USER MOD reduce.3.24.130724 H: found=0, std=0, add=1093, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1100 hydrogens (14 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 NoAdj-H: B 36 ALY H2 : B 36 ALY N : B 35 VAL C :(H bumps) USER MOD NoAdj-H: B 36 ALY H : B 36 ALY N : B 35 VAL C :(H bumps) USER MOD Set 1.1: A 800 LYS NZ :NH3+ -170:sc= -2.1 (180deg=-2.39) USER MOD Set 1.2: A 814 ASN : amide:sc= 0 X(o=-2.1,f=-2.4) USER MOD Set 2.1: A 798 ASN : amide:sc= -7.57! C(o=-19!,f=-24!) USER MOD Set 2.2: A 799 CYS SG : rot 49:sc= -11.1! USER MOD Set 3.1: A 789 MET CE :methyl -151:sc= -15.3! (180deg=-15.2!) USER MOD Set 3.2: A 793 GLN : amide:sc= -4.08! C(o=-19!,f=-21!) USER MOD Set 4.1: A 773 MET CE :methyl -114:sc= -11! (180deg=-11.8!) USER MOD Set 4.2: A 782 TYR OH : rot -28:sc= -5.14! USER MOD Set 5.1: A 744 SER OG : rot -51:sc= 0.453 USER MOD Set 5.2: A 812 CYS SG : rot 102:sc= 0.8 USER MOD Set 6.1: A 730 SER OG : rot 180:sc=-0.00801 USER MOD Set 6.2: A 733 LYS NZ :NH3+ 165:sc= -0.388 (180deg=-0.794) USER MOD Single : A 716 SER OG : rot 180:sc= 0 USER MOD Single : A 717 HIS : no HD1:sc=-0.00614 X(o=-0.0061,f=0) USER MOD Single : A 718 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 719 SER OG : rot 180:sc= 0 USER MOD Single : A 720 LYS NZ :NH3+ -160:sc= -1.01 (180deg=-1.47) USER MOD Single : A 727 GLN : amide:sc= -1.94! C(o=-1.9!,f=-8.7!) USER MOD Single : A 729 TYR OH : rot 180:sc= 0 USER MOD Single : A 731 THR OG1 : rot 96:sc= 1.16 USER MOD Single : A 734 SER OG : rot 68:sc= 0.136 USER MOD Single : A 737 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 738 GLN :FLIP amide:sc= -3.81! C(o=-8.9!,f=-3.8!) USER MOD Single : A 740 LYS NZ :NH3+ -172:sc= -3.22! (180deg=-3.7!) USER MOD Single : A 741 SER OG : rot -34:sc= 0.117 USER MOD Single : A 742 HIS : no HD1:sc= -10.4! C(o=-10!,f=-20!) USER MOD Single : A 743 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 749 MET CE :methyl 145:sc= -3.64! (180deg=-5.42!) USER MOD Single : A 753 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 755 THR OG1 : rot 180:sc= 0 USER MOD Single : A 760 TYR OH : rot 165:sc= -1.57! USER MOD Single : A 761 TYR OH : rot 180:sc= 0 USER MOD Single : A 768 MET CE :methyl 137:sc= -8.66! (180deg=-12.4!) USER MOD Single : A 771 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 772 THR OG1 : rot 180:sc= 0 USER MOD Single : A 774 SER OG : rot -17:sc= -0.385 USER MOD Single : A 778 LYS NZ :NH3+ -173:sc= -6.17! (180deg=-6.7!) USER MOD Single : A 779 ASN :FLIP amide:sc= -9.21! C(o=-11!,f=-9.2!) USER MOD Single : A 781 TYR OH : rot 180:sc= -1.04! USER MOD Single : A 784 SER OG : rot 37:sc= 0.666 USER MOD Single : A 785 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 786 LYS NZ :NH3+ 164:sc= -0.402 (180deg=-0.735) USER MOD Single : A 797 THR OG1 : rot -66:sc= 1.24 USER MOD Single : A 802 TYR OH : rot 30:sc= -2.49! USER MOD Single : A 803 ASN : amide:sc= -1.24 X(o=-1.2,f=-1.3) USER MOD Single : A 807 SER OG : rot 28:sc= -2.27 USER MOD Single : A 809 TYR OH : rot -81:sc= -1.3! USER MOD Single : A 810 TYR OH : rot 125:sc= 0.00135 USER MOD Single : A 811 LYS NZ :NH3+ -163:sc= 0.00639 (180deg=0) USER MOD Single : A 818 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0475) USER MOD Single : A 822 SER OG : rot 180:sc= 0 USER MOD Single : A 823 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 825 LYS NZ :NH3+ 150:sc= -0.0798 (180deg=-1.65!) USER MOD Single : A 832 LYS NZ :NH3+ 136:sc= -0.0822 (180deg=-0.411) USER MOD Single : B 31 SER OG : rot -25:sc= 0.0337 USER MOD Single : B 32 THR OG1 : rot 48:sc= 0.743 USER MOD Single : B 37 LYS NZ :NH3+ 151:sc= 0 (180deg=-0.509) USER MOD Single : B 39 HIS : no HE2:sc= -0.718 K(o=-0.72,f=-3.1!) USER MOD Single : B 41 TYR OH : rot 180:sc= 0 USER MOD Single : B 42 LYS NZ :NH3+ -162:sc= -0.0488 (180deg=-0.322) USER MOD Single : B 43 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 715 -31.540 2.312 -3.204 1.00 0.00 N ATOM 2 CA GLY A 715 -30.747 3.554 -3.419 1.00 0.00 C ATOM 3 C GLY A 715 -29.311 3.265 -3.813 1.00 0.00 C ATOM 4 O GLY A 715 -28.754 2.233 -3.440 1.00 0.00 O ATOM 0 HA2 GLY A 715 -31.220 4.153 -4.197 1.00 0.00 H new ATOM 0 HA3 GLY A 715 -30.757 4.150 -2.507 1.00 0.00 H new ATOM 10 N SER A 716 -28.711 4.181 -4.569 1.00 0.00 N ATOM 11 CA SER A 716 -27.332 4.021 -5.015 1.00 0.00 C ATOM 12 C SER A 716 -26.365 4.697 -4.048 1.00 0.00 C ATOM 13 O SER A 716 -25.329 4.134 -3.695 1.00 0.00 O ATOM 14 CB SER A 716 -27.157 4.603 -6.419 1.00 0.00 C ATOM 15 OG SER A 716 -28.009 3.960 -7.349 1.00 0.00 O ATOM 0 H SER A 716 -29.159 5.041 -4.885 1.00 0.00 H new ATOM 0 HA SER A 716 -27.106 2.955 -5.040 1.00 0.00 H new ATOM 0 HB2 SER A 716 -27.373 5.671 -6.402 1.00 0.00 H new ATOM 0 HB3 SER A 716 -26.120 4.492 -6.735 1.00 0.00 H new ATOM 0 HG SER A 716 -27.878 4.352 -8.238 1.00 0.00 H new ATOM 21 N HIS A 717 -26.713 5.908 -3.623 1.00 0.00 N ATOM 22 CA HIS A 717 -25.876 6.664 -2.698 1.00 0.00 C ATOM 23 C HIS A 717 -26.041 6.160 -1.268 1.00 0.00 C ATOM 24 O HIS A 717 -27.110 6.298 -0.671 1.00 0.00 O ATOM 25 CB HIS A 717 -26.225 8.153 -2.762 1.00 0.00 C ATOM 26 CG HIS A 717 -25.972 8.774 -4.100 1.00 0.00 C ATOM 27 ND1 HIS A 717 -24.903 9.609 -4.352 1.00 0.00 N ATOM 28 CD2 HIS A 717 -26.659 8.684 -5.263 1.00 0.00 C ATOM 29 CE1 HIS A 717 -24.945 10.007 -5.612 1.00 0.00 C ATOM 30 NE2 HIS A 717 -26.000 9.459 -6.186 1.00 0.00 N ATOM 0 H HIS A 717 -27.569 6.386 -3.905 1.00 0.00 H new ATOM 0 HA HIS A 717 -24.837 6.522 -2.997 1.00 0.00 H new ATOM 0 HB2 HIS A 717 -27.276 8.282 -2.505 1.00 0.00 H new ATOM 0 HB3 HIS A 717 -25.645 8.686 -2.009 1.00 0.00 H new ATOM 0 HD2 HIS A 717 -27.558 8.110 -5.433 1.00 0.00 H new ATOM 0 HE1 HIS A 717 -24.237 10.668 -6.090 1.00 0.00 H new ATOM 0 HE2 HIS A 717 -26.280 9.590 -7.158 1.00 0.00 H new ATOM 39 N MET A 718 -24.979 5.575 -0.725 1.00 0.00 N ATOM 40 CA MET A 718 -25.006 5.056 0.638 1.00 0.00 C ATOM 41 C MET A 718 -24.241 5.978 1.583 1.00 0.00 C ATOM 42 O MET A 718 -24.842 6.756 2.324 1.00 0.00 O ATOM 43 CB MET A 718 -24.421 3.645 0.689 1.00 0.00 C ATOM 44 CG MET A 718 -25.298 2.600 0.018 1.00 0.00 C ATOM 45 SD MET A 718 -24.669 0.924 0.232 1.00 0.00 S ATOM 46 CE MET A 718 -25.985 -0.029 -0.522 1.00 0.00 C ATOM 0 H MET A 718 -24.089 5.448 -1.207 1.00 0.00 H new ATOM 0 HA MET A 718 -26.046 5.014 0.962 1.00 0.00 H new ATOM 0 HB2 MET A 718 -23.442 3.649 0.209 1.00 0.00 H new ATOM 0 HB3 MET A 718 -24.265 3.362 1.730 1.00 0.00 H new ATOM 0 HG2 MET A 718 -26.306 2.660 0.427 1.00 0.00 H new ATOM 0 HG3 MET A 718 -25.372 2.823 -1.046 1.00 0.00 H new ATOM 0 HE1 MET A 718 -25.743 -1.090 -0.468 1.00 0.00 H new ATOM 0 HE2 MET A 718 -26.919 0.157 0.008 1.00 0.00 H new ATOM 0 HE3 MET A 718 -26.095 0.265 -1.566 1.00 0.00 H new ATOM 56 N SER A 719 -22.913 5.890 1.550 1.00 0.00 N ATOM 57 CA SER A 719 -22.071 6.724 2.402 1.00 0.00 C ATOM 58 C SER A 719 -20.595 6.579 2.037 1.00 0.00 C ATOM 59 O SER A 719 -20.079 7.323 1.202 1.00 0.00 O ATOM 60 CB SER A 719 -22.282 6.373 3.877 1.00 0.00 C ATOM 61 OG SER A 719 -21.433 7.140 4.712 1.00 0.00 O ATOM 0 H SER A 719 -22.399 5.251 0.944 1.00 0.00 H new ATOM 0 HA SER A 719 -22.363 7.762 2.239 1.00 0.00 H new ATOM 0 HB2 SER A 719 -23.322 6.550 4.151 1.00 0.00 H new ATOM 0 HB3 SER A 719 -22.088 5.312 4.033 1.00 0.00 H new ATOM 0 HG SER A 719 -21.589 6.897 5.649 1.00 0.00 H new ATOM 67 N LYS A 720 -19.922 5.614 2.662 1.00 0.00 N ATOM 68 CA LYS A 720 -18.505 5.379 2.404 1.00 0.00 C ATOM 69 C LYS A 720 -18.126 3.926 2.665 1.00 0.00 C ATOM 70 O LYS A 720 -17.189 3.643 3.411 1.00 0.00 O ATOM 71 CB LYS A 720 -17.649 6.296 3.264 1.00 0.00 C ATOM 72 CG LYS A 720 -17.455 7.686 2.680 1.00 0.00 C ATOM 73 CD LYS A 720 -16.477 8.508 3.508 1.00 0.00 C ATOM 74 CE LYS A 720 -15.086 7.890 3.505 1.00 0.00 C ATOM 75 NZ LYS A 720 -14.099 8.741 4.226 1.00 0.00 N ATOM 0 H LYS A 720 -20.336 4.984 3.349 1.00 0.00 H new ATOM 0 HA LYS A 720 -18.321 5.597 1.352 1.00 0.00 H new ATOM 0 HB2 LYS A 720 -18.108 6.387 4.248 1.00 0.00 H new ATOM 0 HB3 LYS A 720 -16.672 5.834 3.409 1.00 0.00 H new ATOM 0 HG2 LYS A 720 -17.088 7.604 1.657 1.00 0.00 H new ATOM 0 HG3 LYS A 720 -18.415 8.200 2.634 1.00 0.00 H new ATOM 0 HD2 LYS A 720 -16.426 9.522 3.112 1.00 0.00 H new ATOM 0 HD3 LYS A 720 -16.840 8.584 4.533 1.00 0.00 H new ATOM 0 HE2 LYS A 720 -15.125 6.905 3.971 1.00 0.00 H new ATOM 0 HE3 LYS A 720 -14.756 7.743 2.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 720 -13.136 8.485 3.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 720 -14.276 9.742 4.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 720 -14.195 8.591 5.251 1.00 0.00 H new ATOM 89 N GLU A 721 -18.857 3.010 2.048 1.00 0.00 N ATOM 90 CA GLU A 721 -18.589 1.588 2.209 1.00 0.00 C ATOM 91 C GLU A 721 -19.335 0.778 1.157 1.00 0.00 C ATOM 92 O GLU A 721 -20.544 0.568 1.252 1.00 0.00 O ATOM 93 CB GLU A 721 -18.979 1.121 3.607 1.00 0.00 C ATOM 94 CG GLU A 721 -18.525 -0.294 3.927 1.00 0.00 C ATOM 95 CD GLU A 721 -18.945 -0.741 5.314 1.00 0.00 C ATOM 96 OE1 GLU A 721 -20.075 -1.254 5.454 1.00 0.00 O ATOM 97 OE2 GLU A 721 -18.144 -0.576 6.258 1.00 0.00 O ATOM 0 H GLU A 721 -19.640 3.225 1.431 1.00 0.00 H new ATOM 0 HA GLU A 721 -17.519 1.429 2.076 1.00 0.00 H new ATOM 0 HB2 GLU A 721 -18.553 1.805 4.341 1.00 0.00 H new ATOM 0 HB3 GLU A 721 -20.063 1.178 3.710 1.00 0.00 H new ATOM 0 HG2 GLU A 721 -18.938 -0.980 3.188 1.00 0.00 H new ATOM 0 HG3 GLU A 721 -17.440 -0.351 3.844 1.00 0.00 H new ATOM 104 N PRO A 722 -18.601 0.321 0.139 1.00 0.00 N ATOM 105 CA PRO A 722 -19.142 -0.477 -0.964 1.00 0.00 C ATOM 106 C PRO A 722 -19.752 -1.776 -0.463 1.00 0.00 C ATOM 107 O PRO A 722 -20.729 -2.278 -1.019 1.00 0.00 O ATOM 108 CB PRO A 722 -17.911 -0.761 -1.822 1.00 0.00 C ATOM 109 CG PRO A 722 -16.980 0.322 -1.461 1.00 0.00 C ATOM 110 CD PRO A 722 -17.167 0.541 -0.016 1.00 0.00 C ATOM 0 HA PRO A 722 -19.941 0.035 -1.501 1.00 0.00 H new ATOM 0 HB2 PRO A 722 -17.488 -1.742 -1.605 1.00 0.00 H new ATOM 0 HB3 PRO A 722 -18.151 -0.746 -2.885 1.00 0.00 H new ATOM 0 HG2 PRO A 722 -15.950 0.044 -1.685 1.00 0.00 H new ATOM 0 HG3 PRO A 722 -17.196 1.229 -2.026 1.00 0.00 H new ATOM 0 HD2 PRO A 722 -16.580 -0.156 0.582 1.00 0.00 H new ATOM 0 HD3 PRO A 722 -16.873 1.546 0.286 1.00 0.00 H new ATOM 118 N ARG A 723 -19.157 -2.306 0.605 1.00 0.00 N ATOM 119 CA ARG A 723 -19.611 -3.544 1.220 1.00 0.00 C ATOM 120 C ARG A 723 -19.504 -4.712 0.248 1.00 0.00 C ATOM 121 O ARG A 723 -19.321 -4.519 -0.955 1.00 0.00 O ATOM 122 CB ARG A 723 -21.050 -3.405 1.718 1.00 0.00 C ATOM 123 CG ARG A 723 -21.200 -3.625 3.215 1.00 0.00 C ATOM 124 CD ARG A 723 -20.735 -5.014 3.624 1.00 0.00 C ATOM 125 NE ARG A 723 -20.836 -5.223 5.067 1.00 0.00 N ATOM 126 CZ ARG A 723 -20.182 -6.177 5.723 1.00 0.00 C ATOM 127 NH1 ARG A 723 -19.378 -7.006 5.070 1.00 0.00 N ATOM 128 NH2 ARG A 723 -20.334 -6.306 7.034 1.00 0.00 N ATOM 0 H ARG A 723 -18.348 -1.887 1.065 1.00 0.00 H new ATOM 0 HA ARG A 723 -18.963 -3.747 2.073 1.00 0.00 H new ATOM 0 HB2 ARG A 723 -21.418 -2.410 1.467 1.00 0.00 H new ATOM 0 HB3 ARG A 723 -21.679 -4.121 1.189 1.00 0.00 H new ATOM 0 HG2 ARG A 723 -20.623 -2.874 3.754 1.00 0.00 H new ATOM 0 HG3 ARG A 723 -22.243 -3.491 3.501 1.00 0.00 H new ATOM 0 HD2 ARG A 723 -21.334 -5.764 3.106 1.00 0.00 H new ATOM 0 HD3 ARG A 723 -19.702 -5.158 3.308 1.00 0.00 H new ATOM 0 HE ARG A 723 -21.443 -4.601 5.601 1.00 0.00 H new ATOM 0 HH11 ARG A 723 -19.260 -6.913 4.061 1.00 0.00 H new ATOM 0 HH12 ARG A 723 -18.878 -7.736 5.577 1.00 0.00 H new ATOM 0 HH21 ARG A 723 -20.953 -5.673 7.540 1.00 0.00 H new ATOM 0 HH22 ARG A 723 -19.832 -7.038 7.536 1.00 0.00 H new ATOM 142 N ASP A 724 -19.613 -5.924 0.785 1.00 0.00 N ATOM 143 CA ASP A 724 -19.532 -7.137 -0.017 1.00 0.00 C ATOM 144 C ASP A 724 -18.136 -7.300 -0.616 1.00 0.00 C ATOM 145 O ASP A 724 -17.456 -6.321 -0.924 1.00 0.00 O ATOM 146 CB ASP A 724 -20.617 -7.127 -1.090 1.00 0.00 C ATOM 147 CG ASP A 724 -20.554 -8.280 -2.067 1.00 0.00 C ATOM 148 OD1 ASP A 724 -21.074 -9.369 -1.738 1.00 0.00 O ATOM 149 OD2 ASP A 724 -20.010 -8.089 -3.171 1.00 0.00 O ATOM 0 H ASP A 724 -19.759 -6.091 1.781 1.00 0.00 H new ATOM 0 HA ASP A 724 -19.705 -8.001 0.625 1.00 0.00 H new ATOM 0 HB2 ASP A 724 -21.591 -7.136 -0.602 1.00 0.00 H new ATOM 0 HB3 ASP A 724 -20.548 -6.193 -1.647 1.00 0.00 H new ATOM 154 N PRO A 725 -17.702 -8.553 -0.785 1.00 0.00 N ATOM 155 CA PRO A 725 -16.381 -8.894 -1.286 1.00 0.00 C ATOM 156 C PRO A 725 -16.274 -8.768 -2.799 1.00 0.00 C ATOM 157 O PRO A 725 -15.177 -8.756 -3.351 1.00 0.00 O ATOM 158 CB PRO A 725 -16.193 -10.354 -0.824 1.00 0.00 C ATOM 159 CG PRO A 725 -17.441 -10.712 -0.078 1.00 0.00 C ATOM 160 CD PRO A 725 -18.487 -9.751 -0.551 1.00 0.00 C ATOM 0 HA PRO A 725 -15.612 -8.219 -0.910 1.00 0.00 H new ATOM 0 HB2 PRO A 725 -16.043 -11.017 -1.676 1.00 0.00 H new ATOM 0 HB3 PRO A 725 -15.315 -10.452 -0.186 1.00 0.00 H new ATOM 0 HG2 PRO A 725 -17.736 -11.742 -0.280 1.00 0.00 H new ATOM 0 HG3 PRO A 725 -17.291 -10.629 0.998 1.00 0.00 H new ATOM 0 HD2 PRO A 725 -18.983 -10.099 -1.457 1.00 0.00 H new ATOM 0 HD3 PRO A 725 -19.264 -9.592 0.196 1.00 0.00 H new ATOM 168 N ASP A 726 -17.422 -8.676 -3.461 1.00 0.00 N ATOM 169 CA ASP A 726 -17.463 -8.541 -4.912 1.00 0.00 C ATOM 170 C ASP A 726 -17.505 -7.070 -5.306 1.00 0.00 C ATOM 171 O ASP A 726 -16.749 -6.643 -6.179 1.00 0.00 O ATOM 172 CB ASP A 726 -18.667 -9.284 -5.497 1.00 0.00 C ATOM 173 CG ASP A 726 -18.673 -10.754 -5.126 1.00 0.00 C ATOM 174 OD1 ASP A 726 -18.001 -11.544 -5.822 1.00 0.00 O ATOM 175 OD2 ASP A 726 -19.351 -11.114 -4.141 1.00 0.00 O ATOM 0 H ASP A 726 -18.339 -8.693 -3.014 1.00 0.00 H new ATOM 0 HA ASP A 726 -16.557 -8.988 -5.321 1.00 0.00 H new ATOM 0 HB2 ASP A 726 -19.586 -8.818 -5.141 1.00 0.00 H new ATOM 0 HB3 ASP A 726 -18.659 -9.186 -6.583 1.00 0.00 H new ATOM 180 N GLN A 727 -18.394 -6.291 -4.676 1.00 0.00 N ATOM 181 CA GLN A 727 -18.466 -4.869 -4.982 1.00 0.00 C ATOM 182 C GLN A 727 -17.084 -4.279 -4.818 1.00 0.00 C ATOM 183 O GLN A 727 -16.621 -3.517 -5.652 1.00 0.00 O ATOM 184 CB GLN A 727 -19.462 -4.130 -4.100 1.00 0.00 C ATOM 185 CG GLN A 727 -20.823 -4.775 -4.068 1.00 0.00 C ATOM 186 CD GLN A 727 -21.772 -4.112 -3.087 1.00 0.00 C ATOM 187 OE1 GLN A 727 -21.861 -4.508 -1.925 1.00 0.00 O ATOM 188 NE2 GLN A 727 -22.487 -3.096 -3.554 1.00 0.00 N ATOM 0 H GLN A 727 -19.055 -6.616 -3.970 1.00 0.00 H new ATOM 0 HA GLN A 727 -18.819 -4.754 -6.007 1.00 0.00 H new ATOM 0 HB2 GLN A 727 -19.069 -4.077 -3.085 1.00 0.00 H new ATOM 0 HB3 GLN A 727 -19.562 -3.105 -4.457 1.00 0.00 H new ATOM 0 HG2 GLN A 727 -21.259 -4.740 -5.066 1.00 0.00 H new ATOM 0 HG3 GLN A 727 -20.714 -5.827 -3.805 1.00 0.00 H new ATOM 0 HE21 GLN A 727 -22.381 -2.801 -4.525 1.00 0.00 H new ATOM 0 HE22 GLN A 727 -23.143 -2.610 -2.942 1.00 0.00 H new ATOM 197 N LEU A 728 -16.426 -4.695 -3.743 1.00 0.00 N ATOM 198 CA LEU A 728 -15.081 -4.260 -3.422 1.00 0.00 C ATOM 199 C LEU A 728 -14.096 -4.842 -4.393 1.00 0.00 C ATOM 200 O LEU A 728 -13.367 -4.119 -5.050 1.00 0.00 O ATOM 201 CB LEU A 728 -14.773 -4.692 -2.009 1.00 0.00 C ATOM 202 CG LEU A 728 -15.561 -3.900 -1.006 1.00 0.00 C ATOM 203 CD1 LEU A 728 -15.292 -4.376 0.402 1.00 0.00 C ATOM 204 CD2 LEU A 728 -15.230 -2.452 -1.202 1.00 0.00 C ATOM 0 H LEU A 728 -16.818 -5.350 -3.066 1.00 0.00 H new ATOM 0 HA LEU A 728 -15.006 -3.175 -3.497 1.00 0.00 H new ATOM 0 HB2 LEU A 728 -14.998 -5.752 -1.895 1.00 0.00 H new ATOM 0 HB3 LEU A 728 -13.708 -4.570 -1.814 1.00 0.00 H new ATOM 0 HG LEU A 728 -16.630 -4.043 -1.160 1.00 0.00 H new ATOM 0 HD11 LEU A 728 -15.877 -3.783 1.105 1.00 0.00 H new ATOM 0 HD12 LEU A 728 -15.573 -5.425 0.491 1.00 0.00 H new ATOM 0 HD13 LEU A 728 -14.232 -4.264 0.628 1.00 0.00 H new ATOM 0 HD21 LEU A 728 -15.789 -1.851 -0.485 1.00 0.00 H new ATOM 0 HD22 LEU A 728 -14.162 -2.299 -1.049 1.00 0.00 H new ATOM 0 HD23 LEU A 728 -15.498 -2.151 -2.215 1.00 0.00 H new ATOM 216 N TYR A 729 -14.099 -6.150 -4.510 1.00 0.00 N ATOM 217 CA TYR A 729 -13.206 -6.807 -5.429 1.00 0.00 C ATOM 218 C TYR A 729 -13.035 -5.972 -6.676 1.00 0.00 C ATOM 219 O TYR A 729 -11.943 -5.488 -6.944 1.00 0.00 O ATOM 220 CB TYR A 729 -13.784 -8.170 -5.791 1.00 0.00 C ATOM 221 CG TYR A 729 -13.503 -8.621 -7.197 1.00 0.00 C ATOM 222 CD1 TYR A 729 -12.215 -8.838 -7.569 1.00 0.00 C ATOM 223 CD2 TYR A 729 -14.509 -8.845 -8.127 1.00 0.00 C ATOM 224 CE1 TYR A 729 -11.883 -9.266 -8.825 1.00 0.00 C ATOM 225 CE2 TYR A 729 -14.201 -9.276 -9.407 1.00 0.00 C ATOM 226 CZ TYR A 729 -12.879 -9.486 -9.753 1.00 0.00 C ATOM 227 OH TYR A 729 -12.560 -9.918 -11.019 1.00 0.00 O ATOM 0 H TYR A 729 -14.708 -6.775 -3.982 1.00 0.00 H new ATOM 0 HA TYR A 729 -12.230 -6.933 -4.961 1.00 0.00 H new ATOM 0 HB2 TYR A 729 -13.386 -8.913 -5.100 1.00 0.00 H new ATOM 0 HB3 TYR A 729 -14.863 -8.142 -5.642 1.00 0.00 H new ATOM 0 HD1 TYR A 729 -11.427 -8.667 -6.850 1.00 0.00 H new ATOM 0 HD2 TYR A 729 -15.540 -8.682 -7.850 1.00 0.00 H new ATOM 0 HE1 TYR A 729 -10.848 -9.430 -9.088 1.00 0.00 H new ATOM 0 HE2 TYR A 729 -14.987 -9.446 -10.128 1.00 0.00 H new ATOM 0 HH TYR A 729 -13.380 -10.024 -11.545 1.00 0.00 H new ATOM 237 N SER A 730 -14.107 -5.736 -7.403 1.00 0.00 N ATOM 238 CA SER A 730 -13.969 -4.966 -8.609 1.00 0.00 C ATOM 239 C SER A 730 -14.027 -3.464 -8.383 1.00 0.00 C ATOM 240 O SER A 730 -13.604 -2.698 -9.250 1.00 0.00 O ATOM 241 CB SER A 730 -14.865 -5.451 -9.719 1.00 0.00 C ATOM 242 OG SER A 730 -15.395 -4.373 -10.473 1.00 0.00 O ATOM 0 H SER A 730 -15.051 -6.056 -7.186 1.00 0.00 H new ATOM 0 HA SER A 730 -12.953 -5.148 -8.959 1.00 0.00 H new ATOM 0 HB2 SER A 730 -14.303 -6.114 -10.377 1.00 0.00 H new ATOM 0 HB3 SER A 730 -15.682 -6.037 -9.298 1.00 0.00 H new ATOM 0 HG SER A 730 -15.970 -4.723 -11.185 1.00 0.00 H new ATOM 248 N THR A 731 -14.551 -3.020 -7.239 1.00 0.00 N ATOM 249 CA THR A 731 -14.544 -1.588 -6.962 1.00 0.00 C ATOM 250 C THR A 731 -13.104 -1.230 -6.911 1.00 0.00 C ATOM 251 O THR A 731 -12.580 -0.462 -7.713 1.00 0.00 O ATOM 252 CB THR A 731 -15.189 -1.219 -5.605 1.00 0.00 C ATOM 253 OG1 THR A 731 -16.603 -1.047 -5.767 1.00 0.00 O ATOM 254 CG2 THR A 731 -14.585 0.059 -5.023 1.00 0.00 C ATOM 0 H THR A 731 -14.969 -3.606 -6.517 1.00 0.00 H new ATOM 0 HA THR A 731 -15.121 -1.060 -7.721 1.00 0.00 H new ATOM 0 HB THR A 731 -14.991 -2.036 -4.911 1.00 0.00 H new ATOM 0 HG1 THR A 731 -17.064 -1.877 -5.523 1.00 0.00 H new ATOM 0 HG21 THR A 731 -15.063 0.286 -4.070 1.00 0.00 H new ATOM 0 HG22 THR A 731 -13.515 -0.082 -4.868 1.00 0.00 H new ATOM 0 HG23 THR A 731 -14.745 0.885 -5.715 1.00 0.00 H new ATOM 262 N LEU A 732 -12.486 -1.881 -5.961 1.00 0.00 N ATOM 263 CA LEU A 732 -11.091 -1.788 -5.716 1.00 0.00 C ATOM 264 C LEU A 732 -10.315 -2.158 -6.976 1.00 0.00 C ATOM 265 O LEU A 732 -9.243 -1.624 -7.230 1.00 0.00 O ATOM 266 CB LEU A 732 -10.742 -2.758 -4.612 1.00 0.00 C ATOM 267 CG LEU A 732 -11.650 -2.803 -3.382 1.00 0.00 C ATOM 268 CD1 LEU A 732 -11.481 -4.136 -2.716 1.00 0.00 C ATOM 269 CD2 LEU A 732 -11.292 -1.705 -2.424 1.00 0.00 C ATOM 0 H LEU A 732 -12.968 -2.511 -5.319 1.00 0.00 H new ATOM 0 HA LEU A 732 -10.830 -0.769 -5.429 1.00 0.00 H new ATOM 0 HB2 LEU A 732 -10.714 -3.759 -5.043 1.00 0.00 H new ATOM 0 HB3 LEU A 732 -9.732 -2.529 -4.273 1.00 0.00 H new ATOM 0 HG LEU A 732 -12.687 -2.663 -3.687 1.00 0.00 H new ATOM 0 HD11 LEU A 732 -12.122 -4.187 -1.836 1.00 0.00 H new ATOM 0 HD12 LEU A 732 -11.757 -4.928 -3.412 1.00 0.00 H new ATOM 0 HD13 LEU A 732 -10.441 -4.263 -2.416 1.00 0.00 H new ATOM 0 HD21 LEU A 732 -11.948 -1.752 -1.555 1.00 0.00 H new ATOM 0 HD22 LEU A 732 -10.257 -1.824 -2.104 1.00 0.00 H new ATOM 0 HD23 LEU A 732 -11.411 -0.740 -2.916 1.00 0.00 H new ATOM 281 N LYS A 733 -10.868 -3.088 -7.763 1.00 0.00 N ATOM 282 CA LYS A 733 -10.217 -3.514 -9.001 1.00 0.00 C ATOM 283 C LYS A 733 -9.975 -2.300 -9.863 1.00 0.00 C ATOM 284 O LYS A 733 -9.035 -2.252 -10.644 1.00 0.00 O ATOM 285 CB LYS A 733 -11.077 -4.535 -9.752 1.00 0.00 C ATOM 286 CG LYS A 733 -10.472 -5.052 -11.043 1.00 0.00 C ATOM 287 CD LYS A 733 -10.873 -6.494 -11.312 1.00 0.00 C ATOM 288 CE LYS A 733 -12.303 -6.610 -11.794 1.00 0.00 C ATOM 289 NZ LYS A 733 -12.728 -5.429 -12.598 1.00 0.00 N ATOM 0 H LYS A 733 -11.754 -3.553 -7.566 1.00 0.00 H new ATOM 0 HA LYS A 733 -9.269 -3.995 -8.760 1.00 0.00 H new ATOM 0 HB2 LYS A 733 -11.269 -5.382 -9.093 1.00 0.00 H new ATOM 0 HB3 LYS A 733 -12.042 -4.081 -9.976 1.00 0.00 H new ATOM 0 HG2 LYS A 733 -10.794 -4.423 -11.873 1.00 0.00 H new ATOM 0 HG3 LYS A 733 -9.386 -4.980 -10.991 1.00 0.00 H new ATOM 0 HD2 LYS A 733 -10.204 -6.922 -12.059 1.00 0.00 H new ATOM 0 HD3 LYS A 733 -10.750 -7.079 -10.401 1.00 0.00 H new ATOM 0 HE2 LYS A 733 -12.409 -7.513 -12.395 1.00 0.00 H new ATOM 0 HE3 LYS A 733 -12.965 -6.719 -10.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 733 -13.603 -5.656 -13.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 733 -12.898 -4.621 -11.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 733 -11.980 -5.185 -13.278 1.00 0.00 H new ATOM 303 N SER A 734 -10.822 -1.303 -9.668 1.00 0.00 N ATOM 304 CA SER A 734 -10.725 -0.059 -10.416 1.00 0.00 C ATOM 305 C SER A 734 -9.767 0.878 -9.714 1.00 0.00 C ATOM 306 O SER A 734 -8.882 1.446 -10.354 1.00 0.00 O ATOM 307 CB SER A 734 -12.099 0.597 -10.570 1.00 0.00 C ATOM 308 OG SER A 734 -13.014 -0.274 -11.213 1.00 0.00 O ATOM 0 H SER A 734 -11.588 -1.331 -8.995 1.00 0.00 H new ATOM 0 HA SER A 734 -10.348 -0.279 -11.415 1.00 0.00 H new ATOM 0 HB2 SER A 734 -12.485 0.874 -9.589 1.00 0.00 H new ATOM 0 HB3 SER A 734 -12.003 1.517 -11.146 1.00 0.00 H new ATOM 0 HG SER A 734 -13.211 -1.033 -10.626 1.00 0.00 H new ATOM 314 N ILE A 735 -9.942 1.060 -8.398 1.00 0.00 N ATOM 315 CA ILE A 735 -9.024 1.900 -7.664 1.00 0.00 C ATOM 316 C ILE A 735 -7.630 1.416 -7.976 1.00 0.00 C ATOM 317 O ILE A 735 -6.866 2.116 -8.617 1.00 0.00 O ATOM 318 CB ILE A 735 -9.271 1.891 -6.144 1.00 0.00 C ATOM 319 CG1 ILE A 735 -10.640 2.476 -5.873 1.00 0.00 C ATOM 320 CG2 ILE A 735 -8.208 2.728 -5.431 1.00 0.00 C ATOM 321 CD1 ILE A 735 -11.743 1.478 -5.934 1.00 0.00 C ATOM 0 H ILE A 735 -10.692 0.645 -7.845 1.00 0.00 H new ATOM 0 HA ILE A 735 -9.170 2.935 -7.974 1.00 0.00 H new ATOM 0 HB ILE A 735 -9.217 0.868 -5.772 1.00 0.00 H new ATOM 0 HG12 ILE A 735 -10.637 2.941 -4.887 1.00 0.00 H new ATOM 0 HG13 ILE A 735 -10.837 3.266 -6.598 1.00 0.00 H new ATOM 0 HG21 ILE A 735 -8.394 2.714 -4.357 1.00 0.00 H new ATOM 0 HG22 ILE A 735 -7.221 2.312 -5.634 1.00 0.00 H new ATOM 0 HG23 ILE A 735 -8.251 3.755 -5.793 1.00 0.00 H new ATOM 0 HD11 ILE A 735 -12.693 1.972 -5.729 1.00 0.00 H new ATOM 0 HD12 ILE A 735 -11.774 1.030 -6.927 1.00 0.00 H new ATOM 0 HD13 ILE A 735 -11.571 0.700 -5.190 1.00 0.00 H new ATOM 333 N LEU A 736 -7.349 0.177 -7.589 1.00 0.00 N ATOM 334 CA LEU A 736 -6.059 -0.439 -7.861 1.00 0.00 C ATOM 335 C LEU A 736 -5.620 -0.111 -9.265 1.00 0.00 C ATOM 336 O LEU A 736 -4.596 0.524 -9.476 1.00 0.00 O ATOM 337 CB LEU A 736 -6.156 -1.959 -7.728 1.00 0.00 C ATOM 338 CG LEU A 736 -5.162 -2.580 -6.776 1.00 0.00 C ATOM 339 CD1 LEU A 736 -5.411 -4.052 -6.733 1.00 0.00 C ATOM 340 CD2 LEU A 736 -3.747 -2.241 -7.160 1.00 0.00 C ATOM 0 H LEU A 736 -8.002 -0.422 -7.084 1.00 0.00 H new ATOM 0 HA LEU A 736 -5.338 -0.052 -7.141 1.00 0.00 H new ATOM 0 HB2 LEU A 736 -7.162 -2.216 -7.398 1.00 0.00 H new ATOM 0 HB3 LEU A 736 -6.020 -2.405 -8.713 1.00 0.00 H new ATOM 0 HG LEU A 736 -5.297 -2.172 -5.774 1.00 0.00 H new ATOM 0 HD11 LEU A 736 -4.703 -4.521 -6.050 1.00 0.00 H new ATOM 0 HD12 LEU A 736 -6.427 -4.239 -6.387 1.00 0.00 H new ATOM 0 HD13 LEU A 736 -5.285 -4.472 -7.731 1.00 0.00 H new ATOM 0 HD21 LEU A 736 -3.058 -2.704 -6.454 1.00 0.00 H new ATOM 0 HD22 LEU A 736 -3.543 -2.614 -8.164 1.00 0.00 H new ATOM 0 HD23 LEU A 736 -3.614 -1.159 -7.141 1.00 0.00 H new ATOM 352 N GLN A 737 -6.437 -0.548 -10.209 1.00 0.00 N ATOM 353 CA GLN A 737 -6.193 -0.328 -11.629 1.00 0.00 C ATOM 354 C GLN A 737 -5.731 1.099 -11.892 1.00 0.00 C ATOM 355 O GLN A 737 -4.872 1.350 -12.738 1.00 0.00 O ATOM 356 CB GLN A 737 -7.483 -0.613 -12.409 1.00 0.00 C ATOM 357 CG GLN A 737 -7.539 -1.995 -13.028 1.00 0.00 C ATOM 358 CD GLN A 737 -8.520 -2.083 -14.181 1.00 0.00 C ATOM 359 OE1 GLN A 737 -9.524 -1.371 -14.212 1.00 0.00 O ATOM 360 NE2 GLN A 737 -8.236 -2.963 -15.133 1.00 0.00 N ATOM 0 H GLN A 737 -7.292 -1.068 -10.013 1.00 0.00 H new ATOM 0 HA GLN A 737 -5.402 -1.002 -11.958 1.00 0.00 H new ATOM 0 HB2 GLN A 737 -8.334 -0.492 -11.739 1.00 0.00 H new ATOM 0 HB3 GLN A 737 -7.590 0.131 -13.198 1.00 0.00 H new ATOM 0 HG2 GLN A 737 -6.545 -2.271 -13.381 1.00 0.00 H new ATOM 0 HG3 GLN A 737 -7.818 -2.720 -12.263 1.00 0.00 H new ATOM 0 HE21 GLN A 737 -7.392 -3.532 -15.066 1.00 0.00 H new ATOM 0 HE22 GLN A 737 -8.861 -3.070 -15.932 1.00 0.00 H new ATOM 369 N GLN A 738 -6.290 2.016 -11.130 1.00 0.00 N ATOM 370 CA GLN A 738 -5.987 3.431 -11.259 1.00 0.00 C ATOM 371 C GLN A 738 -4.699 3.821 -10.530 1.00 0.00 C ATOM 372 O GLN A 738 -3.781 4.378 -11.132 1.00 0.00 O ATOM 373 CB GLN A 738 -7.171 4.230 -10.732 1.00 0.00 C ATOM 374 CG GLN A 738 -8.296 4.310 -11.746 1.00 0.00 C ATOM 375 CD GLN A 738 -9.652 4.567 -11.119 1.00 0.00 C ATOM 376 OE1 GLN A 738 -9.892 3.953 -9.969 1.00 0.00 O flip ATOM 377 NE2 GLN A 738 -10.480 5.288 -11.673 1.00 0.00 N flip ATOM 0 H GLN A 738 -6.970 1.803 -10.400 1.00 0.00 H new ATOM 0 HA GLN A 738 -5.820 3.656 -12.312 1.00 0.00 H new ATOM 0 HB2 GLN A 738 -7.540 3.770 -9.816 1.00 0.00 H new ATOM 0 HB3 GLN A 738 -6.843 5.237 -10.473 1.00 0.00 H new ATOM 0 HG2 GLN A 738 -8.077 5.105 -12.459 1.00 0.00 H new ATOM 0 HG3 GLN A 738 -8.335 3.378 -12.309 1.00 0.00 H new ATOM 0 HE21 GLN A 738 -10.251 5.741 -12.558 1.00 0.00 H new ATOM 0 HE22 GLN A 738 -11.396 5.433 -11.248 1.00 0.00 H new ATOM 386 N VAL A 739 -4.639 3.525 -9.234 1.00 0.00 N ATOM 387 CA VAL A 739 -3.489 3.838 -8.418 1.00 0.00 C ATOM 388 C VAL A 739 -2.229 3.255 -9.032 1.00 0.00 C ATOM 389 O VAL A 739 -1.162 3.829 -8.906 1.00 0.00 O ATOM 390 CB VAL A 739 -3.648 3.285 -6.979 1.00 0.00 C ATOM 391 CG1 VAL A 739 -5.083 2.974 -6.638 1.00 0.00 C ATOM 392 CG2 VAL A 739 -2.766 2.080 -6.780 1.00 0.00 C ATOM 0 H VAL A 739 -5.393 3.060 -8.727 1.00 0.00 H new ATOM 0 HA VAL A 739 -3.411 4.924 -8.372 1.00 0.00 H new ATOM 0 HB VAL A 739 -3.330 4.068 -6.291 1.00 0.00 H new ATOM 0 HG11 VAL A 739 -5.140 2.590 -5.620 1.00 0.00 H new ATOM 0 HG12 VAL A 739 -5.681 3.882 -6.717 1.00 0.00 H new ATOM 0 HG13 VAL A 739 -5.467 2.225 -7.330 1.00 0.00 H new ATOM 0 HG21 VAL A 739 -2.889 1.703 -5.765 1.00 0.00 H new ATOM 0 HG22 VAL A 739 -3.045 1.303 -7.492 1.00 0.00 H new ATOM 0 HG23 VAL A 739 -1.725 2.361 -6.939 1.00 0.00 H new ATOM 402 N LYS A 740 -2.366 2.102 -9.680 1.00 0.00 N ATOM 403 CA LYS A 740 -1.226 1.443 -10.298 1.00 0.00 C ATOM 404 C LYS A 740 -0.947 2.056 -11.655 1.00 0.00 C ATOM 405 O LYS A 740 0.203 2.166 -12.078 1.00 0.00 O ATOM 406 CB LYS A 740 -1.468 -0.045 -10.440 1.00 0.00 C ATOM 407 CG LYS A 740 -2.562 -0.312 -11.406 1.00 0.00 C ATOM 408 CD LYS A 740 -2.854 -1.792 -11.621 1.00 0.00 C ATOM 409 CE LYS A 740 -3.534 -2.438 -10.426 1.00 0.00 C ATOM 410 NZ LYS A 740 -4.079 -3.779 -10.768 1.00 0.00 N ATOM 0 H LYS A 740 -3.252 1.608 -9.789 1.00 0.00 H new ATOM 0 HA LYS A 740 -0.359 1.586 -9.653 1.00 0.00 H new ATOM 0 HB2 LYS A 740 -0.554 -0.536 -10.774 1.00 0.00 H new ATOM 0 HB3 LYS A 740 -1.722 -0.471 -9.469 1.00 0.00 H new ATOM 0 HG2 LYS A 740 -3.470 0.179 -11.056 1.00 0.00 H new ATOM 0 HG3 LYS A 740 -2.305 0.140 -12.364 1.00 0.00 H new ATOM 0 HD2 LYS A 740 -3.487 -1.909 -12.500 1.00 0.00 H new ATOM 0 HD3 LYS A 740 -1.921 -2.315 -11.829 1.00 0.00 H new ATOM 0 HE2 LYS A 740 -2.821 -2.532 -9.607 1.00 0.00 H new ATOM 0 HE3 LYS A 740 -4.341 -1.795 -10.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 740 -4.652 -4.133 -9.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 740 -4.673 -3.706 -11.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 740 -3.294 -4.437 -10.949 1.00 0.00 H new ATOM 424 N SER A 741 -2.012 2.432 -12.352 1.00 0.00 N ATOM 425 CA SER A 741 -1.858 3.064 -13.642 1.00 0.00 C ATOM 426 C SER A 741 -1.267 4.445 -13.434 1.00 0.00 C ATOM 427 O SER A 741 -0.846 5.117 -14.376 1.00 0.00 O ATOM 428 CB SER A 741 -3.199 3.168 -14.359 1.00 0.00 C ATOM 429 OG SER A 741 -3.035 3.634 -15.687 1.00 0.00 O ATOM 0 H SER A 741 -2.977 2.310 -12.045 1.00 0.00 H new ATOM 0 HA SER A 741 -1.195 2.462 -14.264 1.00 0.00 H new ATOM 0 HB2 SER A 741 -3.685 2.192 -14.371 1.00 0.00 H new ATOM 0 HB3 SER A 741 -3.855 3.845 -13.812 1.00 0.00 H new ATOM 0 HG SER A 741 -2.296 4.276 -15.719 1.00 0.00 H new ATOM 435 N HIS A 742 -1.249 4.851 -12.169 1.00 0.00 N ATOM 436 CA HIS A 742 -0.725 6.142 -11.772 1.00 0.00 C ATOM 437 C HIS A 742 0.748 6.278 -12.161 1.00 0.00 C ATOM 438 O HIS A 742 1.525 5.331 -12.063 1.00 0.00 O ATOM 439 CB HIS A 742 -0.902 6.331 -10.256 1.00 0.00 C ATOM 440 CG HIS A 742 -0.503 7.688 -9.764 1.00 0.00 C ATOM 441 ND1 HIS A 742 0.503 8.434 -10.331 1.00 0.00 N ATOM 442 CD2 HIS A 742 -0.991 8.436 -8.757 1.00 0.00 C ATOM 443 CE1 HIS A 742 0.617 9.579 -9.702 1.00 0.00 C ATOM 444 NE2 HIS A 742 -0.280 9.612 -8.737 1.00 0.00 N ATOM 0 H HIS A 742 -1.599 4.289 -11.393 1.00 0.00 H new ATOM 0 HA HIS A 742 -1.281 6.919 -12.295 1.00 0.00 H new ATOM 0 HB2 HIS A 742 -1.946 6.154 -9.997 1.00 0.00 H new ATOM 0 HB3 HIS A 742 -0.312 5.578 -9.734 1.00 0.00 H new ATOM 0 HD2 HIS A 742 -1.793 8.162 -8.088 1.00 0.00 H new ATOM 0 HE1 HIS A 742 1.325 10.361 -9.935 1.00 0.00 H new ATOM 0 HE2 HIS A 742 -0.423 10.382 -8.084 1.00 0.00 H new ATOM 453 N GLN A 743 1.102 7.471 -12.624 1.00 0.00 N ATOM 454 CA GLN A 743 2.460 7.806 -13.021 1.00 0.00 C ATOM 455 C GLN A 743 3.462 7.617 -11.868 1.00 0.00 C ATOM 456 O GLN A 743 4.675 7.647 -12.078 1.00 0.00 O ATOM 457 CB GLN A 743 2.457 9.251 -13.508 1.00 0.00 C ATOM 458 CG GLN A 743 3.818 9.892 -13.488 1.00 0.00 C ATOM 459 CD GLN A 743 3.815 11.311 -14.024 1.00 0.00 C ATOM 460 OE1 GLN A 743 2.819 12.026 -13.918 1.00 0.00 O ATOM 461 NE2 GLN A 743 4.935 11.724 -14.606 1.00 0.00 N ATOM 0 H GLN A 743 0.443 8.242 -12.735 1.00 0.00 H new ATOM 0 HA GLN A 743 2.782 7.134 -13.816 1.00 0.00 H new ATOM 0 HB2 GLN A 743 2.063 9.283 -14.524 1.00 0.00 H new ATOM 0 HB3 GLN A 743 1.779 9.835 -12.885 1.00 0.00 H new ATOM 0 HG2 GLN A 743 4.196 9.897 -12.466 1.00 0.00 H new ATOM 0 HG3 GLN A 743 4.506 9.288 -14.079 1.00 0.00 H new ATOM 0 HE21 GLN A 743 5.737 11.097 -14.672 1.00 0.00 H new ATOM 0 HE22 GLN A 743 4.993 12.668 -14.987 1.00 0.00 H new ATOM 470 N SER A 744 2.951 7.412 -10.661 1.00 0.00 N ATOM 471 CA SER A 744 3.794 7.224 -9.479 1.00 0.00 C ATOM 472 C SER A 744 3.680 5.811 -8.973 1.00 0.00 C ATOM 473 O SER A 744 4.141 5.477 -7.882 1.00 0.00 O ATOM 474 CB SER A 744 3.363 8.182 -8.364 1.00 0.00 C ATOM 475 OG SER A 744 4.016 9.434 -8.476 1.00 0.00 O ATOM 0 H SER A 744 1.950 7.371 -10.470 1.00 0.00 H new ATOM 0 HA SER A 744 4.826 7.429 -9.763 1.00 0.00 H new ATOM 0 HB2 SER A 744 2.284 8.328 -8.405 1.00 0.00 H new ATOM 0 HB3 SER A 744 3.588 7.738 -7.394 1.00 0.00 H new ATOM 0 HG SER A 744 4.982 9.293 -8.559 1.00 0.00 H new ATOM 481 N ALA A 745 3.057 4.990 -9.770 1.00 0.00 N ATOM 482 CA ALA A 745 2.823 3.624 -9.399 1.00 0.00 C ATOM 483 C ALA A 745 3.771 2.631 -10.035 1.00 0.00 C ATOM 484 O ALA A 745 3.734 1.467 -9.683 1.00 0.00 O ATOM 485 CB ALA A 745 1.408 3.281 -9.775 1.00 0.00 C ATOM 0 H ALA A 745 2.699 5.247 -10.690 1.00 0.00 H new ATOM 0 HA ALA A 745 2.998 3.546 -8.326 1.00 0.00 H new ATOM 0 HB1 ALA A 745 1.200 2.246 -9.504 1.00 0.00 H new ATOM 0 HB2 ALA A 745 0.721 3.940 -9.244 1.00 0.00 H new ATOM 0 HB3 ALA A 745 1.276 3.409 -10.849 1.00 0.00 H new ATOM 491 N TRP A 746 4.618 3.062 -10.949 1.00 0.00 N ATOM 492 CA TRP A 746 5.504 2.117 -11.616 1.00 0.00 C ATOM 493 C TRP A 746 6.478 1.395 -10.680 1.00 0.00 C ATOM 494 O TRP A 746 6.811 0.239 -10.946 1.00 0.00 O ATOM 495 CB TRP A 746 6.212 2.755 -12.794 1.00 0.00 C ATOM 496 CG TRP A 746 6.856 4.065 -12.481 1.00 0.00 C ATOM 497 CD1 TRP A 746 6.307 5.305 -12.646 1.00 0.00 C ATOM 498 CD2 TRP A 746 8.160 4.269 -11.938 1.00 0.00 C ATOM 499 NE1 TRP A 746 7.209 6.270 -12.273 1.00 0.00 N ATOM 500 CE2 TRP A 746 8.350 5.659 -11.828 1.00 0.00 C ATOM 501 CE3 TRP A 746 9.188 3.411 -11.538 1.00 0.00 C ATOM 502 CZ2 TRP A 746 9.525 6.209 -11.339 1.00 0.00 C ATOM 503 CZ3 TRP A 746 10.352 3.961 -11.044 1.00 0.00 C ATOM 504 CH2 TRP A 746 10.511 5.348 -10.951 1.00 0.00 C ATOM 0 H TRP A 746 4.715 4.034 -11.244 1.00 0.00 H new ATOM 0 HA TRP A 746 4.853 1.331 -11.999 1.00 0.00 H new ATOM 0 HB2 TRP A 746 6.973 2.067 -13.163 1.00 0.00 H new ATOM 0 HB3 TRP A 746 5.494 2.899 -13.601 1.00 0.00 H new ATOM 0 HD1 TRP A 746 5.311 5.498 -13.015 1.00 0.00 H new ATOM 0 HE1 TRP A 746 7.054 7.277 -12.320 1.00 0.00 H new ATOM 0 HE3 TRP A 746 9.073 2.340 -11.614 1.00 0.00 H new ATOM 0 HZ2 TRP A 746 9.655 7.279 -11.268 1.00 0.00 H new ATOM 0 HZ3 TRP A 746 11.153 3.311 -10.724 1.00 0.00 H new ATOM 0 HH2 TRP A 746 11.436 5.747 -10.563 1.00 0.00 H new ATOM 515 N PRO A 747 6.967 2.009 -9.582 1.00 0.00 N ATOM 516 CA PRO A 747 7.844 1.291 -8.674 1.00 0.00 C ATOM 517 C PRO A 747 7.041 0.243 -7.940 1.00 0.00 C ATOM 518 O PRO A 747 7.582 -0.655 -7.295 1.00 0.00 O ATOM 519 CB PRO A 747 8.341 2.344 -7.687 1.00 0.00 C ATOM 520 CG PRO A 747 7.758 3.648 -8.098 1.00 0.00 C ATOM 521 CD PRO A 747 6.701 3.383 -9.124 1.00 0.00 C ATOM 0 HA PRO A 747 8.666 0.793 -9.189 1.00 0.00 H new ATOM 0 HB2 PRO A 747 8.038 2.091 -6.671 1.00 0.00 H new ATOM 0 HB3 PRO A 747 9.430 2.392 -7.692 1.00 0.00 H new ATOM 0 HG2 PRO A 747 7.332 4.163 -7.237 1.00 0.00 H new ATOM 0 HG3 PRO A 747 8.531 4.298 -8.507 1.00 0.00 H new ATOM 0 HD2 PRO A 747 5.702 3.473 -8.697 1.00 0.00 H new ATOM 0 HD3 PRO A 747 6.760 4.094 -9.948 1.00 0.00 H new ATOM 529 N PHE A 748 5.722 0.383 -8.061 1.00 0.00 N ATOM 530 CA PHE A 748 4.784 -0.498 -7.396 1.00 0.00 C ATOM 531 C PHE A 748 3.959 -1.280 -8.419 1.00 0.00 C ATOM 532 O PHE A 748 3.301 -2.259 -8.081 1.00 0.00 O ATOM 533 CB PHE A 748 3.879 0.317 -6.459 1.00 0.00 C ATOM 534 CG PHE A 748 4.496 1.577 -5.916 1.00 0.00 C ATOM 535 CD1 PHE A 748 5.837 1.656 -5.651 1.00 0.00 C ATOM 536 CD2 PHE A 748 3.724 2.689 -5.672 1.00 0.00 C ATOM 537 CE1 PHE A 748 6.404 2.808 -5.157 1.00 0.00 C ATOM 538 CE2 PHE A 748 4.297 3.844 -5.169 1.00 0.00 C ATOM 539 CZ PHE A 748 5.630 3.896 -4.916 1.00 0.00 C ATOM 0 H PHE A 748 5.281 1.111 -8.623 1.00 0.00 H new ATOM 0 HA PHE A 748 5.339 -1.221 -6.798 1.00 0.00 H new ATOM 0 HB2 PHE A 748 2.967 0.579 -6.996 1.00 0.00 H new ATOM 0 HB3 PHE A 748 3.585 -0.316 -5.622 1.00 0.00 H new ATOM 0 HD1 PHE A 748 6.463 0.795 -5.834 1.00 0.00 H new ATOM 0 HD2 PHE A 748 2.664 2.661 -5.874 1.00 0.00 H new ATOM 0 HE1 PHE A 748 7.465 2.846 -4.961 1.00 0.00 H new ATOM 0 HE2 PHE A 748 3.680 4.709 -4.977 1.00 0.00 H new ATOM 0 HZ PHE A 748 6.073 4.800 -4.524 1.00 0.00 H new ATOM 549 N MET A 749 4.013 -0.841 -9.677 1.00 0.00 N ATOM 550 CA MET A 749 3.261 -1.475 -10.765 1.00 0.00 C ATOM 551 C MET A 749 3.498 -2.970 -10.786 1.00 0.00 C ATOM 552 O MET A 749 2.649 -3.745 -11.227 1.00 0.00 O ATOM 553 CB MET A 749 3.644 -0.862 -12.124 1.00 0.00 C ATOM 554 CG MET A 749 2.901 0.420 -12.456 1.00 0.00 C ATOM 555 SD MET A 749 1.635 0.202 -13.718 1.00 0.00 S ATOM 556 CE MET A 749 0.720 -1.102 -12.946 1.00 0.00 C ATOM 0 H MET A 749 4.574 -0.042 -9.971 1.00 0.00 H new ATOM 0 HA MET A 749 2.201 -1.294 -10.586 1.00 0.00 H new ATOM 0 HB2 MET A 749 4.715 -0.661 -12.131 1.00 0.00 H new ATOM 0 HB3 MET A 749 3.452 -1.594 -12.908 1.00 0.00 H new ATOM 0 HG2 MET A 749 2.437 0.808 -11.549 1.00 0.00 H new ATOM 0 HG3 MET A 749 3.617 1.169 -12.794 1.00 0.00 H new ATOM 0 HE1 MET A 749 -0.341 -0.982 -13.167 1.00 0.00 H new ATOM 0 HE2 MET A 749 1.064 -2.063 -13.328 1.00 0.00 H new ATOM 0 HE3 MET A 749 0.872 -1.064 -11.867 1.00 0.00 H new ATOM 566 N GLU A 750 4.658 -3.363 -10.301 1.00 0.00 N ATOM 567 CA GLU A 750 5.027 -4.758 -10.251 1.00 0.00 C ATOM 568 C GLU A 750 6.008 -5.019 -9.111 1.00 0.00 C ATOM 569 O GLU A 750 6.959 -4.262 -8.916 1.00 0.00 O ATOM 570 CB GLU A 750 5.645 -5.173 -11.575 1.00 0.00 C ATOM 571 CG GLU A 750 4.631 -5.612 -12.617 1.00 0.00 C ATOM 572 CD GLU A 750 5.275 -5.972 -13.941 1.00 0.00 C ATOM 573 OE1 GLU A 750 5.473 -5.062 -14.772 1.00 0.00 O ATOM 574 OE2 GLU A 750 5.583 -7.165 -14.147 1.00 0.00 O ATOM 0 H GLU A 750 5.366 -2.727 -9.933 1.00 0.00 H new ATOM 0 HA GLU A 750 4.129 -5.349 -10.071 1.00 0.00 H new ATOM 0 HB2 GLU A 750 6.222 -4.338 -11.973 1.00 0.00 H new ATOM 0 HB3 GLU A 750 6.346 -5.989 -11.398 1.00 0.00 H new ATOM 0 HG2 GLU A 750 4.078 -6.472 -12.240 1.00 0.00 H new ATOM 0 HG3 GLU A 750 3.908 -4.812 -12.775 1.00 0.00 H new ATOM 581 N PRO A 751 5.784 -6.099 -8.346 1.00 0.00 N ATOM 582 CA PRO A 751 6.636 -6.474 -7.225 1.00 0.00 C ATOM 583 C PRO A 751 8.104 -6.521 -7.601 1.00 0.00 C ATOM 584 O PRO A 751 8.489 -7.119 -8.605 1.00 0.00 O ATOM 585 CB PRO A 751 6.150 -7.861 -6.822 1.00 0.00 C ATOM 586 CG PRO A 751 5.251 -8.287 -7.914 1.00 0.00 C ATOM 587 CD PRO A 751 4.689 -7.044 -8.510 1.00 0.00 C ATOM 0 HA PRO A 751 6.567 -5.743 -6.420 1.00 0.00 H new ATOM 0 HB2 PRO A 751 6.984 -8.553 -6.706 1.00 0.00 H new ATOM 0 HB3 PRO A 751 5.625 -7.833 -5.867 1.00 0.00 H new ATOM 0 HG2 PRO A 751 5.796 -8.864 -8.662 1.00 0.00 H new ATOM 0 HG3 PRO A 751 4.456 -8.928 -7.534 1.00 0.00 H new ATOM 0 HD2 PRO A 751 4.423 -7.180 -9.558 1.00 0.00 H new ATOM 0 HD3 PRO A 751 3.788 -6.716 -7.992 1.00 0.00 H new ATOM 595 N VAL A 752 8.903 -5.875 -6.776 1.00 0.00 N ATOM 596 CA VAL A 752 10.330 -5.806 -6.941 1.00 0.00 C ATOM 597 C VAL A 752 10.943 -7.176 -7.230 1.00 0.00 C ATOM 598 O VAL A 752 10.316 -8.211 -7.007 1.00 0.00 O ATOM 599 CB VAL A 752 10.873 -5.275 -5.626 1.00 0.00 C ATOM 600 CG1 VAL A 752 12.366 -5.200 -5.576 1.00 0.00 C ATOM 601 CG2 VAL A 752 10.276 -3.928 -5.308 1.00 0.00 C ATOM 0 H VAL A 752 8.564 -5.374 -5.955 1.00 0.00 H new ATOM 0 HA VAL A 752 10.580 -5.169 -7.789 1.00 0.00 H new ATOM 0 HB VAL A 752 10.575 -5.999 -4.868 1.00 0.00 H new ATOM 0 HG11 VAL A 752 12.679 -4.812 -4.607 1.00 0.00 H new ATOM 0 HG12 VAL A 752 12.785 -6.196 -5.721 1.00 0.00 H new ATOM 0 HG13 VAL A 752 12.724 -4.538 -6.364 1.00 0.00 H new ATOM 0 HG21 VAL A 752 10.678 -3.566 -4.362 1.00 0.00 H new ATOM 0 HG22 VAL A 752 10.525 -3.223 -6.102 1.00 0.00 H new ATOM 0 HG23 VAL A 752 9.193 -4.019 -5.230 1.00 0.00 H new ATOM 611 N LYS A 753 12.179 -7.167 -7.719 1.00 0.00 N ATOM 612 CA LYS A 753 12.898 -8.402 -8.019 1.00 0.00 C ATOM 613 C LYS A 753 13.419 -9.000 -6.729 1.00 0.00 C ATOM 614 O LYS A 753 14.175 -9.972 -6.738 1.00 0.00 O ATOM 615 CB LYS A 753 14.087 -8.126 -8.945 1.00 0.00 C ATOM 616 CG LYS A 753 13.716 -7.338 -10.191 1.00 0.00 C ATOM 617 CD LYS A 753 13.349 -8.254 -11.349 1.00 0.00 C ATOM 618 CE LYS A 753 14.563 -8.994 -11.886 1.00 0.00 C ATOM 619 NZ LYS A 753 14.213 -9.872 -13.037 1.00 0.00 N ATOM 0 H LYS A 753 12.705 -6.316 -7.917 1.00 0.00 H new ATOM 0 HA LYS A 753 12.213 -9.091 -8.513 1.00 0.00 H new ATOM 0 HB2 LYS A 753 14.849 -7.577 -8.391 1.00 0.00 H new ATOM 0 HB3 LYS A 753 14.532 -9.075 -9.244 1.00 0.00 H new ATOM 0 HG2 LYS A 753 12.877 -6.679 -9.968 1.00 0.00 H new ATOM 0 HG3 LYS A 753 14.552 -6.702 -10.481 1.00 0.00 H new ATOM 0 HD2 LYS A 753 12.600 -8.974 -11.020 1.00 0.00 H new ATOM 0 HD3 LYS A 753 12.897 -7.667 -12.149 1.00 0.00 H new ATOM 0 HE2 LYS A 753 15.320 -8.273 -12.196 1.00 0.00 H new ATOM 0 HE3 LYS A 753 15.003 -9.596 -11.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 753 15.068 -10.359 -13.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 753 13.510 -10.576 -12.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 753 13.817 -9.295 -13.806 1.00 0.00 H new ATOM 633 N ARG A 754 13.008 -8.396 -5.618 1.00 0.00 N ATOM 634 CA ARG A 754 13.463 -8.808 -4.305 1.00 0.00 C ATOM 635 C ARG A 754 14.962 -8.575 -4.213 1.00 0.00 C ATOM 636 O ARG A 754 15.594 -8.876 -3.201 1.00 0.00 O ATOM 637 CB ARG A 754 13.113 -10.273 -4.023 1.00 0.00 C ATOM 638 CG ARG A 754 13.550 -10.764 -2.652 1.00 0.00 C ATOM 639 CD ARG A 754 13.092 -12.191 -2.398 1.00 0.00 C ATOM 640 NE ARG A 754 13.814 -13.153 -3.224 1.00 0.00 N ATOM 641 CZ ARG A 754 13.934 -14.443 -2.923 1.00 0.00 C ATOM 642 NH1 ARG A 754 13.370 -14.925 -1.823 1.00 0.00 N ATOM 643 NH2 ARG A 754 14.617 -15.252 -3.721 1.00 0.00 N ATOM 0 H ARG A 754 12.355 -7.613 -5.608 1.00 0.00 H new ATOM 0 HA ARG A 754 12.954 -8.213 -3.547 1.00 0.00 H new ATOM 0 HB2 ARG A 754 12.035 -10.402 -4.116 1.00 0.00 H new ATOM 0 HB3 ARG A 754 13.576 -10.899 -4.786 1.00 0.00 H new ATOM 0 HG2 ARG A 754 14.636 -10.710 -2.574 1.00 0.00 H new ATOM 0 HG3 ARG A 754 13.143 -10.108 -1.883 1.00 0.00 H new ATOM 0 HD2 ARG A 754 13.237 -12.436 -1.346 1.00 0.00 H new ATOM 0 HD3 ARG A 754 12.024 -12.270 -2.600 1.00 0.00 H new ATOM 0 HE ARG A 754 14.252 -12.817 -4.082 1.00 0.00 H new ATOM 0 HH11 ARG A 754 12.843 -14.306 -1.207 1.00 0.00 H new ATOM 0 HH12 ARG A 754 13.463 -15.915 -1.594 1.00 0.00 H new ATOM 0 HH21 ARG A 754 15.052 -14.885 -4.568 1.00 0.00 H new ATOM 0 HH22 ARG A 754 14.708 -16.241 -3.488 1.00 0.00 H new ATOM 657 N THR A 755 15.529 -8.011 -5.284 1.00 0.00 N ATOM 658 CA THR A 755 16.952 -7.743 -5.316 1.00 0.00 C ATOM 659 C THR A 755 17.297 -6.439 -6.031 1.00 0.00 C ATOM 660 O THR A 755 18.393 -5.913 -5.832 1.00 0.00 O ATOM 661 CB THR A 755 17.748 -8.891 -5.956 1.00 0.00 C ATOM 662 OG1 THR A 755 17.656 -8.816 -7.384 1.00 0.00 O ATOM 663 CG2 THR A 755 17.234 -10.242 -5.483 1.00 0.00 C ATOM 0 H THR A 755 15.023 -7.737 -6.126 1.00 0.00 H new ATOM 0 HA THR A 755 17.241 -7.648 -4.269 1.00 0.00 H new ATOM 0 HB THR A 755 18.790 -8.790 -5.651 1.00 0.00 H new ATOM 0 HG1 THR A 755 18.167 -9.550 -7.784 1.00 0.00 H new ATOM 0 HG21 THR A 755 17.815 -11.037 -5.951 1.00 0.00 H new ATOM 0 HG22 THR A 755 17.333 -10.310 -4.400 1.00 0.00 H new ATOM 0 HG23 THR A 755 16.185 -10.349 -5.759 1.00 0.00 H new ATOM 671 N GLU A 756 16.393 -5.899 -6.864 1.00 0.00 N ATOM 672 CA GLU A 756 16.697 -4.619 -7.497 1.00 0.00 C ATOM 673 C GLU A 756 16.748 -3.670 -6.353 1.00 0.00 C ATOM 674 O GLU A 756 17.351 -2.597 -6.374 1.00 0.00 O ATOM 675 CB GLU A 756 15.636 -4.145 -8.472 1.00 0.00 C ATOM 676 CG GLU A 756 14.281 -4.707 -8.187 1.00 0.00 C ATOM 677 CD GLU A 756 13.184 -4.078 -9.025 1.00 0.00 C ATOM 678 OE1 GLU A 756 13.185 -4.285 -10.256 1.00 0.00 O ATOM 679 OE2 GLU A 756 12.323 -3.380 -8.450 1.00 0.00 O ATOM 0 H GLU A 756 15.490 -6.309 -7.103 1.00 0.00 H new ATOM 0 HA GLU A 756 17.612 -4.696 -8.084 1.00 0.00 H new ATOM 0 HB2 GLU A 756 15.584 -3.057 -8.442 1.00 0.00 H new ATOM 0 HB3 GLU A 756 15.932 -4.422 -9.484 1.00 0.00 H new ATOM 0 HG2 GLU A 756 14.296 -5.782 -8.367 1.00 0.00 H new ATOM 0 HG3 GLU A 756 14.050 -4.564 -7.131 1.00 0.00 H new ATOM 686 N ALA A 757 16.048 -4.150 -5.353 1.00 0.00 N ATOM 687 CA ALA A 757 15.890 -3.541 -4.091 1.00 0.00 C ATOM 688 C ALA A 757 16.756 -4.293 -3.110 1.00 0.00 C ATOM 689 O ALA A 757 16.364 -5.304 -2.535 1.00 0.00 O ATOM 690 CB ALA A 757 14.448 -3.601 -3.753 1.00 0.00 C ATOM 0 H ALA A 757 15.548 -5.036 -5.423 1.00 0.00 H new ATOM 0 HA ALA A 757 16.199 -2.496 -4.073 1.00 0.00 H new ATOM 0 HB1 ALA A 757 14.283 -3.138 -2.780 1.00 0.00 H new ATOM 0 HB2 ALA A 757 13.874 -3.067 -4.511 1.00 0.00 H new ATOM 0 HB3 ALA A 757 14.125 -4.642 -3.720 1.00 0.00 H new ATOM 696 N PRO A 758 17.975 -3.810 -2.967 1.00 0.00 N ATOM 697 CA PRO A 758 18.981 -4.408 -2.100 1.00 0.00 C ATOM 698 C PRO A 758 18.540 -4.403 -0.654 1.00 0.00 C ATOM 699 O PRO A 758 18.356 -3.348 -0.048 1.00 0.00 O ATOM 700 CB PRO A 758 20.206 -3.523 -2.320 1.00 0.00 C ATOM 701 CG PRO A 758 19.657 -2.242 -2.850 1.00 0.00 C ATOM 702 CD PRO A 758 18.449 -2.599 -3.627 1.00 0.00 C ATOM 0 HA PRO A 758 19.171 -5.456 -2.329 1.00 0.00 H new ATOM 0 HB2 PRO A 758 20.753 -3.365 -1.390 1.00 0.00 H new ATOM 0 HB3 PRO A 758 20.902 -3.978 -3.025 1.00 0.00 H new ATOM 0 HG2 PRO A 758 19.409 -1.559 -2.037 1.00 0.00 H new ATOM 0 HG3 PRO A 758 20.389 -1.736 -3.479 1.00 0.00 H new ATOM 0 HD2 PRO A 758 17.702 -1.806 -3.598 1.00 0.00 H new ATOM 0 HD3 PRO A 758 18.683 -2.778 -4.676 1.00 0.00 H new ATOM 710 N GLY A 759 18.373 -5.595 -0.108 1.00 0.00 N ATOM 711 CA GLY A 759 17.919 -5.715 1.251 1.00 0.00 C ATOM 712 C GLY A 759 16.441 -5.419 1.345 1.00 0.00 C ATOM 713 O GLY A 759 15.911 -5.238 2.433 1.00 0.00 O ATOM 0 H GLY A 759 18.545 -6.480 -0.585 1.00 0.00 H new ATOM 0 HA2 GLY A 759 18.118 -6.721 1.619 1.00 0.00 H new ATOM 0 HA3 GLY A 759 18.475 -5.027 1.888 1.00 0.00 H new ATOM 717 N TYR A 760 15.780 -5.358 0.186 1.00 0.00 N ATOM 718 CA TYR A 760 14.348 -5.085 0.117 1.00 0.00 C ATOM 719 C TYR A 760 13.579 -5.854 1.178 1.00 0.00 C ATOM 720 O TYR A 760 12.977 -5.267 2.065 1.00 0.00 O ATOM 721 CB TYR A 760 13.883 -5.470 -1.280 1.00 0.00 C ATOM 722 CG TYR A 760 12.412 -5.368 -1.568 1.00 0.00 C ATOM 723 CD1 TYR A 760 11.653 -4.332 -1.090 1.00 0.00 C ATOM 724 CD2 TYR A 760 11.797 -6.304 -2.369 1.00 0.00 C ATOM 725 CE1 TYR A 760 10.315 -4.238 -1.404 1.00 0.00 C ATOM 726 CE2 TYR A 760 10.459 -6.216 -2.675 1.00 0.00 C ATOM 727 CZ TYR A 760 9.725 -5.179 -2.193 1.00 0.00 C ATOM 728 OH TYR A 760 8.389 -5.074 -2.509 1.00 0.00 O ATOM 0 H TYR A 760 16.221 -5.496 -0.723 1.00 0.00 H new ATOM 0 HA TYR A 760 14.159 -4.029 0.309 1.00 0.00 H new ATOM 0 HB2 TYR A 760 14.412 -4.842 -1.997 1.00 0.00 H new ATOM 0 HB3 TYR A 760 14.193 -6.498 -1.468 1.00 0.00 H new ATOM 0 HD1 TYR A 760 12.108 -3.582 -0.461 1.00 0.00 H new ATOM 0 HD2 TYR A 760 12.377 -7.124 -2.765 1.00 0.00 H new ATOM 0 HE1 TYR A 760 9.730 -3.414 -1.023 1.00 0.00 H new ATOM 0 HE2 TYR A 760 9.994 -6.968 -3.296 1.00 0.00 H new ATOM 0 HH TYR A 760 8.182 -5.672 -3.257 1.00 0.00 H new ATOM 738 N TYR A 761 13.612 -7.168 1.082 1.00 0.00 N ATOM 739 CA TYR A 761 12.913 -8.018 2.033 1.00 0.00 C ATOM 740 C TYR A 761 13.456 -7.867 3.448 1.00 0.00 C ATOM 741 O TYR A 761 12.812 -8.272 4.415 1.00 0.00 O ATOM 742 CB TYR A 761 12.953 -9.469 1.571 1.00 0.00 C ATOM 743 CG TYR A 761 11.829 -9.758 0.613 1.00 0.00 C ATOM 744 CD1 TYR A 761 11.602 -8.896 -0.439 1.00 0.00 C ATOM 745 CD2 TYR A 761 10.961 -10.827 0.788 1.00 0.00 C ATOM 746 CE1 TYR A 761 10.552 -9.076 -1.305 1.00 0.00 C ATOM 747 CE2 TYR A 761 9.905 -11.031 -0.084 1.00 0.00 C ATOM 748 CZ TYR A 761 9.703 -10.150 -1.130 1.00 0.00 C ATOM 749 OH TYR A 761 8.648 -10.338 -1.993 1.00 0.00 O ATOM 0 H TYR A 761 14.116 -7.674 0.354 1.00 0.00 H new ATOM 0 HA TYR A 761 11.873 -7.694 2.067 1.00 0.00 H new ATOM 0 HB2 TYR A 761 13.909 -9.675 1.090 1.00 0.00 H new ATOM 0 HB3 TYR A 761 12.881 -10.132 2.433 1.00 0.00 H new ATOM 0 HD1 TYR A 761 12.267 -8.058 -0.585 1.00 0.00 H new ATOM 0 HD2 TYR A 761 11.111 -11.507 1.613 1.00 0.00 H new ATOM 0 HE1 TYR A 761 10.392 -8.382 -2.117 1.00 0.00 H new ATOM 0 HE2 TYR A 761 9.243 -11.873 0.052 1.00 0.00 H new ATOM 0 HH TYR A 761 8.150 -11.140 -1.731 1.00 0.00 H new ATOM 759 N GLU A 762 14.638 -7.283 3.564 1.00 0.00 N ATOM 760 CA GLU A 762 15.256 -7.075 4.865 1.00 0.00 C ATOM 761 C GLU A 762 14.535 -5.957 5.600 1.00 0.00 C ATOM 762 O GLU A 762 14.223 -6.057 6.787 1.00 0.00 O ATOM 763 CB GLU A 762 16.738 -6.725 4.690 1.00 0.00 C ATOM 764 CG GLU A 762 17.104 -5.346 5.213 1.00 0.00 C ATOM 765 CD GLU A 762 18.597 -5.167 5.408 1.00 0.00 C ATOM 766 OE1 GLU A 762 19.273 -4.732 4.451 1.00 0.00 O ATOM 767 OE2 GLU A 762 19.090 -5.462 6.516 1.00 0.00 O ATOM 0 H GLU A 762 15.188 -6.945 2.775 1.00 0.00 H new ATOM 0 HA GLU A 762 15.180 -7.991 5.450 1.00 0.00 H new ATOM 0 HB2 GLU A 762 17.342 -7.472 5.205 1.00 0.00 H new ATOM 0 HB3 GLU A 762 16.994 -6.783 3.632 1.00 0.00 H new ATOM 0 HG2 GLU A 762 16.740 -4.590 4.517 1.00 0.00 H new ATOM 0 HG3 GLU A 762 16.596 -5.176 6.162 1.00 0.00 H new ATOM 774 N VAL A 763 14.286 -4.895 4.860 1.00 0.00 N ATOM 775 CA VAL A 763 13.610 -3.724 5.361 1.00 0.00 C ATOM 776 C VAL A 763 12.129 -3.923 5.245 1.00 0.00 C ATOM 777 O VAL A 763 11.378 -3.896 6.220 1.00 0.00 O ATOM 778 CB VAL A 763 14.000 -2.471 4.529 1.00 0.00 C ATOM 779 CG1 VAL A 763 14.558 -2.837 3.172 1.00 0.00 C ATOM 780 CG2 VAL A 763 12.825 -1.598 4.268 1.00 0.00 C ATOM 0 H VAL A 763 14.554 -4.824 3.878 1.00 0.00 H new ATOM 0 HA VAL A 763 13.901 -3.574 6.401 1.00 0.00 H new ATOM 0 HB VAL A 763 14.750 -1.956 5.129 1.00 0.00 H new ATOM 0 HG11 VAL A 763 14.816 -1.929 2.628 1.00 0.00 H new ATOM 0 HG12 VAL A 763 15.450 -3.450 3.299 1.00 0.00 H new ATOM 0 HG13 VAL A 763 13.810 -3.397 2.610 1.00 0.00 H new ATOM 0 HG21 VAL A 763 13.137 -0.732 3.684 1.00 0.00 H new ATOM 0 HG22 VAL A 763 12.072 -2.158 3.713 1.00 0.00 H new ATOM 0 HG23 VAL A 763 12.403 -1.263 5.216 1.00 0.00 H new ATOM 790 N ILE A 764 11.746 -4.124 4.017 1.00 0.00 N ATOM 791 CA ILE A 764 10.380 -4.288 3.653 1.00 0.00 C ATOM 792 C ILE A 764 9.832 -5.607 4.154 1.00 0.00 C ATOM 793 O ILE A 764 9.913 -6.629 3.477 1.00 0.00 O ATOM 794 CB ILE A 764 10.252 -4.174 2.143 1.00 0.00 C ATOM 795 CG1 ILE A 764 10.831 -2.830 1.705 1.00 0.00 C ATOM 796 CG2 ILE A 764 8.817 -4.307 1.714 1.00 0.00 C ATOM 797 CD1 ILE A 764 10.024 -1.615 2.124 1.00 0.00 C ATOM 0 H ILE A 764 12.392 -4.179 3.230 1.00 0.00 H new ATOM 0 HA ILE A 764 9.788 -3.502 4.122 1.00 0.00 H new ATOM 0 HB ILE A 764 10.806 -4.983 1.667 1.00 0.00 H new ATOM 0 HG12 ILE A 764 11.838 -2.736 2.111 1.00 0.00 H new ATOM 0 HG13 ILE A 764 10.924 -2.828 0.619 1.00 0.00 H new ATOM 0 HG21 ILE A 764 8.752 -4.222 0.629 1.00 0.00 H new ATOM 0 HG22 ILE A 764 8.433 -5.278 2.025 1.00 0.00 H new ATOM 0 HG23 ILE A 764 8.224 -3.517 2.176 1.00 0.00 H new ATOM 0 HD11 ILE A 764 10.516 -0.710 1.767 1.00 0.00 H new ATOM 0 HD12 ILE A 764 9.024 -1.677 1.696 1.00 0.00 H new ATOM 0 HD13 ILE A 764 9.952 -1.583 3.211 1.00 0.00 H new ATOM 809 N ARG A 765 9.313 -5.571 5.368 1.00 0.00 N ATOM 810 CA ARG A 765 8.734 -6.747 5.989 1.00 0.00 C ATOM 811 C ARG A 765 7.581 -7.287 5.161 1.00 0.00 C ATOM 812 O ARG A 765 7.440 -8.499 4.998 1.00 0.00 O ATOM 813 CB ARG A 765 8.238 -6.408 7.384 1.00 0.00 C ATOM 814 CG ARG A 765 8.512 -7.482 8.419 1.00 0.00 C ATOM 815 CD ARG A 765 8.059 -8.845 7.947 1.00 0.00 C ATOM 816 NE ARG A 765 7.779 -9.750 9.059 1.00 0.00 N ATOM 817 CZ ARG A 765 7.376 -11.007 8.905 1.00 0.00 C ATOM 818 NH1 ARG A 765 7.196 -11.506 7.689 1.00 0.00 N ATOM 819 NH2 ARG A 765 7.149 -11.767 9.968 1.00 0.00 N ATOM 0 H ARG A 765 9.281 -4.732 5.947 1.00 0.00 H new ATOM 0 HA ARG A 765 9.508 -7.512 6.051 1.00 0.00 H new ATOM 0 HB2 ARG A 765 8.706 -5.479 7.708 1.00 0.00 H new ATOM 0 HB3 ARG A 765 7.164 -6.226 7.341 1.00 0.00 H new ATOM 0 HG2 ARG A 765 9.579 -7.510 8.640 1.00 0.00 H new ATOM 0 HG3 ARG A 765 8.000 -7.230 9.348 1.00 0.00 H new ATOM 0 HD2 ARG A 765 7.164 -8.736 7.335 1.00 0.00 H new ATOM 0 HD3 ARG A 765 8.829 -9.282 7.311 1.00 0.00 H new ATOM 0 HE ARG A 765 7.900 -9.397 10.008 1.00 0.00 H new ATOM 0 HH11 ARG A 765 7.367 -10.924 6.869 1.00 0.00 H new ATOM 0 HH12 ARG A 765 6.887 -12.471 7.574 1.00 0.00 H new ATOM 0 HH21 ARG A 765 7.284 -11.387 10.905 1.00 0.00 H new ATOM 0 HH22 ARG A 765 6.840 -12.732 9.849 1.00 0.00 H new ATOM 833 N PHE A 766 6.756 -6.387 4.630 1.00 0.00 N ATOM 834 CA PHE A 766 5.603 -6.813 3.844 1.00 0.00 C ATOM 835 C PHE A 766 5.574 -6.218 2.436 1.00 0.00 C ATOM 836 O PHE A 766 4.731 -5.379 2.124 1.00 0.00 O ATOM 837 CB PHE A 766 4.299 -6.466 4.568 1.00 0.00 C ATOM 838 CG PHE A 766 4.422 -6.288 6.053 1.00 0.00 C ATOM 839 CD1 PHE A 766 4.911 -7.303 6.842 1.00 0.00 C ATOM 840 CD2 PHE A 766 4.023 -5.110 6.657 1.00 0.00 C ATOM 841 CE1 PHE A 766 5.005 -7.149 8.213 1.00 0.00 C ATOM 842 CE2 PHE A 766 4.116 -4.943 8.018 1.00 0.00 C ATOM 843 CZ PHE A 766 4.606 -5.962 8.798 1.00 0.00 C ATOM 0 H PHE A 766 6.861 -5.377 4.727 1.00 0.00 H new ATOM 0 HA PHE A 766 5.699 -7.893 3.736 1.00 0.00 H new ATOM 0 HB2 PHE A 766 3.897 -5.548 4.140 1.00 0.00 H new ATOM 0 HB3 PHE A 766 3.572 -7.254 4.371 1.00 0.00 H new ATOM 0 HD1 PHE A 766 5.225 -8.230 6.386 1.00 0.00 H new ATOM 0 HD2 PHE A 766 3.632 -4.308 6.049 1.00 0.00 H new ATOM 0 HE1 PHE A 766 5.389 -7.953 8.824 1.00 0.00 H new ATOM 0 HE2 PHE A 766 3.805 -4.014 8.473 1.00 0.00 H new ATOM 0 HZ PHE A 766 4.679 -5.836 9.868 1.00 0.00 H new ATOM 853 N PRO A 767 6.500 -6.647 1.572 1.00 0.00 N ATOM 854 CA PRO A 767 6.568 -6.201 0.175 1.00 0.00 C ATOM 855 C PRO A 767 5.261 -6.349 -0.571 1.00 0.00 C ATOM 856 O PRO A 767 4.879 -7.454 -0.959 1.00 0.00 O ATOM 857 CB PRO A 767 7.601 -7.149 -0.410 1.00 0.00 C ATOM 858 CG PRO A 767 8.528 -7.330 0.722 1.00 0.00 C ATOM 859 CD PRO A 767 7.621 -7.547 1.892 1.00 0.00 C ATOM 0 HA PRO A 767 6.807 -5.140 0.099 1.00 0.00 H new ATOM 0 HB2 PRO A 767 7.156 -8.092 -0.727 1.00 0.00 H new ATOM 0 HB3 PRO A 767 8.099 -6.723 -1.281 1.00 0.00 H new ATOM 0 HG2 PRO A 767 9.190 -8.182 0.565 1.00 0.00 H new ATOM 0 HG3 PRO A 767 9.162 -6.455 0.864 1.00 0.00 H new ATOM 0 HD2 PRO A 767 7.301 -8.586 1.975 1.00 0.00 H new ATOM 0 HD3 PRO A 767 8.100 -7.285 2.835 1.00 0.00 H new ATOM 867 N MET A 768 4.576 -5.239 -0.768 1.00 0.00 N ATOM 868 CA MET A 768 3.332 -5.260 -1.502 1.00 0.00 C ATOM 869 C MET A 768 3.368 -4.257 -2.625 1.00 0.00 C ATOM 870 O MET A 768 3.906 -3.160 -2.490 1.00 0.00 O ATOM 871 CB MET A 768 2.130 -5.027 -0.587 1.00 0.00 C ATOM 872 CG MET A 768 0.866 -4.568 -1.310 1.00 0.00 C ATOM 873 SD MET A 768 0.070 -5.852 -2.281 1.00 0.00 S ATOM 874 CE MET A 768 -0.033 -7.087 -1.019 1.00 0.00 C ATOM 0 H MET A 768 4.860 -4.319 -0.432 1.00 0.00 H new ATOM 0 HA MET A 768 3.214 -6.254 -1.933 1.00 0.00 H new ATOM 0 HB2 MET A 768 1.912 -5.951 -0.051 1.00 0.00 H new ATOM 0 HB3 MET A 768 2.397 -4.280 0.161 1.00 0.00 H new ATOM 0 HG2 MET A 768 0.156 -4.191 -0.574 1.00 0.00 H new ATOM 0 HG3 MET A 768 1.118 -3.735 -1.966 1.00 0.00 H new ATOM 0 HE1 MET A 768 -1.013 -7.564 -1.056 1.00 0.00 H new ATOM 0 HE2 MET A 768 0.742 -7.837 -1.180 1.00 0.00 H new ATOM 0 HE3 MET A 768 0.108 -6.623 -0.043 1.00 0.00 H new ATOM 884 N ASP A 769 2.806 -4.663 -3.742 1.00 0.00 N ATOM 885 CA ASP A 769 2.761 -3.837 -4.917 1.00 0.00 C ATOM 886 C ASP A 769 1.353 -3.779 -5.463 1.00 0.00 C ATOM 887 O ASP A 769 0.424 -4.301 -4.861 1.00 0.00 O ATOM 888 CB ASP A 769 3.703 -4.394 -5.979 1.00 0.00 C ATOM 889 CG ASP A 769 5.133 -3.932 -5.786 1.00 0.00 C ATOM 890 OD1 ASP A 769 5.698 -4.187 -4.702 1.00 0.00 O ATOM 891 OD2 ASP A 769 5.692 -3.322 -6.720 1.00 0.00 O ATOM 0 H ASP A 769 2.368 -5.577 -3.856 1.00 0.00 H new ATOM 0 HA ASP A 769 3.077 -2.829 -4.649 1.00 0.00 H new ATOM 0 HB2 ASP A 769 3.670 -5.483 -5.954 1.00 0.00 H new ATOM 0 HB3 ASP A 769 3.355 -4.087 -6.965 1.00 0.00 H new ATOM 896 N LEU A 770 1.205 -3.109 -6.584 1.00 0.00 N ATOM 897 CA LEU A 770 -0.081 -2.991 -7.243 1.00 0.00 C ATOM 898 C LEU A 770 -0.424 -4.266 -7.983 1.00 0.00 C ATOM 899 O LEU A 770 -1.594 -4.563 -8.193 1.00 0.00 O ATOM 900 CB LEU A 770 -0.061 -1.804 -8.173 1.00 0.00 C ATOM 901 CG LEU A 770 0.660 -0.619 -7.587 1.00 0.00 C ATOM 902 CD1 LEU A 770 1.336 0.130 -8.677 1.00 0.00 C ATOM 903 CD2 LEU A 770 -0.300 0.289 -6.870 1.00 0.00 C ATOM 0 H LEU A 770 1.968 -2.632 -7.065 1.00 0.00 H new ATOM 0 HA LEU A 770 -0.857 -2.834 -6.493 1.00 0.00 H new ATOM 0 HB2 LEU A 770 0.419 -2.089 -9.109 1.00 0.00 H new ATOM 0 HB3 LEU A 770 -1.085 -1.519 -8.413 1.00 0.00 H new ATOM 0 HG LEU A 770 1.397 -0.977 -6.868 1.00 0.00 H new ATOM 0 HD11 LEU A 770 1.860 0.989 -8.258 1.00 0.00 H new ATOM 0 HD12 LEU A 770 2.052 -0.522 -9.177 1.00 0.00 H new ATOM 0 HD13 LEU A 770 0.593 0.474 -9.397 1.00 0.00 H new ATOM 0 HD21 LEU A 770 0.243 1.138 -6.455 1.00 0.00 H new ATOM 0 HD22 LEU A 770 -1.054 0.648 -7.571 1.00 0.00 H new ATOM 0 HD23 LEU A 770 -0.787 -0.260 -6.064 1.00 0.00 H new ATOM 915 N LYS A 771 0.595 -4.995 -8.429 1.00 0.00 N ATOM 916 CA LYS A 771 0.348 -6.271 -9.073 1.00 0.00 C ATOM 917 C LYS A 771 0.015 -7.277 -7.994 1.00 0.00 C ATOM 918 O LYS A 771 -0.824 -8.150 -8.184 1.00 0.00 O ATOM 919 CB LYS A 771 1.537 -6.759 -9.881 1.00 0.00 C ATOM 920 CG LYS A 771 1.116 -7.627 -11.049 1.00 0.00 C ATOM 921 CD LYS A 771 1.288 -6.883 -12.357 1.00 0.00 C ATOM 922 CE LYS A 771 0.559 -7.580 -13.487 1.00 0.00 C ATOM 923 NZ LYS A 771 0.781 -6.906 -14.796 1.00 0.00 N ATOM 0 H LYS A 771 1.577 -4.728 -8.357 1.00 0.00 H new ATOM 0 HA LYS A 771 -0.476 -6.151 -9.776 1.00 0.00 H new ATOM 0 HB2 LYS A 771 2.099 -5.902 -10.251 1.00 0.00 H new ATOM 0 HB3 LYS A 771 2.207 -7.324 -9.233 1.00 0.00 H new ATOM 0 HG2 LYS A 771 1.711 -8.540 -11.063 1.00 0.00 H new ATOM 0 HG3 LYS A 771 0.075 -7.927 -10.929 1.00 0.00 H new ATOM 0 HD2 LYS A 771 0.911 -5.866 -12.251 1.00 0.00 H new ATOM 0 HD3 LYS A 771 2.348 -6.807 -12.598 1.00 0.00 H new ATOM 0 HE2 LYS A 771 0.895 -8.615 -13.551 1.00 0.00 H new ATOM 0 HE3 LYS A 771 -0.509 -7.604 -13.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 771 0.264 -7.416 -15.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 771 0.437 -5.926 -14.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 771 1.797 -6.905 -15.018 1.00 0.00 H new ATOM 937 N THR A 772 0.719 -7.167 -6.869 1.00 0.00 N ATOM 938 CA THR A 772 0.440 -8.021 -5.726 1.00 0.00 C ATOM 939 C THR A 772 -0.948 -7.663 -5.220 1.00 0.00 C ATOM 940 O THR A 772 -1.761 -8.532 -4.909 1.00 0.00 O ATOM 941 CB THR A 772 1.460 -7.856 -4.590 1.00 0.00 C ATOM 942 OG1 THR A 772 2.785 -8.102 -5.078 1.00 0.00 O ATOM 943 CG2 THR A 772 1.140 -8.821 -3.459 1.00 0.00 C ATOM 0 H THR A 772 1.479 -6.501 -6.729 1.00 0.00 H new ATOM 0 HA THR A 772 0.504 -9.061 -6.046 1.00 0.00 H new ATOM 0 HB THR A 772 1.404 -6.835 -4.214 1.00 0.00 H new ATOM 0 HG1 THR A 772 3.428 -7.993 -4.347 1.00 0.00 H new ATOM 0 HG21 THR A 772 1.869 -8.697 -2.658 1.00 0.00 H new ATOM 0 HG22 THR A 772 0.141 -8.614 -3.076 1.00 0.00 H new ATOM 0 HG23 THR A 772 1.181 -9.845 -3.831 1.00 0.00 H new ATOM 951 N MET A 773 -1.193 -6.355 -5.120 1.00 0.00 N ATOM 952 CA MET A 773 -2.505 -5.843 -4.752 1.00 0.00 C ATOM 953 C MET A 773 -3.502 -6.488 -5.702 1.00 0.00 C ATOM 954 O MET A 773 -4.405 -7.202 -5.294 1.00 0.00 O ATOM 955 CB MET A 773 -2.541 -4.320 -4.914 1.00 0.00 C ATOM 956 CG MET A 773 -2.230 -3.557 -3.647 1.00 0.00 C ATOM 957 SD MET A 773 -3.410 -3.893 -2.350 1.00 0.00 S ATOM 958 CE MET A 773 -4.858 -3.128 -3.052 1.00 0.00 C ATOM 0 H MET A 773 -0.494 -5.632 -5.290 1.00 0.00 H new ATOM 0 HA MET A 773 -2.740 -6.074 -3.713 1.00 0.00 H new ATOM 0 HB2 MET A 773 -1.826 -4.030 -5.684 1.00 0.00 H new ATOM 0 HB3 MET A 773 -3.529 -4.026 -5.269 1.00 0.00 H new ATOM 0 HG2 MET A 773 -1.230 -3.820 -3.303 1.00 0.00 H new ATOM 0 HG3 MET A 773 -2.223 -2.488 -3.861 1.00 0.00 H new ATOM 0 HE1 MET A 773 -5.149 -2.272 -2.443 1.00 0.00 H new ATOM 0 HE2 MET A 773 -4.638 -2.794 -4.066 1.00 0.00 H new ATOM 0 HE3 MET A 773 -5.675 -3.850 -3.077 1.00 0.00 H new ATOM 968 N SER A 774 -3.277 -6.262 -6.990 1.00 0.00 N ATOM 969 CA SER A 774 -4.125 -6.819 -8.038 1.00 0.00 C ATOM 970 C SER A 774 -4.136 -8.334 -7.995 1.00 0.00 C ATOM 971 O SER A 774 -5.070 -8.959 -8.463 1.00 0.00 O ATOM 972 CB SER A 774 -3.657 -6.355 -9.398 1.00 0.00 C ATOM 973 OG SER A 774 -2.525 -7.084 -9.835 1.00 0.00 O ATOM 0 H SER A 774 -2.506 -5.691 -7.337 1.00 0.00 H new ATOM 0 HA SER A 774 -5.140 -6.462 -7.862 1.00 0.00 H new ATOM 0 HB2 SER A 774 -4.465 -6.469 -10.120 1.00 0.00 H new ATOM 0 HB3 SER A 774 -3.414 -5.293 -9.357 1.00 0.00 H new ATOM 0 HG SER A 774 -2.117 -7.543 -9.071 1.00 0.00 H new ATOM 979 N GLU A 775 -3.080 -8.924 -7.462 1.00 0.00 N ATOM 980 CA GLU A 775 -3.006 -10.371 -7.344 1.00 0.00 C ATOM 981 C GLU A 775 -4.119 -10.825 -6.429 1.00 0.00 C ATOM 982 O GLU A 775 -4.902 -11.729 -6.744 1.00 0.00 O ATOM 983 CB GLU A 775 -1.644 -10.770 -6.788 1.00 0.00 C ATOM 984 CG GLU A 775 -0.781 -11.519 -7.779 1.00 0.00 C ATOM 985 CD GLU A 775 0.250 -12.405 -7.109 1.00 0.00 C ATOM 986 OE1 GLU A 775 -0.080 -13.568 -6.796 1.00 0.00 O ATOM 987 OE2 GLU A 775 1.389 -11.937 -6.899 1.00 0.00 O ATOM 0 H GLU A 775 -2.264 -8.426 -7.105 1.00 0.00 H new ATOM 0 HA GLU A 775 -3.122 -10.846 -8.318 1.00 0.00 H new ATOM 0 HB2 GLU A 775 -1.116 -9.873 -6.464 1.00 0.00 H new ATOM 0 HB3 GLU A 775 -1.789 -11.391 -5.904 1.00 0.00 H new ATOM 0 HG2 GLU A 775 -1.418 -12.130 -8.419 1.00 0.00 H new ATOM 0 HG3 GLU A 775 -0.273 -10.803 -8.425 1.00 0.00 H new ATOM 994 N ARG A 776 -4.188 -10.149 -5.301 1.00 0.00 N ATOM 995 CA ARG A 776 -5.206 -10.395 -4.318 1.00 0.00 C ATOM 996 C ARG A 776 -6.555 -10.082 -4.930 1.00 0.00 C ATOM 997 O ARG A 776 -7.489 -10.875 -4.886 1.00 0.00 O ATOM 998 CB ARG A 776 -4.922 -9.513 -3.121 1.00 0.00 C ATOM 999 CG ARG A 776 -3.799 -10.054 -2.258 1.00 0.00 C ATOM 1000 CD ARG A 776 -2.840 -8.968 -1.804 1.00 0.00 C ATOM 1001 NE ARG A 776 -1.891 -9.466 -0.812 1.00 0.00 N ATOM 1002 CZ ARG A 776 -0.945 -10.363 -1.077 1.00 0.00 C ATOM 1003 NH1 ARG A 776 -0.825 -10.867 -2.299 1.00 0.00 N ATOM 1004 NH2 ARG A 776 -0.118 -10.759 -0.119 1.00 0.00 N ATOM 0 H ARG A 776 -3.533 -9.411 -5.045 1.00 0.00 H new ATOM 0 HA ARG A 776 -5.212 -11.436 -3.995 1.00 0.00 H new ATOM 0 HB2 ARG A 776 -4.663 -8.512 -3.464 1.00 0.00 H new ATOM 0 HB3 ARG A 776 -5.826 -9.419 -2.519 1.00 0.00 H new ATOM 0 HG2 ARG A 776 -4.223 -10.549 -1.384 1.00 0.00 H new ATOM 0 HG3 ARG A 776 -3.248 -10.811 -2.817 1.00 0.00 H new ATOM 0 HD2 ARG A 776 -2.296 -8.579 -2.665 1.00 0.00 H new ATOM 0 HD3 ARG A 776 -3.405 -8.137 -1.382 1.00 0.00 H new ATOM 0 HE ARG A 776 -1.957 -9.105 0.140 1.00 0.00 H new ATOM 0 HH11 ARG A 776 -1.459 -10.567 -3.039 1.00 0.00 H new ATOM 0 HH12 ARG A 776 -0.098 -11.555 -2.498 1.00 0.00 H new ATOM 0 HH21 ARG A 776 -0.207 -10.376 0.822 1.00 0.00 H new ATOM 0 HH22 ARG A 776 0.607 -11.447 -0.323 1.00 0.00 H new ATOM 1018 N LEU A 777 -6.602 -8.919 -5.535 1.00 0.00 N ATOM 1019 CA LEU A 777 -7.780 -8.411 -6.214 1.00 0.00 C ATOM 1020 C LEU A 777 -8.337 -9.438 -7.161 1.00 0.00 C ATOM 1021 O LEU A 777 -9.515 -9.780 -7.107 1.00 0.00 O ATOM 1022 CB LEU A 777 -7.364 -7.163 -6.986 1.00 0.00 C ATOM 1023 CG LEU A 777 -8.462 -6.266 -7.537 1.00 0.00 C ATOM 1024 CD1 LEU A 777 -9.734 -7.000 -7.846 1.00 0.00 C ATOM 1025 CD2 LEU A 777 -8.735 -5.162 -6.551 1.00 0.00 C ATOM 0 H LEU A 777 -5.806 -8.282 -5.572 1.00 0.00 H new ATOM 0 HA LEU A 777 -8.557 -8.177 -5.487 1.00 0.00 H new ATOM 0 HB2 LEU A 777 -6.736 -6.559 -6.331 1.00 0.00 H new ATOM 0 HB3 LEU A 777 -6.740 -7.480 -7.822 1.00 0.00 H new ATOM 0 HG LEU A 777 -8.103 -5.863 -8.484 1.00 0.00 H new ATOM 0 HD11 LEU A 777 -10.473 -6.299 -8.235 1.00 0.00 H new ATOM 0 HD12 LEU A 777 -9.537 -7.771 -8.591 1.00 0.00 H new ATOM 0 HD13 LEU A 777 -10.117 -7.464 -6.937 1.00 0.00 H new ATOM 0 HD21 LEU A 777 -9.521 -4.514 -6.939 1.00 0.00 H new ATOM 0 HD22 LEU A 777 -9.055 -5.593 -5.602 1.00 0.00 H new ATOM 0 HD23 LEU A 777 -7.827 -4.579 -6.397 1.00 0.00 H new ATOM 1037 N LYS A 778 -7.479 -9.925 -8.022 1.00 0.00 N ATOM 1038 CA LYS A 778 -7.882 -10.884 -9.003 1.00 0.00 C ATOM 1039 C LYS A 778 -8.607 -12.044 -8.350 1.00 0.00 C ATOM 1040 O LYS A 778 -9.685 -12.446 -8.787 1.00 0.00 O ATOM 1041 CB LYS A 778 -6.691 -11.424 -9.760 1.00 0.00 C ATOM 1042 CG LYS A 778 -6.578 -10.870 -11.153 1.00 0.00 C ATOM 1043 CD LYS A 778 -5.778 -9.583 -11.180 1.00 0.00 C ATOM 1044 CE LYS A 778 -4.269 -9.846 -11.220 1.00 0.00 C ATOM 1045 NZ LYS A 778 -3.875 -11.003 -10.372 1.00 0.00 N ATOM 0 H LYS A 778 -6.493 -9.667 -8.058 1.00 0.00 H new ATOM 0 HA LYS A 778 -8.550 -10.374 -9.698 1.00 0.00 H new ATOM 0 HB2 LYS A 778 -5.781 -11.191 -9.208 1.00 0.00 H new ATOM 0 HB3 LYS A 778 -6.763 -12.510 -9.812 1.00 0.00 H new ATOM 0 HG2 LYS A 778 -6.104 -11.607 -11.801 1.00 0.00 H new ATOM 0 HG3 LYS A 778 -7.575 -10.688 -11.554 1.00 0.00 H new ATOM 0 HD2 LYS A 778 -6.067 -8.995 -12.051 1.00 0.00 H new ATOM 0 HD3 LYS A 778 -6.019 -8.988 -10.299 1.00 0.00 H new ATOM 0 HE2 LYS A 778 -3.962 -10.032 -12.249 1.00 0.00 H new ATOM 0 HE3 LYS A 778 -3.738 -8.955 -10.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 778 -2.838 -11.070 -10.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 778 -4.247 -10.871 -9.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 778 -4.264 -11.878 -10.777 1.00 0.00 H new ATOM 1059 N ASN A 779 -7.997 -12.581 -7.294 1.00 0.00 N ATOM 1060 CA ASN A 779 -8.578 -13.708 -6.585 1.00 0.00 C ATOM 1061 C ASN A 779 -9.747 -13.262 -5.704 1.00 0.00 C ATOM 1062 O ASN A 779 -10.374 -14.081 -5.031 1.00 0.00 O ATOM 1063 CB ASN A 779 -7.508 -14.421 -5.749 1.00 0.00 C ATOM 1064 CG ASN A 779 -7.179 -13.699 -4.464 1.00 0.00 C ATOM 1065 OD1 ASN A 779 -8.112 -13.691 -3.529 1.00 0.00 O flip ATOM 1066 ND2 ASN A 779 -6.088 -13.160 -4.311 1.00 0.00 N flip ATOM 0 H ASN A 779 -7.108 -12.253 -6.917 1.00 0.00 H new ATOM 0 HA ASN A 779 -8.967 -14.410 -7.323 1.00 0.00 H new ATOM 0 HB2 ASN A 779 -7.851 -15.429 -5.515 1.00 0.00 H new ATOM 0 HB3 ASN A 779 -6.600 -14.524 -6.343 1.00 0.00 H new ATOM 0 HD21 ASN A 779 -5.395 -13.190 -5.059 1.00 0.00 H new ATOM 0 HD22 ASN A 779 -5.873 -12.682 -3.436 1.00 0.00 H new ATOM 1073 N ARG A 780 -10.015 -11.953 -5.717 1.00 0.00 N ATOM 1074 CA ARG A 780 -11.107 -11.346 -4.946 1.00 0.00 C ATOM 1075 C ARG A 780 -10.755 -11.288 -3.468 1.00 0.00 C ATOM 1076 O ARG A 780 -11.633 -11.209 -2.608 1.00 0.00 O ATOM 1077 CB ARG A 780 -12.415 -12.116 -5.109 1.00 0.00 C ATOM 1078 CG ARG A 780 -13.114 -11.889 -6.424 1.00 0.00 C ATOM 1079 CD ARG A 780 -12.441 -12.652 -7.545 1.00 0.00 C ATOM 1080 NE ARG A 780 -13.229 -13.802 -7.978 1.00 0.00 N ATOM 1081 CZ ARG A 780 -13.600 -14.011 -9.238 1.00 0.00 C ATOM 1082 NH1 ARG A 780 -13.255 -13.151 -10.187 1.00 0.00 N ATOM 1083 NH2 ARG A 780 -14.319 -15.082 -9.551 1.00 0.00 N ATOM 0 H ARG A 780 -9.479 -11.280 -6.265 1.00 0.00 H new ATOM 0 HA ARG A 780 -11.243 -10.337 -5.336 1.00 0.00 H new ATOM 0 HB2 ARG A 780 -12.211 -13.181 -5.000 1.00 0.00 H new ATOM 0 HB3 ARG A 780 -13.090 -11.836 -4.300 1.00 0.00 H new ATOM 0 HG2 ARG A 780 -14.155 -12.201 -6.343 1.00 0.00 H new ATOM 0 HG3 ARG A 780 -13.117 -10.824 -6.657 1.00 0.00 H new ATOM 0 HD2 ARG A 780 -12.280 -11.984 -8.391 1.00 0.00 H new ATOM 0 HD3 ARG A 780 -11.459 -12.990 -7.214 1.00 0.00 H new ATOM 0 HE ARG A 780 -13.511 -14.484 -7.274 1.00 0.00 H new ATOM 0 HH11 ARG A 780 -12.703 -12.326 -9.952 1.00 0.00 H new ATOM 0 HH12 ARG A 780 -13.541 -13.315 -11.152 1.00 0.00 H new ATOM 0 HH21 ARG A 780 -14.588 -15.746 -8.825 1.00 0.00 H new ATOM 0 HH22 ARG A 780 -14.603 -15.241 -10.518 1.00 0.00 H new ATOM 1097 N TYR A 781 -9.466 -11.335 -3.190 1.00 0.00 N ATOM 1098 CA TYR A 781 -8.962 -11.306 -1.830 1.00 0.00 C ATOM 1099 C TYR A 781 -9.554 -10.150 -1.042 1.00 0.00 C ATOM 1100 O TYR A 781 -9.893 -10.305 0.128 1.00 0.00 O ATOM 1101 CB TYR A 781 -7.443 -11.189 -1.882 1.00 0.00 C ATOM 1102 CG TYR A 781 -6.763 -10.824 -0.591 1.00 0.00 C ATOM 1103 CD1 TYR A 781 -6.662 -9.504 -0.216 1.00 0.00 C ATOM 1104 CD2 TYR A 781 -6.182 -11.790 0.220 1.00 0.00 C ATOM 1105 CE1 TYR A 781 -6.007 -9.135 0.928 1.00 0.00 C ATOM 1106 CE2 TYR A 781 -5.526 -11.435 1.382 1.00 0.00 C ATOM 1107 CZ TYR A 781 -5.437 -10.103 1.732 1.00 0.00 C ATOM 1108 OH TYR A 781 -4.774 -9.741 2.881 1.00 0.00 O ATOM 0 H TYR A 781 -8.738 -11.394 -3.902 1.00 0.00 H new ATOM 0 HA TYR A 781 -9.253 -12.225 -1.321 1.00 0.00 H new ATOM 0 HB2 TYR A 781 -7.037 -12.140 -2.227 1.00 0.00 H new ATOM 0 HB3 TYR A 781 -7.182 -10.441 -2.631 1.00 0.00 H new ATOM 0 HD1 TYR A 781 -7.109 -8.742 -0.838 1.00 0.00 H new ATOM 0 HD2 TYR A 781 -6.244 -12.831 -0.061 1.00 0.00 H new ATOM 0 HE1 TYR A 781 -5.936 -8.092 1.201 1.00 0.00 H new ATOM 0 HE2 TYR A 781 -5.086 -12.194 2.012 1.00 0.00 H new ATOM 0 HH TYR A 781 -4.435 -10.544 3.329 1.00 0.00 H new ATOM 1118 N TYR A 782 -9.680 -8.995 -1.690 1.00 0.00 N ATOM 1119 CA TYR A 782 -10.200 -7.811 -1.030 1.00 0.00 C ATOM 1120 C TYR A 782 -11.664 -7.935 -0.694 1.00 0.00 C ATOM 1121 O TYR A 782 -12.530 -7.392 -1.380 1.00 0.00 O ATOM 1122 CB TYR A 782 -9.936 -6.577 -1.872 1.00 0.00 C ATOM 1123 CG TYR A 782 -8.511 -6.485 -2.216 1.00 0.00 C ATOM 1124 CD1 TYR A 782 -7.623 -6.070 -1.277 1.00 0.00 C ATOM 1125 CD2 TYR A 782 -8.044 -6.858 -3.446 1.00 0.00 C ATOM 1126 CE1 TYR A 782 -6.297 -6.026 -1.539 1.00 0.00 C ATOM 1127 CE2 TYR A 782 -6.705 -6.797 -3.722 1.00 0.00 C ATOM 1128 CZ TYR A 782 -5.839 -6.383 -2.756 1.00 0.00 C ATOM 1129 OH TYR A 782 -4.507 -6.343 -3.000 1.00 0.00 O ATOM 0 H TYR A 782 -9.429 -8.858 -2.669 1.00 0.00 H new ATOM 0 HA TYR A 782 -9.671 -7.709 -0.082 1.00 0.00 H new ATOM 0 HB2 TYR A 782 -10.534 -6.616 -2.782 1.00 0.00 H new ATOM 0 HB3 TYR A 782 -10.243 -5.685 -1.327 1.00 0.00 H new ATOM 0 HD1 TYR A 782 -7.982 -5.770 -0.304 1.00 0.00 H new ATOM 0 HD2 TYR A 782 -8.734 -7.202 -4.202 1.00 0.00 H new ATOM 0 HE1 TYR A 782 -5.605 -5.705 -0.774 1.00 0.00 H new ATOM 0 HE2 TYR A 782 -6.338 -7.075 -4.699 1.00 0.00 H new ATOM 0 HH TYR A 782 -4.091 -5.659 -2.435 1.00 0.00 H new ATOM 1139 N VAL A 783 -11.924 -8.661 0.374 1.00 0.00 N ATOM 1140 CA VAL A 783 -13.265 -8.829 0.862 1.00 0.00 C ATOM 1141 C VAL A 783 -13.583 -7.644 1.735 1.00 0.00 C ATOM 1142 O VAL A 783 -14.594 -7.595 2.438 1.00 0.00 O ATOM 1143 CB VAL A 783 -13.408 -10.121 1.665 1.00 0.00 C ATOM 1144 CG1 VAL A 783 -13.223 -11.304 0.754 1.00 0.00 C ATOM 1145 CG2 VAL A 783 -12.407 -10.139 2.791 1.00 0.00 C ATOM 0 H VAL A 783 -11.212 -9.146 0.921 1.00 0.00 H new ATOM 0 HA VAL A 783 -13.955 -8.893 0.021 1.00 0.00 H new ATOM 0 HB VAL A 783 -14.406 -10.175 2.100 1.00 0.00 H new ATOM 0 HG11 VAL A 783 -13.325 -12.225 1.328 1.00 0.00 H new ATOM 0 HG12 VAL A 783 -13.979 -11.280 -0.031 1.00 0.00 H new ATOM 0 HG13 VAL A 783 -12.231 -11.265 0.304 1.00 0.00 H new ATOM 0 HG21 VAL A 783 -12.515 -11.063 3.359 1.00 0.00 H new ATOM 0 HG22 VAL A 783 -11.398 -10.080 2.382 1.00 0.00 H new ATOM 0 HG23 VAL A 783 -12.583 -9.287 3.448 1.00 0.00 H new ATOM 1155 N SER A 784 -12.676 -6.687 1.659 1.00 0.00 N ATOM 1156 CA SER A 784 -12.750 -5.477 2.428 1.00 0.00 C ATOM 1157 C SER A 784 -11.795 -4.443 1.840 1.00 0.00 C ATOM 1158 O SER A 784 -10.613 -4.734 1.662 1.00 0.00 O ATOM 1159 CB SER A 784 -12.364 -5.802 3.855 1.00 0.00 C ATOM 1160 OG SER A 784 -13.496 -6.156 4.630 1.00 0.00 O ATOM 0 H SER A 784 -11.859 -6.738 1.050 1.00 0.00 H new ATOM 0 HA SER A 784 -13.759 -5.066 2.405 1.00 0.00 H new ATOM 0 HB2 SER A 784 -11.646 -6.622 3.861 1.00 0.00 H new ATOM 0 HB3 SER A 784 -11.869 -4.941 4.304 1.00 0.00 H new ATOM 0 HG SER A 784 -14.120 -6.674 4.080 1.00 0.00 H new ATOM 1166 N LYS A 785 -12.293 -3.246 1.521 1.00 0.00 N ATOM 1167 CA LYS A 785 -11.420 -2.219 0.953 1.00 0.00 C ATOM 1168 C LYS A 785 -10.262 -1.955 1.884 1.00 0.00 C ATOM 1169 O LYS A 785 -9.307 -1.300 1.502 1.00 0.00 O ATOM 1170 CB LYS A 785 -12.131 -0.894 0.670 1.00 0.00 C ATOM 1171 CG LYS A 785 -13.632 -0.946 0.777 1.00 0.00 C ATOM 1172 CD LYS A 785 -14.125 -0.195 1.977 1.00 0.00 C ATOM 1173 CE LYS A 785 -13.460 -0.731 3.220 1.00 0.00 C ATOM 1174 NZ LYS A 785 -14.448 -1.194 4.234 1.00 0.00 N ATOM 0 H LYS A 785 -13.267 -2.970 1.642 1.00 0.00 H new ATOM 0 HA LYS A 785 -11.077 -2.614 -0.003 1.00 0.00 H new ATOM 0 HB2 LYS A 785 -11.757 -0.142 1.365 1.00 0.00 H new ATOM 0 HB3 LYS A 785 -11.864 -0.562 -0.333 1.00 0.00 H new ATOM 0 HG2 LYS A 785 -14.077 -0.525 -0.125 1.00 0.00 H new ATOM 0 HG3 LYS A 785 -13.957 -1.985 0.838 1.00 0.00 H new ATOM 0 HD2 LYS A 785 -13.909 0.868 1.867 1.00 0.00 H new ATOM 0 HD3 LYS A 785 -15.207 -0.294 2.060 1.00 0.00 H new ATOM 0 HE2 LYS A 785 -12.804 -1.559 2.950 1.00 0.00 H new ATOM 0 HE3 LYS A 785 -12.831 0.045 3.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 785 -13.945 -1.554 5.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 785 -15.058 -0.399 4.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 785 -15.032 -1.953 3.828 1.00 0.00 H new ATOM 1188 N LYS A 786 -10.362 -2.445 3.119 1.00 0.00 N ATOM 1189 CA LYS A 786 -9.295 -2.256 4.085 1.00 0.00 C ATOM 1190 C LYS A 786 -8.115 -3.143 3.730 1.00 0.00 C ATOM 1191 O LYS A 786 -6.969 -2.773 3.940 1.00 0.00 O ATOM 1192 CB LYS A 786 -9.778 -2.540 5.509 1.00 0.00 C ATOM 1193 CG LYS A 786 -8.760 -2.181 6.578 1.00 0.00 C ATOM 1194 CD LYS A 786 -9.229 -2.602 7.961 1.00 0.00 C ATOM 1195 CE LYS A 786 -8.267 -2.131 9.040 1.00 0.00 C ATOM 1196 NZ LYS A 786 -8.170 -0.646 9.084 1.00 0.00 N ATOM 0 H LYS A 786 -11.165 -2.970 3.466 1.00 0.00 H new ATOM 0 HA LYS A 786 -8.978 -1.214 4.049 1.00 0.00 H new ATOM 0 HB2 LYS A 786 -10.696 -1.981 5.691 1.00 0.00 H new ATOM 0 HB3 LYS A 786 -10.026 -3.598 5.596 1.00 0.00 H new ATOM 0 HG2 LYS A 786 -7.809 -2.664 6.353 1.00 0.00 H new ATOM 0 HG3 LYS A 786 -8.582 -1.106 6.565 1.00 0.00 H new ATOM 0 HD2 LYS A 786 -10.221 -2.192 8.151 1.00 0.00 H new ATOM 0 HD3 LYS A 786 -9.320 -3.687 8.001 1.00 0.00 H new ATOM 0 HE2 LYS A 786 -8.598 -2.503 10.010 1.00 0.00 H new ATOM 0 HE3 LYS A 786 -7.280 -2.555 8.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 786 -7.733 -0.353 9.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 786 -7.587 -0.313 8.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 786 -9.122 -0.234 9.012 1.00 0.00 H new ATOM 1210 N LEU A 787 -8.404 -4.334 3.230 1.00 0.00 N ATOM 1211 CA LEU A 787 -7.362 -5.230 2.767 1.00 0.00 C ATOM 1212 C LEU A 787 -6.627 -4.507 1.700 1.00 0.00 C ATOM 1213 O LEU A 787 -5.401 -4.428 1.640 1.00 0.00 O ATOM 1214 CB LEU A 787 -7.994 -6.449 2.121 1.00 0.00 C ATOM 1215 CG LEU A 787 -8.362 -7.539 3.068 1.00 0.00 C ATOM 1216 CD1 LEU A 787 -9.089 -8.636 2.323 1.00 0.00 C ATOM 1217 CD2 LEU A 787 -7.111 -8.021 3.766 1.00 0.00 C ATOM 0 H LEU A 787 -9.351 -4.700 3.135 1.00 0.00 H new ATOM 0 HA LEU A 787 -6.721 -5.533 3.595 1.00 0.00 H new ATOM 0 HB2 LEU A 787 -8.890 -6.135 1.585 1.00 0.00 H new ATOM 0 HB3 LEU A 787 -7.302 -6.849 1.380 1.00 0.00 H new ATOM 0 HG LEU A 787 -9.046 -7.179 3.836 1.00 0.00 H new ATOM 0 HD11 LEU A 787 -9.357 -9.432 3.018 1.00 0.00 H new ATOM 0 HD12 LEU A 787 -9.993 -8.230 1.870 1.00 0.00 H new ATOM 0 HD13 LEU A 787 -8.441 -9.038 1.544 1.00 0.00 H new ATOM 0 HD21 LEU A 787 -7.368 -8.819 4.462 1.00 0.00 H new ATOM 0 HD22 LEU A 787 -6.404 -8.397 3.027 1.00 0.00 H new ATOM 0 HD23 LEU A 787 -6.658 -7.194 4.313 1.00 0.00 H new ATOM 1229 N PHE A 788 -7.470 -3.993 0.860 1.00 0.00 N ATOM 1230 CA PHE A 788 -7.110 -3.230 -0.272 1.00 0.00 C ATOM 1231 C PHE A 788 -6.387 -1.976 0.116 1.00 0.00 C ATOM 1232 O PHE A 788 -5.419 -1.569 -0.527 1.00 0.00 O ATOM 1233 CB PHE A 788 -8.373 -2.924 -0.989 1.00 0.00 C ATOM 1234 CG PHE A 788 -8.041 -2.520 -2.334 1.00 0.00 C ATOM 1235 CD1 PHE A 788 -7.727 -1.245 -2.497 1.00 0.00 C ATOM 1236 CD2 PHE A 788 -7.996 -3.382 -3.395 1.00 0.00 C ATOM 1237 CE1 PHE A 788 -7.368 -0.757 -3.691 1.00 0.00 C ATOM 1238 CE2 PHE A 788 -7.632 -2.907 -4.628 1.00 0.00 C ATOM 1239 CZ PHE A 788 -7.319 -1.585 -4.773 1.00 0.00 C ATOM 0 H PHE A 788 -8.479 -4.106 0.960 1.00 0.00 H new ATOM 0 HA PHE A 788 -6.422 -3.785 -0.910 1.00 0.00 H new ATOM 0 HB2 PHE A 788 -9.023 -3.799 -1.004 1.00 0.00 H new ATOM 0 HB3 PHE A 788 -8.918 -2.131 -0.477 1.00 0.00 H new ATOM 0 HD1 PHE A 788 -7.761 -0.581 -1.646 1.00 0.00 H new ATOM 0 HD2 PHE A 788 -8.244 -4.425 -3.263 1.00 0.00 H new ATOM 0 HE1 PHE A 788 -7.118 0.288 -3.797 1.00 0.00 H new ATOM 0 HE2 PHE A 788 -7.593 -3.572 -5.478 1.00 0.00 H new ATOM 0 HZ PHE A 788 -7.034 -1.198 -5.740 1.00 0.00 H new ATOM 1249 N MET A 789 -6.853 -1.373 1.170 1.00 0.00 N ATOM 1250 CA MET A 789 -6.254 -0.173 1.655 1.00 0.00 C ATOM 1251 C MET A 789 -4.876 -0.493 2.172 1.00 0.00 C ATOM 1252 O MET A 789 -3.886 -0.072 1.611 1.00 0.00 O ATOM 1253 CB MET A 789 -7.112 0.412 2.744 1.00 0.00 C ATOM 1254 CG MET A 789 -8.245 1.243 2.191 1.00 0.00 C ATOM 1255 SD MET A 789 -8.460 2.766 3.094 1.00 0.00 S ATOM 1256 CE MET A 789 -8.066 3.900 1.783 1.00 0.00 C ATOM 0 H MET A 789 -7.653 -1.699 1.712 1.00 0.00 H new ATOM 0 HA MET A 789 -6.171 0.561 0.853 1.00 0.00 H new ATOM 0 HB2 MET A 789 -7.519 -0.393 3.356 1.00 0.00 H new ATOM 0 HB3 MET A 789 -6.496 1.029 3.398 1.00 0.00 H new ATOM 0 HG2 MET A 789 -8.051 1.468 1.142 1.00 0.00 H new ATOM 0 HG3 MET A 789 -9.169 0.666 2.228 1.00 0.00 H new ATOM 0 HE1 MET A 789 -7.644 4.812 2.205 1.00 0.00 H new ATOM 0 HE2 MET A 789 -7.340 3.442 1.111 1.00 0.00 H new ATOM 0 HE3 MET A 789 -8.972 4.143 1.227 1.00 0.00 H new ATOM 1266 N ALA A 790 -4.850 -1.314 3.200 1.00 0.00 N ATOM 1267 CA ALA A 790 -3.622 -1.734 3.858 1.00 0.00 C ATOM 1268 C ALA A 790 -2.528 -2.171 2.900 1.00 0.00 C ATOM 1269 O ALA A 790 -1.398 -1.722 3.017 1.00 0.00 O ATOM 1270 CB ALA A 790 -3.926 -2.896 4.775 1.00 0.00 C ATOM 0 H ALA A 790 -5.692 -1.717 3.612 1.00 0.00 H new ATOM 0 HA ALA A 790 -3.254 -0.862 4.399 1.00 0.00 H new ATOM 0 HB1 ALA A 790 -3.010 -3.217 5.272 1.00 0.00 H new ATOM 0 HB2 ALA A 790 -4.656 -2.588 5.523 1.00 0.00 H new ATOM 0 HB3 ALA A 790 -4.331 -3.723 4.192 1.00 0.00 H new ATOM 1276 N ASP A 791 -2.858 -3.074 1.984 1.00 0.00 N ATOM 1277 CA ASP A 791 -1.873 -3.599 1.045 1.00 0.00 C ATOM 1278 C ASP A 791 -1.426 -2.534 0.046 1.00 0.00 C ATOM 1279 O ASP A 791 -0.236 -2.316 -0.138 1.00 0.00 O ATOM 1280 CB ASP A 791 -2.416 -4.839 0.344 1.00 0.00 C ATOM 1281 CG ASP A 791 -2.529 -6.025 1.281 1.00 0.00 C ATOM 1282 OD1 ASP A 791 -1.478 -6.528 1.732 1.00 0.00 O ATOM 1283 OD2 ASP A 791 -3.668 -6.451 1.567 1.00 0.00 O ATOM 0 H ASP A 791 -3.797 -3.457 1.871 1.00 0.00 H new ATOM 0 HA ASP A 791 -0.987 -3.891 1.609 1.00 0.00 H new ATOM 0 HB2 ASP A 791 -3.397 -4.616 -0.077 1.00 0.00 H new ATOM 0 HB3 ASP A 791 -1.763 -5.098 -0.490 1.00 0.00 H new ATOM 1288 N LEU A 792 -2.350 -1.869 -0.623 1.00 0.00 N ATOM 1289 CA LEU A 792 -1.932 -0.813 -1.533 1.00 0.00 C ATOM 1290 C LEU A 792 -1.152 0.188 -0.722 1.00 0.00 C ATOM 1291 O LEU A 792 -0.178 0.781 -1.183 1.00 0.00 O ATOM 1292 CB LEU A 792 -3.130 -0.111 -2.175 1.00 0.00 C ATOM 1293 CG LEU A 792 -3.168 -0.115 -3.676 1.00 0.00 C ATOM 1294 CD1 LEU A 792 -4.253 0.820 -4.151 1.00 0.00 C ATOM 1295 CD2 LEU A 792 -1.821 0.274 -4.228 1.00 0.00 C ATOM 0 H LEU A 792 -3.355 -2.029 -0.561 1.00 0.00 H new ATOM 0 HA LEU A 792 -1.335 -1.243 -2.337 1.00 0.00 H new ATOM 0 HB2 LEU A 792 -4.042 -0.582 -1.807 1.00 0.00 H new ATOM 0 HB3 LEU A 792 -3.145 0.924 -1.834 1.00 0.00 H new ATOM 0 HG LEU A 792 -3.396 -1.117 -4.039 1.00 0.00 H new ATOM 0 HD11 LEU A 792 -4.283 0.819 -5.241 1.00 0.00 H new ATOM 0 HD12 LEU A 792 -5.215 0.488 -3.761 1.00 0.00 H new ATOM 0 HD13 LEU A 792 -4.046 1.829 -3.795 1.00 0.00 H new ATOM 0 HD21 LEU A 792 -1.859 0.268 -5.317 1.00 0.00 H new ATOM 0 HD22 LEU A 792 -1.560 1.273 -3.879 1.00 0.00 H new ATOM 0 HD23 LEU A 792 -1.069 -0.438 -3.887 1.00 0.00 H new ATOM 1307 N GLN A 793 -1.593 0.332 0.514 1.00 0.00 N ATOM 1308 CA GLN A 793 -0.972 1.230 1.450 1.00 0.00 C ATOM 1309 C GLN A 793 0.314 0.604 1.921 1.00 0.00 C ATOM 1310 O GLN A 793 1.211 1.270 2.425 1.00 0.00 O ATOM 1311 CB GLN A 793 -1.923 1.531 2.604 1.00 0.00 C ATOM 1312 CG GLN A 793 -3.045 2.454 2.180 1.00 0.00 C ATOM 1313 CD GLN A 793 -4.170 2.563 3.192 1.00 0.00 C ATOM 1314 OE1 GLN A 793 -3.967 2.370 4.390 1.00 0.00 O ATOM 1315 NE2 GLN A 793 -5.366 2.889 2.701 1.00 0.00 N ATOM 0 H GLN A 793 -2.394 -0.175 0.891 1.00 0.00 H new ATOM 0 HA GLN A 793 -0.744 2.185 0.976 1.00 0.00 H new ATOM 0 HB2 GLN A 793 -2.342 0.599 2.982 1.00 0.00 H new ATOM 0 HB3 GLN A 793 -1.367 1.986 3.424 1.00 0.00 H new ATOM 0 HG2 GLN A 793 -2.635 3.448 1.999 1.00 0.00 H new ATOM 0 HG3 GLN A 793 -3.454 2.101 1.234 1.00 0.00 H new ATOM 0 HE21 GLN A 793 -5.482 3.039 1.699 1.00 0.00 H new ATOM 0 HE22 GLN A 793 -6.165 2.989 3.328 1.00 0.00 H new ATOM 1324 N ARG A 794 0.369 -0.703 1.735 1.00 0.00 N ATOM 1325 CA ARG A 794 1.527 -1.487 2.070 1.00 0.00 C ATOM 1326 C ARG A 794 2.608 -1.208 1.038 1.00 0.00 C ATOM 1327 O ARG A 794 3.794 -1.336 1.325 1.00 0.00 O ATOM 1328 CB ARG A 794 1.174 -2.966 2.104 1.00 0.00 C ATOM 1329 CG ARG A 794 2.308 -3.802 2.636 1.00 0.00 C ATOM 1330 CD ARG A 794 2.558 -3.565 4.106 1.00 0.00 C ATOM 1331 NE ARG A 794 3.840 -2.901 4.340 1.00 0.00 N ATOM 1332 CZ ARG A 794 4.105 -2.159 5.411 1.00 0.00 C ATOM 1333 NH1 ARG A 794 3.171 -1.957 6.332 1.00 0.00 N ATOM 1334 NH2 ARG A 794 5.304 -1.612 5.560 1.00 0.00 N ATOM 0 H ARG A 794 -0.400 -1.247 1.343 1.00 0.00 H new ATOM 0 HA ARG A 794 1.891 -1.215 3.061 1.00 0.00 H new ATOM 0 HB2 ARG A 794 0.291 -3.114 2.726 1.00 0.00 H new ATOM 0 HB3 ARG A 794 0.916 -3.301 1.099 1.00 0.00 H new ATOM 0 HG2 ARG A 794 2.085 -4.857 2.474 1.00 0.00 H new ATOM 0 HG3 ARG A 794 3.215 -3.578 2.075 1.00 0.00 H new ATOM 0 HD2 ARG A 794 1.753 -2.956 4.518 1.00 0.00 H new ATOM 0 HD3 ARG A 794 2.540 -4.517 4.636 1.00 0.00 H new ATOM 0 HE ARG A 794 4.574 -3.014 3.641 1.00 0.00 H new ATOM 0 HH11 ARG A 794 2.246 -2.372 6.220 1.00 0.00 H new ATOM 0 HH12 ARG A 794 3.378 -1.387 7.152 1.00 0.00 H new ATOM 0 HH21 ARG A 794 6.024 -1.760 4.853 1.00 0.00 H new ATOM 0 HH22 ARG A 794 5.506 -1.043 6.382 1.00 0.00 H new ATOM 1348 N VAL A 795 2.184 -0.818 -0.174 1.00 0.00 N ATOM 1349 CA VAL A 795 3.138 -0.476 -1.221 1.00 0.00 C ATOM 1350 C VAL A 795 3.673 0.923 -0.945 1.00 0.00 C ATOM 1351 O VAL A 795 4.861 1.098 -0.743 1.00 0.00 O ATOM 1352 CB VAL A 795 2.553 -0.600 -2.670 1.00 0.00 C ATOM 1353 CG1 VAL A 795 1.341 -1.505 -2.671 1.00 0.00 C ATOM 1354 CG2 VAL A 795 2.215 0.743 -3.322 1.00 0.00 C ATOM 0 H VAL A 795 1.204 -0.735 -0.443 1.00 0.00 H new ATOM 0 HA VAL A 795 3.950 -1.202 -1.191 1.00 0.00 H new ATOM 0 HB VAL A 795 3.345 -1.037 -3.278 1.00 0.00 H new ATOM 0 HG11 VAL A 795 0.945 -1.582 -3.684 1.00 0.00 H new ATOM 0 HG12 VAL A 795 1.626 -2.496 -2.317 1.00 0.00 H new ATOM 0 HG13 VAL A 795 0.577 -1.091 -2.013 1.00 0.00 H new ATOM 0 HG21 VAL A 795 1.816 0.572 -4.322 1.00 0.00 H new ATOM 0 HG22 VAL A 795 1.471 1.263 -2.719 1.00 0.00 H new ATOM 0 HG23 VAL A 795 3.117 1.351 -3.391 1.00 0.00 H new ATOM 1364 N PHE A 796 2.772 1.897 -0.854 1.00 0.00 N ATOM 1365 CA PHE A 796 3.169 3.282 -0.588 1.00 0.00 C ATOM 1366 C PHE A 796 4.044 3.355 0.657 1.00 0.00 C ATOM 1367 O PHE A 796 5.109 3.967 0.641 1.00 0.00 O ATOM 1368 CB PHE A 796 1.957 4.185 -0.372 1.00 0.00 C ATOM 1369 CG PHE A 796 0.745 3.807 -1.166 1.00 0.00 C ATOM 1370 CD1 PHE A 796 0.822 3.531 -2.513 1.00 0.00 C ATOM 1371 CD2 PHE A 796 -0.470 3.699 -0.550 1.00 0.00 C ATOM 1372 CE1 PHE A 796 -0.291 3.154 -3.225 1.00 0.00 C ATOM 1373 CE2 PHE A 796 -1.582 3.324 -1.258 1.00 0.00 C ATOM 1374 CZ PHE A 796 -1.486 3.052 -2.601 1.00 0.00 C ATOM 0 H PHE A 796 1.767 1.757 -0.959 1.00 0.00 H new ATOM 0 HA PHE A 796 3.721 3.626 -1.463 1.00 0.00 H new ATOM 0 HB2 PHE A 796 1.698 4.176 0.687 1.00 0.00 H new ATOM 0 HB3 PHE A 796 2.234 5.209 -0.623 1.00 0.00 H new ATOM 0 HD1 PHE A 796 1.773 3.612 -3.018 1.00 0.00 H new ATOM 0 HD2 PHE A 796 -0.555 3.911 0.506 1.00 0.00 H new ATOM 0 HE1 PHE A 796 -0.211 2.940 -4.281 1.00 0.00 H new ATOM 0 HE2 PHE A 796 -2.536 3.242 -0.759 1.00 0.00 H new ATOM 0 HZ PHE A 796 -2.363 2.757 -3.157 1.00 0.00 H new ATOM 1384 N THR A 797 3.581 2.724 1.736 1.00 0.00 N ATOM 1385 CA THR A 797 4.310 2.734 2.999 1.00 0.00 C ATOM 1386 C THR A 797 5.656 2.024 2.881 1.00 0.00 C ATOM 1387 O THR A 797 6.660 2.527 3.374 1.00 0.00 O ATOM 1388 CB THR A 797 3.488 2.110 4.148 1.00 0.00 C ATOM 1389 OG1 THR A 797 4.027 2.519 5.409 1.00 0.00 O ATOM 1390 CG2 THR A 797 3.484 0.589 4.075 1.00 0.00 C ATOM 0 H THR A 797 2.706 2.201 1.758 1.00 0.00 H new ATOM 0 HA THR A 797 4.490 3.782 3.238 1.00 0.00 H new ATOM 0 HB THR A 797 2.461 2.460 4.047 1.00 0.00 H new ATOM 0 HG1 THR A 797 4.921 2.133 5.524 1.00 0.00 H new ATOM 0 HG21 THR A 797 2.896 0.187 4.900 1.00 0.00 H new ATOM 0 HG22 THR A 797 3.047 0.271 3.128 1.00 0.00 H new ATOM 0 HG23 THR A 797 4.507 0.219 4.145 1.00 0.00 H new ATOM 1398 N ASN A 798 5.679 0.849 2.248 1.00 0.00 N ATOM 1399 CA ASN A 798 6.928 0.123 2.071 1.00 0.00 C ATOM 1400 C ASN A 798 7.824 0.930 1.146 1.00 0.00 C ATOM 1401 O ASN A 798 9.052 0.851 1.207 1.00 0.00 O ATOM 1402 CB ASN A 798 6.676 -1.299 1.532 1.00 0.00 C ATOM 1403 CG ASN A 798 6.443 -1.378 0.031 1.00 0.00 C ATOM 1404 OD1 ASN A 798 7.012 -0.622 -0.751 1.00 0.00 O ATOM 1405 ND2 ASN A 798 5.605 -2.322 -0.380 1.00 0.00 N ATOM 0 H ASN A 798 4.857 0.389 1.856 1.00 0.00 H new ATOM 0 HA ASN A 798 7.425 -0.000 3.033 1.00 0.00 H new ATOM 0 HB2 ASN A 798 7.530 -1.926 1.787 1.00 0.00 H new ATOM 0 HB3 ASN A 798 5.809 -1.718 2.043 1.00 0.00 H new ATOM 0 HD21 ASN A 798 5.416 -2.438 -1.376 1.00 0.00 H new ATOM 0 HD22 ASN A 798 5.151 -2.932 0.300 1.00 0.00 H new ATOM 1412 N CYS A 799 7.183 1.749 0.315 1.00 0.00 N ATOM 1413 CA CYS A 799 7.888 2.589 -0.616 1.00 0.00 C ATOM 1414 C CYS A 799 8.400 3.823 0.108 1.00 0.00 C ATOM 1415 O CYS A 799 9.384 4.445 -0.275 1.00 0.00 O ATOM 1416 CB CYS A 799 6.984 2.899 -1.787 1.00 0.00 C ATOM 1417 SG CYS A 799 6.513 1.395 -2.664 1.00 0.00 S ATOM 0 H CYS A 799 6.168 1.840 0.277 1.00 0.00 H new ATOM 0 HA CYS A 799 8.764 2.084 -1.023 1.00 0.00 H new ATOM 0 HB2 CYS A 799 6.090 3.412 -1.433 1.00 0.00 H new ATOM 0 HB3 CYS A 799 7.492 3.578 -2.472 1.00 0.00 H new ATOM 0 HG CYS A 799 6.104 0.505 -1.810 1.00 0.00 H new ATOM 1423 N LYS A 800 7.679 4.159 1.156 1.00 0.00 N ATOM 1424 CA LYS A 800 8.002 5.257 2.046 1.00 0.00 C ATOM 1425 C LYS A 800 8.973 4.782 3.129 1.00 0.00 C ATOM 1426 O LYS A 800 9.672 5.565 3.766 1.00 0.00 O ATOM 1427 CB LYS A 800 6.718 5.695 2.697 1.00 0.00 C ATOM 1428 CG LYS A 800 5.870 6.612 1.863 1.00 0.00 C ATOM 1429 CD LYS A 800 4.425 6.519 2.302 1.00 0.00 C ATOM 1430 CE LYS A 800 3.539 7.346 1.408 1.00 0.00 C ATOM 1431 NZ LYS A 800 2.539 8.128 2.184 1.00 0.00 N ATOM 0 H LYS A 800 6.828 3.663 1.421 1.00 0.00 H new ATOM 0 HA LYS A 800 8.466 6.073 1.493 1.00 0.00 H new ATOM 0 HB2 LYS A 800 6.133 4.810 2.947 1.00 0.00 H new ATOM 0 HB3 LYS A 800 6.955 6.196 3.636 1.00 0.00 H new ATOM 0 HG2 LYS A 800 6.224 7.638 1.962 1.00 0.00 H new ATOM 0 HG3 LYS A 800 5.957 6.345 0.810 1.00 0.00 H new ATOM 0 HD2 LYS A 800 4.100 5.479 2.281 1.00 0.00 H new ATOM 0 HD3 LYS A 800 4.331 6.862 3.332 1.00 0.00 H new ATOM 0 HE2 LYS A 800 4.153 8.027 0.818 1.00 0.00 H new ATOM 0 HE3 LYS A 800 3.022 6.693 0.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 800 1.845 8.548 1.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 800 2.050 7.499 2.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 800 3.022 8.884 2.710 1.00 0.00 H new ATOM 1445 N GLU A 801 8.969 3.470 3.332 1.00 0.00 N ATOM 1446 CA GLU A 801 9.771 2.821 4.369 1.00 0.00 C ATOM 1447 C GLU A 801 11.244 2.723 4.037 1.00 0.00 C ATOM 1448 O GLU A 801 12.100 3.289 4.714 1.00 0.00 O ATOM 1449 CB GLU A 801 9.275 1.386 4.524 1.00 0.00 C ATOM 1450 CG GLU A 801 8.673 1.065 5.884 1.00 0.00 C ATOM 1451 CD GLU A 801 7.793 2.181 6.417 1.00 0.00 C ATOM 1452 OE1 GLU A 801 6.585 2.187 6.100 1.00 0.00 O ATOM 1453 OE2 GLU A 801 8.311 3.048 7.152 1.00 0.00 O ATOM 0 H GLU A 801 8.408 2.821 2.781 1.00 0.00 H new ATOM 0 HA GLU A 801 9.662 3.430 5.266 1.00 0.00 H new ATOM 0 HB2 GLU A 801 8.528 1.189 3.755 1.00 0.00 H new ATOM 0 HB3 GLU A 801 10.107 0.706 4.341 1.00 0.00 H new ATOM 0 HG2 GLU A 801 8.086 0.150 5.809 1.00 0.00 H new ATOM 0 HG3 GLU A 801 9.476 0.871 6.595 1.00 0.00 H new ATOM 1460 N TYR A 802 11.508 1.999 2.975 1.00 0.00 N ATOM 1461 CA TYR A 802 12.855 1.722 2.532 1.00 0.00 C ATOM 1462 C TYR A 802 13.388 2.808 1.638 1.00 0.00 C ATOM 1463 O TYR A 802 14.415 3.422 1.929 1.00 0.00 O ATOM 1464 CB TYR A 802 12.795 0.376 1.829 1.00 0.00 C ATOM 1465 CG TYR A 802 13.811 0.075 0.778 1.00 0.00 C ATOM 1466 CD1 TYR A 802 15.062 0.678 0.705 1.00 0.00 C ATOM 1467 CD2 TYR A 802 13.479 -0.864 -0.155 1.00 0.00 C ATOM 1468 CE1 TYR A 802 15.944 0.335 -0.298 1.00 0.00 C ATOM 1469 CE2 TYR A 802 14.337 -1.211 -1.143 1.00 0.00 C ATOM 1470 CZ TYR A 802 15.575 -0.613 -1.224 1.00 0.00 C ATOM 1471 OH TYR A 802 16.441 -0.963 -2.227 1.00 0.00 O ATOM 0 H TYR A 802 10.786 1.581 2.388 1.00 0.00 H new ATOM 0 HA TYR A 802 13.547 1.691 3.373 1.00 0.00 H new ATOM 0 HB2 TYR A 802 12.867 -0.400 2.591 1.00 0.00 H new ATOM 0 HB3 TYR A 802 11.809 0.284 1.373 1.00 0.00 H new ATOM 0 HD1 TYR A 802 15.344 1.419 1.438 1.00 0.00 H new ATOM 0 HD2 TYR A 802 12.511 -1.340 -0.104 1.00 0.00 H new ATOM 0 HE1 TYR A 802 16.914 0.806 -0.356 1.00 0.00 H new ATOM 0 HE2 TYR A 802 14.050 -1.958 -1.869 1.00 0.00 H new ATOM 0 HH TYR A 802 17.364 -0.858 -1.914 1.00 0.00 H new ATOM 1481 N ASN A 803 12.691 3.040 0.557 1.00 0.00 N ATOM 1482 CA ASN A 803 13.106 4.063 -0.382 1.00 0.00 C ATOM 1483 C ASN A 803 13.206 5.390 0.343 1.00 0.00 C ATOM 1484 O ASN A 803 12.504 5.601 1.324 1.00 0.00 O ATOM 1485 CB ASN A 803 12.112 4.166 -1.539 1.00 0.00 C ATOM 1486 CG ASN A 803 12.152 2.951 -2.446 1.00 0.00 C ATOM 1487 OD1 ASN A 803 13.208 2.357 -2.660 1.00 0.00 O ATOM 1488 ND2 ASN A 803 10.995 2.571 -2.975 1.00 0.00 N ATOM 0 H ASN A 803 11.839 2.542 0.301 1.00 0.00 H new ATOM 0 HA ASN A 803 14.079 3.798 -0.795 1.00 0.00 H new ATOM 0 HB2 ASN A 803 11.105 4.285 -1.140 1.00 0.00 H new ATOM 0 HB3 ASN A 803 12.330 5.060 -2.124 1.00 0.00 H new ATOM 0 HD21 ASN A 803 10.957 1.756 -3.587 1.00 0.00 H new ATOM 0 HD22 ASN A 803 10.144 3.094 -2.769 1.00 0.00 H new ATOM 1495 N PRO A 804 14.158 6.247 -0.054 1.00 0.00 N ATOM 1496 CA PRO A 804 14.309 7.582 0.527 1.00 0.00 C ATOM 1497 C PRO A 804 13.378 8.585 -0.152 1.00 0.00 C ATOM 1498 O PRO A 804 13.085 8.452 -1.339 1.00 0.00 O ATOM 1499 CB PRO A 804 15.759 7.915 0.224 1.00 0.00 C ATOM 1500 CG PRO A 804 16.019 7.228 -1.072 1.00 0.00 C ATOM 1501 CD PRO A 804 15.214 5.956 -1.042 1.00 0.00 C ATOM 0 HA PRO A 804 14.062 7.619 1.588 1.00 0.00 H new ATOM 0 HB2 PRO A 804 15.914 8.991 0.144 1.00 0.00 H new ATOM 0 HB3 PRO A 804 16.424 7.554 1.008 1.00 0.00 H new ATOM 0 HG2 PRO A 804 15.723 7.856 -1.912 1.00 0.00 H new ATOM 0 HG3 PRO A 804 17.081 7.014 -1.193 1.00 0.00 H new ATOM 0 HD2 PRO A 804 14.796 5.721 -2.021 1.00 0.00 H new ATOM 0 HD3 PRO A 804 15.822 5.102 -0.742 1.00 0.00 H new ATOM 1509 N PRO A 805 12.911 9.614 0.583 1.00 0.00 N ATOM 1510 CA PRO A 805 11.985 10.617 0.044 1.00 0.00 C ATOM 1511 C PRO A 805 12.635 11.464 -1.045 1.00 0.00 C ATOM 1512 O PRO A 805 12.049 12.434 -1.528 1.00 0.00 O ATOM 1513 CB PRO A 805 11.616 11.482 1.255 1.00 0.00 C ATOM 1514 CG PRO A 805 12.131 10.750 2.451 1.00 0.00 C ATOM 1515 CD PRO A 805 13.273 9.902 1.972 1.00 0.00 C ATOM 0 HA PRO A 805 11.118 10.154 -0.427 1.00 0.00 H new ATOM 0 HB2 PRO A 805 12.065 12.472 1.179 1.00 0.00 H new ATOM 0 HB3 PRO A 805 10.537 11.625 1.319 1.00 0.00 H new ATOM 0 HG2 PRO A 805 12.462 11.448 3.220 1.00 0.00 H new ATOM 0 HG3 PRO A 805 11.349 10.133 2.895 1.00 0.00 H new ATOM 0 HD2 PRO A 805 14.224 10.430 2.040 1.00 0.00 H new ATOM 0 HD3 PRO A 805 13.373 8.990 2.560 1.00 0.00 H new ATOM 1523 N GLU A 806 13.856 11.089 -1.420 1.00 0.00 N ATOM 1524 CA GLU A 806 14.603 11.800 -2.449 1.00 0.00 C ATOM 1525 C GLU A 806 14.868 10.895 -3.647 1.00 0.00 C ATOM 1526 O GLU A 806 15.210 11.370 -4.730 1.00 0.00 O ATOM 1527 CB GLU A 806 15.932 12.290 -1.882 1.00 0.00 C ATOM 1528 CG GLU A 806 15.784 13.170 -0.652 1.00 0.00 C ATOM 1529 CD GLU A 806 17.116 13.692 -0.148 1.00 0.00 C ATOM 1530 OE1 GLU A 806 17.746 13.007 0.686 1.00 0.00 O ATOM 1531 OE2 GLU A 806 17.530 14.786 -0.587 1.00 0.00 O ATOM 0 H GLU A 806 14.350 10.290 -1.022 1.00 0.00 H new ATOM 0 HA GLU A 806 14.007 12.652 -2.776 1.00 0.00 H new ATOM 0 HB2 GLU A 806 16.549 11.428 -1.629 1.00 0.00 H new ATOM 0 HB3 GLU A 806 16.463 12.846 -2.654 1.00 0.00 H new ATOM 0 HG2 GLU A 806 15.133 14.012 -0.888 1.00 0.00 H new ATOM 0 HG3 GLU A 806 15.296 12.602 0.141 1.00 0.00 H new ATOM 1538 N SER A 807 14.710 9.590 -3.441 1.00 0.00 N ATOM 1539 CA SER A 807 14.937 8.614 -4.505 1.00 0.00 C ATOM 1540 C SER A 807 14.122 8.955 -5.736 1.00 0.00 C ATOM 1541 O SER A 807 14.618 9.580 -6.675 1.00 0.00 O ATOM 1542 CB SER A 807 14.570 7.207 -4.040 1.00 0.00 C ATOM 1543 OG SER A 807 15.724 6.395 -3.919 1.00 0.00 O ATOM 0 H SER A 807 14.426 9.184 -2.549 1.00 0.00 H new ATOM 0 HA SER A 807 15.997 8.647 -4.755 1.00 0.00 H new ATOM 0 HB2 SER A 807 14.056 7.260 -3.080 1.00 0.00 H new ATOM 0 HB3 SER A 807 13.876 6.755 -4.749 1.00 0.00 H new ATOM 0 HG SER A 807 16.501 6.958 -3.719 1.00 0.00 H new ATOM 1549 N GLU A 808 12.862 8.544 -5.707 1.00 0.00 N ATOM 1550 CA GLU A 808 11.949 8.772 -6.810 1.00 0.00 C ATOM 1551 C GLU A 808 10.623 8.073 -6.536 1.00 0.00 C ATOM 1552 O GLU A 808 9.553 8.652 -6.721 1.00 0.00 O ATOM 1553 CB GLU A 808 12.566 8.250 -8.111 1.00 0.00 C ATOM 1554 CG GLU A 808 11.550 7.857 -9.164 1.00 0.00 C ATOM 1555 CD GLU A 808 10.686 9.020 -9.610 1.00 0.00 C ATOM 1556 OE1 GLU A 808 11.220 9.941 -10.261 1.00 0.00 O ATOM 1557 OE2 GLU A 808 9.474 9.007 -9.312 1.00 0.00 O ATOM 0 H GLU A 808 12.448 8.045 -4.919 1.00 0.00 H new ATOM 0 HA GLU A 808 11.767 9.842 -6.912 1.00 0.00 H new ATOM 0 HB2 GLU A 808 13.222 9.017 -8.523 1.00 0.00 H new ATOM 0 HB3 GLU A 808 13.190 7.386 -7.883 1.00 0.00 H new ATOM 0 HG2 GLU A 808 12.070 7.445 -10.028 1.00 0.00 H new ATOM 0 HG3 GLU A 808 10.912 7.067 -8.769 1.00 0.00 H new ATOM 1564 N TYR A 809 10.707 6.824 -6.089 1.00 0.00 N ATOM 1565 CA TYR A 809 9.509 6.043 -5.798 1.00 0.00 C ATOM 1566 C TYR A 809 8.850 6.484 -4.500 1.00 0.00 C ATOM 1567 O TYR A 809 7.625 6.508 -4.398 1.00 0.00 O ATOM 1568 CB TYR A 809 9.833 4.571 -5.705 1.00 0.00 C ATOM 1569 CG TYR A 809 11.010 4.161 -6.536 1.00 0.00 C ATOM 1570 CD1 TYR A 809 11.219 4.628 -7.823 1.00 0.00 C ATOM 1571 CD2 TYR A 809 11.929 3.329 -5.993 1.00 0.00 C ATOM 1572 CE1 TYR A 809 12.336 4.242 -8.534 1.00 0.00 C ATOM 1573 CE2 TYR A 809 13.041 2.938 -6.670 1.00 0.00 C ATOM 1574 CZ TYR A 809 13.246 3.394 -7.956 1.00 0.00 C ATOM 1575 OH TYR A 809 14.358 3.011 -8.665 1.00 0.00 O ATOM 0 H TYR A 809 11.585 6.333 -5.921 1.00 0.00 H new ATOM 0 HA TYR A 809 8.816 6.215 -6.621 1.00 0.00 H new ATOM 0 HB2 TYR A 809 10.028 4.316 -4.663 1.00 0.00 H new ATOM 0 HB3 TYR A 809 8.961 3.996 -6.016 1.00 0.00 H new ATOM 0 HD1 TYR A 809 10.502 5.299 -8.273 1.00 0.00 H new ATOM 0 HD2 TYR A 809 11.774 2.964 -4.989 1.00 0.00 H new ATOM 0 HE1 TYR A 809 12.493 4.605 -9.539 1.00 0.00 H new ATOM 0 HE2 TYR A 809 13.757 2.277 -6.206 1.00 0.00 H new ATOM 0 HH TYR A 809 14.123 2.277 -9.271 1.00 0.00 H new ATOM 1585 N TYR A 810 9.671 6.808 -3.500 1.00 0.00 N ATOM 1586 CA TYR A 810 9.158 7.240 -2.205 1.00 0.00 C ATOM 1587 C TYR A 810 8.055 8.268 -2.395 1.00 0.00 C ATOM 1588 O TYR A 810 6.926 8.077 -1.948 1.00 0.00 O ATOM 1589 CB TYR A 810 10.283 7.837 -1.359 1.00 0.00 C ATOM 1590 CG TYR A 810 9.926 8.032 0.099 1.00 0.00 C ATOM 1591 CD1 TYR A 810 8.728 8.595 0.472 1.00 0.00 C ATOM 1592 CD2 TYR A 810 10.800 7.657 1.097 1.00 0.00 C ATOM 1593 CE1 TYR A 810 8.412 8.777 1.797 1.00 0.00 C ATOM 1594 CE2 TYR A 810 10.496 7.833 2.428 1.00 0.00 C ATOM 1595 CZ TYR A 810 9.296 8.395 2.774 1.00 0.00 C ATOM 1596 OH TYR A 810 8.978 8.578 4.100 1.00 0.00 O ATOM 0 H TYR A 810 10.689 6.779 -3.564 1.00 0.00 H new ATOM 0 HA TYR A 810 8.750 6.372 -1.687 1.00 0.00 H new ATOM 0 HB2 TYR A 810 11.156 7.187 -1.424 1.00 0.00 H new ATOM 0 HB3 TYR A 810 10.570 8.799 -1.783 1.00 0.00 H new ATOM 0 HD1 TYR A 810 8.024 8.899 -0.289 1.00 0.00 H new ATOM 0 HD2 TYR A 810 11.747 7.214 0.828 1.00 0.00 H new ATOM 0 HE1 TYR A 810 7.466 9.221 2.070 1.00 0.00 H new ATOM 0 HE2 TYR A 810 11.197 7.531 3.192 1.00 0.00 H new ATOM 0 HH TYR A 810 9.053 7.724 4.575 1.00 0.00 H new ATOM 1606 N LYS A 811 8.393 9.370 -3.033 1.00 0.00 N ATOM 1607 CA LYS A 811 7.411 10.406 -3.298 1.00 0.00 C ATOM 1608 C LYS A 811 6.228 9.773 -3.971 1.00 0.00 C ATOM 1609 O LYS A 811 5.109 9.854 -3.496 1.00 0.00 O ATOM 1610 CB LYS A 811 7.981 11.451 -4.240 1.00 0.00 C ATOM 1611 CG LYS A 811 9.487 11.563 -4.200 1.00 0.00 C ATOM 1612 CD LYS A 811 9.958 12.553 -5.233 1.00 0.00 C ATOM 1613 CE LYS A 811 9.691 13.965 -4.765 1.00 0.00 C ATOM 1614 NZ LYS A 811 10.789 14.483 -3.905 1.00 0.00 N ATOM 0 H LYS A 811 9.332 9.572 -3.376 1.00 0.00 H new ATOM 0 HA LYS A 811 7.131 10.880 -2.357 1.00 0.00 H new ATOM 0 HB2 LYS A 811 7.672 11.214 -5.258 1.00 0.00 H new ATOM 0 HB3 LYS A 811 7.549 12.421 -3.994 1.00 0.00 H new ATOM 0 HG2 LYS A 811 9.810 11.879 -3.208 1.00 0.00 H new ATOM 0 HG3 LYS A 811 9.937 10.588 -4.387 1.00 0.00 H new ATOM 0 HD2 LYS A 811 11.024 12.419 -5.416 1.00 0.00 H new ATOM 0 HD3 LYS A 811 9.447 12.373 -6.179 1.00 0.00 H new ATOM 0 HE2 LYS A 811 9.569 14.617 -5.630 1.00 0.00 H new ATOM 0 HE3 LYS A 811 8.753 13.992 -4.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 811 10.454 15.314 -3.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 811 11.084 13.744 -3.235 1.00 0.00 H new ATOM 0 HZ3 LYS A 811 11.598 14.753 -4.500 1.00 0.00 H new ATOM 1628 N CYS A 812 6.517 9.143 -5.095 1.00 0.00 N ATOM 1629 CA CYS A 812 5.519 8.443 -5.881 1.00 0.00 C ATOM 1630 C CYS A 812 4.596 7.626 -4.989 1.00 0.00 C ATOM 1631 O CYS A 812 3.449 7.378 -5.336 1.00 0.00 O ATOM 1632 CB CYS A 812 6.216 7.521 -6.874 1.00 0.00 C ATOM 1633 SG CYS A 812 6.791 8.343 -8.377 1.00 0.00 S ATOM 0 H CYS A 812 7.457 9.103 -5.490 1.00 0.00 H new ATOM 0 HA CYS A 812 4.917 9.180 -6.413 1.00 0.00 H new ATOM 0 HB2 CYS A 812 7.068 7.054 -6.381 1.00 0.00 H new ATOM 0 HB3 CYS A 812 5.530 6.721 -7.152 1.00 0.00 H new ATOM 0 HG CYS A 812 8.071 8.554 -8.294 1.00 0.00 H new ATOM 1639 N ALA A 813 5.103 7.211 -3.840 1.00 0.00 N ATOM 1640 CA ALA A 813 4.313 6.435 -2.902 1.00 0.00 C ATOM 1641 C ALA A 813 3.308 7.341 -2.227 1.00 0.00 C ATOM 1642 O ALA A 813 2.137 7.013 -2.119 1.00 0.00 O ATOM 1643 CB ALA A 813 5.212 5.753 -1.887 1.00 0.00 C ATOM 0 H ALA A 813 6.058 7.399 -3.535 1.00 0.00 H new ATOM 0 HA ALA A 813 3.774 5.653 -3.437 1.00 0.00 H new ATOM 0 HB1 ALA A 813 4.603 5.176 -1.191 1.00 0.00 H new ATOM 0 HB2 ALA A 813 5.904 5.087 -2.403 1.00 0.00 H new ATOM 0 HB3 ALA A 813 5.776 6.506 -1.337 1.00 0.00 H new ATOM 1649 N ASN A 814 3.793 8.489 -1.792 1.00 0.00 N ATOM 1650 CA ASN A 814 2.981 9.499 -1.154 1.00 0.00 C ATOM 1651 C ASN A 814 1.979 10.073 -2.156 1.00 0.00 C ATOM 1652 O ASN A 814 0.794 10.246 -1.863 1.00 0.00 O ATOM 1653 CB ASN A 814 3.910 10.598 -0.674 1.00 0.00 C ATOM 1654 CG ASN A 814 3.264 11.522 0.339 1.00 0.00 C ATOM 1655 OD1 ASN A 814 3.329 11.282 1.545 1.00 0.00 O ATOM 1656 ND2 ASN A 814 2.635 12.586 -0.145 1.00 0.00 N ATOM 0 H ASN A 814 4.777 8.746 -1.875 1.00 0.00 H new ATOM 0 HA ASN A 814 2.426 9.071 -0.319 1.00 0.00 H new ATOM 0 HB2 ASN A 814 4.798 10.147 -0.231 1.00 0.00 H new ATOM 0 HB3 ASN A 814 4.243 11.184 -1.531 1.00 0.00 H new ATOM 0 HD21 ASN A 814 2.181 13.243 0.490 1.00 0.00 H new ATOM 0 HD22 ASN A 814 2.605 12.747 -1.152 1.00 0.00 H new ATOM 1663 N ILE A 815 2.493 10.346 -3.350 1.00 0.00 N ATOM 1664 CA ILE A 815 1.721 10.897 -4.452 1.00 0.00 C ATOM 1665 C ILE A 815 0.604 9.953 -4.817 1.00 0.00 C ATOM 1666 O ILE A 815 -0.570 10.311 -4.793 1.00 0.00 O ATOM 1667 CB ILE A 815 2.622 11.128 -5.670 1.00 0.00 C ATOM 1668 CG1 ILE A 815 3.349 12.450 -5.523 1.00 0.00 C ATOM 1669 CG2 ILE A 815 1.827 11.088 -6.959 1.00 0.00 C ATOM 1670 CD1 ILE A 815 4.761 12.398 -6.008 1.00 0.00 C ATOM 0 H ILE A 815 3.474 10.187 -3.581 1.00 0.00 H new ATOM 0 HA ILE A 815 1.299 11.852 -4.140 1.00 0.00 H new ATOM 0 HB ILE A 815 3.355 10.323 -5.717 1.00 0.00 H new ATOM 0 HG12 ILE A 815 2.809 13.219 -6.076 1.00 0.00 H new ATOM 0 HG13 ILE A 815 3.342 12.747 -4.474 1.00 0.00 H new ATOM 0 HG21 ILE A 815 2.495 11.255 -7.804 1.00 0.00 H new ATOM 0 HG22 ILE A 815 1.349 10.114 -7.062 1.00 0.00 H new ATOM 0 HG23 ILE A 815 1.064 11.866 -6.940 1.00 0.00 H new ATOM 0 HD11 ILE A 815 5.227 13.374 -5.876 1.00 0.00 H new ATOM 0 HD12 ILE A 815 5.314 11.652 -5.438 1.00 0.00 H new ATOM 0 HD13 ILE A 815 4.773 12.130 -7.064 1.00 0.00 H new ATOM 1682 N LEU A 816 0.994 8.750 -5.187 1.00 0.00 N ATOM 1683 CA LEU A 816 0.046 7.716 -5.515 1.00 0.00 C ATOM 1684 C LEU A 816 -0.940 7.603 -4.380 1.00 0.00 C ATOM 1685 O LEU A 816 -2.139 7.728 -4.566 1.00 0.00 O ATOM 1686 CB LEU A 816 0.773 6.396 -5.692 1.00 0.00 C ATOM 1687 CG LEU A 816 0.120 5.410 -6.624 1.00 0.00 C ATOM 1688 CD1 LEU A 816 0.904 4.139 -6.623 1.00 0.00 C ATOM 1689 CD2 LEU A 816 -1.298 5.187 -6.216 1.00 0.00 C ATOM 0 H LEU A 816 1.971 8.467 -5.267 1.00 0.00 H new ATOM 0 HA LEU A 816 -0.473 7.960 -6.442 1.00 0.00 H new ATOM 0 HB2 LEU A 816 1.779 6.603 -6.058 1.00 0.00 H new ATOM 0 HB3 LEU A 816 0.880 5.927 -4.714 1.00 0.00 H new ATOM 0 HG LEU A 816 0.110 5.803 -7.640 1.00 0.00 H new ATOM 0 HD11 LEU A 816 0.435 3.422 -7.297 1.00 0.00 H new ATOM 0 HD12 LEU A 816 1.922 4.339 -6.958 1.00 0.00 H new ATOM 0 HD13 LEU A 816 0.928 3.727 -5.614 1.00 0.00 H new ATOM 0 HD21 LEU A 816 -1.764 4.473 -6.895 1.00 0.00 H new ATOM 0 HD22 LEU A 816 -1.327 4.794 -5.200 1.00 0.00 H new ATOM 0 HD23 LEU A 816 -1.841 6.132 -6.255 1.00 0.00 H new ATOM 1701 N GLU A 817 -0.401 7.395 -3.197 1.00 0.00 N ATOM 1702 CA GLU A 817 -1.200 7.271 -1.995 1.00 0.00 C ATOM 1703 C GLU A 817 -2.262 8.376 -1.928 1.00 0.00 C ATOM 1704 O GLU A 817 -3.316 8.213 -1.330 1.00 0.00 O ATOM 1705 CB GLU A 817 -0.289 7.356 -0.776 1.00 0.00 C ATOM 1706 CG GLU A 817 -0.973 6.918 0.506 1.00 0.00 C ATOM 1707 CD GLU A 817 -0.041 6.884 1.699 1.00 0.00 C ATOM 1708 OE1 GLU A 817 0.745 5.921 1.811 1.00 0.00 O ATOM 1709 OE2 GLU A 817 -0.102 7.819 2.524 1.00 0.00 O ATOM 0 H GLU A 817 0.603 7.307 -3.041 1.00 0.00 H new ATOM 0 HA GLU A 817 -1.711 6.308 -2.010 1.00 0.00 H new ATOM 0 HB2 GLU A 817 0.591 6.735 -0.943 1.00 0.00 H new ATOM 0 HB3 GLU A 817 0.062 8.382 -0.662 1.00 0.00 H new ATOM 0 HG2 GLU A 817 -1.800 7.596 0.719 1.00 0.00 H new ATOM 0 HG3 GLU A 817 -1.402 5.927 0.360 1.00 0.00 H new ATOM 1716 N LYS A 818 -1.956 9.511 -2.531 1.00 0.00 N ATOM 1717 CA LYS A 818 -2.850 10.638 -2.574 1.00 0.00 C ATOM 1718 C LYS A 818 -3.901 10.462 -3.681 1.00 0.00 C ATOM 1719 O LYS A 818 -5.104 10.545 -3.416 1.00 0.00 O ATOM 1720 CB LYS A 818 -1.960 11.826 -2.757 1.00 0.00 C ATOM 1721 CG LYS A 818 -2.393 12.753 -3.823 1.00 0.00 C ATOM 1722 CD LYS A 818 -1.204 13.494 -4.398 1.00 0.00 C ATOM 1723 CE LYS A 818 -1.214 13.450 -5.910 1.00 0.00 C ATOM 1724 NZ LYS A 818 -2.423 14.106 -6.481 1.00 0.00 N ATOM 0 H LYS A 818 -1.068 9.671 -3.008 1.00 0.00 H new ATOM 0 HA LYS A 818 -3.444 10.753 -1.667 1.00 0.00 H new ATOM 0 HB2 LYS A 818 -1.906 12.373 -1.816 1.00 0.00 H new ATOM 0 HB3 LYS A 818 -0.952 11.478 -2.982 1.00 0.00 H new ATOM 0 HG2 LYS A 818 -2.899 12.197 -4.613 1.00 0.00 H new ATOM 0 HG3 LYS A 818 -3.114 13.466 -3.422 1.00 0.00 H new ATOM 0 HD2 LYS A 818 -1.220 14.531 -4.061 1.00 0.00 H new ATOM 0 HD3 LYS A 818 -0.281 13.052 -4.024 1.00 0.00 H new ATOM 0 HE2 LYS A 818 -0.320 13.942 -6.293 1.00 0.00 H new ATOM 0 HE3 LYS A 818 -1.174 12.413 -6.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 818 -2.333 14.159 -7.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 818 -3.268 13.552 -6.235 1.00 0.00 H new ATOM 0 HZ3 LYS A 818 -2.513 15.066 -6.092 1.00 0.00 H new ATOM 1738 N PHE A 819 -3.453 10.219 -4.916 1.00 0.00 N ATOM 1739 CA PHE A 819 -4.377 9.978 -6.024 1.00 0.00 C ATOM 1740 C PHE A 819 -5.273 8.830 -5.616 1.00 0.00 C ATOM 1741 O PHE A 819 -6.499 8.929 -5.616 1.00 0.00 O ATOM 1742 CB PHE A 819 -3.589 9.626 -7.290 1.00 0.00 C ATOM 1743 CG PHE A 819 -4.357 8.872 -8.354 1.00 0.00 C ATOM 1744 CD1 PHE A 819 -4.722 7.540 -8.171 1.00 0.00 C ATOM 1745 CD2 PHE A 819 -4.686 9.484 -9.553 1.00 0.00 C ATOM 1746 CE1 PHE A 819 -5.389 6.844 -9.141 1.00 0.00 C ATOM 1747 CE2 PHE A 819 -5.365 8.788 -10.538 1.00 0.00 C ATOM 1748 CZ PHE A 819 -5.716 7.466 -10.332 1.00 0.00 C ATOM 0 H PHE A 819 -2.466 10.184 -5.171 1.00 0.00 H new ATOM 0 HA PHE A 819 -4.973 10.865 -6.240 1.00 0.00 H new ATOM 0 HB2 PHE A 819 -3.210 10.549 -7.728 1.00 0.00 H new ATOM 0 HB3 PHE A 819 -2.723 9.030 -7.002 1.00 0.00 H new ATOM 0 HD1 PHE A 819 -4.473 7.046 -7.243 1.00 0.00 H new ATOM 0 HD2 PHE A 819 -4.410 10.515 -9.721 1.00 0.00 H new ATOM 0 HE1 PHE A 819 -5.660 5.811 -8.977 1.00 0.00 H new ATOM 0 HE2 PHE A 819 -5.621 9.277 -11.467 1.00 0.00 H new ATOM 0 HZ PHE A 819 -6.244 6.921 -11.100 1.00 0.00 H new ATOM 1758 N PHE A 820 -4.612 7.725 -5.300 1.00 0.00 N ATOM 1759 CA PHE A 820 -5.262 6.534 -4.816 1.00 0.00 C ATOM 1760 C PHE A 820 -6.273 6.930 -3.769 1.00 0.00 C ATOM 1761 O PHE A 820 -7.412 6.513 -3.847 1.00 0.00 O ATOM 1762 CB PHE A 820 -4.193 5.571 -4.306 1.00 0.00 C ATOM 1763 CG PHE A 820 -4.454 4.893 -3.011 1.00 0.00 C ATOM 1764 CD1 PHE A 820 -4.052 5.410 -1.805 1.00 0.00 C ATOM 1765 CD2 PHE A 820 -5.035 3.687 -3.034 1.00 0.00 C ATOM 1766 CE1 PHE A 820 -4.264 4.701 -0.637 1.00 0.00 C ATOM 1767 CE2 PHE A 820 -5.240 2.969 -1.906 1.00 0.00 C ATOM 1768 CZ PHE A 820 -4.863 3.464 -0.696 1.00 0.00 C ATOM 0 H PHE A 820 -3.599 7.638 -5.376 1.00 0.00 H new ATOM 0 HA PHE A 820 -5.809 6.013 -5.602 1.00 0.00 H new ATOM 0 HB2 PHE A 820 -4.040 4.803 -5.065 1.00 0.00 H new ATOM 0 HB3 PHE A 820 -3.257 6.122 -4.216 1.00 0.00 H new ATOM 0 HD1 PHE A 820 -3.568 6.375 -1.768 1.00 0.00 H new ATOM 0 HD2 PHE A 820 -5.349 3.275 -3.982 1.00 0.00 H new ATOM 0 HE1 PHE A 820 -3.962 5.115 0.314 1.00 0.00 H new ATOM 0 HE2 PHE A 820 -5.706 1.997 -1.966 1.00 0.00 H new ATOM 0 HZ PHE A 820 -5.032 2.894 0.206 1.00 0.00 H new ATOM 1778 N PHE A 821 -5.877 7.813 -2.846 1.00 0.00 N ATOM 1779 CA PHE A 821 -6.791 8.262 -1.802 1.00 0.00 C ATOM 1780 C PHE A 821 -8.067 8.857 -2.362 1.00 0.00 C ATOM 1781 O PHE A 821 -9.121 8.716 -1.759 1.00 0.00 O ATOM 1782 CB PHE A 821 -6.116 9.213 -0.831 1.00 0.00 C ATOM 1783 CG PHE A 821 -5.959 8.568 0.503 1.00 0.00 C ATOM 1784 CD1 PHE A 821 -5.244 7.411 0.570 1.00 0.00 C ATOM 1785 CD2 PHE A 821 -6.566 9.056 1.647 1.00 0.00 C ATOM 1786 CE1 PHE A 821 -5.107 6.714 1.747 1.00 0.00 C ATOM 1787 CE2 PHE A 821 -6.430 8.379 2.849 1.00 0.00 C ATOM 1788 CZ PHE A 821 -5.699 7.200 2.898 1.00 0.00 C ATOM 0 H PHE A 821 -4.944 8.223 -2.804 1.00 0.00 H new ATOM 0 HA PHE A 821 -7.078 7.371 -1.244 1.00 0.00 H new ATOM 0 HB2 PHE A 821 -5.140 9.505 -1.218 1.00 0.00 H new ATOM 0 HB3 PHE A 821 -6.707 10.124 -0.734 1.00 0.00 H new ATOM 0 HD1 PHE A 821 -4.773 7.031 -0.324 1.00 0.00 H new ATOM 0 HD2 PHE A 821 -7.147 9.966 1.603 1.00 0.00 H new ATOM 0 HE1 PHE A 821 -4.542 5.794 1.772 1.00 0.00 H new ATOM 0 HE2 PHE A 821 -6.891 8.768 3.745 1.00 0.00 H new ATOM 0 HZ PHE A 821 -5.593 6.665 3.830 1.00 0.00 H new ATOM 1798 N SER A 822 -7.985 9.519 -3.501 1.00 0.00 N ATOM 1799 CA SER A 822 -9.179 10.089 -4.109 1.00 0.00 C ATOM 1800 C SER A 822 -9.993 8.995 -4.791 1.00 0.00 C ATOM 1801 O SER A 822 -11.199 9.128 -4.979 1.00 0.00 O ATOM 1802 CB SER A 822 -8.807 11.180 -5.113 1.00 0.00 C ATOM 1803 OG SER A 822 -9.962 11.720 -5.733 1.00 0.00 O ATOM 0 H SER A 822 -7.120 9.675 -4.019 1.00 0.00 H new ATOM 0 HA SER A 822 -9.785 10.541 -3.324 1.00 0.00 H new ATOM 0 HB2 SER A 822 -8.259 11.974 -4.605 1.00 0.00 H new ATOM 0 HB3 SER A 822 -8.142 10.768 -5.872 1.00 0.00 H new ATOM 0 HG SER A 822 -9.696 12.416 -6.369 1.00 0.00 H new ATOM 1809 N LYS A 823 -9.311 7.912 -5.154 1.00 0.00 N ATOM 1810 CA LYS A 823 -9.941 6.762 -5.801 1.00 0.00 C ATOM 1811 C LYS A 823 -10.726 5.964 -4.786 1.00 0.00 C ATOM 1812 O LYS A 823 -11.932 5.783 -4.917 1.00 0.00 O ATOM 1813 CB LYS A 823 -8.850 5.902 -6.433 1.00 0.00 C ATOM 1814 CG LYS A 823 -8.798 5.919 -7.952 1.00 0.00 C ATOM 1815 CD LYS A 823 -9.598 7.059 -8.539 1.00 0.00 C ATOM 1816 CE LYS A 823 -8.967 7.605 -9.794 1.00 0.00 C ATOM 1817 NZ LYS A 823 -9.917 8.435 -10.584 1.00 0.00 N ATOM 0 H LYS A 823 -8.307 7.806 -5.009 1.00 0.00 H new ATOM 0 HA LYS A 823 -10.632 7.099 -6.574 1.00 0.00 H new ATOM 0 HB2 LYS A 823 -7.884 6.233 -6.051 1.00 0.00 H new ATOM 0 HB3 LYS A 823 -8.988 4.872 -6.103 1.00 0.00 H new ATOM 0 HG2 LYS A 823 -7.761 6.000 -8.277 1.00 0.00 H new ATOM 0 HG3 LYS A 823 -9.180 4.974 -8.337 1.00 0.00 H new ATOM 0 HD2 LYS A 823 -10.608 6.716 -8.761 1.00 0.00 H new ATOM 0 HD3 LYS A 823 -9.687 7.857 -7.802 1.00 0.00 H new ATOM 0 HE2 LYS A 823 -8.096 8.205 -9.530 1.00 0.00 H new ATOM 0 HE3 LYS A 823 -8.611 6.779 -10.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 823 -9.441 8.790 -11.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 823 -10.737 7.857 -10.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 823 -10.238 9.239 -10.008 1.00 0.00 H new ATOM 1831 N ILE A 824 -10.028 5.479 -3.784 1.00 0.00 N ATOM 1832 CA ILE A 824 -10.661 4.750 -2.707 1.00 0.00 C ATOM 1833 C ILE A 824 -11.814 5.576 -2.161 1.00 0.00 C ATOM 1834 O ILE A 824 -12.930 5.101 -1.991 1.00 0.00 O ATOM 1835 CB ILE A 824 -9.676 4.508 -1.582 1.00 0.00 C ATOM 1836 CG1 ILE A 824 -8.642 5.576 -1.610 1.00 0.00 C ATOM 1837 CG2 ILE A 824 -9.038 3.154 -1.708 1.00 0.00 C ATOM 1838 CD1 ILE A 824 -7.443 5.287 -0.787 1.00 0.00 C ATOM 0 H ILE A 824 -9.017 5.577 -3.692 1.00 0.00 H new ATOM 0 HA ILE A 824 -11.016 3.794 -3.092 1.00 0.00 H new ATOM 0 HB ILE A 824 -10.205 4.534 -0.630 1.00 0.00 H new ATOM 0 HG12 ILE A 824 -8.330 5.736 -2.642 1.00 0.00 H new ATOM 0 HG13 ILE A 824 -9.090 6.508 -1.264 1.00 0.00 H new ATOM 0 HG21 ILE A 824 -8.335 3.005 -0.888 1.00 0.00 H new ATOM 0 HG22 ILE A 824 -9.808 2.384 -1.670 1.00 0.00 H new ATOM 0 HG23 ILE A 824 -8.507 3.089 -2.658 1.00 0.00 H new ATOM 0 HD11 ILE A 824 -6.740 6.117 -0.864 1.00 0.00 H new ATOM 0 HD12 ILE A 824 -7.739 5.158 0.254 1.00 0.00 H new ATOM 0 HD13 ILE A 824 -6.967 4.374 -1.145 1.00 0.00 H new ATOM 1850 N LYS A 825 -11.505 6.845 -1.932 1.00 0.00 N ATOM 1851 CA LYS A 825 -12.458 7.816 -1.410 1.00 0.00 C ATOM 1852 C LYS A 825 -13.723 7.777 -2.235 1.00 0.00 C ATOM 1853 O LYS A 825 -14.836 7.637 -1.727 1.00 0.00 O ATOM 1854 CB LYS A 825 -11.884 9.235 -1.509 1.00 0.00 C ATOM 1855 CG LYS A 825 -11.435 9.840 -0.189 1.00 0.00 C ATOM 1856 CD LYS A 825 -12.532 10.657 0.451 1.00 0.00 C ATOM 1857 CE LYS A 825 -13.531 9.762 1.149 1.00 0.00 C ATOM 1858 NZ LYS A 825 -14.906 10.334 1.123 1.00 0.00 N ATOM 0 H LYS A 825 -10.578 7.233 -2.105 1.00 0.00 H new ATOM 0 HA LYS A 825 -12.663 7.566 -0.369 1.00 0.00 H new ATOM 0 HB2 LYS A 825 -11.035 9.220 -2.192 1.00 0.00 H new ATOM 0 HB3 LYS A 825 -12.638 9.886 -1.952 1.00 0.00 H new ATOM 0 HG2 LYS A 825 -11.129 9.045 0.491 1.00 0.00 H new ATOM 0 HG3 LYS A 825 -10.561 10.470 -0.356 1.00 0.00 H new ATOM 0 HD2 LYS A 825 -12.100 11.356 1.168 1.00 0.00 H new ATOM 0 HD3 LYS A 825 -13.039 11.252 -0.309 1.00 0.00 H new ATOM 0 HE2 LYS A 825 -13.537 8.783 0.671 1.00 0.00 H new ATOM 0 HE3 LYS A 825 -13.221 9.610 2.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 825 -15.603 9.562 1.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 825 -15.050 10.930 1.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 825 -15.026 10.910 0.265 1.00 0.00 H new ATOM 1872 N GLU A 826 -13.504 7.909 -3.530 1.00 0.00 N ATOM 1873 CA GLU A 826 -14.563 7.920 -4.515 1.00 0.00 C ATOM 1874 C GLU A 826 -15.339 6.618 -4.496 1.00 0.00 C ATOM 1875 O GLU A 826 -16.550 6.597 -4.717 1.00 0.00 O ATOM 1876 CB GLU A 826 -13.947 8.127 -5.903 1.00 0.00 C ATOM 1877 CG GLU A 826 -13.928 6.864 -6.741 1.00 0.00 C ATOM 1878 CD GLU A 826 -13.063 6.989 -7.981 1.00 0.00 C ATOM 1879 OE1 GLU A 826 -12.831 8.130 -8.431 1.00 0.00 O ATOM 1880 OE2 GLU A 826 -12.618 5.944 -8.501 1.00 0.00 O ATOM 0 H GLU A 826 -12.572 8.013 -3.930 1.00 0.00 H new ATOM 0 HA GLU A 826 -15.253 8.731 -4.280 1.00 0.00 H new ATOM 0 HB2 GLU A 826 -14.508 8.898 -6.431 1.00 0.00 H new ATOM 0 HB3 GLU A 826 -12.928 8.496 -5.790 1.00 0.00 H new ATOM 0 HG2 GLU A 826 -13.564 6.036 -6.133 1.00 0.00 H new ATOM 0 HG3 GLU A 826 -14.947 6.617 -7.039 1.00 0.00 H new ATOM 1887 N ALA A 827 -14.629 5.537 -4.230 1.00 0.00 N ATOM 1888 CA ALA A 827 -15.231 4.225 -4.236 1.00 0.00 C ATOM 1889 C ALA A 827 -15.731 3.779 -2.867 1.00 0.00 C ATOM 1890 O ALA A 827 -15.951 2.597 -2.659 1.00 0.00 O ATOM 1891 CB ALA A 827 -14.239 3.227 -4.792 1.00 0.00 C ATOM 0 H ALA A 827 -13.634 5.546 -4.007 1.00 0.00 H new ATOM 0 HA ALA A 827 -16.115 4.276 -4.871 1.00 0.00 H new ATOM 0 HB1 ALA A 827 -14.688 2.234 -4.799 1.00 0.00 H new ATOM 0 HB2 ALA A 827 -13.969 3.511 -5.809 1.00 0.00 H new ATOM 0 HB3 ALA A 827 -13.345 3.217 -4.169 1.00 0.00 H new ATOM 1897 N GLY A 828 -15.922 4.713 -1.942 1.00 0.00 N ATOM 1898 CA GLY A 828 -16.414 4.343 -0.621 1.00 0.00 C ATOM 1899 C GLY A 828 -15.427 3.497 0.156 1.00 0.00 C ATOM 1900 O GLY A 828 -15.773 2.892 1.169 1.00 0.00 O ATOM 0 H GLY A 828 -15.748 5.709 -2.077 1.00 0.00 H new ATOM 0 HA2 GLY A 828 -16.636 5.247 -0.054 1.00 0.00 H new ATOM 0 HA3 GLY A 828 -17.351 3.796 -0.727 1.00 0.00 H new ATOM 1904 N LEU A 829 -14.188 3.491 -0.298 1.00 0.00 N ATOM 1905 CA LEU A 829 -13.146 2.680 0.306 1.00 0.00 C ATOM 1906 C LEU A 829 -12.741 3.197 1.676 1.00 0.00 C ATOM 1907 O LEU A 829 -13.360 2.845 2.678 1.00 0.00 O ATOM 1908 CB LEU A 829 -11.980 2.630 -0.668 1.00 0.00 C ATOM 1909 CG LEU A 829 -12.368 2.067 -2.043 1.00 0.00 C ATOM 1910 CD1 LEU A 829 -11.241 1.344 -2.705 1.00 0.00 C ATOM 1911 CD2 LEU A 829 -13.554 1.128 -1.950 1.00 0.00 C ATOM 0 H LEU A 829 -13.875 4.047 -1.094 1.00 0.00 H new ATOM 0 HA LEU A 829 -13.514 1.670 0.487 1.00 0.00 H new ATOM 0 HB2 LEU A 829 -11.576 3.635 -0.794 1.00 0.00 H new ATOM 0 HB3 LEU A 829 -11.185 2.018 -0.243 1.00 0.00 H new ATOM 0 HG LEU A 829 -12.632 2.935 -2.648 1.00 0.00 H new ATOM 0 HD11 LEU A 829 -11.570 0.967 -3.673 1.00 0.00 H new ATOM 0 HD12 LEU A 829 -10.404 2.027 -2.847 1.00 0.00 H new ATOM 0 HD13 LEU A 829 -10.926 0.510 -2.078 1.00 0.00 H new ATOM 0 HD21 LEU A 829 -13.798 0.751 -2.943 1.00 0.00 H new ATOM 0 HD22 LEU A 829 -13.306 0.293 -1.295 1.00 0.00 H new ATOM 0 HD23 LEU A 829 -14.412 1.665 -1.545 1.00 0.00 H new ATOM 1923 N ILE A 830 -11.694 4.010 1.709 1.00 0.00 N ATOM 1924 CA ILE A 830 -11.195 4.611 2.934 1.00 0.00 C ATOM 1925 C ILE A 830 -12.229 4.655 4.047 1.00 0.00 C ATOM 1926 O ILE A 830 -13.319 5.204 3.882 1.00 0.00 O ATOM 1927 CB ILE A 830 -10.723 6.025 2.645 1.00 0.00 C ATOM 1928 CG1 ILE A 830 -10.640 6.198 1.147 1.00 0.00 C ATOM 1929 CG2 ILE A 830 -9.361 6.259 3.250 1.00 0.00 C ATOM 1930 CD1 ILE A 830 -9.751 7.313 0.725 1.00 0.00 C ATOM 0 H ILE A 830 -11.164 4.272 0.878 1.00 0.00 H new ATOM 0 HA ILE A 830 -10.375 3.982 3.280 1.00 0.00 H new ATOM 0 HB ILE A 830 -11.422 6.740 3.078 1.00 0.00 H new ATOM 0 HG12 ILE A 830 -10.281 5.270 0.702 1.00 0.00 H new ATOM 0 HG13 ILE A 830 -11.641 6.374 0.754 1.00 0.00 H new ATOM 0 HG21 ILE A 830 -9.037 7.277 3.034 1.00 0.00 H new ATOM 0 HG22 ILE A 830 -9.413 6.116 4.329 1.00 0.00 H new ATOM 0 HG23 ILE A 830 -8.648 5.553 2.824 1.00 0.00 H new ATOM 0 HD11 ILE A 830 -9.740 7.378 -0.363 1.00 0.00 H new ATOM 0 HD12 ILE A 830 -10.121 8.250 1.141 1.00 0.00 H new ATOM 0 HD13 ILE A 830 -8.740 7.129 1.088 1.00 0.00 H new ATOM 1942 N ASP A 831 -11.870 4.075 5.182 1.00 0.00 N ATOM 1943 CA ASP A 831 -12.758 4.041 6.336 1.00 0.00 C ATOM 1944 C ASP A 831 -11.968 3.927 7.636 1.00 0.00 C ATOM 1945 O ASP A 831 -12.354 4.497 8.658 1.00 0.00 O ATOM 1946 CB ASP A 831 -13.740 2.872 6.228 1.00 0.00 C ATOM 1947 CG ASP A 831 -14.879 3.153 5.269 1.00 0.00 C ATOM 1948 OD1 ASP A 831 -15.479 4.245 5.364 1.00 0.00 O ATOM 1949 OD2 ASP A 831 -15.176 2.278 4.428 1.00 0.00 O ATOM 0 H ASP A 831 -10.969 3.621 5.330 1.00 0.00 H new ATOM 0 HA ASP A 831 -13.316 4.977 6.348 1.00 0.00 H new ATOM 0 HB2 ASP A 831 -13.204 1.982 5.899 1.00 0.00 H new ATOM 0 HB3 ASP A 831 -14.147 2.652 7.215 1.00 0.00 H new ATOM 1954 N LYS A 832 -10.866 3.178 7.588 1.00 0.00 N ATOM 1955 CA LYS A 832 -10.011 2.976 8.755 1.00 0.00 C ATOM 1956 C LYS A 832 -9.797 4.281 9.521 1.00 0.00 C ATOM 1957 O LYS A 832 -9.977 4.275 10.757 1.00 0.00 O ATOM 1958 CB LYS A 832 -8.663 2.387 8.326 1.00 0.00 C ATOM 1959 CG LYS A 832 -7.836 3.316 7.453 1.00 0.00 C ATOM 1960 CD LYS A 832 -6.426 2.787 7.252 1.00 0.00 C ATOM 1961 CE LYS A 832 -5.567 3.777 6.483 1.00 0.00 C ATOM 1962 NZ LYS A 832 -5.475 5.091 7.177 1.00 0.00 N ATOM 1963 OXT LYS A 832 -9.464 5.299 8.879 1.00 0.00 O ATOM 0 H LYS A 832 -10.544 2.699 6.747 1.00 0.00 H new ATOM 0 HA LYS A 832 -10.512 2.274 9.422 1.00 0.00 H new ATOM 0 HB2 LYS A 832 -8.088 2.134 9.217 1.00 0.00 H new ATOM 0 HB3 LYS A 832 -8.839 1.457 7.785 1.00 0.00 H new ATOM 0 HG2 LYS A 832 -8.322 3.435 6.485 1.00 0.00 H new ATOM 0 HG3 LYS A 832 -7.793 4.304 7.911 1.00 0.00 H new ATOM 0 HD2 LYS A 832 -5.970 2.584 8.221 1.00 0.00 H new ATOM 0 HD3 LYS A 832 -6.464 1.840 6.713 1.00 0.00 H new ATOM 0 HE2 LYS A 832 -4.566 3.365 6.353 1.00 0.00 H new ATOM 0 HE3 LYS A 832 -5.984 3.922 5.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 832 -4.490 5.425 7.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 832 -6.084 5.782 6.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 832 -5.786 4.985 8.164 1.00 0.00 H new TER 1977 LYS A 832 ATOM 1978 N SER B 31 11.730 6.360 -21.154 1.00 0.00 N ATOM 1979 CA SER B 31 11.602 6.459 -19.677 1.00 0.00 C ATOM 1980 C SER B 31 12.974 6.511 -19.014 1.00 0.00 C ATOM 1981 O SER B 31 13.980 6.137 -19.617 1.00 0.00 O ATOM 1982 CB SER B 31 10.810 5.267 -19.136 1.00 0.00 C ATOM 1983 OG SER B 31 11.474 4.046 -19.412 1.00 0.00 O ATOM 0 HA SER B 31 11.070 7.381 -19.443 1.00 0.00 H new ATOM 0 HB2 SER B 31 10.674 5.375 -18.060 1.00 0.00 H new ATOM 0 HB3 SER B 31 9.816 5.253 -19.584 1.00 0.00 H new ATOM 0 HG SER B 31 12.053 4.158 -20.195 1.00 0.00 H new ATOM 1991 N THR B 32 13.007 6.978 -17.769 1.00 0.00 N ATOM 1992 CA THR B 32 14.255 7.079 -17.022 1.00 0.00 C ATOM 1993 C THR B 32 14.071 6.627 -15.577 1.00 0.00 C ATOM 1994 O THR B 32 13.693 7.419 -14.712 1.00 0.00 O ATOM 1995 CB THR B 32 14.803 8.519 -17.033 1.00 0.00 C ATOM 1996 OG1 THR B 32 13.821 9.423 -16.511 1.00 0.00 O ATOM 1997 CG2 THR B 32 15.188 8.942 -18.443 1.00 0.00 C ATOM 0 H THR B 32 12.183 7.292 -17.257 1.00 0.00 H new ATOM 0 HA THR B 32 14.971 6.423 -17.516 1.00 0.00 H new ATOM 0 HB THR B 32 15.694 8.548 -16.405 1.00 0.00 H new ATOM 0 HG1 THR B 32 13.461 9.066 -15.673 1.00 0.00 H new ATOM 0 HG21 THR B 32 15.572 9.962 -18.425 1.00 0.00 H new ATOM 0 HG22 THR B 32 15.957 8.272 -18.827 1.00 0.00 H new ATOM 0 HG23 THR B 32 14.311 8.896 -19.089 1.00 0.00 H new ATOM 2005 N GLY B 33 14.337 5.350 -15.322 1.00 0.00 N ATOM 2006 CA GLY B 33 14.196 4.814 -13.981 1.00 0.00 C ATOM 2007 C GLY B 33 13.344 3.560 -13.941 1.00 0.00 C ATOM 2008 O GLY B 33 12.130 3.633 -13.749 1.00 0.00 O ATOM 0 H GLY B 33 14.648 4.676 -16.021 1.00 0.00 H new ATOM 0 HA2 GLY B 33 15.184 4.591 -13.577 1.00 0.00 H new ATOM 0 HA3 GLY B 33 13.751 5.572 -13.336 1.00 0.00 H new ATOM 2012 N GLY B 34 13.983 2.408 -14.126 1.00 0.00 N ATOM 2013 CA GLY B 34 13.263 1.148 -14.106 1.00 0.00 C ATOM 2014 C GLY B 34 13.747 0.222 -13.007 1.00 0.00 C ATOM 2015 O GLY B 34 13.173 -0.845 -12.787 1.00 0.00 O ATOM 0 H GLY B 34 14.986 2.325 -14.289 1.00 0.00 H new ATOM 0 HA2 GLY B 34 12.199 1.343 -13.971 1.00 0.00 H new ATOM 0 HA3 GLY B 34 13.376 0.653 -15.070 1.00 0.00 H new ATOM 2019 N VAL B 35 14.805 0.633 -12.316 1.00 0.00 N ATOM 2020 CA VAL B 35 15.371 -0.162 -11.232 1.00 0.00 C ATOM 2021 C VAL B 35 14.630 0.093 -9.923 1.00 0.00 C ATOM 2022 O VAL B 35 13.555 0.691 -9.914 1.00 0.00 O ATOM 2023 CB VAL B 35 16.867 0.149 -11.032 1.00 0.00 C ATOM 2024 CG1 VAL B 35 17.666 -0.270 -12.257 1.00 0.00 C ATOM 2025 CG2 VAL B 35 17.069 1.629 -10.735 1.00 0.00 C ATOM 0 H VAL B 35 15.289 1.514 -12.488 1.00 0.00 H new ATOM 0 HA VAL B 35 15.260 -1.209 -11.512 1.00 0.00 H new ATOM 0 HB VAL B 35 17.229 -0.422 -10.177 1.00 0.00 H new ATOM 0 HG11 VAL B 35 18.720 -0.043 -12.099 1.00 0.00 H new ATOM 0 HG12 VAL B 35 17.546 -1.341 -12.421 1.00 0.00 H new ATOM 0 HG13 VAL B 35 17.305 0.273 -13.130 1.00 0.00 H new ATOM 0 HG21 VAL B 35 18.131 1.831 -10.597 1.00 0.00 H new ATOM 0 HG22 VAL B 35 16.693 2.222 -11.569 1.00 0.00 H new ATOM 0 HG23 VAL B 35 16.528 1.895 -9.827 1.00 0.00 H new HETATM 2035 OH ALY B 36 8.789 -1.328 -3.614 1.00 0.00 O HETATM 2036 CH ALY B 36 9.416 -0.616 -4.398 1.00 0.00 C HETATM 2037 CH3 ALY B 36 8.843 0.752 -4.781 1.00 0.00 C HETATM 2038 NZ ALY B 36 10.611 -0.964 -4.867 1.00 0.00 N HETATM 2039 CE ALY B 36 11.818 -1.040 -4.046 1.00 0.00 C HETATM 2040 CD ALY B 36 13.077 -0.822 -4.872 1.00 0.00 C HETATM 2041 CG ALY B 36 13.080 -1.687 -6.100 1.00 0.00 C HETATM 2042 CB ALY B 36 14.393 -1.564 -6.843 1.00 0.00 C HETATM 2043 CA ALY B 36 14.610 -0.192 -7.505 1.00 0.00 C HETATM 2044 N ALY B 36 15.213 -0.368 -8.820 1.00 0.00 N HETATM 2045 C ALY B 36 15.477 0.722 -6.635 1.00 0.00 C HETATM 2046 O ALY B 36 15.680 0.455 -5.450 1.00 0.00 O HETATM 0 HH33 ALY B 36 7.869 0.620 -5.252 1.00 0.00 H new HETATM 0 HH32 ALY B 36 8.733 1.364 -3.886 1.00 0.00 H new HETATM 0 HH31 ALY B 36 9.519 1.247 -5.478 1.00 0.00 H new HETATM 0 HZ ALY B 36 10.690 -1.191 -5.858 1.00 0.00 H new HETATM 0 HG3 ALY B 36 12.258 -1.398 -6.755 1.00 0.00 H new HETATM 0 HG2 ALY B 36 12.913 -2.727 -5.818 1.00 0.00 H new HETATM 0 HE3 ALY B 36 11.866 -2.014 -3.560 1.00 0.00 H new HETATM 0 HE2 ALY B 36 11.768 -0.291 -3.255 1.00 0.00 H new HETATM 0 HD3 ALY B 36 13.955 -1.044 -4.266 1.00 0.00 H new HETATM 0 HD2 ALY B 36 13.147 0.226 -5.163 1.00 0.00 H new HETATM 0 HCA ALY B 36 13.638 0.289 -7.616 1.00 0.00 H new HETATM 0 HB3 ALY B 36 14.439 -2.337 -7.610 1.00 0.00 H new HETATM 0 HB2 ALY B 36 15.211 -1.755 -6.148 1.00 0.00 H new ATOM 2061 N LYS B 37 15.975 1.805 -7.260 1.00 0.00 N ATOM 2062 CA LYS B 37 16.828 2.811 -6.606 1.00 0.00 C ATOM 2063 C LYS B 37 17.353 2.318 -5.269 1.00 0.00 C ATOM 2064 O LYS B 37 16.831 2.682 -4.216 1.00 0.00 O ATOM 2065 CB LYS B 37 16.087 4.140 -6.402 1.00 0.00 C ATOM 2066 CG LYS B 37 17.018 5.342 -6.361 1.00 0.00 C ATOM 2067 CD LYS B 37 16.404 6.552 -7.050 1.00 0.00 C ATOM 2068 CE LYS B 37 16.418 6.396 -8.563 1.00 0.00 C ATOM 2069 NZ LYS B 37 15.843 7.585 -9.251 1.00 0.00 N ATOM 0 H LYS B 37 15.794 2.007 -8.243 1.00 0.00 H new ATOM 0 HA LYS B 37 17.671 2.979 -7.276 1.00 0.00 H new ATOM 0 HB2 LYS B 37 15.365 4.274 -7.208 1.00 0.00 H new ATOM 0 HB3 LYS B 37 15.521 4.094 -5.472 1.00 0.00 H new ATOM 0 HG2 LYS B 37 17.247 5.590 -5.325 1.00 0.00 H new ATOM 0 HG3 LYS B 37 17.962 5.088 -6.844 1.00 0.00 H new ATOM 0 HD2 LYS B 37 15.378 6.687 -6.706 1.00 0.00 H new ATOM 0 HD3 LYS B 37 16.955 7.450 -6.770 1.00 0.00 H new ATOM 0 HE2 LYS B 37 17.442 6.241 -8.902 1.00 0.00 H new ATOM 0 HE3 LYS B 37 15.852 5.507 -8.841 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 16.282 7.690 -10.188 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 14.817 7.459 -9.362 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 16.028 8.437 -8.684 1.00 0.00 H new ATOM 2083 N PRO B 38 18.389 1.471 -5.299 1.00 0.00 N ATOM 2084 CA PRO B 38 18.987 0.915 -4.093 1.00 0.00 C ATOM 2085 C PRO B 38 19.146 1.935 -2.970 1.00 0.00 C ATOM 2086 O PRO B 38 19.422 3.110 -3.216 1.00 0.00 O ATOM 2087 CB PRO B 38 20.355 0.459 -4.591 1.00 0.00 C ATOM 2088 CG PRO B 38 20.090 0.009 -5.980 1.00 0.00 C ATOM 2089 CD PRO B 38 19.066 0.970 -6.517 1.00 0.00 C ATOM 0 HA PRO B 38 18.370 0.130 -3.656 1.00 0.00 H new ATOM 0 HB2 PRO B 38 21.082 1.271 -4.565 1.00 0.00 H new ATOM 0 HB3 PRO B 38 20.756 -0.348 -3.978 1.00 0.00 H new ATOM 0 HG2 PRO B 38 21.000 0.027 -6.580 1.00 0.00 H new ATOM 0 HG3 PRO B 38 19.717 -1.015 -5.998 1.00 0.00 H new ATOM 0 HD2 PRO B 38 19.531 1.780 -7.079 1.00 0.00 H new ATOM 0 HD3 PRO B 38 18.366 0.476 -7.191 1.00 0.00 H new ATOM 2097 N HIS B 39 18.973 1.470 -1.738 1.00 0.00 N ATOM 2098 CA HIS B 39 19.105 2.323 -0.563 1.00 0.00 C ATOM 2099 C HIS B 39 19.035 1.484 0.710 1.00 0.00 C ATOM 2100 O HIS B 39 18.028 1.497 1.418 1.00 0.00 O ATOM 2101 CB HIS B 39 18.017 3.401 -0.549 1.00 0.00 C ATOM 2102 CG HIS B 39 18.219 4.434 0.518 1.00 0.00 C ATOM 2103 ND1 HIS B 39 18.012 4.184 1.859 1.00 0.00 N ATOM 2104 CD2 HIS B 39 18.624 5.724 0.437 1.00 0.00 C ATOM 2105 CE1 HIS B 39 18.280 5.274 2.554 1.00 0.00 C ATOM 2106 NE2 HIS B 39 18.654 6.222 1.716 1.00 0.00 N ATOM 0 H HIS B 39 18.739 0.500 -1.526 1.00 0.00 H new ATOM 0 HA HIS B 39 20.076 2.817 -0.606 1.00 0.00 H new ATOM 0 HB2 HIS B 39 17.991 3.893 -1.521 1.00 0.00 H new ATOM 0 HB3 HIS B 39 17.046 2.926 -0.406 1.00 0.00 H new ATOM 0 HD1 HIS B 39 17.701 3.296 2.252 1.00 0.00 H new ATOM 0 HD2 HIS B 39 18.876 6.261 -0.466 1.00 0.00 H new ATOM 0 HE1 HIS B 39 18.206 5.373 3.627 1.00 0.00 H new ATOM 2115 N ARG B 40 20.115 0.753 0.982 1.00 0.00 N ATOM 2116 CA ARG B 40 20.203 -0.112 2.160 1.00 0.00 C ATOM 2117 C ARG B 40 19.480 0.491 3.361 1.00 0.00 C ATOM 2118 O ARG B 40 19.955 1.451 3.969 1.00 0.00 O ATOM 2119 CB ARG B 40 21.670 -0.367 2.511 1.00 0.00 C ATOM 2120 CG ARG B 40 22.517 0.895 2.521 1.00 0.00 C ATOM 2121 CD ARG B 40 23.954 0.607 2.922 1.00 0.00 C ATOM 2122 NE ARG B 40 24.776 1.814 2.899 1.00 0.00 N ATOM 2123 CZ ARG B 40 25.315 2.362 3.984 1.00 0.00 C ATOM 2124 NH1 ARG B 40 25.122 1.810 5.175 1.00 0.00 N ATOM 2125 NH2 ARG B 40 26.046 3.463 3.880 1.00 0.00 N ATOM 0 H ARG B 40 20.950 0.743 0.396 1.00 0.00 H new ATOM 0 HA ARG B 40 19.714 -1.055 1.916 1.00 0.00 H new ATOM 0 HB2 ARG B 40 21.724 -0.840 3.492 1.00 0.00 H new ATOM 0 HB3 ARG B 40 22.090 -1.072 1.794 1.00 0.00 H new ATOM 0 HG2 ARG B 40 22.500 1.352 1.531 1.00 0.00 H new ATOM 0 HG3 ARG B 40 22.084 1.618 3.213 1.00 0.00 H new ATOM 0 HD2 ARG B 40 23.972 0.174 3.922 1.00 0.00 H new ATOM 0 HD3 ARG B 40 24.378 -0.135 2.245 1.00 0.00 H new ATOM 0 HE ARG B 40 24.946 2.262 1.999 1.00 0.00 H new ATOM 0 HH11 ARG B 40 24.559 0.964 5.260 1.00 0.00 H new ATOM 0 HH12 ARG B 40 25.536 2.232 6.006 1.00 0.00 H new ATOM 0 HH21 ARG B 40 26.196 3.891 2.966 1.00 0.00 H new ATOM 0 HH22 ARG B 40 26.459 3.882 4.714 1.00 0.00 H new ATOM 2139 N TYR B 41 18.324 -0.078 3.696 1.00 0.00 N ATOM 2140 CA TYR B 41 17.537 0.404 4.824 1.00 0.00 C ATOM 2141 C TYR B 41 17.241 -0.725 5.806 1.00 0.00 C ATOM 2142 O TYR B 41 17.218 -1.897 5.429 1.00 0.00 O ATOM 2143 CB TYR B 41 16.226 1.029 4.341 1.00 0.00 C ATOM 2144 CG TYR B 41 15.573 1.920 5.377 1.00 0.00 C ATOM 2145 CD1 TYR B 41 16.146 3.135 5.734 1.00 0.00 C ATOM 2146 CD2 TYR B 41 14.391 1.545 6.005 1.00 0.00 C ATOM 2147 CE1 TYR B 41 15.560 3.950 6.684 1.00 0.00 C ATOM 2148 CE2 TYR B 41 13.800 2.355 6.957 1.00 0.00 C ATOM 2149 CZ TYR B 41 14.388 3.555 7.292 1.00 0.00 C ATOM 2150 OH TYR B 41 13.801 4.363 8.240 1.00 0.00 O ATOM 0 H TYR B 41 17.914 -0.871 3.203 1.00 0.00 H new ATOM 0 HA TYR B 41 18.124 1.166 5.337 1.00 0.00 H new ATOM 0 HB2 TYR B 41 16.419 1.611 3.440 1.00 0.00 H new ATOM 0 HB3 TYR B 41 15.532 0.235 4.065 1.00 0.00 H new ATOM 0 HD1 TYR B 41 17.065 3.448 5.261 1.00 0.00 H new ATOM 0 HD2 TYR B 41 13.927 0.605 5.745 1.00 0.00 H new ATOM 0 HE1 TYR B 41 16.018 4.892 6.949 1.00 0.00 H new ATOM 0 HE2 TYR B 41 12.882 2.048 7.436 1.00 0.00 H new ATOM 0 HH TYR B 41 12.981 3.939 8.569 1.00 0.00 H new ATOM 2160 N LYS B 42 17.015 -0.358 7.063 1.00 0.00 N ATOM 2161 CA LYS B 42 16.718 -1.329 8.110 1.00 0.00 C ATOM 2162 C LYS B 42 17.825 -2.375 8.212 1.00 0.00 C ATOM 2163 O LYS B 42 17.630 -3.540 7.859 1.00 0.00 O ATOM 2164 CB LYS B 42 15.373 -2.011 7.842 1.00 0.00 C ATOM 2165 CG LYS B 42 14.641 -2.420 9.111 1.00 0.00 C ATOM 2166 CD LYS B 42 13.242 -2.937 8.815 1.00 0.00 C ATOM 2167 CE LYS B 42 12.325 -1.825 8.328 1.00 0.00 C ATOM 2168 NZ LYS B 42 12.142 -0.764 9.356 1.00 0.00 N ATOM 0 H LYS B 42 17.032 0.610 7.383 1.00 0.00 H new ATOM 0 HA LYS B 42 16.660 -0.795 9.059 1.00 0.00 H new ATOM 0 HB2 LYS B 42 14.739 -1.335 7.267 1.00 0.00 H new ATOM 0 HB3 LYS B 42 15.538 -2.895 7.226 1.00 0.00 H new ATOM 0 HG2 LYS B 42 15.212 -3.192 9.627 1.00 0.00 H new ATOM 0 HG3 LYS B 42 14.578 -1.566 9.785 1.00 0.00 H new ATOM 0 HD2 LYS B 42 13.296 -3.722 8.060 1.00 0.00 H new ATOM 0 HD3 LYS B 42 12.822 -3.388 9.714 1.00 0.00 H new ATOM 0 HE2 LYS B 42 12.739 -1.384 7.421 1.00 0.00 H new ATOM 0 HE3 LYS B 42 11.355 -2.245 8.063 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 11.300 -0.199 9.125 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 12.018 -1.204 10.290 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 12.979 -0.147 9.371 1.00 0.00 H new ATOM 2182 N CYS B 43 18.989 -1.950 8.696 1.00 0.00 N ATOM 2183 CA CYS B 43 20.131 -2.846 8.843 1.00 0.00 C ATOM 2184 C CYS B 43 20.779 -2.683 10.215 1.00 0.00 C ATOM 2185 O CYS B 43 21.672 -1.820 10.348 1.00 0.00 O ATOM 2186 CB CYS B 43 21.160 -2.578 7.744 1.00 0.00 C ATOM 2187 SG CYS B 43 22.608 -3.661 7.808 1.00 0.00 S ATOM 2188 OXT CYS B 43 20.387 -3.418 11.145 1.00 0.00 O ATOM 0 H CYS B 43 19.166 -0.990 8.993 1.00 0.00 H new ATOM 0 HA CYS B 43 19.771 -3.871 8.752 1.00 0.00 H new ATOM 0 HB2 CYS B 43 20.677 -2.692 6.773 1.00 0.00 H new ATOM 0 HB3 CYS B 43 21.491 -1.542 7.816 1.00 0.00 H new ATOM 0 HG CYS B 43 23.419 -3.359 6.838 1.00 0.00 H new TER 2194 CYS B 43