0.00 H new ATOM 0 HD13 ILE A 147 1.276 10.229 3.170 1.00 0.00 H new ATOM 2386 N MET A 148 5.649 7.842 3.629 1.00 0.00 N ATOM 2387 CA MET A 148 6.797 7.180 4.240 1.00 0.00 C ATOM 2388 C MET A 148 8.083 7.993 4.094 1.00 0.00 C ATOM 2389 O MET A 148 8.708 8.016 3.034 1.00 0.00 O ATOM 2390 CB MET A 148 6.986 5.770 3.638 1.00 0.00 C ATOM 2391 CG MET A 148 6.225 4.722 4.470 1.00 0.00 C ATOM 2392 SD MET A 148 5.430 3.546 3.348 1.00 0.00 S ATOM 2393 CE MET A 148 6.913 2.650 2.835 1.00 0.00 C ATOM 0 H MET A 148 5.389 7.488 2.708 1.00 0.00 H new ATOM 0 HA MET A 148 6.588 7.094 5.306 1.00 0.00 H new ATOM 0 HB2 MET A 148 6.627 5.756 2.609 1.00 0.00 H new ATOM 0 HB3 MET A 148 8.046 5.520 3.609 1.00 0.00 H new ATOM 0 HG2 MET A 148 6.911 4.201 5.138 1.00 0.00 H new ATOM 0 HG3 MET A 148 5.478 5.209 5.097 1.00 0.00 H new ATOM 0 HE1 MET A 148 7.007 2.692 1.750 1.00 0.00 H new ATOM 0 HE2 MET A 148 7.791 3.106 3.293 1.00 0.00 H new ATOM 0 HE3 MET A 148 6.838 1.610 3.152 1.00 0.00 H new ATOM 2403 N THR A 149 8.474 8.634 5.192 1.00 0.00 N ATOM 2404 CA THR A 149 9.698 9.429 5.232 1.00 0.00 C ATOM 2405 C THR A 149 10.799 8.633 5.932 1.00 0.00 C ATOM 2406 O THR A 149 10.564 7.505 6.364 1.00 0.00 O ATOM 2407 CB THR A 149 9.447 10.735 5.995 1.00 0.00 C ATOM 2408 OG1 THR A 149 8.543 10.484 7.063 1.00 0.00 O ATOM 2409 CG2 THR A 149 8.849 11.794 5.057 1.00 0.00 C ATOM 0 H THR A 149 7.957 8.618 6.071 1.00 0.00 H new ATOM 0 HA THR A 149 10.007 9.663 4.213 1.00 0.00 H new ATOM 0 HB THR A 149 10.393 11.107 6.387 1.00 0.00 H new ATOM 0 HG1 THR A 149 8.380 11.315 7.556 1.00 0.00 H new ATOM 0 HG21 THR A 149 8.676 12.716 5.612 1.00 0.00 H new ATOM 0 HG22 THR A 149 9.542 11.988 4.238 1.00 0.00 H new ATOM 0 HG23 THR A 149 7.904 11.431 4.654 1.00 0.00 H new ATOM 2417 N TYR A 150 11.992 9.217 6.047 1.00 0.00 N ATOM 2418 CA TYR A 150 13.108 8.536 6.702 1.00 0.00 C ATOM 2419 C TYR A 150 12.612 7.666 7.854 1.00 0.00 C ATOM 2420 O TYR A 150 12.723 6.440 7.805 1.00 0.00 O ATOM 2421 CB TYR A 150 14.119 9.559 7.220 1.00 0.00 C ATOM 2422 CG TYR A 150 13.394 10.742 7.812 1.00 0.00 C ATOM 2423 CD1 TYR A 150 12.871 11.730 6.970 1.00 0.00 C ATOM 2424 CD2 TYR A 150 13.254 10.857 9.198 1.00 0.00 C ATOM 2425 CE1 TYR A 150 12.205 12.833 7.515 1.00 0.00 C ATOM 2426 CE2 TYR A 150 12.589 11.961 9.746 1.00 0.00 C ATOM 2427 CZ TYR A 150 12.065 12.950 8.904 1.00 0.00 C ATOM 2428 OH TYR A 150 11.411 14.039 9.442 1.00 0.00 O ATOM 0 H TYR A 150 12.209 10.151 5.699 1.00 0.00 H new ATOM 0 HA TYR A 150 13.594 7.893 5.968 1.00 0.00 H new ATOM 0 HB2 TYR A 150 14.760 9.101 7.973 1.00 0.00 H new ATOM 0 HB3 TYR A 150 14.766 9.888 6.407 1.00 0.00 H new ATOM 0 HD1 TYR A 150 12.982 11.641 5.899 1.00 0.00 H new ATOM 0 HD2 TYR A 150 13.659 10.094 9.847 1.00 0.00 H new ATOM 0 HE1 TYR A 150 11.799 13.594 6.865 1.00 0.00 H new ATOM 0 HE2 TYR A 150 12.480 12.050 10.817 1.00 0.00 H new ATOM 0 HH TYR A 150 11.401 13.965 10.419 1.00 0.00 H new ATOM 2438 N SER A 151 12.056 8.296 8.883 1.00 0.00 N ATOM 2439 CA SER A 151 11.541 7.550 10.025 1.00 0.00 C ATOM 2440 C SER A 151 10.724 6.360 9.535 1.00 0.00 C ATOM 2441 O SER A 151 11.096 5.205 9.740 1.00 0.00 O ATOM 2442 CB SER A 151 10.662 8.453 10.889 1.00 0.00 C ATOM 2443 OG SER A 151 10.155 7.703 11.985 1.00 0.00 O ATOM 0 H SER A 151 11.951 9.308 8.950 1.00 0.00 H new ATOM 0 HA SER A 151 12.380 7.193 10.622 1.00 0.00 H new ATOM 0 HB2 SER A 151 11.239 9.304 11.251 1.00 0.00 H new ATOM 0 HB3 SER A 151 9.840 8.855 10.297 1.00 0.00 H new ATOM 0 HG SER A 151 9.280 7.330 11.749 1.00 0.00 H new ATOM 2449 N GLU A 152 9.615 6.663 8.873 1.00 0.00 N ATOM 2450 CA GLU A 152 8.740 5.629 8.333 1.00 0.00 C ATOM 2451 C GLU A 152 9.520 4.703 7.409 1.00 0.00 C ATOM 2452 O GLU A 152 9.080 3.594 7.110 1.00 0.00 O ATOM 2453 CB GLU A 152 7.592 6.284 7.577 1.00 0.00 C ATOM 2454 CG GLU A 152 6.491 6.686 8.563 1.00 0.00 C ATOM 2455 CD GLU A 152 7.101 7.400 9.765 1.00 0.00 C ATOM 2456 OE1 GLU A 152 7.348 8.591 9.659 1.00 0.00 O ATOM 2457 OE2 GLU A 152 7.311 6.747 10.774 1.00 0.00 O ATOM 0 H GLU A 152 9.299 7.617 8.697 1.00 0.00 H new ATOM 0 HA GLU A 152 8.339 5.034 9.154 1.00 0.00 H new ATOM 0 HB2 GLU A 152 7.951 7.162 7.039 1.00 0.00 H new ATOM 0 HB3 GLU A 152 7.194 5.595 6.832 1.00 0.00 H new ATOM 0 HG2 GLU A 152 5.770 7.338 8.070 1.00 0.00 H new ATOM 0 HG3 GLU A 152 5.947 5.801 8.893 1.00 0.00 H new ATOM 2464 N PHE A 153 10.691 5.157 6.974 1.00 0.00 N ATOM 2465 CA PHE A 153 11.528 4.347 6.104 1.00 0.00 C ATOM 2466 C PHE A 153 12.240 3.288 6.941 1.00 0.00 C ATOM 2467 O PHE A 153 11.945 2.094 6.848 1.00 0.00 O ATOM 2468 CB PHE A 153 12.549 5.239 5.382 1.00 0.00 C ATOM 2469 CG PHE A 153 12.749 4.746 3.971 1.00 0.00 C ATOM 2470 CD1 PHE A 153 13.436 3.552 3.741 1.00 0.00 C ATOM 2471 CD2 PHE A 153 12.242 5.481 2.895 1.00 0.00 C ATOM 2472 CE1 PHE A 153 13.621 3.090 2.434 1.00 0.00 C ATOM 2473 CE2 PHE A 153 12.425 5.022 1.585 1.00 0.00 C ATOM 2474 CZ PHE A 153 13.114 3.824 1.355 1.00 0.00 C ATOM 0 H PHE A 153 11.077 6.072 7.208 1.00 0.00 H new ATOM 0 HA PHE A 153 10.911 3.854 5.353 1.00 0.00 H new ATOM 0 HB2 PHE A 153 12.200 6.271 5.370 1.00 0.00 H new ATOM 0 HB3 PHE A 153 13.498 5.229 5.918 1.00 0.00 H new ATOM 0 HD1 PHE A 153 13.825 2.985 4.574 1.00 0.00 H new ATOM 0 HD2 PHE A 153 11.709 6.403 3.074 1.00 0.00 H new ATOM 0 HE1 PHE A 153 14.155 2.168 2.257 1.00 0.00 H new ATOM 0 HE2 PHE A 153 12.036 5.590 0.753 1.00 0.00 H new ATOM 0 HZ PHE A 153 13.254 3.467 0.345 1.00 0.00 H new ATOM 2484 N LYS A 154 13.160 3.729 7.789 1.00 0.00 N ATOM 2485 CA LYS A 154 13.863 2.796 8.654 1.00 0.00 C ATOM 2486 C LYS A 154 12.850 1.830 9.244 1.00 0.00 C ATOM 2487 O LYS A 154 13.177 0.711 9.650 1.00 0.00 O ATOM 2488 CB LYS A 154 14.571 3.553 9.778 1.00 0.00 C ATOM 2489 CG LYS A 154 15.441 4.674 9.181 1.00 0.00 C ATOM 2490 CD LYS A 154 15.400 5.914 10.078 1.00 0.00 C ATOM 2491 CE LYS A 154 16.219 5.657 11.346 1.00 0.00 C ATOM 2492 NZ LYS A 154 17.660 5.918 11.068 1.00 0.00 N ATOM 0 H LYS A 154 13.432 4.706 7.895 1.00 0.00 H new ATOM 0 HA LYS A 154 14.611 2.251 8.079 1.00 0.00 H new ATOM 0 HB2 LYS A 154 13.837 3.976 10.464 1.00 0.00 H new ATOM 0 HB3 LYS A 154 15.190 2.868 10.357 1.00 0.00 H new ATOM 0 HG2 LYS A 154 16.469 4.328 9.074 1.00 0.00 H new ATOM 0 HG3 LYS A 154 15.085 4.927 8.182 1.00 0.00 H new ATOM 0 HD2 LYS A 154 15.799 6.776 9.543 1.00 0.00 H new ATOM 0 HD3 LYS A 154 14.369 6.152 10.341 1.00 0.00 H new ATOM 0 HE2 LYS A 154 15.871 6.301 12.153 1.00 0.00 H new ATOM 0 HE3 LYS A 154 16.082 4.628 11.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 18.217 5.744 11.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 17.987 5.286 10.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 17.783 6.907 10.771 1.00 0.00 H new ATOM 2506 N HIS A 155 11.606 2.284 9.262 1.00 0.00 N ATOM 2507 CA HIS A 155 10.505 1.488 9.775 1.00 0.00 C ATOM 2508 C HIS A 155 10.007 0.558 8.682 1.00 0.00 C ATOM 2509 O HIS A 155 9.734 -0.617 8.923 1.00 0.00 O ATOM 2510 CB HIS A 155 9.372 2.408 10.231 1.00 0.00 C ATOM 2511 CG HIS A 155 8.542 1.717 11.278 1.00 0.00 C ATOM 2512 ND1 HIS A 155 8.841 1.796 12.628 1.00 0.00 N ATOM 2513 CD2 HIS A 155 7.418 0.933 11.187 1.00 0.00 C ATOM 2514 CE1 HIS A 155 7.915 1.078 13.292 1.00 0.00 C ATOM 2515 NE2 HIS A 155 7.025 0.531 12.460 1.00 0.00 N ATOM 0 H HIS A 155 11.334 3.207 8.924 1.00 0.00 H new ATOM 0 HA HIS A 155 10.846 0.898 10.625 1.00 0.00 H new ATOM 0 HB2 HIS A 155 9.783 3.334 10.633 1.00 0.00 H new ATOM 0 HB3 HIS A 155 8.747 2.680 9.380 1.00 0.00 H new ATOM 0 HD2 HIS A 155 6.916 0.669 10.268 1.00 0.00 H new ATOM 0 HE1 HIS A 155 7.895 0.959 14.365 1.00 0.00 H new ATOM 0 HE2 HIS A 155 6.228 -0.056 12.705 1.00 0.00 H new ATOM 2524 N CYS A 156 9.911 1.096 7.470 1.00 0.00 N ATOM 2525 CA CYS A 156 9.466 0.304 6.334 1.00 0.00 C ATOM 2526 C CYS A 156 10.216 -1.019 6.319 1.00 0.00 C ATOM 2527 O CYS A 156 9.711 -2.022 5.814 1.00 0.00 O ATOM 2528 CB CYS A 156 9.707 1.069 5.029 1.00 0.00 C ATOM 2529 SG CYS A 156 9.831 -0.092 3.644 1.00 0.00 S ATOM 0 H CYS A 156 10.133 2.067 7.253 1.00 0.00 H new ATOM 0 HA CYS A 156 8.397 0.110 6.424 1.00 0.00 H new ATOM 0 HB2 CYS A 156 8.892 1.771 4.854 1.00 0.00 H new ATOM 0 HB3 CYS A 156 10.622 1.656 5.106 1.00 0.00 H new ATOM 0 HG CYS A 156 10.034 0.567 2.542 1.00 0.00 H new ATOM 2535 N TRP A 157 11.409 -1.030 6.912 1.00 0.00 N ATOM 2536 CA TRP A 157 12.179 -2.265 6.986 1.00 0.00 C ATOM 2537 C TRP A 157 11.753 -3.004 8.236 1.00 0.00 C ATOM 2538 O TRP A 157 11.313 -4.153 8.194 1.00 0.00 O ATOM 2539 CB TRP A 157 13.692 -2.002 7.074 1.00 0.00 C ATOM 2540 CG TRP A 157 14.097 -0.838 6.230 1.00 0.00 C ATOM 2541 CD1 TRP A 157 13.552 -0.491 5.041 1.00 0.00 C ATOM 2542 CD2 TRP A 157 15.152 0.131 6.496 1.00 0.00 C ATOM 2543 NE1 TRP A 157 14.207 0.634 4.566 1.00 0.00 N ATOM 2544 CE2 TRP A 157 15.193 1.053 5.428 1.00 0.00 C ATOM 2545 CE3 TRP A 157 16.066 0.300 7.552 1.00 0.00 C ATOM 2546 CZ2 TRP A 157 16.103 2.105 5.403 1.00 0.00 C ATOM 2547 CZ3 TRP A 157 16.988 1.360 7.532 1.00 0.00 C ATOM 2548 CH2 TRP A 157 17.006 2.262 6.457 1.00 0.00 C ATOM 0 H TRP A 157 11.853 -0.217 7.338 1.00 0.00 H new ATOM 0 HA TRP A 157 11.990 -2.842 6.081 1.00 0.00 H new ATOM 0 HB2 TRP A 157 13.970 -1.814 8.111 1.00 0.00 H new ATOM 0 HB3 TRP A 157 14.236 -2.891 6.754 1.00 0.00 H new ATOM 0 HD1 TRP A 157 12.742 -1.005 4.545 1.00 0.00 H new ATOM 0 HE1 TRP A 157 13.985 1.095 3.684 1.00 0.00 H new ATOM 0 HE3 TRP A 157 16.059 -0.389 8.383 1.00 0.00 H new ATOM 0 HZ2 TRP A 157 16.111 2.796 4.573 1.00 0.00 H new ATOM 0 HZ3 TRP A 157 17.686 1.481 8.347 1.00 0.00 H new ATOM 0 HH2 TRP A 157 17.716 3.075 6.445 1.00 0.00 H new ATOM 2559 N ASP A 158 11.888 -2.306 9.349 1.00 0.00 N ATOM 2560 CA ASP A 158 11.524 -2.844 10.641 1.00 0.00 C ATOM 2561 C ASP A 158 10.115 -3.422 10.623 1.00 0.00 C ATOM 2562 O ASP A 158 9.656 -3.985 11.616 1.00 0.00 O ATOM 2563 CB ASP A 158 11.604 -1.723 11.672 1.00 0.00 C ATOM 2564 CG ASP A 158 11.768 -2.306 13.071 1.00 0.00 C ATOM 2565 OD1 ASP A 158 11.084 -3.270 13.374 1.00 0.00 O ATOM 2566 OD2 ASP A 158 12.576 -1.782 13.819 1.00 0.00 O ATOM 0 H ASP A 158 12.252 -1.354 9.380 1.00 0.00 H new ATOM 0 HA ASP A 158 12.212 -3.650 10.895 1.00 0.00 H new ATOM 0 HB2 ASP A 158 12.444 -1.067 11.443 1.00 0.00 H new ATOM 0 HB3 ASP A 158 10.702 -1.113 11.628 1.00 0.00 H new ATOM 2571 N THR A 159 9.418 -3.258 9.503 1.00 0.00 N ATOM 2572 CA THR A 159 8.048 -3.747 9.400 1.00 0.00 C ATOM 2573 C THR A 159 7.955 -5.150 8.792 1.00 0.00 C ATOM 2574 O THR A 159 7.284 -6.019 9.349 1.00 0.00 O ATOM 2575 CB THR A 159 7.220 -2.771 8.559 1.00 0.00 C ATOM 2576 OG1 THR A 159 7.396 -1.453 9.059 1.00 0.00 O ATOM 2577 CG2 THR A 159 5.738 -3.148 8.625 1.00 0.00 C ATOM 0 H THR A 159 9.773 -2.797 8.665 1.00 0.00 H new ATOM 0 HA THR A 159 7.656 -3.813 10.415 1.00 0.00 H new ATOM 0 HB THR A 159 7.553 -2.820 7.522 1.00 0.00 H new ATOM 0 HG1 THR A 159 8.233 -1.080 8.711 1.00 0.00 H new ATOM 0 HG21 THR A 159 5.157 -2.448 8.024 1.00 0.00 H new ATOM 0 HG22 THR A 159 5.602 -4.158 8.239 1.00 0.00 H new ATOM 0 HG23 THR A 159 5.398 -3.107 9.660 1.00 0.00 H new ATOM 2585 N PHE A 160 8.585 -5.366 7.636 1.00 0.00 N ATOM 2586 CA PHE A 160 8.500 -6.665 6.971 1.00 0.00 C ATOM 2587 C PHE A 160 9.872 -7.278 6.696 1.00 0.00 C ATOM 2588 O PHE A 160 9.982 -8.488 6.494 1.00 0.00 O ATOM 2589 CB PHE A 160 7.760 -6.488 5.649 1.00 0.00 C ATOM 2590 CG PHE A 160 8.674 -5.847 4.630 1.00 0.00 C ATOM 2591 CD1 PHE A 160 8.829 -4.455 4.603 1.00 0.00 C ATOM 2592 CD2 PHE A 160 9.367 -6.646 3.711 1.00 0.00 C ATOM 2593 CE1 PHE A 160 9.677 -3.864 3.659 1.00 0.00 C ATOM 2594 CE2 PHE A 160 10.214 -6.053 2.766 1.00 0.00 C ATOM 2595 CZ PHE A 160 10.369 -4.662 2.741 1.00 0.00 C ATOM 0 H PHE A 160 9.150 -4.671 7.148 1.00 0.00 H new ATOM 0 HA PHE A 160 7.969 -7.345 7.638 1.00 0.00 H new ATOM 0 HB2 PHE A 160 7.415 -7.455 5.283 1.00 0.00 H new ATOM 0 HB3 PHE A 160 6.875 -5.869 5.797 1.00 0.00 H new ATOM 0 HD1 PHE A 160 8.294 -3.838 5.310 1.00 0.00 H new ATOM 0 HD2 PHE A 160 9.248 -7.719 3.731 1.00 0.00 H new ATOM 0 HE1 PHE A 160 9.797 -2.791 3.639 1.00 0.00 H new ATOM 0 HE2 PHE A 160 10.747 -6.669 2.057 1.00 0.00 H new ATOM 0 HZ PHE A 160 11.023 -4.205 2.013 1.00 0.00 H new ATOM 2605 N VAL A 161 10.907 -6.453 6.664 1.00 0.00 N ATOM 2606 CA VAL A 161 12.241 -6.951 6.385 1.00 0.00 C ATOM 2607 C VAL A 161 12.704 -7.909 7.479 1.00 0.00 C ATOM 2608 O VAL A 161 12.645 -7.587 8.665 1.00 0.00 O ATOM 2609 CB VAL A 161 13.205 -5.774 6.271 1.00 0.00 C ATOM 2610 CG1 VAL A 161 14.635 -6.290 6.261 1.00 0.00 C ATOM 2611 CG2 VAL A 161 12.926 -5.020 4.968 1.00 0.00 C ATOM 0 H VAL A 161 10.849 -5.448 6.826 1.00 0.00 H new ATOM 0 HA VAL A 161 12.223 -7.500 5.444 1.00 0.00 H new ATOM 0 HB VAL A 161 13.068 -5.104 7.120 1.00 0.00 H new ATOM 0 HG11 VAL A 161 15.324 -5.450 6.180 1.00 0.00 H new ATOM 0 HG12 VAL A 161 14.832 -6.833 7.185 1.00 0.00 H new ATOM 0 HG13 VAL A 161 14.775 -6.958 5.411 1.00 0.00 H new ATOM 0 HG21 VAL A 161 13.612 -4.178 4.881 1.00 0.00 H new ATOM 0 HG22 VAL A 161 13.067 -5.692 4.121 1.00 0.00 H new ATOM 0 HG23 VAL A 161 11.900 -4.653 4.973 1.00 0.00 H new ATOM 2621 N ASP A 162 13.174 -9.087 7.070 1.00 0.00 N ATOM 2622 CA ASP A 162 13.653 -10.081 8.027 1.00 0.00 C ATOM 2623 C ASP A 162 14.985 -9.642 8.616 1.00 0.00 C ATOM 2624 O ASP A 162 15.817 -10.464 9.003 1.00 0.00 O ATOM 2625 CB ASP A 162 13.811 -11.440 7.347 1.00 0.00 C ATOM 2626 CG ASP A 162 14.331 -12.463 8.351 1.00 0.00 C ATOM 2627 OD1 ASP A 162 13.642 -12.710 9.326 1.00 0.00 O ATOM 2628 OD2 ASP A 162 15.413 -12.982 8.131 1.00 0.00 O ATOM 0 H ASP A 162 13.233 -9.374 6.093 1.00 0.00 H new ATOM 0 HA ASP A 162 12.921 -10.171 8.829 1.00 0.00 H new ATOM 0 HB2 ASP A 162 12.853 -11.768 6.943 1.00 0.00 H new ATOM 0 HB3 ASP A 162 14.501 -11.358 6.507 1.00 0.00 H new ATOM 2633 N HIS A 163 15.163 -8.335 8.682 1.00 0.00 N ATOM 2634 CA HIS A 163 16.375 -7.737 9.225 1.00 0.00 C ATOM 2635 C HIS A 163 16.092 -6.288 9.585 1.00 0.00 C ATOM 2636 O HIS A 163 16.525 -5.362 8.900 1.00 0.00 O ATOM 2637 CB HIS A 163 17.508 -7.788 8.204 1.00 0.00 C ATOM 2638 CG HIS A 163 17.436 -9.067 7.416 1.00 0.00 C ATOM 2639 ND1 HIS A 163 17.976 -10.310 7.635 1.00 0.00 N flip ATOM 2640 CD2 HIS A 163 16.734 -9.164 6.224 1.00 0.00 C flip ATOM 2641 CE1 HIS A 163 17.617 -11.166 6.598 1.00 0.00 C flip ATOM 2642 NE2 HIS A 163 16.869 -10.426 5.776 1.00 0.00 N flip ATOM 0 H HIS A 163 14.473 -7.656 8.361 1.00 0.00 H new ATOM 0 HA HIS A 163 16.678 -8.297 10.110 1.00 0.00 H new ATOM 0 HB2 HIS A 163 17.441 -6.933 7.531 1.00 0.00 H new ATOM 0 HB3 HIS A 163 18.470 -7.719 8.712 1.00 0.00 H new ATOM 0 HD2 HIS A 163 16.180 -8.371 5.743 1.00 0.00 H new ATOM 0 HE1 HIS A 163 17.886 -12.206 6.483 1.00 0.00 H new ATOM 0 HE2 HIS A 163 16.451 -10.775 4.913 1.00 0.00 H new ATOM 2651 N GLN A 164 15.342 -6.106 10.654 1.00 0.00 N ATOM 2652 CA GLN A 164 14.973 -4.773 11.102 1.00 0.00 C ATOM 2653 C GLN A 164 16.186 -3.844 11.098 1.00 0.00 C ATOM 2654 O GLN A 164 16.050 -2.632 11.262 1.00 0.00 O ATOM 2655 CB GLN A 164 14.350 -4.841 12.502 1.00 0.00 C ATOM 2656 CG GLN A 164 13.177 -5.842 12.513 1.00 0.00 C ATOM 2657 CD GLN A 164 13.110 -6.556 13.860 1.00 0.00 C ATOM 2658 OE1 GLN A 164 12.687 -5.968 14.854 1.00 0.00 O ATOM 2659 NE2 GLN A 164 13.505 -7.796 13.949 1.00 0.00 N ATOM 0 H GLN A 164 14.975 -6.863 11.230 1.00 0.00 H new ATOM 0 HA GLN A 164 14.235 -4.367 10.410 1.00 0.00 H new ATOM 0 HB2 GLN A 164 15.103 -5.144 13.229 1.00 0.00 H new ATOM 0 HB3 GLN A 164 13.998 -3.853 12.800 1.00 0.00 H new ATOM 0 HG2 GLN A 164 12.240 -5.318 12.323 1.00 0.00 H new ATOM 0 HG3 GLN A 164 13.303 -6.571 11.712 1.00 0.00 H new ATOM 0 HE21 GLN A 164 13.855 -8.280 13.122 1.00 0.00 H new ATOM 0 HE22 GLN A 164 13.464 -8.281 14.845 1.00 0.00 H new ATOM 2668 N GLY A 165 17.370 -4.417 10.889 1.00 0.00 N ATOM 2669 CA GLY A 165 18.600 -3.631 10.837 1.00 0.00 C ATOM 2670 C GLY A 165 19.199 -3.692 9.438 1.00 0.00 C ATOM 2671 O GLY A 165 20.416 -3.755 9.267 1.00 0.00 O ATOM 0 H GLY A 165 17.503 -5.419 10.753 1.00 0.00 H new ATOM 0 HA2 GLY A 165 18.391 -2.596 11.107 1.00 0.00 H new ATOM 0 HA3 GLY A 165 19.316 -4.012 11.565 1.00 0.00 H new ATOM 2675 N CYS A 166 18.319 -3.680 8.444 1.00 0.00 N ATOM 2676 CA CYS A 166 18.736 -3.743 7.046 1.00 0.00 C ATOM 2677 C CYS A 166 19.947 -2.837 6.797 1.00 0.00 C ATOM 2678 O CYS A 166 20.110 -1.815 7.464 1.00 0.00 O ATOM 2679 CB CYS A 166 17.567 -3.325 6.144 1.00 0.00 C ATOM 2680 SG CYS A 166 17.568 -1.527 5.923 1.00 0.00 S ATOM 0 H CYS A 166 17.309 -3.627 8.579 1.00 0.00 H new ATOM 0 HA CYS A 166 19.027 -4.767 6.812 1.00 0.00 H new ATOM 0 HB2 CYS A 166 17.649 -3.819 5.176 1.00 0.00 H new ATOM 0 HB3 CYS A 166 16.623 -3.645 6.586 1.00 0.00 H new ATOM 0 HG CYS A 166 16.698 -0.991 6.726 1.00 0.00 H new ATOM 2686 N PRO A 167 20.793 -3.188 5.857 1.00 0.00 N ATOM 2687 CA PRO A 167 22.009 -2.383 5.528 1.00 0.00 C ATOM 2688 C PRO A 167 21.668 -1.049 4.865 1.00 0.00 C ATOM 2689 O PRO A 167 22.547 -0.213 4.654 1.00 0.00 O ATOM 2690 CB PRO A 167 22.800 -3.284 4.573 1.00 0.00 C ATOM 2691 CG PRO A 167 21.795 -4.206 3.969 1.00 0.00 C ATOM 2692 CD PRO A 167 20.689 -4.387 5.006 1.00 0.00 C ATOM 0 HA PRO A 167 22.567 -2.112 6.424 1.00 0.00 H new ATOM 0 HB2 PRO A 167 23.304 -2.696 3.806 1.00 0.00 H new ATOM 0 HB3 PRO A 167 23.571 -3.840 5.106 1.00 0.00 H new ATOM 0 HG2 PRO A 167 21.395 -3.790 3.044 1.00 0.00 H new ATOM 0 HG3 PRO A 167 22.250 -5.164 3.717 1.00 0.00 H new ATOM 0 HD2 PRO A 167 19.709 -4.457 4.535 1.00 0.00 H new ATOM 0 HD3 PRO A 167 20.831 -5.300 5.585 1.00 0.00 H new ATOM 2700 N PHE A 168 20.395 -0.850 4.540 1.00 0.00 N ATOM 2701 CA PHE A 168 19.974 0.394 3.903 1.00 0.00 C ATOM 2702 C PHE A 168 20.172 1.566 4.862 1.00 0.00 C ATOM 2703 O PHE A 168 20.191 1.389 6.080 1.00 0.00 O ATOM 2704 CB PHE A 168 18.492 0.299 3.483 1.00 0.00 C ATOM 2705 CG PHE A 168 18.298 0.853 2.088 1.00 0.00 C ATOM 2706 CD1 PHE A 168 18.408 2.229 1.856 1.00 0.00 C ATOM 2707 CD2 PHE A 168 17.999 -0.013 1.030 1.00 0.00 C ATOM 2708 CE1 PHE A 168 18.221 2.738 0.564 1.00 0.00 C ATOM 2709 CE2 PHE A 168 17.812 0.494 -0.261 1.00 0.00 C ATOM 2710 CZ PHE A 168 17.923 1.870 -0.493 1.00 0.00 C ATOM 0 H PHE A 168 19.646 -1.523 4.704 1.00 0.00 H new ATOM 0 HA PHE A 168 20.583 0.558 3.014 1.00 0.00 H new ATOM 0 HB2 PHE A 168 18.165 -0.740 3.516 1.00 0.00 H new ATOM 0 HB3 PHE A 168 17.872 0.851 4.189 1.00 0.00 H new ATOM 0 HD1 PHE A 168 18.637 2.898 2.672 1.00 0.00 H new ATOM 0 HD2 PHE A 168 17.912 -1.074 1.210 1.00 0.00 H new ATOM 0 HE1 PHE A 168 18.307 3.799 0.384 1.00 0.00 H new ATOM 0 HE2 PHE A 168 17.582 -0.175 -1.077 1.00 0.00 H new ATOM 0 HZ PHE A 168 17.779 2.262 -1.489 1.00 0.00 H new ATOM 2720 N GLN A 169 20.323 2.760 4.302 1.00 0.00 N ATOM 2721 CA GLN A 169 20.522 3.959 5.109 1.00 0.00 C ATOM 2722 C GLN A 169 19.740 5.137 4.527 1.00 0.00 C ATOM 2723 O GLN A 169 19.364 5.121 3.357 1.00 0.00 O ATOM 2724 CB GLN A 169 22.016 4.295 5.181 1.00 0.00 C ATOM 2725 CG GLN A 169 22.584 3.811 6.515 1.00 0.00 C ATOM 2726 CD GLN A 169 24.089 4.036 6.558 1.00 0.00 C ATOM 2727 OE1 GLN A 169 24.667 4.557 5.603 1.00 0.00 O ATOM 2728 NE2 GLN A 169 24.761 3.674 7.614 1.00 0.00 N ATOM 0 H GLN A 169 20.312 2.924 3.295 1.00 0.00 H new ATOM 0 HA GLN A 169 20.151 3.768 6.116 1.00 0.00 H new ATOM 0 HB2 GLN A 169 22.546 3.822 4.355 1.00 0.00 H new ATOM 0 HB3 GLN A 169 22.163 5.370 5.080 1.00 0.00 H new ATOM 0 HG2 GLN A 169 22.106 4.344 7.337 1.00 0.00 H new ATOM 0 HG3 GLN A 169 22.363 2.752 6.650 1.00 0.00 H new ATOM 0 HE21 GLN A 169 24.279 3.243 8.403 1.00 0.00 H new ATOM 0 HE22 GLN A 169 25.770 3.822 7.652 1.00 0.00 H new ATOM 2737 N PRO A 170 19.481 6.141 5.328 1.00 0.00 N ATOM 2738 CA PRO A 170 18.718 7.346 4.898 1.00 0.00 C ATOM 2739 C PRO A 170 19.598 8.356 4.159 1.00 0.00 C ATOM 2740 O PRO A 170 20.623 8.793 4.682 1.00 0.00 O ATOM 2741 CB PRO A 170 18.236 7.914 6.229 1.00 0.00 C ATOM 2742 CG PRO A 170 19.322 7.591 7.189 1.00 0.00 C ATOM 2743 CD PRO A 170 19.892 6.250 6.741 1.00 0.00 C ATOM 0 HA PRO A 170 17.918 7.114 4.195 1.00 0.00 H new ATOM 0 HB2 PRO A 170 18.071 8.989 6.165 1.00 0.00 H new ATOM 0 HB3 PRO A 170 17.291 7.464 6.533 1.00 0.00 H new ATOM 0 HG2 PRO A 170 20.091 8.364 7.183 1.00 0.00 H new ATOM 0 HG3 PRO A 170 18.938 7.531 8.207 1.00 0.00 H new ATOM 0 HD2 PRO A 170 20.977 6.223 6.844 1.00 0.00 H new ATOM 0 HD3 PRO A 170 19.494 5.428 7.337 1.00 0.00 H new ATOM 2751 N TRP A 171 19.198 8.719 2.940 1.00 0.00 N ATOM 2752 CA TRP A 171 19.967 9.670 2.145 1.00 0.00 C ATOM 2753 C TRP A 171 19.267 11.032 2.094 1.00 0.00 C ATOM 2754 O TRP A 171 18.047 11.122 2.245 1.00 0.00 O ATOM 2755 CB TRP A 171 20.150 9.118 0.732 1.00 0.00 C ATOM 2756 CG TRP A 171 18.820 8.939 0.087 1.00 0.00 C ATOM 2757 CD1 TRP A 171 18.332 9.702 -0.913 1.00 0.00 C ATOM 2758 CD2 TRP A 171 17.809 7.940 0.369 1.00 0.00 C ATOM 2759 NE1 TRP A 171 17.066 9.246 -1.246 1.00 0.00 N ATOM 2760 CE2 TRP A 171 16.707 8.152 -0.485 1.00 0.00 C ATOM 2761 CE3 TRP A 171 17.744 6.886 1.284 1.00 0.00 C ATOM 2762 CZ2 TRP A 171 15.580 7.334 -0.433 1.00 0.00 C ATOM 2763 CZ3 TRP A 171 16.620 6.062 1.343 1.00 0.00 C ATOM 2764 CH2 TRP A 171 15.541 6.283 0.488 1.00 0.00 C ATOM 0 H TRP A 171 18.353 8.371 2.487 1.00 0.00 H new ATOM 0 HA TRP A 171 20.942 9.810 2.611 1.00 0.00 H new ATOM 0 HB2 TRP A 171 20.763 9.799 0.142 1.00 0.00 H new ATOM 0 HB3 TRP A 171 20.678 8.165 0.769 1.00 0.00 H new ATOM 0 HD1 TRP A 171 18.844 10.532 -1.378 1.00 0.00 H new ATOM 0 HE1 TRP A 171 16.474 9.666 -1.963 1.00 0.00 H new ATOM 0 HE3 TRP A 171 18.573 6.707 1.953 1.00 0.00 H new ATOM 0 HZ2 TRP A 171 14.746 7.510 -1.097 1.00 0.00 H new ATOM 0 HZ3 TRP A 171 16.585 5.250 2.054 1.00 0.00 H new ATOM 0 HH2 TRP A 171 14.674 5.641 0.537 1.00 0.00 H new ATOM 2775 N ASP A 172 20.056 12.087 1.895 1.00 0.00 N ATOM 2776 CA ASP A 172 19.522 13.450 1.845 1.00 0.00 C ATOM 2777 C ASP A 172 18.658 13.677 0.615 1.00 0.00 C ATOM 2778 O ASP A 172 18.653 14.764 0.036 1.00 0.00 O ATOM 2779 CB ASP A 172 20.665 14.456 1.846 1.00 0.00 C ATOM 2780 CG ASP A 172 21.231 14.605 3.255 1.00 0.00 C ATOM 2781 OD1 ASP A 172 20.524 15.124 4.103 1.00 0.00 O ATOM 2782 OD2 ASP A 172 22.361 14.198 3.462 1.00 0.00 O ATOM 0 H ASP A 172 21.066 12.026 1.766 1.00 0.00 H new ATOM 0 HA ASP A 172 18.898 13.587 2.728 1.00 0.00 H new ATOM 0 HB2 ASP A 172 21.449 14.128 1.164 1.00 0.00 H new ATOM 0 HB3 ASP A 172 20.311 15.421 1.484 1.00 0.00 H new ATOM 2787 N GLY A 173 17.910 12.659 0.244 1.00 0.00 N ATOM 2788 CA GLY A 173 17.005 12.753 -0.900 1.00 0.00 C ATOM 2789 C GLY A 173 15.586 12.484 -0.440 1.00 0.00 C ATOM 2790 O GLY A 173 14.636 13.100 -0.924 1.00 0.00 O ATOM 0 H GLY A 173 17.905 11.753 0.713 1.00 0.00 H new ATOM 0 HA2 GLY A 173 17.072 13.743 -1.351 1.00 0.00 H new ATOM 0 HA3 GLY A 173 17.293 12.034 -1.667 1.00 0.00 H new ATOM 2794 N LEU A 174 15.448 11.571 0.519 1.00 0.00 N ATOM 2795 CA LEU A 174 14.148 11.246 1.057 1.00 0.00 C ATOM 2796 C LEU A 174 13.323 12.515 1.186 1.00 0.00 C ATOM 2797 O LEU A 174 12.095 12.502 1.102 1.00 0.00 O ATOM 2798 CB LEU A 174 14.320 10.620 2.425 1.00 0.00 C ATOM 2799 CG LEU A 174 14.801 9.182 2.258 1.00 0.00 C ATOM 2800 CD1 LEU A 174 15.322 8.683 3.591 1.00 0.00 C ATOM 2801 CD2 LEU A 174 13.650 8.284 1.795 1.00 0.00 C ATOM 0 H LEU A 174 16.222 11.051 0.932 1.00 0.00 H new ATOM 0 HA LEU A 174 13.640 10.548 0.392 1.00 0.00 H new ATOM 0 HB2 LEU A 174 15.039 11.191 3.012 1.00 0.00 H new ATOM 0 HB3 LEU A 174 13.376 10.640 2.969 1.00 0.00 H new ATOM 0 HG LEU A 174 15.591 9.152 1.508 1.00 0.00 H new ATOM 0 HD11 LEU A 174 15.669 7.655 3.484 1.00 0.00 H new ATOM 0 HD12 LEU A 174 16.149 9.313 3.917 1.00 0.00 H new ATOM 0 HD13 LEU A 174 14.523 8.721 4.331 1.00 0.00 H new ATOM 0 HD21 LEU A 174 14.010 7.261 1.681 1.00 0.00 H new ATOM 0 HD22 LEU A 174 12.850 8.307 2.535 1.00 0.00 H new ATOM 0 HD23 LEU A 174 13.270 8.644 0.839 1.00 0.00 H new ATOM 2813 N ASP A 175 14.038 13.610 1.386 1.00 0.00 N ATOM 2814 CA ASP A 175 13.435 14.921 1.529 1.00 0.00 C ATOM 2815 C ASP A 175 12.716 15.296 0.250 1.00 0.00 C ATOM 2816 O ASP A 175 11.498 15.460 0.218 1.00 0.00 O ATOM 2817 CB ASP A 175 14.544 15.936 1.799 1.00 0.00 C ATOM 2818 CG ASP A 175 14.020 17.090 2.649 1.00 0.00 C ATOM 2819 OD1 ASP A 175 13.444 18.002 2.080 1.00 0.00 O ATOM 2820 OD2 ASP A 175 14.200 17.042 3.855 1.00 0.00 O ATOM 0 H ASP A 175 15.056 13.613 1.454 1.00 0.00 H new ATOM 0 HA ASP A 175 12.719 14.912 2.351 1.00 0.00 H new ATOM 0 HB2 ASP A 175 15.374 15.448 2.310 1.00 0.00 H new ATOM 0 HB3 ASP A 175 14.932 16.319 0.855 1.00 0.00 H new ATOM 2825 N GLU A 176 13.501 15.418 -0.804 1.00 0.00 N ATOM 2826 CA GLU A 176 12.963 15.766 -2.108 1.00 0.00 C ATOM 2827 C GLU A 176 11.737 14.917 -2.404 1.00 0.00 C ATOM 2828 O GLU A 176 10.696 15.423 -2.823 1.00 0.00 O ATOM 2829 CB GLU A 176 14.016 15.536 -3.179 1.00 0.00 C ATOM 2830 CG GLU A 176 13.628 16.291 -4.453 1.00 0.00 C ATOM 2831 CD GLU A 176 14.545 15.884 -5.600 1.00 0.00 C ATOM 2832 OE1 GLU A 176 14.619 14.700 -5.882 1.00 0.00 O ATOM 2833 OE2 GLU A 176 15.158 16.764 -6.184 1.00 0.00 O ATOM 0 H GLU A 176 14.512 15.282 -0.784 1.00 0.00 H new ATOM 0 HA GLU A 176 12.678 16.818 -2.106 1.00 0.00 H new ATOM 0 HB2 GLU A 176 14.989 15.876 -2.825 1.00 0.00 H new ATOM 0 HB3 GLU A 176 14.108 14.471 -3.390 1.00 0.00 H new ATOM 0 HG2 GLU A 176 12.591 16.076 -4.712 1.00 0.00 H new ATOM 0 HG3 GLU A 176 13.698 17.366 -4.284 1.00 0.00 H new ATOM 2840 N HIS A 177 11.873 13.618 -2.168 1.00 0.00 N ATOM 2841 CA HIS A 177 10.770 12.691 -2.398 1.00 0.00 C ATOM 2842 C HIS A 177 9.610 13.029 -1.472 1.00 0.00 C ATOM 2843 O HIS A 177 8.571 13.522 -1.913 1.00 0.00 O ATOM 2844 CB HIS A 177 11.227 11.254 -2.141 1.00 0.00 C ATOM 2845 CG HIS A 177 12.200 10.845 -3.210 1.00 0.00 C ATOM 2846 ND1 HIS A 177 12.235 9.762 -4.051 1.00 0.00 N flip ATOM 2847 CD2 HIS A 177 13.318 11.602 -3.521 1.00 0.00 C flip ATOM 2848 CE1 HIS A 177 13.353 9.844 -4.875 1.00 0.00 C flip ATOM 2849 NE2 HIS A 177 13.971 10.971 -4.513 1.00 0.00 N flip ATOM 0 H HIS A 177 12.728 13.184 -1.820 1.00 0.00 H new ATOM 0 HA HIS A 177 10.445 12.782 -3.434 1.00 0.00 H new ATOM 0 HB2 HIS A 177 11.695 11.179 -1.159 1.00 0.00 H new ATOM 0 HB3 HIS A 177 10.369 10.582 -2.138 1.00 0.00 H new ATOM 0 HD2 HIS A 177 13.612 12.530 -3.052 1.00 0.00 H new ATOM 0 HE1 HIS A 177 13.656 9.147 -5.642 1.00 0.00 H new ATOM 0 HE2 HIS A 177 14.834 11.312 -4.937 1.00 0.00 H new ATOM 2858 N SER A 178 9.805 12.774 -0.184 1.00 0.00 N ATOM 2859 CA SER A 178 8.782 13.070 0.810 1.00 0.00 C ATOM 2860 C SER A 178 8.059 14.360 0.446 1.00 0.00 C ATOM 2861 O SER A 178 6.857 14.362 0.190 1.00 0.00 O ATOM 2862 CB SER A 178 9.436 13.218 2.180 1.00 0.00 C ATOM 2863 OG SER A 178 8.495 13.762 3.093 1.00 0.00 O ATOM 0 H SER A 178 10.659 12.365 0.195 1.00 0.00 H new ATOM 0 HA SER A 178 8.059 12.254 0.835 1.00 0.00 H new ATOM 0 HB2 SER A 178 9.786 12.249 2.535 1.00 0.00 H new ATOM 0 HB3 SER A 178 10.309 13.866 2.111 1.00 0.00 H new ATOM 0 HG SER A 178 8.965 14.287 3.774 1.00 0.00 H new ATOM 2869 N GLN A 179 8.811 15.451 0.406 1.00 0.00 N ATOM 2870 CA GLN A 179 8.248 16.746 0.052 1.00 0.00 C ATOM 2871 C GLN A 179 7.250 16.592 -1.085 1.00 0.00 C ATOM 2872 O GLN A 179 6.127 17.092 -1.024 1.00 0.00 O ATOM 2873 CB GLN A 179 9.367 17.677 -0.410 1.00 0.00 C ATOM 2874 CG GLN A 179 8.851 19.116 -0.464 1.00 0.00 C ATOM 2875 CD GLN A 179 9.671 19.923 -1.465 1.00 0.00 C ATOM 2876 OE1 GLN A 179 9.672 19.617 -2.657 1.00 0.00 O ATOM 2877 NE2 GLN A 179 10.374 20.940 -1.049 1.00 0.00 N ATOM 0 H GLN A 179 9.810 15.465 0.614 1.00 0.00 H new ATOM 0 HA GLN A 179 7.746 17.159 0.927 1.00 0.00 H new ATOM 0 HB2 GLN A 179 10.214 17.610 0.272 1.00 0.00 H new ATOM 0 HB3 GLN A 179 9.725 17.372 -1.393 1.00 0.00 H new ATOM 0 HG2 GLN A 179 7.800 19.124 -0.751 1.00 0.00 H new ATOM 0 HG3 GLN A 179 8.915 19.572 0.524 1.00 0.00 H new ATOM 0 HE21 GLN A 179 10.371 21.192 -0.061 1.00 0.00 H new ATOM 0 HE22 GLN A 179 10.926 21.484 -1.712 1.00 0.00 H new ATOM 2886 N ASP A 180 7.688 15.904 -2.126 1.00 0.00 N ATOM 2887 CA ASP A 180 6.868 15.681 -3.298 1.00 0.00 C ATOM 2888 C ASP A 180 5.554 14.991 -2.939 1.00 0.00 C ATOM 2889 O ASP A 180 4.480 15.567 -3.117 1.00 0.00 O ATOM 2890 CB ASP A 180 7.664 14.845 -4.292 1.00 0.00 C ATOM 2891 CG ASP A 180 7.171 15.101 -5.712 1.00 0.00 C ATOM 2892 OD1 ASP A 180 6.070 14.679 -6.022 1.00 0.00 O ATOM 2893 OD2 ASP A 180 7.904 15.716 -6.469 1.00 0.00 O ATOM 0 H ASP A 180 8.618 15.487 -2.180 1.00 0.00 H new ATOM 0 HA ASP A 180 6.609 16.642 -3.743 1.00 0.00 H new ATOM 0 HB2 ASP A 180 8.723 15.090 -4.218 1.00 0.00 H new ATOM 0 HB3 ASP A 180 7.564 13.787 -4.050 1.00 0.00 H new ATOM 2898 N LEU A 181 5.627 13.762 -2.429 1.00 0.00 N ATOM 2899 CA LEU A 181 4.423 13.043 -2.058 1.00 0.00 C ATOM 2900 C LEU A 181 3.630 13.863 -1.053 1.00 0.00 C ATOM 2901 O LEU A 181 2.463 14.174 -1.259 1.00 0.00 O ATOM 2902 CB LEU A 181 4.805 11.710 -1.423 1.00 0.00 C ATOM 2903 CG LEU A 181 3.630 10.710 -1.429 1.00 0.00 C ATOM 2904 CD1 LEU A 181 3.812 9.726 -0.277 1.00 0.00 C ATOM 2905 CD2 LEU A 181 2.266 11.398 -1.242 1.00 0.00 C ATOM 0 H LEU A 181 6.497 13.255 -2.267 1.00 0.00 H new ATOM 0 HA LEU A 181 3.818 12.869 -2.948 1.00 0.00 H new ATOM 0 HB2 LEU A 181 5.650 11.280 -1.962 1.00 0.00 H new ATOM 0 HB3 LEU A 181 5.133 11.878 -0.397 1.00 0.00 H new ATOM 0 HG LEU A 181 3.636 10.214 -2.399 1.00 0.00 H new ATOM 0 HD11 LEU A 181 2.986 9.015 -0.272 1.00 0.00 H new ATOM 0 HD12 LEU A 181 4.753 9.190 -0.402 1.00 0.00 H new ATOM 0 HD13 LEU A 181 3.827 10.270 0.667 1.00 0.00 H new ATOM 0 HD21 LEU A 181 1.475 10.648 -1.254 1.00 0.00 H new ATOM 0 HD22 LEU A 181 2.252 11.925 -0.288 1.00 0.00 H new ATOM 0 HD23 LEU A 181 2.103 12.110 -2.052 1.00 0.00 H new ATOM 2917 N SER A 182 4.273 14.197 0.052 1.00 0.00 N ATOM 2918 CA SER A 182 3.612 14.967 1.086 1.00 0.00 C ATOM 2919 C SER A 182 2.915 16.180 0.481 1.00 0.00 C ATOM 2920 O SER A 182 1.694 16.249 0.436 1.00 0.00 O ATOM 2921 CB SER A 182 4.634 15.428 2.124 1.00 0.00 C ATOM 2922 OG SER A 182 4.134 16.575 2.798 1.00 0.00 O ATOM 0 H SER A 182 5.242 13.950 0.254 1.00 0.00 H new ATOM 0 HA SER A 182 2.866 14.335 1.568 1.00 0.00 H new ATOM 0 HB2 SER A 182 4.830 14.629 2.839 1.00 0.00 H new ATOM 0 HB3 SER A 182 5.582 15.661 1.639 1.00 0.00 H new ATOM 0 HG SER A 182 4.787 16.872 3.466 1.00 0.00 H new ATOM 2928 N GLY A 183 3.692 17.132 -0.004 1.00 0.00 N ATOM 2929 CA GLY A 183 3.111 18.325 -0.599 1.00 0.00 C ATOM 2930 C GLY A 183 1.873 17.964 -1.397 1.00 0.00 C ATOM 2931 O GLY A 183 0.890 18.701 -1.401 1.00 0.00 O ATOM 0 H GLY A 183 4.712 17.106 0.001 1.00 0.00 H new ATOM 0 HA2 GLY A 183 2.853 19.041 0.182 1.00 0.00 H new ATOM 0 HA3 GLY A 183 3.841 18.809 -1.247 1.00 0.00 H new ATOM 2935 N ARG A 184 1.923 16.819 -2.064 1.00 0.00 N ATOM 2936 CA ARG A 184 0.789 16.376 -2.850 1.00 0.00 C ATOM 2937 C ARG A 184 -0.340 15.877 -1.960 1.00 0.00 C ATOM 2938 O ARG A 184 -1.390 16.510 -1.883 1.00 0.00 O ATOM 2939 CB ARG A 184 1.185 15.270 -3.818 1.00 0.00 C ATOM 2940 CG ARG A 184 1.909 15.881 -5.019 1.00 0.00 C ATOM 2941 CD ARG A 184 0.898 16.233 -6.107 1.00 0.00 C ATOM 2942 NE ARG A 184 0.133 15.049 -6.478 1.00 0.00 N ATOM 2943 CZ ARG A 184 -1.126 15.140 -6.897 1.00 0.00 C ATOM 2944 NH1 ARG A 184 -1.697 16.309 -7.007 1.00 0.00 N ATOM 2945 NH2 ARG A 184 -1.790 14.058 -7.200 1.00 0.00 N ATOM 0 H ARG A 184 2.726 16.191 -2.075 1.00 0.00 H new ATOM 0 HA ARG A 184 0.442 17.240 -3.417 1.00 0.00 H new ATOM 0 HB2 ARG A 184 1.831 14.548 -3.318 1.00 0.00 H new ATOM 0 HB3 ARG A 184 0.300 14.728 -4.150 1.00 0.00 H new ATOM 0 HG2 ARG A 184 2.452 16.775 -4.712 1.00 0.00 H new ATOM 0 HG3 ARG A 184 2.646 15.178 -5.408 1.00 0.00 H new ATOM 0 HD2 ARG A 184 0.226 17.014 -5.751 1.00 0.00 H new ATOM 0 HD3 ARG A 184 1.415 16.631 -6.980 1.00 0.00 H new ATOM 0 HE ARG A 184 0.573 14.131 -6.415 1.00 0.00 H new ATOM 0 HH11 ARG A 184 -1.177 17.155 -6.771 1.00 0.00 H new ATOM 0 HH12 ARG A 184 -2.663 16.377 -7.329 1.00 0.00 H new ATOM 0 HH21 ARG A 184 -1.343 13.145 -7.115 1.00 0.00 H new ATOM 0 HH22 ARG A 184 -2.756 14.125 -7.522 1.00 0.00 H new ATOM 2959 N LEU A 185 -0.122 14.738 -1.291 1.00 0.00 N ATOM 2960 CA LEU A 185 -1.153 14.174 -0.418 1.00 0.00 C ATOM 2961 C LEU A 185 -1.877 15.299 0.288 1.00 0.00 C ATOM 2962 O LEU A 185 -3.104 15.334 0.357 1.00 0.00 O ATOM 2963 CB LEU A 185 -0.552 13.218 0.596 1.00 0.00 C ATOM 2964 CG LEU A 185 -1.694 12.476 1.325 1.00 0.00 C ATOM 2965 CD1 LEU A 185 -1.753 11.017 0.860 1.00 0.00 C ATOM 2966 CD2 LEU A 185 -1.468 12.528 2.842 1.00 0.00 C ATOM 0 H LEU A 185 0.743 14.199 -1.337 1.00 0.00 H new ATOM 0 HA LEU A 185 -1.857 13.609 -1.028 1.00 0.00 H new ATOM 0 HB2 LEU A 185 0.103 12.504 0.098 1.00 0.00 H new ATOM 0 HB3 LEU A 185 0.060 13.765 1.313 1.00 0.00 H new ATOM 0 HG LEU A 185 -2.639 12.964 1.087 1.00 0.00 H new ATOM 0 HD11 LEU A 185 -2.561 10.502 1.379 1.00 0.00 H new ATOM 0 HD12 LEU A 185 -1.934 10.985 -0.214 1.00 0.00 H new ATOM 0 HD13 LEU A 185 -0.806 10.525 1.084 1.00 0.00 H new ATOM 0 HD21 LEU A 185 -2.278 12.003 3.349 1.00 0.00 H new ATOM 0 HD22 LEU A 185 -0.518 12.052 3.085 1.00 0.00 H new ATOM 0 HD23 LEU A 185 -1.448 13.567 3.171 1.00 0.00 H new ATOM 2978 N ARG A 186 -1.095 16.248 0.755 1.00 0.00 N ATOM 2979 CA ARG A 186 -1.627 17.430 1.384 1.00 0.00 C ATOM 2980 C ARG A 186 -2.514 18.117 0.402 1.00 0.00 C ATOM 2981 O ARG A 186 -3.716 18.227 0.569 1.00 0.00 O ATOM 2982 CB ARG A 186 -0.453 18.332 1.673 1.00 0.00 C ATOM 2983 CG ARG A 186 0.499 17.707 2.710 1.00 0.00 C ATOM 2984 CD ARG A 186 0.291 16.194 2.951 1.00 0.00 C ATOM 2985 NE ARG A 186 0.996 15.790 4.160 1.00 0.00 N ATOM 2986 CZ ARG A 186 0.595 16.205 5.357 1.00 0.00 C ATOM 2987 NH1 ARG A 186 -0.442 16.990 5.460 1.00 0.00 N ATOM 2988 NH2 ARG A 186 1.239 15.831 6.428 1.00 0.00 N ATOM 0 H ARG A 186 -0.076 16.219 0.708 1.00 0.00 H new ATOM 0 HA ARG A 186 -2.182 17.191 2.291 1.00 0.00 H new ATOM 0 HB2 ARG A 186 0.092 18.528 0.750 1.00 0.00 H new ATOM 0 HB3 ARG A 186 -0.813 19.293 2.041 1.00 0.00 H new ATOM 0 HG2 ARG A 186 1.526 17.871 2.385 1.00 0.00 H new ATOM 0 HG3 ARG A 186 0.377 18.232 3.657 1.00 0.00 H new ATOM 0 HD2 ARG A 186 -0.772 15.974 3.047 1.00 0.00 H new ATOM 0 HD3 ARG A 186 0.658 15.626 2.097 1.00 0.00 H new ATOM 0 HE ARG A 186 1.810 15.179 4.087 1.00 0.00 H new ATOM 0 HH11 ARG A 186 -0.944 17.284 4.622 1.00 0.00 H new ATOM 0 HH12 ARG A 186 -0.751 17.309 6.378 1.00 0.00 H new ATOM 0 HH21 ARG A 186 2.051 15.219 6.347 1.00 0.00 H new ATOM 0 HH22 ARG A 186 0.930 16.150 7.346 1.00 0.00 H new ATOM 3002 N ALA A 187 -1.868 18.561 -0.631 1.00 0.00 N ATOM 3003 CA ALA A 187 -2.537 19.269 -1.714 1.00 0.00 C ATOM 3004 C ALA A 187 -3.856 18.619 -2.102 1.00 0.00 C ATOM 3005 O ALA A 187 -4.916 19.234 -1.983 1.00 0.00 O ATOM 3006 CB ALA A 187 -1.651 19.291 -2.945 1.00 0.00 C ATOM 0 H ALA A 187 -0.862 18.450 -0.761 1.00 0.00 H new ATOM 0 HA ALA A 187 -2.735 20.278 -1.351 1.00 0.00 H new ATOM 0 HB1 ALA A 187 -2.159 19.822 -3.750 1.00 0.00 H new ATOM 0 HB2 ALA A 187 -0.715 19.797 -2.710 1.00 0.00 H new ATOM 0 HB3 ALA A 187 -1.441 18.269 -3.261 1.00 0.00 H new ATOM 3012 N ILE A 188 -3.787 17.392 -2.610 1.00 0.00 N ATOM 3013 CA ILE A 188 -4.991 16.717 -3.054 1.00 0.00 C ATOM 3014 C ILE A 188 -6.084 16.795 -1.985 1.00 0.00 C ATOM 3015 O ILE A 188 -7.257 16.979 -2.308 1.00 0.00 O ATOM 3016 CB ILE A 188 -4.713 15.244 -3.442 1.00 0.00 C ATOM 3017 CG1 ILE A 188 -3.803 14.569 -2.393 1.00 0.00 C ATOM 3018 CG2 ILE A 188 -4.033 15.167 -4.824 1.00 0.00 C ATOM 3019 CD1 ILE A 188 -4.648 13.738 -1.424 1.00 0.00 C ATOM 0 H ILE A 188 -2.925 16.857 -2.721 1.00 0.00 H new ATOM 0 HA ILE A 188 -5.342 17.233 -3.948 1.00 0.00 H new ATOM 0 HB ILE A 188 -5.669 14.722 -3.480 1.00 0.00 H new ATOM 0 HG12 ILE A 188 -3.072 13.931 -2.890 1.00 0.00 H new ATOM 0 HG13 ILE A 188 -3.244 15.326 -1.843 1.00 0.00 H new ATOM 0 HG21 ILE A 188 -3.845 14.124 -5.080 1.00 0.00 H new ATOM 0 HG22 ILE A 188 -4.684 15.613 -5.575 1.00 0.00 H new ATOM 0 HG23 ILE A 188 -3.088 15.709 -4.795 1.00 0.00 H new ATOM 0 HD11 ILE A 188 -3.998 13.265 -0.688 1.00 0.00 H new ATOM 0 HD12 ILE A 188 -5.361 14.386 -0.915 1.00 0.00 H new ATOM 0 HD13 ILE A 188 -5.187 12.970 -1.978 1.00 0.00 H new ATOM 3031 N LEU A 189 -5.700 16.671 -0.715 1.00 0.00 N ATOM 3032 CA LEU A 189 -6.669 16.749 0.376 1.00 0.00 C ATOM 3033 C LEU A 189 -7.062 18.208 0.601 1.00 0.00 C ATOM 3034 O LEU A 189 -8.233 18.580 0.515 1.00 0.00 O ATOM 3035 CB LEU A 189 -6.033 16.171 1.655 1.00 0.00 C ATOM 3036 CG LEU A 189 -6.880 15.025 2.210 1.00 0.00 C ATOM 3037 CD1 LEU A 189 -6.658 13.772 1.375 1.00 0.00 C ATOM 3038 CD2 LEU A 189 -6.460 14.732 3.647 1.00 0.00 C ATOM 0 H LEU A 189 -4.736 16.518 -0.419 1.00 0.00 H new ATOM 0 HA LEU A 189 -7.561 16.175 0.125 1.00 0.00 H new ATOM 0 HB2 LEU A 189 -5.027 15.813 1.437 1.00 0.00 H new ATOM 0 HB3 LEU A 189 -5.937 16.955 2.406 1.00 0.00 H new ATOM 0 HG LEU A 189 -7.931 15.312 2.177 1.00 0.00 H new ATOM 0 HD11 LEU A 189 -7.263 12.957 1.773 1.00 0.00 H new ATOM 0 HD12 LEU A 189 -6.947 13.967 0.342 1.00 0.00 H new ATOM 0 HD13 LEU A 189 -5.605 13.493 1.411 1.00 0.00 H new ATOM 0 HD21 LEU A 189 -7.063 13.915 4.043 1.00 0.00 H new ATOM 0 HD22 LEU A 189 -5.408 14.449 3.668 1.00 0.00 H new ATOM 0 HD23 LEU A 189 -6.608 15.622 4.258 1.00 0.00 H new ATOM 3050 N GLN A 190 -6.051 19.017 0.878 1.00 0.00 N ATOM 3051 CA GLN A 190 -6.215 20.434 1.113 1.00 0.00 C ATOM 3052 C GLN A 190 -6.670 21.150 -0.156 1.00 0.00 C ATOM 3053 O GLN A 190 -6.590 22.374 -0.255 1.00 0.00 O ATOM 3054 CB GLN A 190 -4.877 21.000 1.604 1.00 0.00 C ATOM 3055 CG GLN A 190 -4.888 21.125 3.127 1.00 0.00 C ATOM 3056 CD GLN A 190 -3.641 21.863 3.599 1.00 0.00 C ATOM 3057 OE1 GLN A 190 -2.606 21.821 2.936 1.00 0.00 O ATOM 3058 NE2 GLN A 190 -3.677 22.542 4.714 1.00 0.00 N ATOM 0 H GLN A 190 -5.084 18.699 0.946 1.00 0.00 H new ATOM 0 HA GLN A 190 -6.985 20.593 1.868 1.00 0.00 H new ATOM 0 HB2 GLN A 190 -4.061 20.349 1.290 1.00 0.00 H new ATOM 0 HB3 GLN A 190 -4.698 21.976 1.152 1.00 0.00 H new ATOM 0 HG2 GLN A 190 -5.781 21.660 3.450 1.00 0.00 H new ATOM 0 HG3 GLN A 190 -4.928 20.135 3.581 1.00 0.00 H new ATOM 0 HE21 GLN A 190 -4.536 22.576 5.263 1.00 0.00 H new ATOM 0 HE22 GLN A 190 -2.846 23.038 5.036 1.00 0.00 H new ATOM 3067 N ASN A 191 -7.151 20.365 -1.108 1.00 0.00 N ATOM 3068 CA ASN A 191 -7.636 20.887 -2.379 1.00 0.00 C ATOM 3069 C ASN A 191 -6.923 22.190 -2.743 1.00 0.00 C ATOM 3070 O ASN A 191 -7.464 23.281 -2.562 1.00 0.00 O ATOM 3071 CB ASN A 191 -9.147 21.089 -2.279 1.00 0.00 C ATOM 3072 CG ASN A 191 -9.639 22.160 -3.239 1.00 0.00 C ATOM 3073 OD1 ASN A 191 -8.971 22.478 -4.224 1.00 0.00 O ATOM 3074 ND2 ASN A 191 -10.784 22.731 -3.013 1.00 0.00 N ATOM 0 H ASN A 191 -7.217 19.351 -1.023 1.00 0.00 H new ATOM 0 HA ASN A 191 -7.420 20.175 -3.175 1.00 0.00 H new ATOM 0 HB2 ASN A 191 -9.654 20.148 -2.493 1.00 0.00 H new ATOM 0 HB3 ASN A 191 -9.410 21.368 -1.258 1.00 0.00 H new ATOM 0 HD21 ASN A 191 -11.133 23.445 -3.652 1.00 0.00 H new ATOM 0 HD22 ASN A 191 -11.334 22.465 -2.196 1.00 0.00 H new ATOM 3081 N GLN A 192 -5.702 22.063 -3.247 1.00 0.00 N ATOM 3082 CA GLN A 192 -4.914 23.219 -3.628 1.00 0.00 C ATOM 3083 C GLN A 192 -5.550 23.936 -4.816 1.00 0.00 C ATOM 3084 O GLN A 192 -5.232 23.649 -5.971 1.00 0.00 O ATOM 3085 CB GLN A 192 -3.504 22.752 -3.988 1.00 0.00 C ATOM 3086 CG GLN A 192 -2.495 23.845 -3.647 1.00 0.00 C ATOM 3087 CD GLN A 192 -2.784 25.102 -4.462 1.00 0.00 C ATOM 3088 OE1 GLN A 192 -2.618 25.104 -5.682 1.00 0.00 O ATOM 3089 NE2 GLN A 192 -3.211 26.176 -3.856 1.00 0.00 N ATOM 0 H GLN A 192 -5.239 21.167 -3.400 1.00 0.00 H new ATOM 0 HA GLN A 192 -4.872 23.921 -2.795 1.00 0.00 H new ATOM 0 HB2 GLN A 192 -3.263 21.839 -3.443 1.00 0.00 H new ATOM 0 HB3 GLN A 192 -3.450 22.513 -5.050 1.00 0.00 H new ATOM 0 HG2 GLN A 192 -2.542 24.074 -2.582 1.00 0.00 H new ATOM 0 HG3 GLN A 192 -1.484 23.494 -3.853 1.00 0.00 H new ATOM 0 HE21 GLN A 192 -3.348 26.171 -2.845 1.00 0.00 H new ATOM 0 HE22 GLN A 192 -3.408 27.020 -4.393 1.00 0.00 H new ATOM 3098 N GLU A 193 -6.449 24.869 -4.525 1.00 0.00 N ATOM 3099 CA GLU A 193 -7.122 25.621 -5.577 1.00 0.00 C ATOM 3100 C GLU A 193 -7.632 24.684 -6.666 1.00 0.00 C ATOM 3101 O GLU A 193 -7.488 23.466 -6.571 1.00 0.00 O ATOM 3102 CB GLU A 193 -6.159 26.639 -6.189 1.00 0.00 C ATOM 3103 CG GLU A 193 -6.059 27.861 -5.276 1.00 0.00 C ATOM 3104 CD GLU A 193 -5.241 28.954 -5.954 1.00 0.00 C ATOM 3105 OE1 GLU A 193 -5.824 29.738 -6.683 1.00 0.00 O ATOM 3106 OE2 GLU A 193 -4.041 28.991 -5.734 1.00 0.00 O ATOM 0 H GLU A 193 -6.727 25.122 -3.577 1.00 0.00 H new ATOM 0 HA GLU A 193 -7.971 26.143 -5.136 1.00 0.00 H new ATOM 0 HB2 GLU A 193 -5.175 26.190 -6.322 1.00 0.00 H new ATOM 0 HB3 GLU A 193 -6.509 26.938 -7.177 1.00 0.00 H new ATOM 0 HG2 GLU A 193 -7.057 28.234 -5.043 1.00 0.00 H new ATOM 0 HG3 GLU A 193 -5.594 27.581 -4.330 1.00 0.00 H new ATOM 3113 N ASN A 194 -8.227 25.267 -7.700 1.00 0.00 N ATOM 3114 CA ASN A 194 -8.757 24.484 -8.806 1.00 0.00 C ATOM 3115 C ASN A 194 -7.737 23.447 -9.267 1.00 0.00 C ATOM 3116 O ASN A 194 -8.147 22.342 -9.584 1.00 0.00 O ATOM 3117 CB ASN A 194 -9.110 25.409 -9.970 1.00 0.00 C ATOM 3118 CG ASN A 194 -8.009 26.446 -10.165 1.00 0.00 C ATOM 3119 OD1 ASN A 194 -7.935 27.422 -9.419 1.00 0.00 O ATOM 3120 ND2 ASN A 194 -7.142 26.291 -11.129 1.00 0.00 N ATOM 3121 OXT ASN A 194 -6.561 23.772 -9.293 1.00 0.00 O ATOM 0 H ASN A 194 -8.353 26.275 -7.794 1.00 0.00 H new ATOM 0 HA ASN A 194 -9.654 23.965 -8.466 1.00 0.00 H new ATOM 0 HB2 ASN A 194 -9.238 24.826 -10.882 1.00 0.00 H new ATOM 0 HB3 ASN A 194 -10.060 25.907 -9.774 1.00 0.00 H new ATOM 0 HD21 ASN A 194 -6.402 26.979 -11.265 1.00 0.00 H new ATOM 0 HD22 ASN A 194 -7.205 25.481 -11.746 1.00 0.00 H new