USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 834 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 108 ASN : amide:sc=-0.00238 K(o=0.033,f=-0.56!) USER MOD Set 1.2: A 112 ASN : amide:sc= 0.0351 X(o=0.033,f=-0.036) USER MOD Single : A 34 LYS NZ :NH3+ -163:sc= -0.023 (180deg=-0.277) USER MOD Single : A 35 HIS : no HE2:sc= 0.376 K(o=0.38,f=-1.5) USER MOD Single : A 37 GLN : amide:sc= -0.493 X(o=-0.49,f=-0.03) USER MOD Single : A 40 TYR OH : rot 2:sc= 0.0572 USER MOD Single : A 50 SER OG : rot -98:sc= 1.2 USER MOD Single : A 51 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 54 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 59 GLN : amide:sc= -2.86! C(o=-2.9!,f=-3.1!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= -2! C(o=-2!,f=-2.1!) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl -176:sc= -0.838 (180deg=-0.874) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot -97:sc= 0.00146 USER MOD Single : A 91 GLN : amide:sc= 1.13 K(o=1.1,f=-0.13) USER MOD Single : A 94 LYS NZ :NH3+ 162:sc= 2.23 (180deg=0.907) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 GLN : amide:sc= -2.39! C(o=-2.4!,f=-9.4!) USER MOD Single : A 105 SER OG : rot 71:sc= 1.2 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 1.25 (180deg=1.25) USER MOD Single : A 122 SER OG : rot 80:sc= 0 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0.0289 USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 GLN :FLIP amide:sc= -0.0668 F(o=-1.7!,f=-0.067) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 139 MET CE :methyl -170:sc= -2.16 (180deg=-2.57) USER MOD Single : A 141 TYR OH : rot 30:sc= 0 USER MOD Single : A 142 CYS SG : rot 88:sc= -2.99! USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 540 N LYS A 34 -10.561 0.667 -7.262 1.00 0.00 N ATOM 541 CA LYS A 34 -9.977 -0.388 -6.411 1.00 0.00 C ATOM 542 C LYS A 34 -8.783 -1.093 -7.071 1.00 0.00 C ATOM 543 O LYS A 34 -8.166 -0.569 -8.001 1.00 0.00 O ATOM 544 CB LYS A 34 -11.034 -1.416 -5.941 1.00 0.00 C ATOM 545 CG LYS A 34 -11.786 -2.151 -7.040 1.00 0.00 C ATOM 546 CD LYS A 34 -12.668 -3.246 -6.461 1.00 0.00 C ATOM 547 CE LYS A 34 -13.595 -3.837 -7.509 1.00 0.00 C ATOM 548 NZ LYS A 34 -14.604 -2.849 -7.973 1.00 0.00 N ATOM 0 HA LYS A 34 -9.598 0.126 -5.527 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -10.538 -2.155 -5.311 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -11.761 -0.899 -5.314 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -12.398 -1.445 -7.601 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -11.076 -2.586 -7.743 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -12.042 -4.034 -6.044 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -13.259 -2.840 -5.640 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -13.008 -4.184 -8.359 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -14.103 -4.708 -7.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -15.381 -3.346 -8.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -14.980 -2.327 -7.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -14.158 -2.182 -8.634 1.00 0.00 H new ATOM 562 N HIS A 35 -8.435 -2.262 -6.545 1.00 0.00 N ATOM 563 CA HIS A 35 -7.291 -3.035 -7.023 1.00 0.00 C ATOM 564 C HIS A 35 -7.537 -4.517 -6.768 1.00 0.00 C ATOM 565 O HIS A 35 -8.650 -4.913 -6.421 1.00 0.00 O ATOM 566 CB HIS A 35 -5.993 -2.612 -6.310 1.00 0.00 C ATOM 567 CG HIS A 35 -5.489 -1.248 -6.675 1.00 0.00 C ATOM 568 ND1 HIS A 35 -5.453 -0.193 -5.784 1.00 0.00 N ATOM 569 CD2 HIS A 35 -4.978 -0.772 -7.837 1.00 0.00 C ATOM 570 CE1 HIS A 35 -4.943 0.868 -6.384 1.00 0.00 C ATOM 571 NE2 HIS A 35 -4.647 0.542 -7.626 1.00 0.00 N ATOM 0 H HIS A 35 -8.938 -2.702 -5.774 1.00 0.00 H new ATOM 0 HA HIS A 35 -7.178 -2.847 -8.091 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -6.159 -2.646 -5.233 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -5.217 -3.343 -6.536 1.00 0.00 H new ATOM 0 HD1 HIS A 35 -5.770 -0.228 -4.815 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -4.855 -1.324 -8.757 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -4.794 1.838 -5.933 1.00 0.00 H new ATOM 580 N GLY A 36 -6.499 -5.325 -6.940 1.00 0.00 N ATOM 581 CA GLY A 36 -6.584 -6.732 -6.598 1.00 0.00 C ATOM 582 C GLY A 36 -6.454 -6.954 -5.103 1.00 0.00 C ATOM 583 O GLY A 36 -6.615 -6.017 -4.321 1.00 0.00 O ATOM 0 H GLY A 36 -5.596 -5.030 -7.312 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.536 -7.134 -6.944 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -5.798 -7.281 -7.117 1.00 0.00 H new ATOM 587 N GLN A 37 -6.144 -8.180 -4.702 1.00 0.00 N ATOM 588 CA GLN A 37 -6.038 -8.503 -3.286 1.00 0.00 C ATOM 589 C GLN A 37 -4.701 -8.039 -2.721 1.00 0.00 C ATOM 590 O GLN A 37 -4.637 -7.054 -1.995 1.00 0.00 O ATOM 591 CB GLN A 37 -6.207 -10.006 -3.046 1.00 0.00 C ATOM 592 CG GLN A 37 -7.561 -10.554 -3.476 1.00 0.00 C ATOM 593 CD GLN A 37 -7.753 -12.011 -3.092 1.00 0.00 C ATOM 594 OE1 GLN A 37 -8.424 -12.766 -3.797 1.00 0.00 O ATOM 595 NE2 GLN A 37 -7.191 -12.411 -1.960 1.00 0.00 N ATOM 0 H GLN A 37 -5.963 -8.961 -5.332 1.00 0.00 H new ATOM 0 HA GLN A 37 -6.841 -7.976 -2.771 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -5.423 -10.540 -3.584 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -6.063 -10.212 -1.985 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -8.351 -9.956 -3.022 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -7.664 -10.451 -4.556 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -6.642 -11.755 -1.404 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -7.307 -13.374 -1.645 1.00 0.00 H new ATOM 604 N PHE A 38 -3.637 -8.743 -3.068 1.00 0.00 N ATOM 605 CA PHE A 38 -2.318 -8.440 -2.534 1.00 0.00 C ATOM 606 C PHE A 38 -1.486 -7.686 -3.563 1.00 0.00 C ATOM 607 O PHE A 38 -0.922 -8.280 -4.488 1.00 0.00 O ATOM 608 CB PHE A 38 -1.608 -9.727 -2.105 1.00 0.00 C ATOM 609 CG PHE A 38 -2.318 -10.470 -1.003 1.00 0.00 C ATOM 610 CD1 PHE A 38 -2.147 -10.103 0.323 1.00 0.00 C ATOM 611 CD2 PHE A 38 -3.159 -11.532 -1.296 1.00 0.00 C ATOM 612 CE1 PHE A 38 -2.800 -10.783 1.334 1.00 0.00 C ATOM 613 CE2 PHE A 38 -3.815 -12.214 -0.288 1.00 0.00 C ATOM 614 CZ PHE A 38 -3.636 -11.839 1.029 1.00 0.00 C ATOM 0 H PHE A 38 -3.660 -9.529 -3.718 1.00 0.00 H new ATOM 0 HA PHE A 38 -2.437 -7.803 -1.657 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.510 -10.383 -2.970 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -0.598 -9.482 -1.775 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -1.496 -9.277 0.569 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -3.304 -11.830 -2.324 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -2.656 -10.488 2.363 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -4.467 -13.040 -0.531 1.00 0.00 H new ATOM 0 HZ PHE A 38 -4.148 -12.370 1.818 1.00 0.00 H new ATOM 624 N ILE A 39 -1.421 -6.374 -3.403 1.00 0.00 N ATOM 625 CA ILE A 39 -0.749 -5.517 -4.366 1.00 0.00 C ATOM 626 C ILE A 39 0.352 -4.698 -3.703 1.00 0.00 C ATOM 627 O ILE A 39 0.088 -3.896 -2.806 1.00 0.00 O ATOM 628 CB ILE A 39 -1.751 -4.554 -5.047 1.00 0.00 C ATOM 629 CG1 ILE A 39 -2.854 -5.335 -5.773 1.00 0.00 C ATOM 630 CG2 ILE A 39 -1.032 -3.622 -6.012 1.00 0.00 C ATOM 631 CD1 ILE A 39 -2.345 -6.223 -6.892 1.00 0.00 C ATOM 0 H ILE A 39 -1.828 -5.877 -2.611 1.00 0.00 H new ATOM 0 HA ILE A 39 -0.306 -6.169 -5.118 1.00 0.00 H new ATOM 0 HB ILE A 39 -2.218 -3.949 -4.270 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -3.387 -5.950 -5.048 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -3.576 -4.629 -6.183 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.755 -2.954 -6.479 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -0.294 -3.034 -5.467 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -0.532 -4.210 -6.781 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -3.184 -6.741 -7.356 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -1.838 -5.612 -7.639 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -1.646 -6.955 -6.487 1.00 0.00 H new ATOM 643 N TYR A 40 1.584 -4.905 -4.140 1.00 0.00 N ATOM 644 CA TYR A 40 2.700 -4.095 -3.686 1.00 0.00 C ATOM 645 C TYR A 40 3.111 -3.124 -4.785 1.00 0.00 C ATOM 646 O TYR A 40 3.405 -3.529 -5.913 1.00 0.00 O ATOM 647 CB TYR A 40 3.891 -4.976 -3.289 1.00 0.00 C ATOM 648 CG TYR A 40 5.078 -4.201 -2.745 1.00 0.00 C ATOM 649 CD1 TYR A 40 6.082 -3.735 -3.588 1.00 0.00 C ATOM 650 CD2 TYR A 40 5.195 -3.939 -1.386 1.00 0.00 C ATOM 651 CE1 TYR A 40 7.165 -3.035 -3.090 1.00 0.00 C ATOM 652 CE2 TYR A 40 6.274 -3.238 -0.882 1.00 0.00 C ATOM 653 CZ TYR A 40 7.256 -2.790 -1.738 1.00 0.00 C ATOM 654 OH TYR A 40 8.335 -2.098 -1.239 1.00 0.00 O ATOM 0 H TYR A 40 1.836 -5.631 -4.811 1.00 0.00 H new ATOM 0 HA TYR A 40 2.385 -3.534 -2.806 1.00 0.00 H new ATOM 0 HB2 TYR A 40 3.564 -5.694 -2.537 1.00 0.00 H new ATOM 0 HB3 TYR A 40 4.212 -5.549 -4.159 1.00 0.00 H new ATOM 0 HD1 TYR A 40 6.014 -3.923 -4.649 1.00 0.00 H new ATOM 0 HD2 TYR A 40 4.429 -4.290 -0.711 1.00 0.00 H new ATOM 0 HE1 TYR A 40 7.936 -2.682 -3.758 1.00 0.00 H new ATOM 0 HE2 TYR A 40 6.347 -3.042 0.178 1.00 0.00 H new ATOM 0 HH TYR A 40 8.918 -1.824 -1.978 1.00 0.00 H new ATOM 664 N VAL A 41 3.113 -1.846 -4.462 1.00 0.00 N ATOM 665 CA VAL A 41 3.558 -0.827 -5.397 1.00 0.00 C ATOM 666 C VAL A 41 4.933 -0.312 -4.992 1.00 0.00 C ATOM 667 O VAL A 41 5.121 0.205 -3.888 1.00 0.00 O ATOM 668 CB VAL A 41 2.550 0.342 -5.506 1.00 0.00 C ATOM 669 CG1 VAL A 41 1.298 -0.107 -6.245 1.00 0.00 C ATOM 670 CG2 VAL A 41 2.185 0.882 -4.130 1.00 0.00 C ATOM 0 H VAL A 41 2.811 -1.486 -3.557 1.00 0.00 H new ATOM 0 HA VAL A 41 3.623 -1.288 -6.383 1.00 0.00 H new ATOM 0 HB VAL A 41 3.025 1.145 -6.070 1.00 0.00 H new ATOM 0 HG11 VAL A 41 0.598 0.726 -6.314 1.00 0.00 H new ATOM 0 HG12 VAL A 41 1.567 -0.439 -7.248 1.00 0.00 H new ATOM 0 HG13 VAL A 41 0.831 -0.930 -5.703 1.00 0.00 H new ATOM 0 HG21 VAL A 41 1.475 1.702 -4.238 1.00 0.00 H new ATOM 0 HG22 VAL A 41 1.734 0.088 -3.535 1.00 0.00 H new ATOM 0 HG23 VAL A 41 3.084 1.243 -3.631 1.00 0.00 H new ATOM 680 N TRP A 42 5.905 -0.491 -5.871 1.00 0.00 N ATOM 681 CA TRP A 42 7.263 -0.071 -5.575 1.00 0.00 C ATOM 682 C TRP A 42 7.611 1.177 -6.373 1.00 0.00 C ATOM 683 O TRP A 42 7.044 1.427 -7.441 1.00 0.00 O ATOM 684 CB TRP A 42 8.267 -1.198 -5.868 1.00 0.00 C ATOM 685 CG TRP A 42 8.680 -1.311 -7.309 1.00 0.00 C ATOM 686 CD1 TRP A 42 7.950 -1.827 -8.338 1.00 0.00 C ATOM 687 CD2 TRP A 42 9.936 -0.909 -7.871 1.00 0.00 C ATOM 688 NE1 TRP A 42 8.668 -1.757 -9.507 1.00 0.00 N ATOM 689 CE2 TRP A 42 9.889 -1.198 -9.246 1.00 0.00 C ATOM 690 CE3 TRP A 42 11.090 -0.322 -7.346 1.00 0.00 C ATOM 691 CZ2 TRP A 42 10.955 -0.931 -10.101 1.00 0.00 C ATOM 692 CZ3 TRP A 42 12.148 -0.058 -8.194 1.00 0.00 C ATOM 693 CH2 TRP A 42 12.072 -0.357 -9.561 1.00 0.00 C ATOM 0 H TRP A 42 5.780 -0.921 -6.788 1.00 0.00 H new ATOM 0 HA TRP A 42 7.325 0.163 -4.512 1.00 0.00 H new ATOM 0 HB2 TRP A 42 9.158 -1.040 -5.260 1.00 0.00 H new ATOM 0 HB3 TRP A 42 7.831 -2.146 -5.554 1.00 0.00 H new ATOM 0 HD1 TRP A 42 6.953 -2.232 -8.247 1.00 0.00 H new ATOM 0 HE1 TRP A 42 8.343 -2.071 -10.422 1.00 0.00 H new ATOM 0 HE3 TRP A 42 11.154 -0.079 -6.296 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 10.901 -1.169 -11.153 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 13.049 0.386 -7.797 1.00 0.00 H new ATOM 0 HH2 TRP A 42 12.912 -0.130 -10.200 1.00 0.00 H new ATOM 787 N SER A 50 0.598 8.073 0.890 1.00 0.00 N ATOM 788 CA SER A 50 -0.701 8.279 1.544 1.00 0.00 C ATOM 789 C SER A 50 -1.869 8.382 0.542 1.00 0.00 C ATOM 790 O SER A 50 -2.910 7.751 0.731 1.00 0.00 O ATOM 791 CB SER A 50 -0.663 9.530 2.432 1.00 0.00 C ATOM 792 OG SER A 50 0.451 9.503 3.314 1.00 0.00 O ATOM 0 HA SER A 50 -0.882 7.397 2.158 1.00 0.00 H new ATOM 0 HB2 SER A 50 -0.613 10.421 1.807 1.00 0.00 H new ATOM 0 HB3 SER A 50 -1.585 9.597 3.009 1.00 0.00 H new ATOM 0 HG SER A 50 0.164 9.181 4.194 1.00 0.00 H new ATOM 798 N HIS A 51 -1.687 9.166 -0.523 1.00 0.00 N ATOM 799 CA HIS A 51 -2.767 9.489 -1.464 1.00 0.00 C ATOM 800 C HIS A 51 -3.393 8.242 -2.078 1.00 0.00 C ATOM 801 O HIS A 51 -4.613 8.072 -2.031 1.00 0.00 O ATOM 802 CB HIS A 51 -2.267 10.412 -2.583 1.00 0.00 C ATOM 803 CG HIS A 51 -1.918 11.797 -2.132 1.00 0.00 C ATOM 804 ND1 HIS A 51 -2.863 12.757 -1.848 1.00 0.00 N ATOM 805 CD2 HIS A 51 -0.716 12.387 -1.932 1.00 0.00 C ATOM 806 CE1 HIS A 51 -2.260 13.877 -1.498 1.00 0.00 C ATOM 807 NE2 HIS A 51 -0.957 13.681 -1.540 1.00 0.00 N ATOM 0 H HIS A 51 -0.792 9.594 -0.759 1.00 0.00 H new ATOM 0 HA HIS A 51 -3.534 10.003 -0.885 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -1.388 9.961 -3.044 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -3.034 10.477 -3.354 1.00 0.00 H new ATOM 0 HD2 HIS A 51 0.252 11.926 -2.057 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -2.751 14.799 -1.223 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -0.245 14.376 -1.318 1.00 0.00 H new ATOM 816 N LEU A 52 -2.569 7.373 -2.654 1.00 0.00 N ATOM 817 CA LEU A 52 -3.075 6.171 -3.316 1.00 0.00 C ATOM 818 C LEU A 52 -3.757 5.238 -2.321 1.00 0.00 C ATOM 819 O LEU A 52 -4.734 4.566 -2.652 1.00 0.00 O ATOM 820 CB LEU A 52 -1.949 5.427 -4.040 1.00 0.00 C ATOM 821 CG LEU A 52 -1.345 6.163 -5.239 1.00 0.00 C ATOM 822 CD1 LEU A 52 -0.294 5.300 -5.915 1.00 0.00 C ATOM 823 CD2 LEU A 52 -2.430 6.554 -6.233 1.00 0.00 C ATOM 0 H LEU A 52 -1.554 7.475 -2.677 1.00 0.00 H new ATOM 0 HA LEU A 52 -3.813 6.492 -4.052 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -1.154 5.219 -3.324 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -2.331 4.465 -4.380 1.00 0.00 H new ATOM 0 HG LEU A 52 -0.868 7.074 -4.877 1.00 0.00 H new ATOM 0 HD11 LEU A 52 0.126 5.837 -6.765 1.00 0.00 H new ATOM 0 HD12 LEU A 52 0.499 5.069 -5.204 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -0.752 4.373 -6.261 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -1.979 7.076 -7.077 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -2.937 5.657 -6.589 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -3.152 7.209 -5.745 1.00 0.00 H new ATOM 835 N LEU A 53 -3.248 5.219 -1.100 1.00 0.00 N ATOM 836 CA LEU A 53 -3.802 4.370 -0.057 1.00 0.00 C ATOM 837 C LEU A 53 -5.147 4.907 0.413 1.00 0.00 C ATOM 838 O LEU A 53 -6.109 4.157 0.555 1.00 0.00 O ATOM 839 CB LEU A 53 -2.840 4.261 1.129 1.00 0.00 C ATOM 840 CG LEU A 53 -1.567 3.439 0.885 1.00 0.00 C ATOM 841 CD1 LEU A 53 -0.592 4.174 -0.023 1.00 0.00 C ATOM 842 CD2 LEU A 53 -0.907 3.100 2.206 1.00 0.00 C ATOM 0 H LEU A 53 -2.450 5.783 -0.806 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.947 3.375 -0.478 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -2.548 5.267 1.429 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -3.378 3.822 1.969 1.00 0.00 H new ATOM 0 HG LEU A 53 -1.854 2.516 0.381 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.297 3.562 -0.173 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.066 4.368 -0.985 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -0.308 5.120 0.438 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -0.005 2.517 2.023 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.645 4.020 2.728 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -1.596 2.519 2.819 1.00 0.00 H new ATOM 854 N GLN A 54 -5.206 6.210 0.641 1.00 0.00 N ATOM 855 CA GLN A 54 -6.429 6.863 1.086 1.00 0.00 C ATOM 856 C GLN A 54 -7.527 6.706 0.042 1.00 0.00 C ATOM 857 O GLN A 54 -8.680 6.427 0.373 1.00 0.00 O ATOM 858 CB GLN A 54 -6.159 8.346 1.338 1.00 0.00 C ATOM 859 CG GLN A 54 -7.338 9.096 1.932 1.00 0.00 C ATOM 860 CD GLN A 54 -7.059 10.574 2.096 1.00 0.00 C ATOM 861 OE1 GLN A 54 -5.916 10.985 2.283 1.00 0.00 O ATOM 862 NE2 GLN A 54 -8.104 11.385 2.029 1.00 0.00 N ATOM 0 H GLN A 54 -4.414 6.842 0.524 1.00 0.00 H new ATOM 0 HA GLN A 54 -6.761 6.393 2.012 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -5.306 8.440 2.010 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -5.878 8.819 0.397 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -8.210 8.963 1.291 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -7.587 8.666 2.902 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -9.037 11.003 1.872 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -7.976 12.391 2.134 1.00 0.00 H new ATOM 871 N ALA A 55 -7.150 6.875 -1.219 1.00 0.00 N ATOM 872 CA ALA A 55 -8.081 6.745 -2.329 1.00 0.00 C ATOM 873 C ALA A 55 -8.667 5.340 -2.390 1.00 0.00 C ATOM 874 O ALA A 55 -9.866 5.162 -2.597 1.00 0.00 O ATOM 875 CB ALA A 55 -7.373 7.080 -3.634 1.00 0.00 C ATOM 0 H ALA A 55 -6.196 7.105 -1.498 1.00 0.00 H new ATOM 0 HA ALA A 55 -8.903 7.444 -2.176 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -8.073 6.982 -4.464 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -7.000 8.103 -3.593 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -6.538 6.395 -3.781 1.00 0.00 H new ATOM 881 N TRP A 56 -7.807 4.350 -2.190 1.00 0.00 N ATOM 882 CA TRP A 56 -8.205 2.948 -2.267 1.00 0.00 C ATOM 883 C TRP A 56 -9.079 2.562 -1.077 1.00 0.00 C ATOM 884 O TRP A 56 -10.066 1.846 -1.225 1.00 0.00 O ATOM 885 CB TRP A 56 -6.949 2.078 -2.327 1.00 0.00 C ATOM 886 CG TRP A 56 -7.209 0.603 -2.427 1.00 0.00 C ATOM 887 CD1 TRP A 56 -7.757 -0.072 -3.480 1.00 0.00 C ATOM 888 CD2 TRP A 56 -6.902 -0.380 -1.436 1.00 0.00 C ATOM 889 NE1 TRP A 56 -7.805 -1.417 -3.202 1.00 0.00 N ATOM 890 CE2 TRP A 56 -7.291 -1.630 -1.951 1.00 0.00 C ATOM 891 CE3 TRP A 56 -6.339 -0.324 -0.158 1.00 0.00 C ATOM 892 CZ2 TRP A 56 -7.129 -2.811 -1.235 1.00 0.00 C ATOM 893 CZ3 TRP A 56 -6.183 -1.497 0.552 1.00 0.00 C ATOM 894 CH2 TRP A 56 -6.576 -2.727 0.012 1.00 0.00 C ATOM 0 H TRP A 56 -6.821 4.493 -1.971 1.00 0.00 H new ATOM 0 HA TRP A 56 -8.797 2.790 -3.168 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -6.351 2.386 -3.185 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -6.350 2.268 -1.436 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -8.102 0.384 -4.396 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -8.165 -2.139 -3.826 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -6.032 0.620 0.266 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -7.430 -3.762 -1.650 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -5.750 -1.465 1.541 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -6.440 -3.628 0.592 1.00 0.00 H new ATOM 905 N VAL A 57 -8.717 3.055 0.095 1.00 0.00 N ATOM 906 CA VAL A 57 -9.458 2.753 1.312 1.00 0.00 C ATOM 907 C VAL A 57 -10.847 3.393 1.296 1.00 0.00 C ATOM 908 O VAL A 57 -11.845 2.732 1.581 1.00 0.00 O ATOM 909 CB VAL A 57 -8.672 3.215 2.558 1.00 0.00 C ATOM 910 CG1 VAL A 57 -9.542 3.203 3.809 1.00 0.00 C ATOM 911 CG2 VAL A 57 -7.449 2.331 2.758 1.00 0.00 C ATOM 0 H VAL A 57 -7.913 3.668 0.232 1.00 0.00 H new ATOM 0 HA VAL A 57 -9.586 1.672 1.358 1.00 0.00 H new ATOM 0 HB VAL A 57 -8.352 4.243 2.390 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -8.954 3.534 4.665 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -10.389 3.874 3.669 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -9.906 2.192 3.989 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -6.900 2.663 3.639 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -7.766 1.297 2.897 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -6.804 2.398 1.882 1.00 0.00 H new ATOM 921 N ALA A 58 -10.907 4.672 0.942 1.00 0.00 N ATOM 922 CA ALA A 58 -12.162 5.422 0.981 1.00 0.00 C ATOM 923 C ALA A 58 -13.207 4.839 0.036 1.00 0.00 C ATOM 924 O ALA A 58 -14.377 4.710 0.405 1.00 0.00 O ATOM 925 CB ALA A 58 -11.916 6.890 0.656 1.00 0.00 C ATOM 0 H ALA A 58 -10.103 5.213 0.625 1.00 0.00 H new ATOM 0 HA ALA A 58 -12.556 5.341 1.994 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -12.860 7.433 0.689 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -11.227 7.314 1.387 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -11.484 6.974 -0.341 1.00 0.00 H new ATOM 931 N GLN A 59 -12.792 4.470 -1.172 1.00 0.00 N ATOM 932 CA GLN A 59 -13.727 3.937 -2.154 1.00 0.00 C ATOM 933 C GLN A 59 -14.221 2.558 -1.730 1.00 0.00 C ATOM 934 O GLN A 59 -15.362 2.189 -2.011 1.00 0.00 O ATOM 935 CB GLN A 59 -13.104 3.915 -3.564 1.00 0.00 C ATOM 936 CG GLN A 59 -11.865 3.038 -3.716 1.00 0.00 C ATOM 937 CD GLN A 59 -12.187 1.584 -4.013 1.00 0.00 C ATOM 938 OE1 GLN A 59 -11.445 0.684 -3.636 1.00 0.00 O ATOM 939 NE2 GLN A 59 -13.286 1.348 -4.710 1.00 0.00 N ATOM 0 H GLN A 59 -11.825 4.530 -1.491 1.00 0.00 H new ATOM 0 HA GLN A 59 -14.592 4.599 -2.199 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -13.859 3.574 -4.272 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -12.843 4.936 -3.844 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -11.244 3.436 -4.518 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -11.276 3.092 -2.800 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -13.879 2.124 -5.006 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -13.541 0.390 -4.951 1.00 0.00 H new ATOM 948 N ALA A 60 -13.371 1.814 -1.030 1.00 0.00 N ATOM 949 CA ALA A 60 -13.751 0.506 -0.515 1.00 0.00 C ATOM 950 C ALA A 60 -14.699 0.653 0.669 1.00 0.00 C ATOM 951 O ALA A 60 -15.625 -0.142 0.844 1.00 0.00 O ATOM 952 CB ALA A 60 -12.516 -0.284 -0.118 1.00 0.00 C ATOM 0 H ALA A 60 -12.416 2.095 -0.807 1.00 0.00 H new ATOM 0 HA ALA A 60 -14.271 -0.040 -1.302 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -12.816 -1.259 0.265 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -11.874 -0.418 -0.989 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -11.971 0.257 0.655 1.00 0.00 H new ATOM 958 N LEU A 61 -14.466 1.685 1.470 1.00 0.00 N ATOM 959 CA LEU A 61 -15.317 1.992 2.612 1.00 0.00 C ATOM 960 C LEU A 61 -16.753 2.250 2.174 1.00 0.00 C ATOM 961 O LEU A 61 -17.696 1.705 2.750 1.00 0.00 O ATOM 962 CB LEU A 61 -14.769 3.208 3.367 1.00 0.00 C ATOM 963 CG LEU A 61 -13.535 2.938 4.229 1.00 0.00 C ATOM 964 CD1 LEU A 61 -13.031 4.231 4.847 1.00 0.00 C ATOM 965 CD2 LEU A 61 -13.861 1.922 5.313 1.00 0.00 C ATOM 0 H LEU A 61 -13.685 2.330 1.347 1.00 0.00 H new ATOM 0 HA LEU A 61 -15.316 1.128 3.277 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -14.524 3.985 2.643 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -15.558 3.605 4.005 1.00 0.00 H new ATOM 0 HG LEU A 61 -12.749 2.528 3.595 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -12.152 4.024 5.458 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -12.766 4.933 4.056 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -13.813 4.665 5.471 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -12.974 1.739 5.919 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -14.659 2.309 5.946 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -14.184 0.989 4.852 1.00 0.00 H new ATOM 977 N GLU A 62 -16.919 3.070 1.143 1.00 0.00 N ATOM 978 CA GLU A 62 -18.248 3.384 0.630 1.00 0.00 C ATOM 979 C GLU A 62 -18.795 2.239 -0.214 1.00 0.00 C ATOM 980 O GLU A 62 -19.962 2.241 -0.601 1.00 0.00 O ATOM 981 CB GLU A 62 -18.222 4.671 -0.184 1.00 0.00 C ATOM 982 CG GLU A 62 -17.777 5.872 0.624 1.00 0.00 C ATOM 983 CD GLU A 62 -17.917 7.176 -0.135 1.00 0.00 C ATOM 984 OE1 GLU A 62 -18.328 7.143 -1.318 1.00 0.00 O ATOM 985 OE2 GLU A 62 -17.638 8.242 0.457 1.00 0.00 O ATOM 0 H GLU A 62 -16.154 3.528 0.647 1.00 0.00 H new ATOM 0 HA GLU A 62 -18.909 3.525 1.485 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -17.552 4.543 -1.034 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -19.217 4.860 -0.588 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -18.365 5.926 1.540 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -16.736 5.739 0.920 1.00 0.00 H new ATOM 992 N ALA A 63 -17.940 1.269 -0.502 1.00 0.00 N ATOM 993 CA ALA A 63 -18.350 0.084 -1.244 1.00 0.00 C ATOM 994 C ALA A 63 -18.938 -0.959 -0.301 1.00 0.00 C ATOM 995 O ALA A 63 -19.410 -2.014 -0.734 1.00 0.00 O ATOM 996 CB ALA A 63 -17.178 -0.497 -2.020 1.00 0.00 C ATOM 0 H ALA A 63 -16.956 1.278 -0.233 1.00 0.00 H new ATOM 0 HA ALA A 63 -19.120 0.376 -1.958 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -17.506 -1.381 -2.567 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -16.803 0.246 -2.723 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -16.384 -0.773 -1.327 1.00 0.00 H new ATOM 1002 N GLY A 64 -18.899 -0.665 0.992 1.00 0.00 N ATOM 1003 CA GLY A 64 -19.498 -1.551 1.967 1.00 0.00 C ATOM 1004 C GLY A 64 -18.506 -2.533 2.544 1.00 0.00 C ATOM 1005 O GLY A 64 -18.886 -3.531 3.158 1.00 0.00 O ATOM 0 H GLY A 64 -18.463 0.171 1.381 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -19.929 -0.959 2.774 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -20.317 -2.099 1.501 1.00 0.00 H new ATOM 1009 N LYS A 65 -17.231 -2.263 2.336 1.00 0.00 N ATOM 1010 CA LYS A 65 -16.181 -3.091 2.881 1.00 0.00 C ATOM 1011 C LYS A 65 -15.438 -2.305 3.940 1.00 0.00 C ATOM 1012 O LYS A 65 -15.494 -1.075 3.962 1.00 0.00 O ATOM 1013 CB LYS A 65 -15.207 -3.522 1.784 1.00 0.00 C ATOM 1014 CG LYS A 65 -15.864 -4.227 0.608 1.00 0.00 C ATOM 1015 CD LYS A 65 -16.527 -5.522 1.039 1.00 0.00 C ATOM 1016 CE LYS A 65 -17.131 -6.261 -0.142 1.00 0.00 C ATOM 1017 NZ LYS A 65 -17.802 -7.520 0.275 1.00 0.00 N ATOM 0 H LYS A 65 -16.899 -1.469 1.788 1.00 0.00 H new ATOM 0 HA LYS A 65 -16.624 -3.986 3.318 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -14.679 -2.642 1.417 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -14.459 -4.185 2.218 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -16.606 -3.569 0.156 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -15.116 -4.436 -0.157 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -15.794 -6.160 1.532 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -17.305 -5.307 1.771 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -17.851 -5.615 -0.644 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -16.349 -6.489 -0.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -18.201 -7.994 -0.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -17.110 -8.148 0.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -18.566 -7.301 0.946 1.00 0.00 H new ATOM 1031 N ASN A 66 -14.751 -2.998 4.819 1.00 0.00 N ATOM 1032 CA ASN A 66 -13.968 -2.323 5.837 1.00 0.00 C ATOM 1033 C ASN A 66 -12.551 -2.144 5.345 1.00 0.00 C ATOM 1034 O ASN A 66 -11.946 -3.079 4.817 1.00 0.00 O ATOM 1035 CB ASN A 66 -13.969 -3.093 7.154 1.00 0.00 C ATOM 1036 CG ASN A 66 -13.536 -2.215 8.313 1.00 0.00 C ATOM 1037 OD1 ASN A 66 -13.643 -0.990 8.252 1.00 0.00 O ATOM 1038 ND2 ASN A 66 -13.066 -2.828 9.383 1.00 0.00 N ATOM 0 H ASN A 66 -14.716 -4.017 4.853 1.00 0.00 H new ATOM 0 HA ASN A 66 -14.422 -1.350 6.024 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -14.968 -3.485 7.347 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -13.300 -3.950 7.076 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -12.777 -2.285 10.196 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -12.992 -3.845 9.397 1.00 0.00 H new ATOM 1045 N ALA A 67 -12.027 -0.953 5.521 1.00 0.00 N ATOM 1046 CA ALA A 67 -10.711 -0.628 5.022 1.00 0.00 C ATOM 1047 C ALA A 67 -10.000 0.314 5.974 1.00 0.00 C ATOM 1048 O ALA A 67 -10.641 1.107 6.663 1.00 0.00 O ATOM 1049 CB ALA A 67 -10.819 -0.010 3.639 1.00 0.00 C ATOM 0 H ALA A 67 -12.495 -0.189 6.009 1.00 0.00 H new ATOM 0 HA ALA A 67 -10.125 -1.544 4.951 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -9.822 0.232 3.270 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -11.295 -0.718 2.960 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -11.417 0.900 3.693 1.00 0.00 H new ATOM 1055 N ALA A 68 -8.684 0.214 6.019 1.00 0.00 N ATOM 1056 CA ALA A 68 -7.883 1.085 6.862 1.00 0.00 C ATOM 1057 C ALA A 68 -6.494 1.272 6.273 1.00 0.00 C ATOM 1058 O ALA A 68 -5.841 0.305 5.882 1.00 0.00 O ATOM 1059 CB ALA A 68 -7.789 0.526 8.277 1.00 0.00 C ATOM 0 H ALA A 68 -8.145 -0.464 5.480 1.00 0.00 H new ATOM 0 HA ALA A 68 -8.372 2.058 6.907 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -7.185 1.193 8.892 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -8.789 0.445 8.703 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -7.326 -0.460 8.249 1.00 0.00 H new ATOM 1065 N TYR A 69 -6.053 2.517 6.191 1.00 0.00 N ATOM 1066 CA TYR A 69 -4.710 2.817 5.736 1.00 0.00 C ATOM 1067 C TYR A 69 -3.878 3.311 6.908 1.00 0.00 C ATOM 1068 O TYR A 69 -4.315 4.163 7.680 1.00 0.00 O ATOM 1069 CB TYR A 69 -4.719 3.846 4.591 1.00 0.00 C ATOM 1070 CG TYR A 69 -5.328 5.188 4.937 1.00 0.00 C ATOM 1071 CD1 TYR A 69 -6.699 5.390 4.863 1.00 0.00 C ATOM 1072 CD2 TYR A 69 -4.529 6.256 5.328 1.00 0.00 C ATOM 1073 CE1 TYR A 69 -7.257 6.612 5.171 1.00 0.00 C ATOM 1074 CE2 TYR A 69 -5.081 7.483 5.639 1.00 0.00 C ATOM 1075 CZ TYR A 69 -6.445 7.656 5.559 1.00 0.00 C ATOM 1076 OH TYR A 69 -7.003 8.877 5.864 1.00 0.00 O ATOM 0 H TYR A 69 -6.609 3.336 6.435 1.00 0.00 H new ATOM 0 HA TYR A 69 -4.263 1.905 5.340 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -3.693 4.005 4.259 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -5.265 3.423 3.748 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -7.340 4.576 4.559 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -3.459 6.124 5.390 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -8.326 6.751 5.109 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -4.447 8.302 5.943 1.00 0.00 H new ATOM 0 HH TYR A 69 -6.296 9.505 6.120 1.00 0.00 H new ATOM 1086 N ILE A 70 -2.701 2.741 7.059 1.00 0.00 N ATOM 1087 CA ILE A 70 -1.818 3.101 8.149 1.00 0.00 C ATOM 1088 C ILE A 70 -0.468 3.550 7.613 1.00 0.00 C ATOM 1089 O ILE A 70 0.274 2.763 7.019 1.00 0.00 O ATOM 1090 CB ILE A 70 -1.623 1.925 9.133 1.00 0.00 C ATOM 1091 CG1 ILE A 70 -2.975 1.513 9.728 1.00 0.00 C ATOM 1092 CG2 ILE A 70 -0.637 2.303 10.234 1.00 0.00 C ATOM 1093 CD1 ILE A 70 -2.901 0.323 10.660 1.00 0.00 C ATOM 0 H ILE A 70 -2.332 2.022 6.437 1.00 0.00 H new ATOM 0 HA ILE A 70 -2.284 3.925 8.690 1.00 0.00 H new ATOM 0 HB ILE A 70 -1.208 1.076 8.590 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -3.395 2.360 10.270 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -3.663 1.282 8.915 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -0.513 1.462 10.916 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.326 2.554 9.789 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -1.018 3.163 10.784 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -3.897 0.095 11.039 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -2.512 -0.539 10.119 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.240 0.555 11.495 1.00 0.00 H new ATOM 1105 N ASP A 71 -0.175 4.824 7.806 1.00 0.00 N ATOM 1106 CA ASP A 71 1.098 5.393 7.401 1.00 0.00 C ATOM 1107 C ASP A 71 2.138 5.040 8.443 1.00 0.00 C ATOM 1108 O ASP A 71 2.176 5.646 9.510 1.00 0.00 O ATOM 1109 CB ASP A 71 1.004 6.922 7.271 1.00 0.00 C ATOM 1110 CG ASP A 71 -0.167 7.379 6.421 1.00 0.00 C ATOM 1111 OD1 ASP A 71 -1.309 7.363 6.929 1.00 0.00 O ATOM 1112 OD2 ASP A 71 0.054 7.772 5.257 1.00 0.00 O ATOM 0 H ASP A 71 -0.810 5.490 8.246 1.00 0.00 H new ATOM 0 HA ASP A 71 1.374 4.986 6.428 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.916 7.360 8.265 1.00 0.00 H new ATOM 0 HB3 ASP A 71 1.929 7.301 6.837 1.00 0.00 H new ATOM 1117 N ALA A 72 2.971 4.055 8.147 1.00 0.00 N ATOM 1118 CA ALA A 72 3.929 3.540 9.122 1.00 0.00 C ATOM 1119 C ALA A 72 4.915 4.614 9.577 1.00 0.00 C ATOM 1120 O ALA A 72 5.545 4.481 10.622 1.00 0.00 O ATOM 1121 CB ALA A 72 4.673 2.340 8.561 1.00 0.00 C ATOM 0 H ALA A 72 3.006 3.593 7.238 1.00 0.00 H new ATOM 0 HA ALA A 72 3.361 3.225 9.997 1.00 0.00 H new ATOM 0 HB1 ALA A 72 5.382 1.972 9.303 1.00 0.00 H new ATOM 0 HB2 ALA A 72 3.961 1.552 8.317 1.00 0.00 H new ATOM 0 HB3 ALA A 72 5.211 2.634 7.660 1.00 0.00 H new ATOM 1127 N ALA A 73 5.037 5.680 8.798 1.00 0.00 N ATOM 1128 CA ALA A 73 5.934 6.775 9.147 1.00 0.00 C ATOM 1129 C ALA A 73 5.192 7.907 9.858 1.00 0.00 C ATOM 1130 O ALA A 73 5.616 9.063 9.816 1.00 0.00 O ATOM 1131 CB ALA A 73 6.634 7.295 7.899 1.00 0.00 C ATOM 0 H ALA A 73 4.529 5.811 7.923 1.00 0.00 H new ATOM 0 HA ALA A 73 6.682 6.389 9.840 1.00 0.00 H new ATOM 0 HB1 ALA A 73 7.302 8.113 8.170 1.00 0.00 H new ATOM 0 HB2 ALA A 73 7.212 6.490 7.444 1.00 0.00 H new ATOM 0 HB3 ALA A 73 5.890 7.655 7.188 1.00 0.00 H new ATOM 1137 N SER A 74 4.100 7.563 10.526 1.00 0.00 N ATOM 1138 CA SER A 74 3.316 8.539 11.277 1.00 0.00 C ATOM 1139 C SER A 74 2.390 7.836 12.270 1.00 0.00 C ATOM 1140 O SER A 74 2.135 8.333 13.368 1.00 0.00 O ATOM 1141 CB SER A 74 2.501 9.414 10.318 1.00 0.00 C ATOM 1142 OG SER A 74 1.860 10.476 11.005 1.00 0.00 O ATOM 0 H SER A 74 3.734 6.612 10.564 1.00 0.00 H new ATOM 0 HA SER A 74 4.001 9.175 11.837 1.00 0.00 H new ATOM 0 HB2 SER A 74 3.156 9.820 9.548 1.00 0.00 H new ATOM 0 HB3 SER A 74 1.754 8.803 9.811 1.00 0.00 H new ATOM 0 HG SER A 74 1.349 11.017 10.367 1.00 0.00 H new ATOM 1148 N MET A 75 1.905 6.667 11.878 1.00 0.00 N ATOM 1149 CA MET A 75 0.973 5.899 12.690 1.00 0.00 C ATOM 1150 C MET A 75 1.476 4.471 12.879 1.00 0.00 C ATOM 1151 O MET A 75 2.096 3.899 11.978 1.00 0.00 O ATOM 1152 CB MET A 75 -0.416 5.881 12.033 1.00 0.00 C ATOM 1153 CG MET A 75 -1.147 7.212 12.107 1.00 0.00 C ATOM 1154 SD MET A 75 -2.871 7.095 11.586 1.00 0.00 S ATOM 1155 CE MET A 75 -2.684 6.614 9.869 1.00 0.00 C ATOM 0 H MET A 75 2.146 6.225 10.991 1.00 0.00 H new ATOM 0 HA MET A 75 0.898 6.375 13.668 1.00 0.00 H new ATOM 0 HB2 MET A 75 -0.309 5.593 10.987 1.00 0.00 H new ATOM 0 HB3 MET A 75 -1.025 5.115 12.514 1.00 0.00 H new ATOM 0 HG2 MET A 75 -1.106 7.587 13.130 1.00 0.00 H new ATOM 0 HG3 MET A 75 -0.632 7.939 11.480 1.00 0.00 H new ATOM 0 HE1 MET A 75 -3.664 6.572 9.394 1.00 0.00 H new ATOM 0 HE2 MET A 75 -2.061 7.344 9.352 1.00 0.00 H new ATOM 0 HE3 MET A 75 -2.213 5.633 9.815 1.00 0.00 H new ATOM 1165 N PRO A 76 1.238 3.884 14.061 1.00 0.00 N ATOM 1166 CA PRO A 76 1.623 2.504 14.351 1.00 0.00 C ATOM 1167 C PRO A 76 0.544 1.497 13.952 1.00 0.00 C ATOM 1168 O PRO A 76 -0.616 1.859 13.747 1.00 0.00 O ATOM 1169 CB PRO A 76 1.796 2.528 15.866 1.00 0.00 C ATOM 1170 CG PRO A 76 0.792 3.527 16.346 1.00 0.00 C ATOM 1171 CD PRO A 76 0.600 4.528 15.227 1.00 0.00 C ATOM 0 HA PRO A 76 2.509 2.192 13.798 1.00 0.00 H new ATOM 0 HB2 PRO A 76 1.616 1.545 16.301 1.00 0.00 H new ATOM 0 HB3 PRO A 76 2.809 2.819 16.145 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -0.151 3.039 16.594 1.00 0.00 H new ATOM 0 HG3 PRO A 76 1.142 4.022 17.252 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -0.456 4.727 15.045 1.00 0.00 H new ATOM 0 HD3 PRO A 76 1.068 5.484 15.461 1.00 0.00 H new ATOM 1179 N LEU A 77 0.929 0.234 13.843 1.00 0.00 N ATOM 1180 CA LEU A 77 -0.015 -0.825 13.522 1.00 0.00 C ATOM 1181 C LEU A 77 -0.696 -1.315 14.794 1.00 0.00 C ATOM 1182 O LEU A 77 -0.079 -1.365 15.859 1.00 0.00 O ATOM 1183 CB LEU A 77 0.709 -1.979 12.823 1.00 0.00 C ATOM 1184 CG LEU A 77 -0.177 -3.153 12.393 1.00 0.00 C ATOM 1185 CD1 LEU A 77 -1.242 -2.696 11.411 1.00 0.00 C ATOM 1186 CD2 LEU A 77 0.666 -4.258 11.777 1.00 0.00 C ATOM 0 H LEU A 77 1.890 -0.082 13.972 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.776 -0.434 12.847 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.214 -1.586 11.941 1.00 0.00 H new ATOM 0 HB3 LEU A 77 1.483 -2.357 13.491 1.00 0.00 H new ATOM 0 HG LEU A 77 -0.674 -3.545 13.281 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.858 -3.547 11.120 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.869 -1.938 11.881 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -0.764 -2.275 10.526 1.00 0.00 H new ATOM 0 HD21 LEU A 77 0.021 -5.084 11.477 1.00 0.00 H new ATOM 0 HD22 LEU A 77 1.190 -3.871 10.903 1.00 0.00 H new ATOM 0 HD23 LEU A 77 1.392 -4.612 12.508 1.00 0.00 H new ATOM 1198 N THR A 78 -1.967 -1.670 14.685 1.00 0.00 N ATOM 1199 CA THR A 78 -2.736 -2.111 15.829 1.00 0.00 C ATOM 1200 C THR A 78 -3.524 -3.372 15.492 1.00 0.00 C ATOM 1201 O THR A 78 -3.698 -3.715 14.320 1.00 0.00 O ATOM 1202 CB THR A 78 -3.712 -1.014 16.301 1.00 0.00 C ATOM 1203 OG1 THR A 78 -4.460 -0.511 15.183 1.00 0.00 O ATOM 1204 CG2 THR A 78 -2.972 0.131 16.979 1.00 0.00 C ATOM 0 H THR A 78 -2.487 -1.660 13.808 1.00 0.00 H new ATOM 0 HA THR A 78 -2.032 -2.326 16.633 1.00 0.00 H new ATOM 0 HB THR A 78 -4.392 -1.459 17.028 1.00 0.00 H new ATOM 0 HG1 THR A 78 -5.079 0.184 15.490 1.00 0.00 H new ATOM 0 HG21 THR A 78 -3.688 0.888 17.300 1.00 0.00 H new ATOM 0 HG22 THR A 78 -2.431 -0.248 17.846 1.00 0.00 H new ATOM 0 HG23 THR A 78 -2.266 0.574 16.277 1.00 0.00 H new ATOM 1212 N ASP A 79 -4.005 -4.048 16.527 1.00 0.00 N ATOM 1213 CA ASP A 79 -4.801 -5.265 16.369 1.00 0.00 C ATOM 1214 C ASP A 79 -6.169 -4.957 15.763 1.00 0.00 C ATOM 1215 O ASP A 79 -6.890 -5.861 15.334 1.00 0.00 O ATOM 1216 CB ASP A 79 -4.976 -5.969 17.719 1.00 0.00 C ATOM 1217 CG ASP A 79 -5.840 -5.187 18.693 1.00 0.00 C ATOM 1218 OD1 ASP A 79 -5.309 -4.282 19.373 1.00 0.00 O ATOM 1219 OD2 ASP A 79 -7.051 -5.485 18.793 1.00 0.00 O ATOM 0 H ASP A 79 -3.857 -3.772 17.498 1.00 0.00 H new ATOM 0 HA ASP A 79 -4.265 -5.926 15.688 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -5.421 -6.950 17.555 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -3.995 -6.135 18.165 1.00 0.00 H new ATOM 1224 N ALA A 80 -6.515 -3.675 15.729 1.00 0.00 N ATOM 1225 CA ALA A 80 -7.777 -3.224 15.152 1.00 0.00 C ATOM 1226 C ALA A 80 -7.833 -3.521 13.655 1.00 0.00 C ATOM 1227 O ALA A 80 -8.911 -3.648 13.073 1.00 0.00 O ATOM 1228 CB ALA A 80 -7.975 -1.736 15.408 1.00 0.00 C ATOM 0 H ALA A 80 -5.933 -2.923 16.098 1.00 0.00 H new ATOM 0 HA ALA A 80 -8.586 -3.773 15.635 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -8.921 -1.414 14.972 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -7.989 -1.550 16.482 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -7.157 -1.177 14.954 1.00 0.00 H new ATOM 1234 N ALA A 81 -6.658 -3.624 13.037 1.00 0.00 N ATOM 1235 CA ALA A 81 -6.550 -3.870 11.602 1.00 0.00 C ATOM 1236 C ALA A 81 -7.219 -5.185 11.192 1.00 0.00 C ATOM 1237 O ALA A 81 -7.598 -5.357 10.035 1.00 0.00 O ATOM 1238 CB ALA A 81 -5.089 -3.870 11.179 1.00 0.00 C ATOM 0 H ALA A 81 -5.760 -3.540 13.514 1.00 0.00 H new ATOM 0 HA ALA A 81 -7.076 -3.063 11.091 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -5.021 -4.054 10.107 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -4.643 -2.902 11.410 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.555 -4.653 11.717 1.00 0.00 H new ATOM 1244 N PHE A 82 -7.382 -6.099 12.148 1.00 0.00 N ATOM 1245 CA PHE A 82 -7.990 -7.401 11.876 1.00 0.00 C ATOM 1246 C PHE A 82 -9.481 -7.279 11.556 1.00 0.00 C ATOM 1247 O PHE A 82 -10.101 -8.237 11.091 1.00 0.00 O ATOM 1248 CB PHE A 82 -7.793 -8.348 13.063 1.00 0.00 C ATOM 1249 CG PHE A 82 -6.424 -8.959 13.131 1.00 0.00 C ATOM 1250 CD1 PHE A 82 -6.050 -9.939 12.228 1.00 0.00 C ATOM 1251 CD2 PHE A 82 -5.514 -8.563 14.099 1.00 0.00 C ATOM 1252 CE1 PHE A 82 -4.797 -10.513 12.284 1.00 0.00 C ATOM 1253 CE2 PHE A 82 -4.257 -9.136 14.162 1.00 0.00 C ATOM 1254 CZ PHE A 82 -3.899 -10.113 13.252 1.00 0.00 C ATOM 0 H PHE A 82 -7.101 -5.962 13.119 1.00 0.00 H new ATOM 0 HA PHE A 82 -7.488 -7.811 10.999 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -7.983 -7.802 13.987 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -8.534 -9.145 13.006 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -6.749 -10.259 11.469 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -5.790 -7.799 14.811 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -4.519 -11.275 11.571 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -3.556 -8.821 14.921 1.00 0.00 H new ATOM 0 HZ PHE A 82 -2.918 -10.562 13.299 1.00 0.00 H new ATOM 1264 N GLU A 83 -10.055 -6.111 11.817 1.00 0.00 N ATOM 1265 CA GLU A 83 -11.460 -5.873 11.525 1.00 0.00 C ATOM 1266 C GLU A 83 -11.657 -5.534 10.055 1.00 0.00 C ATOM 1267 O GLU A 83 -12.732 -5.745 9.490 1.00 0.00 O ATOM 1268 CB GLU A 83 -11.992 -4.726 12.374 1.00 0.00 C ATOM 1269 CG GLU A 83 -11.847 -4.955 13.860 1.00 0.00 C ATOM 1270 CD GLU A 83 -12.483 -3.852 14.681 1.00 0.00 C ATOM 1271 OE1 GLU A 83 -12.368 -2.666 14.292 1.00 0.00 O ATOM 1272 OE2 GLU A 83 -13.095 -4.167 15.724 1.00 0.00 O ATOM 0 H GLU A 83 -9.568 -5.315 12.230 1.00 0.00 H new ATOM 0 HA GLU A 83 -12.007 -6.786 11.759 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.466 -3.810 12.103 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -13.045 -4.570 12.140 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -12.303 -5.909 14.124 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -10.789 -5.027 14.112 1.00 0.00 H new ATOM 1279 N ALA A 84 -10.617 -4.998 9.443 1.00 0.00 N ATOM 1280 CA ALA A 84 -10.700 -4.515 8.079 1.00 0.00 C ATOM 1281 C ALA A 84 -10.377 -5.613 7.087 1.00 0.00 C ATOM 1282 O ALA A 84 -9.550 -6.482 7.351 1.00 0.00 O ATOM 1283 CB ALA A 84 -9.768 -3.328 7.878 1.00 0.00 C ATOM 0 H ALA A 84 -9.699 -4.886 9.874 1.00 0.00 H new ATOM 0 HA ALA A 84 -11.725 -4.191 7.900 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -9.842 -2.977 6.849 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -10.052 -2.524 8.557 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -8.742 -3.632 8.085 1.00 0.00 H new ATOM 1289 N GLU A 85 -11.064 -5.583 5.961 1.00 0.00 N ATOM 1290 CA GLU A 85 -10.777 -6.504 4.870 1.00 0.00 C ATOM 1291 C GLU A 85 -9.733 -5.899 3.939 1.00 0.00 C ATOM 1292 O GLU A 85 -8.901 -6.604 3.366 1.00 0.00 O ATOM 1293 CB GLU A 85 -12.052 -6.824 4.089 1.00 0.00 C ATOM 1294 CG GLU A 85 -11.884 -7.964 3.096 1.00 0.00 C ATOM 1295 CD GLU A 85 -13.178 -8.344 2.406 1.00 0.00 C ATOM 1296 OE1 GLU A 85 -13.493 -7.760 1.354 1.00 0.00 O ATOM 1297 OE2 GLU A 85 -13.880 -9.249 2.907 1.00 0.00 O ATOM 0 H GLU A 85 -11.826 -4.931 5.775 1.00 0.00 H new ATOM 0 HA GLU A 85 -10.386 -7.430 5.291 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -12.845 -7.079 4.792 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -12.375 -5.931 3.554 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -11.148 -7.678 2.344 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -11.486 -8.836 3.616 1.00 0.00 H new ATOM 1304 N TYR A 86 -9.793 -4.584 3.801 1.00 0.00 N ATOM 1305 CA TYR A 86 -8.865 -3.847 2.953 1.00 0.00 C ATOM 1306 C TYR A 86 -7.854 -3.095 3.813 1.00 0.00 C ATOM 1307 O TYR A 86 -8.188 -2.092 4.442 1.00 0.00 O ATOM 1308 CB TYR A 86 -9.625 -2.853 2.061 1.00 0.00 C ATOM 1309 CG TYR A 86 -10.503 -3.487 1.002 1.00 0.00 C ATOM 1310 CD1 TYR A 86 -11.611 -4.249 1.342 1.00 0.00 C ATOM 1311 CD2 TYR A 86 -10.222 -3.309 -0.345 1.00 0.00 C ATOM 1312 CE1 TYR A 86 -12.410 -4.818 0.370 1.00 0.00 C ATOM 1313 CE2 TYR A 86 -11.017 -3.872 -1.324 1.00 0.00 C ATOM 1314 CZ TYR A 86 -12.110 -4.625 -0.961 1.00 0.00 C ATOM 1315 OH TYR A 86 -12.908 -5.186 -1.934 1.00 0.00 O ATOM 0 H TYR A 86 -10.483 -3.998 4.271 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.338 -4.559 2.318 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -10.246 -2.220 2.695 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -8.902 -2.202 1.570 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -11.853 -4.400 2.384 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -9.365 -2.719 -0.634 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -13.267 -5.412 0.652 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.782 -3.722 -2.368 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.508 -6.027 -2.240 1.00 0.00 H new ATOM 1325 N LEU A 87 -6.628 -3.587 3.856 1.00 0.00 N ATOM 1326 CA LEU A 87 -5.573 -2.936 4.624 1.00 0.00 C ATOM 1327 C LEU A 87 -4.560 -2.283 3.698 1.00 0.00 C ATOM 1328 O LEU A 87 -4.135 -2.877 2.708 1.00 0.00 O ATOM 1329 CB LEU A 87 -4.848 -3.927 5.546 1.00 0.00 C ATOM 1330 CG LEU A 87 -5.608 -4.365 6.803 1.00 0.00 C ATOM 1331 CD1 LEU A 87 -6.128 -3.154 7.566 1.00 0.00 C ATOM 1332 CD2 LEU A 87 -6.740 -5.318 6.454 1.00 0.00 C ATOM 0 H LEU A 87 -6.335 -4.434 3.370 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.051 -2.174 5.240 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.603 -4.817 4.967 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.904 -3.479 5.856 1.00 0.00 H new ATOM 0 HG LEU A 87 -4.912 -4.900 7.449 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -6.664 -3.487 8.455 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -5.290 -2.524 7.863 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -6.803 -2.584 6.927 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -7.262 -5.612 7.365 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -7.438 -4.822 5.780 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.333 -6.204 5.967 1.00 0.00 H new ATOM 1344 N ALA A 88 -4.179 -1.061 4.020 1.00 0.00 N ATOM 1345 CA ALA A 88 -3.176 -0.346 3.253 1.00 0.00 C ATOM 1346 C ALA A 88 -2.060 0.128 4.174 1.00 0.00 C ATOM 1347 O ALA A 88 -2.315 0.812 5.162 1.00 0.00 O ATOM 1348 CB ALA A 88 -3.804 0.830 2.519 1.00 0.00 C ATOM 0 H ALA A 88 -4.552 -0.540 4.813 1.00 0.00 H new ATOM 0 HA ALA A 88 -2.752 -1.021 2.509 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -3.037 1.355 1.949 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -4.575 0.465 1.840 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -4.250 1.513 3.241 1.00 0.00 H new ATOM 1354 N VAL A 89 -0.830 -0.244 3.856 1.00 0.00 N ATOM 1355 CA VAL A 89 0.308 0.097 4.700 1.00 0.00 C ATOM 1356 C VAL A 89 1.315 0.947 3.931 1.00 0.00 C ATOM 1357 O VAL A 89 1.928 0.480 2.967 1.00 0.00 O ATOM 1358 CB VAL A 89 1.016 -1.170 5.238 1.00 0.00 C ATOM 1359 CG1 VAL A 89 2.122 -0.794 6.213 1.00 0.00 C ATOM 1360 CG2 VAL A 89 0.013 -2.109 5.903 1.00 0.00 C ATOM 0 H VAL A 89 -0.593 -0.781 3.022 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.079 0.666 5.545 1.00 0.00 H new ATOM 0 HB VAL A 89 1.465 -1.692 4.393 1.00 0.00 H new ATOM 0 HG11 VAL A 89 2.607 -1.699 6.580 1.00 0.00 H new ATOM 0 HG12 VAL A 89 2.857 -0.168 5.706 1.00 0.00 H new ATOM 0 HG13 VAL A 89 1.696 -0.245 7.053 1.00 0.00 H new ATOM 0 HG21 VAL A 89 0.532 -2.993 6.274 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -0.469 -1.596 6.735 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -0.741 -2.410 5.176 1.00 0.00 H new ATOM 1370 N ASP A 90 1.478 2.193 4.362 1.00 0.00 N ATOM 1371 CA ASP A 90 2.411 3.112 3.724 1.00 0.00 C ATOM 1372 C ASP A 90 3.775 2.996 4.382 1.00 0.00 C ATOM 1373 O ASP A 90 3.897 3.170 5.597 1.00 0.00 O ATOM 1374 CB ASP A 90 1.900 4.554 3.818 1.00 0.00 C ATOM 1375 CG ASP A 90 2.752 5.534 3.029 1.00 0.00 C ATOM 1376 OD1 ASP A 90 3.800 5.972 3.556 1.00 0.00 O ATOM 1377 OD2 ASP A 90 2.371 5.870 1.884 1.00 0.00 O ATOM 0 H ASP A 90 0.973 2.590 5.154 1.00 0.00 H new ATOM 0 HA ASP A 90 2.497 2.848 2.670 1.00 0.00 H new ATOM 0 HB2 ASP A 90 0.874 4.595 3.452 1.00 0.00 H new ATOM 0 HB3 ASP A 90 1.878 4.859 4.864 1.00 0.00 H new ATOM 1382 N GLN A 91 4.787 2.664 3.580 1.00 0.00 N ATOM 1383 CA GLN A 91 6.158 2.518 4.063 1.00 0.00 C ATOM 1384 C GLN A 91 6.257 1.385 5.084 1.00 0.00 C ATOM 1385 O GLN A 91 6.715 1.580 6.211 1.00 0.00 O ATOM 1386 CB GLN A 91 6.655 3.842 4.655 1.00 0.00 C ATOM 1387 CG GLN A 91 6.871 4.919 3.606 1.00 0.00 C ATOM 1388 CD GLN A 91 7.154 6.274 4.211 1.00 0.00 C ATOM 1389 OE1 GLN A 91 8.307 6.622 4.481 1.00 0.00 O ATOM 1390 NE2 GLN A 91 6.108 7.056 4.414 1.00 0.00 N ATOM 0 H GLN A 91 4.679 2.489 2.581 1.00 0.00 H new ATOM 0 HA GLN A 91 6.798 2.259 3.220 1.00 0.00 H new ATOM 0 HB2 GLN A 91 5.933 4.198 5.390 1.00 0.00 H new ATOM 0 HB3 GLN A 91 7.591 3.667 5.186 1.00 0.00 H new ATOM 0 HG2 GLN A 91 7.703 4.632 2.963 1.00 0.00 H new ATOM 0 HG3 GLN A 91 5.986 4.986 2.973 1.00 0.00 H new ATOM 0 HE21 GLN A 91 5.172 6.728 4.176 1.00 0.00 H new ATOM 0 HE22 GLN A 91 6.237 7.988 4.808 1.00 0.00 H new ATOM 1399 N VAL A 92 5.850 0.190 4.654 1.00 0.00 N ATOM 1400 CA VAL A 92 5.807 -0.996 5.515 1.00 0.00 C ATOM 1401 C VAL A 92 7.175 -1.322 6.128 1.00 0.00 C ATOM 1402 O VAL A 92 7.259 -1.958 7.179 1.00 0.00 O ATOM 1403 CB VAL A 92 5.272 -2.219 4.726 1.00 0.00 C ATOM 1404 CG1 VAL A 92 6.185 -2.566 3.562 1.00 0.00 C ATOM 1405 CG2 VAL A 92 5.078 -3.427 5.634 1.00 0.00 C ATOM 0 H VAL A 92 5.540 0.015 3.698 1.00 0.00 H new ATOM 0 HA VAL A 92 5.128 -0.769 6.337 1.00 0.00 H new ATOM 0 HB VAL A 92 4.298 -1.942 4.323 1.00 0.00 H new ATOM 0 HG11 VAL A 92 5.783 -3.427 3.029 1.00 0.00 H new ATOM 0 HG12 VAL A 92 6.248 -1.716 2.883 1.00 0.00 H new ATOM 0 HG13 VAL A 92 7.180 -2.804 3.938 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.702 -4.266 5.048 1.00 0.00 H new ATOM 0 HG22 VAL A 92 6.032 -3.699 6.087 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.361 -3.182 6.418 1.00 0.00 H new ATOM 1415 N GLU A 93 8.241 -0.866 5.481 1.00 0.00 N ATOM 1416 CA GLU A 93 9.596 -1.075 5.983 1.00 0.00 C ATOM 1417 C GLU A 93 9.785 -0.448 7.369 1.00 0.00 C ATOM 1418 O GLU A 93 10.630 -0.880 8.154 1.00 0.00 O ATOM 1419 CB GLU A 93 10.609 -0.471 5.008 1.00 0.00 C ATOM 1420 CG GLU A 93 12.031 -0.466 5.537 1.00 0.00 C ATOM 1421 CD GLU A 93 12.976 0.316 4.658 1.00 0.00 C ATOM 1422 OE1 GLU A 93 12.669 1.488 4.352 1.00 0.00 O ATOM 1423 OE2 GLU A 93 14.044 -0.222 4.296 1.00 0.00 O ATOM 0 H GLU A 93 8.194 -0.347 4.604 1.00 0.00 H new ATOM 0 HA GLU A 93 9.758 -2.149 6.070 1.00 0.00 H new ATOM 0 HB2 GLU A 93 10.580 -1.031 4.073 1.00 0.00 H new ATOM 0 HB3 GLU A 93 10.313 0.552 4.776 1.00 0.00 H new ATOM 0 HG2 GLU A 93 12.039 -0.041 6.541 1.00 0.00 H new ATOM 0 HG3 GLU A 93 12.386 -1.493 5.622 1.00 0.00 H new ATOM 1430 N LYS A 94 8.979 0.560 7.668 1.00 0.00 N ATOM 1431 CA LYS A 94 9.141 1.331 8.893 1.00 0.00 C ATOM 1432 C LYS A 94 8.354 0.731 10.060 1.00 0.00 C ATOM 1433 O LYS A 94 8.094 1.413 11.053 1.00 0.00 O ATOM 1434 CB LYS A 94 8.726 2.784 8.657 1.00 0.00 C ATOM 1435 CG LYS A 94 9.901 3.715 8.380 1.00 0.00 C ATOM 1436 CD LYS A 94 10.705 3.301 7.154 1.00 0.00 C ATOM 1437 CE LYS A 94 9.917 3.484 5.866 1.00 0.00 C ATOM 1438 NZ LYS A 94 10.774 3.306 4.662 1.00 0.00 N ATOM 0 H LYS A 94 8.204 0.864 7.078 1.00 0.00 H new ATOM 0 HA LYS A 94 10.196 1.297 9.167 1.00 0.00 H new ATOM 0 HB2 LYS A 94 8.035 2.824 7.815 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.185 3.145 9.531 1.00 0.00 H new ATOM 0 HG2 LYS A 94 9.529 4.730 8.239 1.00 0.00 H new ATOM 0 HG3 LYS A 94 10.557 3.733 9.250 1.00 0.00 H new ATOM 0 HD2 LYS A 94 11.621 3.890 7.105 1.00 0.00 H new ATOM 0 HD3 LYS A 94 11.003 2.257 7.251 1.00 0.00 H new ATOM 0 HE2 LYS A 94 9.097 2.767 5.837 1.00 0.00 H new ATOM 0 HE3 LYS A 94 9.472 4.479 5.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 10.173 3.134 3.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 11.340 4.165 4.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 11.408 2.494 4.804 1.00 0.00 H new ATOM 1452 N LEU A 95 7.982 -0.539 9.948 1.00 0.00 N ATOM 1453 CA LEU A 95 7.357 -1.241 11.060 1.00 0.00 C ATOM 1454 C LEU A 95 8.421 -1.709 12.049 1.00 0.00 C ATOM 1455 O LEU A 95 9.568 -1.958 11.666 1.00 0.00 O ATOM 1456 CB LEU A 95 6.540 -2.434 10.560 1.00 0.00 C ATOM 1457 CG LEU A 95 5.275 -2.076 9.777 1.00 0.00 C ATOM 1458 CD1 LEU A 95 4.535 -3.338 9.357 1.00 0.00 C ATOM 1459 CD2 LEU A 95 4.372 -1.178 10.609 1.00 0.00 C ATOM 0 H LEU A 95 8.102 -1.099 9.104 1.00 0.00 H new ATOM 0 HA LEU A 95 6.681 -0.551 11.565 1.00 0.00 H new ATOM 0 HB2 LEU A 95 7.178 -3.050 9.926 1.00 0.00 H new ATOM 0 HB3 LEU A 95 6.257 -3.045 11.417 1.00 0.00 H new ATOM 0 HG LEU A 95 5.566 -1.533 8.878 1.00 0.00 H new ATOM 0 HD11 LEU A 95 3.638 -3.066 8.801 1.00 0.00 H new ATOM 0 HD12 LEU A 95 5.182 -3.946 8.725 1.00 0.00 H new ATOM 0 HD13 LEU A 95 4.254 -3.907 10.243 1.00 0.00 H new ATOM 0 HD21 LEU A 95 3.477 -0.933 10.038 1.00 0.00 H new ATOM 0 HD22 LEU A 95 4.087 -1.696 11.525 1.00 0.00 H new ATOM 0 HD23 LEU A 95 4.904 -0.261 10.862 1.00 0.00 H new ATOM 1471 N GLY A 96 8.043 -1.818 13.317 1.00 0.00 N ATOM 1472 CA GLY A 96 8.994 -2.194 14.342 1.00 0.00 C ATOM 1473 C GLY A 96 8.978 -3.677 14.660 1.00 0.00 C ATOM 1474 O GLY A 96 9.052 -4.517 13.763 1.00 0.00 O ATOM 0 H GLY A 96 7.094 -1.652 13.652 1.00 0.00 H new ATOM 0 HA2 GLY A 96 9.996 -1.909 14.021 1.00 0.00 H new ATOM 0 HA3 GLY A 96 8.779 -1.632 15.251 1.00 0.00 H new ATOM 1478 N ASN A 97 8.863 -4.001 15.941 1.00 0.00 N ATOM 1479 CA ASN A 97 8.966 -5.386 16.391 1.00 0.00 C ATOM 1480 C ASN A 97 7.610 -6.077 16.378 1.00 0.00 C ATOM 1481 O ASN A 97 7.344 -6.934 15.534 1.00 0.00 O ATOM 1482 CB ASN A 97 9.556 -5.457 17.804 1.00 0.00 C ATOM 1483 CG ASN A 97 10.915 -4.794 17.919 1.00 0.00 C ATOM 1484 OD1 ASN A 97 11.012 -3.607 18.235 1.00 0.00 O ATOM 1485 ND2 ASN A 97 11.973 -5.552 17.674 1.00 0.00 N ATOM 0 H ASN A 97 8.699 -3.326 16.687 1.00 0.00 H new ATOM 0 HA ASN A 97 9.629 -5.901 15.696 1.00 0.00 H new ATOM 0 HB2 ASN A 97 8.867 -4.982 18.502 1.00 0.00 H new ATOM 0 HB3 ASN A 97 9.642 -6.502 18.102 1.00 0.00 H new ATOM 0 HD21 ASN A 97 12.911 -5.157 17.744 1.00 0.00 H new ATOM 0 HD22 ASN A 97 11.850 -6.531 17.415 1.00 0.00 H new ATOM 1492 N GLU A 98 6.746 -5.683 17.306 1.00 0.00 N ATOM 1493 CA GLU A 98 5.459 -6.342 17.493 1.00 0.00 C ATOM 1494 C GLU A 98 4.543 -6.088 16.306 1.00 0.00 C ATOM 1495 O GLU A 98 3.743 -6.945 15.929 1.00 0.00 O ATOM 1496 CB GLU A 98 4.801 -5.854 18.782 1.00 0.00 C ATOM 1497 CG GLU A 98 5.652 -6.088 20.019 1.00 0.00 C ATOM 1498 CD GLU A 98 4.997 -5.574 21.281 1.00 0.00 C ATOM 1499 OE1 GLU A 98 4.945 -4.340 21.464 1.00 0.00 O ATOM 1500 OE2 GLU A 98 4.544 -6.400 22.101 1.00 0.00 O ATOM 0 H GLU A 98 6.915 -4.906 17.944 1.00 0.00 H new ATOM 0 HA GLU A 98 5.631 -7.416 17.567 1.00 0.00 H new ATOM 0 HB2 GLU A 98 4.589 -4.789 18.692 1.00 0.00 H new ATOM 0 HB3 GLU A 98 3.844 -6.360 18.907 1.00 0.00 H new ATOM 0 HG2 GLU A 98 5.848 -7.155 20.124 1.00 0.00 H new ATOM 0 HG3 GLU A 98 6.617 -5.598 19.890 1.00 0.00 H new ATOM 1507 N GLU A 99 4.670 -4.905 15.727 1.00 0.00 N ATOM 1508 CA GLU A 99 3.902 -4.524 14.552 1.00 0.00 C ATOM 1509 C GLU A 99 4.204 -5.462 13.390 1.00 0.00 C ATOM 1510 O GLU A 99 3.315 -5.829 12.631 1.00 0.00 O ATOM 1511 CB GLU A 99 4.213 -3.080 14.141 1.00 0.00 C ATOM 1512 CG GLU A 99 4.147 -2.071 15.281 1.00 0.00 C ATOM 1513 CD GLU A 99 5.408 -2.057 16.128 1.00 0.00 C ATOM 1514 OE1 GLU A 99 6.335 -1.295 15.799 1.00 0.00 O ATOM 1515 OE2 GLU A 99 5.479 -2.809 17.124 1.00 0.00 O ATOM 0 H GLU A 99 5.308 -4.182 16.058 1.00 0.00 H new ATOM 0 HA GLU A 99 2.844 -4.597 14.806 1.00 0.00 H new ATOM 0 HB2 GLU A 99 5.210 -3.047 13.701 1.00 0.00 H new ATOM 0 HB3 GLU A 99 3.511 -2.778 13.364 1.00 0.00 H new ATOM 0 HG2 GLU A 99 3.980 -1.075 14.870 1.00 0.00 H new ATOM 0 HG3 GLU A 99 3.291 -2.302 15.915 1.00 0.00 H new ATOM 1522 N GLN A 100 5.463 -5.860 13.273 1.00 0.00 N ATOM 1523 CA GLN A 100 5.887 -6.758 12.215 1.00 0.00 C ATOM 1524 C GLN A 100 5.261 -8.138 12.405 1.00 0.00 C ATOM 1525 O GLN A 100 4.771 -8.747 11.453 1.00 0.00 O ATOM 1526 CB GLN A 100 7.413 -6.858 12.204 1.00 0.00 C ATOM 1527 CG GLN A 100 7.968 -7.737 11.101 1.00 0.00 C ATOM 1528 CD GLN A 100 9.485 -7.750 11.062 1.00 0.00 C ATOM 1529 OE1 GLN A 100 10.086 -7.919 10.004 1.00 0.00 O ATOM 1530 NE2 GLN A 100 10.115 -7.559 12.213 1.00 0.00 N ATOM 0 H GLN A 100 6.211 -5.571 13.904 1.00 0.00 H new ATOM 0 HA GLN A 100 5.552 -6.361 11.257 1.00 0.00 H new ATOM 0 HB2 GLN A 100 7.831 -5.857 12.101 1.00 0.00 H new ATOM 0 HB3 GLN A 100 7.748 -7.246 13.166 1.00 0.00 H new ATOM 0 HG2 GLN A 100 7.605 -8.755 11.238 1.00 0.00 H new ATOM 0 HG3 GLN A 100 7.588 -7.389 10.140 1.00 0.00 H new ATOM 0 HE21 GLN A 100 9.580 -7.422 13.071 1.00 0.00 H new ATOM 0 HE22 GLN A 100 11.135 -7.549 12.241 1.00 0.00 H new ATOM 1539 N ALA A 101 5.265 -8.616 13.645 1.00 0.00 N ATOM 1540 CA ALA A 101 4.644 -9.893 13.978 1.00 0.00 C ATOM 1541 C ALA A 101 3.133 -9.822 13.780 1.00 0.00 C ATOM 1542 O ALA A 101 2.499 -10.788 13.346 1.00 0.00 O ATOM 1543 CB ALA A 101 4.981 -10.282 15.409 1.00 0.00 C ATOM 0 H ALA A 101 5.692 -8.137 14.438 1.00 0.00 H new ATOM 0 HA ALA A 101 5.038 -10.658 13.309 1.00 0.00 H new ATOM 0 HB1 ALA A 101 4.512 -11.237 15.647 1.00 0.00 H new ATOM 0 HB2 ALA A 101 6.062 -10.372 15.517 1.00 0.00 H new ATOM 0 HB3 ALA A 101 4.611 -9.516 16.091 1.00 0.00 H new ATOM 1549 N LEU A 102 2.565 -8.666 14.100 1.00 0.00 N ATOM 1550 CA LEU A 102 1.142 -8.418 13.912 1.00 0.00 C ATOM 1551 C LEU A 102 0.815 -8.447 12.421 1.00 0.00 C ATOM 1552 O LEU A 102 -0.124 -9.116 11.992 1.00 0.00 O ATOM 1553 CB LEU A 102 0.776 -7.058 14.529 1.00 0.00 C ATOM 1554 CG LEU A 102 -0.696 -6.844 14.911 1.00 0.00 C ATOM 1555 CD1 LEU A 102 -1.593 -6.775 13.686 1.00 0.00 C ATOM 1556 CD2 LEU A 102 -1.165 -7.945 15.850 1.00 0.00 C ATOM 0 H LEU A 102 3.076 -7.877 14.496 1.00 0.00 H new ATOM 0 HA LEU A 102 0.558 -9.192 14.409 1.00 0.00 H new ATOM 0 HB2 LEU A 102 1.383 -6.916 15.423 1.00 0.00 H new ATOM 0 HB3 LEU A 102 1.061 -6.277 13.824 1.00 0.00 H new ATOM 0 HG LEU A 102 -0.766 -5.885 15.424 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -2.626 -6.623 13.999 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -1.280 -5.945 13.052 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -1.517 -7.707 13.127 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -2.210 -7.779 16.112 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -1.063 -8.912 15.357 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -0.558 -7.934 16.755 1.00 0.00 H new ATOM 1568 N LEU A 103 1.616 -7.727 11.646 1.00 0.00 N ATOM 1569 CA LEU A 103 1.482 -7.695 10.192 1.00 0.00 C ATOM 1570 C LEU A 103 1.537 -9.113 9.626 1.00 0.00 C ATOM 1571 O LEU A 103 0.711 -9.495 8.793 1.00 0.00 O ATOM 1572 CB LEU A 103 2.602 -6.819 9.597 1.00 0.00 C ATOM 1573 CG LEU A 103 2.504 -6.481 8.099 1.00 0.00 C ATOM 1574 CD1 LEU A 103 2.970 -7.643 7.231 1.00 0.00 C ATOM 1575 CD2 LEU A 103 1.080 -6.074 7.730 1.00 0.00 C ATOM 0 H LEU A 103 2.376 -7.149 12.005 1.00 0.00 H new ATOM 0 HA LEU A 103 0.518 -7.264 9.922 1.00 0.00 H new ATOM 0 HB2 LEU A 103 2.632 -5.883 10.154 1.00 0.00 H new ATOM 0 HB3 LEU A 103 3.553 -7.323 9.769 1.00 0.00 H new ATOM 0 HG LEU A 103 3.168 -5.638 7.908 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.887 -7.368 6.180 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.009 -7.877 7.464 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.348 -8.516 7.428 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.033 -5.839 6.667 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.398 -6.895 7.951 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.791 -5.197 8.309 1.00 0.00 H new ATOM 1587 N PHE A 104 2.508 -9.890 10.095 1.00 0.00 N ATOM 1588 CA PHE A 104 2.645 -11.281 9.681 1.00 0.00 C ATOM 1589 C PHE A 104 1.369 -12.060 9.978 1.00 0.00 C ATOM 1590 O PHE A 104 0.912 -12.865 9.165 1.00 0.00 O ATOM 1591 CB PHE A 104 3.827 -11.939 10.395 1.00 0.00 C ATOM 1592 CG PHE A 104 4.047 -13.372 9.991 1.00 0.00 C ATOM 1593 CD1 PHE A 104 4.670 -13.680 8.792 1.00 0.00 C ATOM 1594 CD2 PHE A 104 3.621 -14.409 10.806 1.00 0.00 C ATOM 1595 CE1 PHE A 104 4.867 -14.995 8.416 1.00 0.00 C ATOM 1596 CE2 PHE A 104 3.814 -15.725 10.434 1.00 0.00 C ATOM 1597 CZ PHE A 104 4.437 -16.018 9.238 1.00 0.00 C ATOM 0 H PHE A 104 3.213 -9.579 10.763 1.00 0.00 H new ATOM 0 HA PHE A 104 2.825 -11.296 8.606 1.00 0.00 H new ATOM 0 HB2 PHE A 104 4.732 -11.368 10.187 1.00 0.00 H new ATOM 0 HB3 PHE A 104 3.662 -11.894 11.472 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.005 -12.883 8.144 1.00 0.00 H new ATOM 0 HD2 PHE A 104 3.132 -14.185 11.743 1.00 0.00 H new ATOM 0 HE1 PHE A 104 5.357 -15.222 7.481 1.00 0.00 H new ATOM 0 HE2 PHE A 104 3.478 -16.524 11.078 1.00 0.00 H new ATOM 0 HZ PHE A 104 4.588 -17.046 8.945 1.00 0.00 H new ATOM 1607 N SER A 105 0.800 -11.811 11.148 1.00 0.00 N ATOM 1608 CA SER A 105 -0.429 -12.457 11.562 1.00 0.00 C ATOM 1609 C SER A 105 -1.579 -12.094 10.623 1.00 0.00 C ATOM 1610 O SER A 105 -2.417 -12.936 10.305 1.00 0.00 O ATOM 1611 CB SER A 105 -0.758 -12.053 12.995 1.00 0.00 C ATOM 1612 OG SER A 105 0.301 -12.389 13.881 1.00 0.00 O ATOM 0 H SER A 105 1.179 -11.157 11.833 1.00 0.00 H new ATOM 0 HA SER A 105 -0.292 -13.537 11.517 1.00 0.00 H new ATOM 0 HB2 SER A 105 -0.946 -10.980 13.039 1.00 0.00 H new ATOM 0 HB3 SER A 105 -1.674 -12.550 13.314 1.00 0.00 H new ATOM 0 HG SER A 105 1.068 -11.802 13.712 1.00 0.00 H new ATOM 1618 N ILE A 106 -1.602 -10.844 10.173 1.00 0.00 N ATOM 1619 CA ILE A 106 -2.603 -10.393 9.212 1.00 0.00 C ATOM 1620 C ILE A 106 -2.458 -11.163 7.899 1.00 0.00 C ATOM 1621 O ILE A 106 -3.437 -11.682 7.356 1.00 0.00 O ATOM 1622 CB ILE A 106 -2.478 -8.876 8.934 1.00 0.00 C ATOM 1623 CG1 ILE A 106 -2.674 -8.079 10.226 1.00 0.00 C ATOM 1624 CG2 ILE A 106 -3.489 -8.437 7.884 1.00 0.00 C ATOM 1625 CD1 ILE A 106 -2.503 -6.585 10.050 1.00 0.00 C ATOM 0 H ILE A 106 -0.938 -10.124 10.459 1.00 0.00 H new ATOM 0 HA ILE A 106 -3.585 -10.584 9.645 1.00 0.00 H new ATOM 0 HB ILE A 106 -1.477 -8.679 8.551 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -3.671 -8.278 10.618 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -1.962 -8.432 10.972 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -3.384 -7.367 7.703 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -3.310 -8.981 6.957 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -4.498 -8.648 8.239 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -2.656 -6.086 11.007 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -1.497 -6.374 9.688 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -3.233 -6.218 9.328 1.00 0.00 H new ATOM 1637 N PHE A 107 -1.225 -11.250 7.416 1.00 0.00 N ATOM 1638 CA PHE A 107 -0.923 -11.983 6.192 1.00 0.00 C ATOM 1639 C PHE A 107 -1.292 -13.454 6.325 1.00 0.00 C ATOM 1640 O PHE A 107 -1.957 -14.013 5.457 1.00 0.00 O ATOM 1641 CB PHE A 107 0.561 -11.857 5.850 1.00 0.00 C ATOM 1642 CG PHE A 107 0.912 -10.623 5.064 1.00 0.00 C ATOM 1643 CD1 PHE A 107 0.287 -9.411 5.316 1.00 0.00 C ATOM 1644 CD2 PHE A 107 1.875 -10.681 4.069 1.00 0.00 C ATOM 1645 CE1 PHE A 107 0.620 -8.282 4.591 1.00 0.00 C ATOM 1646 CE2 PHE A 107 2.210 -9.557 3.342 1.00 0.00 C ATOM 1647 CZ PHE A 107 1.583 -8.356 3.604 1.00 0.00 C ATOM 0 H PHE A 107 -0.412 -10.819 7.857 1.00 0.00 H new ATOM 0 HA PHE A 107 -1.519 -11.548 5.390 1.00 0.00 H new ATOM 0 HB2 PHE A 107 1.137 -11.860 6.775 1.00 0.00 H new ATOM 0 HB3 PHE A 107 0.867 -12.735 5.281 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -0.467 -9.348 6.086 1.00 0.00 H new ATOM 0 HD2 PHE A 107 2.370 -11.618 3.860 1.00 0.00 H new ATOM 0 HE1 PHE A 107 0.127 -7.343 4.796 1.00 0.00 H new ATOM 0 HE2 PHE A 107 2.962 -9.617 2.569 1.00 0.00 H new ATOM 0 HZ PHE A 107 1.845 -7.475 3.038 1.00 0.00 H new ATOM 1657 N ASN A 108 -0.865 -14.065 7.423 1.00 0.00 N ATOM 1658 CA ASN A 108 -1.116 -15.482 7.675 1.00 0.00 C ATOM 1659 C ASN A 108 -2.617 -15.746 7.748 1.00 0.00 C ATOM 1660 O ASN A 108 -3.106 -16.763 7.261 1.00 0.00 O ATOM 1661 CB ASN A 108 -0.430 -15.902 8.980 1.00 0.00 C ATOM 1662 CG ASN A 108 -0.242 -17.404 9.105 1.00 0.00 C ATOM 1663 OD1 ASN A 108 -1.049 -18.196 8.624 1.00 0.00 O ATOM 1664 ND2 ASN A 108 0.842 -17.807 9.753 1.00 0.00 N ATOM 0 H ASN A 108 -0.338 -13.598 8.161 1.00 0.00 H new ATOM 0 HA ASN A 108 -0.705 -16.072 6.856 1.00 0.00 H new ATOM 0 HB2 ASN A 108 0.543 -15.415 9.044 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -1.021 -15.546 9.824 1.00 0.00 H new ATOM 0 HD21 ASN A 108 1.028 -18.804 9.865 1.00 0.00 H new ATOM 0 HD22 ASN A 108 1.490 -17.120 10.139 1.00 0.00 H new ATOM 1671 N ARG A 109 -3.343 -14.808 8.343 1.00 0.00 N ATOM 1672 CA ARG A 109 -4.792 -14.900 8.450 1.00 0.00 C ATOM 1673 C ARG A 109 -5.454 -14.862 7.072 1.00 0.00 C ATOM 1674 O ARG A 109 -6.276 -15.718 6.742 1.00 0.00 O ATOM 1675 CB ARG A 109 -5.320 -13.759 9.325 1.00 0.00 C ATOM 1676 CG ARG A 109 -6.830 -13.611 9.304 1.00 0.00 C ATOM 1677 CD ARG A 109 -7.278 -12.516 10.253 1.00 0.00 C ATOM 1678 NE ARG A 109 -8.674 -12.137 10.052 1.00 0.00 N ATOM 1679 CZ ARG A 109 -9.538 -11.931 11.047 1.00 0.00 C ATOM 1680 NH1 ARG A 109 -9.182 -12.185 12.305 1.00 0.00 N ATOM 1681 NH2 ARG A 109 -10.765 -11.497 10.781 1.00 0.00 N ATOM 0 H ARG A 109 -2.946 -13.967 8.762 1.00 0.00 H new ATOM 0 HA ARG A 109 -5.042 -15.855 8.912 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -4.996 -13.923 10.353 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -4.869 -12.823 8.994 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -7.163 -13.380 8.292 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -7.296 -14.555 9.585 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -7.141 -12.852 11.281 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -6.644 -11.640 10.117 1.00 0.00 H new ATOM 0 HE ARG A 109 -9.008 -12.023 9.095 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -8.247 -12.538 12.509 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -9.844 -12.027 13.064 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -11.046 -11.322 9.816 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -11.426 -11.339 11.541 1.00 0.00 H new ATOM 1695 N PHE A 110 -5.085 -13.874 6.264 1.00 0.00 N ATOM 1696 CA PHE A 110 -5.692 -13.703 4.951 1.00 0.00 C ATOM 1697 C PHE A 110 -5.254 -14.800 3.984 1.00 0.00 C ATOM 1698 O PHE A 110 -6.074 -15.353 3.252 1.00 0.00 O ATOM 1699 CB PHE A 110 -5.361 -12.323 4.382 1.00 0.00 C ATOM 1700 CG PHE A 110 -6.115 -11.203 5.045 1.00 0.00 C ATOM 1701 CD1 PHE A 110 -7.407 -11.402 5.513 1.00 0.00 C ATOM 1702 CD2 PHE A 110 -5.539 -9.953 5.194 1.00 0.00 C ATOM 1703 CE1 PHE A 110 -8.106 -10.376 6.116 1.00 0.00 C ATOM 1704 CE2 PHE A 110 -6.237 -8.923 5.798 1.00 0.00 C ATOM 1705 CZ PHE A 110 -7.520 -9.135 6.260 1.00 0.00 C ATOM 0 H PHE A 110 -4.371 -13.183 6.495 1.00 0.00 H new ATOM 0 HA PHE A 110 -6.772 -13.781 5.073 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -4.291 -12.142 4.488 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -5.581 -12.317 3.315 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -7.871 -12.371 5.404 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -4.535 -9.780 4.835 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -9.111 -10.544 6.475 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -5.778 -7.952 5.908 1.00 0.00 H new ATOM 0 HZ PHE A 110 -8.064 -8.331 6.733 1.00 0.00 H new ATOM 1715 N ARG A 111 -3.967 -15.130 3.999 1.00 0.00 N ATOM 1716 CA ARG A 111 -3.430 -16.165 3.118 1.00 0.00 C ATOM 1717 C ARG A 111 -4.014 -17.534 3.469 1.00 0.00 C ATOM 1718 O ARG A 111 -4.097 -18.422 2.615 1.00 0.00 O ATOM 1719 CB ARG A 111 -1.897 -16.190 3.198 1.00 0.00 C ATOM 1720 CG ARG A 111 -1.242 -17.272 2.348 1.00 0.00 C ATOM 1721 CD ARG A 111 -1.692 -17.199 0.897 1.00 0.00 C ATOM 1722 NE ARG A 111 -1.034 -18.206 0.068 1.00 0.00 N ATOM 1723 CZ ARG A 111 -1.480 -19.453 -0.099 1.00 0.00 C ATOM 1724 NH1 ARG A 111 -2.570 -19.867 0.543 1.00 0.00 N ATOM 1725 NH2 ARG A 111 -0.828 -20.284 -0.906 1.00 0.00 N ATOM 0 H ARG A 111 -3.275 -14.697 4.611 1.00 0.00 H new ATOM 0 HA ARG A 111 -3.719 -15.930 2.094 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -1.513 -15.218 2.888 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -1.601 -16.332 4.237 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -0.158 -17.167 2.398 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -1.487 -18.253 2.756 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -2.772 -17.336 0.845 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -1.477 -16.207 0.500 1.00 0.00 H new ATOM 0 HE ARG A 111 -0.177 -17.938 -0.415 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -3.068 -19.231 1.165 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -2.907 -20.821 0.413 1.00 0.00 H new ATOM 0 HH21 ARG A 111 0.010 -19.968 -1.395 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -1.165 -21.238 -1.036 1.00 0.00 H new ATOM 1739 N ASN A 112 -4.421 -17.689 4.723 1.00 0.00 N ATOM 1740 CA ASN A 112 -5.036 -18.927 5.194 1.00 0.00 C ATOM 1741 C ASN A 112 -6.359 -19.167 4.477 1.00 0.00 C ATOM 1742 O ASN A 112 -6.606 -20.247 3.934 1.00 0.00 O ATOM 1743 CB ASN A 112 -5.277 -18.851 6.702 1.00 0.00 C ATOM 1744 CG ASN A 112 -4.746 -20.060 7.441 1.00 0.00 C ATOM 1745 OD1 ASN A 112 -5.440 -21.064 7.601 1.00 0.00 O ATOM 1746 ND2 ASN A 112 -3.509 -19.965 7.907 1.00 0.00 N ATOM 0 H ASN A 112 -4.336 -16.967 5.438 1.00 0.00 H new ATOM 0 HA ASN A 112 -4.360 -19.754 4.978 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -4.803 -17.952 7.097 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -6.346 -18.756 6.890 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -3.097 -20.743 8.421 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -2.969 -19.114 7.751 1.00 0.00 H new ATOM 1753 N SER A 113 -7.200 -18.142 4.471 1.00 0.00 N ATOM 1754 CA SER A 113 -8.512 -18.230 3.854 1.00 0.00 C ATOM 1755 C SER A 113 -8.426 -18.072 2.336 1.00 0.00 C ATOM 1756 O SER A 113 -9.133 -18.753 1.594 1.00 0.00 O ATOM 1757 CB SER A 113 -9.433 -17.163 4.444 1.00 0.00 C ATOM 1758 OG SER A 113 -9.491 -17.273 5.856 1.00 0.00 O ATOM 0 H SER A 113 -6.993 -17.235 4.890 1.00 0.00 H new ATOM 0 HA SER A 113 -8.921 -19.219 4.063 1.00 0.00 H new ATOM 0 HB2 SER A 113 -9.074 -16.172 4.166 1.00 0.00 H new ATOM 0 HB3 SER A 113 -10.434 -17.268 4.025 1.00 0.00 H new ATOM 0 HG SER A 113 -10.084 -16.580 6.214 1.00 0.00 H new ATOM 1764 N GLY A 114 -7.560 -17.175 1.880 1.00 0.00 N ATOM 1765 CA GLY A 114 -7.417 -16.939 0.456 1.00 0.00 C ATOM 1766 C GLY A 114 -7.949 -15.579 0.048 1.00 0.00 C ATOM 1767 O GLY A 114 -7.782 -15.151 -1.095 1.00 0.00 O ATOM 0 H GLY A 114 -6.954 -16.606 2.471 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -6.365 -17.014 0.180 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -7.947 -17.716 -0.095 1.00 0.00 H new ATOM 1771 N LYS A 115 -8.591 -14.898 0.984 1.00 0.00 N ATOM 1772 CA LYS A 115 -9.124 -13.570 0.739 1.00 0.00 C ATOM 1773 C LYS A 115 -8.202 -12.537 1.379 1.00 0.00 C ATOM 1774 O LYS A 115 -7.076 -12.857 1.751 1.00 0.00 O ATOM 1775 CB LYS A 115 -10.540 -13.457 1.311 1.00 0.00 C ATOM 1776 CG LYS A 115 -11.465 -12.576 0.483 1.00 0.00 C ATOM 1777 CD LYS A 115 -12.743 -12.254 1.234 1.00 0.00 C ATOM 1778 CE LYS A 115 -13.696 -11.418 0.395 1.00 0.00 C ATOM 1779 NZ LYS A 115 -14.898 -11.018 1.170 1.00 0.00 N ATOM 0 H LYS A 115 -8.756 -15.248 1.928 1.00 0.00 H new ATOM 0 HA LYS A 115 -9.176 -13.387 -0.334 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -10.973 -14.454 1.386 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -10.483 -13.058 2.324 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -10.951 -11.651 0.223 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -11.708 -13.080 -0.453 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -13.235 -13.181 1.528 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -12.500 -11.717 2.151 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -13.180 -10.527 0.036 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -14.001 -11.985 -0.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -15.526 -10.449 0.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -15.403 -11.869 1.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -14.608 -10.456 1.995 1.00 0.00 H new ATOM 1793 N GLY A 116 -8.674 -11.307 1.505 1.00 0.00 N ATOM 1794 CA GLY A 116 -7.873 -10.267 2.110 1.00 0.00 C ATOM 1795 C GLY A 116 -7.279 -9.341 1.079 1.00 0.00 C ATOM 1796 O GLY A 116 -6.725 -9.792 0.075 1.00 0.00 O ATOM 0 H GLY A 116 -9.600 -11.011 1.198 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -8.488 -9.692 2.802 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -7.072 -10.720 2.695 1.00 0.00 H new ATOM 1800 N PHE A 117 -7.409 -8.048 1.315 1.00 0.00 N ATOM 1801 CA PHE A 117 -6.893 -7.051 0.399 1.00 0.00 C ATOM 1802 C PHE A 117 -5.825 -6.217 1.087 1.00 0.00 C ATOM 1803 O PHE A 117 -6.084 -5.574 2.102 1.00 0.00 O ATOM 1804 CB PHE A 117 -8.026 -6.159 -0.112 1.00 0.00 C ATOM 1805 CG PHE A 117 -9.046 -6.892 -0.942 1.00 0.00 C ATOM 1806 CD1 PHE A 117 -10.056 -7.626 -0.338 1.00 0.00 C ATOM 1807 CD2 PHE A 117 -8.993 -6.845 -2.324 1.00 0.00 C ATOM 1808 CE1 PHE A 117 -10.992 -8.300 -1.100 1.00 0.00 C ATOM 1809 CE2 PHE A 117 -9.925 -7.516 -3.092 1.00 0.00 C ATOM 1810 CZ PHE A 117 -10.926 -8.244 -2.481 1.00 0.00 C ATOM 0 H PHE A 117 -7.871 -7.664 2.139 1.00 0.00 H new ATOM 0 HA PHE A 117 -6.444 -7.556 -0.456 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -8.527 -5.699 0.740 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -7.600 -5.351 -0.706 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -10.112 -7.671 0.740 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -8.213 -6.276 -2.808 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -11.773 -8.869 -0.618 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -9.870 -7.471 -4.170 1.00 0.00 H new ATOM 0 HZ PHE A 117 -11.656 -8.769 -3.079 1.00 0.00 H new ATOM 1820 N LEU A 118 -4.625 -6.246 0.537 1.00 0.00 N ATOM 1821 CA LEU A 118 -3.489 -5.560 1.125 1.00 0.00 C ATOM 1822 C LEU A 118 -2.804 -4.673 0.096 1.00 0.00 C ATOM 1823 O LEU A 118 -2.267 -5.158 -0.902 1.00 0.00 O ATOM 1824 CB LEU A 118 -2.481 -6.570 1.684 1.00 0.00 C ATOM 1825 CG LEU A 118 -2.426 -6.686 3.211 1.00 0.00 C ATOM 1826 CD1 LEU A 118 -2.030 -5.357 3.837 1.00 0.00 C ATOM 1827 CD2 LEU A 118 -3.758 -7.168 3.767 1.00 0.00 C ATOM 0 H LEU A 118 -4.411 -6.744 -0.327 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.859 -4.937 1.939 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.714 -7.552 1.273 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -1.488 -6.301 1.323 1.00 0.00 H new ATOM 0 HG LEU A 118 -1.666 -7.424 3.467 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -1.997 -5.461 4.922 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -1.047 -5.061 3.471 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -2.762 -4.596 3.568 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -3.694 -7.242 4.853 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -4.542 -6.460 3.498 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -3.994 -8.147 3.350 1.00 0.00 H new ATOM 1839 N LEU A 119 -2.833 -3.377 0.339 1.00 0.00 N ATOM 1840 CA LEU A 119 -2.107 -2.432 -0.489 1.00 0.00 C ATOM 1841 C LEU A 119 -0.794 -2.092 0.193 1.00 0.00 C ATOM 1842 O LEU A 119 -0.765 -1.361 1.186 1.00 0.00 O ATOM 1843 CB LEU A 119 -2.930 -1.165 -0.733 1.00 0.00 C ATOM 1844 CG LEU A 119 -2.291 -0.148 -1.685 1.00 0.00 C ATOM 1845 CD1 LEU A 119 -2.096 -0.754 -3.067 1.00 0.00 C ATOM 1846 CD2 LEU A 119 -3.141 1.110 -1.771 1.00 0.00 C ATOM 0 H LEU A 119 -3.354 -2.952 1.106 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.911 -2.885 -1.461 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.902 -1.453 -1.133 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -3.112 -0.678 0.225 1.00 0.00 H new ATOM 0 HG LEU A 119 -1.313 0.123 -1.288 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -1.641 -0.016 -3.727 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -1.445 -1.625 -2.994 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -3.062 -1.056 -3.471 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -2.672 1.820 -2.451 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -4.133 0.854 -2.142 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -3.228 1.559 -0.781 1.00 0.00 H new ATOM 1858 N LEU A 120 0.283 -2.647 -0.325 1.00 0.00 N ATOM 1859 CA LEU A 120 1.584 -2.513 0.297 1.00 0.00 C ATOM 1860 C LEU A 120 2.440 -1.500 -0.449 1.00 0.00 C ATOM 1861 O LEU A 120 2.663 -1.632 -1.653 1.00 0.00 O ATOM 1862 CB LEU A 120 2.280 -3.871 0.321 1.00 0.00 C ATOM 1863 CG LEU A 120 1.518 -4.976 1.052 1.00 0.00 C ATOM 1864 CD1 LEU A 120 2.153 -6.327 0.776 1.00 0.00 C ATOM 1865 CD2 LEU A 120 1.486 -4.696 2.547 1.00 0.00 C ATOM 0 H LEU A 120 0.282 -3.200 -1.182 1.00 0.00 H new ATOM 0 HA LEU A 120 1.448 -2.156 1.318 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.456 -4.190 -0.706 1.00 0.00 H new ATOM 0 HB3 LEU A 120 3.257 -3.753 0.790 1.00 0.00 H new ATOM 0 HG LEU A 120 0.493 -4.996 0.683 1.00 0.00 H new ATOM 0 HD11 LEU A 120 1.599 -7.104 1.303 1.00 0.00 H new ATOM 0 HD12 LEU A 120 2.129 -6.528 -0.295 1.00 0.00 H new ATOM 0 HD13 LEU A 120 3.187 -6.320 1.121 1.00 0.00 H new ATOM 0 HD21 LEU A 120 0.940 -5.491 3.055 1.00 0.00 H new ATOM 0 HD22 LEU A 120 2.505 -4.653 2.931 1.00 0.00 H new ATOM 0 HD23 LEU A 120 0.990 -3.743 2.728 1.00 0.00 H new ATOM 1877 N GLY A 121 2.904 -0.488 0.265 1.00 0.00 N ATOM 1878 CA GLY A 121 3.783 0.497 -0.326 1.00 0.00 C ATOM 1879 C GLY A 121 5.038 0.691 0.492 1.00 0.00 C ATOM 1880 O GLY A 121 5.008 0.564 1.718 1.00 0.00 O ATOM 0 H GLY A 121 2.686 -0.331 1.249 1.00 0.00 H new ATOM 0 HA2 GLY A 121 4.052 0.186 -1.335 1.00 0.00 H new ATOM 0 HA3 GLY A 121 3.257 1.447 -0.415 1.00 0.00 H new ATOM 1884 N SER A 122 6.141 0.981 -0.185 1.00 0.00 N ATOM 1885 CA SER A 122 7.415 1.234 0.471 1.00 0.00 C ATOM 1886 C SER A 122 8.446 1.620 -0.581 1.00 0.00 C ATOM 1887 O SER A 122 8.242 1.370 -1.772 1.00 0.00 O ATOM 1888 CB SER A 122 7.878 -0.009 1.246 1.00 0.00 C ATOM 1889 OG SER A 122 8.959 0.289 2.120 1.00 0.00 O ATOM 0 H SER A 122 6.177 1.047 -1.202 1.00 0.00 H new ATOM 0 HA SER A 122 7.300 2.050 1.184 1.00 0.00 H new ATOM 0 HB2 SER A 122 7.044 -0.410 1.822 1.00 0.00 H new ATOM 0 HB3 SER A 122 8.182 -0.784 0.543 1.00 0.00 H new ATOM 0 HG SER A 122 8.614 0.706 2.937 1.00 0.00 H new ATOM 1895 N GLU A 123 9.531 2.250 -0.152 1.00 0.00 N ATOM 1896 CA GLU A 123 10.602 2.615 -1.066 1.00 0.00 C ATOM 1897 C GLU A 123 11.308 1.361 -1.572 1.00 0.00 C ATOM 1898 O GLU A 123 11.675 0.491 -0.781 1.00 0.00 O ATOM 1899 CB GLU A 123 11.617 3.544 -0.388 1.00 0.00 C ATOM 1900 CG GLU A 123 10.994 4.724 0.341 1.00 0.00 C ATOM 1901 CD GLU A 123 10.795 4.451 1.820 1.00 0.00 C ATOM 1902 OE1 GLU A 123 9.890 3.665 2.178 1.00 0.00 O ATOM 1903 OE2 GLU A 123 11.562 5.009 2.637 1.00 0.00 O ATOM 0 H GLU A 123 9.692 2.518 0.819 1.00 0.00 H new ATOM 0 HA GLU A 123 10.160 3.148 -1.908 1.00 0.00 H new ATOM 0 HB2 GLU A 123 12.206 2.963 0.322 1.00 0.00 H new ATOM 0 HB3 GLU A 123 12.308 3.921 -1.142 1.00 0.00 H new ATOM 0 HG2 GLU A 123 11.631 5.600 0.219 1.00 0.00 H new ATOM 0 HG3 GLU A 123 10.033 4.962 -0.114 1.00 0.00 H new ATOM 1910 N TYR A 124 11.486 1.279 -2.889 1.00 0.00 N ATOM 1911 CA TYR A 124 12.167 0.148 -3.525 1.00 0.00 C ATOM 1912 C TYR A 124 11.368 -1.152 -3.379 1.00 0.00 C ATOM 1913 O TYR A 124 10.175 -1.132 -3.077 1.00 0.00 O ATOM 1914 CB TYR A 124 13.589 -0.020 -2.972 1.00 0.00 C ATOM 1915 CG TYR A 124 14.511 1.121 -3.346 1.00 0.00 C ATOM 1916 CD1 TYR A 124 15.149 1.142 -4.581 1.00 0.00 C ATOM 1917 CD2 TYR A 124 14.732 2.182 -2.476 1.00 0.00 C ATOM 1918 CE1 TYR A 124 15.982 2.185 -4.937 1.00 0.00 C ATOM 1919 CE2 TYR A 124 15.562 3.231 -2.826 1.00 0.00 C ATOM 1920 CZ TYR A 124 16.184 3.226 -4.057 1.00 0.00 C ATOM 1921 OH TYR A 124 17.007 4.270 -4.415 1.00 0.00 O ATOM 0 H TYR A 124 11.164 1.991 -3.545 1.00 0.00 H new ATOM 0 HA TYR A 124 12.238 0.370 -4.590 1.00 0.00 H new ATOM 0 HB2 TYR A 124 13.543 -0.101 -1.886 1.00 0.00 H new ATOM 0 HB3 TYR A 124 14.009 -0.955 -3.343 1.00 0.00 H new ATOM 0 HD1 TYR A 124 14.991 0.329 -5.274 1.00 0.00 H new ATOM 0 HD2 TYR A 124 14.248 2.187 -1.511 1.00 0.00 H new ATOM 0 HE1 TYR A 124 16.472 2.185 -5.899 1.00 0.00 H new ATOM 0 HE2 TYR A 124 15.722 4.049 -2.140 1.00 0.00 H new ATOM 0 HH TYR A 124 17.043 4.923 -3.685 1.00 0.00 H new ATOM 1931 N THR A 125 12.032 -2.276 -3.622 1.00 0.00 N ATOM 1932 CA THR A 125 11.378 -3.574 -3.655 1.00 0.00 C ATOM 1933 C THR A 125 11.354 -4.238 -2.272 1.00 0.00 C ATOM 1934 O THR A 125 12.182 -3.933 -1.413 1.00 0.00 O ATOM 1935 CB THR A 125 12.094 -4.495 -4.658 1.00 0.00 C ATOM 1936 OG1 THR A 125 13.513 -4.427 -4.451 1.00 0.00 O ATOM 1937 CG2 THR A 125 11.762 -4.095 -6.089 1.00 0.00 C ATOM 0 H THR A 125 13.036 -2.311 -3.801 1.00 0.00 H new ATOM 0 HA THR A 125 10.346 -3.415 -3.967 1.00 0.00 H new ATOM 0 HB THR A 125 11.751 -5.517 -4.496 1.00 0.00 H new ATOM 0 HG1 THR A 125 13.965 -5.016 -5.090 1.00 0.00 H new ATOM 0 HG21 THR A 125 12.279 -4.759 -6.782 1.00 0.00 H new ATOM 0 HG22 THR A 125 10.686 -4.171 -6.248 1.00 0.00 H new ATOM 0 HG23 THR A 125 12.083 -3.068 -6.264 1.00 0.00 H new ATOM 1945 N PRO A 126 10.413 -5.179 -2.052 1.00 0.00 N ATOM 1946 CA PRO A 126 10.250 -5.860 -0.758 1.00 0.00 C ATOM 1947 C PRO A 126 11.463 -6.705 -0.392 1.00 0.00 C ATOM 1948 O PRO A 126 11.745 -6.939 0.784 1.00 0.00 O ATOM 1949 CB PRO A 126 9.033 -6.769 -0.965 1.00 0.00 C ATOM 1950 CG PRO A 126 8.357 -6.261 -2.190 1.00 0.00 C ATOM 1951 CD PRO A 126 9.431 -5.646 -3.040 1.00 0.00 C ATOM 0 HA PRO A 126 10.131 -5.142 0.053 1.00 0.00 H new ATOM 0 HB2 PRO A 126 9.337 -7.809 -1.088 1.00 0.00 H new ATOM 0 HB3 PRO A 126 8.365 -6.731 -0.105 1.00 0.00 H new ATOM 0 HG2 PRO A 126 7.856 -7.070 -2.722 1.00 0.00 H new ATOM 0 HG3 PRO A 126 7.593 -5.526 -1.936 1.00 0.00 H new ATOM 0 HD2 PRO A 126 9.865 -6.372 -3.728 1.00 0.00 H new ATOM 0 HD3 PRO A 126 9.046 -4.825 -3.644 1.00 0.00 H new ATOM 1959 N GLN A 127 12.186 -7.148 -1.410 1.00 0.00 N ATOM 1960 CA GLN A 127 13.354 -7.995 -1.213 1.00 0.00 C ATOM 1961 C GLN A 127 14.566 -7.143 -0.858 1.00 0.00 C ATOM 1962 O GLN A 127 15.646 -7.657 -0.568 1.00 0.00 O ATOM 1963 CB GLN A 127 13.637 -8.825 -2.471 1.00 0.00 C ATOM 1964 CG GLN A 127 12.423 -9.583 -2.984 1.00 0.00 C ATOM 1965 CD GLN A 127 12.757 -10.536 -4.116 1.00 0.00 C ATOM 1966 OE1 GLN A 127 13.053 -11.707 -3.883 1.00 0.00 O ATOM 1967 NE2 GLN A 127 12.723 -10.042 -5.343 1.00 0.00 N ATOM 0 H GLN A 127 11.983 -6.934 -2.386 1.00 0.00 H new ATOM 0 HA GLN A 127 13.151 -8.679 -0.389 1.00 0.00 H new ATOM 0 HB2 GLN A 127 14.002 -8.165 -3.258 1.00 0.00 H new ATOM 0 HB3 GLN A 127 14.435 -9.536 -2.256 1.00 0.00 H new ATOM 0 HG2 GLN A 127 11.978 -10.144 -2.163 1.00 0.00 H new ATOM 0 HG3 GLN A 127 11.673 -8.869 -3.326 1.00 0.00 H new ATOM 0 HE21 GLN A 127 12.472 -9.065 -5.493 1.00 0.00 H new ATOM 0 HE22 GLN A 127 12.947 -10.639 -6.139 1.00 0.00 H new ATOM 1976 N GLN A 128 14.372 -5.835 -0.879 1.00 0.00 N ATOM 1977 CA GLN A 128 15.435 -4.897 -0.574 1.00 0.00 C ATOM 1978 C GLN A 128 15.172 -4.237 0.777 1.00 0.00 C ATOM 1979 O GLN A 128 16.036 -3.561 1.334 1.00 0.00 O ATOM 1980 CB GLN A 128 15.510 -3.850 -1.686 1.00 0.00 C ATOM 1981 CG GLN A 128 16.792 -3.038 -1.706 1.00 0.00 C ATOM 1982 CD GLN A 128 16.891 -2.155 -2.938 1.00 0.00 C ATOM 1983 OE1 GLN A 128 16.277 -2.587 -4.033 1.00 0.00 O flip ATOM 1984 NE2 GLN A 128 17.510 -1.094 -2.909 1.00 0.00 N flip ATOM 0 H GLN A 128 13.479 -5.397 -1.106 1.00 0.00 H new ATOM 0 HA GLN A 128 16.389 -5.421 -0.516 1.00 0.00 H new ATOM 0 HB2 GLN A 128 15.399 -4.352 -2.647 1.00 0.00 H new ATOM 0 HB3 GLN A 128 14.666 -3.168 -1.582 1.00 0.00 H new ATOM 0 HG2 GLN A 128 16.841 -2.418 -0.811 1.00 0.00 H new ATOM 0 HG3 GLN A 128 17.648 -3.712 -1.674 1.00 0.00 H new ATOM 0 HE21 GLN A 128 17.969 -0.795 -2.049 1.00 0.00 H new ATOM 0 HE22 GLN A 128 17.565 -0.512 -3.745 1.00 0.00 H new ATOM 1993 N LEU A 129 13.974 -4.463 1.307 1.00 0.00 N ATOM 1994 CA LEU A 129 13.565 -3.867 2.571 1.00 0.00 C ATOM 1995 C LEU A 129 14.228 -4.564 3.753 1.00 0.00 C ATOM 1996 O LEU A 129 14.477 -5.773 3.718 1.00 0.00 O ATOM 1997 CB LEU A 129 12.044 -3.939 2.721 1.00 0.00 C ATOM 1998 CG LEU A 129 11.241 -3.206 1.645 1.00 0.00 C ATOM 1999 CD1 LEU A 129 9.748 -3.355 1.898 1.00 0.00 C ATOM 2000 CD2 LEU A 129 11.629 -1.737 1.597 1.00 0.00 C ATOM 0 H LEU A 129 13.267 -5.059 0.876 1.00 0.00 H new ATOM 0 HA LEU A 129 13.882 -2.824 2.565 1.00 0.00 H new ATOM 0 HB2 LEU A 129 11.746 -4.987 2.721 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.773 -3.530 3.694 1.00 0.00 H new ATOM 0 HG LEU A 129 11.473 -3.655 0.679 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.193 -2.827 1.123 1.00 0.00 H new ATOM 0 HD12 LEU A 129 9.480 -4.411 1.881 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.500 -2.934 2.872 1.00 0.00 H new ATOM 0 HD21 LEU A 129 11.047 -1.232 0.826 1.00 0.00 H new ATOM 0 HD22 LEU A 129 11.427 -1.276 2.564 1.00 0.00 H new ATOM 0 HD23 LEU A 129 12.691 -1.648 1.367 1.00 0.00 H new ATOM 2012 N VAL A 130 14.511 -3.796 4.797 1.00 0.00 N ATOM 2013 CA VAL A 130 15.117 -4.335 6.007 1.00 0.00 C ATOM 2014 C VAL A 130 14.041 -4.794 6.988 1.00 0.00 C ATOM 2015 O VAL A 130 13.547 -4.017 7.806 1.00 0.00 O ATOM 2016 CB VAL A 130 16.042 -3.307 6.699 1.00 0.00 C ATOM 2017 CG1 VAL A 130 16.754 -3.934 7.889 1.00 0.00 C ATOM 2018 CG2 VAL A 130 17.050 -2.736 5.707 1.00 0.00 C ATOM 0 H VAL A 130 14.329 -2.793 4.830 1.00 0.00 H new ATOM 0 HA VAL A 130 15.724 -5.188 5.706 1.00 0.00 H new ATOM 0 HB VAL A 130 15.424 -2.488 7.067 1.00 0.00 H new ATOM 0 HG11 VAL A 130 17.399 -3.192 8.360 1.00 0.00 H new ATOM 0 HG12 VAL A 130 16.016 -4.284 8.611 1.00 0.00 H new ATOM 0 HG13 VAL A 130 17.357 -4.776 7.550 1.00 0.00 H new ATOM 0 HG21 VAL A 130 17.691 -2.015 6.214 1.00 0.00 H new ATOM 0 HG22 VAL A 130 17.661 -3.544 5.303 1.00 0.00 H new ATOM 0 HG23 VAL A 130 16.520 -2.241 4.894 1.00 0.00 H new ATOM 2028 N ILE A 131 13.676 -6.060 6.864 1.00 0.00 N ATOM 2029 CA ILE A 131 12.668 -6.696 7.709 1.00 0.00 C ATOM 2030 C ILE A 131 13.082 -8.141 7.941 1.00 0.00 C ATOM 2031 O ILE A 131 14.183 -8.525 7.539 1.00 0.00 O ATOM 2032 CB ILE A 131 11.264 -6.667 7.051 1.00 0.00 C ATOM 2033 CG1 ILE A 131 11.346 -7.179 5.603 1.00 0.00 C ATOM 2034 CG2 ILE A 131 10.668 -5.267 7.108 1.00 0.00 C ATOM 2035 CD1 ILE A 131 10.017 -7.197 4.881 1.00 0.00 C ATOM 0 H ILE A 131 14.075 -6.687 6.165 1.00 0.00 H new ATOM 0 HA ILE A 131 12.605 -6.148 8.649 1.00 0.00 H new ATOM 0 HB ILE A 131 10.603 -7.329 7.610 1.00 0.00 H new ATOM 0 HG12 ILE A 131 12.042 -6.552 5.046 1.00 0.00 H new ATOM 0 HG13 ILE A 131 11.759 -8.188 5.608 1.00 0.00 H new ATOM 0 HG21 ILE A 131 9.683 -5.271 6.641 1.00 0.00 H new ATOM 0 HG22 ILE A 131 10.575 -4.953 8.148 1.00 0.00 H new ATOM 0 HG23 ILE A 131 11.319 -4.573 6.577 1.00 0.00 H new ATOM 0 HD11 ILE A 131 10.159 -7.570 3.867 1.00 0.00 H new ATOM 0 HD12 ILE A 131 9.323 -7.847 5.413 1.00 0.00 H new ATOM 0 HD13 ILE A 131 9.610 -6.186 4.842 1.00 0.00 H new ATOM 2047 N ARG A 132 12.233 -8.941 8.589 1.00 0.00 N ATOM 2048 CA ARG A 132 12.503 -10.373 8.683 1.00 0.00 C ATOM 2049 C ARG A 132 12.626 -10.944 7.282 1.00 0.00 C ATOM 2050 O ARG A 132 11.806 -10.648 6.412 1.00 0.00 O ATOM 2051 CB ARG A 132 11.409 -11.153 9.432 1.00 0.00 C ATOM 2052 CG ARG A 132 11.203 -10.745 10.878 1.00 0.00 C ATOM 2053 CD ARG A 132 10.639 -11.893 11.711 1.00 0.00 C ATOM 2054 NE ARG A 132 9.611 -12.669 11.006 1.00 0.00 N ATOM 2055 CZ ARG A 132 8.689 -13.422 11.618 1.00 0.00 C ATOM 2056 NH1 ARG A 132 8.611 -13.446 12.942 1.00 0.00 N ATOM 2057 NH2 ARG A 132 7.851 -14.163 10.904 1.00 0.00 N ATOM 0 H ARG A 132 11.375 -8.631 9.045 1.00 0.00 H new ATOM 0 HA ARG A 132 13.427 -10.483 9.250 1.00 0.00 H new ATOM 0 HB2 ARG A 132 10.467 -11.030 8.898 1.00 0.00 H new ATOM 0 HB3 ARG A 132 11.656 -12.214 9.402 1.00 0.00 H new ATOM 0 HG2 ARG A 132 12.152 -10.418 11.303 1.00 0.00 H new ATOM 0 HG3 ARG A 132 10.524 -9.894 10.923 1.00 0.00 H new ATOM 0 HD2 ARG A 132 11.453 -12.558 11.999 1.00 0.00 H new ATOM 0 HD3 ARG A 132 10.214 -11.491 12.631 1.00 0.00 H new ATOM 0 HE ARG A 132 9.599 -12.632 9.987 1.00 0.00 H new ATOM 0 HH11 ARG A 132 9.256 -12.888 13.501 1.00 0.00 H new ATOM 0 HH12 ARG A 132 7.906 -14.022 13.401 1.00 0.00 H new ATOM 0 HH21 ARG A 132 7.908 -14.160 9.886 1.00 0.00 H new ATOM 0 HH22 ARG A 132 7.150 -14.736 11.374 1.00 0.00 H new ATOM 2071 N GLU A 133 13.643 -11.757 7.062 1.00 0.00 N ATOM 2072 CA GLU A 133 13.839 -12.382 5.766 1.00 0.00 C ATOM 2073 C GLU A 133 12.658 -13.304 5.470 1.00 0.00 C ATOM 2074 O GLU A 133 12.245 -13.472 4.319 1.00 0.00 O ATOM 2075 CB GLU A 133 15.162 -13.144 5.747 1.00 0.00 C ATOM 2076 CG GLU A 133 15.608 -13.576 4.364 1.00 0.00 C ATOM 2077 CD GLU A 133 17.006 -14.141 4.376 1.00 0.00 C ATOM 2078 OE1 GLU A 133 17.163 -15.348 4.645 1.00 0.00 O ATOM 2079 OE2 GLU A 133 17.963 -13.377 4.130 1.00 0.00 O ATOM 0 H GLU A 133 14.345 -12.000 7.762 1.00 0.00 H new ATOM 0 HA GLU A 133 13.886 -11.620 4.988 1.00 0.00 H new ATOM 0 HB2 GLU A 133 15.937 -12.516 6.187 1.00 0.00 H new ATOM 0 HB3 GLU A 133 15.069 -14.027 6.379 1.00 0.00 H new ATOM 0 HG2 GLU A 133 14.917 -14.325 3.977 1.00 0.00 H new ATOM 0 HG3 GLU A 133 15.567 -12.723 3.686 1.00 0.00 H new ATOM 2086 N ASP A 134 12.113 -13.884 6.534 1.00 0.00 N ATOM 2087 CA ASP A 134 10.856 -14.622 6.461 1.00 0.00 C ATOM 2088 C ASP A 134 9.736 -13.723 5.947 1.00 0.00 C ATOM 2089 O ASP A 134 9.035 -14.072 5.001 1.00 0.00 O ATOM 2090 CB ASP A 134 10.488 -15.166 7.845 1.00 0.00 C ATOM 2091 CG ASP A 134 9.026 -15.556 7.958 1.00 0.00 C ATOM 2092 OD1 ASP A 134 8.684 -16.712 7.641 1.00 0.00 O ATOM 2093 OD2 ASP A 134 8.212 -14.701 8.368 1.00 0.00 O ATOM 0 H ASP A 134 12.527 -13.857 7.466 1.00 0.00 H new ATOM 0 HA ASP A 134 10.983 -15.454 5.768 1.00 0.00 H new ATOM 0 HB2 ASP A 134 11.108 -16.035 8.065 1.00 0.00 H new ATOM 0 HB3 ASP A 134 10.717 -14.412 8.598 1.00 0.00 H new ATOM 2098 N LEU A 135 9.599 -12.547 6.547 1.00 0.00 N ATOM 2099 CA LEU A 135 8.534 -11.615 6.181 1.00 0.00 C ATOM 2100 C LEU A 135 8.713 -11.154 4.738 1.00 0.00 C ATOM 2101 O LEU A 135 7.742 -10.973 4.004 1.00 0.00 O ATOM 2102 CB LEU A 135 8.533 -10.401 7.116 1.00 0.00 C ATOM 2103 CG LEU A 135 7.321 -9.470 6.979 1.00 0.00 C ATOM 2104 CD1 LEU A 135 6.104 -10.065 7.667 1.00 0.00 C ATOM 2105 CD2 LEU A 135 7.633 -8.095 7.545 1.00 0.00 C ATOM 0 H LEU A 135 10.212 -12.214 7.291 1.00 0.00 H new ATOM 0 HA LEU A 135 7.579 -12.131 6.278 1.00 0.00 H new ATOM 0 HB2 LEU A 135 8.584 -10.756 8.145 1.00 0.00 H new ATOM 0 HB3 LEU A 135 9.438 -9.822 6.934 1.00 0.00 H new ATOM 0 HG LEU A 135 7.096 -9.362 5.918 1.00 0.00 H new ATOM 0 HD11 LEU A 135 5.257 -9.388 7.557 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.862 -11.026 7.212 1.00 0.00 H new ATOM 0 HD13 LEU A 135 6.319 -10.209 8.726 1.00 0.00 H new ATOM 0 HD21 LEU A 135 6.760 -7.451 7.438 1.00 0.00 H new ATOM 0 HD22 LEU A 135 7.890 -8.186 8.600 1.00 0.00 H new ATOM 0 HD23 LEU A 135 8.473 -7.661 7.003 1.00 0.00 H new ATOM 2117 N ARG A 136 9.967 -10.988 4.340 1.00 0.00 N ATOM 2118 CA ARG A 136 10.311 -10.557 2.993 1.00 0.00 C ATOM 2119 C ARG A 136 9.721 -11.490 1.939 1.00 0.00 C ATOM 2120 O ARG A 136 9.125 -11.034 0.963 1.00 0.00 O ATOM 2121 CB ARG A 136 11.830 -10.498 2.848 1.00 0.00 C ATOM 2122 CG ARG A 136 12.305 -10.208 1.437 1.00 0.00 C ATOM 2123 CD ARG A 136 13.818 -10.186 1.364 1.00 0.00 C ATOM 2124 NE ARG A 136 14.393 -9.099 2.155 1.00 0.00 N ATOM 2125 CZ ARG A 136 15.620 -9.129 2.672 1.00 0.00 C ATOM 2126 NH1 ARG A 136 16.386 -10.200 2.507 1.00 0.00 N ATOM 2127 NH2 ARG A 136 16.084 -8.092 3.358 1.00 0.00 N ATOM 0 H ARG A 136 10.774 -11.149 4.942 1.00 0.00 H new ATOM 0 HA ARG A 136 9.887 -9.566 2.833 1.00 0.00 H new ATOM 0 HB2 ARG A 136 12.219 -9.730 3.516 1.00 0.00 H new ATOM 0 HB3 ARG A 136 12.253 -11.448 3.175 1.00 0.00 H new ATOM 0 HG2 ARG A 136 11.916 -10.965 0.756 1.00 0.00 H new ATOM 0 HG3 ARG A 136 11.908 -9.248 1.106 1.00 0.00 H new ATOM 0 HD2 ARG A 136 14.211 -11.139 1.719 1.00 0.00 H new ATOM 0 HD3 ARG A 136 14.128 -10.080 0.325 1.00 0.00 H new ATOM 0 HE ARG A 136 13.822 -8.270 2.320 1.00 0.00 H new ATOM 0 HH11 ARG A 136 16.035 -11.002 1.983 1.00 0.00 H new ATOM 0 HH12 ARG A 136 17.325 -10.221 2.904 1.00 0.00 H new ATOM 0 HH21 ARG A 136 15.500 -7.266 3.492 1.00 0.00 H new ATOM 0 HH22 ARG A 136 17.025 -8.121 3.752 1.00 0.00 H new ATOM 2141 N THR A 137 9.874 -12.795 2.138 1.00 0.00 N ATOM 2142 CA THR A 137 9.373 -13.758 1.169 1.00 0.00 C ATOM 2143 C THR A 137 7.842 -13.842 1.231 1.00 0.00 C ATOM 2144 O THR A 137 7.201 -14.232 0.258 1.00 0.00 O ATOM 2145 CB THR A 137 10.014 -15.160 1.352 1.00 0.00 C ATOM 2146 OG1 THR A 137 9.683 -16.016 0.247 1.00 0.00 O ATOM 2147 CG2 THR A 137 9.562 -15.822 2.643 1.00 0.00 C ATOM 0 H THR A 137 10.335 -13.204 2.951 1.00 0.00 H new ATOM 0 HA THR A 137 9.662 -13.403 0.180 1.00 0.00 H new ATOM 0 HB THR A 137 11.093 -15.013 1.395 1.00 0.00 H new ATOM 0 HG1 THR A 137 10.097 -16.895 0.379 1.00 0.00 H new ATOM 0 HG21 THR A 137 10.033 -16.801 2.734 1.00 0.00 H new ATOM 0 HG22 THR A 137 9.850 -15.201 3.491 1.00 0.00 H new ATOM 0 HG23 THR A 137 8.478 -15.940 2.631 1.00 0.00 H new ATOM 2155 N ARG A 138 7.253 -13.450 2.366 1.00 0.00 N ATOM 2156 CA ARG A 138 5.799 -13.367 2.470 1.00 0.00 C ATOM 2157 C ARG A 138 5.294 -12.183 1.652 1.00 0.00 C ATOM 2158 O ARG A 138 4.262 -12.260 0.987 1.00 0.00 O ATOM 2159 CB ARG A 138 5.362 -13.209 3.927 1.00 0.00 C ATOM 2160 CG ARG A 138 6.092 -14.130 4.884 1.00 0.00 C ATOM 2161 CD ARG A 138 5.863 -15.598 4.564 1.00 0.00 C ATOM 2162 NE ARG A 138 6.797 -16.450 5.296 1.00 0.00 N ATOM 2163 CZ ARG A 138 7.344 -17.559 4.804 1.00 0.00 C ATOM 2164 NH1 ARG A 138 6.983 -18.017 3.610 1.00 0.00 N ATOM 2165 NH2 ARG A 138 8.255 -18.205 5.513 1.00 0.00 N ATOM 0 H ARG A 138 7.757 -13.189 3.214 1.00 0.00 H new ATOM 0 HA ARG A 138 5.373 -14.292 2.082 1.00 0.00 H new ATOM 0 HB2 ARG A 138 5.524 -12.176 4.236 1.00 0.00 H new ATOM 0 HB3 ARG A 138 4.291 -13.399 3.999 1.00 0.00 H new ATOM 0 HG2 ARG A 138 7.160 -13.915 4.847 1.00 0.00 H new ATOM 0 HG3 ARG A 138 5.761 -13.927 5.903 1.00 0.00 H new ATOM 0 HD2 ARG A 138 4.840 -15.873 4.819 1.00 0.00 H new ATOM 0 HD3 ARG A 138 5.980 -15.762 3.493 1.00 0.00 H new ATOM 0 HE ARG A 138 7.046 -16.177 6.247 1.00 0.00 H new ATOM 0 HH11 ARG A 138 6.282 -17.518 3.063 1.00 0.00 H new ATOM 0 HH12 ARG A 138 7.407 -18.868 3.240 1.00 0.00 H new ATOM 0 HH21 ARG A 138 8.533 -17.852 6.429 1.00 0.00 H new ATOM 0 HH22 ARG A 138 8.680 -19.056 5.144 1.00 0.00 H new ATOM 2179 N MET A 139 6.047 -11.089 1.705 1.00 0.00 N ATOM 2180 CA MET A 139 5.754 -9.895 0.920 1.00 0.00 C ATOM 2181 C MET A 139 5.828 -10.212 -0.572 1.00 0.00 C ATOM 2182 O MET A 139 5.099 -9.640 -1.383 1.00 0.00 O ATOM 2183 CB MET A 139 6.756 -8.786 1.261 1.00 0.00 C ATOM 2184 CG MET A 139 6.703 -8.323 2.708 1.00 0.00 C ATOM 2185 SD MET A 139 5.218 -7.372 3.086 1.00 0.00 S ATOM 2186 CE MET A 139 5.481 -5.924 2.066 1.00 0.00 C ATOM 0 H MET A 139 6.877 -11.005 2.293 1.00 0.00 H new ATOM 0 HA MET A 139 4.746 -9.557 1.162 1.00 0.00 H new ATOM 0 HB2 MET A 139 7.763 -9.141 1.041 1.00 0.00 H new ATOM 0 HB3 MET A 139 6.570 -7.931 0.611 1.00 0.00 H new ATOM 0 HG2 MET A 139 6.749 -9.192 3.364 1.00 0.00 H new ATOM 0 HG3 MET A 139 7.582 -7.715 2.922 1.00 0.00 H new ATOM 0 HE1 MET A 139 4.744 -5.162 2.319 1.00 0.00 H new ATOM 0 HE2 MET A 139 6.483 -5.532 2.242 1.00 0.00 H new ATOM 0 HE3 MET A 139 5.377 -6.195 1.015 1.00 0.00 H new ATOM 2196 N ALA A 140 6.701 -11.156 -0.914 1.00 0.00 N ATOM 2197 CA ALA A 140 6.942 -11.530 -2.304 1.00 0.00 C ATOM 2198 C ALA A 140 5.808 -12.379 -2.874 1.00 0.00 C ATOM 2199 O ALA A 140 5.803 -12.687 -4.066 1.00 0.00 O ATOM 2200 CB ALA A 140 8.272 -12.262 -2.427 1.00 0.00 C ATOM 0 H ALA A 140 7.258 -11.680 -0.239 1.00 0.00 H new ATOM 0 HA ALA A 140 6.983 -10.612 -2.890 1.00 0.00 H new ATOM 0 HB1 ALA A 140 8.441 -12.536 -3.468 1.00 0.00 H new ATOM 0 HB2 ALA A 140 9.078 -11.612 -2.087 1.00 0.00 H new ATOM 0 HB3 ALA A 140 8.250 -13.163 -1.814 1.00 0.00 H new ATOM 2206 N TYR A 141 4.847 -12.751 -2.032 1.00 0.00 N ATOM 2207 CA TYR A 141 3.687 -13.507 -2.491 1.00 0.00 C ATOM 2208 C TYR A 141 2.681 -12.586 -3.174 1.00 0.00 C ATOM 2209 O TYR A 141 1.744 -13.046 -3.831 1.00 0.00 O ATOM 2210 CB TYR A 141 3.006 -14.229 -1.327 1.00 0.00 C ATOM 2211 CG TYR A 141 3.782 -15.407 -0.787 1.00 0.00 C ATOM 2212 CD1 TYR A 141 4.147 -16.462 -1.613 1.00 0.00 C ATOM 2213 CD2 TYR A 141 4.133 -15.474 0.554 1.00 0.00 C ATOM 2214 CE1 TYR A 141 4.840 -17.548 -1.116 1.00 0.00 C ATOM 2215 CE2 TYR A 141 4.829 -16.553 1.056 1.00 0.00 C ATOM 2216 CZ TYR A 141 5.179 -17.589 0.219 1.00 0.00 C ATOM 2217 OH TYR A 141 5.870 -18.668 0.716 1.00 0.00 O ATOM 0 H TYR A 141 4.849 -12.542 -1.034 1.00 0.00 H new ATOM 0 HA TYR A 141 4.040 -14.249 -3.207 1.00 0.00 H new ATOM 0 HB2 TYR A 141 2.841 -13.516 -0.519 1.00 0.00 H new ATOM 0 HB3 TYR A 141 2.025 -14.574 -1.653 1.00 0.00 H new ATOM 0 HD1 TYR A 141 3.885 -16.433 -2.660 1.00 0.00 H new ATOM 0 HD2 TYR A 141 3.856 -14.667 1.216 1.00 0.00 H new ATOM 0 HE1 TYR A 141 5.115 -18.362 -1.771 1.00 0.00 H new ATOM 0 HE2 TYR A 141 5.099 -16.586 2.101 1.00 0.00 H new ATOM 0 HH TYR A 141 6.437 -19.046 0.012 1.00 0.00 H new ATOM 2227 N CYS A 142 2.883 -11.288 -3.024 1.00 0.00 N ATOM 2228 CA CYS A 142 1.993 -10.309 -3.594 1.00 0.00 C ATOM 2229 C CYS A 142 2.455 -9.936 -4.993 1.00 0.00 C ATOM 2230 O CYS A 142 3.513 -10.377 -5.452 1.00 0.00 O ATOM 2231 CB CYS A 142 1.961 -9.068 -2.706 1.00 0.00 C ATOM 2232 SG CYS A 142 1.648 -9.432 -0.965 1.00 0.00 S ATOM 0 H CYS A 142 3.667 -10.891 -2.505 1.00 0.00 H new ATOM 0 HA CYS A 142 0.990 -10.731 -3.657 1.00 0.00 H new ATOM 0 HB2 CYS A 142 2.913 -8.544 -2.794 1.00 0.00 H new ATOM 0 HB3 CYS A 142 1.190 -8.390 -3.071 1.00 0.00 H new ATOM 0 HG CYS A 142 2.775 -9.669 -0.362 1.00 0.00 H new ATOM 2238 N LEU A 143 1.660 -9.136 -5.664 1.00 0.00 N ATOM 2239 CA LEU A 143 2.029 -8.630 -6.974 1.00 0.00 C ATOM 2240 C LEU A 143 2.843 -7.363 -6.837 1.00 0.00 C ATOM 2241 O LEU A 143 2.838 -6.718 -5.790 1.00 0.00 O ATOM 2242 CB LEU A 143 0.796 -8.365 -7.833 1.00 0.00 C ATOM 2243 CG LEU A 143 0.387 -9.524 -8.734 1.00 0.00 C ATOM 2244 CD1 LEU A 143 -1.012 -9.311 -9.295 1.00 0.00 C ATOM 2245 CD2 LEU A 143 1.391 -9.696 -9.864 1.00 0.00 C ATOM 0 H LEU A 143 0.751 -8.819 -5.327 1.00 0.00 H new ATOM 0 HA LEU A 143 2.631 -9.392 -7.468 1.00 0.00 H new ATOM 0 HB2 LEU A 143 -0.040 -8.119 -7.178 1.00 0.00 H new ATOM 0 HB3 LEU A 143 0.984 -7.489 -8.454 1.00 0.00 H new ATOM 0 HG LEU A 143 0.376 -10.433 -8.133 1.00 0.00 H new ATOM 0 HD11 LEU A 143 -1.280 -10.152 -9.935 1.00 0.00 H new ATOM 0 HD12 LEU A 143 -1.726 -9.238 -8.474 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -1.034 -8.390 -9.878 1.00 0.00 H new ATOM 0 HD21 LEU A 143 1.085 -10.528 -10.499 1.00 0.00 H new ATOM 0 HD22 LEU A 143 1.431 -8.782 -10.457 1.00 0.00 H new ATOM 0 HD23 LEU A 143 2.377 -9.901 -9.447 1.00 0.00 H new ATOM 2257 N VAL A 144 3.527 -7.005 -7.902 1.00 0.00 N ATOM 2258 CA VAL A 144 4.399 -5.841 -7.887 1.00 0.00 C ATOM 2259 C VAL A 144 4.119 -4.950 -9.089 1.00 0.00 C ATOM 2260 O VAL A 144 4.318 -5.360 -10.234 1.00 0.00 O ATOM 2261 CB VAL A 144 5.890 -6.252 -7.893 1.00 0.00 C ATOM 2262 CG1 VAL A 144 6.787 -5.026 -7.832 1.00 0.00 C ATOM 2263 CG2 VAL A 144 6.204 -7.191 -6.739 1.00 0.00 C ATOM 0 H VAL A 144 3.499 -7.501 -8.793 1.00 0.00 H new ATOM 0 HA VAL A 144 4.193 -5.292 -6.968 1.00 0.00 H new ATOM 0 HB VAL A 144 6.085 -6.780 -8.826 1.00 0.00 H new ATOM 0 HG11 VAL A 144 7.831 -5.339 -7.837 1.00 0.00 H new ATOM 0 HG12 VAL A 144 6.594 -4.391 -8.696 1.00 0.00 H new ATOM 0 HG13 VAL A 144 6.580 -4.469 -6.919 1.00 0.00 H new ATOM 0 HG21 VAL A 144 7.259 -7.463 -6.768 1.00 0.00 H new ATOM 0 HG22 VAL A 144 5.984 -6.693 -5.795 1.00 0.00 H new ATOM 0 HG23 VAL A 144 5.595 -8.091 -6.826 1.00 0.00 H new ATOM 2273 N TYR A 145 3.656 -3.737 -8.823 1.00 0.00 N ATOM 2274 CA TYR A 145 3.378 -2.777 -9.881 1.00 0.00 C ATOM 2275 C TYR A 145 4.415 -1.664 -9.872 1.00 0.00 C ATOM 2276 O TYR A 145 4.887 -1.251 -8.811 1.00 0.00 O ATOM 2277 CB TYR A 145 1.980 -2.161 -9.721 1.00 0.00 C ATOM 2278 CG TYR A 145 0.828 -3.122 -9.948 1.00 0.00 C ATOM 2279 CD1 TYR A 145 0.987 -4.284 -10.693 1.00 0.00 C ATOM 2280 CD2 TYR A 145 -0.428 -2.852 -9.417 1.00 0.00 C ATOM 2281 CE1 TYR A 145 -0.070 -5.149 -10.900 1.00 0.00 C ATOM 2282 CE2 TYR A 145 -1.490 -3.711 -9.622 1.00 0.00 C ATOM 2283 CZ TYR A 145 -1.305 -4.857 -10.363 1.00 0.00 C ATOM 2284 OH TYR A 145 -2.364 -5.709 -10.576 1.00 0.00 O ATOM 0 H TYR A 145 3.465 -3.394 -7.882 1.00 0.00 H new ATOM 0 HA TYR A 145 3.420 -3.313 -10.829 1.00 0.00 H new ATOM 0 HB2 TYR A 145 1.895 -1.746 -8.717 1.00 0.00 H new ATOM 0 HB3 TYR A 145 1.883 -1.330 -10.419 1.00 0.00 H new ATOM 0 HD1 TYR A 145 1.953 -4.515 -11.117 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -0.576 -1.955 -8.834 1.00 0.00 H new ATOM 0 HE1 TYR A 145 0.071 -6.049 -11.480 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -2.460 -3.485 -9.204 1.00 0.00 H new ATOM 0 HH TYR A 145 -3.162 -5.358 -10.128 1.00 0.00 H new ATOM 2294 N GLU A 146 4.770 -1.186 -11.056 1.00 0.00 N ATOM 2295 CA GLU A 146 5.696 -0.072 -11.180 1.00 0.00 C ATOM 2296 C GLU A 146 4.928 1.186 -11.570 1.00 0.00 C ATOM 2297 O GLU A 146 4.347 1.261 -12.651 1.00 0.00 O ATOM 2298 CB GLU A 146 6.774 -0.383 -12.219 1.00 0.00 C ATOM 2299 CG GLU A 146 7.907 0.625 -12.232 1.00 0.00 C ATOM 2300 CD GLU A 146 8.956 0.308 -13.274 1.00 0.00 C ATOM 2301 OE1 GLU A 146 9.176 -0.886 -13.554 1.00 0.00 O ATOM 2302 OE2 GLU A 146 9.552 1.254 -13.827 1.00 0.00 O ATOM 0 H GLU A 146 4.430 -1.553 -11.945 1.00 0.00 H new ATOM 0 HA GLU A 146 6.188 0.091 -10.221 1.00 0.00 H new ATOM 0 HB2 GLU A 146 7.182 -1.375 -12.023 1.00 0.00 H new ATOM 0 HB3 GLU A 146 6.316 -0.417 -13.208 1.00 0.00 H new ATOM 0 HG2 GLU A 146 7.502 1.619 -12.421 1.00 0.00 H new ATOM 0 HG3 GLU A 146 8.375 0.653 -11.248 1.00 0.00 H new