USER MOD reduce.3.24.130724 H: found=0, std=0, add=1347, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1170 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 637 GLN : amide:sc= -2.28 K(o=-6.4,f=-3.1) USER MOD Set 1.2: B 641 GLN : amide:sc= -2.72 K(o=-6.4,f=-3.7!) USER MOD Set 1.3: B 656 GLN : amide:sc= -1.38 K(o=-6.4,f=-4.6!) USER MOD Set 2.1: A 75 ASN : amide:sc= -1.57 X(o=-2.4,f=-2.4) USER MOD Set 2.2: B 648 THR OG1 : rot -75:sc= -0.798 USER MOD Set 3.1: A 66 ASN : amide:sc= -0.589 X(o=0.66,f=1.1) USER MOD Set 3.2: A 67 THR OG1 : rot 91:sc= 1.24 USER MOD Set 4.1: A 55 HIS : no HD1:sc= -0.665 K(o=-0.66,f=-0.11) USER MOD Set 4.2: B 673 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 25 MET CE :methyl -176:sc= -2.38! (180deg=-2.51!) USER MOD Set 5.2: B 663 MET CE :methyl -124:sc= -1.1 (180deg=-1.83) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 143:sc= 0.0564 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.317 USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 10 GLN : amide:sc= 0.179 X(o=0.18,f=0) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= -0.0273 K(o=-0.027,f=-1.2) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 140:sc= 0.00126 (180deg=-0.507) USER MOD Single : A 27 HIS : no HD1:sc= -1.18 K(o=-1.2,f=-0.48) USER MOD Single : A 28 THR OG1 : rot -117:sc= -1.59! USER MOD Single : A 31 GLN : amide:sc= -0.152 X(o=-0.15,f=-0.15) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 HIS : no HE2:sc= 0.292 K(o=0.29,f=-1.2) USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 44:sc= -0.0394 USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=-0.034) USER MOD Single : A 64 LYS NZ :NH3+ -167:sc= -0.0871 (180deg=-0.464) USER MOD Single : A 73 GLN : amide:sc= 0 K(o=0,f=0.54) USER MOD Single : A 82 THR OG1 : rot 180:sc= -0.15 USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 84:sc= 0.0295 USER MOD Single : A 93 THR OG1 : rot -92:sc= -0.121 USER MOD Single : A 94 TYR OH : rot 29:sc= 0.225 USER MOD Single : A 95 THR OG1 : rot 65:sc= 0.583 USER MOD Single : B 601 SER OG : rot -55:sc= 0.0606 USER MOD Single : B 602 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 603 SER OG : rot 180:sc= 0 USER MOD Single : B 604 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 606 MET CE :methyl -164:sc=-0.00643 (180deg=-0.408) USER MOD Single : B 607 TYR OH : rot 180:sc= 0 USER MOD Single : B 608 ASN : amide:sc= 0 X(o=0,f=-0.071) USER MOD Single : B 609 TYR OH : rot 180:sc= 0 USER MOD Single : B 612 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 615 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 619 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 622 TYR OH : rot 180:sc= 0 USER MOD Single : B 625 THR OG1 : rot 180:sc= 0 USER MOD Single : B 627 GLN : amide:sc= -0.0963 K(o=-0.096,f=-1.7!) USER MOD Single : B 628 SER OG : rot 180:sc= 0 USER MOD Single : B 642 SER OG : rot 180:sc= 0 USER MOD Single : B 645 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 651 THR OG1 : rot 180:sc= 0 USER MOD Single : B 652 TYR OH : rot 180:sc= 0 USER MOD Single : B 653 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : B 658 GLN : amide:sc= -1.75 K(o=-1.7,f=-2.4) USER MOD Single : B 660 ASN : amide:sc= -0.233 X(o=-0.23,f=0) USER MOD Single : B 661 GLN : amide:sc= -0.0145 X(o=-0.015,f=-0.23) USER MOD Single : B 670 TYR OH : rot -155:sc= 1.24 USER MOD Single : B 671 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 674 SER OG : rot 170:sc= 0 USER MOD Single : B 675 SER OG : rot 75:sc= 0.146 USER MOD Single : B 676 THR OG1 : rot 180:sc= 0.109 USER MOD Single : B 677 HIS : no HD1:sc= -0.783 K(o=-0.78,f=-1.7!) USER MOD Single : B 680 ASN : amide:sc= -0.68 K(o=-0.68,f=-0.17) USER MOD Single : B 681 THR OG1 : rot 180:sc= 0.0657 USER MOD Single : B 682 MET CE :methyl -156:sc= -5.35! (180deg=-6.26!) USER MOD Single : B 684 MET CE :methyl -148:sc= 0 (180deg=-0.0584) USER MOD Single : B 685 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 689 THR OG1 : rot 180:sc= 0.0654 USER MOD Single : B 694 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 10.169 -12.212 8.249 1.00 0.00 N ATOM 2 CA MET A 1 11.583 -12.106 8.587 1.00 0.00 C ATOM 3 C MET A 1 11.844 -12.614 10.003 1.00 0.00 C ATOM 4 O MET A 1 10.946 -12.621 10.844 1.00 0.00 O ATOM 5 CB MET A 1 12.053 -10.655 8.460 1.00 0.00 C ATOM 6 CG MET A 1 12.743 -10.353 7.139 1.00 0.00 C ATOM 7 SD MET A 1 14.047 -9.119 7.303 1.00 0.00 S ATOM 8 CE MET A 1 14.866 -9.279 5.717 1.00 0.00 C ATOM 0 H1 MET A 1 9.888 -11.394 7.672 1.00 0.00 H new ATOM 0 H2 MET A 1 10.005 -13.087 7.711 1.00 0.00 H new ATOM 0 H3 MET A 1 9.604 -12.231 9.122 1.00 0.00 H new ATOM 0 HA MET A 1 12.145 -12.725 7.888 1.00 0.00 H new ATOM 0 HB2 MET A 1 11.195 -9.993 8.572 1.00 0.00 H new ATOM 0 HB3 MET A 1 12.738 -10.431 9.278 1.00 0.00 H new ATOM 0 HG2 MET A 1 13.167 -11.273 6.736 1.00 0.00 H new ATOM 0 HG3 MET A 1 12.004 -10.001 6.419 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.699 -8.578 5.665 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.241 -10.296 5.602 1.00 0.00 H new ATOM 0 HE3 MET A 1 14.157 -9.061 4.918 1.00 0.00 H new ATOM 16 N SER A 2 13.078 -13.039 10.256 1.00 0.00 N ATOM 17 CA SER A 2 13.455 -13.553 11.567 1.00 0.00 C ATOM 18 C SER A 2 12.589 -14.749 11.952 1.00 0.00 C ATOM 19 O SER A 2 12.378 -15.023 13.134 1.00 0.00 O ATOM 20 CB SER A 2 13.326 -12.455 12.625 1.00 0.00 C ATOM 21 OG SER A 2 13.245 -11.175 12.024 1.00 0.00 O ATOM 0 H SER A 2 13.833 -13.037 9.570 1.00 0.00 H new ATOM 0 HA SER A 2 14.494 -13.880 11.516 1.00 0.00 H new ATOM 0 HB2 SER A 2 12.438 -12.632 13.231 1.00 0.00 H new ATOM 0 HB3 SER A 2 14.183 -12.491 13.297 1.00 0.00 H new ATOM 0 HG SER A 2 13.161 -10.491 12.721 1.00 0.00 H new ATOM 26 N LEU A 3 12.089 -15.457 10.945 1.00 0.00 N ATOM 27 CA LEU A 3 11.245 -16.624 11.174 1.00 0.00 C ATOM 28 C LEU A 3 12.086 -17.894 11.269 1.00 0.00 C ATOM 29 O LEU A 3 13.143 -17.998 10.646 1.00 0.00 O ATOM 30 CB LEU A 3 10.215 -16.763 10.052 1.00 0.00 C ATOM 31 CG LEU A 3 8.747 -16.707 10.478 1.00 0.00 C ATOM 32 CD1 LEU A 3 7.858 -16.388 9.286 1.00 0.00 C ATOM 33 CD2 LEU A 3 8.329 -18.020 11.122 1.00 0.00 C ATOM 0 H LEU A 3 12.254 -15.243 9.961 1.00 0.00 H new ATOM 0 HA LEU A 3 10.723 -16.484 12.121 1.00 0.00 H new ATOM 0 HB2 LEU A 3 10.392 -15.972 9.324 1.00 0.00 H new ATOM 0 HB3 LEU A 3 10.389 -17.710 9.542 1.00 0.00 H new ATOM 0 HG LEU A 3 8.631 -15.912 11.214 1.00 0.00 H new ATOM 0 HD11 LEU A 3 6.817 -16.352 9.608 1.00 0.00 H new ATOM 0 HD12 LEU A 3 8.142 -15.422 8.868 1.00 0.00 H new ATOM 0 HD13 LEU A 3 7.977 -17.161 8.526 1.00 0.00 H new ATOM 0 HD21 LEU A 3 7.282 -17.962 11.419 1.00 0.00 H new ATOM 0 HD22 LEU A 3 8.460 -18.833 10.408 1.00 0.00 H new ATOM 0 HD23 LEU A 3 8.946 -18.207 12.001 1.00 0.00 H new ATOM 44 N LEU A 4 11.608 -18.857 12.050 1.00 0.00 N ATOM 45 CA LEU A 4 12.315 -20.121 12.223 1.00 0.00 C ATOM 46 C LEU A 4 11.516 -21.277 11.629 1.00 0.00 C ATOM 47 O LEU A 4 10.406 -21.087 11.131 1.00 0.00 O ATOM 48 CB LEU A 4 12.580 -20.380 13.707 1.00 0.00 C ATOM 49 CG LEU A 4 13.930 -19.900 14.241 1.00 0.00 C ATOM 50 CD1 LEU A 4 13.857 -19.662 15.741 1.00 0.00 C ATOM 51 CD2 LEU A 4 15.022 -20.908 13.912 1.00 0.00 C ATOM 0 H LEU A 4 10.735 -18.787 12.573 1.00 0.00 H new ATOM 0 HA LEU A 4 13.267 -20.052 11.696 1.00 0.00 H new ATOM 0 HB2 LEU A 4 11.791 -19.899 14.286 1.00 0.00 H new ATOM 0 HB3 LEU A 4 12.500 -21.452 13.888 1.00 0.00 H new ATOM 0 HG LEU A 4 14.176 -18.955 13.756 1.00 0.00 H new ATOM 0 HD11 LEU A 4 14.827 -19.321 16.103 1.00 0.00 H new ATOM 0 HD12 LEU A 4 13.103 -18.903 15.953 1.00 0.00 H new ATOM 0 HD13 LEU A 4 13.588 -20.591 16.244 1.00 0.00 H new ATOM 0 HD21 LEU A 4 15.976 -20.550 14.299 1.00 0.00 H new ATOM 0 HD22 LEU A 4 14.781 -21.868 14.370 1.00 0.00 H new ATOM 0 HD23 LEU A 4 15.092 -21.029 12.831 1.00 0.00 H new ATOM 62 N ASP A 5 12.087 -22.475 11.687 1.00 0.00 N ATOM 63 CA ASP A 5 11.427 -23.663 11.157 1.00 0.00 C ATOM 64 C ASP A 5 11.463 -24.802 12.171 1.00 0.00 C ATOM 65 O ASP A 5 11.622 -25.967 11.806 1.00 0.00 O ATOM 66 CB ASP A 5 12.092 -24.103 9.853 1.00 0.00 C ATOM 67 CG ASP A 5 11.647 -23.270 8.667 1.00 0.00 C ATOM 68 OD1 ASP A 5 10.548 -23.534 8.136 1.00 0.00 O ATOM 69 OD2 ASP A 5 12.399 -22.356 8.268 1.00 0.00 O ATOM 0 H ASP A 5 13.005 -22.649 12.096 1.00 0.00 H new ATOM 0 HA ASP A 5 10.385 -23.411 10.957 1.00 0.00 H new ATOM 0 HB2 ASP A 5 13.175 -24.031 9.958 1.00 0.00 H new ATOM 0 HB3 ASP A 5 11.859 -25.151 9.665 1.00 0.00 H new ATOM 73 N ALA A 6 11.316 -24.459 13.446 1.00 0.00 N ATOM 74 CA ALA A 6 11.332 -25.451 14.513 1.00 0.00 C ATOM 75 C ALA A 6 9.947 -25.616 15.131 1.00 0.00 C ATOM 76 O ALA A 6 9.384 -26.711 15.134 1.00 0.00 O ATOM 77 CB ALA A 6 12.345 -25.064 15.580 1.00 0.00 C ATOM 0 H ALA A 6 11.184 -23.499 13.765 1.00 0.00 H new ATOM 0 HA ALA A 6 11.625 -26.408 14.080 1.00 0.00 H new ATOM 0 HB1 ALA A 6 12.346 -25.815 16.370 1.00 0.00 H new ATOM 0 HB2 ALA A 6 13.338 -25.005 15.135 1.00 0.00 H new ATOM 0 HB3 ALA A 6 12.078 -24.094 16.000 1.00 0.00 H new ATOM 83 N HIS A 7 9.404 -24.522 15.653 1.00 0.00 N ATOM 84 CA HIS A 7 8.084 -24.545 16.273 1.00 0.00 C ATOM 85 C HIS A 7 7.264 -23.328 15.854 1.00 0.00 C ATOM 86 O HIS A 7 7.079 -22.394 16.633 1.00 0.00 O ATOM 87 CB HIS A 7 8.215 -24.584 17.797 1.00 0.00 C ATOM 88 CG HIS A 7 8.699 -25.900 18.323 1.00 0.00 C ATOM 89 ND1 HIS A 7 10.028 -26.268 18.320 1.00 0.00 N ATOM 90 CD2 HIS A 7 8.024 -26.938 18.870 1.00 0.00 C ATOM 91 CE1 HIS A 7 10.149 -27.475 18.842 1.00 0.00 C ATOM 92 NE2 HIS A 7 8.948 -27.904 19.186 1.00 0.00 N ATOM 0 H HIS A 7 9.857 -23.608 15.659 1.00 0.00 H new ATOM 0 HA HIS A 7 7.567 -25.443 15.935 1.00 0.00 H new ATOM 0 HB2 HIS A 7 8.903 -23.800 18.115 1.00 0.00 H new ATOM 0 HB3 HIS A 7 7.246 -24.358 18.243 1.00 0.00 H new ATOM 0 HD2 HIS A 7 6.957 -26.996 19.029 1.00 0.00 H new ATOM 0 HE1 HIS A 7 11.073 -28.019 18.967 1.00 0.00 H new ATOM 0 HE2 HIS A 7 8.741 -28.805 19.616 1.00 0.00 H new ATOM 99 N ILE A 8 6.778 -23.348 14.617 1.00 0.00 N ATOM 100 CA ILE A 8 5.978 -22.247 14.094 1.00 0.00 C ATOM 101 C ILE A 8 4.587 -22.723 13.687 1.00 0.00 C ATOM 102 O ILE A 8 4.381 -23.883 13.329 1.00 0.00 O ATOM 103 CB ILE A 8 6.657 -21.585 12.880 1.00 0.00 C ATOM 104 CG1 ILE A 8 6.658 -22.540 11.685 1.00 0.00 C ATOM 105 CG2 ILE A 8 8.077 -21.165 13.232 1.00 0.00 C ATOM 106 CD1 ILE A 8 7.343 -21.975 10.461 1.00 0.00 C ATOM 0 H ILE A 8 6.924 -24.114 13.959 1.00 0.00 H new ATOM 0 HA ILE A 8 5.889 -21.513 14.895 1.00 0.00 H new ATOM 0 HB ILE A 8 6.092 -20.693 12.607 1.00 0.00 H new ATOM 0 HG12 ILE A 8 7.152 -23.468 11.972 1.00 0.00 H new ATOM 0 HG13 ILE A 8 5.629 -22.793 11.431 1.00 0.00 H new ATOM 0 HG21 ILE A 8 8.544 -20.699 12.365 1.00 0.00 H new ATOM 0 HG22 ILE A 8 8.052 -20.453 14.057 1.00 0.00 H new ATOM 0 HG23 ILE A 8 8.653 -22.042 13.527 1.00 0.00 H new ATOM 0 HD11 ILE A 8 7.306 -22.706 9.653 1.00 0.00 H new ATOM 0 HD12 ILE A 8 6.835 -21.063 10.148 1.00 0.00 H new ATOM 0 HD13 ILE A 8 8.383 -21.749 10.698 1.00 0.00 H new ATOM 117 N PRO A 9 3.609 -21.807 13.742 1.00 0.00 N ATOM 118 CA PRO A 9 2.220 -22.109 13.380 1.00 0.00 C ATOM 119 C PRO A 9 2.050 -22.345 11.884 1.00 0.00 C ATOM 120 O PRO A 9 1.611 -21.458 11.152 1.00 0.00 O ATOM 121 CB PRO A 9 1.460 -20.852 13.813 1.00 0.00 C ATOM 122 CG PRO A 9 2.477 -19.764 13.780 1.00 0.00 C ATOM 123 CD PRO A 9 3.783 -20.406 14.159 1.00 0.00 C ATOM 0 HA PRO A 9 1.864 -23.024 13.854 1.00 0.00 H new ATOM 0 HB2 PRO A 9 0.630 -20.639 13.139 1.00 0.00 H new ATOM 0 HB3 PRO A 9 1.038 -20.969 14.811 1.00 0.00 H new ATOM 0 HG2 PRO A 9 2.536 -19.315 12.788 1.00 0.00 H new ATOM 0 HG3 PRO A 9 2.218 -18.966 14.476 1.00 0.00 H new ATOM 0 HD2 PRO A 9 4.624 -19.937 13.649 1.00 0.00 H new ATOM 0 HD3 PRO A 9 3.974 -20.326 15.229 1.00 0.00 H new ATOM 128 N GLN A 10 2.399 -23.547 11.436 1.00 0.00 N ATOM 129 CA GLN A 10 2.283 -23.899 10.025 1.00 0.00 C ATOM 130 C GLN A 10 0.831 -24.173 9.649 1.00 0.00 C ATOM 131 O GLN A 10 0.385 -23.823 8.556 1.00 0.00 O ATOM 132 CB GLN A 10 3.142 -25.126 9.713 1.00 0.00 C ATOM 133 CG GLN A 10 2.773 -26.352 10.530 1.00 0.00 C ATOM 134 CD GLN A 10 3.986 -27.142 10.978 1.00 0.00 C ATOM 135 OE1 GLN A 10 4.143 -28.313 10.628 1.00 0.00 O ATOM 136 NE2 GLN A 10 4.854 -26.505 11.757 1.00 0.00 N ATOM 0 H GLN A 10 2.764 -24.293 12.029 1.00 0.00 H new ATOM 0 HA GLN A 10 2.638 -23.054 9.435 1.00 0.00 H new ATOM 0 HB2 GLN A 10 3.048 -25.364 8.654 1.00 0.00 H new ATOM 0 HB3 GLN A 10 4.189 -24.881 9.893 1.00 0.00 H new ATOM 0 HG2 GLN A 10 2.203 -26.042 11.406 1.00 0.00 H new ATOM 0 HG3 GLN A 10 2.123 -26.996 9.938 1.00 0.00 H new ATOM 0 HE21 GLN A 10 4.685 -25.535 12.023 1.00 0.00 H new ATOM 0 HE22 GLN A 10 5.690 -26.986 12.089 1.00 0.00 H new ATOM 143 N LEU A 11 0.096 -24.799 10.562 1.00 0.00 N ATOM 144 CA LEU A 11 -1.307 -25.119 10.327 1.00 0.00 C ATOM 145 C LEU A 11 -2.162 -24.739 11.531 1.00 0.00 C ATOM 146 O LEU A 11 -2.549 -25.596 12.326 1.00 0.00 O ATOM 147 CB LEU A 11 -1.466 -26.611 10.024 1.00 0.00 C ATOM 148 CG LEU A 11 -1.473 -26.998 8.545 1.00 0.00 C ATOM 149 CD1 LEU A 11 -2.642 -26.341 7.826 1.00 0.00 C ATOM 150 CD2 LEU A 11 -0.156 -26.614 7.887 1.00 0.00 C ATOM 0 H LEU A 11 0.449 -25.095 11.472 1.00 0.00 H new ATOM 0 HA LEU A 11 -1.647 -24.541 9.467 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -0.656 -27.150 10.516 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -2.397 -26.955 10.474 1.00 0.00 H new ATOM 0 HG LEU A 11 -1.591 -28.079 8.473 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -2.630 -26.628 6.775 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -3.578 -26.666 8.281 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -2.556 -25.257 7.907 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -0.179 -26.897 6.835 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -0.008 -25.537 7.970 1.00 0.00 H new ATOM 0 HD23 LEU A 11 0.664 -27.132 8.384 1.00 0.00 H new ATOM 161 N VAL A 12 -2.456 -23.449 11.659 1.00 0.00 N ATOM 162 CA VAL A 12 -3.268 -22.955 12.764 1.00 0.00 C ATOM 163 C VAL A 12 -4.430 -22.109 12.257 1.00 0.00 C ATOM 164 O VAL A 12 -5.545 -22.195 12.770 1.00 0.00 O ATOM 165 CB VAL A 12 -2.429 -22.119 13.748 1.00 0.00 C ATOM 166 CG1 VAL A 12 -3.278 -21.669 14.927 1.00 0.00 C ATOM 167 CG2 VAL A 12 -1.220 -22.912 14.223 1.00 0.00 C ATOM 0 H VAL A 12 -2.143 -22.727 11.010 1.00 0.00 H new ATOM 0 HA VAL A 12 -3.659 -23.829 13.284 1.00 0.00 H new ATOM 0 HB VAL A 12 -2.072 -21.230 13.229 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -2.667 -21.080 15.611 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -4.108 -21.062 14.567 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -3.668 -22.543 15.449 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -0.638 -22.307 14.918 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -1.555 -23.820 14.725 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -0.600 -23.178 13.367 1.00 0.00 H new ATOM 177 N ALA A 13 -4.160 -21.289 11.246 1.00 0.00 N ATOM 178 CA ALA A 13 -5.184 -20.428 10.667 1.00 0.00 C ATOM 179 C ALA A 13 -5.489 -20.828 9.228 1.00 0.00 C ATOM 180 O ALA A 13 -5.770 -19.978 8.383 1.00 0.00 O ATOM 181 CB ALA A 13 -4.745 -18.971 10.730 1.00 0.00 C ATOM 0 H ALA A 13 -3.241 -21.203 10.811 1.00 0.00 H new ATOM 0 HA ALA A 13 -6.097 -20.548 11.251 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -5.519 -18.339 10.294 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -4.584 -18.684 11.769 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -3.817 -18.846 10.172 1.00 0.00 H new ATOM 187 N SER A 14 -5.430 -22.128 8.955 1.00 0.00 N ATOM 188 CA SER A 14 -5.696 -22.640 7.616 1.00 0.00 C ATOM 189 C SER A 14 -7.067 -22.187 7.123 1.00 0.00 C ATOM 190 O SER A 14 -7.286 -22.035 5.921 1.00 0.00 O ATOM 191 CB SER A 14 -5.618 -24.168 7.607 1.00 0.00 C ATOM 192 OG SER A 14 -6.898 -24.745 7.790 1.00 0.00 O ATOM 0 H SER A 14 -5.200 -22.845 9.643 1.00 0.00 H new ATOM 0 HA SER A 14 -4.937 -22.240 6.944 1.00 0.00 H new ATOM 0 HB2 SER A 14 -5.194 -24.508 6.662 1.00 0.00 H new ATOM 0 HB3 SER A 14 -4.947 -24.506 8.397 1.00 0.00 H new ATOM 0 HG SER A 14 -6.821 -25.722 7.779 1.00 0.00 H new ATOM 197 N GLN A 15 -7.985 -21.974 8.060 1.00 0.00 N ATOM 198 CA GLN A 15 -9.335 -21.539 7.721 1.00 0.00 C ATOM 199 C GLN A 15 -9.302 -20.269 6.877 1.00 0.00 C ATOM 200 O GLN A 15 -9.871 -20.222 5.787 1.00 0.00 O ATOM 201 CB GLN A 15 -10.150 -21.300 8.994 1.00 0.00 C ATOM 202 CG GLN A 15 -11.040 -22.471 9.375 1.00 0.00 C ATOM 203 CD GLN A 15 -12.242 -22.614 8.462 1.00 0.00 C ATOM 204 OE1 GLN A 15 -12.454 -21.798 7.564 1.00 0.00 O ATOM 205 NE2 GLN A 15 -13.038 -23.653 8.687 1.00 0.00 N ATOM 0 H GLN A 15 -7.819 -22.095 9.059 1.00 0.00 H new ATOM 0 HA GLN A 15 -9.809 -22.328 7.137 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -9.468 -21.090 9.818 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -10.769 -20.413 8.858 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -10.456 -23.391 9.346 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -11.382 -22.343 10.402 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -12.825 -24.305 9.442 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -13.863 -23.799 8.105 1.00 0.00 H new ATOM 212 N SER A 16 -8.633 -19.241 7.389 1.00 0.00 N ATOM 213 CA SER A 16 -8.530 -17.969 6.684 1.00 0.00 C ATOM 214 C SER A 16 -7.626 -17.001 7.442 1.00 0.00 C ATOM 215 O SER A 16 -8.023 -16.426 8.455 1.00 0.00 O ATOM 216 CB SER A 16 -9.916 -17.350 6.500 1.00 0.00 C ATOM 217 OG SER A 16 -10.175 -17.077 5.133 1.00 0.00 O ATOM 0 H SER A 16 -8.154 -19.264 8.289 1.00 0.00 H new ATOM 0 HA SER A 16 -8.092 -18.159 5.704 1.00 0.00 H new ATOM 0 HB2 SER A 16 -10.675 -18.028 6.889 1.00 0.00 H new ATOM 0 HB3 SER A 16 -9.986 -16.428 7.078 1.00 0.00 H new ATOM 0 HG SER A 16 -11.068 -16.683 5.041 1.00 0.00 H new ATOM 222 N ALA A 17 -6.407 -16.824 6.941 1.00 0.00 N ATOM 223 CA ALA A 17 -5.447 -15.925 7.566 1.00 0.00 C ATOM 224 C ALA A 17 -5.171 -14.714 6.682 1.00 0.00 C ATOM 225 O ALA A 17 -4.878 -13.625 7.177 1.00 0.00 O ATOM 226 CB ALA A 17 -4.152 -16.664 7.871 1.00 0.00 C ATOM 0 H ALA A 17 -6.062 -17.292 6.103 1.00 0.00 H new ATOM 0 HA ALA A 17 -5.878 -15.568 8.501 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -3.444 -15.980 8.338 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.357 -17.492 8.549 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -3.727 -17.050 6.945 1.00 0.00 H new ATOM 232 N PHE A 18 -5.268 -14.910 5.371 1.00 0.00 N ATOM 233 CA PHE A 18 -5.027 -13.834 4.418 1.00 0.00 C ATOM 234 C PHE A 18 -6.152 -12.804 4.464 1.00 0.00 C ATOM 235 O PHE A 18 -5.906 -11.605 4.590 1.00 0.00 O ATOM 236 CB PHE A 18 -4.896 -14.398 3.001 1.00 0.00 C ATOM 237 CG PHE A 18 -4.231 -13.456 2.039 1.00 0.00 C ATOM 238 CD1 PHE A 18 -2.848 -13.394 1.953 1.00 0.00 C ATOM 239 CD2 PHE A 18 -4.986 -12.631 1.223 1.00 0.00 C ATOM 240 CE1 PHE A 18 -2.233 -12.529 1.069 1.00 0.00 C ATOM 241 CE2 PHE A 18 -4.376 -11.763 0.336 1.00 0.00 C ATOM 242 CZ PHE A 18 -2.998 -11.711 0.259 1.00 0.00 C ATOM 0 H PHE A 18 -5.512 -15.804 4.945 1.00 0.00 H new ATOM 0 HA PHE A 18 -4.095 -13.341 4.694 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.327 -15.327 3.040 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -5.888 -14.648 2.625 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -2.245 -14.029 2.585 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -6.064 -12.666 1.280 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -1.155 -12.492 1.011 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -4.977 -11.126 -0.296 1.00 0.00 H new ATOM 0 HZ PHE A 18 -2.520 -11.033 -0.432 1.00 0.00 H new ATOM 251 N ALA A 19 -7.388 -13.282 4.361 1.00 0.00 N ATOM 252 CA ALA A 19 -8.551 -12.405 4.392 1.00 0.00 C ATOM 253 C ALA A 19 -8.564 -11.555 5.658 1.00 0.00 C ATOM 254 O ALA A 19 -9.015 -10.410 5.644 1.00 0.00 O ATOM 255 CB ALA A 19 -9.831 -13.222 4.291 1.00 0.00 C ATOM 0 H ALA A 19 -7.609 -14.272 4.255 1.00 0.00 H new ATOM 0 HA ALA A 19 -8.492 -11.734 3.535 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -10.692 -12.554 4.315 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -9.832 -13.782 3.356 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -9.887 -13.916 5.129 1.00 0.00 H new ATOM 261 N ALA A 20 -8.065 -12.122 6.752 1.00 0.00 N ATOM 262 CA ALA A 20 -8.018 -11.415 8.025 1.00 0.00 C ATOM 263 C ALA A 20 -7.207 -10.129 7.910 1.00 0.00 C ATOM 264 O ALA A 20 -7.615 -9.078 8.407 1.00 0.00 O ATOM 265 CB ALA A 20 -7.435 -12.314 9.107 1.00 0.00 C ATOM 0 H ALA A 20 -7.688 -13.069 6.781 1.00 0.00 H new ATOM 0 HA ALA A 20 -9.038 -11.147 8.301 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -7.406 -11.773 10.053 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -8.057 -13.202 9.216 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -6.424 -12.611 8.828 1.00 0.00 H new ATOM 271 N LYS A 21 -6.056 -10.219 7.252 1.00 0.00 N ATOM 272 CA LYS A 21 -5.187 -9.062 7.070 1.00 0.00 C ATOM 273 C LYS A 21 -5.754 -8.115 6.017 1.00 0.00 C ATOM 274 O LYS A 21 -5.598 -6.898 6.114 1.00 0.00 O ATOM 275 CB LYS A 21 -3.783 -9.512 6.662 1.00 0.00 C ATOM 276 CG LYS A 21 -3.181 -10.550 7.594 1.00 0.00 C ATOM 277 CD LYS A 21 -1.750 -10.202 7.966 1.00 0.00 C ATOM 278 CE LYS A 21 -1.697 -9.114 9.027 1.00 0.00 C ATOM 279 NZ LYS A 21 -0.637 -9.377 10.040 1.00 0.00 N ATOM 0 H LYS A 21 -5.703 -11.081 6.836 1.00 0.00 H new ATOM 0 HA LYS A 21 -5.130 -8.530 8.019 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -3.821 -9.921 5.652 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -3.127 -8.642 6.629 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -3.786 -10.623 8.498 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -3.206 -11.529 7.115 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -1.241 -11.094 8.333 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -1.212 -9.871 7.077 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -1.513 -8.151 8.551 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -2.665 -9.044 9.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -0.162 -8.485 10.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -1.067 -9.787 10.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 0.059 -10.043 9.649 1.00 0.00 H new ATOM 289 N ALA A 22 -6.415 -8.681 5.013 1.00 0.00 N ATOM 290 CA ALA A 22 -7.008 -7.887 3.944 1.00 0.00 C ATOM 291 C ALA A 22 -7.987 -6.860 4.503 1.00 0.00 C ATOM 292 O ALA A 22 -8.044 -5.723 4.036 1.00 0.00 O ATOM 293 CB ALA A 22 -7.706 -8.791 2.940 1.00 0.00 C ATOM 0 H ALA A 22 -6.553 -9.687 4.917 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.207 -7.350 3.437 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -8.144 -8.184 2.147 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.983 -9.483 2.509 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -8.492 -9.354 3.443 1.00 0.00 H new ATOM 299 N GLY A 23 -8.757 -7.268 5.507 1.00 0.00 N ATOM 300 CA GLY A 23 -9.724 -6.371 6.112 1.00 0.00 C ATOM 301 C GLY A 23 -9.066 -5.223 6.853 1.00 0.00 C ATOM 302 O GLY A 23 -9.538 -4.087 6.798 1.00 0.00 O ATOM 0 H GLY A 23 -8.728 -8.204 5.912 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -10.379 -5.972 5.337 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -10.353 -6.932 6.803 1.00 0.00 H new ATOM 306 N LEU A 24 -7.974 -5.520 7.549 1.00 0.00 N ATOM 307 CA LEU A 24 -7.250 -4.504 8.307 1.00 0.00 C ATOM 308 C LEU A 24 -6.642 -3.462 7.375 1.00 0.00 C ATOM 309 O LEU A 24 -6.419 -2.317 7.769 1.00 0.00 O ATOM 310 CB LEU A 24 -6.152 -5.155 9.149 1.00 0.00 C ATOM 311 CG LEU A 24 -5.895 -4.524 10.519 1.00 0.00 C ATOM 312 CD1 LEU A 24 -6.677 -5.257 11.598 1.00 0.00 C ATOM 313 CD2 LEU A 24 -4.408 -4.531 10.838 1.00 0.00 C ATOM 0 H LEU A 24 -7.570 -6.455 7.604 1.00 0.00 H new ATOM 0 HA LEU A 24 -7.958 -4.004 8.968 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -6.409 -6.204 9.297 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -5.223 -5.131 8.580 1.00 0.00 H new ATOM 0 HG LEU A 24 -6.235 -3.489 10.492 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -6.482 -4.795 12.566 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -7.743 -5.201 11.377 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -6.367 -6.302 11.626 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -4.244 -4.079 11.816 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -4.043 -5.558 10.847 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -3.871 -3.962 10.080 1.00 0.00 H new ATOM 324 N MET A 25 -6.376 -3.865 6.136 1.00 0.00 N ATOM 325 CA MET A 25 -5.796 -2.964 5.147 1.00 0.00 C ATOM 326 C MET A 25 -6.690 -1.748 4.929 1.00 0.00 C ATOM 327 O MET A 25 -6.265 -0.610 5.128 1.00 0.00 O ATOM 328 CB MET A 25 -5.580 -3.697 3.822 1.00 0.00 C ATOM 329 CG MET A 25 -4.980 -2.821 2.734 1.00 0.00 C ATOM 330 SD MET A 25 -3.250 -3.208 2.407 1.00 0.00 S ATOM 331 CE MET A 25 -2.484 -2.645 3.925 1.00 0.00 C ATOM 0 H MET A 25 -6.553 -4.809 5.794 1.00 0.00 H new ATOM 0 HA MET A 25 -4.833 -2.621 5.525 1.00 0.00 H new ATOM 0 HB2 MET A 25 -4.925 -4.552 3.991 1.00 0.00 H new ATOM 0 HB3 MET A 25 -6.535 -4.091 3.474 1.00 0.00 H new ATOM 0 HG2 MET A 25 -5.555 -2.943 1.816 1.00 0.00 H new ATOM 0 HG3 MET A 25 -5.065 -1.775 3.027 1.00 0.00 H new ATOM 0 HE1 MET A 25 -1.402 -2.752 3.848 1.00 0.00 H new ATOM 0 HE2 MET A 25 -2.734 -1.597 4.092 1.00 0.00 H new ATOM 0 HE3 MET A 25 -2.849 -3.243 4.760 1.00 0.00 H new ATOM 339 N ARG A 26 -7.930 -1.997 4.520 1.00 0.00 N ATOM 340 CA ARG A 26 -8.883 -0.922 4.273 1.00 0.00 C ATOM 341 C ARG A 26 -9.053 -0.050 5.514 1.00 0.00 C ATOM 342 O ARG A 26 -9.420 1.122 5.418 1.00 0.00 O ATOM 343 CB ARG A 26 -10.237 -1.498 3.853 1.00 0.00 C ATOM 344 CG ARG A 26 -10.715 -1.003 2.497 1.00 0.00 C ATOM 345 CD ARG A 26 -10.634 -2.098 1.445 1.00 0.00 C ATOM 346 NE ARG A 26 -11.441 -3.262 1.802 1.00 0.00 N ATOM 347 CZ ARG A 26 -11.431 -4.401 1.119 1.00 0.00 C ATOM 348 NH1 ARG A 26 -10.659 -4.530 0.049 1.00 0.00 N ATOM 349 NH2 ARG A 26 -12.194 -5.415 1.507 1.00 0.00 N ATOM 0 H ARG A 26 -8.298 -2.934 4.353 1.00 0.00 H new ATOM 0 HA ARG A 26 -8.492 -0.303 3.465 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.168 -2.586 3.830 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -10.981 -1.242 4.607 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -11.743 -0.651 2.579 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -10.110 -0.152 2.185 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -10.970 -1.704 0.486 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -9.595 -2.402 1.318 1.00 0.00 H new ATOM 0 HE ARG A 26 -12.046 -3.196 2.621 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -10.070 -3.753 -0.252 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -10.654 -5.406 -0.473 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -12.789 -5.320 2.330 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -12.186 -6.289 0.982 1.00 0.00 H new ATOM 360 N HIS A 27 -8.785 -0.630 6.680 1.00 0.00 N ATOM 361 CA HIS A 27 -8.907 0.093 7.940 1.00 0.00 C ATOM 362 C HIS A 27 -7.836 1.176 8.052 1.00 0.00 C ATOM 363 O HIS A 27 -8.132 2.326 8.376 1.00 0.00 O ATOM 364 CB HIS A 27 -8.799 -0.872 9.120 1.00 0.00 C ATOM 365 CG HIS A 27 -9.262 -0.287 10.419 1.00 0.00 C ATOM 366 ND1 HIS A 27 -10.030 0.856 10.497 1.00 0.00 N ATOM 367 CD2 HIS A 27 -9.063 -0.693 11.694 1.00 0.00 C ATOM 368 CE1 HIS A 27 -10.282 1.128 11.765 1.00 0.00 C ATOM 369 NE2 HIS A 27 -9.706 0.202 12.512 1.00 0.00 N ATOM 0 H HIS A 27 -8.482 -1.599 6.778 1.00 0.00 H new ATOM 0 HA HIS A 27 -9.886 0.572 7.962 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -9.386 -1.764 8.903 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -7.762 -1.191 9.224 1.00 0.00 H new ATOM 0 HD2 HIS A 27 -8.502 -1.560 12.010 1.00 0.00 H new ATOM 0 HE1 HIS A 27 -10.860 1.964 12.129 1.00 0.00 H new ATOM 0 HE2 HIS A 27 -9.735 0.160 13.531 1.00 0.00 H new ATOM 376 N THR A 28 -6.591 0.798 7.783 1.00 0.00 N ATOM 377 CA THR A 28 -5.476 1.734 7.855 1.00 0.00 C ATOM 378 C THR A 28 -5.732 2.962 6.988 1.00 0.00 C ATOM 379 O THR A 28 -5.664 4.095 7.465 1.00 0.00 O ATOM 380 CB THR A 28 -4.157 1.073 7.412 1.00 0.00 C ATOM 381 OG1 THR A 28 -4.155 -0.310 7.781 1.00 0.00 O ATOM 382 CG2 THR A 28 -2.963 1.773 8.043 1.00 0.00 C ATOM 0 H THR A 28 -6.329 -0.150 7.513 1.00 0.00 H new ATOM 0 HA THR A 28 -5.388 2.040 8.897 1.00 0.00 H new ATOM 0 HB THR A 28 -4.078 1.160 6.328 1.00 0.00 H new ATOM 0 HG1 THR A 28 -3.431 -0.477 8.420 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.043 1.289 7.716 1.00 0.00 H new ATOM 0 HG22 THR A 28 -2.951 2.819 7.737 1.00 0.00 H new ATOM 0 HG23 THR A 28 -3.038 1.713 9.129 1.00 0.00 H new ATOM 390 N ILE A 29 -6.028 2.730 5.714 1.00 0.00 N ATOM 391 CA ILE A 29 -6.295 3.817 4.782 1.00 0.00 C ATOM 392 C ILE A 29 -7.580 4.553 5.150 1.00 0.00 C ATOM 393 O ILE A 29 -7.608 5.780 5.214 1.00 0.00 O ATOM 394 CB ILE A 29 -6.407 3.303 3.335 1.00 0.00 C ATOM 395 CG1 ILE A 29 -5.045 2.814 2.837 1.00 0.00 C ATOM 396 CG2 ILE A 29 -6.949 4.397 2.424 1.00 0.00 C ATOM 397 CD1 ILE A 29 -4.703 1.414 3.293 1.00 0.00 C ATOM 0 H ILE A 29 -6.089 1.798 5.304 1.00 0.00 H new ATOM 0 HA ILE A 29 -5.453 4.505 4.850 1.00 0.00 H new ATOM 0 HB ILE A 29 -7.102 2.464 3.316 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -5.033 2.846 1.748 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -4.272 3.500 3.185 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -7.022 4.018 1.405 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -7.937 4.702 2.770 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -6.276 5.254 2.445 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -3.725 1.133 2.903 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -4.683 1.381 4.382 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -5.455 0.717 2.923 1.00 0.00 H new ATOM 408 N GLY A 30 -8.643 3.791 5.391 1.00 0.00 N ATOM 409 CA GLY A 30 -9.917 4.387 5.751 1.00 0.00 C ATOM 410 C GLY A 30 -9.804 5.321 6.939 1.00 0.00 C ATOM 411 O GLY A 30 -10.323 6.437 6.910 1.00 0.00 O ATOM 0 H GLY A 30 -8.645 2.772 5.343 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -10.312 4.937 4.897 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -10.632 3.597 5.980 1.00 0.00 H new ATOM 415 N GLN A 31 -9.124 4.866 7.986 1.00 0.00 N ATOM 416 CA GLN A 31 -8.948 5.669 9.190 1.00 0.00 C ATOM 417 C GLN A 31 -7.952 6.799 8.949 1.00 0.00 C ATOM 418 O GLN A 31 -8.219 7.955 9.277 1.00 0.00 O ATOM 419 CB GLN A 31 -8.471 4.792 10.349 1.00 0.00 C ATOM 420 CG GLN A 31 -9.604 4.196 11.168 1.00 0.00 C ATOM 421 CD GLN A 31 -10.397 5.249 11.920 1.00 0.00 C ATOM 422 OE1 GLN A 31 -9.884 5.889 12.838 1.00 0.00 O ATOM 423 NE2 GLN A 31 -11.654 5.433 11.533 1.00 0.00 N ATOM 0 H GLN A 31 -8.686 3.946 8.025 1.00 0.00 H new ATOM 0 HA GLN A 31 -9.912 6.107 9.448 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -7.856 3.984 9.953 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -7.834 5.386 11.004 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -10.274 3.645 10.508 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -9.195 3.478 11.879 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -12.038 4.880 10.767 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -12.235 6.128 12.002 1.00 0.00 H new ATOM 430 N ALA A 32 -6.803 6.457 8.375 1.00 0.00 N ATOM 431 CA ALA A 32 -5.769 7.443 8.089 1.00 0.00 C ATOM 432 C ALA A 32 -6.313 8.574 7.224 1.00 0.00 C ATOM 433 O ALA A 32 -5.823 9.702 7.280 1.00 0.00 O ATOM 434 CB ALA A 32 -4.582 6.779 7.407 1.00 0.00 C ATOM 0 H ALA A 32 -6.565 5.504 8.099 1.00 0.00 H new ATOM 0 HA ALA A 32 -5.438 7.871 9.035 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -3.817 7.527 7.199 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -4.170 6.010 8.061 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -4.908 6.323 6.472 1.00 0.00 H new ATOM 440 N GLU A 33 -7.329 8.266 6.424 1.00 0.00 N ATOM 441 CA GLU A 33 -7.937 9.258 5.545 1.00 0.00 C ATOM 442 C GLU A 33 -8.802 10.231 6.342 1.00 0.00 C ATOM 443 O GLU A 33 -8.911 11.407 5.994 1.00 0.00 O ATOM 444 CB GLU A 33 -8.782 8.571 4.470 1.00 0.00 C ATOM 445 CG GLU A 33 -9.198 9.496 3.339 1.00 0.00 C ATOM 446 CD GLU A 33 -10.153 8.834 2.366 1.00 0.00 C ATOM 447 OE1 GLU A 33 -10.119 7.591 2.252 1.00 0.00 O ATOM 448 OE2 GLU A 33 -10.936 9.560 1.717 1.00 0.00 O ATOM 0 H GLU A 33 -7.748 7.338 6.367 1.00 0.00 H new ATOM 0 HA GLU A 33 -7.136 9.819 5.063 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -8.218 7.735 4.056 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -9.676 8.154 4.934 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -9.670 10.385 3.757 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -8.310 9.829 2.801 1.00 0.00 H new ATOM 453 N GLN A 34 -9.415 9.732 7.411 1.00 0.00 N ATOM 454 CA GLN A 34 -10.270 10.557 8.255 1.00 0.00 C ATOM 455 C GLN A 34 -9.508 11.766 8.786 1.00 0.00 C ATOM 456 O GLN A 34 -10.007 12.890 8.751 1.00 0.00 O ATOM 457 CB GLN A 34 -10.820 9.732 9.420 1.00 0.00 C ATOM 458 CG GLN A 34 -12.087 10.309 10.029 1.00 0.00 C ATOM 459 CD GLN A 34 -12.653 9.438 11.134 1.00 0.00 C ATOM 460 OE1 GLN A 34 -13.568 8.646 10.909 1.00 0.00 O ATOM 461 NE2 GLN A 34 -12.108 9.580 12.337 1.00 0.00 N ATOM 0 H GLN A 34 -9.335 8.761 7.712 1.00 0.00 H new ATOM 0 HA GLN A 34 -11.102 10.914 7.648 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -11.022 8.719 9.073 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -10.056 9.657 10.194 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -11.875 11.302 10.427 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -12.837 10.432 9.248 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -11.351 10.249 12.478 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -12.446 9.020 13.120 1.00 0.00 H new ATOM 468 N ALA A 35 -8.297 11.527 9.278 1.00 0.00 N ATOM 469 CA ALA A 35 -7.465 12.596 9.815 1.00 0.00 C ATOM 470 C ALA A 35 -7.263 13.704 8.786 1.00 0.00 C ATOM 471 O ALA A 35 -7.106 14.871 9.141 1.00 0.00 O ATOM 472 CB ALA A 35 -6.121 12.043 10.268 1.00 0.00 C ATOM 0 H ALA A 35 -7.870 10.601 9.316 1.00 0.00 H new ATOM 0 HA ALA A 35 -7.978 13.024 10.676 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -5.510 12.853 10.667 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -6.279 11.292 11.042 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.610 11.587 9.420 1.00 0.00 H new ATOM 478 N ALA A 36 -7.269 13.329 7.511 1.00 0.00 N ATOM 479 CA ALA A 36 -7.087 14.291 6.431 1.00 0.00 C ATOM 480 C ALA A 36 -8.341 15.137 6.234 1.00 0.00 C ATOM 481 O ALA A 36 -8.277 16.244 5.700 1.00 0.00 O ATOM 482 CB ALA A 36 -6.723 13.574 5.140 1.00 0.00 C ATOM 0 H ALA A 36 -7.398 12.366 7.201 1.00 0.00 H new ATOM 0 HA ALA A 36 -6.269 14.958 6.705 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -6.590 14.305 4.343 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.796 13.019 5.281 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -7.522 12.883 4.870 1.00 0.00 H new ATOM 488 N MET A 37 -9.481 14.606 6.665 1.00 0.00 N ATOM 489 CA MET A 37 -10.750 15.313 6.535 1.00 0.00 C ATOM 490 C MET A 37 -10.647 16.723 7.109 1.00 0.00 C ATOM 491 O MET A 37 -11.333 17.639 6.655 1.00 0.00 O ATOM 492 CB MET A 37 -11.863 14.541 7.244 1.00 0.00 C ATOM 493 CG MET A 37 -12.071 13.136 6.700 1.00 0.00 C ATOM 494 SD MET A 37 -13.283 13.080 5.366 1.00 0.00 S ATOM 495 CE MET A 37 -12.966 11.453 4.690 1.00 0.00 C ATOM 0 H MET A 37 -9.552 13.689 7.107 1.00 0.00 H new ATOM 0 HA MET A 37 -10.989 15.388 5.474 1.00 0.00 H new ATOM 0 HB2 MET A 37 -11.631 14.479 8.307 1.00 0.00 H new ATOM 0 HB3 MET A 37 -12.795 15.099 7.153 1.00 0.00 H new ATOM 0 HG2 MET A 37 -11.120 12.746 6.338 1.00 0.00 H new ATOM 0 HG3 MET A 37 -12.396 12.482 7.509 1.00 0.00 H new ATOM 0 HE1 MET A 37 -13.640 11.269 3.853 1.00 0.00 H new ATOM 0 HE2 MET A 37 -11.934 11.398 4.344 1.00 0.00 H new ATOM 0 HE3 MET A 37 -13.131 10.700 5.461 1.00 0.00 H new ATOM 503 N SER A 38 -9.788 16.889 8.109 1.00 0.00 N ATOM 504 CA SER A 38 -9.600 18.187 8.748 1.00 0.00 C ATOM 505 C SER A 38 -9.305 19.266 7.709 1.00 0.00 C ATOM 506 O SER A 38 -9.897 20.344 7.733 1.00 0.00 O ATOM 507 CB SER A 38 -8.461 18.117 9.766 1.00 0.00 C ATOM 508 OG SER A 38 -8.896 17.528 10.978 1.00 0.00 O ATOM 0 H SER A 38 -9.211 16.141 8.495 1.00 0.00 H new ATOM 0 HA SER A 38 -10.524 18.448 9.265 1.00 0.00 H new ATOM 0 HB2 SER A 38 -7.635 17.538 9.353 1.00 0.00 H new ATOM 0 HB3 SER A 38 -8.081 19.120 9.961 1.00 0.00 H new ATOM 0 HG SER A 38 -8.149 17.493 11.611 1.00 0.00 H new ATOM 513 N ALA A 39 -8.385 18.965 6.799 1.00 0.00 N ATOM 514 CA ALA A 39 -8.012 19.907 5.751 1.00 0.00 C ATOM 515 C ALA A 39 -9.201 20.228 4.852 1.00 0.00 C ATOM 516 O ALA A 39 -9.237 21.275 4.206 1.00 0.00 O ATOM 517 CB ALA A 39 -6.860 19.351 4.928 1.00 0.00 C ATOM 0 H ALA A 39 -7.884 18.077 6.766 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.690 20.833 6.227 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -6.592 20.065 4.149 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -6.000 19.180 5.575 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -7.162 18.409 4.469 1.00 0.00 H new ATOM 523 N GLN A 40 -10.170 19.320 4.815 1.00 0.00 N ATOM 524 CA GLN A 40 -11.361 19.506 3.993 1.00 0.00 C ATOM 525 C GLN A 40 -12.296 20.537 4.616 1.00 0.00 C ATOM 526 O GLN A 40 -13.295 20.927 4.013 1.00 0.00 O ATOM 527 CB GLN A 40 -12.094 18.177 3.811 1.00 0.00 C ATOM 528 CG GLN A 40 -12.696 17.998 2.428 1.00 0.00 C ATOM 529 CD GLN A 40 -11.893 17.048 1.561 1.00 0.00 C ATOM 530 OE1 GLN A 40 -10.892 17.434 0.958 1.00 0.00 O ATOM 531 NE2 GLN A 40 -12.329 15.795 1.493 1.00 0.00 N ATOM 0 H GLN A 40 -10.155 18.448 5.344 1.00 0.00 H new ATOM 0 HA GLN A 40 -11.045 19.873 3.017 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -11.400 17.359 4.004 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -12.887 18.104 4.555 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -13.715 17.622 2.525 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -12.760 18.968 1.935 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -13.164 15.517 2.009 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -11.829 15.111 0.925 1.00 0.00 H new ATOM 538 N ALA A 41 -11.966 20.972 5.828 1.00 0.00 N ATOM 539 CA ALA A 41 -12.777 21.958 6.533 1.00 0.00 C ATOM 540 C ALA A 41 -12.956 23.220 5.696 1.00 0.00 C ATOM 541 O ALA A 41 -14.080 23.630 5.405 1.00 0.00 O ATOM 542 CB ALA A 41 -12.146 22.297 7.875 1.00 0.00 C ATOM 0 H ALA A 41 -11.143 20.657 6.342 1.00 0.00 H new ATOM 0 HA ALA A 41 -13.762 21.526 6.706 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -12.762 23.034 8.391 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -12.075 21.395 8.482 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -11.148 22.706 7.715 1.00 0.00 H new ATOM 548 N PHE A 42 -11.841 23.833 5.313 1.00 0.00 N ATOM 549 CA PHE A 42 -11.875 25.051 4.511 1.00 0.00 C ATOM 550 C PHE A 42 -12.767 26.105 5.159 1.00 0.00 C ATOM 551 O PHE A 42 -13.286 26.995 4.485 1.00 0.00 O ATOM 552 CB PHE A 42 -12.375 24.742 3.098 1.00 0.00 C ATOM 553 CG PHE A 42 -11.587 23.667 2.405 1.00 0.00 C ATOM 554 CD1 PHE A 42 -10.204 23.725 2.357 1.00 0.00 C ATOM 555 CD2 PHE A 42 -12.231 22.599 1.800 1.00 0.00 C ATOM 556 CE1 PHE A 42 -9.477 22.737 1.721 1.00 0.00 C ATOM 557 CE2 PHE A 42 -11.509 21.609 1.163 1.00 0.00 C ATOM 558 CZ PHE A 42 -10.130 21.679 1.121 1.00 0.00 C ATOM 0 H PHE A 42 -10.903 23.507 5.545 1.00 0.00 H new ATOM 0 HA PHE A 42 -10.861 25.446 4.452 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -13.421 24.439 3.149 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -12.336 25.653 2.500 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -9.688 24.552 2.822 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -13.309 22.540 1.827 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -8.399 22.792 1.693 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -12.022 20.780 0.698 1.00 0.00 H new ATOM 0 HZ PHE A 42 -9.564 20.908 0.620 1.00 0.00 H new ATOM 567 N HIS A 43 -12.941 25.997 6.473 1.00 0.00 N ATOM 568 CA HIS A 43 -13.771 26.940 7.214 1.00 0.00 C ATOM 569 C HIS A 43 -13.841 26.559 8.690 1.00 0.00 C ATOM 570 O HIS A 43 -13.798 27.423 9.565 1.00 0.00 O ATOM 571 CB HIS A 43 -15.179 26.988 6.621 1.00 0.00 C ATOM 572 CG HIS A 43 -15.627 28.370 6.253 1.00 0.00 C ATOM 573 ND1 HIS A 43 -15.240 29.001 5.089 1.00 0.00 N ATOM 574 CD2 HIS A 43 -16.434 29.241 6.901 1.00 0.00 C ATOM 575 CE1 HIS A 43 -15.790 30.201 5.039 1.00 0.00 C ATOM 576 NE2 HIS A 43 -16.520 30.372 6.127 1.00 0.00 N ATOM 0 H HIS A 43 -12.518 25.266 7.046 1.00 0.00 H new ATOM 0 HA HIS A 43 -13.317 27.927 7.133 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -15.213 26.356 5.734 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -15.882 26.566 7.340 1.00 0.00 H new ATOM 0 HD1 HIS A 43 -14.626 28.603 4.378 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -16.921 29.077 7.851 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -15.664 30.921 4.243 1.00 0.00 H new ATOM 583 N GLN A 44 -13.950 25.262 8.957 1.00 0.00 N ATOM 584 CA GLN A 44 -14.028 24.768 10.326 1.00 0.00 C ATOM 585 C GLN A 44 -12.884 25.322 11.170 1.00 0.00 C ATOM 586 O GLN A 44 -13.027 25.517 12.376 1.00 0.00 O ATOM 587 CB GLN A 44 -13.995 23.239 10.342 1.00 0.00 C ATOM 588 CG GLN A 44 -15.010 22.618 11.290 1.00 0.00 C ATOM 589 CD GLN A 44 -14.438 22.362 12.670 1.00 0.00 C ATOM 590 OE1 GLN A 44 -14.599 23.174 13.582 1.00 0.00 O ATOM 591 NE2 GLN A 44 -13.767 21.228 12.832 1.00 0.00 N ATOM 0 H GLN A 44 -13.986 24.534 8.243 1.00 0.00 H new ATOM 0 HA GLN A 44 -14.970 25.108 10.755 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -14.179 22.869 9.333 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -12.996 22.908 10.625 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -15.873 23.278 11.375 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -15.368 21.678 10.869 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -13.658 20.584 12.049 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -13.361 21.001 13.740 1.00 0.00 H new ATOM 598 N GLY A 45 -11.748 25.571 10.527 1.00 0.00 N ATOM 599 CA GLY A 45 -10.595 26.100 11.233 1.00 0.00 C ATOM 600 C GLY A 45 -9.573 26.714 10.298 1.00 0.00 C ATOM 601 O GLY A 45 -9.229 27.888 10.432 1.00 0.00 O ATOM 0 H GLY A 45 -11.605 25.416 9.529 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -10.925 26.852 11.949 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -10.125 25.300 11.805 1.00 0.00 H new ATOM 605 N GLU A 46 -9.086 25.919 9.351 1.00 0.00 N ATOM 606 CA GLU A 46 -8.094 26.393 8.393 1.00 0.00 C ATOM 607 C GLU A 46 -8.386 25.851 6.996 1.00 0.00 C ATOM 608 O GLU A 46 -9.441 25.265 6.754 1.00 0.00 O ATOM 609 CB GLU A 46 -6.689 25.973 8.830 1.00 0.00 C ATOM 610 CG GLU A 46 -5.668 27.097 8.756 1.00 0.00 C ATOM 611 CD GLU A 46 -5.944 28.201 9.759 1.00 0.00 C ATOM 612 OE1 GLU A 46 -5.581 28.030 10.942 1.00 0.00 O ATOM 613 OE2 GLU A 46 -6.520 29.235 9.361 1.00 0.00 O ATOM 0 H GLU A 46 -9.362 24.945 9.226 1.00 0.00 H new ATOM 0 HA GLU A 46 -8.147 27.481 8.362 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -6.732 25.599 9.853 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -6.354 25.147 8.203 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -4.672 26.691 8.933 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -5.667 27.517 7.750 1.00 0.00 H new ATOM 618 N SER A 47 -7.444 26.053 6.081 1.00 0.00 N ATOM 619 CA SER A 47 -7.601 25.590 4.706 1.00 0.00 C ATOM 620 C SER A 47 -6.263 25.137 4.130 1.00 0.00 C ATOM 621 O SER A 47 -5.236 25.179 4.807 1.00 0.00 O ATOM 622 CB SER A 47 -8.196 26.700 3.837 1.00 0.00 C ATOM 623 OG SER A 47 -7.493 27.917 4.014 1.00 0.00 O ATOM 0 H SER A 47 -6.564 26.534 6.266 1.00 0.00 H new ATOM 0 HA SER A 47 -8.281 24.738 4.710 1.00 0.00 H new ATOM 0 HB2 SER A 47 -8.160 26.404 2.788 1.00 0.00 H new ATOM 0 HB3 SER A 47 -9.246 26.842 4.092 1.00 0.00 H new ATOM 0 HG SER A 47 -7.891 28.610 3.447 1.00 0.00 H new ATOM 628 N SER A 48 -6.285 24.703 2.874 1.00 0.00 N ATOM 629 CA SER A 48 -5.075 24.238 2.205 1.00 0.00 C ATOM 630 C SER A 48 -5.376 23.814 0.770 1.00 0.00 C ATOM 631 O SER A 48 -6.175 22.907 0.534 1.00 0.00 O ATOM 632 CB SER A 48 -4.459 23.069 2.975 1.00 0.00 C ATOM 633 OG SER A 48 -5.458 22.166 3.419 1.00 0.00 O ATOM 0 H SER A 48 -7.127 24.664 2.299 1.00 0.00 H new ATOM 0 HA SER A 48 -4.363 25.063 2.180 1.00 0.00 H new ATOM 0 HB2 SER A 48 -3.748 22.544 2.337 1.00 0.00 H new ATOM 0 HB3 SER A 48 -3.900 23.448 3.831 1.00 0.00 H new ATOM 0 HG SER A 48 -6.099 22.005 2.695 1.00 0.00 H new ATOM 638 N ALA A 49 -4.731 24.476 -0.184 1.00 0.00 N ATOM 639 CA ALA A 49 -4.927 24.169 -1.595 1.00 0.00 C ATOM 640 C ALA A 49 -4.061 22.989 -2.024 1.00 0.00 C ATOM 641 O ALA A 49 -4.557 22.018 -2.594 1.00 0.00 O ATOM 642 CB ALA A 49 -4.621 25.389 -2.449 1.00 0.00 C ATOM 0 H ALA A 49 -4.067 25.230 -0.005 1.00 0.00 H new ATOM 0 HA ALA A 49 -5.971 23.892 -1.740 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -4.772 25.144 -3.500 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -5.285 26.206 -2.168 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -3.586 25.693 -2.292 1.00 0.00 H new ATOM 648 N ALA A 50 -2.764 23.080 -1.747 1.00 0.00 N ATOM 649 CA ALA A 50 -1.831 22.020 -2.104 1.00 0.00 C ATOM 650 C ALA A 50 -2.258 20.686 -1.502 1.00 0.00 C ATOM 651 O ALA A 50 -1.909 19.622 -2.014 1.00 0.00 O ATOM 652 CB ALA A 50 -0.424 22.380 -1.648 1.00 0.00 C ATOM 0 H ALA A 50 -2.336 23.877 -1.276 1.00 0.00 H new ATOM 0 HA ALA A 50 -1.835 21.917 -3.189 1.00 0.00 H new ATOM 0 HB1 ALA A 50 0.263 21.579 -1.921 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -0.111 23.306 -2.130 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -0.415 22.513 -0.566 1.00 0.00 H new ATOM 658 N PHE A 51 -3.016 20.750 -0.413 1.00 0.00 N ATOM 659 CA PHE A 51 -3.490 19.546 0.260 1.00 0.00 C ATOM 660 C PHE A 51 -4.270 18.656 -0.703 1.00 0.00 C ATOM 661 O PHE A 51 -4.174 17.430 -0.646 1.00 0.00 O ATOM 662 CB PHE A 51 -4.371 19.918 1.455 1.00 0.00 C ATOM 663 CG PHE A 51 -5.067 18.740 2.076 1.00 0.00 C ATOM 664 CD1 PHE A 51 -6.316 18.342 1.628 1.00 0.00 C ATOM 665 CD2 PHE A 51 -4.472 18.030 3.107 1.00 0.00 C ATOM 666 CE1 PHE A 51 -6.960 17.260 2.198 1.00 0.00 C ATOM 667 CE2 PHE A 51 -5.110 16.947 3.680 1.00 0.00 C ATOM 668 CZ PHE A 51 -6.355 16.560 3.224 1.00 0.00 C ATOM 0 H PHE A 51 -3.315 21.622 0.023 1.00 0.00 H new ATOM 0 HA PHE A 51 -2.621 18.993 0.616 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -3.757 20.407 2.211 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -5.118 20.643 1.134 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -6.792 18.884 0.824 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -3.498 18.327 3.467 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -7.935 16.962 1.842 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -4.636 16.403 4.484 1.00 0.00 H new ATOM 0 HZ PHE A 51 -6.855 15.712 3.669 1.00 0.00 H new ATOM 677 N GLN A 52 -5.041 19.282 -1.586 1.00 0.00 N ATOM 678 CA GLN A 52 -5.838 18.547 -2.561 1.00 0.00 C ATOM 679 C GLN A 52 -4.944 17.770 -3.521 1.00 0.00 C ATOM 680 O GLN A 52 -5.097 16.561 -3.686 1.00 0.00 O ATOM 681 CB GLN A 52 -6.735 19.507 -3.344 1.00 0.00 C ATOM 682 CG GLN A 52 -7.608 18.815 -4.379 1.00 0.00 C ATOM 683 CD GLN A 52 -9.013 18.552 -3.874 1.00 0.00 C ATOM 684 OE1 GLN A 52 -9.745 19.480 -3.526 1.00 0.00 O ATOM 685 NE2 GLN A 52 -9.399 17.283 -3.830 1.00 0.00 N ATOM 0 H GLN A 52 -5.131 20.296 -1.646 1.00 0.00 H new ATOM 0 HA GLN A 52 -6.463 17.836 -2.020 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -7.373 20.047 -2.645 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -6.111 20.248 -3.844 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -7.658 19.431 -5.277 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -7.146 17.870 -4.666 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -8.761 16.545 -4.128 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -10.334 17.046 -3.498 1.00 0.00 H new ATOM 692 N ALA A 53 -4.008 18.473 -4.151 1.00 0.00 N ATOM 693 CA ALA A 53 -3.088 17.849 -5.093 1.00 0.00 C ATOM 694 C ALA A 53 -2.418 16.626 -4.477 1.00 0.00 C ATOM 695 O ALA A 53 -2.204 15.618 -5.150 1.00 0.00 O ATOM 696 CB ALA A 53 -2.039 18.852 -5.550 1.00 0.00 C ATOM 0 H ALA A 53 -3.867 19.475 -4.026 1.00 0.00 H new ATOM 0 HA ALA A 53 -3.662 17.520 -5.959 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -1.359 18.372 -6.253 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -2.529 19.695 -6.037 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -1.477 19.209 -4.687 1.00 0.00 H new ATOM 702 N ALA A 54 -2.089 16.721 -3.193 1.00 0.00 N ATOM 703 CA ALA A 54 -1.444 15.620 -2.486 1.00 0.00 C ATOM 704 C ALA A 54 -2.455 14.543 -2.108 1.00 0.00 C ATOM 705 O ALA A 54 -2.145 13.352 -2.129 1.00 0.00 O ATOM 706 CB ALA A 54 -0.730 16.136 -1.245 1.00 0.00 C ATOM 0 H ALA A 54 -2.258 17.548 -2.621 1.00 0.00 H new ATOM 0 HA ALA A 54 -0.709 15.172 -3.155 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -0.253 15.304 -0.727 1.00 0.00 H new ATOM 0 HB2 ALA A 54 0.027 16.864 -1.537 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -1.452 16.611 -0.581 1.00 0.00 H new ATOM 712 N HIS A 55 -3.666 14.970 -1.762 1.00 0.00 N ATOM 713 CA HIS A 55 -4.723 14.041 -1.379 1.00 0.00 C ATOM 714 C HIS A 55 -5.098 13.133 -2.546 1.00 0.00 C ATOM 715 O HIS A 55 -5.453 11.971 -2.352 1.00 0.00 O ATOM 716 CB HIS A 55 -5.956 14.809 -0.898 1.00 0.00 C ATOM 717 CG HIS A 55 -7.148 13.935 -0.657 1.00 0.00 C ATOM 718 ND1 HIS A 55 -7.569 13.568 0.603 1.00 0.00 N ATOM 719 CD2 HIS A 55 -8.012 13.356 -1.524 1.00 0.00 C ATOM 720 CE1 HIS A 55 -8.639 12.801 0.501 1.00 0.00 C ATOM 721 NE2 HIS A 55 -8.929 12.657 -0.780 1.00 0.00 N ATOM 0 H HIS A 55 -3.939 15.953 -1.739 1.00 0.00 H new ATOM 0 HA HIS A 55 -4.350 13.420 -0.564 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -5.709 15.336 0.024 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -6.214 15.566 -1.638 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -7.985 13.430 -2.601 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -9.185 12.365 1.325 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -9.707 12.115 -1.155 1.00 0.00 H new ATOM 728 N ALA A 56 -5.018 13.672 -3.759 1.00 0.00 N ATOM 729 CA ALA A 56 -5.347 12.910 -4.957 1.00 0.00 C ATOM 730 C ALA A 56 -4.304 11.830 -5.224 1.00 0.00 C ATOM 731 O ALA A 56 -4.618 10.774 -5.775 1.00 0.00 O ATOM 732 CB ALA A 56 -5.466 13.839 -6.156 1.00 0.00 C ATOM 0 H ALA A 56 -4.728 14.634 -3.937 1.00 0.00 H new ATOM 0 HA ALA A 56 -6.307 12.419 -4.794 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -5.712 13.257 -7.044 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -6.252 14.571 -5.972 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -4.519 14.355 -6.312 1.00 0.00 H new ATOM 738 N ARG A 57 -3.065 12.099 -4.830 1.00 0.00 N ATOM 739 CA ARG A 57 -1.976 11.150 -5.028 1.00 0.00 C ATOM 740 C ARG A 57 -2.190 9.895 -4.188 1.00 0.00 C ATOM 741 O ARG A 57 -1.893 8.783 -4.627 1.00 0.00 O ATOM 742 CB ARG A 57 -0.637 11.796 -4.670 1.00 0.00 C ATOM 743 CG ARG A 57 -0.145 12.794 -5.704 1.00 0.00 C ATOM 744 CD ARG A 57 1.229 13.338 -5.345 1.00 0.00 C ATOM 745 NE ARG A 57 2.304 12.505 -5.877 1.00 0.00 N ATOM 746 CZ ARG A 57 3.566 12.906 -5.975 1.00 0.00 C ATOM 747 NH1 ARG A 57 3.911 14.123 -5.576 1.00 0.00 N ATOM 748 NH2 ARG A 57 4.488 12.090 -6.470 1.00 0.00 N ATOM 0 H ARG A 57 -2.789 12.967 -4.371 1.00 0.00 H new ATOM 0 HA ARG A 57 -1.963 10.864 -6.080 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -0.732 12.300 -3.708 1.00 0.00 H new ATOM 0 HB3 ARG A 57 0.112 11.014 -4.547 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -0.103 12.315 -6.682 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -0.854 13.618 -5.782 1.00 0.00 H new ATOM 0 HD2 ARG A 57 1.330 14.352 -5.733 1.00 0.00 H new ATOM 0 HD3 ARG A 57 1.322 13.401 -4.261 1.00 0.00 H new ATOM 0 HE ARG A 57 2.072 11.562 -6.191 1.00 0.00 H new ATOM 0 HH11 ARG A 57 3.206 14.753 -5.193 1.00 0.00 H new ATOM 0 HH12 ARG A 57 4.881 14.429 -5.652 1.00 0.00 H new ATOM 0 HH21 ARG A 57 4.228 11.152 -6.776 1.00 0.00 H new ATOM 0 HH22 ARG A 57 5.457 12.400 -6.544 1.00 0.00 H new ATOM 759 N PHE A 58 -2.705 10.080 -2.977 1.00 0.00 N ATOM 760 CA PHE A 58 -2.956 8.962 -2.074 1.00 0.00 C ATOM 761 C PHE A 58 -4.063 8.063 -2.618 1.00 0.00 C ATOM 762 O PHE A 58 -3.876 6.856 -2.776 1.00 0.00 O ATOM 763 CB PHE A 58 -3.337 9.478 -0.685 1.00 0.00 C ATOM 764 CG PHE A 58 -3.709 8.386 0.278 1.00 0.00 C ATOM 765 CD1 PHE A 58 -2.732 7.721 1.001 1.00 0.00 C ATOM 766 CD2 PHE A 58 -5.034 8.027 0.461 1.00 0.00 C ATOM 767 CE1 PHE A 58 -3.071 6.716 1.887 1.00 0.00 C ATOM 768 CE2 PHE A 58 -5.379 7.022 1.346 1.00 0.00 C ATOM 769 CZ PHE A 58 -4.396 6.366 2.060 1.00 0.00 C ATOM 0 H PHE A 58 -2.957 10.993 -2.598 1.00 0.00 H new ATOM 0 HA PHE A 58 -2.041 8.375 -1.997 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.501 10.045 -0.275 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -4.175 10.169 -0.780 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -1.694 7.991 0.871 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -5.807 8.538 -0.094 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -2.300 6.204 2.444 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -6.416 6.751 1.479 1.00 0.00 H new ATOM 0 HZ PHE A 58 -4.662 5.581 2.752 1.00 0.00 H new ATOM 778 N VAL A 59 -5.217 8.659 -2.901 1.00 0.00 N ATOM 779 CA VAL A 59 -6.354 7.914 -3.426 1.00 0.00 C ATOM 780 C VAL A 59 -5.983 7.178 -4.708 1.00 0.00 C ATOM 781 O VAL A 59 -6.504 6.098 -4.989 1.00 0.00 O ATOM 782 CB VAL A 59 -7.551 8.842 -3.707 1.00 0.00 C ATOM 783 CG1 VAL A 59 -7.114 10.041 -4.534 1.00 0.00 C ATOM 784 CG2 VAL A 59 -8.664 8.077 -4.409 1.00 0.00 C ATOM 0 H VAL A 59 -5.389 9.657 -2.775 1.00 0.00 H new ATOM 0 HA VAL A 59 -6.638 7.189 -2.663 1.00 0.00 H new ATOM 0 HB VAL A 59 -7.936 9.208 -2.755 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -7.973 10.685 -4.723 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -6.353 10.601 -3.990 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -6.702 9.698 -5.483 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -9.502 8.747 -4.600 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -8.293 7.681 -5.354 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -8.995 7.254 -3.776 1.00 0.00 H new ATOM 794 N ALA A 60 -5.080 7.768 -5.483 1.00 0.00 N ATOM 795 CA ALA A 60 -4.637 7.167 -6.735 1.00 0.00 C ATOM 796 C ALA A 60 -3.804 5.916 -6.479 1.00 0.00 C ATOM 797 O ALA A 60 -3.900 4.933 -7.214 1.00 0.00 O ATOM 798 CB ALA A 60 -3.842 8.175 -7.552 1.00 0.00 C ATOM 0 H ALA A 60 -4.640 8.662 -5.266 1.00 0.00 H new ATOM 0 HA ALA A 60 -5.521 6.873 -7.301 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -3.517 7.713 -8.484 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -4.469 9.039 -7.774 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -2.969 8.497 -6.984 1.00 0.00 H new ATOM 804 N ALA A 61 -2.987 5.959 -5.432 1.00 0.00 N ATOM 805 CA ALA A 61 -2.138 4.828 -5.078 1.00 0.00 C ATOM 806 C ALA A 61 -2.930 3.759 -4.335 1.00 0.00 C ATOM 807 O ALA A 61 -2.721 2.564 -4.539 1.00 0.00 O ATOM 808 CB ALA A 61 -0.960 5.295 -4.237 1.00 0.00 C ATOM 0 H ALA A 61 -2.895 6.765 -4.814 1.00 0.00 H new ATOM 0 HA ALA A 61 -1.759 4.387 -6.000 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -0.335 4.440 -3.980 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -0.372 6.017 -4.803 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -1.328 5.763 -3.324 1.00 0.00 H new ATOM 814 N ALA A 62 -3.840 4.196 -3.470 1.00 0.00 N ATOM 815 CA ALA A 62 -4.665 3.276 -2.698 1.00 0.00 C ATOM 816 C ALA A 62 -5.344 2.254 -3.603 1.00 0.00 C ATOM 817 O ALA A 62 -5.445 1.077 -3.260 1.00 0.00 O ATOM 818 CB ALA A 62 -5.703 4.045 -1.894 1.00 0.00 C ATOM 0 H ALA A 62 -4.024 5.182 -3.287 1.00 0.00 H new ATOM 0 HA ALA A 62 -4.015 2.736 -2.009 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -6.312 3.345 -1.322 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -5.200 4.730 -1.211 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -6.341 4.612 -2.572 1.00 0.00 H new ATOM 824 N ALA A 63 -5.810 2.714 -4.760 1.00 0.00 N ATOM 825 CA ALA A 63 -6.479 1.839 -5.715 1.00 0.00 C ATOM 826 C ALA A 63 -5.572 0.685 -6.132 1.00 0.00 C ATOM 827 O ALA A 63 -6.044 -0.408 -6.443 1.00 0.00 O ATOM 828 CB ALA A 63 -6.921 2.632 -6.936 1.00 0.00 C ATOM 0 H ALA A 63 -5.737 3.687 -5.058 1.00 0.00 H new ATOM 0 HA ALA A 63 -7.359 1.418 -5.230 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -7.419 1.967 -7.641 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -7.611 3.418 -6.629 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -6.050 3.080 -7.414 1.00 0.00 H new ATOM 834 N LYS A 64 -4.267 0.937 -6.137 1.00 0.00 N ATOM 835 CA LYS A 64 -3.293 -0.080 -6.515 1.00 0.00 C ATOM 836 C LYS A 64 -3.264 -1.212 -5.492 1.00 0.00 C ATOM 837 O LYS A 64 -3.393 -2.385 -5.846 1.00 0.00 O ATOM 838 CB LYS A 64 -1.900 0.541 -6.642 1.00 0.00 C ATOM 839 CG LYS A 64 -1.097 -0.003 -7.811 1.00 0.00 C ATOM 840 CD LYS A 64 -1.034 -1.522 -7.786 1.00 0.00 C ATOM 841 CE LYS A 64 -0.205 -2.065 -8.940 1.00 0.00 C ATOM 842 NZ LYS A 64 -0.639 -1.499 -10.247 1.00 0.00 N ATOM 0 H LYS A 64 -3.860 1.837 -5.883 1.00 0.00 H new ATOM 0 HA LYS A 64 -3.591 -0.492 -7.479 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -2.001 1.621 -6.752 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -1.347 0.365 -5.719 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -1.546 0.328 -8.747 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -0.087 0.405 -7.780 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -0.605 -1.854 -6.841 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -2.043 -1.930 -7.838 1.00 0.00 H new ATOM 0 HE2 LYS A 64 0.847 -1.831 -8.774 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -0.289 -3.151 -8.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -0.211 -2.046 -11.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -1.675 -1.548 -10.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -0.334 -0.507 -10.314 1.00 0.00 H new ATOM 852 N VAL A 65 -3.098 -0.854 -4.224 1.00 0.00 N ATOM 853 CA VAL A 65 -3.054 -1.839 -3.150 1.00 0.00 C ATOM 854 C VAL A 65 -4.389 -2.567 -3.018 1.00 0.00 C ATOM 855 O VAL A 65 -4.428 -3.776 -2.792 1.00 0.00 O ATOM 856 CB VAL A 65 -2.704 -1.185 -1.801 1.00 0.00 C ATOM 857 CG1 VAL A 65 -2.428 -2.248 -0.747 1.00 0.00 C ATOM 858 CG2 VAL A 65 -1.511 -0.254 -1.955 1.00 0.00 C ATOM 0 H VAL A 65 -2.992 0.112 -3.914 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.275 -2.556 -3.410 1.00 0.00 H new ATOM 0 HB VAL A 65 -3.558 -0.594 -1.471 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -2.182 -1.767 0.200 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -3.313 -2.871 -0.618 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -1.591 -2.868 -1.067 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -1.277 0.200 -0.992 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.650 -0.821 -2.307 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -1.750 0.528 -2.676 1.00 0.00 H new ATOM 868 N ASN A 66 -5.480 -1.821 -3.162 1.00 0.00 N ATOM 869 CA ASN A 66 -6.816 -2.394 -3.059 1.00 0.00 C ATOM 870 C ASN A 66 -7.057 -3.415 -4.168 1.00 0.00 C ATOM 871 O ASN A 66 -7.514 -4.529 -3.913 1.00 0.00 O ATOM 872 CB ASN A 66 -7.873 -1.291 -3.127 1.00 0.00 C ATOM 873 CG ASN A 66 -9.204 -1.798 -3.647 1.00 0.00 C ATOM 874 OD1 ASN A 66 -10.073 -2.201 -2.873 1.00 0.00 O ATOM 875 ND2 ASN A 66 -9.371 -1.779 -4.964 1.00 0.00 N ATOM 0 H ASN A 66 -5.464 -0.819 -3.350 1.00 0.00 H new ATOM 0 HA ASN A 66 -6.893 -2.903 -2.098 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -8.013 -0.864 -2.134 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -7.516 -0.488 -3.772 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -10.247 -2.107 -5.372 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -8.624 -1.436 -5.568 1.00 0.00 H new ATOM 881 N THR A 67 -6.746 -3.026 -5.401 1.00 0.00 N ATOM 882 CA THR A 67 -6.929 -3.905 -6.548 1.00 0.00 C ATOM 883 C THR A 67 -6.143 -5.200 -6.380 1.00 0.00 C ATOM 884 O THR A 67 -6.692 -6.294 -6.517 1.00 0.00 O ATOM 885 CB THR A 67 -6.493 -3.219 -7.856 1.00 0.00 C ATOM 886 OG1 THR A 67 -7.300 -2.061 -8.096 1.00 0.00 O ATOM 887 CG2 THR A 67 -6.608 -4.175 -9.034 1.00 0.00 C ATOM 0 H THR A 67 -6.366 -2.107 -5.630 1.00 0.00 H new ATOM 0 HA THR A 67 -7.993 -4.134 -6.604 1.00 0.00 H new ATOM 0 HB THR A 67 -5.450 -2.919 -7.751 1.00 0.00 H new ATOM 0 HG1 THR A 67 -6.876 -1.277 -7.690 1.00 0.00 H new ATOM 0 HG21 THR A 67 -6.295 -3.668 -9.946 1.00 0.00 H new ATOM 0 HG22 THR A 67 -5.969 -5.042 -8.863 1.00 0.00 H new ATOM 0 HG23 THR A 67 -7.643 -4.502 -9.138 1.00 0.00 H new ATOM 895 N LEU A 68 -4.855 -5.070 -6.081 1.00 0.00 N ATOM 896 CA LEU A 68 -3.992 -6.231 -5.893 1.00 0.00 C ATOM 897 C LEU A 68 -4.522 -7.128 -4.780 1.00 0.00 C ATOM 898 O LEU A 68 -4.418 -8.353 -4.853 1.00 0.00 O ATOM 899 CB LEU A 68 -2.566 -5.784 -5.568 1.00 0.00 C ATOM 900 CG LEU A 68 -1.831 -5.027 -6.675 1.00 0.00 C ATOM 901 CD1 LEU A 68 -0.597 -4.332 -6.119 1.00 0.00 C ATOM 902 CD2 LEU A 68 -1.448 -5.973 -7.804 1.00 0.00 C ATOM 0 H LEU A 68 -4.385 -4.172 -5.964 1.00 0.00 H new ATOM 0 HA LEU A 68 -3.984 -6.801 -6.822 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -2.598 -5.150 -4.682 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -1.981 -6.666 -5.308 1.00 0.00 H new ATOM 0 HG LEU A 68 -2.502 -4.267 -7.075 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -0.087 -3.799 -6.921 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -0.895 -3.624 -5.345 1.00 0.00 H new ATOM 0 HD13 LEU A 68 0.077 -5.074 -5.691 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -0.926 -5.417 -8.583 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.795 -6.756 -7.417 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -2.348 -6.424 -8.222 1.00 0.00 H new ATOM 913 N LEU A 69 -5.092 -6.512 -3.751 1.00 0.00 N ATOM 914 CA LEU A 69 -5.641 -7.254 -2.621 1.00 0.00 C ATOM 915 C LEU A 69 -6.696 -8.252 -3.088 1.00 0.00 C ATOM 916 O LEU A 69 -6.752 -9.383 -2.605 1.00 0.00 O ATOM 917 CB LEU A 69 -6.249 -6.292 -1.600 1.00 0.00 C ATOM 918 CG LEU A 69 -5.506 -6.170 -0.268 1.00 0.00 C ATOM 919 CD1 LEU A 69 -6.226 -5.203 0.658 1.00 0.00 C ATOM 920 CD2 LEU A 69 -5.362 -7.535 0.390 1.00 0.00 C ATOM 0 H LEU A 69 -5.186 -5.499 -3.675 1.00 0.00 H new ATOM 0 HA LEU A 69 -4.827 -7.806 -2.150 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.307 -5.302 -2.053 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.271 -6.609 -1.395 1.00 0.00 H new ATOM 0 HG LEU A 69 -4.508 -5.777 -0.465 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -5.683 -5.129 1.600 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -6.276 -4.220 0.190 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.236 -5.566 0.849 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -4.831 -7.429 1.336 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -6.350 -7.956 0.574 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.801 -8.199 -0.268 1.00 0.00 H new ATOM 931 N ASP A 70 -7.529 -7.826 -4.031 1.00 0.00 N ATOM 932 CA ASP A 70 -8.582 -8.683 -4.566 1.00 0.00 C ATOM 933 C ASP A 70 -8.001 -9.729 -5.514 1.00 0.00 C ATOM 934 O ASP A 70 -8.509 -10.847 -5.607 1.00 0.00 O ATOM 935 CB ASP A 70 -9.632 -7.844 -5.294 1.00 0.00 C ATOM 936 CG ASP A 70 -11.036 -8.382 -5.105 1.00 0.00 C ATOM 937 OD1 ASP A 70 -11.176 -9.592 -4.833 1.00 0.00 O ATOM 938 OD2 ASP A 70 -11.997 -7.594 -5.230 1.00 0.00 O ATOM 0 H ASP A 70 -7.496 -6.893 -4.441 1.00 0.00 H new ATOM 0 HA ASP A 70 -9.057 -9.198 -3.731 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -9.588 -6.817 -4.931 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -9.397 -7.816 -6.358 1.00 0.00 H new ATOM 942 N VAL A 71 -6.935 -9.357 -6.215 1.00 0.00 N ATOM 943 CA VAL A 71 -6.285 -10.263 -7.155 1.00 0.00 C ATOM 944 C VAL A 71 -5.548 -11.379 -6.424 1.00 0.00 C ATOM 945 O VAL A 71 -5.510 -12.519 -6.886 1.00 0.00 O ATOM 946 CB VAL A 71 -5.291 -9.512 -8.061 1.00 0.00 C ATOM 947 CG1 VAL A 71 -4.626 -10.473 -9.035 1.00 0.00 C ATOM 948 CG2 VAL A 71 -5.993 -8.387 -8.805 1.00 0.00 C ATOM 0 H VAL A 71 -6.503 -8.435 -6.150 1.00 0.00 H new ATOM 0 HA VAL A 71 -7.072 -10.697 -7.772 1.00 0.00 H new ATOM 0 HB VAL A 71 -4.515 -9.073 -7.434 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -3.927 -9.925 -9.667 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -4.087 -11.240 -8.479 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -5.386 -10.944 -9.658 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -5.275 -7.867 -9.440 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -6.791 -8.801 -9.422 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -6.417 -7.685 -8.087 1.00 0.00 H new ATOM 958 N ALA A 72 -4.964 -11.043 -5.279 1.00 0.00 N ATOM 959 CA ALA A 72 -4.229 -12.017 -4.482 1.00 0.00 C ATOM 960 C ALA A 72 -5.138 -13.154 -4.031 1.00 0.00 C ATOM 961 O ALA A 72 -4.807 -14.328 -4.197 1.00 0.00 O ATOM 962 CB ALA A 72 -3.591 -11.339 -3.277 1.00 0.00 C ATOM 0 H ALA A 72 -4.986 -10.104 -4.882 1.00 0.00 H new ATOM 0 HA ALA A 72 -3.442 -12.441 -5.106 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -3.045 -12.078 -2.690 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -2.903 -10.565 -3.617 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -4.368 -10.888 -2.660 1.00 0.00 H new ATOM 968 N GLN A 73 -6.285 -12.800 -3.460 1.00 0.00 N ATOM 969 CA GLN A 73 -7.241 -13.792 -2.983 1.00 0.00 C ATOM 970 C GLN A 73 -7.893 -14.523 -4.152 1.00 0.00 C ATOM 971 O GLN A 73 -8.166 -15.721 -4.074 1.00 0.00 O ATOM 972 CB GLN A 73 -8.313 -13.126 -2.119 1.00 0.00 C ATOM 973 CG GLN A 73 -7.747 -12.331 -0.954 1.00 0.00 C ATOM 974 CD GLN A 73 -8.770 -11.403 -0.329 1.00 0.00 C ATOM 975 OE1 GLN A 73 -8.906 -10.248 -0.732 1.00 0.00 O ATOM 976 NE2 GLN A 73 -9.497 -11.906 0.662 1.00 0.00 N ATOM 0 H GLN A 73 -6.575 -11.833 -3.316 1.00 0.00 H new ATOM 0 HA GLN A 73 -6.700 -14.520 -2.378 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -8.912 -12.463 -2.744 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -8.985 -13.893 -1.733 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -7.376 -13.020 -0.195 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -6.894 -11.746 -1.298 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -9.351 -12.869 0.964 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -10.202 -11.329 1.121 1.00 0.00 H new ATOM 983 N ALA A 74 -8.144 -13.793 -5.234 1.00 0.00 N ATOM 984 CA ALA A 74 -8.765 -14.372 -6.419 1.00 0.00 C ATOM 985 C ALA A 74 -7.825 -15.359 -7.104 1.00 0.00 C ATOM 986 O ALA A 74 -8.266 -16.348 -7.686 1.00 0.00 O ATOM 987 CB ALA A 74 -9.177 -13.274 -7.389 1.00 0.00 C ATOM 0 H ALA A 74 -7.927 -12.800 -5.314 1.00 0.00 H new ATOM 0 HA ALA A 74 -9.655 -14.916 -6.103 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -9.639 -13.721 -8.269 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.890 -12.608 -6.903 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.297 -12.706 -7.690 1.00 0.00 H new ATOM 993 N ASN A 75 -6.526 -15.081 -7.031 1.00 0.00 N ATOM 994 CA ASN A 75 -5.526 -15.944 -7.645 1.00 0.00 C ATOM 995 C ASN A 75 -5.257 -17.170 -6.777 1.00 0.00 C ATOM 996 O ASN A 75 -5.085 -18.279 -7.285 1.00 0.00 O ATOM 997 CB ASN A 75 -4.225 -15.170 -7.870 1.00 0.00 C ATOM 998 CG ASN A 75 -4.160 -14.536 -9.246 1.00 0.00 C ATOM 999 OD1 ASN A 75 -3.417 -14.990 -10.117 1.00 0.00 O ATOM 1000 ND2 ASN A 75 -4.941 -13.481 -9.448 1.00 0.00 N ATOM 0 H ASN A 75 -6.143 -14.265 -6.553 1.00 0.00 H new ATOM 0 HA ASN A 75 -5.914 -16.280 -8.607 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -4.131 -14.394 -7.111 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -3.378 -15.844 -7.743 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -4.941 -13.013 -10.354 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -5.541 -13.139 -8.697 1.00 0.00 H new ATOM 1006 N LEU A 76 -5.223 -16.963 -5.465 1.00 0.00 N ATOM 1007 CA LEU A 76 -4.976 -18.051 -4.525 1.00 0.00 C ATOM 1008 C LEU A 76 -6.177 -18.988 -4.449 1.00 0.00 C ATOM 1009 O LEU A 76 -6.028 -20.187 -4.220 1.00 0.00 O ATOM 1010 CB LEU A 76 -4.664 -17.489 -3.136 1.00 0.00 C ATOM 1011 CG LEU A 76 -3.338 -16.740 -2.997 1.00 0.00 C ATOM 1012 CD1 LEU A 76 -3.264 -16.032 -1.653 1.00 0.00 C ATOM 1013 CD2 LEU A 76 -2.166 -17.696 -3.164 1.00 0.00 C ATOM 0 H LEU A 76 -5.363 -16.052 -5.028 1.00 0.00 H new ATOM 0 HA LEU A 76 -4.117 -18.620 -4.882 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -5.471 -16.815 -2.849 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -4.669 -18.313 -2.423 1.00 0.00 H new ATOM 0 HG LEU A 76 -3.282 -15.988 -3.784 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -2.314 -15.504 -1.572 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -4.084 -15.318 -1.572 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -3.342 -16.766 -0.851 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -1.230 -17.146 -3.062 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -2.217 -18.471 -2.399 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -2.210 -18.157 -4.151 1.00 0.00 H new ATOM 1024 N GLY A 77 -7.369 -18.431 -4.646 1.00 0.00 N ATOM 1025 CA GLY A 77 -8.578 -19.232 -4.599 1.00 0.00 C ATOM 1026 C GLY A 77 -8.999 -19.562 -3.181 1.00 0.00 C ATOM 1027 O GLY A 77 -10.079 -19.170 -2.741 1.00 0.00 O ATOM 0 H GLY A 77 -7.518 -17.440 -4.837 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -9.385 -18.696 -5.099 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -8.419 -20.158 -5.152 1.00 0.00 H new ATOM 1031 N GLU A 78 -8.145 -20.288 -2.465 1.00 0.00 N ATOM 1032 CA GLU A 78 -8.436 -20.673 -1.089 1.00 0.00 C ATOM 1033 C GLU A 78 -8.819 -19.454 -0.253 1.00 0.00 C ATOM 1034 O GLU A 78 -9.715 -19.522 0.587 1.00 0.00 O ATOM 1035 CB GLU A 78 -7.229 -21.375 -0.465 1.00 0.00 C ATOM 1036 CG GLU A 78 -7.589 -22.297 0.687 1.00 0.00 C ATOM 1037 CD GLU A 78 -6.369 -22.895 1.359 1.00 0.00 C ATOM 1038 OE1 GLU A 78 -5.256 -22.373 1.142 1.00 0.00 O ATOM 1039 OE2 GLU A 78 -6.527 -23.885 2.104 1.00 0.00 O ATOM 0 H GLU A 78 -7.247 -20.621 -2.815 1.00 0.00 H new ATOM 0 HA GLU A 78 -9.280 -21.363 -1.103 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -6.717 -21.952 -1.235 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -6.525 -20.622 -0.110 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -8.169 -21.742 1.424 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -8.227 -23.101 0.319 1.00 0.00 H new ATOM 1044 N ALA A 79 -8.131 -18.342 -0.490 1.00 0.00 N ATOM 1045 CA ALA A 79 -8.400 -17.109 0.239 1.00 0.00 C ATOM 1046 C ALA A 79 -9.836 -16.645 0.025 1.00 0.00 C ATOM 1047 O ALA A 79 -10.627 -16.587 0.965 1.00 0.00 O ATOM 1048 CB ALA A 79 -7.423 -16.022 -0.186 1.00 0.00 C ATOM 0 H ALA A 79 -7.384 -18.270 -1.181 1.00 0.00 H new ATOM 0 HA ALA A 79 -8.266 -17.308 1.302 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -7.635 -15.106 0.366 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -6.404 -16.346 0.026 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -7.530 -15.834 -1.254 1.00 0.00 H new ATOM 1054 N ALA A 80 -10.166 -16.314 -1.220 1.00 0.00 N ATOM 1055 CA ALA A 80 -11.509 -15.856 -1.558 1.00 0.00 C ATOM 1056 C ALA A 80 -12.304 -16.955 -2.254 1.00 0.00 C ATOM 1057 O ALA A 80 -13.213 -17.543 -1.669 1.00 0.00 O ATOM 1058 CB ALA A 80 -11.438 -14.616 -2.437 1.00 0.00 C ATOM 0 H ALA A 80 -9.522 -16.354 -2.010 1.00 0.00 H new ATOM 0 HA ALA A 80 -12.024 -15.602 -0.631 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -12.447 -14.285 -2.682 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -10.915 -13.822 -1.904 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -10.901 -14.852 -3.356 1.00 0.00 H new ATOM 1064 N GLY A 81 -11.956 -17.229 -3.507 1.00 0.00 N ATOM 1065 CA GLY A 81 -12.649 -18.256 -4.262 1.00 0.00 C ATOM 1066 C GLY A 81 -13.537 -17.679 -5.347 1.00 0.00 C ATOM 1067 O GLY A 81 -14.457 -18.343 -5.827 1.00 0.00 O ATOM 0 H GLY A 81 -11.206 -16.758 -4.013 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -11.918 -18.926 -4.714 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -13.254 -18.856 -3.582 1.00 0.00 H new ATOM 1071 N THR A 82 -13.264 -16.437 -5.736 1.00 0.00 N ATOM 1072 CA THR A 82 -14.047 -15.770 -6.768 1.00 0.00 C ATOM 1073 C THR A 82 -13.808 -16.403 -8.134 1.00 0.00 C ATOM 1074 O THR A 82 -12.931 -17.253 -8.290 1.00 0.00 O ATOM 1075 CB THR A 82 -13.711 -14.269 -6.844 1.00 0.00 C ATOM 1076 OG1 THR A 82 -14.630 -13.605 -7.721 1.00 0.00 O ATOM 1077 CG2 THR A 82 -12.289 -14.056 -7.338 1.00 0.00 C ATOM 0 H THR A 82 -12.506 -15.873 -5.351 1.00 0.00 H new ATOM 0 HA THR A 82 -15.096 -15.887 -6.495 1.00 0.00 H new ATOM 0 HB THR A 82 -13.797 -13.850 -5.842 1.00 0.00 H new ATOM 0 HG1 THR A 82 -14.411 -12.651 -7.763 1.00 0.00 H new ATOM 0 HG21 THR A 82 -12.076 -12.988 -7.383 1.00 0.00 H new ATOM 0 HG22 THR A 82 -11.590 -14.537 -6.654 1.00 0.00 H new ATOM 0 HG23 THR A 82 -12.180 -14.490 -8.332 1.00 0.00 H new ATOM 1085 N TYR A 83 -14.591 -15.982 -9.121 1.00 0.00 N ATOM 1086 CA TYR A 83 -14.466 -16.509 -10.474 1.00 0.00 C ATOM 1087 C TYR A 83 -13.601 -15.595 -11.337 1.00 0.00 C ATOM 1088 O TYR A 83 -13.086 -14.581 -10.865 1.00 0.00 O ATOM 1089 CB TYR A 83 -15.847 -16.673 -11.110 1.00 0.00 C ATOM 1090 CG TYR A 83 -16.564 -15.362 -11.347 1.00 0.00 C ATOM 1091 CD1 TYR A 83 -16.317 -14.609 -12.488 1.00 0.00 C ATOM 1092 CD2 TYR A 83 -17.486 -14.878 -10.427 1.00 0.00 C ATOM 1093 CE1 TYR A 83 -16.971 -13.411 -12.707 1.00 0.00 C ATOM 1094 CE2 TYR A 83 -18.144 -13.682 -10.639 1.00 0.00 C ATOM 1095 CZ TYR A 83 -17.883 -12.952 -11.781 1.00 0.00 C ATOM 1096 OH TYR A 83 -18.535 -11.759 -11.994 1.00 0.00 O ATOM 0 H TYR A 83 -15.319 -15.277 -9.009 1.00 0.00 H new ATOM 0 HA TYR A 83 -13.984 -17.485 -10.413 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -15.740 -17.196 -12.060 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -16.462 -17.303 -10.467 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -15.603 -14.965 -13.215 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -17.692 -15.446 -9.532 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -16.768 -12.837 -13.599 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -18.859 -13.320 -9.915 1.00 0.00 H new ATOM 0 HH TYR A 83 -19.144 -11.581 -11.247 1.00 0.00 H new ATOM 1105 N VAL A 84 -13.446 -15.961 -12.605 1.00 0.00 N ATOM 1106 CA VAL A 84 -12.645 -15.174 -13.536 1.00 0.00 C ATOM 1107 C VAL A 84 -13.243 -13.786 -13.737 1.00 0.00 C ATOM 1108 O VAL A 84 -14.108 -13.590 -14.589 1.00 0.00 O ATOM 1109 CB VAL A 84 -12.527 -15.873 -14.903 1.00 0.00 C ATOM 1110 CG1 VAL A 84 -13.897 -16.307 -15.402 1.00 0.00 C ATOM 1111 CG2 VAL A 84 -11.848 -14.958 -15.912 1.00 0.00 C ATOM 0 H VAL A 84 -13.864 -16.798 -13.012 1.00 0.00 H new ATOM 0 HA VAL A 84 -11.651 -15.079 -13.098 1.00 0.00 H new ATOM 0 HB VAL A 84 -11.912 -16.765 -14.783 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -13.793 -16.799 -16.369 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -14.341 -17.001 -14.688 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -14.540 -15.433 -15.507 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -11.773 -15.468 -16.872 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -12.435 -14.047 -16.030 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -10.849 -14.703 -15.557 1.00 0.00 H new ATOM 1121 N ALA A 85 -12.774 -12.827 -12.946 1.00 0.00 N ATOM 1122 CA ALA A 85 -13.260 -11.455 -13.039 1.00 0.00 C ATOM 1123 C ALA A 85 -12.174 -10.522 -13.565 1.00 0.00 C ATOM 1124 O ALA A 85 -12.067 -9.375 -13.135 1.00 0.00 O ATOM 1125 CB ALA A 85 -13.757 -10.978 -11.681 1.00 0.00 C ATOM 0 H ALA A 85 -12.059 -12.974 -12.234 1.00 0.00 H new ATOM 0 HA ALA A 85 -14.091 -11.437 -13.745 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -14.117 -9.953 -11.765 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -14.570 -11.621 -11.345 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -12.940 -11.018 -10.960 1.00 0.00 H new ATOM 1131 N ALA A 86 -11.370 -11.024 -14.496 1.00 0.00 N ATOM 1132 CA ALA A 86 -10.293 -10.235 -15.081 1.00 0.00 C ATOM 1133 C ALA A 86 -10.782 -9.453 -16.295 1.00 0.00 C ATOM 1134 O ALA A 86 -10.232 -8.405 -16.633 1.00 0.00 O ATOM 1135 CB ALA A 86 -9.127 -11.135 -15.465 1.00 0.00 C ATOM 0 H ALA A 86 -11.444 -11.973 -14.861 1.00 0.00 H new ATOM 0 HA ALA A 86 -9.954 -9.519 -14.333 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -8.330 -10.532 -15.901 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -8.753 -11.644 -14.577 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -9.462 -11.874 -16.193 1.00 0.00 H new ATOM 1141 N ASP A 87 -11.819 -9.968 -16.946 1.00 0.00 N ATOM 1142 CA ASP A 87 -12.383 -9.318 -18.123 1.00 0.00 C ATOM 1143 C ASP A 87 -11.353 -9.237 -19.245 1.00 0.00 C ATOM 1144 O ASP A 87 -10.260 -9.795 -19.141 1.00 0.00 O ATOM 1145 CB ASP A 87 -12.880 -7.916 -17.768 1.00 0.00 C ATOM 1146 CG ASP A 87 -14.194 -7.579 -18.443 1.00 0.00 C ATOM 1147 OD1 ASP A 87 -15.113 -8.423 -18.409 1.00 0.00 O ATOM 1148 OD2 ASP A 87 -14.304 -6.470 -19.008 1.00 0.00 O ATOM 0 H ASP A 87 -12.286 -10.834 -16.678 1.00 0.00 H new ATOM 0 HA ASP A 87 -13.225 -9.917 -18.470 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -13.000 -7.839 -16.687 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -12.127 -7.183 -18.058 1.00 0.00 H new ATOM 1152 N ALA A 88 -11.708 -8.539 -20.319 1.00 0.00 N ATOM 1153 CA ALA A 88 -10.815 -8.384 -21.460 1.00 0.00 C ATOM 1154 C ALA A 88 -10.281 -6.959 -21.551 1.00 0.00 C ATOM 1155 O ALA A 88 -9.148 -6.735 -21.975 1.00 0.00 O ATOM 1156 CB ALA A 88 -11.532 -8.763 -22.747 1.00 0.00 C ATOM 0 H ALA A 88 -12.609 -8.072 -20.422 1.00 0.00 H new ATOM 0 HA ALA A 88 -9.967 -9.054 -21.318 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -10.853 -8.642 -23.591 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -11.858 -9.801 -22.689 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -12.399 -8.117 -22.884 1.00 0.00 H new ATOM 1162 N ALA A 89 -11.105 -5.996 -21.149 1.00 0.00 N ATOM 1163 CA ALA A 89 -10.716 -4.592 -21.183 1.00 0.00 C ATOM 1164 C ALA A 89 -9.944 -4.206 -19.925 1.00 0.00 C ATOM 1165 O ALA A 89 -8.896 -3.565 -20.000 1.00 0.00 O ATOM 1166 CB ALA A 89 -11.943 -3.707 -21.345 1.00 0.00 C ATOM 0 H ALA A 89 -12.047 -6.164 -20.796 1.00 0.00 H new ATOM 0 HA ALA A 89 -10.060 -4.443 -22.041 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -11.637 -2.661 -21.369 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -12.452 -3.957 -22.276 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -12.621 -3.868 -20.507 1.00 0.00 H new ATOM 1172 N ALA A 90 -10.471 -4.599 -18.769 1.00 0.00 N ATOM 1173 CA ALA A 90 -9.831 -4.294 -17.497 1.00 0.00 C ATOM 1174 C ALA A 90 -8.370 -4.731 -17.497 1.00 0.00 C ATOM 1175 O ALA A 90 -7.471 -3.924 -17.264 1.00 0.00 O ATOM 1176 CB ALA A 90 -10.583 -4.963 -16.355 1.00 0.00 C ATOM 0 H ALA A 90 -11.339 -5.129 -18.689 1.00 0.00 H new ATOM 0 HA ALA A 90 -9.859 -3.214 -17.355 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -10.094 -4.727 -15.410 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -11.610 -4.599 -16.333 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -10.584 -6.043 -16.503 1.00 0.00 H new ATOM 1182 N ALA A 91 -8.140 -6.013 -17.762 1.00 0.00 N ATOM 1183 CA ALA A 91 -6.788 -6.557 -17.795 1.00 0.00 C ATOM 1184 C ALA A 91 -6.018 -6.038 -19.005 1.00 0.00 C ATOM 1185 O ALA A 91 -4.898 -5.545 -18.874 1.00 0.00 O ATOM 1186 CB ALA A 91 -6.831 -8.077 -17.805 1.00 0.00 C ATOM 0 H ALA A 91 -8.873 -6.695 -17.957 1.00 0.00 H new ATOM 0 HA ALA A 91 -6.267 -6.226 -16.897 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -5.814 -8.470 -17.830 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -7.336 -8.433 -16.907 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -7.374 -8.420 -18.686 1.00 0.00 H new ATOM 1192 N SER A 92 -6.625 -6.156 -20.181 1.00 0.00 N ATOM 1193 CA SER A 92 -5.994 -5.703 -21.415 1.00 0.00 C ATOM 1194 C SER A 92 -4.687 -6.450 -21.662 1.00 0.00 C ATOM 1195 O SER A 92 -4.298 -7.321 -20.883 1.00 0.00 O ATOM 1196 CB SER A 92 -5.731 -4.198 -21.357 1.00 0.00 C ATOM 1197 OG SER A 92 -6.596 -3.494 -22.231 1.00 0.00 O ATOM 0 H SER A 92 -7.553 -6.561 -20.306 1.00 0.00 H new ATOM 0 HA SER A 92 -6.675 -5.913 -22.240 1.00 0.00 H new ATOM 0 HB2 SER A 92 -5.871 -3.841 -20.337 1.00 0.00 H new ATOM 0 HB3 SER A 92 -4.694 -3.996 -21.626 1.00 0.00 H new ATOM 0 HG SER A 92 -7.455 -3.338 -21.786 1.00 0.00 H new ATOM 1202 N THR A 93 -4.012 -6.104 -22.754 1.00 0.00 N ATOM 1203 CA THR A 93 -2.749 -6.741 -23.106 1.00 0.00 C ATOM 1204 C THR A 93 -1.622 -6.268 -22.196 1.00 0.00 C ATOM 1205 O THR A 93 -1.792 -5.331 -21.416 1.00 0.00 O ATOM 1206 CB THR A 93 -2.364 -6.454 -24.570 1.00 0.00 C ATOM 1207 OG1 THR A 93 -1.249 -7.268 -24.952 1.00 0.00 O ATOM 1208 CG2 THR A 93 -2.016 -4.987 -24.761 1.00 0.00 C ATOM 0 H THR A 93 -4.319 -5.386 -23.410 1.00 0.00 H new ATOM 0 HA THR A 93 -2.890 -7.814 -22.978 1.00 0.00 H new ATOM 0 HB THR A 93 -3.220 -6.692 -25.201 1.00 0.00 H new ATOM 0 HG1 THR A 93 -0.416 -6.779 -24.788 1.00 0.00 H new ATOM 0 HG21 THR A 93 -1.748 -4.809 -25.802 1.00 0.00 H new ATOM 0 HG22 THR A 93 -2.876 -4.372 -24.498 1.00 0.00 H new ATOM 0 HG23 THR A 93 -1.174 -4.726 -24.120 1.00 0.00 H new ATOM 1216 N TYR A 94 -0.470 -6.922 -22.298 1.00 0.00 N ATOM 1217 CA TYR A 94 0.685 -6.569 -21.482 1.00 0.00 C ATOM 1218 C TYR A 94 1.041 -5.096 -21.651 1.00 0.00 C ATOM 1219 O TYR A 94 1.543 -4.456 -20.725 1.00 0.00 O ATOM 1220 CB TYR A 94 1.885 -7.442 -21.855 1.00 0.00 C ATOM 1221 CG TYR A 94 2.338 -7.270 -23.287 1.00 0.00 C ATOM 1222 CD1 TYR A 94 3.261 -6.291 -23.631 1.00 0.00 C ATOM 1223 CD2 TYR A 94 1.841 -8.087 -24.297 1.00 0.00 C ATOM 1224 CE1 TYR A 94 3.677 -6.130 -24.939 1.00 0.00 C ATOM 1225 CE2 TYR A 94 2.252 -7.933 -25.606 1.00 0.00 C ATOM 1226 CZ TYR A 94 3.170 -6.953 -25.923 1.00 0.00 C ATOM 1227 OH TYR A 94 3.583 -6.796 -27.226 1.00 0.00 O ATOM 0 H TYR A 94 -0.312 -7.700 -22.938 1.00 0.00 H new ATOM 0 HA TYR A 94 0.428 -6.744 -20.437 1.00 0.00 H new ATOM 0 HB2 TYR A 94 2.716 -7.207 -21.189 1.00 0.00 H new ATOM 0 HB3 TYR A 94 1.629 -8.488 -21.687 1.00 0.00 H new ATOM 0 HD1 TYR A 94 3.660 -5.645 -22.863 1.00 0.00 H new ATOM 0 HD2 TYR A 94 1.122 -8.855 -24.053 1.00 0.00 H new ATOM 0 HE1 TYR A 94 4.396 -5.364 -25.190 1.00 0.00 H new ATOM 0 HE2 TYR A 94 1.857 -8.577 -26.378 1.00 0.00 H new ATOM 0 HH TYR A 94 4.496 -6.439 -27.239 1.00 0.00 H new ATOM 1236 N THR A 95 0.780 -4.562 -22.840 1.00 0.00 N ATOM 1237 CA THR A 95 1.073 -3.165 -23.132 1.00 0.00 C ATOM 1238 C THR A 95 2.552 -2.859 -22.925 1.00 0.00 C ATOM 1239 O THR A 95 2.975 -2.509 -21.823 1.00 0.00 O ATOM 1240 CB THR A 95 0.235 -2.219 -22.252 1.00 0.00 C ATOM 1241 OG1 THR A 95 -1.141 -2.612 -22.283 1.00 0.00 O ATOM 1242 CG2 THR A 95 0.368 -0.780 -22.724 1.00 0.00 C ATOM 0 H THR A 95 0.366 -5.077 -23.617 1.00 0.00 H new ATOM 0 HA THR A 95 0.814 -2.999 -24.178 1.00 0.00 H new ATOM 0 HB THR A 95 0.608 -2.284 -21.230 1.00 0.00 H new ATOM 0 HG1 THR A 95 -1.238 -3.495 -21.869 1.00 0.00 H new ATOM 0 HG21 THR A 95 -0.233 -0.131 -22.087 1.00 0.00 H new ATOM 0 HG22 THR A 95 1.413 -0.475 -22.670 1.00 0.00 H new ATOM 0 HG23 THR A 95 0.019 -0.701 -23.754 1.00 0.00 H new ATOM 1250 N GLY A 96 3.335 -2.990 -23.991 1.00 0.00 N ATOM 1251 CA GLY A 96 4.758 -2.722 -23.905 1.00 0.00 C ATOM 1252 C GLY A 96 5.476 -2.970 -25.217 1.00 0.00 C ATOM 1253 O GLY A 96 4.897 -2.806 -26.290 1.00 0.00 O ATOM 0 H GLY A 96 3.009 -3.277 -24.914 1.00 0.00 H new ATOM 0 HA2 GLY A 96 4.912 -1.687 -23.601 1.00 0.00 H new ATOM 0 HA3 GLY A 96 5.197 -3.351 -23.130 1.00 0.00 H new ATOM 1257 N PHE A 97 6.742 -3.365 -25.131 1.00 0.00 N ATOM 1258 CA PHE A 97 7.541 -3.633 -26.321 1.00 0.00 C ATOM 1259 C PHE A 97 7.530 -5.121 -26.658 1.00 0.00 C ATOM 1260 O PHE A 97 6.478 -5.653 -27.006 1.00 0.00 O ATOM 1261 CB PHE A 97 8.980 -3.155 -26.113 1.00 0.00 C ATOM 1262 CG PHE A 97 9.488 -2.283 -27.225 1.00 0.00 C ATOM 1263 CD1 PHE A 97 8.966 -1.014 -27.422 1.00 0.00 C ATOM 1264 CD2 PHE A 97 10.488 -2.731 -28.074 1.00 0.00 C ATOM 1265 CE1 PHE A 97 9.432 -0.208 -28.444 1.00 0.00 C ATOM 1266 CE2 PHE A 97 10.957 -1.929 -29.097 1.00 0.00 C ATOM 1267 CZ PHE A 97 10.428 -0.667 -29.283 1.00 0.00 C ATOM 0 H PHE A 97 7.236 -3.507 -24.250 1.00 0.00 H new ATOM 0 HA PHE A 97 7.102 -3.086 -27.155 1.00 0.00 H new ATOM 0 HB2 PHE A 97 9.039 -2.604 -25.174 1.00 0.00 H new ATOM 0 HB3 PHE A 97 9.632 -4.023 -26.016 1.00 0.00 H new ATOM 0 HD1 PHE A 97 8.186 -0.651 -26.769 1.00 0.00 H new ATOM 0 HD2 PHE A 97 10.905 -3.717 -27.934 1.00 0.00 H new ATOM 0 HE1 PHE A 97 9.018 0.779 -28.586 1.00 0.00 H new ATOM 0 HE2 PHE A 97 11.737 -2.289 -29.751 1.00 0.00 H new ATOM 0 HZ PHE A 97 10.793 -0.040 -30.083 1.00 0.00 H new TER 1276 PHE A 97 ATOM 1277 N SER B 601 5.865 29.895 10.408 1.00 0.00 N ATOM 1278 CA SER B 601 6.971 30.828 10.596 1.00 0.00 C ATOM 1279 C SER B 601 8.312 30.125 10.410 1.00 0.00 C ATOM 1280 O SER B 601 9.266 30.380 11.144 1.00 0.00 O ATOM 1281 CB SER B 601 6.902 31.459 11.988 1.00 0.00 C ATOM 1282 OG SER B 601 7.671 32.647 12.048 1.00 0.00 O ATOM 0 HA SER B 601 6.884 31.613 9.844 1.00 0.00 H new ATOM 0 HB2 SER B 601 5.865 31.680 12.239 1.00 0.00 H new ATOM 0 HB3 SER B 601 7.265 30.749 12.731 1.00 0.00 H new ATOM 0 HG SER B 601 8.591 32.455 11.771 1.00 0.00 H new ATOM 1287 N MET B 602 8.376 29.239 9.421 1.00 0.00 N ATOM 1288 CA MET B 602 9.601 28.500 9.136 1.00 0.00 C ATOM 1289 C MET B 602 9.836 28.396 7.633 1.00 0.00 C ATOM 1290 O MET B 602 10.076 27.310 7.106 1.00 0.00 O ATOM 1291 CB MET B 602 9.532 27.101 9.751 1.00 0.00 C ATOM 1292 CG MET B 602 9.864 27.071 11.234 1.00 0.00 C ATOM 1293 SD MET B 602 9.184 25.625 12.070 1.00 0.00 S ATOM 1294 CE MET B 602 10.630 24.573 12.155 1.00 0.00 C ATOM 0 H MET B 602 7.595 29.016 8.804 1.00 0.00 H new ATOM 0 HA MET B 602 10.435 29.044 9.579 1.00 0.00 H new ATOM 0 HB2 MET B 602 8.530 26.697 9.603 1.00 0.00 H new ATOM 0 HB3 MET B 602 10.222 26.445 9.220 1.00 0.00 H new ATOM 0 HG2 MET B 602 10.947 27.083 11.360 1.00 0.00 H new ATOM 0 HG3 MET B 602 9.478 27.974 11.707 1.00 0.00 H new ATOM 0 HE1 MET B 602 10.370 23.636 12.648 1.00 0.00 H new ATOM 0 HE2 MET B 602 10.989 24.365 11.147 1.00 0.00 H new ATOM 0 HE3 MET B 602 11.413 25.076 12.722 1.00 0.00 H new ATOM 1302 N SER B 603 9.765 29.533 6.948 1.00 0.00 N ATOM 1303 CA SER B 603 9.966 29.568 5.504 1.00 0.00 C ATOM 1304 C SER B 603 11.247 30.316 5.152 1.00 0.00 C ATOM 1305 O SER B 603 11.710 30.274 4.013 1.00 0.00 O ATOM 1306 CB SER B 603 8.770 30.232 4.817 1.00 0.00 C ATOM 1307 OG SER B 603 8.690 31.607 5.149 1.00 0.00 O ATOM 0 H SER B 603 9.570 30.441 7.369 1.00 0.00 H new ATOM 0 HA SER B 603 10.056 28.541 5.150 1.00 0.00 H new ATOM 0 HB2 SER B 603 8.859 30.120 3.736 1.00 0.00 H new ATOM 0 HB3 SER B 603 7.850 29.729 5.115 1.00 0.00 H new ATOM 0 HG SER B 603 7.919 32.008 4.696 1.00 0.00 H new ATOM 1312 N GLN B 604 11.816 31.002 6.140 1.00 0.00 N ATOM 1313 CA GLN B 604 13.044 31.761 5.935 1.00 0.00 C ATOM 1314 C GLN B 604 14.270 30.894 6.206 1.00 0.00 C ATOM 1315 O GLN B 604 15.391 31.398 6.291 1.00 0.00 O ATOM 1316 CB GLN B 604 13.064 32.992 6.842 1.00 0.00 C ATOM 1317 CG GLN B 604 13.105 32.655 8.324 1.00 0.00 C ATOM 1318 CD GLN B 604 12.912 33.875 9.205 1.00 0.00 C ATOM 1319 OE1 GLN B 604 11.875 34.031 9.850 1.00 0.00 O ATOM 1320 NE2 GLN B 604 13.913 34.748 9.236 1.00 0.00 N ATOM 0 H GLN B 604 11.446 31.047 7.089 1.00 0.00 H new ATOM 0 HA GLN B 604 13.073 32.085 4.895 1.00 0.00 H new ATOM 0 HB2 GLN B 604 13.932 33.603 6.593 1.00 0.00 H new ATOM 0 HB3 GLN B 604 12.180 33.597 6.640 1.00 0.00 H new ATOM 0 HG2 GLN B 604 12.329 31.923 8.548 1.00 0.00 H new ATOM 0 HG3 GLN B 604 14.061 32.188 8.560 1.00 0.00 H new ATOM 0 HE21 GLN B 604 14.755 34.579 8.685 1.00 0.00 H new ATOM 0 HE22 GLN B 604 13.840 35.588 9.811 1.00 0.00 H new ATOM 1327 N ILE B 605 14.050 29.591 6.341 1.00 0.00 N ATOM 1328 CA ILE B 605 15.137 28.656 6.600 1.00 0.00 C ATOM 1329 C ILE B 605 15.413 27.781 5.383 1.00 0.00 C ATOM 1330 O ILE B 605 14.868 28.013 4.304 1.00 0.00 O ATOM 1331 CB ILE B 605 14.825 27.752 7.808 1.00 0.00 C ATOM 1332 CG1 ILE B 605 13.694 28.354 8.645 1.00 0.00 C ATOM 1333 CG2 ILE B 605 16.071 27.554 8.658 1.00 0.00 C ATOM 1334 CD1 ILE B 605 14.056 29.671 9.292 1.00 0.00 C ATOM 0 H ILE B 605 13.128 29.159 6.275 1.00 0.00 H new ATOM 0 HA ILE B 605 16.021 29.254 6.821 1.00 0.00 H new ATOM 0 HB ILE B 605 14.501 26.779 7.440 1.00 0.00 H new ATOM 0 HG12 ILE B 605 12.820 28.499 8.010 1.00 0.00 H new ATOM 0 HG13 ILE B 605 13.410 27.643 9.421 1.00 0.00 H new ATOM 0 HG21 ILE B 605 15.834 26.913 9.507 1.00 0.00 H new ATOM 0 HG22 ILE B 605 16.851 27.086 8.057 1.00 0.00 H new ATOM 0 HG23 ILE B 605 16.422 28.520 9.020 1.00 0.00 H new ATOM 0 HD11 ILE B 605 13.207 30.038 9.869 1.00 0.00 H new ATOM 0 HD12 ILE B 605 14.910 29.529 9.954 1.00 0.00 H new ATOM 0 HD13 ILE B 605 14.312 30.397 8.520 1.00 0.00 H new ATOM 1345 N MET B 606 16.263 26.775 5.564 1.00 0.00 N ATOM 1346 CA MET B 606 16.609 25.864 4.480 1.00 0.00 C ATOM 1347 C MET B 606 15.386 25.074 4.022 1.00 0.00 C ATOM 1348 O MET B 606 14.892 24.206 4.741 1.00 0.00 O ATOM 1349 CB MET B 606 17.713 24.902 4.926 1.00 0.00 C ATOM 1350 CG MET B 606 17.367 24.120 6.183 1.00 0.00 C ATOM 1351 SD MET B 606 18.829 23.548 7.068 1.00 0.00 S ATOM 1352 CE MET B 606 19.807 22.892 5.719 1.00 0.00 C ATOM 0 H MET B 606 16.724 26.571 6.451 1.00 0.00 H new ATOM 0 HA MET B 606 16.971 26.459 3.641 1.00 0.00 H new ATOM 0 HB2 MET B 606 17.921 24.201 4.118 1.00 0.00 H new ATOM 0 HB3 MET B 606 18.628 25.468 5.100 1.00 0.00 H new ATOM 0 HG2 MET B 606 16.769 24.748 6.844 1.00 0.00 H new ATOM 0 HG3 MET B 606 16.751 23.262 5.915 1.00 0.00 H new ATOM 0 HE1 MET B 606 20.597 22.256 6.118 1.00 0.00 H new ATOM 0 HE2 MET B 606 19.168 22.306 5.058 1.00 0.00 H new ATOM 0 HE3 MET B 606 20.252 23.714 5.159 1.00 0.00 H new ATOM 1360 N TYR B 607 14.905 25.381 2.822 1.00 0.00 N ATOM 1361 CA TYR B 607 13.739 24.703 2.270 1.00 0.00 C ATOM 1362 C TYR B 607 13.754 24.748 0.745 1.00 0.00 C ATOM 1363 O TYR B 607 12.768 25.131 0.115 1.00 0.00 O ATOM 1364 CB TYR B 607 12.453 25.342 2.798 1.00 0.00 C ATOM 1365 CG TYR B 607 12.155 25.001 4.241 1.00 0.00 C ATOM 1366 CD1 TYR B 607 11.458 23.846 4.572 1.00 0.00 C ATOM 1367 CD2 TYR B 607 12.572 25.834 5.272 1.00 0.00 C ATOM 1368 CE1 TYR B 607 11.184 23.530 5.889 1.00 0.00 C ATOM 1369 CE2 TYR B 607 12.303 25.526 6.592 1.00 0.00 C ATOM 1370 CZ TYR B 607 11.608 24.373 6.895 1.00 0.00 C ATOM 1371 OH TYR B 607 11.337 24.063 8.208 1.00 0.00 O ATOM 0 H TYR B 607 15.305 26.095 2.213 1.00 0.00 H new ATOM 0 HA TYR B 607 13.774 23.660 2.585 1.00 0.00 H new ATOM 0 HB2 TYR B 607 12.527 26.425 2.697 1.00 0.00 H new ATOM 0 HB3 TYR B 607 11.616 25.021 2.177 1.00 0.00 H new ATOM 0 HD1 TYR B 607 11.125 23.184 3.787 1.00 0.00 H new ATOM 0 HD2 TYR B 607 13.116 26.737 5.038 1.00 0.00 H new ATOM 0 HE1 TYR B 607 10.641 22.628 6.129 1.00 0.00 H new ATOM 0 HE2 TYR B 607 12.635 26.184 7.382 1.00 0.00 H new ATOM 0 HH TYR B 607 11.705 24.759 8.791 1.00 0.00 H new ATOM 1380 N ASN B 608 14.880 24.354 0.159 1.00 0.00 N ATOM 1381 CA ASN B 608 15.025 24.350 -1.292 1.00 0.00 C ATOM 1382 C ASN B 608 14.589 23.009 -1.878 1.00 0.00 C ATOM 1383 O ASN B 608 14.164 22.932 -3.031 1.00 0.00 O ATOM 1384 CB ASN B 608 16.475 24.642 -1.682 1.00 0.00 C ATOM 1385 CG ASN B 608 16.893 26.057 -1.330 1.00 0.00 C ATOM 1386 OD1 ASN B 608 17.091 26.385 -0.160 1.00 0.00 O ATOM 1387 ND2 ASN B 608 17.032 26.902 -2.345 1.00 0.00 N ATOM 0 H ASN B 608 15.705 24.034 0.666 1.00 0.00 H new ATOM 0 HA ASN B 608 14.383 25.131 -1.699 1.00 0.00 H new ATOM 0 HB2 ASN B 608 17.134 23.935 -1.178 1.00 0.00 H new ATOM 0 HB3 ASN B 608 16.599 24.485 -2.753 1.00 0.00 H new ATOM 0 HD21 ASN B 608 17.314 27.867 -2.171 1.00 0.00 H new ATOM 0 HD22 ASN B 608 16.857 26.586 -3.299 1.00 0.00 H new ATOM 1393 N TYR B 609 14.698 21.956 -1.075 1.00 0.00 N ATOM 1394 CA TYR B 609 14.318 20.619 -1.514 1.00 0.00 C ATOM 1395 C TYR B 609 13.129 20.100 -0.711 1.00 0.00 C ATOM 1396 O TYR B 609 12.826 20.582 0.381 1.00 0.00 O ATOM 1397 CB TYR B 609 15.500 19.658 -1.375 1.00 0.00 C ATOM 1398 CG TYR B 609 16.403 19.629 -2.587 1.00 0.00 C ATOM 1399 CD1 TYR B 609 15.888 19.398 -3.856 1.00 0.00 C ATOM 1400 CD2 TYR B 609 17.771 19.834 -2.463 1.00 0.00 C ATOM 1401 CE1 TYR B 609 16.709 19.369 -4.966 1.00 0.00 C ATOM 1402 CE2 TYR B 609 18.600 19.808 -3.568 1.00 0.00 C ATOM 1403 CZ TYR B 609 18.064 19.575 -4.817 1.00 0.00 C ATOM 1404 OH TYR B 609 18.886 19.549 -5.921 1.00 0.00 O ATOM 0 H TYR B 609 15.046 22.003 -0.117 1.00 0.00 H new ATOM 0 HA TYR B 609 14.028 20.677 -2.563 1.00 0.00 H new ATOM 0 HB2 TYR B 609 16.087 19.942 -0.502 1.00 0.00 H new ATOM 0 HB3 TYR B 609 15.120 18.653 -1.191 1.00 0.00 H new ATOM 0 HD1 TYR B 609 14.827 19.238 -3.977 1.00 0.00 H new ATOM 0 HD2 TYR B 609 18.194 20.017 -1.486 1.00 0.00 H new ATOM 0 HE1 TYR B 609 16.292 19.186 -5.945 1.00 0.00 H new ATOM 0 HE2 TYR B 609 19.662 19.969 -3.454 1.00 0.00 H new ATOM 0 HH TYR B 609 19.812 19.713 -5.644 1.00 0.00 H new ATOM 1413 N PRO B 610 12.438 19.092 -1.264 1.00 0.00 N ATOM 1414 CA PRO B 610 11.272 18.483 -0.617 1.00 0.00 C ATOM 1415 C PRO B 610 11.650 17.676 0.619 1.00 0.00 C ATOM 1416 O PRO B 610 10.825 17.456 1.506 1.00 0.00 O ATOM 1417 CB PRO B 610 10.704 17.565 -1.702 1.00 0.00 C ATOM 1418 CG PRO B 610 11.868 17.245 -2.575 1.00 0.00 C ATOM 1419 CD PRO B 610 12.743 18.467 -2.562 1.00 0.00 C ATOM 0 HA PRO B 610 10.566 19.233 -0.261 1.00 0.00 H new ATOM 0 HB2 PRO B 610 10.273 16.662 -1.270 1.00 0.00 H new ATOM 0 HB3 PRO B 610 9.912 18.059 -2.264 1.00 0.00 H new ATOM 0 HG2 PRO B 610 12.408 16.374 -2.202 1.00 0.00 H new ATOM 0 HG3 PRO B 610 11.543 17.009 -3.588 1.00 0.00 H new ATOM 0 HD2 PRO B 610 13.798 18.206 -2.644 1.00 0.00 H new ATOM 0 HD3 PRO B 610 12.514 19.134 -3.393 1.00 0.00 H new ATOM 1424 N ALA B 611 12.903 17.236 0.673 1.00 0.00 N ATOM 1425 CA ALA B 611 13.391 16.454 1.803 1.00 0.00 C ATOM 1426 C ALA B 611 13.169 17.193 3.118 1.00 0.00 C ATOM 1427 O ALA B 611 13.020 16.575 4.171 1.00 0.00 O ATOM 1428 CB ALA B 611 14.867 16.129 1.621 1.00 0.00 C ATOM 0 H ALA B 611 13.599 17.408 -0.053 1.00 0.00 H new ATOM 0 HA ALA B 611 12.826 15.522 1.840 1.00 0.00 H new ATOM 0 HB1 ALA B 611 15.219 15.545 2.472 1.00 0.00 H new ATOM 0 HB2 ALA B 611 15.003 15.554 0.705 1.00 0.00 H new ATOM 0 HB3 ALA B 611 15.438 17.055 1.556 1.00 0.00 H new ATOM 1434 N MET B 612 13.147 18.520 3.050 1.00 0.00 N ATOM 1435 CA MET B 612 12.943 19.343 4.236 1.00 0.00 C ATOM 1436 C MET B 612 11.457 19.467 4.563 1.00 0.00 C ATOM 1437 O MET B 612 11.080 19.657 5.719 1.00 0.00 O ATOM 1438 CB MET B 612 13.549 20.733 4.030 1.00 0.00 C ATOM 1439 CG MET B 612 15.033 20.803 4.355 1.00 0.00 C ATOM 1440 SD MET B 612 16.051 21.077 2.893 1.00 0.00 S ATOM 1441 CE MET B 612 17.381 19.913 3.185 1.00 0.00 C ATOM 0 H MET B 612 13.268 19.048 2.186 1.00 0.00 H new ATOM 0 HA MET B 612 13.443 18.857 5.074 1.00 0.00 H new ATOM 0 HB2 MET B 612 13.397 21.037 2.994 1.00 0.00 H new ATOM 0 HB3 MET B 612 13.015 21.450 4.654 1.00 0.00 H new ATOM 0 HG2 MET B 612 15.207 21.607 5.070 1.00 0.00 H new ATOM 0 HG3 MET B 612 15.340 19.875 4.838 1.00 0.00 H new ATOM 0 HE1 MET B 612 18.096 19.964 2.364 1.00 0.00 H new ATOM 0 HE2 MET B 612 17.884 20.162 4.119 1.00 0.00 H new ATOM 0 HE3 MET B 612 16.974 18.904 3.250 1.00 0.00 H new ATOM 1449 N LEU B 613 10.620 19.357 3.537 1.00 0.00 N ATOM 1450 CA LEU B 613 9.176 19.457 3.714 1.00 0.00 C ATOM 1451 C LEU B 613 8.680 18.427 4.725 1.00 0.00 C ATOM 1452 O LEU B 613 9.094 17.270 4.702 1.00 0.00 O ATOM 1453 CB LEU B 613 8.463 19.258 2.375 1.00 0.00 C ATOM 1454 CG LEU B 613 7.459 20.343 1.983 1.00 0.00 C ATOM 1455 CD1 LEU B 613 6.314 20.397 2.983 1.00 0.00 C ATOM 1456 CD2 LEU B 613 8.147 21.696 1.882 1.00 0.00 C ATOM 0 H LEU B 613 10.917 19.199 2.574 1.00 0.00 H new ATOM 0 HA LEU B 613 8.949 20.453 4.095 1.00 0.00 H new ATOM 0 HB2 LEU B 613 9.217 19.188 1.591 1.00 0.00 H new ATOM 0 HB3 LEU B 613 7.942 18.301 2.402 1.00 0.00 H new ATOM 0 HG LEU B 613 7.048 20.094 1.005 1.00 0.00 H new ATOM 0 HD11 LEU B 613 5.610 21.175 2.688 1.00 0.00 H new ATOM 0 HD12 LEU B 613 5.804 19.434 3.004 1.00 0.00 H new ATOM 0 HD13 LEU B 613 6.707 20.621 3.975 1.00 0.00 H new ATOM 0 HD21 LEU B 613 7.417 22.455 1.602 1.00 0.00 H new ATOM 0 HD22 LEU B 613 8.587 21.953 2.845 1.00 0.00 H new ATOM 0 HD23 LEU B 613 8.931 21.650 1.126 1.00 0.00 H new ATOM 1467 N GLY B 614 7.787 18.858 5.611 1.00 0.00 N ATOM 1468 CA GLY B 614 7.246 17.962 6.616 1.00 0.00 C ATOM 1469 C GLY B 614 7.734 18.295 8.012 1.00 0.00 C ATOM 1470 O GLY B 614 7.297 19.277 8.613 1.00 0.00 O ATOM 0 H GLY B 614 7.429 19.812 5.650 1.00 0.00 H new ATOM 0 HA2 GLY B 614 6.157 18.011 6.594 1.00 0.00 H new ATOM 0 HA3 GLY B 614 7.524 16.937 6.372 1.00 0.00 H new ATOM 1474 N HIS B 615 8.643 17.474 8.531 1.00 0.00 N ATOM 1475 CA HIS B 615 9.190 17.687 9.867 1.00 0.00 C ATOM 1476 C HIS B 615 8.091 17.608 10.922 1.00 0.00 C ATOM 1477 O HIS B 615 7.453 18.610 11.244 1.00 0.00 O ATOM 1478 CB HIS B 615 9.891 19.044 9.943 1.00 0.00 C ATOM 1479 CG HIS B 615 10.916 19.126 11.032 1.00 0.00 C ATOM 1480 ND1 HIS B 615 12.272 19.034 10.798 1.00 0.00 N ATOM 1481 CD2 HIS B 615 10.777 19.295 12.368 1.00 0.00 C ATOM 1482 CE1 HIS B 615 12.922 19.142 11.943 1.00 0.00 C ATOM 1483 NE2 HIS B 615 12.038 19.301 12.912 1.00 0.00 N ATOM 0 H HIS B 615 9.016 16.657 8.048 1.00 0.00 H new ATOM 0 HA HIS B 615 9.917 16.900 10.066 1.00 0.00 H new ATOM 0 HB2 HIS B 615 10.371 19.250 8.986 1.00 0.00 H new ATOM 0 HB3 HIS B 615 9.144 19.822 10.099 1.00 0.00 H new ATOM 0 HD2 HIS B 615 9.847 19.405 12.906 1.00 0.00 H new ATOM 0 HE1 HIS B 615 13.994 19.106 12.066 1.00 0.00 H new ATOM 0 HE2 HIS B 615 12.256 19.410 13.902 1.00 0.00 H new ATOM 1490 N ALA B 616 7.876 16.410 11.458 1.00 0.00 N ATOM 1491 CA ALA B 616 6.857 16.201 12.477 1.00 0.00 C ATOM 1492 C ALA B 616 6.953 14.799 13.071 1.00 0.00 C ATOM 1493 O ALA B 616 7.824 14.016 12.699 1.00 0.00 O ATOM 1494 CB ALA B 616 5.472 16.436 11.895 1.00 0.00 C ATOM 0 H ALA B 616 8.395 15.570 11.202 1.00 0.00 H new ATOM 0 HA ALA B 616 7.028 16.919 13.279 1.00 0.00 H new ATOM 0 HB1 ALA B 616 4.721 16.276 12.668 1.00 0.00 H new ATOM 0 HB2 ALA B 616 5.401 17.459 11.526 1.00 0.00 H new ATOM 0 HB3 ALA B 616 5.300 15.741 11.073 1.00 0.00 H new ATOM 1500 N GLY B 617 6.051 14.491 13.998 1.00 0.00 N ATOM 1501 CA GLY B 617 6.053 13.184 14.628 1.00 0.00 C ATOM 1502 C GLY B 617 4.674 12.768 15.102 1.00 0.00 C ATOM 1503 O GLY B 617 4.472 12.501 16.287 1.00 0.00 O ATOM 0 H GLY B 617 5.320 15.123 14.324 1.00 0.00 H new ATOM 0 HA2 GLY B 617 6.430 12.444 13.922 1.00 0.00 H new ATOM 0 HA3 GLY B 617 6.738 13.194 15.476 1.00 0.00 H new ATOM 1507 N ASP B 618 3.723 12.713 14.176 1.00 0.00 N ATOM 1508 CA ASP B 618 2.356 12.326 14.505 1.00 0.00 C ATOM 1509 C ASP B 618 1.652 11.734 13.289 1.00 0.00 C ATOM 1510 O ASP B 618 1.220 10.582 13.309 1.00 0.00 O ATOM 1511 CB ASP B 618 1.574 13.533 15.026 1.00 0.00 C ATOM 1512 CG ASP B 618 0.407 13.130 15.906 1.00 0.00 C ATOM 1513 OD1 ASP B 618 0.493 12.067 16.557 1.00 0.00 O ATOM 1514 OD2 ASP B 618 -0.592 13.879 15.946 1.00 0.00 O ATOM 0 H ASP B 618 3.874 12.932 13.191 1.00 0.00 H new ATOM 0 HA ASP B 618 2.397 11.565 15.284 1.00 0.00 H new ATOM 0 HB2 ASP B 618 2.245 14.181 15.591 1.00 0.00 H new ATOM 0 HB3 ASP B 618 1.205 14.115 14.182 1.00 0.00 H new ATOM 1518 N MET B 619 1.536 12.531 12.231 1.00 0.00 N ATOM 1519 CA MET B 619 0.883 12.085 11.006 1.00 0.00 C ATOM 1520 C MET B 619 1.685 10.975 10.336 1.00 0.00 C ATOM 1521 O MET B 619 1.127 10.121 9.649 1.00 0.00 O ATOM 1522 CB MET B 619 0.708 13.258 10.040 1.00 0.00 C ATOM 1523 CG MET B 619 -0.398 14.220 10.446 1.00 0.00 C ATOM 1524 SD MET B 619 0.238 15.790 11.061 1.00 0.00 S ATOM 1525 CE MET B 619 -0.898 16.112 12.406 1.00 0.00 C ATOM 0 H MET B 619 1.886 13.489 12.198 1.00 0.00 H new ATOM 0 HA MET B 619 -0.099 11.691 11.270 1.00 0.00 H new ATOM 0 HB2 MET B 619 1.648 13.806 9.972 1.00 0.00 H new ATOM 0 HB3 MET B 619 0.493 12.869 9.045 1.00 0.00 H new ATOM 0 HG2 MET B 619 -1.045 14.406 9.589 1.00 0.00 H new ATOM 0 HG3 MET B 619 -1.014 13.755 11.216 1.00 0.00 H new ATOM 0 HE1 MET B 619 -0.634 17.053 12.888 1.00 0.00 H new ATOM 0 HE2 MET B 619 -1.914 16.176 12.017 1.00 0.00 H new ATOM 0 HE3 MET B 619 -0.839 15.303 13.134 1.00 0.00 H new ATOM 1533 N ALA B 620 2.998 10.994 10.540 1.00 0.00 N ATOM 1534 CA ALA B 620 3.877 9.987 9.956 1.00 0.00 C ATOM 1535 C ALA B 620 3.517 8.590 10.450 1.00 0.00 C ATOM 1536 O ALA B 620 3.577 7.620 9.697 1.00 0.00 O ATOM 1537 CB ALA B 620 5.330 10.304 10.278 1.00 0.00 C ATOM 0 H ALA B 620 3.477 11.695 11.105 1.00 0.00 H new ATOM 0 HA ALA B 620 3.743 10.007 8.874 1.00 0.00 H new ATOM 0 HB1 ALA B 620 5.975 9.544 9.836 1.00 0.00 H new ATOM 0 HB2 ALA B 620 5.588 11.281 9.870 1.00 0.00 H new ATOM 0 HB3 ALA B 620 5.469 10.314 11.359 1.00 0.00 H new ATOM 1543 N GLY B 621 3.141 8.496 11.722 1.00 0.00 N ATOM 1544 CA GLY B 621 2.777 7.214 12.296 1.00 0.00 C ATOM 1545 C GLY B 621 1.645 6.543 11.543 1.00 0.00 C ATOM 1546 O GLY B 621 1.683 5.337 11.295 1.00 0.00 O ATOM 0 H GLY B 621 3.082 9.285 12.365 1.00 0.00 H new ATOM 0 HA2 GLY B 621 3.648 6.559 12.296 1.00 0.00 H new ATOM 0 HA3 GLY B 621 2.484 7.355 13.336 1.00 0.00 H new ATOM 1550 N TYR B 622 0.633 7.324 11.181 1.00 0.00 N ATOM 1551 CA TYR B 622 -0.517 6.798 10.456 1.00 0.00 C ATOM 1552 C TYR B 622 -0.075 6.044 9.206 1.00 0.00 C ATOM 1553 O TYR B 622 -0.492 4.910 8.971 1.00 0.00 O ATOM 1554 CB TYR B 622 -1.468 7.933 10.073 1.00 0.00 C ATOM 1555 CG TYR B 622 -2.487 8.256 11.141 1.00 0.00 C ATOM 1556 CD1 TYR B 622 -3.433 7.317 11.533 1.00 0.00 C ATOM 1557 CD2 TYR B 622 -2.506 9.501 11.757 1.00 0.00 C ATOM 1558 CE1 TYR B 622 -4.368 7.608 12.508 1.00 0.00 C ATOM 1559 CE2 TYR B 622 -3.436 9.801 12.734 1.00 0.00 C ATOM 1560 CZ TYR B 622 -4.365 8.851 13.106 1.00 0.00 C ATOM 1561 OH TYR B 622 -5.293 9.145 14.078 1.00 0.00 O ATOM 0 H TYR B 622 0.586 8.324 11.378 1.00 0.00 H new ATOM 0 HA TYR B 622 -1.040 6.101 11.111 1.00 0.00 H new ATOM 0 HB2 TYR B 622 -0.884 8.828 9.858 1.00 0.00 H new ATOM 0 HB3 TYR B 622 -1.990 7.664 9.155 1.00 0.00 H new ATOM 0 HD1 TYR B 622 -3.438 6.342 11.068 1.00 0.00 H new ATOM 0 HD2 TYR B 622 -1.781 10.247 11.467 1.00 0.00 H new ATOM 0 HE1 TYR B 622 -5.097 6.867 12.800 1.00 0.00 H new ATOM 0 HE2 TYR B 622 -3.436 10.773 13.204 1.00 0.00 H new ATOM 0 HH TYR B 622 -5.153 10.061 14.397 1.00 0.00 H new ATOM 1570 N ALA B 623 0.772 6.683 8.407 1.00 0.00 N ATOM 1571 CA ALA B 623 1.274 6.074 7.181 1.00 0.00 C ATOM 1572 C ALA B 623 2.196 4.900 7.490 1.00 0.00 C ATOM 1573 O ALA B 623 2.233 3.916 6.751 1.00 0.00 O ATOM 1574 CB ALA B 623 2.002 7.110 6.337 1.00 0.00 C ATOM 0 H ALA B 623 1.126 7.623 8.586 1.00 0.00 H new ATOM 0 HA ALA B 623 0.422 5.695 6.617 1.00 0.00 H new ATOM 0 HB1 ALA B 623 2.372 6.642 5.425 1.00 0.00 H new ATOM 0 HB2 ALA B 623 1.316 7.916 6.079 1.00 0.00 H new ATOM 0 HB3 ALA B 623 2.841 7.515 6.902 1.00 0.00 H new ATOM 1580 N GLY B 624 2.941 5.008 8.586 1.00 0.00 N ATOM 1581 CA GLY B 624 3.852 3.947 8.972 1.00 0.00 C ATOM 1582 C GLY B 624 3.156 2.610 9.125 1.00 0.00 C ATOM 1583 O GLY B 624 3.780 1.557 8.994 1.00 0.00 O ATOM 0 H GLY B 624 2.930 5.812 9.214 1.00 0.00 H new ATOM 0 HA2 GLY B 624 4.640 3.859 8.224 1.00 0.00 H new ATOM 0 HA3 GLY B 624 4.334 4.211 9.913 1.00 0.00 H new ATOM 1587 N THR B 625 1.857 2.651 9.406 1.00 0.00 N ATOM 1588 CA THR B 625 1.075 1.434 9.580 1.00 0.00 C ATOM 1589 C THR B 625 0.899 0.698 8.256 1.00 0.00 C ATOM 1590 O THR B 625 0.784 -0.528 8.225 1.00 0.00 O ATOM 1591 CB THR B 625 -0.314 1.738 10.173 1.00 0.00 C ATOM 1592 OG1 THR B 625 -0.174 2.369 11.450 1.00 0.00 O ATOM 1593 CG2 THR B 625 -1.132 0.464 10.318 1.00 0.00 C ATOM 0 H THR B 625 1.325 3.514 9.518 1.00 0.00 H new ATOM 0 HA THR B 625 1.628 0.801 10.274 1.00 0.00 H new ATOM 0 HB THR B 625 -0.836 2.410 9.492 1.00 0.00 H new ATOM 0 HG1 THR B 625 -1.061 2.560 11.819 1.00 0.00 H new ATOM 0 HG21 THR B 625 -2.108 0.704 10.739 1.00 0.00 H new ATOM 0 HG22 THR B 625 -1.262 0.002 9.339 1.00 0.00 H new ATOM 0 HG23 THR B 625 -0.612 -0.229 10.980 1.00 0.00 H new ATOM 1601 N LEU B 626 0.879 1.454 7.163 1.00 0.00 N ATOM 1602 CA LEU B 626 0.719 0.874 5.835 1.00 0.00 C ATOM 1603 C LEU B 626 1.938 0.040 5.453 1.00 0.00 C ATOM 1604 O LEU B 626 1.808 -1.031 4.860 1.00 0.00 O ATOM 1605 CB LEU B 626 0.497 1.976 4.798 1.00 0.00 C ATOM 1606 CG LEU B 626 -0.754 2.835 4.990 1.00 0.00 C ATOM 1607 CD1 LEU B 626 -0.846 3.894 3.902 1.00 0.00 C ATOM 1608 CD2 LEU B 626 -2.003 1.966 4.996 1.00 0.00 C ATOM 0 H LEU B 626 0.972 2.470 7.171 1.00 0.00 H new ATOM 0 HA LEU B 626 -0.153 0.221 5.855 1.00 0.00 H new ATOM 0 HB2 LEU B 626 1.368 2.632 4.802 1.00 0.00 H new ATOM 0 HB3 LEU B 626 0.449 1.515 3.811 1.00 0.00 H new ATOM 0 HG LEU B 626 -0.681 3.338 5.954 1.00 0.00 H new ATOM 0 HD11 LEU B 626 -1.742 4.496 4.055 1.00 0.00 H new ATOM 0 HD12 LEU B 626 0.034 4.536 3.944 1.00 0.00 H new ATOM 0 HD13 LEU B 626 -0.896 3.410 2.927 1.00 0.00 H new ATOM 0 HD21 LEU B 626 -2.883 2.594 5.134 1.00 0.00 H new ATOM 0 HD22 LEU B 626 -2.081 1.435 4.047 1.00 0.00 H new ATOM 0 HD23 LEU B 626 -1.941 1.245 5.811 1.00 0.00 H new ATOM 1619 N GLN B 627 3.120 0.537 5.800 1.00 0.00 N ATOM 1620 CA GLN B 627 4.363 -0.164 5.495 1.00 0.00 C ATOM 1621 C GLN B 627 4.481 -1.443 6.315 1.00 0.00 C ATOM 1622 O GLN B 627 4.977 -2.460 5.829 1.00 0.00 O ATOM 1623 CB GLN B 627 5.564 0.744 5.767 1.00 0.00 C ATOM 1624 CG GLN B 627 6.827 0.316 5.036 1.00 0.00 C ATOM 1625 CD GLN B 627 8.091 0.730 5.764 1.00 0.00 C ATOM 1626 OE1 GLN B 627 8.035 1.399 6.796 1.00 0.00 O ATOM 1627 NE2 GLN B 627 9.238 0.332 5.229 1.00 0.00 N ATOM 0 H GLN B 627 3.244 1.422 6.292 1.00 0.00 H new ATOM 0 HA GLN B 627 4.351 -0.432 4.439 1.00 0.00 H new ATOM 0 HB2 GLN B 627 5.312 1.763 5.474 1.00 0.00 H new ATOM 0 HB3 GLN B 627 5.762 0.760 6.839 1.00 0.00 H new ATOM 0 HG2 GLN B 627 6.821 -0.767 4.912 1.00 0.00 H new ATOM 0 HG3 GLN B 627 6.829 0.751 4.036 1.00 0.00 H new ATOM 0 HE21 GLN B 627 9.236 -0.221 4.372 1.00 0.00 H new ATOM 0 HE22 GLN B 627 10.122 0.579 5.675 1.00 0.00 H new ATOM 1634 N SER B 628 4.023 -1.386 7.562 1.00 0.00 N ATOM 1635 CA SER B 628 4.083 -2.540 8.451 1.00 0.00 C ATOM 1636 C SER B 628 3.002 -3.556 8.094 1.00 0.00 C ATOM 1637 O SER B 628 3.287 -4.737 7.886 1.00 0.00 O ATOM 1638 CB SER B 628 3.922 -2.097 9.907 1.00 0.00 C ATOM 1639 OG SER B 628 3.661 -3.205 10.752 1.00 0.00 O ATOM 0 H SER B 628 3.607 -0.553 7.979 1.00 0.00 H new ATOM 0 HA SER B 628 5.057 -3.013 8.328 1.00 0.00 H new ATOM 0 HB2 SER B 628 4.828 -1.589 10.238 1.00 0.00 H new ATOM 0 HB3 SER B 628 3.107 -1.378 9.983 1.00 0.00 H new ATOM 0 HG SER B 628 3.564 -2.895 11.677 1.00 0.00 H new ATOM 1644 N LEU B 629 1.760 -3.091 8.028 1.00 0.00 N ATOM 1645 CA LEU B 629 0.635 -3.957 7.696 1.00 0.00 C ATOM 1646 C LEU B 629 0.765 -4.502 6.278 1.00 0.00 C ATOM 1647 O LEU B 629 0.689 -5.710 6.055 1.00 0.00 O ATOM 1648 CB LEU B 629 -0.683 -3.194 7.841 1.00 0.00 C ATOM 1649 CG LEU B 629 -1.905 -3.832 7.180 1.00 0.00 C ATOM 1650 CD1 LEU B 629 -2.083 -5.266 7.657 1.00 0.00 C ATOM 1651 CD2 LEU B 629 -3.156 -3.015 7.468 1.00 0.00 C ATOM 0 H LEU B 629 1.506 -2.118 8.200 1.00 0.00 H new ATOM 0 HA LEU B 629 0.640 -4.797 8.390 1.00 0.00 H new ATOM 0 HB2 LEU B 629 -0.893 -3.070 8.903 1.00 0.00 H new ATOM 0 HB3 LEU B 629 -0.549 -2.196 7.424 1.00 0.00 H new ATOM 0 HG LEU B 629 -1.744 -3.846 6.102 1.00 0.00 H new ATOM 0 HD11 LEU B 629 -2.958 -5.704 7.176 1.00 0.00 H new ATOM 0 HD12 LEU B 629 -1.198 -5.848 7.399 1.00 0.00 H new ATOM 0 HD13 LEU B 629 -2.221 -5.275 8.738 1.00 0.00 H new ATOM 0 HD21 LEU B 629 -4.015 -3.485 6.989 1.00 0.00 H new ATOM 0 HD22 LEU B 629 -3.321 -2.969 8.545 1.00 0.00 H new ATOM 0 HD23 LEU B 629 -3.029 -2.006 7.077 1.00 0.00 H new ATOM 1662 N GLY B 630 0.966 -3.602 5.319 1.00 0.00 N ATOM 1663 CA GLY B 630 1.107 -4.011 3.934 1.00 0.00 C ATOM 1664 C GLY B 630 2.151 -5.096 3.754 1.00 0.00 C ATOM 1665 O GLY B 630 1.912 -6.090 3.069 1.00 0.00 O ATOM 0 H GLY B 630 1.034 -2.597 5.477 1.00 0.00 H new ATOM 0 HA2 GLY B 630 0.146 -4.370 3.565 1.00 0.00 H new ATOM 0 HA3 GLY B 630 1.378 -3.146 3.329 1.00 0.00 H new ATOM 1669 N ALA B 631 3.314 -4.905 4.370 1.00 0.00 N ATOM 1670 CA ALA B 631 4.398 -5.874 4.274 1.00 0.00 C ATOM 1671 C ALA B 631 3.955 -7.244 4.777 1.00 0.00 C ATOM 1672 O ALA B 631 4.352 -8.273 4.232 1.00 0.00 O ATOM 1673 CB ALA B 631 5.610 -5.389 5.055 1.00 0.00 C ATOM 0 H ALA B 631 3.529 -4.087 4.941 1.00 0.00 H new ATOM 0 HA ALA B 631 4.673 -5.973 3.224 1.00 0.00 H new ATOM 0 HB1 ALA B 631 6.412 -6.123 4.975 1.00 0.00 H new ATOM 0 HB2 ALA B 631 5.948 -4.436 4.648 1.00 0.00 H new ATOM 0 HB3 ALA B 631 5.340 -5.260 6.103 1.00 0.00 H new ATOM 1679 N GLU B 632 3.131 -7.248 5.820 1.00 0.00 N ATOM 1680 CA GLU B 632 2.636 -8.492 6.398 1.00 0.00 C ATOM 1681 C GLU B 632 1.863 -9.303 5.360 1.00 0.00 C ATOM 1682 O GLU B 632 1.922 -10.533 5.349 1.00 0.00 O ATOM 1683 CB GLU B 632 1.741 -8.201 7.604 1.00 0.00 C ATOM 1684 CG GLU B 632 2.427 -7.387 8.687 1.00 0.00 C ATOM 1685 CD GLU B 632 2.566 -8.150 9.991 1.00 0.00 C ATOM 1686 OE1 GLU B 632 3.267 -9.184 10.000 1.00 0.00 O ATOM 1687 OE2 GLU B 632 1.975 -7.714 11.000 1.00 0.00 O ATOM 0 H GLU B 632 2.792 -6.404 6.282 1.00 0.00 H new ATOM 0 HA GLU B 632 3.495 -9.077 6.727 1.00 0.00 H new ATOM 0 HB2 GLU B 632 0.853 -7.666 7.267 1.00 0.00 H new ATOM 0 HB3 GLU B 632 1.402 -9.145 8.030 1.00 0.00 H new ATOM 0 HG2 GLU B 632 3.415 -7.086 8.339 1.00 0.00 H new ATOM 0 HG3 GLU B 632 1.860 -6.473 8.864 1.00 0.00 H new ATOM 1692 N ILE B 633 1.138 -8.605 4.493 1.00 0.00 N ATOM 1693 CA ILE B 633 0.354 -9.259 3.453 1.00 0.00 C ATOM 1694 C ILE B 633 1.254 -9.826 2.360 1.00 0.00 C ATOM 1695 O ILE B 633 1.074 -10.961 1.920 1.00 0.00 O ATOM 1696 CB ILE B 633 -0.658 -8.288 2.817 1.00 0.00 C ATOM 1697 CG1 ILE B 633 -1.600 -7.728 3.883 1.00 0.00 C ATOM 1698 CG2 ILE B 633 -1.448 -8.990 1.721 1.00 0.00 C ATOM 1699 CD1 ILE B 633 -2.493 -6.616 3.377 1.00 0.00 C ATOM 0 H ILE B 633 1.077 -7.587 4.490 1.00 0.00 H new ATOM 0 HA ILE B 633 -0.188 -10.074 3.932 1.00 0.00 H new ATOM 0 HB ILE B 633 -0.111 -7.458 2.370 1.00 0.00 H new ATOM 0 HG12 ILE B 633 -2.222 -8.536 4.267 1.00 0.00 H new ATOM 0 HG13 ILE B 633 -1.009 -7.356 4.720 1.00 0.00 H new ATOM 0 HG21 ILE B 633 -2.159 -8.291 1.281 1.00 0.00 H new ATOM 0 HG22 ILE B 633 -0.764 -9.346 0.950 1.00 0.00 H new ATOM 0 HG23 ILE B 633 -1.987 -9.837 2.146 1.00 0.00 H new ATOM 0 HD11 ILE B 633 -3.134 -6.267 4.187 1.00 0.00 H new ATOM 0 HD12 ILE B 633 -1.878 -5.790 3.019 1.00 0.00 H new ATOM 0 HD13 ILE B 633 -3.111 -6.989 2.560 1.00 0.00 H new ATOM 1710 N ALA B 634 2.225 -9.028 1.928 1.00 0.00 N ATOM 1711 CA ALA B 634 3.156 -9.451 0.889 1.00 0.00 C ATOM 1712 C ALA B 634 3.940 -10.685 1.325 1.00 0.00 C ATOM 1713 O ALA B 634 4.300 -11.526 0.501 1.00 0.00 O ATOM 1714 CB ALA B 634 4.107 -8.315 0.539 1.00 0.00 C ATOM 0 H ALA B 634 2.387 -8.085 2.281 1.00 0.00 H new ATOM 0 HA ALA B 634 2.579 -9.714 0.002 1.00 0.00 H new ATOM 0 HB1 ALA B 634 4.797 -8.644 -0.238 1.00 0.00 H new ATOM 0 HB2 ALA B 634 3.535 -7.460 0.178 1.00 0.00 H new ATOM 0 HB3 ALA B 634 4.671 -8.026 1.426 1.00 0.00 H new ATOM 1720 N VAL B 635 4.202 -10.786 2.624 1.00 0.00 N ATOM 1721 CA VAL B 635 4.943 -11.917 3.168 1.00 0.00 C ATOM 1722 C VAL B 635 4.057 -13.153 3.275 1.00 0.00 C ATOM 1723 O VAL B 635 4.532 -14.282 3.150 1.00 0.00 O ATOM 1724 CB VAL B 635 5.522 -11.593 4.557 1.00 0.00 C ATOM 1725 CG1 VAL B 635 6.273 -12.791 5.118 1.00 0.00 C ATOM 1726 CG2 VAL B 635 6.429 -10.373 4.486 1.00 0.00 C ATOM 0 H VAL B 635 3.912 -10.098 3.319 1.00 0.00 H new ATOM 0 HA VAL B 635 5.763 -12.119 2.479 1.00 0.00 H new ATOM 0 HB VAL B 635 4.695 -11.365 5.229 1.00 0.00 H new ATOM 0 HG11 VAL B 635 6.674 -12.541 6.100 1.00 0.00 H new ATOM 0 HG12 VAL B 635 5.592 -13.637 5.209 1.00 0.00 H new ATOM 0 HG13 VAL B 635 7.091 -13.054 4.448 1.00 0.00 H new ATOM 0 HG21 VAL B 635 6.829 -10.159 5.477 1.00 0.00 H new ATOM 0 HG22 VAL B 635 7.251 -10.570 3.798 1.00 0.00 H new ATOM 0 HG23 VAL B 635 5.858 -9.515 4.132 1.00 0.00 H new ATOM 1736 N GLU B 636 2.768 -12.933 3.507 1.00 0.00 N ATOM 1737 CA GLU B 636 1.815 -14.030 3.632 1.00 0.00 C ATOM 1738 C GLU B 636 1.662 -14.771 2.305 1.00 0.00 C ATOM 1739 O GLU B 636 1.803 -15.992 2.246 1.00 0.00 O ATOM 1740 CB GLU B 636 0.455 -13.505 4.095 1.00 0.00 C ATOM 1741 CG GLU B 636 0.121 -13.865 5.533 1.00 0.00 C ATOM 1742 CD GLU B 636 -0.537 -15.225 5.656 1.00 0.00 C ATOM 1743 OE1 GLU B 636 -1.524 -15.474 4.933 1.00 0.00 O ATOM 1744 OE2 GLU B 636 -0.066 -16.039 6.477 1.00 0.00 O ATOM 0 H GLU B 636 2.359 -12.005 3.612 1.00 0.00 H new ATOM 0 HA GLU B 636 2.199 -14.727 4.377 1.00 0.00 H new ATOM 0 HB2 GLU B 636 0.438 -12.420 3.987 1.00 0.00 H new ATOM 0 HB3 GLU B 636 -0.321 -13.902 3.440 1.00 0.00 H new ATOM 0 HG2 GLU B 636 1.034 -13.852 6.128 1.00 0.00 H new ATOM 0 HG3 GLU B 636 -0.542 -13.106 5.949 1.00 0.00 H new ATOM 1749 N GLN B 637 1.373 -14.022 1.247 1.00 0.00 N ATOM 1750 CA GLN B 637 1.200 -14.607 -0.077 1.00 0.00 C ATOM 1751 C GLN B 637 2.482 -15.291 -0.543 1.00 0.00 C ATOM 1752 O GLN B 637 2.440 -16.258 -1.302 1.00 0.00 O ATOM 1753 CB GLN B 637 0.787 -13.531 -1.084 1.00 0.00 C ATOM 1754 CG GLN B 637 1.924 -12.606 -1.485 1.00 0.00 C ATOM 1755 CD GLN B 637 2.586 -13.023 -2.783 1.00 0.00 C ATOM 1756 OE1 GLN B 637 1.929 -13.142 -3.818 1.00 0.00 O ATOM 1757 NE2 GLN B 637 3.894 -13.246 -2.737 1.00 0.00 N ATOM 0 H GLN B 637 1.254 -13.010 1.280 1.00 0.00 H new ATOM 0 HA GLN B 637 0.412 -15.357 -0.014 1.00 0.00 H new ATOM 0 HB2 GLN B 637 0.390 -14.014 -1.977 1.00 0.00 H new ATOM 0 HB3 GLN B 637 -0.021 -12.937 -0.657 1.00 0.00 H new ATOM 0 HG2 GLN B 637 1.542 -11.590 -1.586 1.00 0.00 H new ATOM 0 HG3 GLN B 637 2.670 -12.588 -0.691 1.00 0.00 H new ATOM 0 HE21 GLN B 637 4.400 -13.136 -1.858 1.00 0.00 H new ATOM 0 HE22 GLN B 637 4.393 -13.528 -3.581 1.00 0.00 H new ATOM 1764 N ALA B 638 3.619 -14.780 -0.082 1.00 0.00 N ATOM 1765 CA ALA B 638 4.913 -15.342 -0.450 1.00 0.00 C ATOM 1766 C ALA B 638 5.013 -16.805 -0.034 1.00 0.00 C ATOM 1767 O ALA B 638 5.779 -17.574 -0.614 1.00 0.00 O ATOM 1768 CB ALA B 638 6.037 -14.535 0.180 1.00 0.00 C ATOM 0 H ALA B 638 3.670 -13.978 0.547 1.00 0.00 H new ATOM 0 HA ALA B 638 5.008 -15.292 -1.535 1.00 0.00 H new ATOM 0 HB1 ALA B 638 6.997 -14.966 -0.103 1.00 0.00 H new ATOM 0 HB2 ALA B 638 5.985 -13.504 -0.170 1.00 0.00 H new ATOM 0 HB3 ALA B 638 5.936 -14.556 1.265 1.00 0.00 H new ATOM 1774 N ALA B 639 4.235 -17.185 0.975 1.00 0.00 N ATOM 1775 CA ALA B 639 4.236 -18.557 1.467 1.00 0.00 C ATOM 1776 C ALA B 639 3.282 -19.430 0.660 1.00 0.00 C ATOM 1777 O ALA B 639 3.453 -20.648 0.584 1.00 0.00 O ATOM 1778 CB ALA B 639 3.864 -18.588 2.942 1.00 0.00 C ATOM 0 H ALA B 639 3.596 -16.561 1.468 1.00 0.00 H new ATOM 0 HA ALA B 639 5.242 -18.959 1.349 1.00 0.00 H new ATOM 0 HB1 ALA B 639 3.868 -19.619 3.297 1.00 0.00 H new ATOM 0 HB2 ALA B 639 4.587 -18.005 3.512 1.00 0.00 H new ATOM 0 HB3 ALA B 639 2.869 -18.163 3.075 1.00 0.00 H new ATOM 1784 N LEU B 640 2.278 -18.803 0.059 1.00 0.00 N ATOM 1785 CA LEU B 640 1.295 -19.523 -0.743 1.00 0.00 C ATOM 1786 C LEU B 640 1.598 -19.382 -2.232 1.00 0.00 C ATOM 1787 O LEU B 640 0.697 -19.452 -3.066 1.00 0.00 O ATOM 1788 CB LEU B 640 -0.113 -19.006 -0.446 1.00 0.00 C ATOM 1789 CG LEU B 640 -0.403 -18.650 1.013 1.00 0.00 C ATOM 1790 CD1 LEU B 640 -1.740 -17.932 1.131 1.00 0.00 C ATOM 1791 CD2 LEU B 640 -0.389 -19.900 1.880 1.00 0.00 C ATOM 0 H LEU B 640 2.123 -17.796 0.112 1.00 0.00 H new ATOM 0 HA LEU B 640 1.350 -20.579 -0.478 1.00 0.00 H new ATOM 0 HB2 LEU B 640 -0.290 -18.121 -1.057 1.00 0.00 H new ATOM 0 HB3 LEU B 640 -0.831 -19.762 -0.764 1.00 0.00 H new ATOM 0 HG LEU B 640 0.380 -17.979 1.366 1.00 0.00 H new ATOM 0 HD11 LEU B 640 -1.930 -17.686 2.176 1.00 0.00 H new ATOM 0 HD12 LEU B 640 -1.714 -17.015 0.542 1.00 0.00 H new ATOM 0 HD13 LEU B 640 -2.535 -18.579 0.760 1.00 0.00 H new ATOM 0 HD21 LEU B 640 -0.597 -19.628 2.915 1.00 0.00 H new ATOM 0 HD22 LEU B 640 -1.151 -20.596 1.528 1.00 0.00 H new ATOM 0 HD23 LEU B 640 0.591 -20.374 1.820 1.00 0.00 H new ATOM 1802 N GLN B 641 2.871 -19.185 -2.555 1.00 0.00 N ATOM 1803 CA GLN B 641 3.292 -19.035 -3.943 1.00 0.00 C ATOM 1804 C GLN B 641 2.892 -20.253 -4.768 1.00 0.00 C ATOM 1805 O GLN B 641 2.468 -20.125 -5.916 1.00 0.00 O ATOM 1806 CB GLN B 641 4.806 -18.828 -4.020 1.00 0.00 C ATOM 1807 CG GLN B 641 5.266 -17.489 -3.466 1.00 0.00 C ATOM 1808 CD GLN B 641 5.134 -16.364 -4.474 1.00 0.00 C ATOM 1809 OE1 GLN B 641 6.010 -16.163 -5.316 1.00 0.00 O ATOM 1810 NE2 GLN B 641 4.035 -15.622 -4.394 1.00 0.00 N ATOM 0 H GLN B 641 3.629 -19.125 -1.875 1.00 0.00 H new ATOM 0 HA GLN B 641 2.791 -18.159 -4.355 1.00 0.00 H new ATOM 0 HB2 GLN B 641 5.302 -19.629 -3.471 1.00 0.00 H new ATOM 0 HB3 GLN B 641 5.123 -18.910 -5.060 1.00 0.00 H new ATOM 0 HG2 GLN B 641 4.681 -17.247 -2.579 1.00 0.00 H new ATOM 0 HG3 GLN B 641 6.306 -17.569 -3.150 1.00 0.00 H new ATOM 0 HE21 GLN B 641 3.334 -15.824 -3.681 1.00 0.00 H new ATOM 0 HE22 GLN B 641 3.892 -14.851 -5.046 1.00 0.00 H new ATOM 1817 N SER B 642 3.028 -21.435 -4.174 1.00 0.00 N ATOM 1818 CA SER B 642 2.685 -22.678 -4.856 1.00 0.00 C ATOM 1819 C SER B 642 1.184 -22.753 -5.122 1.00 0.00 C ATOM 1820 O SER B 642 0.742 -23.415 -6.061 1.00 0.00 O ATOM 1821 CB SER B 642 3.127 -23.881 -4.022 1.00 0.00 C ATOM 1822 OG SER B 642 4.524 -24.092 -4.133 1.00 0.00 O ATOM 0 H SER B 642 3.373 -21.558 -3.222 1.00 0.00 H new ATOM 0 HA SER B 642 3.208 -22.697 -5.812 1.00 0.00 H new ATOM 0 HB2 SER B 642 2.862 -23.720 -2.977 1.00 0.00 H new ATOM 0 HB3 SER B 642 2.594 -24.772 -4.352 1.00 0.00 H new ATOM 0 HG SER B 642 4.782 -24.865 -3.589 1.00 0.00 H new ATOM 1827 N ALA B 643 0.406 -22.070 -4.290 1.00 0.00 N ATOM 1828 CA ALA B 643 -1.044 -22.058 -4.435 1.00 0.00 C ATOM 1829 C ALA B 643 -1.472 -21.144 -5.578 1.00 0.00 C ATOM 1830 O ALA B 643 -2.495 -21.379 -6.223 1.00 0.00 O ATOM 1831 CB ALA B 643 -1.702 -21.622 -3.134 1.00 0.00 C ATOM 0 H ALA B 643 0.756 -21.517 -3.508 1.00 0.00 H new ATOM 0 HA ALA B 643 -1.369 -23.071 -4.671 1.00 0.00 H new ATOM 0 HB1 ALA B 643 -2.785 -21.618 -3.258 1.00 0.00 H new ATOM 0 HB2 ALA B 643 -1.430 -22.316 -2.338 1.00 0.00 H new ATOM 0 HB3 ALA B 643 -1.363 -20.620 -2.873 1.00 0.00 H new ATOM 1837 N TRP B 644 -0.686 -20.103 -5.824 1.00 0.00 N ATOM 1838 CA TRP B 644 -0.987 -19.154 -6.890 1.00 0.00 C ATOM 1839 C TRP B 644 -1.209 -19.875 -8.215 1.00 0.00 C ATOM 1840 O TRP B 644 -0.576 -20.893 -8.490 1.00 0.00 O ATOM 1841 CB TRP B 644 0.150 -18.139 -7.032 1.00 0.00 C ATOM 1842 CG TRP B 644 -0.248 -16.903 -7.779 1.00 0.00 C ATOM 1843 CD1 TRP B 644 -0.295 -16.744 -9.135 1.00 0.00 C ATOM 1844 CD2 TRP B 644 -0.652 -15.652 -7.212 1.00 0.00 C ATOM 1845 NE1 TRP B 644 -0.705 -15.469 -9.444 1.00 0.00 N ATOM 1846 CE2 TRP B 644 -0.931 -14.779 -8.283 1.00 0.00 C ATOM 1847 CE3 TRP B 644 -0.808 -15.185 -5.904 1.00 0.00 C ATOM 1848 CZ2 TRP B 644 -1.354 -13.468 -8.083 1.00 0.00 C ATOM 1849 CZ3 TRP B 644 -1.228 -13.883 -5.709 1.00 0.00 C ATOM 1850 CH2 TRP B 644 -1.498 -13.037 -6.793 1.00 0.00 C ATOM 0 H TRP B 644 0.164 -19.894 -5.301 1.00 0.00 H new ATOM 0 HA TRP B 644 -1.905 -18.628 -6.626 1.00 0.00 H new ATOM 0 HB2 TRP B 644 0.502 -17.858 -6.040 1.00 0.00 H new ATOM 0 HB3 TRP B 644 0.987 -18.612 -7.545 1.00 0.00 H new ATOM 0 HD1 TRP B 644 -0.047 -17.507 -9.857 1.00 0.00 H new ATOM 0 HE1 TRP B 644 -0.822 -15.097 -10.386 1.00 0.00 H new ATOM 0 HE3 TRP B 644 -0.604 -15.829 -5.062 1.00 0.00 H new ATOM 0 HZ2 TRP B 644 -1.561 -12.814 -8.917 1.00 0.00 H new ATOM 0 HZ3 TRP B 644 -1.350 -13.511 -4.703 1.00 0.00 H new ATOM 0 HH2 TRP B 644 -1.826 -12.025 -6.606 1.00 0.00 H new ATOM 1860 N GLN B 645 -2.112 -19.340 -9.030 1.00 0.00 N ATOM 1861 CA GLN B 645 -2.418 -19.935 -10.326 1.00 0.00 C ATOM 1862 C GLN B 645 -1.539 -19.338 -11.420 1.00 0.00 C ATOM 1863 O GLN B 645 -0.721 -20.032 -12.021 1.00 0.00 O ATOM 1864 CB GLN B 645 -3.894 -19.728 -10.670 1.00 0.00 C ATOM 1865 CG GLN B 645 -4.847 -20.266 -9.615 1.00 0.00 C ATOM 1866 CD GLN B 645 -5.042 -21.766 -9.717 1.00 0.00 C ATOM 1867 OE1 GLN B 645 -5.849 -22.246 -10.513 1.00 0.00 O ATOM 1868 NE2 GLN B 645 -4.302 -22.516 -8.908 1.00 0.00 N ATOM 0 H GLN B 645 -2.644 -18.496 -8.816 1.00 0.00 H new ATOM 0 HA GLN B 645 -2.214 -21.004 -10.265 1.00 0.00 H new ATOM 0 HB2 GLN B 645 -4.080 -18.663 -10.806 1.00 0.00 H new ATOM 0 HB3 GLN B 645 -4.108 -20.214 -11.622 1.00 0.00 H new ATOM 0 HG2 GLN B 645 -4.464 -20.020 -8.625 1.00 0.00 H new ATOM 0 HG3 GLN B 645 -5.812 -19.770 -9.716 1.00 0.00 H new ATOM 0 HE21 GLN B 645 -3.645 -22.076 -8.263 1.00 0.00 H new ATOM 0 HE22 GLN B 645 -4.391 -23.532 -8.931 1.00 0.00 H new ATOM 1875 N GLY B 646 -1.715 -18.045 -11.673 1.00 0.00 N ATOM 1876 CA GLY B 646 -0.931 -17.376 -12.696 1.00 0.00 C ATOM 1877 C GLY B 646 -1.603 -17.409 -14.055 1.00 0.00 C ATOM 1878 O GLY B 646 -0.949 -17.226 -15.082 1.00 0.00 O ATOM 0 H GLY B 646 -2.386 -17.449 -11.189 1.00 0.00 H new ATOM 0 HA2 GLY B 646 -0.764 -16.340 -12.402 1.00 0.00 H new ATOM 0 HA3 GLY B 646 0.048 -17.849 -12.767 1.00 0.00 H new ATOM 1882 N ASP B 647 -2.909 -17.645 -14.063 1.00 0.00 N ATOM 1883 CA ASP B 647 -3.669 -17.704 -15.306 1.00 0.00 C ATOM 1884 C ASP B 647 -4.975 -16.925 -15.182 1.00 0.00 C ATOM 1885 O ASP B 647 -5.951 -17.213 -15.875 1.00 0.00 O ATOM 1886 CB ASP B 647 -3.961 -19.157 -15.683 1.00 0.00 C ATOM 1887 CG ASP B 647 -3.564 -19.476 -17.111 1.00 0.00 C ATOM 1888 OD1 ASP B 647 -4.383 -19.238 -18.022 1.00 0.00 O ATOM 1889 OD2 ASP B 647 -2.434 -19.966 -17.317 1.00 0.00 O ATOM 0 H ASP B 647 -3.465 -17.799 -13.222 1.00 0.00 H new ATOM 0 HA ASP B 647 -3.068 -17.247 -16.092 1.00 0.00 H new ATOM 0 HB2 ASP B 647 -3.426 -19.820 -15.003 1.00 0.00 H new ATOM 0 HB3 ASP B 647 -5.024 -19.357 -15.551 1.00 0.00 H new ATOM 1893 N THR B 648 -4.986 -15.936 -14.294 1.00 0.00 N ATOM 1894 CA THR B 648 -6.172 -15.116 -14.078 1.00 0.00 C ATOM 1895 C THR B 648 -5.891 -13.651 -14.386 1.00 0.00 C ATOM 1896 O THR B 648 -6.779 -12.915 -14.815 1.00 0.00 O ATOM 1897 CB THR B 648 -6.680 -15.236 -12.628 1.00 0.00 C ATOM 1898 OG1 THR B 648 -5.636 -14.885 -11.712 1.00 0.00 O ATOM 1899 CG2 THR B 648 -7.161 -16.649 -12.338 1.00 0.00 C ATOM 0 H THR B 648 -4.187 -15.683 -13.713 1.00 0.00 H new ATOM 0 HA THR B 648 -6.940 -15.486 -14.757 1.00 0.00 H new ATOM 0 HB THR B 648 -7.518 -14.551 -12.503 1.00 0.00 H new ATOM 0 HG1 THR B 648 -4.987 -15.617 -11.660 1.00 0.00 H new ATOM 0 HG21 THR B 648 -7.515 -16.709 -11.309 1.00 0.00 H new ATOM 0 HG22 THR B 648 -7.975 -16.903 -13.017 1.00 0.00 H new ATOM 0 HG23 THR B 648 -6.338 -17.350 -12.480 1.00 0.00 H new ATOM 1907 N GLY B 649 -4.648 -13.231 -14.165 1.00 0.00 N ATOM 1908 CA GLY B 649 -4.273 -11.853 -14.427 1.00 0.00 C ATOM 1909 C GLY B 649 -2.861 -11.542 -13.972 1.00 0.00 C ATOM 1910 O GLY B 649 -1.963 -11.359 -14.795 1.00 0.00 O ATOM 0 H GLY B 649 -3.895 -13.820 -13.810 1.00 0.00 H new ATOM 0 HA2 GLY B 649 -4.360 -11.652 -15.495 1.00 0.00 H new ATOM 0 HA3 GLY B 649 -4.970 -11.187 -13.919 1.00 0.00 H new ATOM 1914 N ILE B 650 -2.664 -11.478 -12.660 1.00 0.00 N ATOM 1915 CA ILE B 650 -1.351 -11.184 -12.098 1.00 0.00 C ATOM 1916 C ILE B 650 -0.652 -12.461 -11.641 1.00 0.00 C ATOM 1917 O ILE B 650 -1.290 -13.388 -11.142 1.00 0.00 O ATOM 1918 CB ILE B 650 -1.452 -10.214 -10.908 1.00 0.00 C ATOM 1919 CG1 ILE B 650 -2.122 -8.908 -11.342 1.00 0.00 C ATOM 1920 CG2 ILE B 650 -0.072 -9.939 -10.329 1.00 0.00 C ATOM 1921 CD1 ILE B 650 -2.268 -7.901 -10.223 1.00 0.00 C ATOM 0 H ILE B 650 -3.397 -11.626 -11.966 1.00 0.00 H new ATOM 0 HA ILE B 650 -0.766 -10.714 -12.889 1.00 0.00 H new ATOM 0 HB ILE B 650 -2.064 -10.676 -10.134 1.00 0.00 H new ATOM 0 HG12 ILE B 650 -1.540 -8.461 -12.148 1.00 0.00 H new ATOM 0 HG13 ILE B 650 -3.108 -9.133 -11.748 1.00 0.00 H new ATOM 0 HG21 ILE B 650 -0.161 -9.251 -9.488 1.00 0.00 H new ATOM 0 HG22 ILE B 650 0.372 -10.874 -9.988 1.00 0.00 H new ATOM 0 HG23 ILE B 650 0.562 -9.495 -11.096 1.00 0.00 H new ATOM 0 HD11 ILE B 650 -2.751 -7.001 -10.604 1.00 0.00 H new ATOM 0 HD12 ILE B 650 -2.876 -8.329 -9.426 1.00 0.00 H new ATOM 0 HD13 ILE B 650 -1.283 -7.647 -9.832 1.00 0.00 H new ATOM 1932 N THR B 651 0.666 -12.500 -11.812 1.00 0.00 N ATOM 1933 CA THR B 651 1.453 -13.661 -11.417 1.00 0.00 C ATOM 1934 C THR B 651 2.118 -13.439 -10.062 1.00 0.00 C ATOM 1935 O THR B 651 2.068 -12.341 -9.508 1.00 0.00 O ATOM 1936 CB THR B 651 2.538 -13.987 -12.461 1.00 0.00 C ATOM 1937 OG1 THR B 651 2.313 -13.226 -13.653 1.00 0.00 O ATOM 1938 CG2 THR B 651 2.540 -15.472 -12.793 1.00 0.00 C ATOM 0 H THR B 651 1.210 -11.741 -12.221 1.00 0.00 H new ATOM 0 HA THR B 651 0.763 -14.502 -11.347 1.00 0.00 H new ATOM 0 HB THR B 651 3.509 -13.724 -12.040 1.00 0.00 H new ATOM 0 HG1 THR B 651 3.007 -13.437 -14.312 1.00 0.00 H new ATOM 0 HG21 THR B 651 3.314 -15.679 -13.532 1.00 0.00 H new ATOM 0 HG22 THR B 651 2.739 -16.047 -11.889 1.00 0.00 H new ATOM 0 HG23 THR B 651 1.568 -15.756 -13.197 1.00 0.00 H new ATOM 1946 N TYR B 652 2.741 -14.488 -9.537 1.00 0.00 N ATOM 1947 CA TYR B 652 3.415 -14.408 -8.246 1.00 0.00 C ATOM 1948 C TYR B 652 4.608 -13.457 -8.312 1.00 0.00 C ATOM 1949 O TYR B 652 4.873 -12.713 -7.369 1.00 0.00 O ATOM 1950 CB TYR B 652 3.879 -15.795 -7.802 1.00 0.00 C ATOM 1951 CG TYR B 652 4.890 -16.423 -8.735 1.00 0.00 C ATOM 1952 CD1 TYR B 652 4.482 -17.190 -9.818 1.00 0.00 C ATOM 1953 CD2 TYR B 652 6.254 -16.248 -8.532 1.00 0.00 C ATOM 1954 CE1 TYR B 652 5.402 -17.767 -10.673 1.00 0.00 C ATOM 1955 CE2 TYR B 652 7.181 -16.819 -9.382 1.00 0.00 C ATOM 1956 CZ TYR B 652 6.750 -17.578 -10.450 1.00 0.00 C ATOM 1957 OH TYR B 652 7.670 -18.148 -11.300 1.00 0.00 O ATOM 0 H TYR B 652 2.793 -15.403 -9.985 1.00 0.00 H new ATOM 0 HA TYR B 652 2.703 -14.020 -7.517 1.00 0.00 H new ATOM 0 HB2 TYR B 652 4.314 -15.722 -6.805 1.00 0.00 H new ATOM 0 HB3 TYR B 652 3.012 -16.451 -7.724 1.00 0.00 H new ATOM 0 HD1 TYR B 652 3.427 -17.338 -9.995 1.00 0.00 H new ATOM 0 HD2 TYR B 652 6.595 -15.656 -7.696 1.00 0.00 H new ATOM 0 HE1 TYR B 652 5.068 -18.362 -11.510 1.00 0.00 H new ATOM 0 HE2 TYR B 652 8.237 -16.672 -9.211 1.00 0.00 H new ATOM 0 HH TYR B 652 8.575 -17.918 -11.004 1.00 0.00 H new ATOM 1966 N GLN B 653 5.320 -13.490 -9.433 1.00 0.00 N ATOM 1967 CA GLN B 653 6.484 -12.633 -9.623 1.00 0.00 C ATOM 1968 C GLN B 653 6.062 -11.186 -9.862 1.00 0.00 C ATOM 1969 O GLN B 653 6.675 -10.257 -9.340 1.00 0.00 O ATOM 1970 CB GLN B 653 7.325 -13.131 -10.799 1.00 0.00 C ATOM 1971 CG GLN B 653 6.560 -13.191 -12.112 1.00 0.00 C ATOM 1972 CD GLN B 653 7.378 -13.793 -13.237 1.00 0.00 C ATOM 1973 OE1 GLN B 653 8.365 -14.490 -12.999 1.00 0.00 O ATOM 1974 NE2 GLN B 653 6.971 -13.528 -14.473 1.00 0.00 N ATOM 0 H GLN B 653 5.112 -14.100 -10.223 1.00 0.00 H new ATOM 0 HA GLN B 653 7.084 -12.673 -8.714 1.00 0.00 H new ATOM 0 HB2 GLN B 653 8.188 -12.477 -10.921 1.00 0.00 H new ATOM 0 HB3 GLN B 653 7.708 -14.124 -10.566 1.00 0.00 H new ATOM 0 HG2 GLN B 653 5.653 -13.779 -11.973 1.00 0.00 H new ATOM 0 HG3 GLN B 653 6.248 -12.185 -12.393 1.00 0.00 H new ATOM 0 HE21 GLN B 653 6.148 -12.946 -14.625 1.00 0.00 H new ATOM 0 HE22 GLN B 653 7.482 -13.907 -15.270 1.00 0.00 H new ATOM 1981 N ALA B 654 5.011 -11.006 -10.655 1.00 0.00 N ATOM 1982 CA ALA B 654 4.505 -9.673 -10.961 1.00 0.00 C ATOM 1983 C ALA B 654 3.859 -9.035 -9.736 1.00 0.00 C ATOM 1984 O ALA B 654 4.146 -7.887 -9.400 1.00 0.00 O ATOM 1985 CB ALA B 654 3.511 -9.737 -12.111 1.00 0.00 C ATOM 0 H ALA B 654 4.493 -11.766 -11.097 1.00 0.00 H new ATOM 0 HA ALA B 654 5.349 -9.051 -11.259 1.00 0.00 H new ATOM 0 HB1 ALA B 654 3.141 -8.735 -12.329 1.00 0.00 H new ATOM 0 HB2 ALA B 654 4.003 -10.142 -12.995 1.00 0.00 H new ATOM 0 HB3 ALA B 654 2.675 -10.380 -11.834 1.00 0.00 H new ATOM 1991 N TRP B 655 2.988 -9.787 -9.074 1.00 0.00 N ATOM 1992 CA TRP B 655 2.301 -9.294 -7.886 1.00 0.00 C ATOM 1993 C TRP B 655 3.300 -8.794 -6.848 1.00 0.00 C ATOM 1994 O TRP B 655 3.138 -7.708 -6.293 1.00 0.00 O ATOM 1995 CB TRP B 655 1.429 -10.396 -7.283 1.00 0.00 C ATOM 1996 CG TRP B 655 0.477 -9.895 -6.238 1.00 0.00 C ATOM 1997 CD1 TRP B 655 -0.852 -9.625 -6.402 1.00 0.00 C ATOM 1998 CD2 TRP B 655 0.782 -9.603 -4.870 1.00 0.00 C ATOM 1999 NE1 TRP B 655 -1.390 -9.182 -5.219 1.00 0.00 N ATOM 2000 CE2 TRP B 655 -0.410 -9.160 -4.263 1.00 0.00 C ATOM 2001 CE3 TRP B 655 1.945 -9.674 -4.098 1.00 0.00 C ATOM 2002 CZ2 TRP B 655 -0.469 -8.791 -2.922 1.00 0.00 C ATOM 2003 CZ3 TRP B 655 1.885 -9.305 -2.768 1.00 0.00 C ATOM 2004 CH2 TRP B 655 0.685 -8.870 -2.190 1.00 0.00 C ATOM 0 H TRP B 655 2.741 -10.740 -9.339 1.00 0.00 H new ATOM 0 HA TRP B 655 1.666 -8.459 -8.183 1.00 0.00 H new ATOM 0 HB2 TRP B 655 0.862 -10.878 -8.080 1.00 0.00 H new ATOM 0 HB3 TRP B 655 2.072 -11.158 -6.843 1.00 0.00 H new ATOM 0 HD1 TRP B 655 -1.399 -9.743 -7.326 1.00 0.00 H new ATOM 0 HE1 TRP B 655 -2.363 -8.913 -5.075 1.00 0.00 H new ATOM 0 HE3 TRP B 655 2.874 -10.011 -4.533 1.00 0.00 H new ATOM 0 HZ2 TRP B 655 -1.393 -8.454 -2.475 1.00 0.00 H new ATOM 0 HZ3 TRP B 655 2.779 -9.353 -2.163 1.00 0.00 H new ATOM 0 HH2 TRP B 655 0.670 -8.592 -1.147 1.00 0.00 H new ATOM 2014 N GLN B 656 4.331 -9.592 -6.593 1.00 0.00 N ATOM 2015 CA GLN B 656 5.355 -9.228 -5.620 1.00 0.00 C ATOM 2016 C GLN B 656 5.956 -7.865 -5.947 1.00 0.00 C ATOM 2017 O GLN B 656 6.440 -7.160 -5.061 1.00 0.00 O ATOM 2018 CB GLN B 656 6.457 -10.288 -5.587 1.00 0.00 C ATOM 2019 CG GLN B 656 6.084 -11.527 -4.788 1.00 0.00 C ATOM 2020 CD GLN B 656 6.037 -11.267 -3.296 1.00 0.00 C ATOM 2021 OE1 GLN B 656 5.121 -10.612 -2.797 1.00 0.00 O ATOM 2022 NE2 GLN B 656 7.026 -11.779 -2.573 1.00 0.00 N ATOM 0 H GLN B 656 4.480 -10.494 -7.046 1.00 0.00 H new ATOM 0 HA GLN B 656 4.884 -9.172 -4.639 1.00 0.00 H new ATOM 0 HB2 GLN B 656 6.697 -10.583 -6.609 1.00 0.00 H new ATOM 0 HB3 GLN B 656 7.359 -9.849 -5.162 1.00 0.00 H new ATOM 0 HG2 GLN B 656 5.111 -11.890 -5.120 1.00 0.00 H new ATOM 0 HG3 GLN B 656 6.806 -12.318 -4.993 1.00 0.00 H new ATOM 0 HE21 GLN B 656 7.765 -12.315 -3.027 1.00 0.00 H new ATOM 0 HE22 GLN B 656 7.047 -11.636 -1.563 1.00 0.00 H new ATOM 2029 N ALA B 657 5.922 -7.499 -7.225 1.00 0.00 N ATOM 2030 CA ALA B 657 6.461 -6.219 -7.668 1.00 0.00 C ATOM 2031 C ALA B 657 5.395 -5.129 -7.622 1.00 0.00 C ATOM 2032 O ALA B 657 5.651 -4.018 -7.158 1.00 0.00 O ATOM 2033 CB ALA B 657 7.031 -6.345 -9.073 1.00 0.00 C ATOM 0 H ALA B 657 5.527 -8.071 -7.971 1.00 0.00 H new ATOM 0 HA ALA B 657 7.263 -5.934 -6.987 1.00 0.00 H new ATOM 0 HB1 ALA B 657 7.430 -5.382 -9.391 1.00 0.00 H new ATOM 0 HB2 ALA B 657 7.829 -7.088 -9.077 1.00 0.00 H new ATOM 0 HB3 ALA B 657 6.243 -6.656 -9.759 1.00 0.00 H new ATOM 2039 N GLN B 658 4.202 -5.455 -8.108 1.00 0.00 N ATOM 2040 CA GLN B 658 3.099 -4.501 -8.125 1.00 0.00 C ATOM 2041 C GLN B 658 2.790 -4.001 -6.716 1.00 0.00 C ATOM 2042 O GLN B 658 2.721 -2.796 -6.478 1.00 0.00 O ATOM 2043 CB GLN B 658 1.851 -5.143 -8.735 1.00 0.00 C ATOM 2044 CG GLN B 658 1.826 -5.100 -10.254 1.00 0.00 C ATOM 2045 CD GLN B 658 0.648 -5.854 -10.840 1.00 0.00 C ATOM 2046 OE1 GLN B 658 -0.475 -5.351 -10.864 1.00 0.00 O ATOM 2047 NE2 GLN B 658 0.900 -7.067 -11.317 1.00 0.00 N ATOM 0 H GLN B 658 3.974 -6.371 -8.495 1.00 0.00 H new ATOM 0 HA GLN B 658 3.398 -3.650 -8.737 1.00 0.00 H new ATOM 0 HB2 GLN B 658 1.790 -6.181 -8.408 1.00 0.00 H new ATOM 0 HB3 GLN B 658 0.966 -4.635 -8.351 1.00 0.00 H new ATOM 0 HG2 GLN B 658 1.788 -4.062 -10.584 1.00 0.00 H new ATOM 0 HG3 GLN B 658 2.753 -5.524 -10.641 1.00 0.00 H new ATOM 0 HE21 GLN B 658 1.847 -7.444 -11.276 1.00 0.00 H new ATOM 0 HE22 GLN B 658 0.147 -7.621 -11.724 1.00 0.00 H new ATOM 2054 N TRP B 659 2.608 -4.934 -5.790 1.00 0.00 N ATOM 2055 CA TRP B 659 2.307 -4.588 -4.406 1.00 0.00 C ATOM 2056 C TRP B 659 3.322 -3.589 -3.861 1.00 0.00 C ATOM 2057 O TRP B 659 2.963 -2.489 -3.445 1.00 0.00 O ATOM 2058 CB TRP B 659 2.292 -5.846 -3.535 1.00 0.00 C ATOM 2059 CG TRP B 659 1.870 -5.585 -2.121 1.00 0.00 C ATOM 2060 CD1 TRP B 659 2.688 -5.353 -1.051 1.00 0.00 C ATOM 2061 CD2 TRP B 659 0.529 -5.529 -1.622 1.00 0.00 C ATOM 2062 NE1 TRP B 659 1.934 -5.157 0.082 1.00 0.00 N ATOM 2063 CE2 TRP B 659 0.607 -5.260 -0.243 1.00 0.00 C ATOM 2064 CE3 TRP B 659 -0.731 -5.679 -2.209 1.00 0.00 C ATOM 2065 CZ2 TRP B 659 -0.526 -5.139 0.558 1.00 0.00 C ATOM 2066 CZ3 TRP B 659 -1.855 -5.560 -1.413 1.00 0.00 C ATOM 2067 CH2 TRP B 659 -1.746 -5.291 -0.043 1.00 0.00 C ATOM 0 H TRP B 659 2.663 -5.936 -5.972 1.00 0.00 H new ATOM 0 HA TRP B 659 1.320 -4.125 -4.380 1.00 0.00 H new ATOM 0 HB2 TRP B 659 1.617 -6.578 -3.979 1.00 0.00 H new ATOM 0 HB3 TRP B 659 3.288 -6.290 -3.533 1.00 0.00 H new ATOM 0 HD1 TRP B 659 3.767 -5.327 -1.090 1.00 0.00 H new ATOM 0 HE1 TRP B 659 2.303 -4.966 1.014 1.00 0.00 H new ATOM 0 HE3 TRP B 659 -0.825 -5.884 -3.265 1.00 0.00 H new ATOM 0 HZ2 TRP B 659 -0.445 -4.933 1.615 1.00 0.00 H new ATOM 0 HZ3 TRP B 659 -2.833 -5.676 -1.855 1.00 0.00 H new ATOM 0 HH2 TRP B 659 -2.643 -5.202 0.551 1.00 0.00 H new ATOM 2077 N ASN B 660 4.592 -3.981 -3.869 1.00 0.00 N ATOM 2078 CA ASN B 660 5.660 -3.119 -3.374 1.00 0.00 C ATOM 2079 C ASN B 660 5.676 -1.790 -4.123 1.00 0.00 C ATOM 2080 O ASN B 660 5.669 -0.722 -3.511 1.00 0.00 O ATOM 2081 CB ASN B 660 7.015 -3.816 -3.520 1.00 0.00 C ATOM 2082 CG ASN B 660 7.331 -4.718 -2.342 1.00 0.00 C ATOM 2083 OD1 ASN B 660 8.348 -4.548 -1.672 1.00 0.00 O ATOM 2084 ND2 ASN B 660 6.456 -5.684 -2.087 1.00 0.00 N ATOM 0 H ASN B 660 4.907 -4.889 -4.212 1.00 0.00 H new ATOM 0 HA ASN B 660 5.473 -2.919 -2.319 1.00 0.00 H new ATOM 0 HB2 ASN B 660 7.021 -4.405 -4.437 1.00 0.00 H new ATOM 0 HB3 ASN B 660 7.798 -3.065 -3.619 1.00 0.00 H new ATOM 0 HD21 ASN B 660 6.614 -6.323 -1.308 1.00 0.00 H new ATOM 0 HD22 ASN B 660 5.626 -5.787 -2.670 1.00 0.00 H new ATOM 2090 N GLN B 661 5.698 -1.864 -5.450 1.00 0.00 N ATOM 2091 CA GLN B 661 5.715 -0.666 -6.282 1.00 0.00 C ATOM 2092 C GLN B 661 4.575 0.274 -5.906 1.00 0.00 C ATOM 2093 O GLN B 661 4.698 1.492 -6.022 1.00 0.00 O ATOM 2094 CB GLN B 661 5.614 -1.045 -7.760 1.00 0.00 C ATOM 2095 CG GLN B 661 6.884 -1.666 -8.318 1.00 0.00 C ATOM 2096 CD GLN B 661 7.739 -0.666 -9.073 1.00 0.00 C ATOM 2097 OE1 GLN B 661 7.251 0.048 -9.950 1.00 0.00 O ATOM 2098 NE2 GLN B 661 9.022 -0.610 -8.736 1.00 0.00 N ATOM 0 H GLN B 661 5.704 -2.740 -5.972 1.00 0.00 H new ATOM 0 HA GLN B 661 6.659 -0.148 -6.111 1.00 0.00 H new ATOM 0 HB2 GLN B 661 4.789 -1.746 -7.891 1.00 0.00 H new ATOM 0 HB3 GLN B 661 5.371 -0.154 -8.339 1.00 0.00 H new ATOM 0 HG2 GLN B 661 7.466 -2.092 -7.500 1.00 0.00 H new ATOM 0 HG3 GLN B 661 6.620 -2.488 -8.983 1.00 0.00 H new ATOM 0 HE21 GLN B 661 9.384 -1.220 -8.003 1.00 0.00 H new ATOM 0 HE22 GLN B 661 9.646 0.043 -9.210 1.00 0.00 H new ATOM 2105 N ALA B 662 3.465 -0.301 -5.455 1.00 0.00 N ATOM 2106 CA ALA B 662 2.303 0.485 -5.061 1.00 0.00 C ATOM 2107 C ALA B 662 2.507 1.115 -3.686 1.00 0.00 C ATOM 2108 O ALA B 662 2.386 2.329 -3.527 1.00 0.00 O ATOM 2109 CB ALA B 662 1.052 -0.381 -5.066 1.00 0.00 C ATOM 0 H ALA B 662 3.346 -1.309 -5.353 1.00 0.00 H new ATOM 0 HA ALA B 662 2.177 1.289 -5.786 1.00 0.00 H new ATOM 0 HB1 ALA B 662 0.192 0.220 -4.770 1.00 0.00 H new ATOM 0 HB2 ALA B 662 0.889 -0.779 -6.068 1.00 0.00 H new ATOM 0 HB3 ALA B 662 1.177 -1.206 -4.364 1.00 0.00 H new ATOM 2115 N MET B 663 2.816 0.282 -2.699 1.00 0.00 N ATOM 2116 CA MET B 663 3.036 0.758 -1.338 1.00 0.00 C ATOM 2117 C MET B 663 4.083 1.868 -1.315 1.00 0.00 C ATOM 2118 O MET B 663 4.040 2.755 -0.462 1.00 0.00 O ATOM 2119 CB MET B 663 3.479 -0.396 -0.437 1.00 0.00 C ATOM 2120 CG MET B 663 2.337 -1.036 0.335 1.00 0.00 C ATOM 2121 SD MET B 663 1.984 -0.188 1.887 1.00 0.00 S ATOM 2122 CE MET B 663 0.269 -0.639 2.137 1.00 0.00 C ATOM 0 H MET B 663 2.920 -0.726 -2.815 1.00 0.00 H new ATOM 0 HA MET B 663 2.095 1.161 -0.963 1.00 0.00 H new ATOM 0 HB2 MET B 663 3.966 -1.157 -1.047 1.00 0.00 H new ATOM 0 HB3 MET B 663 4.224 -0.030 0.269 1.00 0.00 H new ATOM 0 HG2 MET B 663 1.441 -1.038 -0.285 1.00 0.00 H new ATOM 0 HG3 MET B 663 2.583 -2.077 0.543 1.00 0.00 H new ATOM 0 HE1 MET B 663 -0.333 0.264 2.242 1.00 0.00 H new ATOM 0 HE2 MET B 663 -0.085 -1.213 1.281 1.00 0.00 H new ATOM 0 HE3 MET B 663 0.179 -1.242 3.040 1.00 0.00 H new ATOM 2130 N GLU B 664 5.021 1.811 -2.254 1.00 0.00 N ATOM 2131 CA GLU B 664 6.079 2.812 -2.338 1.00 0.00 C ATOM 2132 C GLU B 664 5.492 4.210 -2.509 1.00 0.00 C ATOM 2133 O GLU B 664 5.769 5.111 -1.718 1.00 0.00 O ATOM 2134 CB GLU B 664 7.019 2.495 -3.503 1.00 0.00 C ATOM 2135 CG GLU B 664 8.013 3.605 -3.802 1.00 0.00 C ATOM 2136 CD GLU B 664 9.312 3.083 -4.385 1.00 0.00 C ATOM 2137 OE1 GLU B 664 9.799 2.036 -3.911 1.00 0.00 O ATOM 2138 OE2 GLU B 664 9.842 3.723 -5.318 1.00 0.00 O ATOM 0 H GLU B 664 5.071 1.083 -2.967 1.00 0.00 H new ATOM 0 HA GLU B 664 6.645 2.786 -1.407 1.00 0.00 H new ATOM 0 HB2 GLU B 664 7.566 1.579 -3.279 1.00 0.00 H new ATOM 0 HB3 GLU B 664 6.425 2.301 -4.396 1.00 0.00 H new ATOM 0 HG2 GLU B 664 7.564 4.312 -4.500 1.00 0.00 H new ATOM 0 HG3 GLU B 664 8.225 4.154 -2.885 1.00 0.00 H new ATOM 2143 N ASP B 665 4.682 4.382 -3.547 1.00 0.00 N ATOM 2144 CA ASP B 665 4.055 5.669 -3.824 1.00 0.00 C ATOM 2145 C ASP B 665 2.893 5.924 -2.869 1.00 0.00 C ATOM 2146 O ASP B 665 2.619 7.066 -2.498 1.00 0.00 O ATOM 2147 CB ASP B 665 3.564 5.722 -5.271 1.00 0.00 C ATOM 2148 CG ASP B 665 2.977 7.072 -5.634 1.00 0.00 C ATOM 2149 OD1 ASP B 665 1.815 7.333 -5.260 1.00 0.00 O ATOM 2150 OD2 ASP B 665 3.679 7.867 -6.294 1.00 0.00 O ATOM 0 H ASP B 665 4.444 3.646 -4.211 1.00 0.00 H new ATOM 0 HA ASP B 665 4.802 6.448 -3.675 1.00 0.00 H new ATOM 0 HB2 ASP B 665 4.394 5.498 -5.942 1.00 0.00 H new ATOM 0 HB3 ASP B 665 2.812 4.949 -5.425 1.00 0.00 H new ATOM 2154 N LEU B 666 2.212 4.853 -2.476 1.00 0.00 N ATOM 2155 CA LEU B 666 1.077 4.960 -1.565 1.00 0.00 C ATOM 2156 C LEU B 666 1.524 5.456 -0.194 1.00 0.00 C ATOM 2157 O LEU B 666 0.798 6.185 0.482 1.00 0.00 O ATOM 2158 CB LEU B 666 0.380 3.605 -1.427 1.00 0.00 C ATOM 2159 CG LEU B 666 -0.491 3.421 -0.184 1.00 0.00 C ATOM 2160 CD1 LEU B 666 -1.864 2.895 -0.566 1.00 0.00 C ATOM 2161 CD2 LEU B 666 0.186 2.485 0.806 1.00 0.00 C ATOM 0 H LEU B 666 2.426 3.901 -2.774 1.00 0.00 H new ATOM 0 HA LEU B 666 0.375 5.683 -1.981 1.00 0.00 H new ATOM 0 HB2 LEU B 666 -0.242 3.448 -2.308 1.00 0.00 H new ATOM 0 HB3 LEU B 666 1.142 2.825 -1.431 1.00 0.00 H new ATOM 0 HG LEU B 666 -0.619 4.392 0.294 1.00 0.00 H new ATOM 0 HD11 LEU B 666 -2.469 2.771 0.332 1.00 0.00 H new ATOM 0 HD12 LEU B 666 -2.351 3.603 -1.237 1.00 0.00 H new ATOM 0 HD13 LEU B 666 -1.758 1.933 -1.068 1.00 0.00 H new ATOM 0 HD21 LEU B 666 -0.447 2.365 1.685 1.00 0.00 H new ATOM 0 HD22 LEU B 666 0.345 1.514 0.338 1.00 0.00 H new ATOM 0 HD23 LEU B 666 1.146 2.905 1.105 1.00 0.00 H new ATOM 2172 N VAL B 667 2.726 5.058 0.210 1.00 0.00 N ATOM 2173 CA VAL B 667 3.272 5.464 1.500 1.00 0.00 C ATOM 2174 C VAL B 667 3.628 6.947 1.502 1.00 0.00 C ATOM 2175 O VAL B 667 3.203 7.696 2.382 1.00 0.00 O ATOM 2176 CB VAL B 667 4.525 4.645 1.862 1.00 0.00 C ATOM 2177 CG1 VAL B 667 5.366 5.384 2.893 1.00 0.00 C ATOM 2178 CG2 VAL B 667 4.132 3.267 2.372 1.00 0.00 C ATOM 0 H VAL B 667 3.340 4.455 -0.337 1.00 0.00 H new ATOM 0 HA VAL B 667 2.499 5.278 2.245 1.00 0.00 H new ATOM 0 HB VAL B 667 5.126 4.516 0.962 1.00 0.00 H new ATOM 0 HG11 VAL B 667 6.247 4.790 3.137 1.00 0.00 H new ATOM 0 HG12 VAL B 667 5.678 6.346 2.486 1.00 0.00 H new ATOM 0 HG13 VAL B 667 4.776 5.546 3.795 1.00 0.00 H new ATOM 0 HG21 VAL B 667 5.030 2.702 2.623 1.00 0.00 H new ATOM 0 HG22 VAL B 667 3.509 3.372 3.260 1.00 0.00 H new ATOM 0 HG23 VAL B 667 3.575 2.738 1.599 1.00 0.00 H new ATOM 2188 N ARG B 668 4.412 7.364 0.513 1.00 0.00 N ATOM 2189 CA ARG B 668 4.826 8.757 0.401 1.00 0.00 C ATOM 2190 C ARG B 668 3.638 9.652 0.061 1.00 0.00 C ATOM 2191 O ARG B 668 3.600 10.820 0.444 1.00 0.00 O ATOM 2192 CB ARG B 668 5.911 8.904 -0.667 1.00 0.00 C ATOM 2193 CG ARG B 668 5.510 8.348 -2.023 1.00 0.00 C ATOM 2194 CD ARG B 668 6.706 8.239 -2.956 1.00 0.00 C ATOM 2195 NE ARG B 668 7.627 7.182 -2.544 1.00 0.00 N ATOM 2196 CZ ARG B 668 8.899 7.129 -2.920 1.00 0.00 C ATOM 2197 NH1 ARG B 668 9.400 8.067 -3.712 1.00 0.00 N ATOM 2198 NH2 ARG B 668 9.675 6.136 -2.503 1.00 0.00 N ATOM 0 H ARG B 668 4.773 6.756 -0.222 1.00 0.00 H new ATOM 0 HA ARG B 668 5.229 9.069 1.365 1.00 0.00 H new ATOM 0 HB2 ARG B 668 6.161 9.959 -0.776 1.00 0.00 H new ATOM 0 HB3 ARG B 668 6.814 8.396 -0.328 1.00 0.00 H new ATOM 0 HG2 ARG B 668 5.056 7.365 -1.895 1.00 0.00 H new ATOM 0 HG3 ARG B 668 4.754 8.992 -2.472 1.00 0.00 H new ATOM 0 HD2 ARG B 668 6.358 8.042 -3.970 1.00 0.00 H new ATOM 0 HD3 ARG B 668 7.235 9.192 -2.980 1.00 0.00 H new ATOM 0 HE ARG B 668 7.273 6.445 -1.934 1.00 0.00 H new ATOM 0 HH11 ARG B 668 8.808 8.832 -4.034 1.00 0.00 H new ATOM 0 HH12 ARG B 668 10.378 8.023 -3.999 1.00 0.00 H new ATOM 0 HH21 ARG B 668 9.294 5.413 -1.893 1.00 0.00 H new ATOM 0 HH22 ARG B 668 10.652 6.096 -2.793 1.00 0.00 H new ATOM 2209 N ALA B 669 2.670 9.094 -0.660 1.00 0.00 N ATOM 2210 CA ALA B 669 1.481 9.841 -1.050 1.00 0.00 C ATOM 2211 C ALA B 669 0.772 10.419 0.170 1.00 0.00 C ATOM 2212 O ALA B 669 0.211 11.514 0.112 1.00 0.00 O ATOM 2213 CB ALA B 669 0.535 8.950 -1.841 1.00 0.00 C ATOM 0 H ALA B 669 2.687 8.127 -0.985 1.00 0.00 H new ATOM 0 HA ALA B 669 1.794 10.672 -1.683 1.00 0.00 H new ATOM 0 HB1 ALA B 669 -0.349 9.520 -2.126 1.00 0.00 H new ATOM 0 HB2 ALA B 669 1.039 8.590 -2.738 1.00 0.00 H new ATOM 0 HB3 ALA B 669 0.236 8.101 -1.227 1.00 0.00 H new ATOM 2219 N TYR B 670 0.799 9.677 1.270 1.00 0.00 N ATOM 2220 CA TYR B 670 0.155 10.114 2.503 1.00 0.00 C ATOM 2221 C TYR B 670 1.085 11.010 3.316 1.00 0.00 C ATOM 2222 O TYR B 670 0.719 12.122 3.698 1.00 0.00 O ATOM 2223 CB TYR B 670 -0.268 8.906 3.340 1.00 0.00 C ATOM 2224 CG TYR B 670 -1.088 9.268 4.557 1.00 0.00 C ATOM 2225 CD1 TYR B 670 -0.475 9.581 5.765 1.00 0.00 C ATOM 2226 CD2 TYR B 670 -2.476 9.299 4.500 1.00 0.00 C ATOM 2227 CE1 TYR B 670 -1.220 9.912 6.880 1.00 0.00 C ATOM 2228 CE2 TYR B 670 -3.230 9.630 5.610 1.00 0.00 C ATOM 2229 CZ TYR B 670 -2.597 9.935 6.797 1.00 0.00 C ATOM 2230 OH TYR B 670 -3.344 10.265 7.904 1.00 0.00 O ATOM 0 H TYR B 670 1.260 8.769 1.334 1.00 0.00 H new ATOM 0 HA TYR B 670 -0.731 10.689 2.235 1.00 0.00 H new ATOM 0 HB2 TYR B 670 -0.844 8.225 2.714 1.00 0.00 H new ATOM 0 HB3 TYR B 670 0.623 8.367 3.661 1.00 0.00 H new ATOM 0 HD1 TYR B 670 0.603 9.565 5.833 1.00 0.00 H new ATOM 0 HD2 TYR B 670 -2.974 9.060 3.572 1.00 0.00 H new ATOM 0 HE1 TYR B 670 -0.728 10.151 7.811 1.00 0.00 H new ATOM 0 HE2 TYR B 670 -4.308 9.650 5.548 1.00 0.00 H new ATOM 0 HH TYR B 670 -4.237 9.869 7.826 1.00 0.00 H new ATOM 2239 N HIS B 671 2.292 10.516 3.577 1.00 0.00 N ATOM 2240 CA HIS B 671 3.278 11.271 4.342 1.00 0.00 C ATOM 2241 C HIS B 671 3.468 12.667 3.757 1.00 0.00 C ATOM 2242 O HIS B 671 3.509 13.656 4.488 1.00 0.00 O ATOM 2243 CB HIS B 671 4.614 10.529 4.365 1.00 0.00 C ATOM 2244 CG HIS B 671 5.709 11.287 5.050 1.00 0.00 C ATOM 2245 ND1 HIS B 671 5.649 11.664 6.375 1.00 0.00 N ATOM 2246 CD2 HIS B 671 6.898 11.739 4.585 1.00 0.00 C ATOM 2247 CE1 HIS B 671 6.753 12.315 6.696 1.00 0.00 C ATOM 2248 NE2 HIS B 671 7.528 12.374 5.628 1.00 0.00 N ATOM 0 H HIS B 671 2.610 9.597 3.270 1.00 0.00 H new ATOM 0 HA HIS B 671 2.909 11.372 5.363 1.00 0.00 H new ATOM 0 HB2 HIS B 671 4.479 9.570 4.866 1.00 0.00 H new ATOM 0 HB3 HIS B 671 4.918 10.314 3.341 1.00 0.00 H new ATOM 0 HD2 HIS B 671 7.280 11.622 3.582 1.00 0.00 H new ATOM 0 HE1 HIS B 671 6.983 12.729 7.667 1.00 0.00 H new ATOM 0 HE2 HIS B 671 8.445 12.819 5.585 1.00 0.00 H new ATOM 2255 N ALA B 672 3.583 12.738 2.436 1.00 0.00 N ATOM 2256 CA ALA B 672 3.768 14.013 1.753 1.00 0.00 C ATOM 2257 C ALA B 672 2.560 14.922 1.952 1.00 0.00 C ATOM 2258 O ALA B 672 2.705 16.102 2.270 1.00 0.00 O ATOM 2259 CB ALA B 672 4.021 13.786 0.270 1.00 0.00 C ATOM 0 H ALA B 672 3.551 11.928 1.817 1.00 0.00 H new ATOM 0 HA ALA B 672 4.637 14.507 2.187 1.00 0.00 H new ATOM 0 HB1 ALA B 672 4.157 14.746 -0.227 1.00 0.00 H new ATOM 0 HB2 ALA B 672 4.919 13.181 0.142 1.00 0.00 H new ATOM 0 HB3 ALA B 672 3.169 13.268 -0.169 1.00 0.00 H new ATOM 2265 N MET B 673 1.369 14.365 1.762 1.00 0.00 N ATOM 2266 CA MET B 673 0.135 15.127 1.921 1.00 0.00 C ATOM 2267 C MET B 673 0.046 15.732 3.319 1.00 0.00 C ATOM 2268 O MET B 673 -0.456 16.842 3.494 1.00 0.00 O ATOM 2269 CB MET B 673 -1.079 14.233 1.663 1.00 0.00 C ATOM 2270 CG MET B 673 -2.405 14.896 1.997 1.00 0.00 C ATOM 2271 SD MET B 673 -3.261 14.088 3.363 1.00 0.00 S ATOM 2272 CE MET B 673 -4.186 12.831 2.486 1.00 0.00 C ATOM 0 H MET B 673 1.232 13.389 1.498 1.00 0.00 H new ATOM 0 HA MET B 673 0.142 15.938 1.192 1.00 0.00 H new ATOM 0 HB2 MET B 673 -1.085 13.936 0.614 1.00 0.00 H new ATOM 0 HB3 MET B 673 -0.980 13.321 2.252 1.00 0.00 H new ATOM 0 HG2 MET B 673 -2.230 15.942 2.250 1.00 0.00 H new ATOM 0 HG3 MET B 673 -3.045 14.885 1.115 1.00 0.00 H new ATOM 0 HE1 MET B 673 -4.769 12.245 3.197 1.00 0.00 H new ATOM 0 HE2 MET B 673 -4.858 13.306 1.771 1.00 0.00 H new ATOM 0 HE3 MET B 673 -3.496 12.175 1.955 1.00 0.00 H new ATOM 2280 N SER B 674 0.539 14.995 4.310 1.00 0.00 N ATOM 2281 CA SER B 674 0.511 15.458 5.693 1.00 0.00 C ATOM 2282 C SER B 674 1.656 16.427 5.964 1.00 0.00 C ATOM 2283 O SER B 674 1.543 17.322 6.803 1.00 0.00 O ATOM 2284 CB SER B 674 0.595 14.269 6.653 1.00 0.00 C ATOM 2285 OG SER B 674 -0.573 13.470 6.578 1.00 0.00 O ATOM 0 H SER B 674 0.962 14.076 4.181 1.00 0.00 H new ATOM 0 HA SER B 674 -0.431 15.981 5.856 1.00 0.00 H new ATOM 0 HB2 SER B 674 1.469 13.664 6.412 1.00 0.00 H new ATOM 0 HB3 SER B 674 0.728 14.630 7.673 1.00 0.00 H new ATOM 0 HG SER B 674 -0.432 12.637 7.074 1.00 0.00 H new ATOM 2290 N SER B 675 2.761 16.244 5.248 1.00 0.00 N ATOM 2291 CA SER B 675 3.930 17.099 5.413 1.00 0.00 C ATOM 2292 C SER B 675 3.597 18.548 5.069 1.00 0.00 C ATOM 2293 O SER B 675 3.848 19.460 5.857 1.00 0.00 O ATOM 2294 CB SER B 675 5.079 16.605 4.532 1.00 0.00 C ATOM 2295 OG SER B 675 5.799 15.564 5.168 1.00 0.00 O ATOM 0 H SER B 675 2.871 15.511 4.548 1.00 0.00 H new ATOM 0 HA SER B 675 4.237 17.053 6.458 1.00 0.00 H new ATOM 0 HB2 SER B 675 4.684 16.249 3.580 1.00 0.00 H new ATOM 0 HB3 SER B 675 5.752 17.433 4.309 1.00 0.00 H new ATOM 0 HG SER B 675 5.276 14.736 5.134 1.00 0.00 H new ATOM 2300 N THR B 676 3.030 18.752 3.884 1.00 0.00 N ATOM 2301 CA THR B 676 2.662 20.088 3.432 1.00 0.00 C ATOM 2302 C THR B 676 1.416 20.588 4.153 1.00 0.00 C ATOM 2303 O THR B 676 1.048 21.759 4.039 1.00 0.00 O ATOM 2304 CB THR B 676 2.411 20.119 1.913 1.00 0.00 C ATOM 2305 OG1 THR B 676 2.801 18.872 1.326 1.00 0.00 O ATOM 2306 CG2 THR B 676 3.183 21.256 1.260 1.00 0.00 C ATOM 0 H THR B 676 2.816 18.008 3.220 1.00 0.00 H new ATOM 0 HA THR B 676 3.501 20.743 3.666 1.00 0.00 H new ATOM 0 HB THR B 676 1.346 20.281 1.746 1.00 0.00 H new ATOM 0 HG1 THR B 676 2.637 18.899 0.360 1.00 0.00 H new ATOM 0 HG21 THR B 676 2.990 21.258 0.187 1.00 0.00 H new ATOM 0 HG22 THR B 676 2.863 22.206 1.688 1.00 0.00 H new ATOM 0 HG23 THR B 676 4.250 21.120 1.436 1.00 0.00 H new ATOM 2314 N HIS B 677 0.768 19.695 4.894 1.00 0.00 N ATOM 2315 CA HIS B 677 -0.439 20.048 5.635 1.00 0.00 C ATOM 2316 C HIS B 677 -0.196 21.264 6.522 1.00 0.00 C ATOM 2317 O HIS B 677 -0.920 22.256 6.444 1.00 0.00 O ATOM 2318 CB HIS B 677 -0.904 18.865 6.486 1.00 0.00 C ATOM 2319 CG HIS B 677 -2.331 18.969 6.927 1.00 0.00 C ATOM 2320 ND1 HIS B 677 -2.984 17.962 7.605 1.00 0.00 N ATOM 2321 CD2 HIS B 677 -3.231 19.970 6.783 1.00 0.00 C ATOM 2322 CE1 HIS B 677 -4.225 18.338 7.859 1.00 0.00 C ATOM 2323 NE2 HIS B 677 -4.400 19.553 7.371 1.00 0.00 N ATOM 0 H HIS B 677 1.058 18.722 4.998 1.00 0.00 H new ATOM 0 HA HIS B 677 -1.218 20.297 4.915 1.00 0.00 H new ATOM 0 HB2 HIS B 677 -0.775 17.945 5.916 1.00 0.00 H new ATOM 0 HB3 HIS B 677 -0.265 18.788 7.366 1.00 0.00 H new ATOM 0 HD2 HIS B 677 -3.061 20.919 6.297 1.00 0.00 H new ATOM 0 HE1 HIS B 677 -4.969 17.752 8.377 1.00 0.00 H new ATOM 0 HE2 HIS B 677 -5.263 20.094 7.423 1.00 0.00 H new ATOM 2330 N GLU B 678 0.828 21.180 7.367 1.00 0.00 N ATOM 2331 CA GLU B 678 1.165 22.274 8.270 1.00 0.00 C ATOM 2332 C GLU B 678 2.007 23.328 7.558 1.00 0.00 C ATOM 2333 O GLU B 678 2.019 24.495 7.947 1.00 0.00 O ATOM 2334 CB GLU B 678 1.917 21.743 9.492 1.00 0.00 C ATOM 2335 CG GLU B 678 1.175 20.645 10.234 1.00 0.00 C ATOM 2336 CD GLU B 678 1.373 20.718 11.736 1.00 0.00 C ATOM 2337 OE1 GLU B 678 2.490 20.405 12.202 1.00 0.00 O ATOM 2338 OE2 GLU B 678 0.415 21.087 12.444 1.00 0.00 O ATOM 0 H GLU B 678 1.438 20.366 7.444 1.00 0.00 H new ATOM 0 HA GLU B 678 0.236 22.739 8.599 1.00 0.00 H new ATOM 0 HB2 GLU B 678 2.888 21.363 9.174 1.00 0.00 H new ATOM 0 HB3 GLU B 678 2.107 22.569 10.178 1.00 0.00 H new ATOM 0 HG2 GLU B 678 0.111 20.714 10.008 1.00 0.00 H new ATOM 0 HG3 GLU B 678 1.515 19.674 9.873 1.00 0.00 H new ATOM 2343 N ALA B 679 2.713 22.906 6.513 1.00 0.00 N ATOM 2344 CA ALA B 679 3.557 23.813 5.746 1.00 0.00 C ATOM 2345 C ALA B 679 2.717 24.750 4.885 1.00 0.00 C ATOM 2346 O ALA B 679 3.206 25.771 4.403 1.00 0.00 O ATOM 2347 CB ALA B 679 4.527 23.023 4.878 1.00 0.00 C ATOM 0 H ALA B 679 2.717 21.942 6.179 1.00 0.00 H new ATOM 0 HA ALA B 679 4.126 24.421 6.449 1.00 0.00 H new ATOM 0 HB1 ALA B 679 5.152 23.713 4.310 1.00 0.00 H new ATOM 0 HB2 ALA B 679 5.158 22.400 5.512 1.00 0.00 H new ATOM 0 HB3 ALA B 679 3.967 22.390 4.190 1.00 0.00 H new ATOM 2353 N ASN B 680 1.451 24.395 4.695 1.00 0.00 N ATOM 2354 CA ASN B 680 0.542 25.205 3.891 1.00 0.00 C ATOM 2355 C ASN B 680 0.577 26.664 4.334 1.00 0.00 C ATOM 2356 O ASN B 680 0.732 27.571 3.514 1.00 0.00 O ATOM 2357 CB ASN B 680 -0.885 24.663 3.996 1.00 0.00 C ATOM 2358 CG ASN B 680 -1.919 25.660 3.508 1.00 0.00 C ATOM 2359 OD1 ASN B 680 -2.610 26.295 4.306 1.00 0.00 O ATOM 2360 ND2 ASN B 680 -2.030 25.801 2.193 1.00 0.00 N ATOM 0 H ASN B 680 1.031 23.552 5.086 1.00 0.00 H new ATOM 0 HA ASN B 680 0.869 25.151 2.853 1.00 0.00 H new ATOM 0 HB2 ASN B 680 -0.966 23.745 3.414 1.00 0.00 H new ATOM 0 HB3 ASN B 680 -1.096 24.402 5.033 1.00 0.00 H new ATOM 0 HD21 ASN B 680 -2.709 26.457 1.806 1.00 0.00 H new ATOM 0 HD22 ASN B 680 -1.436 25.254 1.570 1.00 0.00 H new ATOM 2366 N THR B 681 0.435 26.886 5.636 1.00 0.00 N ATOM 2367 CA THR B 681 0.449 28.235 6.189 1.00 0.00 C ATOM 2368 C THR B 681 1.863 28.805 6.209 1.00 0.00 C ATOM 2369 O THR B 681 2.059 30.009 6.047 1.00 0.00 O ATOM 2370 CB THR B 681 -0.123 28.263 7.618 1.00 0.00 C ATOM 2371 OG1 THR B 681 0.157 27.026 8.284 1.00 0.00 O ATOM 2372 CG2 THR B 681 -1.625 28.503 7.595 1.00 0.00 C ATOM 0 H THR B 681 0.309 26.148 6.329 1.00 0.00 H new ATOM 0 HA THR B 681 -0.179 28.848 5.543 1.00 0.00 H new ATOM 0 HB THR B 681 0.352 29.081 8.159 1.00 0.00 H new ATOM 0 HG1 THR B 681 -0.209 27.054 9.193 1.00 0.00 H new ATOM 0 HG21 THR B 681 -2.007 28.519 8.616 1.00 0.00 H new ATOM 0 HG22 THR B 681 -1.833 29.459 7.115 1.00 0.00 H new ATOM 0 HG23 THR B 681 -2.113 27.703 7.038 1.00 0.00 H new ATOM 2380 N MET B 682 2.846 27.931 6.406 1.00 0.00 N ATOM 2381 CA MET B 682 4.243 28.349 6.445 1.00 0.00 C ATOM 2382 C MET B 682 4.592 29.189 5.221 1.00 0.00 C ATOM 2383 O MET B 682 5.166 30.272 5.343 1.00 0.00 O ATOM 2384 CB MET B 682 5.161 27.127 6.519 1.00 0.00 C ATOM 2385 CG MET B 682 6.587 27.413 6.080 1.00 0.00 C ATOM 2386 SD MET B 682 7.540 25.908 5.795 1.00 0.00 S ATOM 2387 CE MET B 682 6.728 25.266 4.334 1.00 0.00 C ATOM 0 H MET B 682 2.701 26.930 6.541 1.00 0.00 H new ATOM 0 HA MET B 682 4.390 28.959 7.336 1.00 0.00 H new ATOM 0 HB2 MET B 682 5.173 26.753 7.543 1.00 0.00 H new ATOM 0 HB3 MET B 682 4.749 26.334 5.894 1.00 0.00 H new ATOM 0 HG2 MET B 682 6.570 28.006 5.166 1.00 0.00 H new ATOM 0 HG3 MET B 682 7.084 28.015 6.841 1.00 0.00 H new ATOM 0 HE1 MET B 682 6.884 24.189 4.275 1.00 0.00 H new ATOM 0 HE2 MET B 682 5.660 25.475 4.390 1.00 0.00 H new ATOM 0 HE3 MET B 682 7.145 25.742 3.447 1.00 0.00 H new ATOM 2395 N ALA B 683 4.245 28.684 4.042 1.00 0.00 N ATOM 2396 CA ALA B 683 4.520 29.389 2.797 1.00 0.00 C ATOM 2397 C ALA B 683 3.789 30.726 2.749 1.00 0.00 C ATOM 2398 O ALA B 683 4.233 31.664 2.087 1.00 0.00 O ATOM 2399 CB ALA B 683 4.129 28.528 1.605 1.00 0.00 C ATOM 0 H ALA B 683 3.772 27.788 3.923 1.00 0.00 H new ATOM 0 HA ALA B 683 5.591 29.589 2.751 1.00 0.00 H new ATOM 0 HB1 ALA B 683 4.340 29.067 0.682 1.00 0.00 H new ATOM 0 HB2 ALA B 683 4.702 27.601 1.622 1.00 0.00 H new ATOM 0 HB3 ALA B 683 3.065 28.298 1.656 1.00 0.00 H new ATOM 2405 N MET B 684 2.664 30.806 3.453 1.00 0.00 N ATOM 2406 CA MET B 684 1.871 32.029 3.491 1.00 0.00 C ATOM 2407 C MET B 684 1.335 32.372 2.105 1.00 0.00 C ATOM 2408 O MET B 684 1.739 31.775 1.108 1.00 0.00 O ATOM 2409 CB MET B 684 2.712 33.191 4.027 1.00 0.00 C ATOM 2410 CG MET B 684 1.936 34.132 4.935 1.00 0.00 C ATOM 2411 SD MET B 684 2.930 34.747 6.308 1.00 0.00 S ATOM 2412 CE MET B 684 2.992 33.297 7.357 1.00 0.00 C ATOM 0 H MET B 684 2.281 30.038 4.005 1.00 0.00 H new ATOM 0 HA MET B 684 1.025 31.864 4.158 1.00 0.00 H new ATOM 0 HB2 MET B 684 3.564 32.790 4.576 1.00 0.00 H new ATOM 0 HB3 MET B 684 3.112 33.758 3.186 1.00 0.00 H new ATOM 0 HG2 MET B 684 1.570 34.976 4.350 1.00 0.00 H new ATOM 0 HG3 MET B 684 1.062 33.613 5.328 1.00 0.00 H new ATOM 0 HE1 MET B 684 3.035 33.605 8.402 1.00 0.00 H new ATOM 0 HE2 MET B 684 2.100 32.692 7.194 1.00 0.00 H new ATOM 0 HE3 MET B 684 3.878 32.710 7.115 1.00 0.00 H new ATOM 2420 N MET B 685 0.422 33.337 2.051 1.00 0.00 N ATOM 2421 CA MET B 685 -0.168 33.758 0.785 1.00 0.00 C ATOM 2422 C MET B 685 0.591 34.945 0.200 1.00 0.00 C ATOM 2423 O MET B 685 0.720 35.071 -1.018 1.00 0.00 O ATOM 2424 CB MET B 685 -1.640 34.128 0.984 1.00 0.00 C ATOM 2425 CG MET B 685 -2.606 33.089 0.438 1.00 0.00 C ATOM 2426 SD MET B 685 -4.065 32.883 1.477 1.00 0.00 S ATOM 2427 CE MET B 685 -5.348 33.484 0.382 1.00 0.00 C ATOM 0 H MET B 685 0.075 33.841 2.867 1.00 0.00 H new ATOM 0 HA MET B 685 -0.100 32.925 0.085 1.00 0.00 H new ATOM 0 HB2 MET B 685 -1.831 34.266 2.048 1.00 0.00 H new ATOM 0 HB3 MET B 685 -1.835 35.084 0.498 1.00 0.00 H new ATOM 0 HG2 MET B 685 -2.917 33.380 -0.565 1.00 0.00 H new ATOM 0 HG3 MET B 685 -2.091 32.132 0.347 1.00 0.00 H new ATOM 0 HE1 MET B 685 -6.314 33.420 0.883 1.00 0.00 H new ATOM 0 HE2 MET B 685 -5.144 34.522 0.118 1.00 0.00 H new ATOM 0 HE3 MET B 685 -5.368 32.876 -0.523 1.00 0.00 H new ATOM 2435 N ALA B 686 1.092 35.812 1.074 1.00 0.00 N ATOM 2436 CA ALA B 686 1.839 36.986 0.643 1.00 0.00 C ATOM 2437 C ALA B 686 2.986 36.597 -0.285 1.00 0.00 C ATOM 2438 O ALA B 686 3.178 37.204 -1.338 1.00 0.00 O ATOM 2439 CB ALA B 686 2.369 37.747 1.850 1.00 0.00 C ATOM 0 H ALA B 686 0.994 35.723 2.085 1.00 0.00 H new ATOM 0 HA ALA B 686 1.161 37.634 0.088 1.00 0.00 H new ATOM 0 HB1 ALA B 686 2.925 38.622 1.513 1.00 0.00 H new ATOM 0 HB2 ALA B 686 1.534 38.066 2.474 1.00 0.00 H new ATOM 0 HB3 ALA B 686 3.028 37.099 2.428 1.00 0.00 H new ATOM 2445 N ARG B 687 3.745 35.581 0.115 1.00 0.00 N ATOM 2446 CA ARG B 687 4.874 35.113 -0.680 1.00 0.00 C ATOM 2447 C ARG B 687 4.416 34.669 -2.066 1.00 0.00 C ATOM 2448 O ARG B 687 4.989 35.072 -3.079 1.00 0.00 O ATOM 2449 CB ARG B 687 5.580 33.956 0.031 1.00 0.00 C ATOM 2450 CG ARG B 687 6.925 34.338 0.625 1.00 0.00 C ATOM 2451 CD ARG B 687 6.776 34.872 2.042 1.00 0.00 C ATOM 2452 NE ARG B 687 8.063 35.245 2.624 1.00 0.00 N ATOM 2453 CZ ARG B 687 8.752 36.320 2.257 1.00 0.00 C ATOM 2454 NH1 ARG B 687 8.280 37.124 1.315 1.00 0.00 N ATOM 2455 NH2 ARG B 687 9.916 36.592 2.834 1.00 0.00 N ATOM 0 H ARG B 687 3.598 35.067 0.984 1.00 0.00 H new ATOM 0 HA ARG B 687 5.573 35.941 -0.796 1.00 0.00 H new ATOM 0 HB2 ARG B 687 4.935 33.581 0.825 1.00 0.00 H new ATOM 0 HB3 ARG B 687 5.723 33.139 -0.676 1.00 0.00 H new ATOM 0 HG2 ARG B 687 7.582 33.468 0.630 1.00 0.00 H new ATOM 0 HG3 ARG B 687 7.400 35.093 -0.002 1.00 0.00 H new ATOM 0 HD2 ARG B 687 6.116 35.740 2.035 1.00 0.00 H new ATOM 0 HD3 ARG B 687 6.301 34.115 2.667 1.00 0.00 H new ATOM 0 HE ARG B 687 8.454 34.647 3.352 1.00 0.00 H new ATOM 0 HH11 ARG B 687 7.386 36.918 0.870 1.00 0.00 H new ATOM 0 HH12 ARG B 687 8.811 37.949 1.035 1.00 0.00 H new ATOM 0 HH21 ARG B 687 10.282 35.976 3.560 1.00 0.00 H new ATOM 0 HH22 ARG B 687 10.445 37.417 2.552 1.00 0.00 H new ATOM 2466 N ASP B 688 3.380 33.837 -2.103 1.00 0.00 N ATOM 2467 CA ASP B 688 2.845 33.338 -3.364 1.00 0.00 C ATOM 2468 C ASP B 688 3.885 32.501 -4.103 1.00 0.00 C ATOM 2469 O ASP B 688 4.709 33.031 -4.849 1.00 0.00 O ATOM 2470 CB ASP B 688 2.390 34.502 -4.245 1.00 0.00 C ATOM 2471 CG ASP B 688 0.880 34.592 -4.353 1.00 0.00 C ATOM 2472 OD1 ASP B 688 0.239 33.545 -4.583 1.00 0.00 O ATOM 2473 OD2 ASP B 688 0.339 35.708 -4.207 1.00 0.00 O ATOM 0 H ASP B 688 2.895 33.494 -1.274 1.00 0.00 H new ATOM 0 HA ASP B 688 1.987 32.704 -3.141 1.00 0.00 H new ATOM 0 HB2 ASP B 688 2.778 35.435 -3.837 1.00 0.00 H new ATOM 0 HB3 ASP B 688 2.816 34.388 -5.242 1.00 0.00 H new ATOM 2477 N THR B 689 3.841 31.189 -3.890 1.00 0.00 N ATOM 2478 CA THR B 689 4.780 30.279 -4.533 1.00 0.00 C ATOM 2479 C THR B 689 4.047 29.201 -5.323 1.00 0.00 C ATOM 2480 O THR B 689 4.111 29.166 -6.551 1.00 0.00 O ATOM 2481 CB THR B 689 5.705 29.605 -3.502 1.00 0.00 C ATOM 2482 OG1 THR B 689 4.938 29.142 -2.386 1.00 0.00 O ATOM 2483 CG2 THR B 689 6.776 30.573 -3.022 1.00 0.00 C ATOM 0 H THR B 689 3.165 30.734 -3.277 1.00 0.00 H new ATOM 0 HA THR B 689 5.384 30.878 -5.215 1.00 0.00 H new ATOM 0 HB THR B 689 6.193 28.758 -3.983 1.00 0.00 H new ATOM 0 HG1 THR B 689 5.533 28.713 -1.736 1.00 0.00 H new ATOM 0 HG21 THR B 689 7.417 30.075 -2.295 1.00 0.00 H new ATOM 0 HG22 THR B 689 7.376 30.901 -3.870 1.00 0.00 H new ATOM 0 HG23 THR B 689 6.303 31.438 -2.556 1.00 0.00 H new ATOM 2491 N ALA B 690 3.350 28.322 -4.610 1.00 0.00 N ATOM 2492 CA ALA B 690 2.603 27.243 -5.244 1.00 0.00 C ATOM 2493 C ALA B 690 1.557 27.794 -6.207 1.00 0.00 C ATOM 2494 O ALA B 690 1.148 27.114 -7.148 1.00 0.00 O ATOM 2495 CB ALA B 690 1.943 26.367 -4.190 1.00 0.00 C ATOM 0 H ALA B 690 3.287 28.336 -3.592 1.00 0.00 H new ATOM 0 HA ALA B 690 3.304 26.636 -5.817 1.00 0.00 H new ATOM 0 HB1 ALA B 690 1.389 25.565 -4.678 1.00 0.00 H new ATOM 0 HB2 ALA B 690 2.708 25.937 -3.543 1.00 0.00 H new ATOM 0 HB3 ALA B 690 1.259 26.970 -3.592 1.00 0.00 H new ATOM 2501 N GLU B 691 1.127 29.029 -5.965 1.00 0.00 N ATOM 2502 CA GLU B 691 0.127 29.668 -6.811 1.00 0.00 C ATOM 2503 C GLU B 691 0.736 30.103 -8.140 1.00 0.00 C ATOM 2504 O GLU B 691 0.318 29.649 -9.205 1.00 0.00 O ATOM 2505 CB GLU B 691 -0.481 30.877 -6.096 1.00 0.00 C ATOM 2506 CG GLU B 691 -0.718 30.651 -4.613 1.00 0.00 C ATOM 2507 CD GLU B 691 -2.058 31.186 -4.148 1.00 0.00 C ATOM 2508 OE1 GLU B 691 -3.074 30.898 -4.815 1.00 0.00 O ATOM 2509 OE2 GLU B 691 -2.092 31.891 -3.118 1.00 0.00 O ATOM 0 H GLU B 691 1.456 29.606 -5.191 1.00 0.00 H new ATOM 0 HA GLU B 691 -0.659 28.941 -7.012 1.00 0.00 H new ATOM 0 HB2 GLU B 691 0.180 31.734 -6.223 1.00 0.00 H new ATOM 0 HB3 GLU B 691 -1.428 31.132 -6.572 1.00 0.00 H new ATOM 0 HG2 GLU B 691 -0.663 29.584 -4.399 1.00 0.00 H new ATOM 0 HG3 GLU B 691 0.078 31.132 -4.044 1.00 0.00 H new ATOM 2514 N ALA B 692 1.728 30.986 -8.070 1.00 0.00 N ATOM 2515 CA ALA B 692 2.396 31.481 -9.266 1.00 0.00 C ATOM 2516 C ALA B 692 3.142 30.360 -9.982 1.00 0.00 C ATOM 2517 O ALA B 692 3.380 30.430 -11.187 1.00 0.00 O ATOM 2518 CB ALA B 692 3.352 32.609 -8.908 1.00 0.00 C ATOM 0 H ALA B 692 2.086 31.373 -7.197 1.00 0.00 H new ATOM 0 HA ALA B 692 1.635 31.866 -9.944 1.00 0.00 H new ATOM 0 HB1 ALA B 692 3.844 32.969 -9.811 1.00 0.00 H new ATOM 0 HB2 ALA B 692 2.795 33.425 -8.448 1.00 0.00 H new ATOM 0 HB3 ALA B 692 4.102 32.242 -8.208 1.00 0.00 H new ATOM 2524 N ALA B 693 3.511 29.327 -9.231 1.00 0.00 N ATOM 2525 CA ALA B 693 4.229 28.191 -9.795 1.00 0.00 C ATOM 2526 C ALA B 693 3.262 27.148 -10.345 1.00 0.00 C ATOM 2527 O ALA B 693 3.611 26.368 -11.231 1.00 0.00 O ATOM 2528 CB ALA B 693 5.138 27.569 -8.745 1.00 0.00 C ATOM 0 H ALA B 693 3.324 29.254 -8.231 1.00 0.00 H new ATOM 0 HA ALA B 693 4.840 28.553 -10.622 1.00 0.00 H new ATOM 0 HB1 ALA B 693 5.669 26.722 -9.179 1.00 0.00 H new ATOM 0 HB2 ALA B 693 5.859 28.311 -8.402 1.00 0.00 H new ATOM 0 HB3 ALA B 693 4.539 27.228 -7.901 1.00 0.00 H new ATOM 2534 N LYS B 694 2.045 27.139 -9.813 1.00 0.00 N ATOM 2535 CA LYS B 694 1.025 26.192 -10.249 1.00 0.00 C ATOM 2536 C LYS B 694 0.865 26.227 -11.767 1.00 0.00 C ATOM 2537 O LYS B 694 0.752 27.298 -12.363 1.00 0.00 O ATOM 2538 CB LYS B 694 -0.313 26.504 -9.576 1.00 0.00 C ATOM 2539 CG LYS B 694 -0.811 25.393 -8.669 1.00 0.00 C ATOM 2540 CD LYS B 694 -1.718 25.932 -7.575 1.00 0.00 C ATOM 2541 CE LYS B 694 -3.046 26.413 -8.138 1.00 0.00 C ATOM 2542 NZ LYS B 694 -4.075 25.336 -8.134 1.00 0.00 N ATOM 0 H LYS B 694 1.740 27.778 -9.078 1.00 0.00 H new ATOM 0 HA LYS B 694 1.345 25.192 -9.957 1.00 0.00 H new ATOM 0 HB2 LYS B 694 -0.212 27.420 -8.993 1.00 0.00 H new ATOM 0 HB3 LYS B 694 -1.061 26.696 -10.345 1.00 0.00 H new ATOM 0 HG2 LYS B 694 -1.352 24.654 -9.260 1.00 0.00 H new ATOM 0 HG3 LYS B 694 0.039 24.881 -8.219 1.00 0.00 H new ATOM 0 HD2 LYS B 694 -1.897 25.154 -6.833 1.00 0.00 H new ATOM 0 HD3 LYS B 694 -1.220 26.754 -7.061 1.00 0.00 H new ATOM 0 HE2 LYS B 694 -3.404 27.259 -7.551 1.00 0.00 H new ATOM 0 HE3 LYS B 694 -2.900 26.771 -9.157 1.00 0.00 H new ATOM 0 HZ1 LYS B 694 -4.965 25.705 -8.525 1.00 0.00 H new ATOM 0 HZ2 LYS B 694 -3.745 24.539 -8.715 1.00 0.00 H new ATOM 0 HZ3 LYS B 694 -4.234 25.011 -7.159 1.00 0.00 H new ATOM 2552 N TRP B 695 0.852 25.051 -12.383 1.00 0.00 N ATOM 2553 CA TRP B 695 0.703 24.949 -13.831 1.00 0.00 C ATOM 2554 C TRP B 695 -0.738 24.623 -14.208 1.00 0.00 C ATOM 2555 O TRP B 695 -1.101 23.458 -14.358 1.00 0.00 O ATOM 2556 CB TRP B 695 1.644 23.877 -14.386 1.00 0.00 C ATOM 2557 CG TRP B 695 1.663 23.823 -15.884 1.00 0.00 C ATOM 2558 CD1 TRP B 695 1.467 22.721 -16.666 1.00 0.00 C ATOM 2559 CD2 TRP B 695 1.892 24.917 -16.778 1.00 0.00 C ATOM 2560 NE1 TRP B 695 1.562 23.064 -17.993 1.00 0.00 N ATOM 2561 CE2 TRP B 695 1.820 24.406 -18.089 1.00 0.00 C ATOM 2562 CE3 TRP B 695 2.149 26.279 -16.599 1.00 0.00 C ATOM 2563 CZ2 TRP B 695 1.998 25.210 -19.212 1.00 0.00 C ATOM 2564 CZ3 TRP B 695 2.325 27.076 -17.714 1.00 0.00 C ATOM 2565 CH2 TRP B 695 2.248 26.540 -19.007 1.00 0.00 C ATOM 0 H TRP B 695 0.943 24.155 -11.904 1.00 0.00 H new ATOM 0 HA TRP B 695 0.964 25.913 -14.268 1.00 0.00 H new ATOM 0 HB2 TRP B 695 2.654 24.067 -14.023 1.00 0.00 H new ATOM 0 HB3 TRP B 695 1.344 22.904 -13.998 1.00 0.00 H new ATOM 0 HD1 TRP B 695 1.267 21.726 -16.296 1.00 0.00 H new ATOM 0 HE1 TRP B 695 1.457 22.423 -18.780 1.00 0.00 H new ATOM 0 HE3 TRP B 695 2.209 26.701 -15.607 1.00 0.00 H new ATOM 0 HZ2 TRP B 695 1.941 24.799 -20.209 1.00 0.00 H new ATOM 0 HZ3 TRP B 695 2.525 28.130 -17.587 1.00 0.00 H new ATOM 0 HH2 TRP B 695 2.389 27.189 -19.858 1.00 0.00 H new ATOM 2575 N GLY B 696 -1.554 25.662 -14.360 1.00 0.00 N ATOM 2576 CA GLY B 696 -2.946 25.465 -14.718 1.00 0.00 C ATOM 2577 C GLY B 696 -3.734 26.760 -14.720 1.00 0.00 C ATOM 2578 O GLY B 696 -4.633 26.947 -15.539 1.00 0.00 O ATOM 0 H GLY B 696 -1.276 26.636 -14.242 1.00 0.00 H new ATOM 0 HA2 GLY B 696 -3.002 25.008 -15.706 1.00 0.00 H new ATOM 0 HA3 GLY B 696 -3.403 24.767 -14.017 1.00 0.00 H new ATOM 2582 N GLY B 697 -3.396 27.658 -13.799 1.00 0.00 N ATOM 2583 CA GLY B 697 -4.089 28.930 -13.715 1.00 0.00 C ATOM 2584 C GLY B 697 -5.588 28.765 -13.567 1.00 0.00 C ATOM 2585 O GLY B 697 -6.351 29.139 -14.459 1.00 0.00 O ATOM 0 H GLY B 697 -2.655 27.527 -13.110 1.00 0.00 H new ATOM 0 HA2 GLY B 697 -3.703 29.495 -12.866 1.00 0.00 H new ATOM 0 HA3 GLY B 697 -3.878 29.515 -14.610 1.00 0.00 H new TER 2589 GLY B 697