USER MOD reduce.3.24.130724 H: found=0, std=0, add=1093, rem=0, adj=49 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 799 CYS SG : rot 146:sc= -13.3! USER MOD Set 1.2: A 803 ASN : amide:sc= -8.02! C(o=-25!,f=-26!) USER MOD Set 1.3: A 807 SER OG : rot -128:sc= -0.941 USER MOD Set 1.4: B 39 HIS : +bothHN:sc= -3.12! C(o=-25!,f=-33!) USER MOD Set 2.1: A 789 MET CE :methyl -152:sc= -12.3! (180deg=-14.6!) USER MOD Set 2.2: A 793 GLN :FLIP amide:sc= -1.76 F(o=-20!,f=-14) USER MOD Set 3.1: A 773 MET CE :methyl -115:sc= -11.5! (180deg=-12.8!) USER MOD Set 3.2: A 782 TYR OH : rot -39:sc= -5.16! USER MOD Set 4.1: A 744 SER OG : rot -46:sc= 0.41 USER MOD Set 4.2: A 812 CYS SG : rot 95:sc= -0.562! USER MOD Set 5.1: A 740 LYS NZ :NH3+ -120:sc= -1.95! (180deg=-4.57!) USER MOD Set 5.2: A 771 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.1: A 730 SER OG : rot 180:sc= -0.0105 USER MOD Set 6.2: A 733 LYS NZ :NH3+ 164:sc= -0.382 (180deg=-0.804) USER MOD Single : A 716 SER OG : rot 180:sc= 0 USER MOD Single : A 717 HIS : no HE2:sc= 0.00472 X(o=0.0047,f=-0.44) USER MOD Single : A 718 MET CE :methyl -158:sc= -0.178 (180deg=-0.855) USER MOD Single : A 719 SER OG : rot 180:sc= 0 USER MOD Single : A 720 LYS NZ :NH3+ 169:sc= -3.64! (180deg=-4.11!) USER MOD Single : A 727 GLN : amide:sc= -1.09 K(o=-1.1,f=-3.2!) USER MOD Single : A 729 TYR OH : rot 180:sc= 0 USER MOD Single : A 731 THR OG1 : rot 97:sc= 1.18 USER MOD Single : A 734 SER OG : rot 180:sc= 0 USER MOD Single : A 737 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 738 GLN :FLIP amide:sc= -2.99! C(o=-8.3!,f=-3!) USER MOD Single : A 741 SER OG : rot -32:sc= 0.292 USER MOD Single : A 742 HIS : no HD1:sc= -10.9! C(o=-11!,f=-20!) USER MOD Single : A 743 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 749 MET CE :methyl -106:sc= -4.67! (180deg=-9.08!) 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 180:sc= -0.113 USER MOD Single : A 761 TYR OH : rot 180:sc= 0 USER MOD Single : A 768 MET CE :methyl -104:sc= -8.43! (180deg=-12.9!) USER MOD Single : A 772 THR OG1 : rot 180:sc= -0.352 USER MOD Single : A 774 SER OG : rot -25:sc= 0.13 USER MOD Single : A 778 LYS NZ :NH3+ 166:sc=-0.00164 (180deg=-0.114) USER MOD Single : A 779 ASN :FLIP amide:sc= -3.91! C(o=-7.4!,f=-3.9!) USER MOD Single : A 781 TYR OH : rot 180:sc= -1.07! USER MOD Single : A 784 SER OG : rot 43:sc= 0.53 USER MOD Single : A 785 LYS NZ :NH3+ -111:sc= -1.86! (180deg=-2.06!) USER MOD Single : A 786 LYS NZ :NH3+ -174:sc= -2.49! (180deg=-2.58!) USER MOD Single : A 797 THR OG1 : rot -88:sc= 1.26 USER MOD Single : A 798 ASN : amide:sc= -9.27! C(o=-9.3!,f=-15!) USER MOD Single : A 800 LYS NZ :NH3+ -172:sc= -0.506 (180deg=-0.627) USER MOD Single : A 802 TYR OH : rot 61:sc= -0.559 USER MOD Single : A 809 TYR OH : rot 15:sc= -3.97! USER MOD Single : A 810 TYR OH : rot 129:sc= 0.14 USER MOD Single : A 811 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 814 ASN : amide:sc= -0.0647 K(o=-0.065,f=-0.98!) USER MOD Single : A 818 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.0764) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 832 LYS NZ :NH3+ -164:sc= -0.0492 (180deg=-0.328) USER MOD Single : B 31 SER OG : rot 36:sc= 0.0684 USER MOD Single : B 32 THR OG1 : rot 180:sc= 0 USER MOD Single : B 37 LYS NZ :NH3+ 170:sc= -0.0091 (180deg=-0.117) USER MOD Single : B 41 TYR OH : rot 180:sc= 0 USER MOD Single : B 42 LYS NZ :NH3+ 166:sc= -0.038 (180deg=-0.329) USER MOD Single : B 43 CYS SG : rot 180:sc= -0.519 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 715 -31.538 3.887 8.681 1.00 0.00 N ATOM 2 CA GLY A 715 -32.219 5.128 8.218 1.00 0.00 C ATOM 3 C GLY A 715 -31.361 5.940 7.269 1.00 0.00 C ATOM 4 O GLY A 715 -31.601 7.133 7.072 1.00 0.00 O ATOM 0 HA2 GLY A 715 -33.153 4.863 7.722 1.00 0.00 H new ATOM 0 HA3 GLY A 715 -32.479 5.740 9.082 1.00 0.00 H new ATOM 10 N SER A 716 -30.358 5.296 6.681 1.00 0.00 N ATOM 11 CA SER A 716 -29.459 5.965 5.748 1.00 0.00 C ATOM 12 C SER A 716 -29.268 5.132 4.485 1.00 0.00 C ATOM 13 O SER A 716 -29.466 3.917 4.496 1.00 0.00 O ATOM 14 CB SER A 716 -28.105 6.226 6.411 1.00 0.00 C ATOM 15 OG SER A 716 -27.494 5.014 6.818 1.00 0.00 O ATOM 0 H SER A 716 -30.147 4.310 6.835 1.00 0.00 H new ATOM 0 HA SER A 716 -29.908 6.918 5.468 1.00 0.00 H new ATOM 0 HB2 SER A 716 -27.451 6.751 5.715 1.00 0.00 H new ATOM 0 HB3 SER A 716 -28.239 6.877 7.275 1.00 0.00 H new ATOM 0 HG SER A 716 -26.630 5.208 7.237 1.00 0.00 H new ATOM 21 N HIS A 717 -28.882 5.794 3.397 1.00 0.00 N ATOM 22 CA HIS A 717 -28.665 5.116 2.124 1.00 0.00 C ATOM 23 C HIS A 717 -27.931 6.020 1.138 1.00 0.00 C ATOM 24 O HIS A 717 -28.147 5.939 -0.072 1.00 0.00 O ATOM 25 CB HIS A 717 -30.002 4.667 1.528 1.00 0.00 C ATOM 26 CG HIS A 717 -30.981 5.785 1.340 1.00 0.00 C ATOM 27 ND1 HIS A 717 -31.010 6.580 0.213 1.00 0.00 N ATOM 28 CD2 HIS A 717 -31.973 6.237 2.144 1.00 0.00 C ATOM 29 CE1 HIS A 717 -31.976 7.473 0.332 1.00 0.00 C ATOM 30 NE2 HIS A 717 -32.576 7.286 1.493 1.00 0.00 N ATOM 0 H HIS A 717 -28.713 6.800 3.373 1.00 0.00 H new ATOM 0 HA HIS A 717 -28.044 4.240 2.311 1.00 0.00 H new ATOM 0 HB2 HIS A 717 -29.819 4.190 0.565 1.00 0.00 H new ATOM 0 HB3 HIS A 717 -30.445 3.913 2.178 1.00 0.00 H new ATOM 0 HD1 HIS A 717 -30.383 6.492 -0.587 1.00 0.00 H new ATOM 0 HD2 HIS A 717 -32.240 5.846 3.115 1.00 0.00 H new ATOM 0 HE1 HIS A 717 -32.232 8.228 -0.397 1.00 0.00 H new ATOM 39 N MET A 718 -27.061 6.880 1.661 1.00 0.00 N ATOM 40 CA MET A 718 -26.298 7.799 0.824 1.00 0.00 C ATOM 41 C MET A 718 -24.836 7.369 0.728 1.00 0.00 C ATOM 42 O MET A 718 -24.094 7.849 -0.130 1.00 0.00 O ATOM 43 CB MET A 718 -26.385 9.221 1.381 1.00 0.00 C ATOM 44 CG MET A 718 -25.848 9.356 2.797 1.00 0.00 C ATOM 45 SD MET A 718 -25.846 11.062 3.382 1.00 0.00 S ATOM 46 CE MET A 718 -24.723 11.822 2.210 1.00 0.00 C ATOM 0 H MET A 718 -26.868 6.959 2.659 1.00 0.00 H new ATOM 0 HA MET A 718 -26.730 7.779 -0.177 1.00 0.00 H new ATOM 0 HB2 MET A 718 -25.831 9.893 0.726 1.00 0.00 H new ATOM 0 HB3 MET A 718 -27.425 9.546 1.364 1.00 0.00 H new ATOM 0 HG2 MET A 718 -26.452 8.746 3.470 1.00 0.00 H new ATOM 0 HG3 MET A 718 -24.832 8.962 2.835 1.00 0.00 H new ATOM 0 HE1 MET A 718 -24.313 12.736 2.639 1.00 0.00 H new ATOM 0 HE2 MET A 718 -23.911 11.131 1.984 1.00 0.00 H new ATOM 0 HE3 MET A 718 -25.261 12.062 1.293 1.00 0.00 H new ATOM 56 N SER A 719 -24.432 6.461 1.611 1.00 0.00 N ATOM 57 CA SER A 719 -23.057 5.969 1.626 1.00 0.00 C ATOM 58 C SER A 719 -22.774 5.104 0.402 1.00 0.00 C ATOM 59 O SER A 719 -23.663 4.422 -0.107 1.00 0.00 O ATOM 60 CB SER A 719 -22.796 5.167 2.902 1.00 0.00 C ATOM 61 OG SER A 719 -23.632 4.024 2.966 1.00 0.00 O ATOM 0 H SER A 719 -25.035 6.051 2.324 1.00 0.00 H new ATOM 0 HA SER A 719 -22.389 6.830 1.601 1.00 0.00 H new ATOM 0 HB2 SER A 719 -21.751 4.859 2.934 1.00 0.00 H new ATOM 0 HB3 SER A 719 -22.970 5.798 3.774 1.00 0.00 H new ATOM 0 HG SER A 719 -23.445 3.527 3.790 1.00 0.00 H new ATOM 67 N LYS A 720 -21.529 5.139 -0.066 1.00 0.00 N ATOM 68 CA LYS A 720 -21.128 4.356 -1.230 1.00 0.00 C ATOM 69 C LYS A 720 -20.184 3.225 -0.833 1.00 0.00 C ATOM 70 O LYS A 720 -19.689 2.490 -1.688 1.00 0.00 O ATOM 71 CB LYS A 720 -20.470 5.249 -2.267 1.00 0.00 C ATOM 72 CG LYS A 720 -21.079 5.122 -3.654 1.00 0.00 C ATOM 73 CD LYS A 720 -20.276 5.887 -4.692 1.00 0.00 C ATOM 74 CE LYS A 720 -19.203 5.015 -5.325 1.00 0.00 C ATOM 75 NZ LYS A 720 -18.339 4.362 -4.303 1.00 0.00 N ATOM 0 H LYS A 720 -20.782 5.700 0.343 1.00 0.00 H new ATOM 0 HA LYS A 720 -22.025 3.913 -1.663 1.00 0.00 H new ATOM 0 HB2 LYS A 720 -20.544 6.286 -1.940 1.00 0.00 H new ATOM 0 HB3 LYS A 720 -19.409 5.007 -2.322 1.00 0.00 H new ATOM 0 HG2 LYS A 720 -21.128 4.070 -3.935 1.00 0.00 H new ATOM 0 HG3 LYS A 720 -22.103 5.496 -3.638 1.00 0.00 H new ATOM 0 HD2 LYS A 720 -20.945 6.261 -5.467 1.00 0.00 H new ATOM 0 HD3 LYS A 720 -19.811 6.756 -4.225 1.00 0.00 H new ATOM 0 HE2 LYS A 720 -19.675 4.251 -5.942 1.00 0.00 H new ATOM 0 HE3 LYS A 720 -18.586 5.623 -5.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 720 -17.747 3.639 -4.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 720 -17.730 5.076 -3.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 720 -18.936 3.914 -3.579 1.00 0.00 H new ATOM 89 N GLU A 721 -19.938 3.100 0.469 1.00 0.00 N ATOM 90 CA GLU A 721 -19.060 2.056 0.995 1.00 0.00 C ATOM 91 C GLU A 721 -19.460 0.687 0.447 1.00 0.00 C ATOM 92 O GLU A 721 -20.573 0.213 0.677 1.00 0.00 O ATOM 93 CB GLU A 721 -19.125 2.047 2.525 1.00 0.00 C ATOM 94 CG GLU A 721 -18.291 0.952 3.167 1.00 0.00 C ATOM 95 CD GLU A 721 -18.404 0.945 4.679 1.00 0.00 C ATOM 96 OE1 GLU A 721 -19.379 0.362 5.199 1.00 0.00 O ATOM 97 OE2 GLU A 721 -17.518 1.521 5.344 1.00 0.00 O ATOM 0 H GLU A 721 -20.336 3.711 1.182 1.00 0.00 H new ATOM 0 HA GLU A 721 -18.039 2.268 0.678 1.00 0.00 H new ATOM 0 HB2 GLU A 721 -18.789 3.014 2.899 1.00 0.00 H new ATOM 0 HB3 GLU A 721 -20.163 1.929 2.835 1.00 0.00 H new ATOM 0 HG2 GLU A 721 -18.607 -0.016 2.778 1.00 0.00 H new ATOM 0 HG3 GLU A 721 -17.246 1.083 2.885 1.00 0.00 H new ATOM 104 N PRO A 722 -18.543 0.042 -0.290 1.00 0.00 N ATOM 105 CA PRO A 722 -18.785 -1.265 -0.886 1.00 0.00 C ATOM 106 C PRO A 722 -18.987 -2.351 0.168 1.00 0.00 C ATOM 107 O PRO A 722 -20.036 -2.989 0.208 1.00 0.00 O ATOM 108 CB PRO A 722 -17.554 -1.520 -1.748 1.00 0.00 C ATOM 109 CG PRO A 722 -16.539 -0.536 -1.336 1.00 0.00 C ATOM 110 CD PRO A 722 -17.205 0.552 -0.589 1.00 0.00 C ATOM 0 HA PRO A 722 -19.705 -1.285 -1.470 1.00 0.00 H new ATOM 0 HB2 PRO A 722 -17.187 -2.537 -1.608 1.00 0.00 H new ATOM 0 HB3 PRO A 722 -17.793 -1.410 -2.806 1.00 0.00 H new ATOM 0 HG2 PRO A 722 -15.782 -1.013 -0.713 1.00 0.00 H new ATOM 0 HG3 PRO A 722 -16.026 -0.135 -2.210 1.00 0.00 H new ATOM 0 HD2 PRO A 722 -16.662 0.794 0.324 1.00 0.00 H new ATOM 0 HD3 PRO A 722 -17.254 1.465 -1.182 1.00 0.00 H new ATOM 118 N ARG A 723 -17.984 -2.543 1.025 1.00 0.00 N ATOM 119 CA ARG A 723 -18.051 -3.533 2.108 1.00 0.00 C ATOM 120 C ARG A 723 -18.019 -4.973 1.595 1.00 0.00 C ATOM 121 O ARG A 723 -17.119 -5.734 1.947 1.00 0.00 O ATOM 122 CB ARG A 723 -19.299 -3.316 2.959 1.00 0.00 C ATOM 123 CG ARG A 723 -19.206 -3.992 4.311 1.00 0.00 C ATOM 124 CD ARG A 723 -18.260 -3.247 5.239 1.00 0.00 C ATOM 125 NE ARG A 723 -18.178 -3.877 6.555 1.00 0.00 N ATOM 126 CZ ARG A 723 -18.541 -3.277 7.685 1.00 0.00 C ATOM 127 NH1 ARG A 723 -19.016 -2.038 7.662 1.00 0.00 N ATOM 128 NH2 ARG A 723 -18.431 -3.917 8.841 1.00 0.00 N ATOM 0 H ARG A 723 -17.107 -2.023 0.992 1.00 0.00 H new ATOM 0 HA ARG A 723 -17.160 -3.384 2.719 1.00 0.00 H new ATOM 0 HB2 ARG A 723 -19.456 -2.247 3.101 1.00 0.00 H new ATOM 0 HB3 ARG A 723 -20.169 -3.698 2.425 1.00 0.00 H new ATOM 0 HG2 ARG A 723 -20.197 -4.043 4.763 1.00 0.00 H new ATOM 0 HG3 ARG A 723 -18.861 -5.018 4.184 1.00 0.00 H new ATOM 0 HD2 ARG A 723 -17.267 -3.211 4.792 1.00 0.00 H new ATOM 0 HD3 ARG A 723 -18.598 -2.217 5.350 1.00 0.00 H new ATOM 0 HE ARG A 723 -17.822 -4.831 6.610 1.00 0.00 H new ATOM 0 HH11 ARG A 723 -19.104 -1.542 6.775 1.00 0.00 H new ATOM 0 HH12 ARG A 723 -19.293 -1.582 8.531 1.00 0.00 H new ATOM 0 HH21 ARG A 723 -18.068 -4.870 8.864 1.00 0.00 H new ATOM 0 HH22 ARG A 723 -18.710 -3.456 9.707 1.00 0.00 H new ATOM 142 N ASP A 724 -19.015 -5.357 0.798 1.00 0.00 N ATOM 143 CA ASP A 724 -19.073 -6.711 0.256 1.00 0.00 C ATOM 144 C ASP A 724 -17.736 -7.087 -0.380 1.00 0.00 C ATOM 145 O ASP A 724 -16.962 -6.214 -0.766 1.00 0.00 O ATOM 146 CB ASP A 724 -20.198 -6.834 -0.771 1.00 0.00 C ATOM 147 CG ASP A 724 -21.543 -6.415 -0.210 1.00 0.00 C ATOM 148 OD1 ASP A 724 -21.731 -5.208 0.047 1.00 0.00 O ATOM 149 OD2 ASP A 724 -22.408 -7.298 -0.023 1.00 0.00 O ATOM 0 H ASP A 724 -19.787 -4.753 0.516 1.00 0.00 H new ATOM 0 HA ASP A 724 -19.278 -7.399 1.077 1.00 0.00 H new ATOM 0 HB2 ASP A 724 -19.962 -6.219 -1.639 1.00 0.00 H new ATOM 0 HB3 ASP A 724 -20.258 -7.866 -1.118 1.00 0.00 H new ATOM 154 N PRO A 725 -17.452 -8.394 -0.507 1.00 0.00 N ATOM 155 CA PRO A 725 -16.199 -8.875 -1.066 1.00 0.00 C ATOM 156 C PRO A 725 -16.169 -8.791 -2.585 1.00 0.00 C ATOM 157 O PRO A 725 -15.102 -8.807 -3.194 1.00 0.00 O ATOM 158 CB PRO A 725 -16.111 -10.333 -0.592 1.00 0.00 C ATOM 159 CG PRO A 725 -17.369 -10.611 0.167 1.00 0.00 C ATOM 160 CD PRO A 725 -18.332 -9.501 -0.147 1.00 0.00 C ATOM 0 HA PRO A 725 -15.355 -8.269 -0.738 1.00 0.00 H new ATOM 0 HB2 PRO A 725 -16.012 -11.011 -1.440 1.00 0.00 H new ATOM 0 HB3 PRO A 725 -15.236 -10.483 0.040 1.00 0.00 H new ATOM 0 HG2 PRO A 725 -17.787 -11.576 -0.121 1.00 0.00 H new ATOM 0 HG3 PRO A 725 -17.170 -10.656 1.238 1.00 0.00 H new ATOM 0 HD2 PRO A 725 -19.001 -9.767 -0.965 1.00 0.00 H new ATOM 0 HD3 PRO A 725 -18.959 -9.256 0.711 1.00 0.00 H new ATOM 168 N ASP A 726 -17.347 -8.705 -3.191 1.00 0.00 N ATOM 169 CA ASP A 726 -17.460 -8.606 -4.641 1.00 0.00 C ATOM 170 C ASP A 726 -17.503 -7.148 -5.064 1.00 0.00 C ATOM 171 O ASP A 726 -16.781 -6.747 -5.976 1.00 0.00 O ATOM 172 CB ASP A 726 -18.707 -9.339 -5.138 1.00 0.00 C ATOM 173 CG ASP A 726 -18.886 -9.225 -6.639 1.00 0.00 C ATOM 174 OD1 ASP A 726 -19.509 -8.240 -7.091 1.00 0.00 O ATOM 175 OD2 ASP A 726 -18.403 -10.120 -7.364 1.00 0.00 O ATOM 0 H ASP A 726 -18.240 -8.702 -2.699 1.00 0.00 H new ATOM 0 HA ASP A 726 -16.585 -9.078 -5.088 1.00 0.00 H new ATOM 0 HB2 ASP A 726 -18.640 -10.391 -4.862 1.00 0.00 H new ATOM 0 HB3 ASP A 726 -19.587 -8.933 -4.638 1.00 0.00 H new ATOM 180 N GLN A 727 -18.355 -6.351 -4.413 1.00 0.00 N ATOM 181 CA GLN A 727 -18.420 -4.938 -4.745 1.00 0.00 C ATOM 182 C GLN A 727 -17.036 -4.356 -4.596 1.00 0.00 C ATOM 183 O GLN A 727 -16.574 -3.617 -5.452 1.00 0.00 O ATOM 184 CB GLN A 727 -19.414 -4.176 -3.886 1.00 0.00 C ATOM 185 CG GLN A 727 -20.764 -4.837 -3.814 1.00 0.00 C ATOM 186 CD GLN A 727 -21.718 -4.135 -2.868 1.00 0.00 C ATOM 187 OE1 GLN A 727 -21.298 -3.499 -1.905 1.00 0.00 O ATOM 188 NE2 GLN A 727 -23.013 -4.250 -3.140 1.00 0.00 N ATOM 0 H GLN A 727 -18.990 -6.655 -3.675 1.00 0.00 H new ATOM 0 HA GLN A 727 -18.774 -4.840 -5.771 1.00 0.00 H new ATOM 0 HB2 GLN A 727 -19.011 -4.076 -2.878 1.00 0.00 H new ATOM 0 HB3 GLN A 727 -19.531 -3.168 -4.284 1.00 0.00 H new ATOM 0 HG2 GLN A 727 -21.203 -4.863 -4.811 1.00 0.00 H new ATOM 0 HG3 GLN A 727 -20.639 -5.871 -3.494 1.00 0.00 H new ATOM 0 HE21 GLN A 727 -23.318 -4.788 -3.951 1.00 0.00 H new ATOM 0 HE22 GLN A 727 -23.703 -3.800 -2.538 1.00 0.00 H new ATOM 197 N LEU A 728 -16.366 -4.743 -3.513 1.00 0.00 N ATOM 198 CA LEU A 728 -15.013 -4.290 -3.244 1.00 0.00 C ATOM 199 C LEU A 728 -14.070 -4.873 -4.264 1.00 0.00 C ATOM 200 O LEU A 728 -13.382 -4.149 -4.960 1.00 0.00 O ATOM 201 CB LEU A 728 -14.568 -4.715 -1.853 1.00 0.00 C ATOM 202 CG LEU A 728 -14.933 -3.752 -0.743 1.00 0.00 C ATOM 203 CD1 LEU A 728 -14.839 -4.426 0.613 1.00 0.00 C ATOM 204 CD2 LEU A 728 -13.994 -2.578 -0.818 1.00 0.00 C ATOM 0 H LEU A 728 -16.745 -5.373 -2.806 1.00 0.00 H new ATOM 0 HA LEU A 728 -14.998 -3.202 -3.302 1.00 0.00 H new ATOM 0 HB2 LEU A 728 -15.006 -5.687 -1.629 1.00 0.00 H new ATOM 0 HB3 LEU A 728 -13.486 -4.847 -1.858 1.00 0.00 H new ATOM 0 HG LEU A 728 -15.963 -3.418 -0.866 1.00 0.00 H new ATOM 0 HD11 LEU A 728 -15.106 -3.713 1.393 1.00 0.00 H new ATOM 0 HD12 LEU A 728 -15.524 -5.274 0.646 1.00 0.00 H new ATOM 0 HD13 LEU A 728 -13.820 -4.776 0.775 1.00 0.00 H new ATOM 0 HD21 LEU A 728 -14.236 -1.868 -0.027 1.00 0.00 H new ATOM 0 HD22 LEU A 728 -12.968 -2.924 -0.693 1.00 0.00 H new ATOM 0 HD23 LEU A 728 -14.097 -2.091 -1.788 1.00 0.00 H new ATOM 216 N TYR A 729 -14.067 -6.189 -4.377 1.00 0.00 N ATOM 217 CA TYR A 729 -13.196 -6.851 -5.324 1.00 0.00 C ATOM 218 C TYR A 729 -13.046 -6.023 -6.573 1.00 0.00 C ATOM 219 O TYR A 729 -11.959 -5.543 -6.865 1.00 0.00 O ATOM 220 CB TYR A 729 -13.787 -8.210 -5.688 1.00 0.00 C ATOM 221 CG TYR A 729 -13.502 -8.664 -7.095 1.00 0.00 C ATOM 222 CD1 TYR A 729 -12.214 -8.886 -7.465 1.00 0.00 C ATOM 223 CD2 TYR A 729 -14.504 -8.881 -8.030 1.00 0.00 C ATOM 224 CE1 TYR A 729 -11.874 -9.314 -8.723 1.00 0.00 C ATOM 225 CE2 TYR A 729 -14.194 -9.311 -9.311 1.00 0.00 C ATOM 226 CZ TYR A 729 -12.870 -9.527 -9.653 1.00 0.00 C ATOM 227 OH TYR A 729 -12.549 -9.956 -10.921 1.00 0.00 O ATOM 0 H TYR A 729 -14.655 -6.815 -3.827 1.00 0.00 H new ATOM 0 HA TYR A 729 -12.214 -6.980 -4.868 1.00 0.00 H new ATOM 0 HB2 TYR A 729 -13.400 -8.957 -4.995 1.00 0.00 H new ATOM 0 HB3 TYR A 729 -14.867 -8.171 -5.545 1.00 0.00 H new ATOM 0 HD1 TYR A 729 -11.429 -8.719 -6.742 1.00 0.00 H new ATOM 0 HD2 TYR A 729 -15.535 -8.713 -7.757 1.00 0.00 H new ATOM 0 HE1 TYR A 729 -10.839 -9.482 -8.982 1.00 0.00 H new ATOM 0 HE2 TYR A 729 -14.978 -9.476 -10.035 1.00 0.00 H new ATOM 0 HH TYR A 729 -13.368 -10.057 -11.449 1.00 0.00 H new ATOM 237 N SER A 730 -14.129 -5.792 -7.279 1.00 0.00 N ATOM 238 CA SER A 730 -14.011 -5.028 -8.489 1.00 0.00 C ATOM 239 C SER A 730 -14.058 -3.526 -8.262 1.00 0.00 C ATOM 240 O SER A 730 -13.658 -2.759 -9.139 1.00 0.00 O ATOM 241 CB SER A 730 -14.927 -5.512 -9.582 1.00 0.00 C ATOM 242 OG SER A 730 -15.459 -4.436 -10.336 1.00 0.00 O ATOM 0 H SER A 730 -15.069 -6.111 -7.044 1.00 0.00 H new ATOM 0 HA SER A 730 -13.004 -5.216 -8.861 1.00 0.00 H new ATOM 0 HB2 SER A 730 -14.381 -6.184 -10.243 1.00 0.00 H new ATOM 0 HB3 SER A 730 -15.743 -6.088 -9.145 1.00 0.00 H new ATOM 0 HG SER A 730 -16.047 -4.787 -11.037 1.00 0.00 H new ATOM 248 N THR A 731 -14.546 -3.088 -7.102 1.00 0.00 N ATOM 249 CA THR A 731 -14.533 -1.661 -6.818 1.00 0.00 C ATOM 250 C THR A 731 -13.090 -1.295 -6.800 1.00 0.00 C ATOM 251 O THR A 731 -12.595 -0.514 -7.609 1.00 0.00 O ATOM 252 CB THR A 731 -15.150 -1.313 -5.445 1.00 0.00 C ATOM 253 OG1 THR A 731 -16.566 -1.137 -5.576 1.00 0.00 O ATOM 254 CG2 THR A 731 -14.536 -0.047 -4.856 1.00 0.00 C ATOM 0 H THR A 731 -14.941 -3.679 -6.370 1.00 0.00 H new ATOM 0 HA THR A 731 -15.123 -1.125 -7.561 1.00 0.00 H new ATOM 0 HB THR A 731 -14.938 -2.141 -4.769 1.00 0.00 H new ATOM 0 HG1 THR A 731 -17.023 -1.970 -5.335 1.00 0.00 H new ATOM 0 HG21 THR A 731 -14.996 0.165 -3.891 1.00 0.00 H new ATOM 0 HG22 THR A 731 -13.464 -0.190 -4.724 1.00 0.00 H new ATOM 0 HG23 THR A 731 -14.710 0.790 -5.532 1.00 0.00 H new ATOM 262 N LEU A 732 -12.441 -1.948 -5.873 1.00 0.00 N ATOM 263 CA LEU A 732 -11.036 -1.848 -5.665 1.00 0.00 C ATOM 264 C LEU A 732 -10.302 -2.213 -6.944 1.00 0.00 C ATOM 265 O LEU A 732 -9.239 -1.679 -7.231 1.00 0.00 O ATOM 266 CB LEU A 732 -10.644 -2.811 -4.570 1.00 0.00 C ATOM 267 CG LEU A 732 -11.547 -2.888 -3.347 1.00 0.00 C ATOM 268 CD1 LEU A 732 -11.400 -4.240 -2.714 1.00 0.00 C ATOM 269 CD2 LEU A 732 -11.193 -1.818 -2.352 1.00 0.00 C ATOM 0 H LEU A 732 -12.901 -2.585 -5.223 1.00 0.00 H new ATOM 0 HA LEU A 732 -10.774 -0.828 -5.382 1.00 0.00 H new ATOM 0 HB2 LEU A 732 -10.581 -3.808 -5.005 1.00 0.00 H new ATOM 0 HB3 LEU A 732 -9.642 -2.547 -4.232 1.00 0.00 H new ATOM 0 HG LEU A 732 -12.580 -2.733 -3.659 1.00 0.00 H new ATOM 0 HD11 LEU A 732 -12.044 -4.303 -1.837 1.00 0.00 H new ATOM 0 HD12 LEU A 732 -11.686 -5.010 -3.430 1.00 0.00 H new ATOM 0 HD13 LEU A 732 -10.363 -4.391 -2.414 1.00 0.00 H new ATOM 0 HD21 LEU A 732 -11.852 -1.893 -1.487 1.00 0.00 H new ATOM 0 HD22 LEU A 732 -10.159 -1.946 -2.033 1.00 0.00 H new ATOM 0 HD23 LEU A 732 -11.311 -0.838 -2.814 1.00 0.00 H new ATOM 281 N LYS A 733 -10.876 -3.141 -7.712 1.00 0.00 N ATOM 282 CA LYS A 733 -10.266 -3.559 -8.969 1.00 0.00 C ATOM 283 C LYS A 733 -10.046 -2.335 -9.823 1.00 0.00 C ATOM 284 O LYS A 733 -9.132 -2.282 -10.630 1.00 0.00 O ATOM 285 CB LYS A 733 -11.151 -4.575 -9.696 1.00 0.00 C ATOM 286 CG LYS A 733 -10.580 -5.105 -10.997 1.00 0.00 C ATOM 287 CD LYS A 733 -10.958 -6.560 -11.219 1.00 0.00 C ATOM 288 CE LYS A 733 -12.393 -6.717 -11.674 1.00 0.00 C ATOM 289 NZ LYS A 733 -12.855 -5.567 -12.502 1.00 0.00 N ATOM 0 H LYS A 733 -11.753 -3.611 -7.487 1.00 0.00 H new ATOM 0 HA LYS A 733 -9.312 -4.046 -8.768 1.00 0.00 H new ATOM 0 HB2 LYS A 733 -11.337 -5.416 -9.028 1.00 0.00 H new ATOM 0 HB3 LYS A 733 -12.116 -4.112 -9.902 1.00 0.00 H new ATOM 0 HG2 LYS A 733 -10.945 -4.502 -11.828 1.00 0.00 H new ATOM 0 HG3 LYS A 733 -9.494 -5.008 -10.986 1.00 0.00 H new ATOM 0 HD2 LYS A 733 -10.293 -6.996 -11.964 1.00 0.00 H new ATOM 0 HD3 LYS A 733 -10.809 -7.117 -10.294 1.00 0.00 H new ATOM 0 HE2 LYS A 733 -12.490 -7.638 -12.249 1.00 0.00 H new ATOM 0 HE3 LYS A 733 -13.039 -6.816 -10.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 733 -13.724 -5.831 -13.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 733 -13.048 -4.751 -11.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 733 -12.116 -5.315 -13.189 1.00 0.00 H new ATOM 303 N SER A 734 -10.880 -1.333 -9.586 1.00 0.00 N ATOM 304 CA SER A 734 -10.801 -0.079 -10.317 1.00 0.00 C ATOM 305 C SER A 734 -9.826 0.848 -9.621 1.00 0.00 C ATOM 306 O SER A 734 -8.941 1.406 -10.266 1.00 0.00 O ATOM 307 CB SER A 734 -12.177 0.578 -10.431 1.00 0.00 C ATOM 308 OG SER A 734 -12.121 1.745 -11.233 1.00 0.00 O ATOM 0 H SER A 734 -11.623 -1.366 -8.888 1.00 0.00 H new ATOM 0 HA SER A 734 -10.447 -0.283 -11.328 1.00 0.00 H new ATOM 0 HB2 SER A 734 -12.886 -0.129 -10.861 1.00 0.00 H new ATOM 0 HB3 SER A 734 -12.545 0.833 -9.437 1.00 0.00 H new ATOM 0 HG SER A 734 -13.014 2.145 -11.291 1.00 0.00 H new ATOM 314 N ILE A 735 -9.991 1.033 -8.302 1.00 0.00 N ATOM 315 CA ILE A 735 -9.060 1.866 -7.572 1.00 0.00 C ATOM 316 C ILE A 735 -7.671 1.381 -7.909 1.00 0.00 C ATOM 317 O ILE A 735 -6.912 2.083 -8.548 1.00 0.00 O ATOM 318 CB ILE A 735 -9.290 1.845 -6.047 1.00 0.00 C ATOM 319 CG1 ILE A 735 -10.674 2.396 -5.764 1.00 0.00 C ATOM 320 CG2 ILE A 735 -8.243 2.708 -5.337 1.00 0.00 C ATOM 321 CD1 ILE A 735 -11.750 1.368 -5.783 1.00 0.00 C ATOM 0 H ILE A 735 -10.741 0.625 -7.744 1.00 0.00 H new ATOM 0 HA ILE A 735 -9.206 2.904 -7.870 1.00 0.00 H new ATOM 0 HB ILE A 735 -9.203 0.823 -5.679 1.00 0.00 H new ATOM 0 HG12 ILE A 735 -10.668 2.883 -4.789 1.00 0.00 H new ATOM 0 HG13 ILE A 735 -10.906 3.164 -6.502 1.00 0.00 H new ATOM 0 HG21 ILE A 735 -8.419 2.683 -4.262 1.00 0.00 H new ATOM 0 HG22 ILE A 735 -7.247 2.321 -5.551 1.00 0.00 H new ATOM 0 HG23 ILE A 735 -8.317 3.736 -5.693 1.00 0.00 H new ATOM 0 HD11 ILE A 735 -12.709 1.841 -5.572 1.00 0.00 H new ATOM 0 HD12 ILE A 735 -11.786 0.897 -6.765 1.00 0.00 H new ATOM 0 HD13 ILE A 735 -11.544 0.612 -5.026 1.00 0.00 H new ATOM 333 N LEU A 736 -7.385 0.139 -7.539 1.00 0.00 N ATOM 334 CA LEU A 736 -6.105 -0.482 -7.842 1.00 0.00 C ATOM 335 C LEU A 736 -5.696 -0.162 -9.265 1.00 0.00 C ATOM 336 O LEU A 736 -4.649 0.419 -9.511 1.00 0.00 O ATOM 337 CB LEU A 736 -6.207 -1.997 -7.688 1.00 0.00 C ATOM 338 CG LEU A 736 -5.169 -2.614 -6.781 1.00 0.00 C ATOM 339 CD1 LEU A 736 -5.423 -4.082 -6.712 1.00 0.00 C ATOM 340 CD2 LEU A 736 -3.771 -2.292 -7.241 1.00 0.00 C ATOM 0 H LEU A 736 -8.029 -0.461 -7.024 1.00 0.00 H new ATOM 0 HA LEU A 736 -5.360 -0.092 -7.148 1.00 0.00 H new ATOM 0 HB2 LEU A 736 -7.197 -2.243 -7.304 1.00 0.00 H new ATOM 0 HB3 LEU A 736 -6.125 -2.454 -8.674 1.00 0.00 H new ATOM 0 HG LEU A 736 -5.251 -2.192 -5.779 1.00 0.00 H new ATOM 0 HD11 LEU A 736 -4.684 -4.549 -6.061 1.00 0.00 H new ATOM 0 HD12 LEU A 736 -6.422 -4.260 -6.313 1.00 0.00 H new ATOM 0 HD13 LEU A 736 -5.349 -4.511 -7.711 1.00 0.00 H new ATOM 0 HD21 LEU A 736 -3.050 -2.752 -6.565 1.00 0.00 H new ATOM 0 HD22 LEU A 736 -3.621 -2.679 -8.249 1.00 0.00 H new ATOM 0 HD23 LEU A 736 -3.628 -1.211 -7.242 1.00 0.00 H new ATOM 352 N GLN A 737 -6.549 -0.567 -10.190 1.00 0.00 N ATOM 353 CA GLN A 737 -6.330 -0.332 -11.614 1.00 0.00 C ATOM 354 C GLN A 737 -5.901 1.108 -11.878 1.00 0.00 C ATOM 355 O GLN A 737 -5.122 1.383 -12.789 1.00 0.00 O ATOM 356 CB GLN A 737 -7.619 -0.642 -12.383 1.00 0.00 C ATOM 357 CG GLN A 737 -7.673 -2.040 -12.966 1.00 0.00 C ATOM 358 CD GLN A 737 -8.815 -2.226 -13.943 1.00 0.00 C ATOM 359 OE1 GLN A 737 -9.860 -1.585 -13.826 1.00 0.00 O ATOM 360 NE2 GLN A 737 -8.623 -3.111 -14.915 1.00 0.00 N ATOM 0 H GLN A 737 -7.413 -1.067 -9.980 1.00 0.00 H new ATOM 0 HA GLN A 737 -5.528 -0.988 -11.954 1.00 0.00 H new ATOM 0 HB2 GLN A 737 -8.469 -0.506 -11.715 1.00 0.00 H new ATOM 0 HB3 GLN A 737 -7.730 0.081 -13.191 1.00 0.00 H new ATOM 0 HG2 GLN A 737 -6.731 -2.255 -13.471 1.00 0.00 H new ATOM 0 HG3 GLN A 737 -7.773 -2.763 -12.156 1.00 0.00 H new ATOM 0 HE21 GLN A 737 -7.741 -3.620 -14.974 1.00 0.00 H new ATOM 0 HE22 GLN A 737 -9.357 -3.281 -15.602 1.00 0.00 H new ATOM 369 N GLN A 738 -6.403 2.011 -11.055 1.00 0.00 N ATOM 370 CA GLN A 738 -6.114 3.434 -11.179 1.00 0.00 C ATOM 371 C GLN A 738 -4.810 3.818 -10.476 1.00 0.00 C ATOM 372 O GLN A 738 -3.900 4.364 -11.099 1.00 0.00 O ATOM 373 CB GLN A 738 -7.284 4.232 -10.606 1.00 0.00 C ATOM 374 CG GLN A 738 -8.524 4.161 -11.478 1.00 0.00 C ATOM 375 CD GLN A 738 -9.777 4.643 -10.773 1.00 0.00 C ATOM 376 OE1 GLN A 738 -9.861 4.387 -9.474 1.00 0.00 O flip ATOM 377 NE2 GLN A 738 -10.664 5.228 -11.393 1.00 0.00 N flip ATOM 0 H GLN A 738 -7.024 1.781 -10.279 1.00 0.00 H new ATOM 0 HA GLN A 738 -5.985 3.668 -12.236 1.00 0.00 H new ATOM 0 HB2 GLN A 738 -7.522 3.856 -9.611 1.00 0.00 H new ATOM 0 HB3 GLN A 738 -6.986 5.274 -10.490 1.00 0.00 H new ATOM 0 HG2 GLN A 738 -8.365 4.761 -12.374 1.00 0.00 H new ATOM 0 HG3 GLN A 738 -8.672 3.132 -11.805 1.00 0.00 H new ATOM 0 HE21 GLN A 738 -10.557 5.404 -12.392 1.00 0.00 H new ATOM 0 HE22 GLN A 738 -11.506 5.537 -10.908 1.00 0.00 H new ATOM 386 N VAL A 739 -4.734 3.536 -9.178 1.00 0.00 N ATOM 387 CA VAL A 739 -3.564 3.835 -8.383 1.00 0.00 C ATOM 388 C VAL A 739 -2.348 3.204 -9.025 1.00 0.00 C ATOM 389 O VAL A 739 -1.237 3.691 -8.890 1.00 0.00 O ATOM 390 CB VAL A 739 -3.710 3.277 -6.942 1.00 0.00 C ATOM 391 CG1 VAL A 739 -5.146 2.975 -6.580 1.00 0.00 C ATOM 392 CG2 VAL A 739 -2.839 2.059 -6.766 1.00 0.00 C ATOM 0 H VAL A 739 -5.488 3.093 -8.654 1.00 0.00 H new ATOM 0 HA VAL A 739 -3.454 4.918 -8.333 1.00 0.00 H new ATOM 0 HB VAL A 739 -3.376 4.055 -6.255 1.00 0.00 H new ATOM 0 HG11 VAL A 739 -5.191 2.588 -5.562 1.00 0.00 H new ATOM 0 HG12 VAL A 739 -5.738 3.888 -6.647 1.00 0.00 H new ATOM 0 HG13 VAL A 739 -5.546 2.231 -7.269 1.00 0.00 H new ATOM 0 HG21 VAL A 739 -2.950 1.676 -5.751 1.00 0.00 H new ATOM 0 HG22 VAL A 739 -3.140 1.291 -7.478 1.00 0.00 H new ATOM 0 HG23 VAL A 739 -1.797 2.328 -6.941 1.00 0.00 H new ATOM 402 N LYS A 740 -2.594 2.099 -9.706 1.00 0.00 N ATOM 403 CA LYS A 740 -1.555 1.349 -10.378 1.00 0.00 C ATOM 404 C LYS A 740 -1.264 1.968 -11.726 1.00 0.00 C ATOM 405 O LYS A 740 -0.116 2.018 -12.163 1.00 0.00 O ATOM 406 CB LYS A 740 -1.998 -0.100 -10.525 1.00 0.00 C ATOM 407 CG LYS A 740 -1.143 -0.927 -11.468 1.00 0.00 C ATOM 408 CD LYS A 740 -2.010 -1.792 -12.367 1.00 0.00 C ATOM 409 CE LYS A 740 -1.887 -3.264 -12.010 1.00 0.00 C ATOM 410 NZ LYS A 740 -0.487 -3.750 -12.147 1.00 0.00 N ATOM 0 H LYS A 740 -3.526 1.697 -9.807 1.00 0.00 H new ATOM 0 HA LYS A 740 -0.638 1.376 -9.790 1.00 0.00 H new ATOM 0 HB2 LYS A 740 -1.991 -0.570 -9.542 1.00 0.00 H new ATOM 0 HB3 LYS A 740 -3.029 -0.117 -10.880 1.00 0.00 H new ATOM 0 HG2 LYS A 740 -0.524 -0.268 -12.077 1.00 0.00 H new ATOM 0 HG3 LYS A 740 -0.466 -1.558 -10.893 1.00 0.00 H new ATOM 0 HD2 LYS A 740 -3.051 -1.481 -12.279 1.00 0.00 H new ATOM 0 HD3 LYS A 740 -1.720 -1.643 -13.407 1.00 0.00 H new ATOM 0 HE2 LYS A 740 -2.227 -3.420 -10.986 1.00 0.00 H new ATOM 0 HE3 LYS A 740 -2.540 -3.851 -12.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 740 -0.453 -4.519 -12.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 740 0.122 -2.969 -12.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 740 -0.150 -4.102 -11.228 1.00 0.00 H new ATOM 424 N SER A 741 -2.311 2.428 -12.393 1.00 0.00 N ATOM 425 CA SER A 741 -2.141 3.080 -13.674 1.00 0.00 C ATOM 426 C SER A 741 -1.556 4.463 -13.444 1.00 0.00 C ATOM 427 O SER A 741 -1.244 5.194 -14.385 1.00 0.00 O ATOM 428 CB SER A 741 -3.472 3.189 -14.408 1.00 0.00 C ATOM 429 OG SER A 741 -3.290 3.652 -15.735 1.00 0.00 O ATOM 0 H SER A 741 -3.276 2.361 -12.070 1.00 0.00 H new ATOM 0 HA SER A 741 -1.466 2.488 -14.292 1.00 0.00 H new ATOM 0 HB2 SER A 741 -3.962 2.216 -14.424 1.00 0.00 H new ATOM 0 HB3 SER A 741 -4.132 3.869 -13.870 1.00 0.00 H new ATOM 0 HG SER A 741 -2.525 4.263 -15.766 1.00 0.00 H new ATOM 435 N HIS A 742 -1.416 4.802 -12.166 1.00 0.00 N ATOM 436 CA HIS A 742 -0.882 6.088 -11.755 1.00 0.00 C ATOM 437 C HIS A 742 0.580 6.243 -12.171 1.00 0.00 C ATOM 438 O HIS A 742 1.371 5.305 -12.101 1.00 0.00 O ATOM 439 CB HIS A 742 -1.024 6.252 -10.231 1.00 0.00 C ATOM 440 CG HIS A 742 -0.632 7.608 -9.728 1.00 0.00 C ATOM 441 ND1 HIS A 742 0.306 8.407 -10.341 1.00 0.00 N ATOM 442 CD2 HIS A 742 -1.065 8.308 -8.663 1.00 0.00 C ATOM 443 CE1 HIS A 742 0.435 9.532 -9.680 1.00 0.00 C ATOM 444 NE2 HIS A 742 -0.389 9.504 -8.651 1.00 0.00 N ATOM 0 H HIS A 742 -1.670 4.191 -11.390 1.00 0.00 H new ATOM 0 HA HIS A 742 -1.454 6.869 -12.256 1.00 0.00 H new ATOM 0 HB2 HIS A 742 -2.058 6.056 -9.949 1.00 0.00 H new ATOM 0 HB3 HIS A 742 -0.410 5.500 -9.736 1.00 0.00 H new ATOM 0 HD2 HIS A 742 -1.808 7.988 -7.948 1.00 0.00 H new ATOM 0 HE1 HIS A 742 1.102 10.343 -9.935 1.00 0.00 H new ATOM 0 HE2 HIS A 742 -0.505 10.246 -7.961 1.00 0.00 H new ATOM 453 N GLN A 743 0.909 7.445 -12.625 1.00 0.00 N ATOM 454 CA GLN A 743 2.252 7.810 -13.039 1.00 0.00 C ATOM 455 C GLN A 743 3.277 7.605 -11.910 1.00 0.00 C ATOM 456 O GLN A 743 4.485 7.593 -12.150 1.00 0.00 O ATOM 457 CB GLN A 743 2.216 9.271 -13.476 1.00 0.00 C ATOM 458 CG GLN A 743 3.564 9.936 -13.471 1.00 0.00 C ATOM 459 CD GLN A 743 3.506 11.394 -13.883 1.00 0.00 C ATOM 460 OE1 GLN A 743 2.648 11.795 -14.668 1.00 0.00 O ATOM 461 NE2 GLN A 743 4.422 12.196 -13.352 1.00 0.00 N ATOM 0 H GLN A 743 0.236 8.206 -12.717 1.00 0.00 H new ATOM 0 HA GLN A 743 2.569 7.167 -13.860 1.00 0.00 H new ATOM 0 HB2 GLN A 743 1.795 9.331 -14.480 1.00 0.00 H new ATOM 0 HB3 GLN A 743 1.546 9.822 -12.816 1.00 0.00 H new ATOM 0 HG2 GLN A 743 3.995 9.863 -12.473 1.00 0.00 H new ATOM 0 HG3 GLN A 743 4.230 9.399 -14.146 1.00 0.00 H new ATOM 0 HE21 GLN A 743 5.115 11.820 -12.705 1.00 0.00 H new ATOM 0 HE22 GLN A 743 4.432 13.187 -13.591 1.00 0.00 H new ATOM 470 N SER A 744 2.785 7.432 -10.687 1.00 0.00 N ATOM 471 CA SER A 744 3.642 7.236 -9.515 1.00 0.00 C ATOM 472 C SER A 744 3.560 5.811 -9.028 1.00 0.00 C ATOM 473 O SER A 744 4.011 5.476 -7.934 1.00 0.00 O ATOM 474 CB SER A 744 3.203 8.175 -8.390 1.00 0.00 C ATOM 475 OG SER A 744 3.809 9.449 -8.518 1.00 0.00 O ATOM 0 H SER A 744 1.787 7.423 -10.477 1.00 0.00 H new ATOM 0 HA SER A 744 4.671 7.455 -9.802 1.00 0.00 H new ATOM 0 HB2 SER A 744 2.118 8.282 -8.405 1.00 0.00 H new ATOM 0 HB3 SER A 744 3.467 7.740 -7.426 1.00 0.00 H new ATOM 0 HG SER A 744 4.765 9.339 -8.702 1.00 0.00 H new ATOM 481 N ALA A 745 2.968 4.982 -9.846 1.00 0.00 N ATOM 482 CA ALA A 745 2.766 3.599 -9.502 1.00 0.00 C ATOM 483 C ALA A 745 3.744 2.643 -10.160 1.00 0.00 C ATOM 484 O ALA A 745 3.636 1.446 -9.952 1.00 0.00 O ATOM 485 CB ALA A 745 1.350 3.234 -9.884 1.00 0.00 C ATOM 0 H ALA A 745 2.613 5.244 -10.766 1.00 0.00 H new ATOM 0 HA ALA A 745 2.942 3.496 -8.431 1.00 0.00 H new ATOM 0 HB1 ALA A 745 1.164 2.189 -9.636 1.00 0.00 H new ATOM 0 HB2 ALA A 745 0.651 3.867 -9.337 1.00 0.00 H new ATOM 0 HB3 ALA A 745 1.212 3.382 -10.955 1.00 0.00 H new ATOM 491 N TRP A 746 4.695 3.130 -10.939 1.00 0.00 N ATOM 492 CA TRP A 746 5.607 2.210 -11.607 1.00 0.00 C ATOM 493 C TRP A 746 6.519 1.435 -10.640 1.00 0.00 C ATOM 494 O TRP A 746 6.831 0.275 -10.915 1.00 0.00 O ATOM 495 CB TRP A 746 6.404 2.893 -12.714 1.00 0.00 C ATOM 496 CG TRP A 746 7.063 4.174 -12.327 1.00 0.00 C ATOM 497 CD1 TRP A 746 6.530 5.428 -12.407 1.00 0.00 C ATOM 498 CD2 TRP A 746 8.386 4.328 -11.815 1.00 0.00 C ATOM 499 NE1 TRP A 746 7.458 6.360 -12.000 1.00 0.00 N ATOM 500 CE2 TRP A 746 8.605 5.706 -11.626 1.00 0.00 C ATOM 501 CE3 TRP A 746 9.407 3.429 -11.500 1.00 0.00 C ATOM 502 CZ2 TRP A 746 9.815 6.201 -11.139 1.00 0.00 C ATOM 503 CZ3 TRP A 746 10.596 3.927 -11.012 1.00 0.00 C ATOM 504 CH2 TRP A 746 10.785 5.301 -10.840 1.00 0.00 C ATOM 0 H TRP A 746 4.856 4.120 -11.122 1.00 0.00 H new ATOM 0 HA TRP A 746 4.970 1.461 -12.077 1.00 0.00 H new ATOM 0 HB2 TRP A 746 7.169 2.202 -13.067 1.00 0.00 H new ATOM 0 HB3 TRP A 746 5.736 3.086 -13.554 1.00 0.00 H new ATOM 0 HD1 TRP A 746 5.528 5.656 -12.740 1.00 0.00 H new ATOM 0 HE1 TRP A 746 7.316 7.370 -11.980 1.00 0.00 H new ATOM 0 HE3 TRP A 746 9.268 2.367 -11.636 1.00 0.00 H new ATOM 0 HZ2 TRP A 746 9.974 7.261 -11.005 1.00 0.00 H new ATOM 0 HZ3 TRP A 746 11.394 3.245 -10.759 1.00 0.00 H new ATOM 0 HH2 TRP A 746 11.731 5.657 -10.458 1.00 0.00 H new ATOM 515 N PRO A 747 6.975 2.018 -9.504 1.00 0.00 N ATOM 516 CA PRO A 747 7.804 1.273 -8.564 1.00 0.00 C ATOM 517 C PRO A 747 6.978 0.234 -7.841 1.00 0.00 C ATOM 518 O PRO A 747 7.509 -0.645 -7.160 1.00 0.00 O ATOM 519 CB PRO A 747 8.301 2.311 -7.559 1.00 0.00 C ATOM 520 CG PRO A 747 7.736 3.625 -7.964 1.00 0.00 C ATOM 521 CD PRO A 747 6.721 3.392 -9.044 1.00 0.00 C ATOM 0 HA PRO A 747 8.618 0.755 -9.071 1.00 0.00 H new ATOM 0 HB2 PRO A 747 7.983 2.051 -6.549 1.00 0.00 H new ATOM 0 HB3 PRO A 747 9.390 2.347 -7.551 1.00 0.00 H new ATOM 0 HG2 PRO A 747 7.274 4.119 -7.109 1.00 0.00 H new ATOM 0 HG3 PRO A 747 8.527 4.284 -8.323 1.00 0.00 H new ATOM 0 HD2 PRO A 747 5.705 3.501 -8.663 1.00 0.00 H new ATOM 0 HD3 PRO A 747 6.835 4.109 -9.857 1.00 0.00 H new ATOM 529 N PHE A 748 5.666 0.347 -8.000 1.00 0.00 N ATOM 530 CA PHE A 748 4.739 -0.550 -7.339 1.00 0.00 C ATOM 531 C PHE A 748 3.934 -1.358 -8.357 1.00 0.00 C ATOM 532 O PHE A 748 3.340 -2.373 -8.017 1.00 0.00 O ATOM 533 CB PHE A 748 3.797 0.250 -6.430 1.00 0.00 C ATOM 534 CG PHE A 748 4.412 1.472 -5.821 1.00 0.00 C ATOM 535 CD1 PHE A 748 5.714 1.463 -5.411 1.00 0.00 C ATOM 536 CD2 PHE A 748 3.688 2.637 -5.682 1.00 0.00 C ATOM 537 CE1 PHE A 748 6.299 2.581 -4.871 1.00 0.00 C ATOM 538 CE2 PHE A 748 4.275 3.768 -5.140 1.00 0.00 C ATOM 539 CZ PHE A 748 5.576 3.734 -4.738 1.00 0.00 C ATOM 0 H PHE A 748 5.222 1.056 -8.584 1.00 0.00 H new ATOM 0 HA PHE A 748 5.313 -1.251 -6.733 1.00 0.00 H new ATOM 0 HB2 PHE A 748 2.922 0.548 -7.007 1.00 0.00 H new ATOM 0 HB3 PHE A 748 3.444 -0.401 -5.630 1.00 0.00 H new ATOM 0 HD1 PHE A 748 6.295 0.558 -5.514 1.00 0.00 H new ATOM 0 HD2 PHE A 748 2.656 2.668 -5.998 1.00 0.00 H new ATOM 0 HE1 PHE A 748 7.330 2.550 -4.551 1.00 0.00 H new ATOM 0 HE2 PHE A 748 3.701 4.677 -5.036 1.00 0.00 H new ATOM 0 HZ PHE A 748 6.035 4.615 -4.315 1.00 0.00 H new ATOM 549 N MET A 749 3.934 -0.907 -9.615 1.00 0.00 N ATOM 550 CA MET A 749 3.163 -1.565 -10.674 1.00 0.00 C ATOM 551 C MET A 749 3.349 -3.065 -10.618 1.00 0.00 C ATOM 552 O MET A 749 2.434 -3.840 -10.894 1.00 0.00 O ATOM 553 CB MET A 749 3.556 -1.022 -12.037 1.00 0.00 C ATOM 554 CG MET A 749 2.644 0.098 -12.441 1.00 0.00 C ATOM 555 SD MET A 749 3.278 1.132 -13.757 1.00 0.00 S ATOM 556 CE MET A 749 2.531 2.650 -13.205 1.00 0.00 C ATOM 0 H MET A 749 4.459 -0.089 -9.925 1.00 0.00 H new ATOM 0 HA MET A 749 2.107 -1.349 -10.513 1.00 0.00 H new ATOM 0 HB2 MET A 749 4.586 -0.668 -12.010 1.00 0.00 H new ATOM 0 HB3 MET A 749 3.512 -1.820 -12.779 1.00 0.00 H new ATOM 0 HG2 MET A 749 1.689 -0.323 -12.755 1.00 0.00 H new ATOM 0 HG3 MET A 749 2.446 0.722 -11.569 1.00 0.00 H new ATOM 0 HE1 MET A 749 1.691 2.899 -13.854 1.00 0.00 H new ATOM 0 HE2 MET A 749 2.176 2.530 -12.182 1.00 0.00 H new ATOM 0 HE3 MET A 749 3.268 3.452 -13.241 1.00 0.00 H new ATOM 566 N GLU A 750 4.555 -3.447 -10.261 1.00 0.00 N ATOM 567 CA GLU A 750 4.927 -4.830 -10.112 1.00 0.00 C ATOM 568 C GLU A 750 6.033 -4.931 -9.086 1.00 0.00 C ATOM 569 O GLU A 750 6.812 -3.995 -8.908 1.00 0.00 O ATOM 570 CB GLU A 750 5.334 -5.432 -11.445 1.00 0.00 C ATOM 571 CG GLU A 750 6.647 -6.177 -11.405 1.00 0.00 C ATOM 572 CD GLU A 750 6.888 -7.017 -12.643 1.00 0.00 C ATOM 573 OE1 GLU A 750 7.481 -6.495 -13.610 1.00 0.00 O ATOM 574 OE2 GLU A 750 6.485 -8.200 -12.645 1.00 0.00 O ATOM 0 H GLU A 750 5.313 -2.794 -10.064 1.00 0.00 H new ATOM 0 HA GLU A 750 4.070 -5.405 -9.762 1.00 0.00 H new ATOM 0 HB2 GLU A 750 4.551 -6.113 -11.779 1.00 0.00 H new ATOM 0 HB3 GLU A 750 5.402 -4.636 -12.186 1.00 0.00 H new ATOM 0 HG2 GLU A 750 7.462 -5.461 -11.294 1.00 0.00 H new ATOM 0 HG3 GLU A 750 6.667 -6.821 -10.526 1.00 0.00 H new ATOM 581 N PRO A 751 6.122 -6.067 -8.394 1.00 0.00 N ATOM 582 CA PRO A 751 7.123 -6.261 -7.360 1.00 0.00 C ATOM 583 C PRO A 751 8.518 -6.157 -7.911 1.00 0.00 C ATOM 584 O PRO A 751 8.790 -6.545 -9.047 1.00 0.00 O ATOM 585 CB PRO A 751 6.838 -7.650 -6.822 1.00 0.00 C ATOM 586 CG PRO A 751 5.444 -7.916 -7.237 1.00 0.00 C ATOM 587 CD PRO A 751 5.301 -7.264 -8.577 1.00 0.00 C ATOM 0 HA PRO A 751 7.069 -5.497 -6.585 1.00 0.00 H new ATOM 0 HB2 PRO A 751 7.525 -8.387 -7.237 1.00 0.00 H new ATOM 0 HB3 PRO A 751 6.946 -7.688 -5.738 1.00 0.00 H new ATOM 0 HG2 PRO A 751 5.249 -8.987 -7.297 1.00 0.00 H new ATOM 0 HG3 PRO A 751 4.734 -7.503 -6.520 1.00 0.00 H new ATOM 0 HD2 PRO A 751 5.669 -7.897 -9.385 1.00 0.00 H new ATOM 0 HD3 PRO A 751 4.264 -7.021 -8.809 1.00 0.00 H new ATOM 595 N VAL A 752 9.396 -5.629 -7.092 1.00 0.00 N ATOM 596 CA VAL A 752 10.772 -5.436 -7.490 1.00 0.00 C ATOM 597 C VAL A 752 11.466 -6.783 -7.633 1.00 0.00 C ATOM 598 O VAL A 752 10.874 -7.826 -7.355 1.00 0.00 O ATOM 599 CB VAL A 752 11.515 -4.485 -6.517 1.00 0.00 C ATOM 600 CG1 VAL A 752 10.538 -3.780 -5.612 1.00 0.00 C ATOM 601 CG2 VAL A 752 12.588 -5.181 -5.694 1.00 0.00 C ATOM 0 H VAL A 752 9.182 -5.324 -6.142 1.00 0.00 H new ATOM 0 HA VAL A 752 10.792 -4.948 -8.464 1.00 0.00 H new ATOM 0 HB VAL A 752 12.027 -3.753 -7.141 1.00 0.00 H new ATOM 0 HG11 VAL A 752 11.080 -3.118 -4.937 1.00 0.00 H new ATOM 0 HG12 VAL A 752 9.842 -3.195 -6.213 1.00 0.00 H new ATOM 0 HG13 VAL A 752 9.984 -4.517 -5.030 1.00 0.00 H new ATOM 0 HG21 VAL A 752 13.068 -4.457 -5.035 1.00 0.00 H new ATOM 0 HG22 VAL A 752 12.133 -5.970 -5.096 1.00 0.00 H new ATOM 0 HG23 VAL A 752 13.334 -5.615 -6.360 1.00 0.00 H new ATOM 611 N LYS A 753 12.714 -6.761 -8.060 1.00 0.00 N ATOM 612 CA LYS A 753 13.461 -7.998 -8.286 1.00 0.00 C ATOM 613 C LYS A 753 13.863 -8.662 -6.982 1.00 0.00 C ATOM 614 O LYS A 753 14.648 -9.612 -6.984 1.00 0.00 O ATOM 615 CB LYS A 753 14.721 -7.708 -9.092 1.00 0.00 C ATOM 616 CG LYS A 753 14.466 -6.880 -10.334 1.00 0.00 C ATOM 617 CD LYS A 753 14.120 -7.747 -11.530 1.00 0.00 C ATOM 618 CE LYS A 753 14.180 -6.944 -12.815 1.00 0.00 C ATOM 619 NZ LYS A 753 14.034 -7.806 -14.020 1.00 0.00 N ATOM 0 H LYS A 753 13.236 -5.908 -8.259 1.00 0.00 H new ATOM 0 HA LYS A 753 12.804 -8.674 -8.834 1.00 0.00 H new ATOM 0 HB2 LYS A 753 15.437 -7.186 -8.457 1.00 0.00 H new ATOM 0 HB3 LYS A 753 15.182 -8.652 -9.383 1.00 0.00 H new ATOM 0 HG2 LYS A 753 13.651 -6.182 -10.144 1.00 0.00 H new ATOM 0 HG3 LYS A 753 15.350 -6.284 -10.561 1.00 0.00 H new ATOM 0 HD2 LYS A 753 14.813 -8.587 -11.588 1.00 0.00 H new ATOM 0 HD3 LYS A 753 13.122 -8.166 -11.404 1.00 0.00 H new ATOM 0 HE2 LYS A 753 13.391 -6.192 -12.810 1.00 0.00 H new ATOM 0 HE3 LYS A 753 15.129 -6.410 -12.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 753 14.081 -7.217 -14.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 753 14.802 -8.507 -14.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 753 13.118 -8.297 -13.987 1.00 0.00 H new ATOM 633 N ARG A 754 13.328 -8.160 -5.875 1.00 0.00 N ATOM 634 CA ARG A 754 13.675 -8.663 -4.551 1.00 0.00 C ATOM 635 C ARG A 754 15.109 -8.280 -4.233 1.00 0.00 C ATOM 636 O ARG A 754 15.518 -8.250 -3.072 1.00 0.00 O ATOM 637 CB ARG A 754 13.506 -10.179 -4.456 1.00 0.00 C ATOM 638 CG ARG A 754 13.641 -10.717 -3.040 1.00 0.00 C ATOM 639 CD ARG A 754 13.439 -12.223 -2.996 1.00 0.00 C ATOM 640 NE ARG A 754 13.660 -12.767 -1.659 1.00 0.00 N ATOM 641 CZ ARG A 754 13.846 -14.061 -1.410 1.00 0.00 C ATOM 642 NH1 ARG A 754 13.841 -14.938 -2.404 1.00 0.00 N ATOM 643 NH2 ARG A 754 14.037 -14.477 -0.166 1.00 0.00 N ATOM 0 H ARG A 754 12.648 -7.400 -5.869 1.00 0.00 H new ATOM 0 HA ARG A 754 12.996 -8.214 -3.826 1.00 0.00 H new ATOM 0 HB2 ARG A 754 12.527 -10.453 -4.848 1.00 0.00 H new ATOM 0 HB3 ARG A 754 14.250 -10.660 -5.091 1.00 0.00 H new ATOM 0 HG2 ARG A 754 14.627 -10.469 -2.648 1.00 0.00 H new ATOM 0 HG3 ARG A 754 12.910 -10.231 -2.394 1.00 0.00 H new ATOM 0 HD2 ARG A 754 12.427 -12.462 -3.322 1.00 0.00 H new ATOM 0 HD3 ARG A 754 14.121 -12.701 -3.699 1.00 0.00 H new ATOM 0 HE ARG A 754 13.673 -12.119 -0.872 1.00 0.00 H new ATOM 0 HH11 ARG A 754 13.694 -14.622 -3.363 1.00 0.00 H new ATOM 0 HH12 ARG A 754 13.984 -15.929 -2.210 1.00 0.00 H new ATOM 0 HH21 ARG A 754 14.041 -13.805 0.601 1.00 0.00 H new ATOM 0 HH22 ARG A 754 14.179 -15.469 0.024 1.00 0.00 H new ATOM 657 N THR A 755 15.868 -7.984 -5.286 1.00 0.00 N ATOM 658 CA THR A 755 17.249 -7.593 -5.147 1.00 0.00 C ATOM 659 C THR A 755 17.524 -6.336 -5.960 1.00 0.00 C ATOM 660 O THR A 755 18.624 -5.784 -5.925 1.00 0.00 O ATOM 661 CB THR A 755 18.205 -8.714 -5.557 1.00 0.00 C ATOM 662 OG1 THR A 755 18.261 -8.827 -6.984 1.00 0.00 O ATOM 663 CG2 THR A 755 17.749 -10.030 -4.951 1.00 0.00 C ATOM 0 H THR A 755 15.536 -8.011 -6.250 1.00 0.00 H new ATOM 0 HA THR A 755 17.427 -7.384 -4.092 1.00 0.00 H new ATOM 0 HB THR A 755 19.202 -8.475 -5.187 1.00 0.00 H new ATOM 0 HG1 THR A 755 18.878 -9.547 -7.231 1.00 0.00 H new ATOM 0 HG21 THR A 755 18.435 -10.824 -5.247 1.00 0.00 H new ATOM 0 HG22 THR A 755 17.739 -9.946 -3.864 1.00 0.00 H new ATOM 0 HG23 THR A 755 16.746 -10.266 -5.306 1.00 0.00 H new ATOM 671 N GLU A 756 16.504 -5.900 -6.699 1.00 0.00 N ATOM 672 CA GLU A 756 16.558 -4.684 -7.451 1.00 0.00 C ATOM 673 C GLU A 756 16.764 -3.659 -6.416 1.00 0.00 C ATOM 674 O GLU A 756 17.504 -2.682 -6.527 1.00 0.00 O ATOM 675 CB GLU A 756 15.192 -4.498 -8.021 1.00 0.00 C ATOM 676 CG GLU A 756 15.081 -3.435 -9.024 1.00 0.00 C ATOM 677 CD GLU A 756 15.725 -3.788 -10.351 1.00 0.00 C ATOM 678 OE1 GLU A 756 16.968 -3.715 -10.446 1.00 0.00 O ATOM 679 OE2 GLU A 756 14.986 -4.136 -11.295 1.00 0.00 O ATOM 0 H GLU A 756 15.618 -6.398 -6.782 1.00 0.00 H new ATOM 0 HA GLU A 756 17.313 -4.658 -8.237 1.00 0.00 H new ATOM 0 HB2 GLU A 756 14.871 -5.437 -8.471 1.00 0.00 H new ATOM 0 HB3 GLU A 756 14.501 -4.282 -7.206 1.00 0.00 H new ATOM 0 HG2 GLU A 756 14.027 -3.210 -9.189 1.00 0.00 H new ATOM 0 HG3 GLU A 756 15.544 -2.528 -8.634 1.00 0.00 H new ATOM 686 N ALA A 757 16.036 -3.987 -5.387 1.00 0.00 N ATOM 687 CA ALA A 757 15.969 -3.287 -4.182 1.00 0.00 C ATOM 688 C ALA A 757 16.856 -3.991 -3.181 1.00 0.00 C ATOM 689 O ALA A 757 16.538 -5.056 -2.660 1.00 0.00 O ATOM 690 CB ALA A 757 14.546 -3.283 -3.784 1.00 0.00 C ATOM 0 H ALA A 757 15.439 -4.814 -5.391 1.00 0.00 H new ATOM 0 HA ALA A 757 16.319 -2.257 -4.255 1.00 0.00 H new ATOM 0 HB1 ALA A 757 14.433 -2.746 -2.842 1.00 0.00 H new ATOM 0 HB2 ALA A 757 13.954 -2.791 -4.556 1.00 0.00 H new ATOM 0 HB3 ALA A 757 14.200 -4.309 -3.660 1.00 0.00 H new ATOM 696 N PRO A 758 18.001 -3.397 -2.953 1.00 0.00 N ATOM 697 CA PRO A 758 19.020 -3.931 -2.061 1.00 0.00 C ATOM 698 C PRO A 758 18.573 -3.955 -0.608 1.00 0.00 C ATOM 699 O PRO A 758 18.429 -2.915 0.034 1.00 0.00 O ATOM 700 CB PRO A 758 20.200 -2.985 -2.284 1.00 0.00 C ATOM 701 CG PRO A 758 19.594 -1.721 -2.802 1.00 0.00 C ATOM 702 CD PRO A 758 18.364 -2.116 -3.548 1.00 0.00 C ATOM 0 HA PRO A 758 19.259 -4.973 -2.273 1.00 0.00 H new ATOM 0 HB2 PRO A 758 20.745 -2.810 -1.357 1.00 0.00 H new ATOM 0 HB3 PRO A 758 20.911 -3.403 -2.997 1.00 0.00 H new ATOM 0 HG2 PRO A 758 19.351 -1.044 -1.983 1.00 0.00 H new ATOM 0 HG3 PRO A 758 20.291 -1.195 -3.454 1.00 0.00 H new ATOM 0 HD2 PRO A 758 17.569 -1.379 -3.430 1.00 0.00 H new ATOM 0 HD3 PRO A 758 18.556 -2.210 -4.617 1.00 0.00 H new ATOM 710 N GLY A 759 18.374 -5.163 -0.093 1.00 0.00 N ATOM 711 CA GLY A 759 17.912 -5.320 1.268 1.00 0.00 C ATOM 712 C GLY A 759 16.418 -5.117 1.345 1.00 0.00 C ATOM 713 O GLY A 759 15.845 -5.051 2.424 1.00 0.00 O ATOM 0 H GLY A 759 18.526 -6.037 -0.597 1.00 0.00 H new ATOM 0 HA2 GLY A 759 18.169 -6.314 1.633 1.00 0.00 H new ATOM 0 HA3 GLY A 759 18.416 -4.602 1.915 1.00 0.00 H new ATOM 717 N TYR A 760 15.799 -5.028 0.170 1.00 0.00 N ATOM 718 CA TYR A 760 14.363 -4.820 0.030 1.00 0.00 C ATOM 719 C TYR A 760 13.529 -5.641 1.002 1.00 0.00 C ATOM 720 O TYR A 760 12.733 -5.105 1.753 1.00 0.00 O ATOM 721 CB TYR A 760 14.018 -5.192 -1.401 1.00 0.00 C ATOM 722 CG TYR A 760 12.582 -5.045 -1.816 1.00 0.00 C ATOM 723 CD1 TYR A 760 11.822 -4.002 -1.365 1.00 0.00 C ATOM 724 CD2 TYR A 760 12.004 -5.941 -2.694 1.00 0.00 C ATOM 725 CE1 TYR A 760 10.524 -3.842 -1.765 1.00 0.00 C ATOM 726 CE2 TYR A 760 10.694 -5.793 -3.103 1.00 0.00 C ATOM 727 CZ TYR A 760 9.958 -4.738 -2.634 1.00 0.00 C ATOM 728 OH TYR A 760 8.653 -4.576 -3.037 1.00 0.00 O ATOM 0 H TYR A 760 16.289 -5.099 -0.722 1.00 0.00 H new ATOM 0 HA TYR A 760 14.128 -3.781 0.262 1.00 0.00 H new ATOM 0 HB2 TYR A 760 14.627 -4.580 -2.066 1.00 0.00 H new ATOM 0 HB3 TYR A 760 14.313 -6.229 -1.562 1.00 0.00 H new ATOM 0 HD1 TYR A 760 12.256 -3.290 -0.679 1.00 0.00 H new ATOM 0 HD2 TYR A 760 12.586 -6.771 -3.066 1.00 0.00 H new ATOM 0 HE1 TYR A 760 9.944 -3.009 -1.396 1.00 0.00 H new ATOM 0 HE2 TYR A 760 10.253 -6.503 -3.787 1.00 0.00 H new ATOM 0 HH TYR A 760 8.409 -5.297 -3.654 1.00 0.00 H new ATOM 738 N TYR A 761 13.692 -6.938 0.962 1.00 0.00 N ATOM 739 CA TYR A 761 12.924 -7.821 1.832 1.00 0.00 C ATOM 740 C TYR A 761 13.332 -7.718 3.295 1.00 0.00 C ATOM 741 O TYR A 761 12.597 -8.150 4.184 1.00 0.00 O ATOM 742 CB TYR A 761 12.995 -9.250 1.317 1.00 0.00 C ATOM 743 CG TYR A 761 11.933 -9.498 0.279 1.00 0.00 C ATOM 744 CD1 TYR A 761 11.683 -8.530 -0.673 1.00 0.00 C ATOM 745 CD2 TYR A 761 11.150 -10.644 0.279 1.00 0.00 C ATOM 746 CE1 TYR A 761 10.689 -8.682 -1.610 1.00 0.00 C ATOM 747 CE2 TYR A 761 10.152 -10.817 -0.666 1.00 0.00 C ATOM 748 CZ TYR A 761 9.925 -9.831 -1.608 1.00 0.00 C ATOM 749 OH TYR A 761 8.927 -9.991 -2.543 1.00 0.00 O ATOM 0 H TYR A 761 14.346 -7.415 0.341 1.00 0.00 H new ATOM 0 HA TYR A 761 11.885 -7.492 1.800 1.00 0.00 H new ATOM 0 HB2 TYR A 761 13.979 -9.438 0.889 1.00 0.00 H new ATOM 0 HB3 TYR A 761 12.869 -9.947 2.146 1.00 0.00 H new ATOM 0 HD1 TYR A 761 12.283 -7.632 -0.682 1.00 0.00 H new ATOM 0 HD2 TYR A 761 11.320 -11.408 1.023 1.00 0.00 H new ATOM 0 HE1 TYR A 761 10.507 -7.909 -2.342 1.00 0.00 H new ATOM 0 HE2 TYR A 761 9.555 -11.717 -0.667 1.00 0.00 H new ATOM 0 HH TYR A 761 8.485 -10.855 -2.405 1.00 0.00 H new ATOM 759 N GLU A 762 14.495 -7.147 3.541 1.00 0.00 N ATOM 760 CA GLU A 762 14.988 -6.970 4.902 1.00 0.00 C ATOM 761 C GLU A 762 14.389 -5.693 5.495 1.00 0.00 C ATOM 762 O GLU A 762 13.847 -5.681 6.600 1.00 0.00 O ATOM 763 CB GLU A 762 16.520 -6.896 4.885 1.00 0.00 C ATOM 764 CG GLU A 762 17.085 -5.607 5.458 1.00 0.00 C ATOM 765 CD GLU A 762 18.545 -5.727 5.848 1.00 0.00 C ATOM 766 OE1 GLU A 762 18.822 -6.202 6.970 1.00 0.00 O ATOM 767 OE2 GLU A 762 19.412 -5.349 5.033 1.00 0.00 O ATOM 0 H GLU A 762 15.121 -6.795 2.817 1.00 0.00 H new ATOM 0 HA GLU A 762 14.689 -7.816 5.521 1.00 0.00 H new ATOM 0 HB2 GLU A 762 16.920 -7.738 5.450 1.00 0.00 H new ATOM 0 HB3 GLU A 762 16.867 -7.007 3.858 1.00 0.00 H new ATOM 0 HG2 GLU A 762 16.974 -4.809 4.724 1.00 0.00 H new ATOM 0 HG3 GLU A 762 16.503 -5.318 6.333 1.00 0.00 H new ATOM 774 N VAL A 763 14.509 -4.630 4.718 1.00 0.00 N ATOM 775 CA VAL A 763 14.007 -3.311 5.058 1.00 0.00 C ATOM 776 C VAL A 763 12.501 -3.302 5.024 1.00 0.00 C ATOM 777 O VAL A 763 11.838 -2.666 5.844 1.00 0.00 O ATOM 778 CB VAL A 763 14.514 -2.290 4.024 1.00 0.00 C ATOM 779 CG1 VAL A 763 14.124 -2.710 2.645 1.00 0.00 C ATOM 780 CG2 VAL A 763 13.920 -0.941 4.215 1.00 0.00 C ATOM 0 H VAL A 763 14.971 -4.662 3.809 1.00 0.00 H new ATOM 0 HA VAL A 763 14.356 -3.053 6.058 1.00 0.00 H new ATOM 0 HB VAL A 763 15.595 -2.250 4.158 1.00 0.00 H new ATOM 0 HG11 VAL A 763 14.490 -1.978 1.925 1.00 0.00 H new ATOM 0 HG12 VAL A 763 14.559 -3.685 2.425 1.00 0.00 H new ATOM 0 HG13 VAL A 763 13.038 -2.774 2.578 1.00 0.00 H new ATOM 0 HG21 VAL A 763 14.312 -0.260 3.459 1.00 0.00 H new ATOM 0 HG22 VAL A 763 12.836 -1.004 4.119 1.00 0.00 H new ATOM 0 HG23 VAL A 763 14.176 -0.568 5.207 1.00 0.00 H new ATOM 790 N ILE A 764 11.979 -4.022 4.058 1.00 0.00 N ATOM 791 CA ILE A 764 10.563 -4.103 3.857 1.00 0.00 C ATOM 792 C ILE A 764 9.983 -5.380 4.411 1.00 0.00 C ATOM 793 O ILE A 764 9.894 -6.387 3.712 1.00 0.00 O ATOM 794 CB ILE A 764 10.215 -4.045 2.394 1.00 0.00 C ATOM 795 CG1 ILE A 764 10.924 -2.890 1.713 1.00 0.00 C ATOM 796 CG2 ILE A 764 8.739 -3.885 2.263 1.00 0.00 C ATOM 797 CD1 ILE A 764 10.237 -1.554 1.844 1.00 0.00 C ATOM 0 H ILE A 764 12.530 -4.565 3.393 1.00 0.00 H new ATOM 0 HA ILE A 764 10.139 -3.249 4.385 1.00 0.00 H new ATOM 0 HB ILE A 764 10.539 -4.967 1.911 1.00 0.00 H new ATOM 0 HG12 ILE A 764 11.929 -2.807 2.126 1.00 0.00 H new ATOM 0 HG13 ILE A 764 11.032 -3.124 0.654 1.00 0.00 H new ATOM 0 HG21 ILE A 764 8.470 -3.841 1.208 1.00 0.00 H new ATOM 0 HG22 ILE A 764 8.238 -4.733 2.730 1.00 0.00 H new ATOM 0 HG23 ILE A 764 8.428 -2.964 2.755 1.00 0.00 H new ATOM 0 HD11 ILE A 764 10.820 -0.793 1.325 1.00 0.00 H new ATOM 0 HD12 ILE A 764 9.242 -1.612 1.404 1.00 0.00 H new ATOM 0 HD13 ILE A 764 10.153 -1.290 2.898 1.00 0.00 H new ATOM 809 N ARG A 765 9.629 -5.347 5.673 1.00 0.00 N ATOM 810 CA ARG A 765 9.009 -6.494 6.306 1.00 0.00 C ATOM 811 C ARG A 765 7.871 -7.037 5.437 1.00 0.00 C ATOM 812 O ARG A 765 7.665 -8.249 5.359 1.00 0.00 O ATOM 813 CB ARG A 765 8.472 -6.097 7.667 1.00 0.00 C ATOM 814 CG ARG A 765 8.682 -7.138 8.748 1.00 0.00 C ATOM 815 CD ARG A 765 8.109 -8.485 8.356 1.00 0.00 C ATOM 816 NE ARG A 765 9.116 -9.360 7.762 1.00 0.00 N ATOM 817 CZ ARG A 765 8.932 -10.660 7.556 1.00 0.00 C ATOM 818 NH1 ARG A 765 7.784 -11.234 7.896 1.00 0.00 N ATOM 819 NH2 ARG A 765 9.896 -11.390 7.011 1.00 0.00 N ATOM 0 H ARG A 765 9.758 -4.541 6.284 1.00 0.00 H new ATOM 0 HA ARG A 765 9.759 -7.276 6.425 1.00 0.00 H new ATOM 0 HB2 ARG A 765 8.950 -5.168 7.976 1.00 0.00 H new ATOM 0 HB3 ARG A 765 7.405 -5.893 7.578 1.00 0.00 H new ATOM 0 HG2 ARG A 765 9.748 -7.242 8.949 1.00 0.00 H new ATOM 0 HG3 ARG A 765 8.214 -6.800 9.673 1.00 0.00 H new ATOM 0 HD2 ARG A 765 7.684 -8.968 9.236 1.00 0.00 H new ATOM 0 HD3 ARG A 765 7.293 -8.339 7.648 1.00 0.00 H new ATOM 0 HE ARG A 765 10.010 -8.951 7.490 1.00 0.00 H new ATOM 0 HH11 ARG A 765 7.040 -10.677 8.317 1.00 0.00 H new ATOM 0 HH12 ARG A 765 7.646 -12.232 7.737 1.00 0.00 H new ATOM 0 HH21 ARG A 765 10.780 -10.954 6.749 1.00 0.00 H new ATOM 0 HH22 ARG A 765 9.753 -12.388 6.854 1.00 0.00 H new ATOM 833 N PHE A 766 7.134 -6.133 4.780 1.00 0.00 N ATOM 834 CA PHE A 766 6.007 -6.542 3.928 1.00 0.00 C ATOM 835 C PHE A 766 5.971 -5.805 2.575 1.00 0.00 C ATOM 836 O PHE A 766 5.199 -4.862 2.404 1.00 0.00 O ATOM 837 CB PHE A 766 4.675 -6.309 4.650 1.00 0.00 C ATOM 838 CG PHE A 766 4.800 -5.973 6.107 1.00 0.00 C ATOM 839 CD1 PHE A 766 5.185 -6.936 7.015 1.00 0.00 C ATOM 840 CD2 PHE A 766 4.511 -4.699 6.569 1.00 0.00 C ATOM 841 CE1 PHE A 766 5.285 -6.643 8.359 1.00 0.00 C ATOM 842 CE2 PHE A 766 4.612 -4.394 7.911 1.00 0.00 C ATOM 843 CZ PHE A 766 4.999 -5.368 8.809 1.00 0.00 C ATOM 0 H PHE A 766 7.293 -5.126 4.819 1.00 0.00 H new ATOM 0 HA PHE A 766 6.154 -7.603 3.727 1.00 0.00 H new ATOM 0 HB2 PHE A 766 4.143 -5.500 4.149 1.00 0.00 H new ATOM 0 HB3 PHE A 766 4.062 -7.204 4.549 1.00 0.00 H new ATOM 0 HD1 PHE A 766 5.411 -7.934 6.669 1.00 0.00 H new ATOM 0 HD2 PHE A 766 4.203 -3.935 5.870 1.00 0.00 H new ATOM 0 HE1 PHE A 766 5.586 -7.409 9.059 1.00 0.00 H new ATOM 0 HE2 PHE A 766 4.389 -3.396 8.258 1.00 0.00 H new ATOM 0 HZ PHE A 766 5.078 -5.134 9.860 1.00 0.00 H new ATOM 853 N PRO A 767 6.807 -6.216 1.597 1.00 0.00 N ATOM 854 CA PRO A 767 6.834 -5.597 0.267 1.00 0.00 C ATOM 855 C PRO A 767 5.624 -5.940 -0.598 1.00 0.00 C ATOM 856 O PRO A 767 5.565 -7.004 -1.213 1.00 0.00 O ATOM 857 CB PRO A 767 8.129 -6.120 -0.367 1.00 0.00 C ATOM 858 CG PRO A 767 8.857 -6.814 0.711 1.00 0.00 C ATOM 859 CD PRO A 767 7.842 -7.236 1.732 1.00 0.00 C ATOM 0 HA PRO A 767 6.797 -4.511 0.348 1.00 0.00 H new ATOM 0 HB2 PRO A 767 7.913 -6.799 -1.192 1.00 0.00 H new ATOM 0 HB3 PRO A 767 8.722 -5.301 -0.775 1.00 0.00 H new ATOM 0 HG2 PRO A 767 9.391 -7.680 0.319 1.00 0.00 H new ATOM 0 HG3 PRO A 767 9.602 -6.155 1.158 1.00 0.00 H new ATOM 0 HD2 PRO A 767 7.455 -8.235 1.529 1.00 0.00 H new ATOM 0 HD3 PRO A 767 8.263 -7.255 2.737 1.00 0.00 H new ATOM 867 N MET A 768 4.661 -5.020 -0.633 1.00 0.00 N ATOM 868 CA MET A 768 3.456 -5.187 -1.437 1.00 0.00 C ATOM 869 C MET A 768 3.486 -4.234 -2.613 1.00 0.00 C ATOM 870 O MET A 768 4.060 -3.150 -2.538 1.00 0.00 O ATOM 871 CB MET A 768 2.200 -4.982 -0.589 1.00 0.00 C ATOM 872 CG MET A 768 0.951 -4.589 -1.379 1.00 0.00 C ATOM 873 SD MET A 768 0.212 -5.934 -2.311 1.00 0.00 S ATOM 874 CE MET A 768 0.113 -7.121 -1.003 1.00 0.00 C ATOM 0 H MET A 768 4.695 -4.146 -0.109 1.00 0.00 H new ATOM 0 HA MET A 768 3.427 -6.207 -1.819 1.00 0.00 H new ATOM 0 HB2 MET A 768 1.993 -5.902 -0.043 1.00 0.00 H new ATOM 0 HB3 MET A 768 2.402 -4.210 0.153 1.00 0.00 H new ATOM 0 HG2 MET A 768 0.208 -4.191 -0.687 1.00 0.00 H new ATOM 0 HG3 MET A 768 1.209 -3.784 -2.068 1.00 0.00 H new ATOM 0 HE1 MET A 768 0.900 -7.865 -1.127 1.00 0.00 H new ATOM 0 HE2 MET A 768 0.237 -6.617 -0.044 1.00 0.00 H new ATOM 0 HE3 MET A 768 -0.859 -7.613 -1.031 1.00 0.00 H new ATOM 884 N ASP A 769 2.879 -4.657 -3.704 1.00 0.00 N ATOM 885 CA ASP A 769 2.845 -3.864 -4.911 1.00 0.00 C ATOM 886 C ASP A 769 1.433 -3.784 -5.466 1.00 0.00 C ATOM 887 O ASP A 769 0.506 -4.343 -4.891 1.00 0.00 O ATOM 888 CB ASP A 769 3.790 -4.481 -5.940 1.00 0.00 C ATOM 889 CG ASP A 769 5.243 -4.167 -5.649 1.00 0.00 C ATOM 890 OD1 ASP A 769 5.807 -4.778 -4.717 1.00 0.00 O ATOM 891 OD2 ASP A 769 5.820 -3.312 -6.351 1.00 0.00 O ATOM 0 H ASP A 769 2.399 -5.554 -3.776 1.00 0.00 H new ATOM 0 HA ASP A 769 3.169 -2.849 -4.681 1.00 0.00 H new ATOM 0 HB2 ASP A 769 3.651 -5.562 -5.956 1.00 0.00 H new ATOM 0 HB3 ASP A 769 3.533 -4.112 -6.933 1.00 0.00 H new ATOM 896 N LEU A 770 1.270 -3.052 -6.559 1.00 0.00 N ATOM 897 CA LEU A 770 -0.029 -2.920 -7.204 1.00 0.00 C ATOM 898 C LEU A 770 -0.387 -4.188 -7.945 1.00 0.00 C ATOM 899 O LEU A 770 -1.559 -4.484 -8.138 1.00 0.00 O ATOM 900 CB LEU A 770 -0.046 -1.720 -8.134 1.00 0.00 C ATOM 901 CG LEU A 770 0.677 -0.533 -7.577 1.00 0.00 C ATOM 902 CD1 LEU A 770 1.304 0.224 -8.694 1.00 0.00 C ATOM 903 CD2 LEU A 770 -0.265 0.355 -6.821 1.00 0.00 C ATOM 0 H LEU A 770 2.023 -2.539 -7.019 1.00 0.00 H new ATOM 0 HA LEU A 770 -0.782 -2.757 -6.433 1.00 0.00 H new ATOM 0 HB2 LEU A 770 0.406 -1.999 -9.086 1.00 0.00 H new ATOM 0 HB3 LEU A 770 -1.080 -1.444 -8.341 1.00 0.00 H new ATOM 0 HG LEU A 770 1.447 -0.877 -6.887 1.00 0.00 H new ATOM 0 HD11 LEU A 770 1.832 1.090 -8.295 1.00 0.00 H new ATOM 0 HD12 LEU A 770 2.009 -0.420 -9.220 1.00 0.00 H new ATOM 0 HD13 LEU A 770 0.531 0.558 -9.386 1.00 0.00 H new ATOM 0 HD21 LEU A 770 0.281 1.211 -6.425 1.00 0.00 H new ATOM 0 HD22 LEU A 770 -1.052 0.704 -7.490 1.00 0.00 H new ATOM 0 HD23 LEU A 770 -0.710 -0.204 -5.998 1.00 0.00 H new ATOM 915 N LYS A 771 0.623 -4.915 -8.414 1.00 0.00 N ATOM 916 CA LYS A 771 0.362 -6.187 -9.060 1.00 0.00 C ATOM 917 C LYS A 771 0.040 -7.197 -7.986 1.00 0.00 C ATOM 918 O LYS A 771 -0.833 -8.039 -8.156 1.00 0.00 O ATOM 919 CB LYS A 771 1.534 -6.687 -9.882 1.00 0.00 C ATOM 920 CG LYS A 771 1.085 -7.604 -10.998 1.00 0.00 C ATOM 921 CD LYS A 771 0.909 -6.830 -12.286 1.00 0.00 C ATOM 922 CE LYS A 771 0.097 -7.615 -13.295 1.00 0.00 C ATOM 923 NZ LYS A 771 -0.168 -6.830 -14.533 1.00 0.00 N ATOM 0 H LYS A 771 1.606 -4.649 -8.359 1.00 0.00 H new ATOM 0 HA LYS A 771 -0.469 -6.050 -9.751 1.00 0.00 H new ATOM 0 HB2 LYS A 771 2.072 -5.837 -10.303 1.00 0.00 H new ATOM 0 HB3 LYS A 771 2.233 -7.217 -9.235 1.00 0.00 H new ATOM 0 HG2 LYS A 771 1.819 -8.397 -11.142 1.00 0.00 H new ATOM 0 HG3 LYS A 771 0.146 -8.085 -10.725 1.00 0.00 H new ATOM 0 HD2 LYS A 771 0.414 -5.881 -12.078 1.00 0.00 H new ATOM 0 HD3 LYS A 771 1.886 -6.594 -12.707 1.00 0.00 H new ATOM 0 HE2 LYS A 771 0.628 -8.531 -13.554 1.00 0.00 H new ATOM 0 HE3 LYS A 771 -0.850 -7.912 -12.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 771 -0.726 -7.405 -15.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 771 -0.698 -5.968 -14.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 771 0.735 -6.568 -14.978 1.00 0.00 H new ATOM 937 N THR A 772 0.794 -7.131 -6.892 1.00 0.00 N ATOM 938 CA THR A 772 0.536 -7.996 -5.752 1.00 0.00 C ATOM 939 C THR A 772 -0.849 -7.651 -5.227 1.00 0.00 C ATOM 940 O THR A 772 -1.636 -8.524 -4.868 1.00 0.00 O ATOM 941 CB THR A 772 1.577 -7.831 -4.635 1.00 0.00 C ATOM 942 OG1 THR A 772 2.892 -8.087 -5.145 1.00 0.00 O ATOM 943 CG2 THR A 772 1.272 -8.789 -3.496 1.00 0.00 C ATOM 0 H THR A 772 1.581 -6.493 -6.774 1.00 0.00 H new ATOM 0 HA THR A 772 0.598 -9.035 -6.075 1.00 0.00 H new ATOM 0 HB THR A 772 1.534 -6.807 -4.263 1.00 0.00 H new ATOM 0 HG1 THR A 772 3.549 -7.978 -4.426 1.00 0.00 H new ATOM 0 HG21 THR A 772 2.015 -8.666 -2.708 1.00 0.00 H new ATOM 0 HG22 THR A 772 0.281 -8.576 -3.097 1.00 0.00 H new ATOM 0 HG23 THR A 772 1.301 -9.814 -3.865 1.00 0.00 H new ATOM 951 N MET A 773 -1.121 -6.347 -5.171 1.00 0.00 N ATOM 952 CA MET A 773 -2.434 -5.846 -4.788 1.00 0.00 C ATOM 953 C MET A 773 -3.444 -6.497 -5.724 1.00 0.00 C ATOM 954 O MET A 773 -4.294 -7.273 -5.307 1.00 0.00 O ATOM 955 CB MET A 773 -2.485 -4.324 -4.939 1.00 0.00 C ATOM 956 CG MET A 773 -2.160 -3.570 -3.667 1.00 0.00 C ATOM 957 SD MET A 773 -3.337 -3.902 -2.366 1.00 0.00 S ATOM 958 CE MET A 773 -4.791 -3.150 -3.065 1.00 0.00 C ATOM 0 H MET A 773 -0.442 -5.617 -5.388 1.00 0.00 H new ATOM 0 HA MET A 773 -2.653 -6.084 -3.747 1.00 0.00 H new ATOM 0 HB2 MET A 773 -1.784 -4.022 -5.718 1.00 0.00 H new ATOM 0 HB3 MET A 773 -3.480 -4.035 -5.277 1.00 0.00 H new ATOM 0 HG2 MET A 773 -1.161 -3.845 -3.329 1.00 0.00 H new ATOM 0 HG3 MET A 773 -2.143 -2.500 -3.875 1.00 0.00 H new ATOM 0 HE1 MET A 773 -5.094 -2.303 -2.450 1.00 0.00 H new ATOM 0 HE2 MET A 773 -4.572 -2.805 -4.075 1.00 0.00 H new ATOM 0 HE3 MET A 773 -5.598 -3.881 -3.099 1.00 0.00 H new ATOM 968 N SER A 774 -3.293 -6.204 -7.010 1.00 0.00 N ATOM 969 CA SER A 774 -4.160 -6.753 -8.046 1.00 0.00 C ATOM 970 C SER A 774 -4.164 -8.267 -8.017 1.00 0.00 C ATOM 971 O SER A 774 -5.109 -8.896 -8.466 1.00 0.00 O ATOM 972 CB SER A 774 -3.720 -6.266 -9.407 1.00 0.00 C ATOM 973 OG SER A 774 -2.586 -6.976 -9.871 1.00 0.00 O ATOM 0 H SER A 774 -2.568 -5.580 -7.364 1.00 0.00 H new ATOM 0 HA SER A 774 -5.175 -6.407 -7.849 1.00 0.00 H new ATOM 0 HB2 SER A 774 -4.538 -6.381 -10.118 1.00 0.00 H new ATOM 0 HB3 SER A 774 -3.489 -5.202 -9.357 1.00 0.00 H new ATOM 0 HG SER A 774 -2.087 -7.331 -9.106 1.00 0.00 H new ATOM 979 N GLU A 775 -3.089 -8.844 -7.512 1.00 0.00 N ATOM 980 CA GLU A 775 -2.988 -10.286 -7.395 1.00 0.00 C ATOM 981 C GLU A 775 -4.108 -10.755 -6.500 1.00 0.00 C ATOM 982 O GLU A 775 -4.933 -11.599 -6.871 1.00 0.00 O ATOM 983 CB GLU A 775 -1.632 -10.656 -6.802 1.00 0.00 C ATOM 984 CG GLU A 775 -0.789 -11.526 -7.704 1.00 0.00 C ATOM 985 CD GLU A 775 0.269 -12.303 -6.947 1.00 0.00 C ATOM 986 OE1 GLU A 775 -0.033 -13.422 -6.482 1.00 0.00 O ATOM 987 OE2 GLU A 775 1.403 -11.793 -6.819 1.00 0.00 O ATOM 0 H GLU A 775 -2.272 -8.334 -7.176 1.00 0.00 H new ATOM 0 HA GLU A 775 -3.071 -10.764 -8.371 1.00 0.00 H new ATOM 0 HB2 GLU A 775 -1.083 -9.742 -6.577 1.00 0.00 H new ATOM 0 HB3 GLU A 775 -1.789 -11.174 -5.856 1.00 0.00 H new ATOM 0 HG2 GLU A 775 -1.435 -12.224 -8.236 1.00 0.00 H new ATOM 0 HG3 GLU A 775 -0.307 -10.902 -8.456 1.00 0.00 H new ATOM 994 N ARG A 776 -4.152 -10.140 -5.333 1.00 0.00 N ATOM 995 CA ARG A 776 -5.167 -10.417 -4.350 1.00 0.00 C ATOM 996 C ARG A 776 -6.521 -10.115 -4.952 1.00 0.00 C ATOM 997 O ARG A 776 -7.443 -10.925 -4.922 1.00 0.00 O ATOM 998 CB ARG A 776 -4.904 -9.556 -3.141 1.00 0.00 C ATOM 999 CG ARG A 776 -3.752 -10.082 -2.307 1.00 0.00 C ATOM 1000 CD ARG A 776 -2.736 -9.005 -1.968 1.00 0.00 C ATOM 1001 NE ARG A 776 -1.548 -9.570 -1.336 1.00 0.00 N ATOM 1002 CZ ARG A 776 -1.440 -9.800 -0.030 1.00 0.00 C ATOM 1003 NH1 ARG A 776 -2.450 -9.519 0.783 1.00 0.00 N ATOM 1004 NH2 ARG A 776 -0.320 -10.310 0.465 1.00 0.00 N ATOM 0 H ARG A 776 -3.478 -9.431 -5.045 1.00 0.00 H new ATOM 0 HA ARG A 776 -5.150 -11.464 -4.047 1.00 0.00 H new ATOM 0 HB2 ARG A 776 -4.683 -8.538 -3.462 1.00 0.00 H new ATOM 0 HB3 ARG A 776 -5.804 -9.509 -2.527 1.00 0.00 H new ATOM 0 HG2 ARG A 776 -4.143 -10.511 -1.384 1.00 0.00 H new ATOM 0 HG3 ARG A 776 -3.255 -10.888 -2.848 1.00 0.00 H new ATOM 0 HD2 ARG A 776 -2.449 -8.475 -2.876 1.00 0.00 H new ATOM 0 HD3 ARG A 776 -3.190 -8.272 -1.301 1.00 0.00 H new ATOM 0 HE ARG A 776 -0.753 -9.802 -1.931 1.00 0.00 H new ATOM 0 HH11 ARG A 776 -3.313 -9.125 0.407 1.00 0.00 H new ATOM 0 HH12 ARG A 776 -2.364 -9.697 1.784 1.00 0.00 H new ATOM 0 HH21 ARG A 776 0.460 -10.526 -0.156 1.00 0.00 H new ATOM 0 HH22 ARG A 776 -0.239 -10.486 1.466 1.00 0.00 H new ATOM 1018 N LEU A 777 -6.588 -8.934 -5.522 1.00 0.00 N ATOM 1019 CA LEU A 777 -7.771 -8.428 -6.191 1.00 0.00 C ATOM 1020 C LEU A 777 -8.326 -9.460 -7.119 1.00 0.00 C ATOM 1021 O LEU A 777 -9.509 -9.783 -7.085 1.00 0.00 O ATOM 1022 CB LEU A 777 -7.366 -7.185 -6.974 1.00 0.00 C ATOM 1023 CG LEU A 777 -8.472 -6.291 -7.515 1.00 0.00 C ATOM 1024 CD1 LEU A 777 -9.744 -7.028 -7.813 1.00 0.00 C ATOM 1025 CD2 LEU A 777 -8.740 -5.189 -6.526 1.00 0.00 C ATOM 0 H LEU A 777 -5.805 -8.281 -5.535 1.00 0.00 H new ATOM 0 HA LEU A 777 -8.542 -8.185 -5.460 1.00 0.00 H new ATOM 0 HB2 LEU A 777 -6.730 -6.577 -6.330 1.00 0.00 H new ATOM 0 HB3 LEU A 777 -6.753 -7.506 -7.817 1.00 0.00 H new ATOM 0 HG LEU A 777 -8.123 -5.887 -8.465 1.00 0.00 H new ATOM 0 HD11 LEU A 777 -10.488 -6.329 -8.195 1.00 0.00 H new ATOM 0 HD12 LEU A 777 -9.552 -7.798 -8.560 1.00 0.00 H new ATOM 0 HD13 LEU A 777 -10.117 -7.493 -6.901 1.00 0.00 H new ATOM 0 HD21 LEU A 777 -9.532 -4.543 -6.906 1.00 0.00 H new ATOM 0 HD22 LEU A 777 -9.050 -5.621 -5.575 1.00 0.00 H new ATOM 0 HD23 LEU A 777 -7.833 -4.603 -6.380 1.00 0.00 H new ATOM 1037 N LYS A 778 -7.457 -9.979 -7.939 1.00 0.00 N ATOM 1038 CA LYS A 778 -7.847 -10.954 -8.901 1.00 0.00 C ATOM 1039 C LYS A 778 -8.614 -12.079 -8.233 1.00 0.00 C ATOM 1040 O LYS A 778 -9.700 -12.459 -8.668 1.00 0.00 O ATOM 1041 CB LYS A 778 -6.638 -11.535 -9.578 1.00 0.00 C ATOM 1042 CG LYS A 778 -6.518 -11.118 -11.014 1.00 0.00 C ATOM 1043 CD LYS A 778 -5.712 -9.837 -11.158 1.00 0.00 C ATOM 1044 CE LYS A 778 -4.212 -10.098 -11.054 1.00 0.00 C ATOM 1045 NZ LYS A 778 -3.685 -10.789 -12.264 1.00 0.00 N ATOM 0 H LYS A 778 -6.466 -9.736 -7.955 1.00 0.00 H new ATOM 0 HA LYS A 778 -8.482 -10.462 -9.638 1.00 0.00 H new ATOM 0 HB2 LYS A 778 -5.742 -11.226 -9.039 1.00 0.00 H new ATOM 0 HB3 LYS A 778 -6.684 -12.623 -9.523 1.00 0.00 H new ATOM 0 HG2 LYS A 778 -6.042 -11.914 -11.586 1.00 0.00 H new ATOM 0 HG3 LYS A 778 -7.512 -10.972 -11.436 1.00 0.00 H new ATOM 0 HD2 LYS A 778 -5.935 -9.373 -12.119 1.00 0.00 H new ATOM 0 HD3 LYS A 778 -6.013 -9.129 -10.385 1.00 0.00 H new ATOM 0 HE2 LYS A 778 -3.687 -9.152 -10.918 1.00 0.00 H new ATOM 0 HE3 LYS A 778 -4.009 -10.705 -10.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 778 -2.646 -10.739 -12.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 778 -3.983 -11.785 -12.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 778 -4.057 -10.326 -13.118 1.00 0.00 H new ATOM 1059 N ASN A 779 -8.020 -12.610 -7.166 1.00 0.00 N ATOM 1060 CA ASN A 779 -8.615 -13.698 -6.417 1.00 0.00 C ATOM 1061 C ASN A 779 -9.808 -13.224 -5.601 1.00 0.00 C ATOM 1062 O ASN A 779 -10.432 -14.011 -4.890 1.00 0.00 O ATOM 1063 CB ASN A 779 -7.598 -14.270 -5.446 1.00 0.00 C ATOM 1064 CG ASN A 779 -6.163 -14.057 -5.856 1.00 0.00 C ATOM 1065 OD1 ASN A 779 -5.467 -13.208 -5.099 1.00 0.00 O flip ATOM 1066 ND2 ASN A 779 -5.678 -14.648 -6.820 1.00 0.00 N flip ATOM 0 H ASN A 779 -7.120 -12.296 -6.804 1.00 0.00 H new ATOM 0 HA ASN A 779 -8.939 -14.448 -7.138 1.00 0.00 H new ATOM 0 HB2 ASN A 779 -7.755 -13.819 -4.466 1.00 0.00 H new ATOM 0 HB3 ASN A 779 -7.778 -15.340 -5.337 1.00 0.00 H new ATOM 0 HD21 ASN A 779 -6.253 -15.288 -7.368 1.00 0.00 H new ATOM 0 HD22 ASN A 779 -4.701 -14.498 -7.071 1.00 0.00 H new ATOM 1073 N ARG A 780 -10.098 -11.932 -5.694 1.00 0.00 N ATOM 1074 CA ARG A 780 -11.190 -11.322 -4.944 1.00 0.00 C ATOM 1075 C ARG A 780 -10.806 -11.287 -3.478 1.00 0.00 C ATOM 1076 O ARG A 780 -11.654 -11.147 -2.597 1.00 0.00 O ATOM 1077 CB ARG A 780 -12.498 -12.097 -5.090 1.00 0.00 C ATOM 1078 CG ARG A 780 -13.166 -11.960 -6.435 1.00 0.00 C ATOM 1079 CD ARG A 780 -12.424 -12.737 -7.499 1.00 0.00 C ATOM 1080 NE ARG A 780 -13.213 -13.847 -8.026 1.00 0.00 N ATOM 1081 CZ ARG A 780 -12.702 -15.032 -8.344 1.00 0.00 C ATOM 1082 NH1 ARG A 780 -11.406 -15.265 -8.184 1.00 0.00 N ATOM 1083 NH2 ARG A 780 -13.489 -15.988 -8.819 1.00 0.00 N ATOM 0 H ARG A 780 -9.586 -11.280 -6.288 1.00 0.00 H new ATOM 0 HA ARG A 780 -11.352 -10.320 -5.341 1.00 0.00 H new ATOM 0 HB2 ARG A 780 -12.302 -13.153 -4.903 1.00 0.00 H new ATOM 0 HB3 ARG A 780 -13.192 -11.761 -4.319 1.00 0.00 H new ATOM 0 HG2 ARG A 780 -14.194 -12.317 -6.371 1.00 0.00 H new ATOM 0 HG3 ARG A 780 -13.211 -10.908 -6.715 1.00 0.00 H new ATOM 0 HD2 ARG A 780 -12.155 -12.066 -8.315 1.00 0.00 H new ATOM 0 HD3 ARG A 780 -11.493 -13.121 -7.082 1.00 0.00 H new ATOM 0 HE ARG A 780 -14.214 -13.705 -8.158 1.00 0.00 H new ATOM 0 HH11 ARG A 780 -10.798 -14.533 -7.816 1.00 0.00 H new ATOM 0 HH12 ARG A 780 -11.017 -16.176 -8.429 1.00 0.00 H new ATOM 0 HH21 ARG A 780 -14.487 -15.814 -8.940 1.00 0.00 H new ATOM 0 HH22 ARG A 780 -13.097 -16.897 -9.063 1.00 0.00 H new ATOM 1097 N TYR A 781 -9.508 -11.423 -3.237 1.00 0.00 N ATOM 1098 CA TYR A 781 -8.966 -11.451 -1.896 1.00 0.00 C ATOM 1099 C TYR A 781 -9.468 -10.277 -1.073 1.00 0.00 C ATOM 1100 O TYR A 781 -9.741 -10.431 0.112 1.00 0.00 O ATOM 1101 CB TYR A 781 -7.440 -11.453 -1.984 1.00 0.00 C ATOM 1102 CG TYR A 781 -6.709 -11.120 -0.711 1.00 0.00 C ATOM 1103 CD1 TYR A 781 -6.536 -9.806 -0.352 1.00 0.00 C ATOM 1104 CD2 TYR A 781 -6.160 -12.105 0.097 1.00 0.00 C ATOM 1105 CE1 TYR A 781 -5.836 -9.454 0.771 1.00 0.00 C ATOM 1106 CE2 TYR A 781 -5.460 -11.772 1.240 1.00 0.00 C ATOM 1107 CZ TYR A 781 -5.296 -10.443 1.573 1.00 0.00 C ATOM 1108 OH TYR A 781 -4.584 -10.104 2.699 1.00 0.00 O ATOM 0 H TYR A 781 -8.806 -11.517 -3.971 1.00 0.00 H new ATOM 0 HA TYR A 781 -9.302 -12.356 -1.389 1.00 0.00 H new ATOM 0 HB2 TYR A 781 -7.116 -12.438 -2.320 1.00 0.00 H new ATOM 0 HB3 TYR A 781 -7.138 -10.740 -2.751 1.00 0.00 H new ATOM 0 HD1 TYR A 781 -6.963 -9.031 -0.971 1.00 0.00 H new ATOM 0 HD2 TYR A 781 -6.281 -13.144 -0.171 1.00 0.00 H new ATOM 0 HE1 TYR A 781 -5.707 -8.413 1.028 1.00 0.00 H new ATOM 0 HE2 TYR A 781 -5.044 -12.546 1.868 1.00 0.00 H new ATOM 0 HH TYR A 781 -4.276 -10.918 3.149 1.00 0.00 H new ATOM 1118 N TYR A 782 -9.600 -9.109 -1.706 1.00 0.00 N ATOM 1119 CA TYR A 782 -10.059 -7.921 -1.004 1.00 0.00 C ATOM 1120 C TYR A 782 -11.507 -8.030 -0.603 1.00 0.00 C ATOM 1121 O TYR A 782 -12.392 -7.430 -1.213 1.00 0.00 O ATOM 1122 CB TYR A 782 -9.821 -6.673 -1.843 1.00 0.00 C ATOM 1123 CG TYR A 782 -8.401 -6.554 -2.206 1.00 0.00 C ATOM 1124 CD1 TYR A 782 -7.504 -6.160 -1.271 1.00 0.00 C ATOM 1125 CD2 TYR A 782 -7.947 -6.889 -3.451 1.00 0.00 C ATOM 1126 CE1 TYR A 782 -6.184 -6.096 -1.545 1.00 0.00 C ATOM 1127 CE2 TYR A 782 -6.612 -6.807 -3.743 1.00 0.00 C ATOM 1128 CZ TYR A 782 -5.738 -6.413 -2.776 1.00 0.00 C ATOM 1129 OH TYR A 782 -4.411 -6.353 -3.035 1.00 0.00 O ATOM 0 H TYR A 782 -9.396 -8.967 -2.695 1.00 0.00 H new ATOM 0 HA TYR A 782 -9.475 -7.838 -0.088 1.00 0.00 H new ATOM 0 HB2 TYR A 782 -10.430 -6.714 -2.746 1.00 0.00 H new ATOM 0 HB3 TYR A 782 -10.135 -5.790 -1.287 1.00 0.00 H new ATOM 0 HD1 TYR A 782 -7.852 -5.891 -0.285 1.00 0.00 H new ATOM 0 HD2 TYR A 782 -8.644 -7.220 -4.207 1.00 0.00 H new ATOM 0 HE1 TYR A 782 -5.487 -5.791 -0.779 1.00 0.00 H new ATOM 0 HE2 TYR A 782 -6.255 -7.053 -4.732 1.00 0.00 H new ATOM 0 HH TYR A 782 -4.026 -5.571 -2.588 1.00 0.00 H new ATOM 1139 N VAL A 783 -11.734 -8.810 0.435 1.00 0.00 N ATOM 1140 CA VAL A 783 -13.054 -8.982 0.972 1.00 0.00 C ATOM 1141 C VAL A 783 -13.325 -7.834 1.908 1.00 0.00 C ATOM 1142 O VAL A 783 -14.297 -7.819 2.664 1.00 0.00 O ATOM 1143 CB VAL A 783 -13.186 -10.307 1.719 1.00 0.00 C ATOM 1144 CG1 VAL A 783 -13.052 -11.447 0.745 1.00 0.00 C ATOM 1145 CG2 VAL A 783 -12.144 -10.391 2.804 1.00 0.00 C ATOM 0 H VAL A 783 -11.009 -9.336 0.922 1.00 0.00 H new ATOM 0 HA VAL A 783 -13.777 -8.998 0.156 1.00 0.00 H new ATOM 0 HB VAL A 783 -14.167 -10.369 2.190 1.00 0.00 H new ATOM 0 HG11 VAL A 783 -13.146 -12.393 1.277 1.00 0.00 H new ATOM 0 HG12 VAL A 783 -13.836 -11.375 -0.009 1.00 0.00 H new ATOM 0 HG13 VAL A 783 -12.077 -11.399 0.260 1.00 0.00 H new ATOM 0 HG21 VAL A 783 -12.245 -11.339 3.332 1.00 0.00 H new ATOM 0 HG22 VAL A 783 -11.151 -10.327 2.360 1.00 0.00 H new ATOM 0 HG23 VAL A 783 -12.282 -9.568 3.505 1.00 0.00 H new ATOM 1155 N SER A 784 -12.424 -6.870 1.826 1.00 0.00 N ATOM 1156 CA SER A 784 -12.465 -5.695 2.652 1.00 0.00 C ATOM 1157 C SER A 784 -11.532 -4.636 2.078 1.00 0.00 C ATOM 1158 O SER A 784 -10.359 -4.919 1.836 1.00 0.00 O ATOM 1159 CB SER A 784 -12.026 -6.085 4.047 1.00 0.00 C ATOM 1160 OG SER A 784 -13.137 -6.383 4.876 1.00 0.00 O ATOM 0 H SER A 784 -11.639 -6.890 1.175 1.00 0.00 H new ATOM 0 HA SER A 784 -13.474 -5.283 2.684 1.00 0.00 H new ATOM 0 HB2 SER A 784 -11.367 -6.952 3.993 1.00 0.00 H new ATOM 0 HB3 SER A 784 -11.448 -5.273 4.488 1.00 0.00 H new ATOM 0 HG SER A 784 -13.787 -6.917 4.373 1.00 0.00 H new ATOM 1166 N LYS A 785 -12.042 -3.423 1.837 1.00 0.00 N ATOM 1167 CA LYS A 785 -11.193 -2.361 1.297 1.00 0.00 C ATOM 1168 C LYS A 785 -9.971 -2.190 2.153 1.00 0.00 C ATOM 1169 O LYS A 785 -9.048 -1.527 1.742 1.00 0.00 O ATOM 1170 CB LYS A 785 -11.897 -1.011 1.223 1.00 0.00 C ATOM 1171 CG LYS A 785 -12.711 -0.678 2.450 1.00 0.00 C ATOM 1172 CD LYS A 785 -14.138 -1.093 2.222 1.00 0.00 C ATOM 1173 CE LYS A 785 -15.061 0.092 2.159 1.00 0.00 C ATOM 1174 NZ LYS A 785 -15.033 0.890 3.416 1.00 0.00 N ATOM 0 H LYS A 785 -13.013 -3.158 2.003 1.00 0.00 H new ATOM 0 HA LYS A 785 -10.933 -2.672 0.285 1.00 0.00 H new ATOM 0 HB2 LYS A 785 -11.151 -0.231 1.071 1.00 0.00 H new ATOM 0 HB3 LYS A 785 -12.551 -1.001 0.351 1.00 0.00 H new ATOM 0 HG2 LYS A 785 -12.305 -1.192 3.321 1.00 0.00 H new ATOM 0 HG3 LYS A 785 -12.659 0.391 2.657 1.00 0.00 H new ATOM 0 HD2 LYS A 785 -14.208 -1.658 1.293 1.00 0.00 H new ATOM 0 HD3 LYS A 785 -14.456 -1.759 3.025 1.00 0.00 H new ATOM 0 HE2 LYS A 785 -14.778 0.728 1.320 1.00 0.00 H new ATOM 0 HE3 LYS A 785 -16.078 -0.251 1.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 785 -15.941 0.788 3.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 785 -14.264 0.548 4.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 785 -14.875 1.892 3.188 1.00 0.00 H new ATOM 1188 N LYS A 786 -9.984 -2.759 3.357 1.00 0.00 N ATOM 1189 CA LYS A 786 -8.837 -2.642 4.242 1.00 0.00 C ATOM 1190 C LYS A 786 -7.704 -3.515 3.747 1.00 0.00 C ATOM 1191 O LYS A 786 -6.542 -3.161 3.869 1.00 0.00 O ATOM 1192 CB LYS A 786 -9.194 -3.003 5.687 1.00 0.00 C ATOM 1193 CG LYS A 786 -10.095 -1.992 6.377 1.00 0.00 C ATOM 1194 CD LYS A 786 -11.547 -2.156 5.962 1.00 0.00 C ATOM 1195 CE LYS A 786 -12.466 -1.295 6.811 1.00 0.00 C ATOM 1196 NZ LYS A 786 -12.096 0.145 6.746 1.00 0.00 N ATOM 0 H LYS A 786 -10.765 -3.296 3.734 1.00 0.00 H new ATOM 0 HA LYS A 786 -8.518 -1.600 4.233 1.00 0.00 H new ATOM 0 HB2 LYS A 786 -9.685 -3.976 5.696 1.00 0.00 H new ATOM 0 HB3 LYS A 786 -8.274 -3.105 6.262 1.00 0.00 H new ATOM 0 HG2 LYS A 786 -10.010 -2.107 7.458 1.00 0.00 H new ATOM 0 HG3 LYS A 786 -9.760 -0.983 6.137 1.00 0.00 H new ATOM 0 HD2 LYS A 786 -11.660 -1.886 4.912 1.00 0.00 H new ATOM 0 HD3 LYS A 786 -11.838 -3.202 6.055 1.00 0.00 H new ATOM 0 HE2 LYS A 786 -13.495 -1.421 6.474 1.00 0.00 H new ATOM 0 HE3 LYS A 786 -12.426 -1.633 7.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 786 -12.681 0.684 7.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 786 -11.092 0.257 6.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 786 -12.256 0.501 5.782 1.00 0.00 H new ATOM 1210 N LEU A 787 -8.039 -4.680 3.232 1.00 0.00 N ATOM 1211 CA LEU A 787 -7.039 -5.549 2.652 1.00 0.00 C ATOM 1212 C LEU A 787 -6.379 -4.781 1.567 1.00 0.00 C ATOM 1213 O LEU A 787 -5.163 -4.764 1.383 1.00 0.00 O ATOM 1214 CB LEU A 787 -7.722 -6.745 2.024 1.00 0.00 C ATOM 1215 CG LEU A 787 -8.094 -7.818 2.989 1.00 0.00 C ATOM 1216 CD1 LEU A 787 -8.857 -8.905 2.275 1.00 0.00 C ATOM 1217 CD2 LEU A 787 -6.840 -8.314 3.669 1.00 0.00 C ATOM 0 H LEU A 787 -8.991 -5.045 3.204 1.00 0.00 H new ATOM 0 HA LEU A 787 -6.329 -5.883 3.409 1.00 0.00 H new ATOM 0 HB2 LEU A 787 -8.622 -6.406 1.511 1.00 0.00 H new ATOM 0 HB3 LEU A 787 -7.063 -7.168 1.266 1.00 0.00 H new ATOM 0 HG LEU A 787 -8.758 -7.437 3.765 1.00 0.00 H new ATOM 0 HD11 LEU A 787 -9.126 -9.687 2.985 1.00 0.00 H new ATOM 0 HD12 LEU A 787 -9.762 -8.486 1.836 1.00 0.00 H new ATOM 0 HD13 LEU A 787 -8.234 -9.329 1.487 1.00 0.00 H new ATOM 0 HD21 LEU A 787 -7.098 -9.100 4.379 1.00 0.00 H new ATOM 0 HD22 LEU A 787 -6.153 -8.711 2.921 1.00 0.00 H new ATOM 0 HD23 LEU A 787 -6.363 -7.489 4.199 1.00 0.00 H new ATOM 1229 N PHE A 788 -7.264 -4.143 0.866 1.00 0.00 N ATOM 1230 CA PHE A 788 -6.961 -3.323 -0.245 1.00 0.00 C ATOM 1231 C PHE A 788 -6.270 -2.052 0.160 1.00 0.00 C ATOM 1232 O PHE A 788 -5.361 -1.574 -0.514 1.00 0.00 O ATOM 1233 CB PHE A 788 -8.247 -3.033 -0.926 1.00 0.00 C ATOM 1234 CG PHE A 788 -7.951 -2.600 -2.271 1.00 0.00 C ATOM 1235 CD1 PHE A 788 -7.647 -1.319 -2.420 1.00 0.00 C ATOM 1236 CD2 PHE A 788 -7.916 -3.443 -3.348 1.00 0.00 C ATOM 1237 CE1 PHE A 788 -7.314 -0.809 -3.613 1.00 0.00 C ATOM 1238 CE2 PHE A 788 -7.580 -2.946 -4.580 1.00 0.00 C ATOM 1239 CZ PHE A 788 -7.280 -1.620 -4.710 1.00 0.00 C ATOM 0 H PHE A 788 -8.262 -4.188 1.070 1.00 0.00 H new ATOM 0 HA PHE A 788 -6.268 -3.838 -0.911 1.00 0.00 H new ATOM 0 HB2 PHE A 788 -8.879 -3.921 -0.942 1.00 0.00 H new ATOM 0 HB3 PHE A 788 -8.797 -2.260 -0.389 1.00 0.00 H new ATOM 0 HD1 PHE A 788 -7.668 -0.669 -1.557 1.00 0.00 H new ATOM 0 HD2 PHE A 788 -8.151 -4.490 -3.228 1.00 0.00 H new ATOM 0 HE1 PHE A 788 -7.073 0.240 -3.706 1.00 0.00 H new ATOM 0 HE2 PHE A 788 -7.553 -3.597 -5.441 1.00 0.00 H new ATOM 0 HZ PHE A 788 -7.017 -1.215 -5.676 1.00 0.00 H new ATOM 1249 N MET A 789 -6.698 -1.520 1.267 1.00 0.00 N ATOM 1250 CA MET A 789 -6.139 -0.309 1.766 1.00 0.00 C ATOM 1251 C MET A 789 -4.754 -0.611 2.269 1.00 0.00 C ATOM 1252 O MET A 789 -3.777 -0.168 1.710 1.00 0.00 O ATOM 1253 CB MET A 789 -7.011 0.243 2.865 1.00 0.00 C ATOM 1254 CG MET A 789 -8.201 1.018 2.333 1.00 0.00 C ATOM 1255 SD MET A 789 -8.433 2.551 3.213 1.00 0.00 S ATOM 1256 CE MET A 789 -7.791 3.663 1.985 1.00 0.00 C ATOM 0 H MET A 789 -7.441 -1.915 1.843 1.00 0.00 H new ATOM 0 HA MET A 789 -6.084 0.445 0.981 1.00 0.00 H new ATOM 0 HB2 MET A 789 -7.366 -0.578 3.488 1.00 0.00 H new ATOM 0 HB3 MET A 789 -6.415 0.894 3.504 1.00 0.00 H new ATOM 0 HG2 MET A 789 -8.056 1.225 1.273 1.00 0.00 H new ATOM 0 HG3 MET A 789 -9.101 0.409 2.419 1.00 0.00 H new ATOM 0 HE1 MET A 789 -7.388 4.550 2.473 1.00 0.00 H new ATOM 0 HE2 MET A 789 -7.000 3.167 1.423 1.00 0.00 H new ATOM 0 HE3 MET A 789 -8.591 3.955 1.305 1.00 0.00 H new ATOM 1266 N ALA A 790 -4.708 -1.446 3.288 1.00 0.00 N ATOM 1267 CA ALA A 790 -3.467 -1.874 3.914 1.00 0.00 C ATOM 1268 C ALA A 790 -2.390 -2.263 2.917 1.00 0.00 C ATOM 1269 O ALA A 790 -1.272 -1.778 3.000 1.00 0.00 O ATOM 1270 CB ALA A 790 -3.741 -3.079 4.791 1.00 0.00 C ATOM 0 H ALA A 790 -5.541 -1.853 3.712 1.00 0.00 H new ATOM 0 HA ALA A 790 -3.101 -1.021 4.486 1.00 0.00 H new ATOM 0 HB1 ALA A 790 -2.814 -3.404 5.263 1.00 0.00 H new ATOM 0 HB2 ALA A 790 -4.465 -2.812 5.560 1.00 0.00 H new ATOM 0 HB3 ALA A 790 -4.141 -3.889 4.181 1.00 0.00 H new ATOM 1276 N ASP A 791 -2.731 -3.155 1.990 1.00 0.00 N ATOM 1277 CA ASP A 791 -1.768 -3.647 1.012 1.00 0.00 C ATOM 1278 C ASP A 791 -1.351 -2.559 0.025 1.00 0.00 C ATOM 1279 O ASP A 791 -0.167 -2.331 -0.181 1.00 0.00 O ATOM 1280 CB ASP A 791 -2.314 -4.872 0.291 1.00 0.00 C ATOM 1281 CG ASP A 791 -2.389 -6.088 1.196 1.00 0.00 C ATOM 1282 OD1 ASP A 791 -1.387 -6.380 1.880 1.00 0.00 O ATOM 1283 OD2 ASP A 791 -3.449 -6.746 1.221 1.00 0.00 O ATOM 0 H ASP A 791 -3.666 -3.551 1.897 1.00 0.00 H new ATOM 0 HA ASP A 791 -0.869 -3.943 1.553 1.00 0.00 H new ATOM 0 HB2 ASP A 791 -3.308 -4.649 -0.097 1.00 0.00 H new ATOM 0 HB3 ASP A 791 -1.680 -5.099 -0.566 1.00 0.00 H new ATOM 1288 N LEU A 792 -2.291 -1.891 -0.617 1.00 0.00 N ATOM 1289 CA LEU A 792 -1.894 -0.818 -1.513 1.00 0.00 C ATOM 1290 C LEU A 792 -1.112 0.179 -0.696 1.00 0.00 C ATOM 1291 O LEU A 792 -0.131 0.768 -1.152 1.00 0.00 O ATOM 1292 CB LEU A 792 -3.100 -0.118 -2.139 1.00 0.00 C ATOM 1293 CG LEU A 792 -3.154 -0.127 -3.640 1.00 0.00 C ATOM 1294 CD1 LEU A 792 -4.254 0.794 -4.103 1.00 0.00 C ATOM 1295 CD2 LEU A 792 -1.818 0.282 -4.203 1.00 0.00 C ATOM 0 H LEU A 792 -3.294 -2.060 -0.542 1.00 0.00 H new ATOM 0 HA LEU A 792 -1.302 -1.233 -2.329 1.00 0.00 H new ATOM 0 HB2 LEU A 792 -4.007 -0.588 -1.759 1.00 0.00 H new ATOM 0 HB3 LEU A 792 -3.112 0.918 -1.800 1.00 0.00 H new ATOM 0 HG LEU A 792 -3.373 -1.132 -4.000 1.00 0.00 H new ATOM 0 HD11 LEU A 792 -4.297 0.791 -5.192 1.00 0.00 H new ATOM 0 HD12 LEU A 792 -5.208 0.452 -3.701 1.00 0.00 H new ATOM 0 HD13 LEU A 792 -4.054 1.806 -3.751 1.00 0.00 H new ATOM 0 HD21 LEU A 792 -1.864 0.273 -5.292 1.00 0.00 H new ATOM 0 HD22 LEU A 792 -1.570 1.286 -3.858 1.00 0.00 H new ATOM 0 HD23 LEU A 792 -1.052 -0.417 -3.867 1.00 0.00 H new ATOM 1307 N GLN A 793 -1.551 0.318 0.541 1.00 0.00 N ATOM 1308 CA GLN A 793 -0.924 1.214 1.482 1.00 0.00 C ATOM 1309 C GLN A 793 0.392 0.607 1.899 1.00 0.00 C ATOM 1310 O GLN A 793 1.291 1.277 2.397 1.00 0.00 O ATOM 1311 CB GLN A 793 -1.830 1.443 2.685 1.00 0.00 C ATOM 1312 CG GLN A 793 -2.995 2.362 2.373 1.00 0.00 C ATOM 1313 CD GLN A 793 -3.982 2.484 3.522 1.00 0.00 C ATOM 1314 OE1 GLN A 793 -5.253 2.756 3.211 1.00 0.00 O flip ATOM 1315 NE2 GLN A 793 -3.608 2.345 4.687 1.00 0.00 N flip ATOM 0 H GLN A 793 -2.352 -0.189 0.917 1.00 0.00 H new ATOM 0 HA GLN A 793 -0.750 2.186 1.021 1.00 0.00 H new ATOM 0 HB2 GLN A 793 -2.212 0.484 3.035 1.00 0.00 H new ATOM 0 HB3 GLN A 793 -1.245 1.869 3.500 1.00 0.00 H new ATOM 0 HG2 GLN A 793 -2.613 3.352 2.124 1.00 0.00 H new ATOM 0 HG3 GLN A 793 -3.517 1.991 1.491 1.00 0.00 H new ATOM 0 HE21 GLN A 793 -2.630 2.138 4.887 1.00 0.00 H new ATOM 0 HE22 GLN A 793 -4.277 2.437 5.452 1.00 0.00 H new ATOM 1324 N ARG A 794 0.461 -0.693 1.679 1.00 0.00 N ATOM 1325 CA ARG A 794 1.632 -1.485 1.975 1.00 0.00 C ATOM 1326 C ARG A 794 2.699 -1.224 0.916 1.00 0.00 C ATOM 1327 O ARG A 794 3.889 -1.377 1.174 1.00 0.00 O ATOM 1328 CB ARG A 794 1.251 -2.964 2.020 1.00 0.00 C ATOM 1329 CG ARG A 794 2.304 -3.815 2.672 1.00 0.00 C ATOM 1330 CD ARG A 794 2.389 -3.543 4.160 1.00 0.00 C ATOM 1331 NE ARG A 794 1.108 -3.117 4.725 1.00 0.00 N ATOM 1332 CZ ARG A 794 0.593 -3.618 5.844 1.00 0.00 C ATOM 1333 NH1 ARG A 794 1.236 -4.571 6.507 1.00 0.00 N ATOM 1334 NH2 ARG A 794 -0.568 -3.168 6.299 1.00 0.00 N ATOM 0 H ARG A 794 -0.309 -1.233 1.284 1.00 0.00 H new ATOM 0 HA ARG A 794 2.036 -1.207 2.948 1.00 0.00 H new ATOM 0 HB2 ARG A 794 0.312 -3.077 2.562 1.00 0.00 H new ATOM 0 HB3 ARG A 794 1.078 -3.321 1.005 1.00 0.00 H new ATOM 0 HG2 ARG A 794 2.078 -4.868 2.505 1.00 0.00 H new ATOM 0 HG3 ARG A 794 3.271 -3.619 2.209 1.00 0.00 H new ATOM 0 HD2 ARG A 794 2.727 -4.444 4.672 1.00 0.00 H new ATOM 0 HD3 ARG A 794 3.138 -2.772 4.343 1.00 0.00 H new ATOM 0 HE ARG A 794 0.581 -2.396 4.233 1.00 0.00 H new ATOM 0 HH11 ARG A 794 2.128 -4.922 6.159 1.00 0.00 H new ATOM 0 HH12 ARG A 794 0.838 -4.953 7.365 1.00 0.00 H new ATOM 0 HH21 ARG A 794 -1.066 -2.437 5.791 1.00 0.00 H new ATOM 0 HH22 ARG A 794 -0.963 -3.552 7.157 1.00 0.00 H new ATOM 1348 N VAL A 795 2.259 -0.813 -0.284 1.00 0.00 N ATOM 1349 CA VAL A 795 3.187 -0.506 -1.373 1.00 0.00 C ATOM 1350 C VAL A 795 3.729 0.907 -1.200 1.00 0.00 C ATOM 1351 O VAL A 795 4.917 1.159 -1.397 1.00 0.00 O ATOM 1352 CB VAL A 795 2.542 -0.664 -2.776 1.00 0.00 C ATOM 1353 CG1 VAL A 795 1.325 -1.548 -2.702 1.00 0.00 C ATOM 1354 CG2 VAL A 795 2.199 0.671 -3.406 1.00 0.00 C ATOM 0 H VAL A 795 1.274 -0.688 -0.519 1.00 0.00 H new ATOM 0 HA VAL A 795 4.001 -1.229 -1.319 1.00 0.00 H new ATOM 0 HB VAL A 795 3.283 -1.138 -3.420 1.00 0.00 H new ATOM 0 HG11 VAL A 795 0.886 -1.647 -3.695 1.00 0.00 H new ATOM 0 HG12 VAL A 795 1.612 -2.532 -2.332 1.00 0.00 H new ATOM 0 HG13 VAL A 795 0.594 -1.105 -2.025 1.00 0.00 H new ATOM 0 HG21 VAL A 795 1.751 0.506 -4.386 1.00 0.00 H new ATOM 0 HG22 VAL A 795 1.493 1.203 -2.769 1.00 0.00 H new ATOM 0 HG23 VAL A 795 3.106 1.265 -3.517 1.00 0.00 H new ATOM 1364 N PHE A 796 2.840 1.828 -0.834 1.00 0.00 N ATOM 1365 CA PHE A 796 3.235 3.218 -0.602 1.00 0.00 C ATOM 1366 C PHE A 796 4.115 3.294 0.631 1.00 0.00 C ATOM 1367 O PHE A 796 5.183 3.897 0.608 1.00 0.00 O ATOM 1368 CB PHE A 796 2.032 4.122 -0.367 1.00 0.00 C ATOM 1369 CG PHE A 796 0.807 3.756 -1.140 1.00 0.00 C ATOM 1370 CD1 PHE A 796 0.859 3.470 -2.487 1.00 0.00 C ATOM 1371 CD2 PHE A 796 -0.401 3.685 -0.506 1.00 0.00 C ATOM 1372 CE1 PHE A 796 -0.273 3.117 -3.177 1.00 0.00 C ATOM 1373 CE2 PHE A 796 -1.531 3.332 -1.195 1.00 0.00 C ATOM 1374 CZ PHE A 796 -1.461 3.047 -2.535 1.00 0.00 C ATOM 0 H PHE A 796 1.848 1.640 -0.692 1.00 0.00 H new ATOM 0 HA PHE A 796 3.764 3.555 -1.493 1.00 0.00 H new ATOM 0 HB2 PHE A 796 1.790 4.110 0.696 1.00 0.00 H new ATOM 0 HB3 PHE A 796 2.310 5.145 -0.619 1.00 0.00 H new ATOM 0 HD1 PHE A 796 1.804 3.525 -3.007 1.00 0.00 H new ATOM 0 HD2 PHE A 796 -0.466 3.909 0.548 1.00 0.00 H new ATOM 0 HE1 PHE A 796 -0.215 2.895 -4.232 1.00 0.00 H new ATOM 0 HE2 PHE A 796 -2.480 3.278 -0.682 1.00 0.00 H new ATOM 0 HZ PHE A 796 -2.353 2.767 -3.076 1.00 0.00 H new ATOM 1384 N THR A 797 3.637 2.680 1.716 1.00 0.00 N ATOM 1385 CA THR A 797 4.359 2.679 2.981 1.00 0.00 C ATOM 1386 C THR A 797 5.709 1.993 2.839 1.00 0.00 C ATOM 1387 O THR A 797 6.692 2.451 3.407 1.00 0.00 O ATOM 1388 CB THR A 797 3.552 2.001 4.111 1.00 0.00 C ATOM 1389 OG1 THR A 797 4.030 2.447 5.384 1.00 0.00 O ATOM 1390 CG2 THR A 797 3.654 0.482 4.040 1.00 0.00 C ATOM 0 H THR A 797 2.750 2.177 1.739 1.00 0.00 H new ATOM 0 HA THR A 797 4.512 3.724 3.252 1.00 0.00 H new ATOM 0 HB THR A 797 2.506 2.280 3.984 1.00 0.00 H new ATOM 0 HG1 THR A 797 4.768 1.872 5.676 1.00 0.00 H new ATOM 0 HG21 THR A 797 3.074 0.040 4.850 1.00 0.00 H new ATOM 0 HG22 THR A 797 3.263 0.135 3.083 1.00 0.00 H new ATOM 0 HG23 THR A 797 4.698 0.183 4.136 1.00 0.00 H new ATOM 1398 N ASN A 798 5.752 0.881 2.103 1.00 0.00 N ATOM 1399 CA ASN A 798 7.005 0.178 1.889 1.00 0.00 C ATOM 1400 C ASN A 798 7.883 1.038 1.013 1.00 0.00 C ATOM 1401 O ASN A 798 9.110 0.977 1.080 1.00 0.00 O ATOM 1402 CB ASN A 798 6.774 -1.208 1.271 1.00 0.00 C ATOM 1403 CG ASN A 798 6.487 -1.202 -0.222 1.00 0.00 C ATOM 1404 OD1 ASN A 798 6.947 -0.340 -0.968 1.00 0.00 O ATOM 1405 ND2 ASN A 798 5.733 -2.196 -0.671 1.00 0.00 N ATOM 0 H ASN A 798 4.941 0.457 1.653 1.00 0.00 H new ATOM 0 HA ASN A 798 7.499 0.005 2.845 1.00 0.00 H new ATOM 0 HB2 ASN A 798 7.655 -1.823 1.455 1.00 0.00 H new ATOM 0 HB3 ASN A 798 5.939 -1.685 1.785 1.00 0.00 H new ATOM 0 HD21 ASN A 798 5.517 -2.263 -1.666 1.00 0.00 H new ATOM 0 HD22 ASN A 798 5.369 -2.893 -0.022 1.00 0.00 H new ATOM 1412 N CYS A 799 7.237 1.870 0.200 1.00 0.00 N ATOM 1413 CA CYS A 799 7.966 2.758 -0.661 1.00 0.00 C ATOM 1414 C CYS A 799 8.459 3.941 0.151 1.00 0.00 C ATOM 1415 O CYS A 799 9.495 4.529 -0.122 1.00 0.00 O ATOM 1416 CB CYS A 799 7.133 3.211 -1.835 1.00 0.00 C ATOM 1417 SG CYS A 799 7.993 4.416 -2.860 1.00 0.00 S ATOM 0 H CYS A 799 6.222 1.938 0.129 1.00 0.00 H new ATOM 0 HA CYS A 799 8.820 2.222 -1.076 1.00 0.00 H new ATOM 0 HB2 CYS A 799 6.865 2.346 -2.442 1.00 0.00 H new ATOM 0 HB3 CYS A 799 6.202 3.646 -1.471 1.00 0.00 H new ATOM 0 HG CYS A 799 7.648 4.254 -4.103 1.00 0.00 H new ATOM 1423 N LYS A 800 7.675 4.269 1.154 1.00 0.00 N ATOM 1424 CA LYS A 800 7.958 5.348 2.079 1.00 0.00 C ATOM 1425 C LYS A 800 8.894 4.862 3.183 1.00 0.00 C ATOM 1426 O LYS A 800 9.554 5.643 3.865 1.00 0.00 O ATOM 1427 CB LYS A 800 6.645 5.771 2.688 1.00 0.00 C ATOM 1428 CG LYS A 800 5.805 6.679 1.835 1.00 0.00 C ATOM 1429 CD LYS A 800 4.339 6.476 2.158 1.00 0.00 C ATOM 1430 CE LYS A 800 3.482 7.435 1.389 1.00 0.00 C ATOM 1431 NZ LYS A 800 2.050 7.358 1.788 1.00 0.00 N ATOM 0 H LYS A 800 6.802 3.782 1.355 1.00 0.00 H new ATOM 0 HA LYS A 800 8.438 6.178 1.561 1.00 0.00 H new ATOM 0 HB2 LYS A 800 6.065 4.877 2.918 1.00 0.00 H new ATOM 0 HB3 LYS A 800 6.847 6.273 3.634 1.00 0.00 H new ATOM 0 HG2 LYS A 800 6.085 7.718 2.009 1.00 0.00 H new ATOM 0 HG3 LYS A 800 5.986 6.473 0.780 1.00 0.00 H new ATOM 0 HD2 LYS A 800 4.049 5.453 1.920 1.00 0.00 H new ATOM 0 HD3 LYS A 800 4.176 6.614 3.227 1.00 0.00 H new ATOM 0 HE2 LYS A 800 3.846 8.450 1.545 1.00 0.00 H new ATOM 0 HE3 LYS A 800 3.572 7.225 0.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 800 1.478 7.937 1.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 800 1.730 6.369 1.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 800 1.941 7.714 2.759 1.00 0.00 H new ATOM 1445 N GLU A 801 8.914 3.546 3.349 1.00 0.00 N ATOM 1446 CA GLU A 801 9.702 2.886 4.385 1.00 0.00 C ATOM 1447 C GLU A 801 11.171 2.833 4.051 1.00 0.00 C ATOM 1448 O GLU A 801 12.021 3.392 4.743 1.00 0.00 O ATOM 1449 CB GLU A 801 9.243 1.433 4.487 1.00 0.00 C ATOM 1450 CG GLU A 801 8.697 1.027 5.844 1.00 0.00 C ATOM 1451 CD GLU A 801 7.663 2.001 6.376 1.00 0.00 C ATOM 1452 OE1 GLU A 801 8.060 2.993 7.024 1.00 0.00 O ATOM 1453 OE2 GLU A 801 6.458 1.771 6.146 1.00 0.00 O ATOM 0 H GLU A 801 8.381 2.901 2.766 1.00 0.00 H new ATOM 0 HA GLU A 801 9.560 3.454 5.304 1.00 0.00 H new ATOM 0 HB2 GLU A 801 8.474 1.257 3.735 1.00 0.00 H new ATOM 0 HB3 GLU A 801 10.084 0.784 4.241 1.00 0.00 H new ATOM 0 HG2 GLU A 801 8.251 0.035 5.769 1.00 0.00 H new ATOM 0 HG3 GLU A 801 9.520 0.954 6.555 1.00 0.00 H new ATOM 1460 N TYR A 802 11.429 2.159 2.958 1.00 0.00 N ATOM 1461 CA TYR A 802 12.761 1.908 2.475 1.00 0.00 C ATOM 1462 C TYR A 802 13.326 3.069 1.690 1.00 0.00 C ATOM 1463 O TYR A 802 14.384 3.610 2.008 1.00 0.00 O ATOM 1464 CB TYR A 802 12.669 0.685 1.581 1.00 0.00 C ATOM 1465 CG TYR A 802 13.952 0.253 0.939 1.00 0.00 C ATOM 1466 CD1 TYR A 802 15.197 0.738 1.328 1.00 0.00 C ATOM 1467 CD2 TYR A 802 13.888 -0.631 -0.098 1.00 0.00 C ATOM 1468 CE1 TYR A 802 16.343 0.326 0.683 1.00 0.00 C ATOM 1469 CE2 TYR A 802 15.013 -1.044 -0.755 1.00 0.00 C ATOM 1470 CZ TYR A 802 16.245 -0.565 -0.362 1.00 0.00 C ATOM 1471 OH TYR A 802 17.377 -0.966 -1.021 1.00 0.00 O ATOM 0 H TYR A 802 10.700 1.761 2.366 1.00 0.00 H new ATOM 0 HA TYR A 802 13.432 1.758 3.321 1.00 0.00 H new ATOM 0 HB2 TYR A 802 12.281 -0.146 2.171 1.00 0.00 H new ATOM 0 HB3 TYR A 802 11.940 0.885 0.796 1.00 0.00 H new ATOM 0 HD1 TYR A 802 15.266 1.444 2.143 1.00 0.00 H new ATOM 0 HD2 TYR A 802 12.926 -1.013 -0.407 1.00 0.00 H new ATOM 0 HE1 TYR A 802 17.308 0.698 0.994 1.00 0.00 H new ATOM 0 HE2 TYR A 802 14.938 -1.741 -1.577 1.00 0.00 H new ATOM 0 HH TYR A 802 17.980 -1.414 -0.392 1.00 0.00 H new ATOM 1481 N ASN A 803 12.608 3.427 0.660 1.00 0.00 N ATOM 1482 CA ASN A 803 13.021 4.499 -0.225 1.00 0.00 C ATOM 1483 C ASN A 803 13.137 5.812 0.517 1.00 0.00 C ATOM 1484 O ASN A 803 12.632 5.957 1.629 1.00 0.00 O ATOM 1485 CB ASN A 803 12.015 4.649 -1.364 1.00 0.00 C ATOM 1486 CG ASN A 803 11.597 3.315 -1.955 1.00 0.00 C ATOM 1487 OD1 ASN A 803 12.003 2.253 -1.484 1.00 0.00 O ATOM 1488 ND2 ASN A 803 10.766 3.363 -2.983 1.00 0.00 N ATOM 0 H ASN A 803 11.722 2.990 0.405 1.00 0.00 H new ATOM 0 HA ASN A 803 14.001 4.242 -0.626 1.00 0.00 H new ATOM 0 HB2 ASN A 803 11.132 5.172 -0.997 1.00 0.00 H new ATOM 0 HB3 ASN A 803 12.450 5.269 -2.148 1.00 0.00 H new ATOM 0 HD21 ASN A 803 10.438 2.499 -3.415 1.00 0.00 H new ATOM 0 HD22 ASN A 803 10.453 4.264 -3.344 1.00 0.00 H new ATOM 1495 N PRO A 804 13.909 6.745 -0.056 1.00 0.00 N ATOM 1496 CA PRO A 804 14.056 8.103 0.454 1.00 0.00 C ATOM 1497 C PRO A 804 13.130 9.060 -0.303 1.00 0.00 C ATOM 1498 O PRO A 804 12.977 8.925 -1.516 1.00 0.00 O ATOM 1499 CB PRO A 804 15.506 8.402 0.107 1.00 0.00 C ATOM 1500 CG PRO A 804 15.698 7.723 -1.210 1.00 0.00 C ATOM 1501 CD PRO A 804 14.812 6.506 -1.197 1.00 0.00 C ATOM 0 HA PRO A 804 13.811 8.211 1.511 1.00 0.00 H new ATOM 0 HB2 PRO A 804 15.689 9.474 0.036 1.00 0.00 H new ATOM 0 HB3 PRO A 804 16.188 8.012 0.863 1.00 0.00 H new ATOM 0 HG2 PRO A 804 15.432 8.388 -2.032 1.00 0.00 H new ATOM 0 HG3 PRO A 804 16.741 7.442 -1.353 1.00 0.00 H new ATOM 0 HD2 PRO A 804 14.259 6.403 -2.131 1.00 0.00 H new ATOM 0 HD3 PRO A 804 15.390 5.591 -1.066 1.00 0.00 H new ATOM 1509 N PRO A 805 12.481 10.031 0.379 1.00 0.00 N ATOM 1510 CA PRO A 805 11.584 10.989 -0.284 1.00 0.00 C ATOM 1511 C PRO A 805 12.278 11.761 -1.409 1.00 0.00 C ATOM 1512 O PRO A 805 11.699 12.676 -1.994 1.00 0.00 O ATOM 1513 CB PRO A 805 11.170 11.939 0.841 1.00 0.00 C ATOM 1514 CG PRO A 805 11.366 11.156 2.091 1.00 0.00 C ATOM 1515 CD PRO A 805 12.546 10.264 1.831 1.00 0.00 C ATOM 0 HA PRO A 805 10.743 10.487 -0.763 1.00 0.00 H new ATOM 0 HB2 PRO A 805 11.780 12.842 0.840 1.00 0.00 H new ATOM 0 HB3 PRO A 805 10.133 12.255 0.731 1.00 0.00 H new ATOM 0 HG2 PRO A 805 11.552 11.814 2.940 1.00 0.00 H new ATOM 0 HG3 PRO A 805 10.478 10.571 2.330 1.00 0.00 H new ATOM 0 HD2 PRO A 805 13.482 10.741 2.120 1.00 0.00 H new ATOM 0 HD3 PRO A 805 12.477 9.332 2.392 1.00 0.00 H new ATOM 1523 N GLU A 806 13.526 11.386 -1.704 1.00 0.00 N ATOM 1524 CA GLU A 806 14.301 12.014 -2.749 1.00 0.00 C ATOM 1525 C GLU A 806 14.205 11.180 -4.021 1.00 0.00 C ATOM 1526 O GLU A 806 14.167 11.714 -5.130 1.00 0.00 O ATOM 1527 CB GLU A 806 15.744 12.134 -2.282 1.00 0.00 C ATOM 1528 CG GLU A 806 16.700 11.486 -3.232 1.00 0.00 C ATOM 1529 CD GLU A 806 18.154 11.773 -2.910 1.00 0.00 C ATOM 1530 OE1 GLU A 806 18.717 11.076 -2.041 1.00 0.00 O ATOM 1531 OE2 GLU A 806 18.728 12.694 -3.528 1.00 0.00 O ATOM 0 H GLU A 806 14.018 10.636 -1.218 1.00 0.00 H new ATOM 0 HA GLU A 806 13.916 13.011 -2.965 1.00 0.00 H new ATOM 0 HB2 GLU A 806 16.002 13.187 -2.171 1.00 0.00 H new ATOM 0 HB3 GLU A 806 15.845 11.676 -1.298 1.00 0.00 H new ATOM 0 HG2 GLU A 806 16.539 10.408 -3.220 1.00 0.00 H new ATOM 0 HG3 GLU A 806 16.485 11.829 -4.244 1.00 0.00 H new ATOM 1538 N SER A 807 14.165 9.861 -3.844 1.00 0.00 N ATOM 1539 CA SER A 807 14.061 8.941 -4.967 1.00 0.00 C ATOM 1540 C SER A 807 12.776 9.195 -5.737 1.00 0.00 C ATOM 1541 O SER A 807 11.932 9.982 -5.310 1.00 0.00 O ATOM 1542 CB SER A 807 14.100 7.490 -4.484 1.00 0.00 C ATOM 1543 OG SER A 807 15.407 7.123 -4.080 1.00 0.00 O ATOM 0 H SER A 807 14.203 9.408 -2.931 1.00 0.00 H new ATOM 0 HA SER A 807 14.912 9.111 -5.627 1.00 0.00 H new ATOM 0 HB2 SER A 807 13.409 7.362 -3.651 1.00 0.00 H new ATOM 0 HB3 SER A 807 13.763 6.828 -5.282 1.00 0.00 H new ATOM 0 HG SER A 807 15.669 6.294 -4.533 1.00 0.00 H new ATOM 1549 N GLU A 808 12.630 8.526 -6.867 1.00 0.00 N ATOM 1550 CA GLU A 808 11.442 8.690 -7.688 1.00 0.00 C ATOM 1551 C GLU A 808 10.247 8.039 -7.038 1.00 0.00 C ATOM 1552 O GLU A 808 9.153 8.601 -6.997 1.00 0.00 O ATOM 1553 CB GLU A 808 11.601 8.014 -9.048 1.00 0.00 C ATOM 1554 CG GLU A 808 13.020 7.692 -9.459 1.00 0.00 C ATOM 1555 CD GLU A 808 13.977 8.857 -9.274 1.00 0.00 C ATOM 1556 OE1 GLU A 808 13.909 9.813 -10.074 1.00 0.00 O ATOM 1557 OE2 GLU A 808 14.794 8.814 -8.331 1.00 0.00 O ATOM 0 H GLU A 808 13.315 7.867 -7.236 1.00 0.00 H new ATOM 0 HA GLU A 808 11.301 9.765 -7.803 1.00 0.00 H new ATOM 0 HB2 GLU A 808 11.025 7.089 -9.043 1.00 0.00 H new ATOM 0 HB3 GLU A 808 11.160 8.659 -9.808 1.00 0.00 H new ATOM 0 HG2 GLU A 808 13.376 6.842 -8.877 1.00 0.00 H new ATOM 0 HG3 GLU A 808 13.028 7.387 -10.505 1.00 0.00 H new ATOM 1564 N TYR A 809 10.478 6.847 -6.519 1.00 0.00 N ATOM 1565 CA TYR A 809 9.404 6.050 -5.955 1.00 0.00 C ATOM 1566 C TYR A 809 8.800 6.621 -4.676 1.00 0.00 C ATOM 1567 O TYR A 809 7.586 6.784 -4.596 1.00 0.00 O ATOM 1568 CB TYR A 809 9.861 4.639 -5.702 1.00 0.00 C ATOM 1569 CG TYR A 809 11.061 4.218 -6.501 1.00 0.00 C ATOM 1570 CD1 TYR A 809 11.302 4.615 -7.801 1.00 0.00 C ATOM 1571 CD2 TYR A 809 11.964 3.425 -5.904 1.00 0.00 C ATOM 1572 CE1 TYR A 809 12.443 4.199 -8.460 1.00 0.00 C ATOM 1573 CE2 TYR A 809 13.088 3.002 -6.522 1.00 0.00 C ATOM 1574 CZ TYR A 809 13.335 3.390 -7.816 1.00 0.00 C ATOM 1575 OH TYR A 809 14.461 2.970 -8.473 1.00 0.00 O ATOM 0 H TYR A 809 11.399 6.410 -6.476 1.00 0.00 H new ATOM 0 HA TYR A 809 8.616 6.067 -6.707 1.00 0.00 H new ATOM 0 HB2 TYR A 809 10.090 4.530 -4.642 1.00 0.00 H new ATOM 0 HB3 TYR A 809 9.038 3.959 -5.922 1.00 0.00 H new ATOM 0 HD1 TYR A 809 10.594 5.255 -8.306 1.00 0.00 H new ATOM 0 HD2 TYR A 809 11.784 3.112 -4.886 1.00 0.00 H new ATOM 0 HE1 TYR A 809 12.628 4.511 -9.477 1.00 0.00 H new ATOM 0 HE2 TYR A 809 13.787 2.364 -6.003 1.00 0.00 H new ATOM 0 HH TYR A 809 14.593 3.514 -9.277 1.00 0.00 H new ATOM 1585 N TYR A 810 9.627 6.887 -3.665 1.00 0.00 N ATOM 1586 CA TYR A 810 9.110 7.404 -2.393 1.00 0.00 C ATOM 1587 C TYR A 810 8.019 8.446 -2.609 1.00 0.00 C ATOM 1588 O TYR A 810 6.895 8.279 -2.143 1.00 0.00 O ATOM 1589 CB TYR A 810 10.224 8.008 -1.540 1.00 0.00 C ATOM 1590 CG TYR A 810 9.843 8.158 -0.082 1.00 0.00 C ATOM 1591 CD1 TYR A 810 8.648 8.730 0.283 1.00 0.00 C ATOM 1592 CD2 TYR A 810 10.676 7.717 0.919 1.00 0.00 C ATOM 1593 CE1 TYR A 810 8.291 8.859 1.608 1.00 0.00 C ATOM 1594 CE2 TYR A 810 10.338 7.840 2.250 1.00 0.00 C ATOM 1595 CZ TYR A 810 9.140 8.413 2.591 1.00 0.00 C ATOM 1596 OH TYR A 810 8.787 8.540 3.915 1.00 0.00 O ATOM 0 H TYR A 810 10.638 6.757 -3.697 1.00 0.00 H new ATOM 0 HA TYR A 810 8.681 6.552 -1.865 1.00 0.00 H new ATOM 0 HB2 TYR A 810 11.111 7.379 -1.614 1.00 0.00 H new ATOM 0 HB3 TYR A 810 10.491 8.985 -1.942 1.00 0.00 H new ATOM 0 HD1 TYR A 810 7.975 9.085 -0.483 1.00 0.00 H new ATOM 0 HD2 TYR A 810 11.620 7.262 0.656 1.00 0.00 H new ATOM 0 HE1 TYR A 810 7.346 9.310 1.873 1.00 0.00 H new ATOM 0 HE2 TYR A 810 11.011 7.488 3.018 1.00 0.00 H new ATOM 0 HH TYR A 810 8.886 7.675 4.364 1.00 0.00 H new ATOM 1606 N LYS A 811 8.345 9.527 -3.289 1.00 0.00 N ATOM 1607 CA LYS A 811 7.355 10.564 -3.546 1.00 0.00 C ATOM 1608 C LYS A 811 6.190 9.967 -4.300 1.00 0.00 C ATOM 1609 O LYS A 811 5.039 10.297 -4.043 1.00 0.00 O ATOM 1610 CB LYS A 811 7.949 11.698 -4.361 1.00 0.00 C ATOM 1611 CG LYS A 811 9.442 11.572 -4.574 1.00 0.00 C ATOM 1612 CD LYS A 811 9.912 12.460 -5.706 1.00 0.00 C ATOM 1613 CE LYS A 811 9.629 13.910 -5.388 1.00 0.00 C ATOM 1614 NZ LYS A 811 9.215 14.679 -6.594 1.00 0.00 N ATOM 0 H LYS A 811 9.273 9.713 -3.670 1.00 0.00 H new ATOM 0 HA LYS A 811 7.021 10.965 -2.589 1.00 0.00 H new ATOM 0 HB2 LYS A 811 7.454 11.736 -5.331 1.00 0.00 H new ATOM 0 HB3 LYS A 811 7.740 12.643 -3.860 1.00 0.00 H new ATOM 0 HG2 LYS A 811 9.966 11.840 -3.657 1.00 0.00 H new ATOM 0 HG3 LYS A 811 9.694 10.535 -4.794 1.00 0.00 H new ATOM 0 HD2 LYS A 811 10.980 12.318 -5.869 1.00 0.00 H new ATOM 0 HD3 LYS A 811 9.409 12.179 -6.631 1.00 0.00 H new ATOM 0 HE2 LYS A 811 8.844 13.969 -4.634 1.00 0.00 H new ATOM 0 HE3 LYS A 811 10.520 14.366 -4.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 811 9.031 15.668 -6.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 811 9.974 14.646 -7.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 811 8.350 14.261 -6.992 1.00 0.00 H new ATOM 1628 N CYS A 812 6.507 9.094 -5.241 1.00 0.00 N ATOM 1629 CA CYS A 812 5.492 8.419 -6.027 1.00 0.00 C ATOM 1630 C CYS A 812 4.572 7.629 -5.110 1.00 0.00 C ATOM 1631 O CYS A 812 3.443 7.320 -5.464 1.00 0.00 O ATOM 1632 CB CYS A 812 6.150 7.487 -7.040 1.00 0.00 C ATOM 1633 SG CYS A 812 6.664 8.296 -8.573 1.00 0.00 S ATOM 0 H CYS A 812 7.465 8.836 -5.479 1.00 0.00 H new ATOM 0 HA CYS A 812 4.904 9.163 -6.565 1.00 0.00 H new ATOM 0 HB2 CYS A 812 7.022 7.024 -6.577 1.00 0.00 H new ATOM 0 HB3 CYS A 812 5.454 6.684 -7.283 1.00 0.00 H new ATOM 0 HG CYS A 812 7.915 8.637 -8.485 1.00 0.00 H new ATOM 1639 N ALA A 813 5.069 7.309 -3.926 1.00 0.00 N ATOM 1640 CA ALA A 813 4.291 6.569 -2.947 1.00 0.00 C ATOM 1641 C ALA A 813 3.287 7.498 -2.292 1.00 0.00 C ATOM 1642 O ALA A 813 2.105 7.203 -2.231 1.00 0.00 O ATOM 1643 CB ALA A 813 5.212 5.948 -1.914 1.00 0.00 C ATOM 0 H ALA A 813 6.011 7.551 -3.619 1.00 0.00 H new ATOM 0 HA ALA A 813 3.748 5.764 -3.443 1.00 0.00 H new ATOM 0 HB1 ALA A 813 4.620 5.395 -1.184 1.00 0.00 H new ATOM 0 HB2 ALA A 813 5.907 5.268 -2.408 1.00 0.00 H new ATOM 0 HB3 ALA A 813 5.772 6.734 -1.407 1.00 0.00 H new ATOM 1649 N ASN A 814 3.790 8.623 -1.811 1.00 0.00 N ATOM 1650 CA ASN A 814 2.981 9.649 -1.184 1.00 0.00 C ATOM 1651 C ASN A 814 1.946 10.163 -2.172 1.00 0.00 C ATOM 1652 O ASN A 814 0.765 10.331 -1.862 1.00 0.00 O ATOM 1653 CB ASN A 814 3.899 10.794 -0.793 1.00 0.00 C ATOM 1654 CG ASN A 814 3.282 11.727 0.232 1.00 0.00 C ATOM 1655 OD1 ASN A 814 2.064 11.896 0.281 1.00 0.00 O ATOM 1656 ND2 ASN A 814 4.124 12.340 1.055 1.00 0.00 N ATOM 0 H ASN A 814 4.784 8.850 -1.847 1.00 0.00 H new ATOM 0 HA ASN A 814 2.471 9.243 -0.311 1.00 0.00 H new ATOM 0 HB2 ASN A 814 4.828 10.387 -0.393 1.00 0.00 H new ATOM 0 HB3 ASN A 814 4.159 11.364 -1.685 1.00 0.00 H new ATOM 0 HD21 ASN A 814 3.768 12.981 1.764 1.00 0.00 H new ATOM 0 HD22 ASN A 814 5.127 12.170 0.978 1.00 0.00 H new ATOM 1663 N ILE A 815 2.440 10.385 -3.373 1.00 0.00 N ATOM 1664 CA ILE A 815 1.658 10.894 -4.481 1.00 0.00 C ATOM 1665 C ILE A 815 0.556 9.928 -4.841 1.00 0.00 C ATOM 1666 O ILE A 815 -0.621 10.280 -4.850 1.00 0.00 O ATOM 1667 CB ILE A 815 2.563 11.139 -5.682 1.00 0.00 C ATOM 1668 CG1 ILE A 815 3.314 12.439 -5.468 1.00 0.00 C ATOM 1669 CG2 ILE A 815 1.774 11.159 -6.974 1.00 0.00 C ATOM 1670 CD1 ILE A 815 4.619 12.485 -6.191 1.00 0.00 C ATOM 0 H ILE A 815 3.417 10.213 -3.611 1.00 0.00 H new ATOM 0 HA ILE A 815 1.200 11.837 -4.184 1.00 0.00 H new ATOM 0 HB ILE A 815 3.278 10.321 -5.770 1.00 0.00 H new ATOM 0 HG12 ILE A 815 2.692 13.270 -5.800 1.00 0.00 H new ATOM 0 HG13 ILE A 815 3.491 12.579 -4.402 1.00 0.00 H new ATOM 0 HG21 ILE A 815 2.450 11.336 -7.810 1.00 0.00 H new ATOM 0 HG22 ILE A 815 1.273 10.201 -7.109 1.00 0.00 H new ATOM 0 HG23 ILE A 815 1.030 11.955 -6.934 1.00 0.00 H new ATOM 0 HD11 ILE A 815 5.108 13.440 -5.998 1.00 0.00 H new ATOM 0 HD12 ILE A 815 5.257 11.673 -5.842 1.00 0.00 H new ATOM 0 HD13 ILE A 815 4.446 12.376 -7.262 1.00 0.00 H new ATOM 1682 N LEU A 816 0.954 8.713 -5.166 1.00 0.00 N ATOM 1683 CA LEU A 816 0.005 7.674 -5.485 1.00 0.00 C ATOM 1684 C LEU A 816 -0.972 7.558 -4.338 1.00 0.00 C ATOM 1685 O LEU A 816 -2.169 7.700 -4.508 1.00 0.00 O ATOM 1686 CB LEU A 816 0.733 6.355 -5.680 1.00 0.00 C ATOM 1687 CG LEU A 816 0.072 5.374 -6.616 1.00 0.00 C ATOM 1688 CD1 LEU A 816 0.868 4.109 -6.659 1.00 0.00 C ATOM 1689 CD2 LEU A 816 -1.330 5.124 -6.178 1.00 0.00 C ATOM 0 H LEU A 816 1.931 8.425 -5.215 1.00 0.00 H new ATOM 0 HA LEU A 816 -0.525 7.917 -6.406 1.00 0.00 H new ATOM 0 HB2 LEU A 816 1.735 6.566 -6.053 1.00 0.00 H new ATOM 0 HB3 LEU A 816 0.849 5.878 -4.707 1.00 0.00 H new ATOM 0 HG LEU A 816 0.038 5.788 -7.624 1.00 0.00 H new ATOM 0 HD11 LEU A 816 0.390 3.401 -7.336 1.00 0.00 H new ATOM 0 HD12 LEU A 816 1.876 4.325 -7.013 1.00 0.00 H new ATOM 0 HD13 LEU A 816 0.920 3.677 -5.659 1.00 0.00 H new ATOM 0 HD21 LEU A 816 -1.803 4.415 -6.858 1.00 0.00 H new ATOM 0 HD22 LEU A 816 -1.328 4.713 -5.168 1.00 0.00 H new ATOM 0 HD23 LEU A 816 -1.887 6.061 -6.187 1.00 0.00 H new ATOM 1701 N GLU A 817 -0.423 7.329 -3.164 1.00 0.00 N ATOM 1702 CA GLU A 817 -1.204 7.205 -1.947 1.00 0.00 C ATOM 1703 C GLU A 817 -2.267 8.311 -1.868 1.00 0.00 C ATOM 1704 O GLU A 817 -3.317 8.147 -1.265 1.00 0.00 O ATOM 1705 CB GLU A 817 -0.258 7.295 -0.752 1.00 0.00 C ATOM 1706 CG GLU A 817 -0.884 6.874 0.567 1.00 0.00 C ATOM 1707 CD GLU A 817 -1.313 8.058 1.413 1.00 0.00 C ATOM 1708 OE1 GLU A 817 -2.414 8.595 1.169 1.00 0.00 O ATOM 1709 OE2 GLU A 817 -0.548 8.447 2.320 1.00 0.00 O ATOM 0 H GLU A 817 0.582 7.223 -3.024 1.00 0.00 H new ATOM 0 HA GLU A 817 -1.721 6.245 -1.942 1.00 0.00 H new ATOM 0 HB2 GLU A 817 0.614 6.670 -0.944 1.00 0.00 H new ATOM 0 HB3 GLU A 817 0.099 8.321 -0.661 1.00 0.00 H new ATOM 0 HG2 GLU A 817 -1.749 6.241 0.369 1.00 0.00 H new ATOM 0 HG3 GLU A 817 -0.170 6.271 1.128 1.00 0.00 H new ATOM 1716 N LYS A 818 -1.966 9.446 -2.474 1.00 0.00 N ATOM 1717 CA LYS A 818 -2.856 10.576 -2.517 1.00 0.00 C ATOM 1718 C LYS A 818 -3.925 10.391 -3.606 1.00 0.00 C ATOM 1719 O LYS A 818 -5.123 10.486 -3.328 1.00 0.00 O ATOM 1720 CB LYS A 818 -1.963 11.758 -2.731 1.00 0.00 C ATOM 1721 CG LYS A 818 -2.415 12.675 -3.796 1.00 0.00 C ATOM 1722 CD LYS A 818 -1.235 13.400 -4.413 1.00 0.00 C ATOM 1723 CE LYS A 818 -1.287 13.331 -5.924 1.00 0.00 C ATOM 1724 NZ LYS A 818 -2.516 13.970 -6.470 1.00 0.00 N ATOM 0 H LYS A 818 -1.081 9.603 -2.955 1.00 0.00 H new ATOM 0 HA LYS A 818 -3.435 10.705 -1.602 1.00 0.00 H new ATOM 0 HB2 LYS A 818 -1.886 12.314 -1.797 1.00 0.00 H new ATOM 0 HB3 LYS A 818 -0.962 11.403 -2.974 1.00 0.00 H new ATOM 0 HG2 LYS A 818 -2.946 12.114 -4.565 1.00 0.00 H new ATOM 0 HG3 LYS A 818 -3.119 13.399 -3.385 1.00 0.00 H new ATOM 0 HD2 LYS A 818 -1.236 14.442 -4.093 1.00 0.00 H new ATOM 0 HD3 LYS A 818 -0.305 12.957 -4.057 1.00 0.00 H new ATOM 0 HE2 LYS A 818 -0.408 13.823 -6.340 1.00 0.00 H new ATOM 0 HE3 LYS A 818 -1.249 12.289 -6.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 818 -2.413 14.099 -7.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 818 -3.338 13.362 -6.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 818 -2.657 14.896 -6.017 1.00 0.00 H new ATOM 1738 N PHE A 819 -3.491 10.128 -4.841 1.00 0.00 N ATOM 1739 CA PHE A 819 -4.419 9.877 -5.944 1.00 0.00 C ATOM 1740 C PHE A 819 -5.299 8.713 -5.534 1.00 0.00 C ATOM 1741 O PHE A 819 -6.528 8.796 -5.533 1.00 0.00 O ATOM 1742 CB PHE A 819 -3.612 9.551 -7.210 1.00 0.00 C ATOM 1743 CG PHE A 819 -4.336 8.792 -8.305 1.00 0.00 C ATOM 1744 CD1 PHE A 819 -4.788 7.492 -8.107 1.00 0.00 C ATOM 1745 CD2 PHE A 819 -4.515 9.364 -9.554 1.00 0.00 C ATOM 1746 CE1 PHE A 819 -5.395 6.787 -9.108 1.00 0.00 C ATOM 1747 CE2 PHE A 819 -5.136 8.660 -10.571 1.00 0.00 C ATOM 1748 CZ PHE A 819 -5.574 7.368 -10.348 1.00 0.00 C ATOM 0 H PHE A 819 -2.506 10.084 -5.101 1.00 0.00 H new ATOM 0 HA PHE A 819 -5.041 10.746 -6.159 1.00 0.00 H new ATOM 0 HB2 PHE A 819 -3.246 10.488 -7.631 1.00 0.00 H new ATOM 0 HB3 PHE A 819 -2.737 8.971 -6.916 1.00 0.00 H new ATOM 0 HD1 PHE A 819 -4.656 7.029 -7.140 1.00 0.00 H new ATOM 0 HD2 PHE A 819 -4.166 10.370 -9.736 1.00 0.00 H new ATOM 0 HE1 PHE A 819 -5.734 5.777 -8.930 1.00 0.00 H new ATOM 0 HE2 PHE A 819 -5.278 9.120 -11.538 1.00 0.00 H new ATOM 0 HZ PHE A 819 -6.055 6.815 -11.141 1.00 0.00 H new ATOM 1758 N PHE A 820 -4.626 7.616 -5.219 1.00 0.00 N ATOM 1759 CA PHE A 820 -5.261 6.417 -4.731 1.00 0.00 C ATOM 1760 C PHE A 820 -6.281 6.802 -3.691 1.00 0.00 C ATOM 1761 O PHE A 820 -7.415 6.359 -3.767 1.00 0.00 O ATOM 1762 CB PHE A 820 -4.182 5.476 -4.207 1.00 0.00 C ATOM 1763 CG PHE A 820 -4.438 4.809 -2.906 1.00 0.00 C ATOM 1764 CD1 PHE A 820 -4.037 5.338 -1.706 1.00 0.00 C ATOM 1765 CD2 PHE A 820 -5.012 3.598 -2.918 1.00 0.00 C ATOM 1766 CE1 PHE A 820 -4.242 4.635 -0.532 1.00 0.00 C ATOM 1767 CE2 PHE A 820 -5.207 2.887 -1.787 1.00 0.00 C ATOM 1768 CZ PHE A 820 -4.831 3.394 -0.581 1.00 0.00 C ATOM 0 H PHE A 820 -3.612 7.540 -5.299 1.00 0.00 H new ATOM 0 HA PHE A 820 -5.795 5.885 -5.519 1.00 0.00 H new ATOM 0 HB2 PHE A 820 -4.015 4.702 -4.956 1.00 0.00 H new ATOM 0 HB3 PHE A 820 -3.254 6.041 -4.120 1.00 0.00 H new ATOM 0 HD1 PHE A 820 -3.560 6.306 -1.677 1.00 0.00 H new ATOM 0 HD2 PHE A 820 -5.328 3.178 -3.861 1.00 0.00 H new ATOM 0 HE1 PHE A 820 -3.942 5.058 0.415 1.00 0.00 H new ATOM 0 HE2 PHE A 820 -5.664 1.910 -1.839 1.00 0.00 H new ATOM 0 HZ PHE A 820 -4.993 2.829 0.325 1.00 0.00 H new ATOM 1778 N PHE A 821 -5.898 7.688 -2.767 1.00 0.00 N ATOM 1779 CA PHE A 821 -6.825 8.133 -1.737 1.00 0.00 C ATOM 1780 C PHE A 821 -8.100 8.694 -2.333 1.00 0.00 C ATOM 1781 O PHE A 821 -9.181 8.479 -1.796 1.00 0.00 O ATOM 1782 CB PHE A 821 -6.172 9.115 -0.779 1.00 0.00 C ATOM 1783 CG PHE A 821 -5.997 8.483 0.562 1.00 0.00 C ATOM 1784 CD1 PHE A 821 -5.239 7.351 0.645 1.00 0.00 C ATOM 1785 CD2 PHE A 821 -6.642 8.946 1.696 1.00 0.00 C ATOM 1786 CE1 PHE A 821 -5.096 6.663 1.824 1.00 0.00 C ATOM 1787 CE2 PHE A 821 -6.497 8.278 2.902 1.00 0.00 C ATOM 1788 CZ PHE A 821 -5.723 7.128 2.965 1.00 0.00 C ATOM 0 H PHE A 821 -4.967 8.102 -2.715 1.00 0.00 H new ATOM 0 HA PHE A 821 -7.103 7.254 -1.155 1.00 0.00 H new ATOM 0 HB2 PHE A 821 -5.205 9.429 -1.171 1.00 0.00 H new ATOM 0 HB3 PHE A 821 -6.786 10.011 -0.690 1.00 0.00 H new ATOM 0 HD1 PHE A 821 -4.739 6.987 -0.240 1.00 0.00 H new ATOM 0 HD2 PHE A 821 -7.260 9.830 1.641 1.00 0.00 H new ATOM 0 HE1 PHE A 821 -4.498 5.765 1.860 1.00 0.00 H new ATOM 0 HE2 PHE A 821 -6.985 8.652 3.790 1.00 0.00 H new ATOM 0 HZ PHE A 821 -5.611 6.599 3.900 1.00 0.00 H new ATOM 1798 N SER A 822 -7.983 9.397 -3.444 1.00 0.00 N ATOM 1799 CA SER A 822 -9.156 9.950 -4.101 1.00 0.00 C ATOM 1800 C SER A 822 -9.981 8.835 -4.745 1.00 0.00 C ATOM 1801 O SER A 822 -11.185 8.973 -4.925 1.00 0.00 O ATOM 1802 CB SER A 822 -8.744 10.978 -5.156 1.00 0.00 C ATOM 1803 OG SER A 822 -9.877 11.505 -5.826 1.00 0.00 O ATOM 0 H SER A 822 -7.097 9.598 -3.908 1.00 0.00 H new ATOM 0 HA SER A 822 -9.768 10.449 -3.350 1.00 0.00 H new ATOM 0 HB2 SER A 822 -8.189 11.788 -4.682 1.00 0.00 H new ATOM 0 HB3 SER A 822 -8.074 10.513 -5.879 1.00 0.00 H new ATOM 0 HG SER A 822 -9.586 12.161 -6.494 1.00 0.00 H new ATOM 1809 N LYS A 823 -9.315 7.727 -5.069 1.00 0.00 N ATOM 1810 CA LYS A 823 -9.957 6.571 -5.711 1.00 0.00 C ATOM 1811 C LYS A 823 -10.683 5.679 -4.720 1.00 0.00 C ATOM 1812 O LYS A 823 -11.756 5.151 -5.007 1.00 0.00 O ATOM 1813 CB LYS A 823 -8.895 5.748 -6.437 1.00 0.00 C ATOM 1814 CG LYS A 823 -8.151 6.504 -7.509 1.00 0.00 C ATOM 1815 CD LYS A 823 -9.102 7.189 -8.462 1.00 0.00 C ATOM 1816 CE LYS A 823 -8.489 8.419 -9.088 1.00 0.00 C ATOM 1817 NZ LYS A 823 -9.514 9.291 -9.726 1.00 0.00 N ATOM 0 H LYS A 823 -8.318 7.602 -4.896 1.00 0.00 H new ATOM 0 HA LYS A 823 -10.700 6.957 -6.409 1.00 0.00 H new ATOM 0 HB2 LYS A 823 -8.177 5.376 -5.706 1.00 0.00 H new ATOM 0 HB3 LYS A 823 -9.372 4.877 -6.887 1.00 0.00 H new ATOM 0 HG2 LYS A 823 -7.499 7.246 -7.047 1.00 0.00 H new ATOM 0 HG3 LYS A 823 -7.511 5.817 -8.063 1.00 0.00 H new ATOM 0 HD2 LYS A 823 -9.395 6.491 -9.246 1.00 0.00 H new ATOM 0 HD3 LYS A 823 -10.011 7.468 -7.929 1.00 0.00 H new ATOM 0 HE2 LYS A 823 -7.955 8.986 -8.325 1.00 0.00 H new ATOM 0 HE3 LYS A 823 -7.754 8.118 -9.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 823 -9.051 10.123 -10.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 823 -10.007 8.759 -10.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 823 -10.201 9.600 -9.009 1.00 0.00 H new ATOM 1831 N ILE A 824 -10.092 5.511 -3.563 1.00 0.00 N ATOM 1832 CA ILE A 824 -10.674 4.687 -2.524 1.00 0.00 C ATOM 1833 C ILE A 824 -11.838 5.446 -1.940 1.00 0.00 C ATOM 1834 O ILE A 824 -12.941 4.935 -1.803 1.00 0.00 O ATOM 1835 CB ILE A 824 -9.664 4.408 -1.428 1.00 0.00 C ATOM 1836 CG1 ILE A 824 -8.614 5.456 -1.453 1.00 0.00 C ATOM 1837 CG2 ILE A 824 -9.039 3.055 -1.605 1.00 0.00 C ATOM 1838 CD1 ILE A 824 -7.438 5.158 -0.600 1.00 0.00 C ATOM 0 H ILE A 824 -9.200 5.937 -3.312 1.00 0.00 H new ATOM 0 HA ILE A 824 -10.991 3.733 -2.946 1.00 0.00 H new ATOM 0 HB ILE A 824 -10.177 4.421 -0.467 1.00 0.00 H new ATOM 0 HG12 ILE A 824 -8.278 5.593 -2.481 1.00 0.00 H new ATOM 0 HG13 ILE A 824 -9.052 6.401 -1.132 1.00 0.00 H new ATOM 0 HG21 ILE A 824 -8.319 2.880 -0.806 1.00 0.00 H new ATOM 0 HG22 ILE A 824 -9.814 2.289 -1.570 1.00 0.00 H new ATOM 0 HG23 ILE A 824 -8.530 3.012 -2.568 1.00 0.00 H new ATOM 0 HD11 ILE A 824 -6.718 5.973 -0.675 1.00 0.00 H new ATOM 0 HD12 ILE A 824 -7.758 5.051 0.436 1.00 0.00 H new ATOM 0 HD13 ILE A 824 -6.972 4.231 -0.934 1.00 0.00 H new ATOM 1850 N LYS A 825 -11.562 6.706 -1.647 1.00 0.00 N ATOM 1851 CA LYS A 825 -12.549 7.602 -1.089 1.00 0.00 C ATOM 1852 C LYS A 825 -13.781 7.577 -1.963 1.00 0.00 C ATOM 1853 O LYS A 825 -14.908 7.396 -1.503 1.00 0.00 O ATOM 1854 CB LYS A 825 -12.028 9.027 -1.058 1.00 0.00 C ATOM 1855 CG LYS A 825 -11.908 9.583 0.341 1.00 0.00 C ATOM 1856 CD LYS A 825 -11.361 10.987 0.337 1.00 0.00 C ATOM 1857 CE LYS A 825 -9.879 10.979 0.032 1.00 0.00 C ATOM 1858 NZ LYS A 825 -9.476 12.133 -0.819 1.00 0.00 N ATOM 0 H LYS A 825 -10.646 7.132 -1.791 1.00 0.00 H new ATOM 0 HA LYS A 825 -12.776 7.277 -0.074 1.00 0.00 H new ATOM 0 HB2 LYS A 825 -11.052 9.061 -1.541 1.00 0.00 H new ATOM 0 HB3 LYS A 825 -12.694 9.664 -1.640 1.00 0.00 H new ATOM 0 HG2 LYS A 825 -12.887 9.575 0.821 1.00 0.00 H new ATOM 0 HG3 LYS A 825 -11.257 8.940 0.934 1.00 0.00 H new ATOM 0 HD2 LYS A 825 -11.888 11.586 -0.406 1.00 0.00 H new ATOM 0 HD3 LYS A 825 -11.536 11.454 1.306 1.00 0.00 H new ATOM 0 HE2 LYS A 825 -9.317 11.004 0.966 1.00 0.00 H new ATOM 0 HE3 LYS A 825 -9.618 10.049 -0.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 825 -8.453 12.088 -1.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 825 -9.992 12.096 -1.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 825 -9.700 13.022 -0.328 1.00 0.00 H new ATOM 1872 N GLU A 826 -13.516 7.770 -3.247 1.00 0.00 N ATOM 1873 CA GLU A 826 -14.542 7.787 -4.269 1.00 0.00 C ATOM 1874 C GLU A 826 -15.312 6.486 -4.262 1.00 0.00 C ATOM 1875 O GLU A 826 -16.526 6.463 -4.465 1.00 0.00 O ATOM 1876 CB GLU A 826 -13.893 8.008 -5.646 1.00 0.00 C ATOM 1877 CG GLU A 826 -13.769 6.749 -6.490 1.00 0.00 C ATOM 1878 CD GLU A 826 -15.051 6.396 -7.220 1.00 0.00 C ATOM 1879 OE1 GLU A 826 -15.443 7.153 -8.133 1.00 0.00 O ATOM 1880 OE2 GLU A 826 -15.662 5.361 -6.879 1.00 0.00 O ATOM 0 H GLU A 826 -12.574 7.920 -3.608 1.00 0.00 H new ATOM 0 HA GLU A 826 -15.236 8.602 -4.062 1.00 0.00 H new ATOM 0 HB2 GLU A 826 -14.479 8.744 -6.197 1.00 0.00 H new ATOM 0 HB3 GLU A 826 -12.900 8.434 -5.502 1.00 0.00 H new ATOM 0 HG2 GLU A 826 -12.968 6.883 -7.217 1.00 0.00 H new ATOM 0 HG3 GLU A 826 -13.481 5.916 -5.849 1.00 0.00 H new ATOM 1887 N ALA A 827 -14.592 5.404 -4.028 1.00 0.00 N ATOM 1888 CA ALA A 827 -15.195 4.090 -4.037 1.00 0.00 C ATOM 1889 C ALA A 827 -15.689 3.636 -2.664 1.00 0.00 C ATOM 1890 O ALA A 827 -15.899 2.445 -2.450 1.00 0.00 O ATOM 1891 CB ALA A 827 -14.206 3.099 -4.600 1.00 0.00 C ATOM 0 H ALA A 827 -13.591 5.412 -3.830 1.00 0.00 H new ATOM 0 HA ALA A 827 -16.083 4.143 -4.667 1.00 0.00 H new ATOM 0 HB1 ALA A 827 -14.653 2.105 -4.610 1.00 0.00 H new ATOM 0 HB2 ALA A 827 -13.940 3.388 -5.617 1.00 0.00 H new ATOM 0 HB3 ALA A 827 -13.310 3.087 -3.980 1.00 0.00 H new ATOM 1897 N GLY A 828 -15.894 4.573 -1.744 1.00 0.00 N ATOM 1898 CA GLY A 828 -16.373 4.208 -0.418 1.00 0.00 C ATOM 1899 C GLY A 828 -15.403 3.315 0.326 1.00 0.00 C ATOM 1900 O GLY A 828 -15.780 2.637 1.278 1.00 0.00 O ATOM 0 H GLY A 828 -15.739 5.571 -1.888 1.00 0.00 H new ATOM 0 HA2 GLY A 828 -16.547 5.113 0.163 1.00 0.00 H new ATOM 0 HA3 GLY A 828 -17.333 3.699 -0.510 1.00 0.00 H new ATOM 1904 N LEU A 829 -14.151 3.342 -0.101 1.00 0.00 N ATOM 1905 CA LEU A 829 -13.098 2.517 0.476 1.00 0.00 C ATOM 1906 C LEU A 829 -12.671 3.031 1.839 1.00 0.00 C ATOM 1907 O LEU A 829 -13.291 2.694 2.844 1.00 0.00 O ATOM 1908 CB LEU A 829 -11.942 2.489 -0.512 1.00 0.00 C ATOM 1909 CG LEU A 829 -12.332 1.920 -1.884 1.00 0.00 C ATOM 1910 CD1 LEU A 829 -11.190 1.229 -2.556 1.00 0.00 C ATOM 1911 CD2 LEU A 829 -13.507 0.957 -1.786 1.00 0.00 C ATOM 0 H LEU A 829 -13.833 3.941 -0.863 1.00 0.00 H new ATOM 0 HA LEU A 829 -13.462 1.504 0.645 1.00 0.00 H new ATOM 0 HB2 LEU A 829 -11.559 3.501 -0.641 1.00 0.00 H new ATOM 0 HB3 LEU A 829 -11.131 1.892 -0.095 1.00 0.00 H new ATOM 0 HG LEU A 829 -12.624 2.780 -2.487 1.00 0.00 H new ATOM 0 HD11 LEU A 829 -11.516 0.844 -3.522 1.00 0.00 H new ATOM 0 HD12 LEU A 829 -10.373 1.935 -2.703 1.00 0.00 H new ATOM 0 HD13 LEU A 829 -10.847 0.403 -1.933 1.00 0.00 H new ATOM 0 HD21 LEU A 829 -13.750 0.578 -2.778 1.00 0.00 H new ATOM 0 HD22 LEU A 829 -13.242 0.124 -1.134 1.00 0.00 H new ATOM 0 HD23 LEU A 829 -14.371 1.478 -1.375 1.00 0.00 H new ATOM 1923 N ILE A 830 -11.604 3.825 1.866 1.00 0.00 N ATOM 1924 CA ILE A 830 -11.102 4.419 3.093 1.00 0.00 C ATOM 1925 C ILE A 830 -12.149 4.474 4.190 1.00 0.00 C ATOM 1926 O ILE A 830 -13.243 5.007 3.996 1.00 0.00 O ATOM 1927 CB ILE A 830 -10.619 5.828 2.813 1.00 0.00 C ATOM 1928 CG1 ILE A 830 -10.570 6.016 1.321 1.00 0.00 C ATOM 1929 CG2 ILE A 830 -9.242 6.041 3.390 1.00 0.00 C ATOM 1930 CD1 ILE A 830 -9.742 7.177 0.893 1.00 0.00 C ATOM 0 H ILE A 830 -11.066 4.072 1.036 1.00 0.00 H new ATOM 0 HA ILE A 830 -10.287 3.785 3.442 1.00 0.00 H new ATOM 0 HB ILE A 830 -11.298 6.546 3.272 1.00 0.00 H new ATOM 0 HG12 ILE A 830 -10.175 5.110 0.862 1.00 0.00 H new ATOM 0 HG13 ILE A 830 -11.585 6.147 0.946 1.00 0.00 H new ATOM 0 HG21 ILE A 830 -8.912 7.058 3.179 1.00 0.00 H new ATOM 0 HG22 ILE A 830 -9.271 5.886 4.468 1.00 0.00 H new ATOM 0 HG23 ILE A 830 -8.546 5.333 2.940 1.00 0.00 H new ATOM 0 HD11 ILE A 830 -9.753 7.251 -0.194 1.00 0.00 H new ATOM 0 HD12 ILE A 830 -10.149 8.092 1.323 1.00 0.00 H new ATOM 0 HD13 ILE A 830 -8.717 7.039 1.237 1.00 0.00 H new ATOM 1942 N ASP A 831 -11.803 3.935 5.342 1.00 0.00 N ATOM 1943 CA ASP A 831 -12.721 3.914 6.472 1.00 0.00 C ATOM 1944 C ASP A 831 -11.981 3.637 7.778 1.00 0.00 C ATOM 1945 O ASP A 831 -12.353 4.149 8.834 1.00 0.00 O ATOM 1946 CB ASP A 831 -13.808 2.858 6.253 1.00 0.00 C ATOM 1947 CG ASP A 831 -14.769 2.766 7.422 1.00 0.00 C ATOM 1948 OD1 ASP A 831 -15.765 3.520 7.433 1.00 0.00 O ATOM 1949 OD2 ASP A 831 -14.526 1.940 8.327 1.00 0.00 O ATOM 0 H ASP A 831 -10.896 3.506 5.524 1.00 0.00 H new ATOM 0 HA ASP A 831 -13.186 4.897 6.545 1.00 0.00 H new ATOM 0 HB2 ASP A 831 -14.365 3.096 5.347 1.00 0.00 H new ATOM 0 HB3 ASP A 831 -13.340 1.887 6.094 1.00 0.00 H new ATOM 1954 N LYS A 832 -10.935 2.815 7.695 1.00 0.00 N ATOM 1955 CA LYS A 832 -10.131 2.458 8.860 1.00 0.00 C ATOM 1956 C LYS A 832 -9.774 3.692 9.690 1.00 0.00 C ATOM 1957 O LYS A 832 -8.855 4.435 9.287 1.00 0.00 O ATOM 1958 CB LYS A 832 -8.860 1.732 8.412 1.00 0.00 C ATOM 1959 CG LYS A 832 -8.098 2.456 7.310 1.00 0.00 C ATOM 1960 CD LYS A 832 -7.012 1.581 6.703 1.00 0.00 C ATOM 1961 CE LYS A 832 -5.919 1.261 7.710 1.00 0.00 C ATOM 1962 NZ LYS A 832 -5.268 2.493 8.235 1.00 0.00 N ATOM 1963 OXT LYS A 832 -10.419 3.900 10.739 1.00 0.00 O ATOM 0 H LYS A 832 -10.624 2.382 6.825 1.00 0.00 H new ATOM 0 HA LYS A 832 -10.722 1.794 9.491 1.00 0.00 H new ATOM 0 HB2 LYS A 832 -8.203 1.604 9.272 1.00 0.00 H new ATOM 0 HB3 LYS A 832 -9.126 0.734 8.063 1.00 0.00 H new ATOM 0 HG2 LYS A 832 -8.794 2.765 6.530 1.00 0.00 H new ATOM 0 HG3 LYS A 832 -7.649 3.363 7.714 1.00 0.00 H new ATOM 0 HD2 LYS A 832 -7.454 0.654 6.338 1.00 0.00 H new ATOM 0 HD3 LYS A 832 -6.576 2.087 5.842 1.00 0.00 H new ATOM 0 HE2 LYS A 832 -6.344 0.694 8.538 1.00 0.00 H new ATOM 0 HE3 LYS A 832 -5.168 0.626 7.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 832 -4.370 2.242 8.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 832 -5.082 3.149 7.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 832 -5.896 2.950 8.926 1.00 0.00 H new TER 1977 LYS A 832 ATOM 1978 N SER B 31 10.295 6.462 -19.956 1.00 0.00 N ATOM 1979 CA SER B 31 9.927 7.079 -18.656 1.00 0.00 C ATOM 1980 C SER B 31 9.549 6.011 -17.635 1.00 0.00 C ATOM 1981 O SER B 31 8.843 6.288 -16.665 1.00 0.00 O ATOM 1982 CB SER B 31 8.762 8.051 -18.845 1.00 0.00 C ATOM 1983 OG SER B 31 9.101 9.083 -19.756 1.00 0.00 O ATOM 0 HA SER B 31 10.793 7.625 -18.282 1.00 0.00 H new ATOM 0 HB2 SER B 31 7.889 7.511 -19.211 1.00 0.00 H new ATOM 0 HB3 SER B 31 8.487 8.486 -17.884 1.00 0.00 H new ATOM 0 HG SER B 31 9.673 8.720 -20.464 1.00 0.00 H new ATOM 1991 N THR B 32 10.026 4.791 -17.859 1.00 0.00 N ATOM 1992 CA THR B 32 9.739 3.679 -16.961 1.00 0.00 C ATOM 1993 C THR B 32 11.020 3.140 -16.332 1.00 0.00 C ATOM 1994 O THR B 32 11.830 2.501 -17.003 1.00 0.00 O ATOM 1995 CB THR B 32 9.018 2.533 -17.695 1.00 0.00 C ATOM 1996 OG1 THR B 32 7.848 3.032 -18.353 1.00 0.00 O ATOM 1997 CG2 THR B 32 8.625 1.428 -16.725 1.00 0.00 C ATOM 0 H THR B 32 10.614 4.547 -18.656 1.00 0.00 H new ATOM 0 HA THR B 32 9.085 4.064 -16.178 1.00 0.00 H new ATOM 0 HB THR B 32 9.704 2.119 -18.434 1.00 0.00 H new ATOM 0 HG1 THR B 32 7.396 2.298 -18.819 1.00 0.00 H new ATOM 0 HG21 THR B 32 8.118 0.631 -17.268 1.00 0.00 H new ATOM 0 HG22 THR B 32 9.519 1.029 -16.246 1.00 0.00 H new ATOM 0 HG23 THR B 32 7.956 1.832 -15.965 1.00 0.00 H new ATOM 2005 N GLY B 33 11.196 3.404 -15.041 1.00 0.00 N ATOM 2006 CA GLY B 33 12.380 2.938 -14.342 1.00 0.00 C ATOM 2007 C GLY B 33 12.458 1.425 -14.279 1.00 0.00 C ATOM 2008 O GLY B 33 11.436 0.750 -14.148 1.00 0.00 O ATOM 0 H GLY B 33 10.540 3.932 -14.466 1.00 0.00 H new ATOM 0 HA2 GLY B 33 13.269 3.324 -14.841 1.00 0.00 H new ATOM 0 HA3 GLY B 33 12.383 3.341 -13.329 1.00 0.00 H new ATOM 2012 N GLY B 34 13.672 0.893 -14.374 1.00 0.00 N ATOM 2013 CA GLY B 34 13.859 -0.545 -14.326 1.00 0.00 C ATOM 2014 C GLY B 34 14.465 -1.008 -13.016 1.00 0.00 C ATOM 2015 O GLY B 34 14.090 -2.054 -12.489 1.00 0.00 O ATOM 0 H GLY B 34 14.530 1.433 -14.483 1.00 0.00 H new ATOM 0 HA2 GLY B 34 12.898 -1.038 -14.473 1.00 0.00 H new ATOM 0 HA3 GLY B 34 14.504 -0.852 -15.150 1.00 0.00 H new ATOM 2019 N VAL B 35 15.401 -0.224 -12.491 1.00 0.00 N ATOM 2020 CA VAL B 35 16.063 -0.559 -11.234 1.00 0.00 C ATOM 2021 C VAL B 35 15.240 -0.100 -10.040 1.00 0.00 C ATOM 2022 O VAL B 35 14.144 0.438 -10.199 1.00 0.00 O ATOM 2023 CB VAL B 35 17.455 0.094 -11.142 1.00 0.00 C ATOM 2024 CG1 VAL B 35 18.276 -0.219 -12.384 1.00 0.00 C ATOM 2025 CG2 VAL B 35 17.325 1.602 -10.939 1.00 0.00 C ATOM 0 H VAL B 35 15.718 0.647 -12.916 1.00 0.00 H new ATOM 0 HA VAL B 35 16.166 -1.644 -11.215 1.00 0.00 H new ATOM 0 HB VAL B 35 17.976 -0.321 -10.280 1.00 0.00 H new ATOM 0 HG11 VAL B 35 19.256 0.251 -12.300 1.00 0.00 H new ATOM 0 HG12 VAL B 35 18.398 -1.298 -12.477 1.00 0.00 H new ATOM 0 HG13 VAL B 35 17.763 0.166 -13.266 1.00 0.00 H new ATOM 0 HG21 VAL B 35 18.318 2.048 -10.876 1.00 0.00 H new ATOM 0 HG22 VAL B 35 16.785 2.037 -11.780 1.00 0.00 H new ATOM 0 HG23 VAL B 35 16.780 1.799 -10.016 1.00 0.00 H new HETATM 2035 OH ALY B 36 10.189 0.695 -5.669 1.00 0.00 O HETATM 2036 CH ALY B 36 9.757 -0.082 -4.817 1.00 0.00 C HETATM 2037 CH3 ALY B 36 8.362 0.150 -4.234 1.00 0.00 C HETATM 2038 NZ ALY B 36 10.470 -1.110 -4.376 1.00 0.00 N HETATM 2039 CE ALY B 36 11.914 -1.065 -4.176 1.00 0.00 C HETATM 2040 CD ALY B 36 12.675 -1.393 -5.446 1.00 0.00 C HETATM 2041 CG ALY B 36 13.986 -0.690 -5.494 1.00 0.00 C HETATM 2042 CB ALY B 36 14.751 -1.090 -6.726 1.00 0.00 C HETATM 2043 CA ALY B 36 15.096 0.107 -7.627 1.00 0.00 C HETATM 2044 N ALY B 36 15.776 -0.313 -8.841 1.00 0.00 N HETATM 2045 C ALY B 36 15.930 1.141 -6.875 1.00 0.00 C HETATM 2046 O ALY B 36 16.057 1.080 -5.653 1.00 0.00 O HETATM 0 HH33 ALY B 36 8.327 1.127 -3.752 1.00 0.00 H new HETATM 0 HH32 ALY B 36 7.623 0.113 -5.034 1.00 0.00 H new HETATM 0 HH31 ALY B 36 8.141 -0.625 -3.500 1.00 0.00 H new HETATM 0 HZ ALY B 36 9.981 -1.980 -4.165 1.00 0.00 H new HETATM 0 HG3 ALY B 36 14.567 -0.930 -4.604 1.00 0.00 H new HETATM 0 HG2 ALY B 36 13.828 0.388 -5.491 1.00 0.00 H new HETATM 0 HE3 ALY B 36 12.194 -1.771 -3.394 1.00 0.00 H new HETATM 0 HE2 ALY B 36 12.201 -0.073 -3.828 1.00 0.00 H new HETATM 0 HD3 ALY B 36 12.077 -1.110 -6.313 1.00 0.00 H new HETATM 0 HD2 ALY B 36 12.836 -2.469 -5.507 1.00 0.00 H new HETATM 0 HCA ALY B 36 14.154 0.572 -7.917 1.00 0.00 H new HETATM 0 HB3 ALY B 36 14.163 -1.810 -7.295 1.00 0.00 H new HETATM 0 HB2 ALY B 36 15.671 -1.593 -6.429 1.00 0.00 H new ATOM 2061 N LYS B 37 16.489 2.095 -7.638 1.00 0.00 N ATOM 2062 CA LYS B 37 17.311 3.175 -7.090 1.00 0.00 C ATOM 2063 C LYS B 37 17.794 2.825 -5.687 1.00 0.00 C ATOM 2064 O LYS B 37 17.417 3.471 -4.716 1.00 0.00 O ATOM 2065 CB LYS B 37 16.528 4.504 -7.096 1.00 0.00 C ATOM 2066 CG LYS B 37 17.327 5.685 -6.565 1.00 0.00 C ATOM 2067 CD LYS B 37 16.657 7.007 -6.897 1.00 0.00 C ATOM 2068 CE LYS B 37 17.418 8.182 -6.304 1.00 0.00 C ATOM 2069 NZ LYS B 37 18.791 8.299 -6.871 1.00 0.00 N ATOM 0 H LYS B 37 16.381 2.135 -8.651 1.00 0.00 H new ATOM 0 HA LYS B 37 18.190 3.299 -7.723 1.00 0.00 H new ATOM 0 HB2 LYS B 37 16.207 4.722 -8.115 1.00 0.00 H new ATOM 0 HB3 LYS B 37 15.626 4.387 -6.495 1.00 0.00 H new ATOM 0 HG2 LYS B 37 17.438 5.594 -5.485 1.00 0.00 H new ATOM 0 HG3 LYS B 37 18.330 5.668 -6.991 1.00 0.00 H new ATOM 0 HD2 LYS B 37 16.593 7.122 -7.979 1.00 0.00 H new ATOM 0 HD3 LYS B 37 15.636 7.004 -6.516 1.00 0.00 H new ATOM 0 HE2 LYS B 37 16.868 9.104 -6.493 1.00 0.00 H new ATOM 0 HE3 LYS B 37 17.481 8.065 -5.222 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 19.214 9.201 -6.573 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 19.377 7.511 -6.527 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 18.742 8.266 -7.909 1.00 0.00 H new ATOM 2083 N PRO B 38 18.642 1.780 -5.581 1.00 0.00 N ATOM 2084 CA PRO B 38 19.170 1.290 -4.317 1.00 0.00 C ATOM 2085 C PRO B 38 19.224 2.359 -3.229 1.00 0.00 C ATOM 2086 O PRO B 38 20.081 3.244 -3.254 1.00 0.00 O ATOM 2087 CB PRO B 38 20.571 0.857 -4.726 1.00 0.00 C ATOM 2088 CG PRO B 38 20.392 0.294 -6.099 1.00 0.00 C ATOM 2089 CD PRO B 38 19.197 1.000 -6.705 1.00 0.00 C ATOM 0 HA PRO B 38 18.554 0.507 -3.875 1.00 0.00 H new ATOM 0 HB2 PRO B 38 21.264 1.698 -4.727 1.00 0.00 H new ATOM 0 HB3 PRO B 38 20.975 0.113 -4.039 1.00 0.00 H new ATOM 0 HG2 PRO B 38 21.285 0.456 -6.703 1.00 0.00 H new ATOM 0 HG3 PRO B 38 20.226 -0.782 -6.058 1.00 0.00 H new ATOM 0 HD2 PRO B 38 19.491 1.645 -7.533 1.00 0.00 H new ATOM 0 HD3 PRO B 38 18.469 0.290 -7.097 1.00 0.00 H new ATOM 2097 N HIS B 39 18.302 2.266 -2.279 1.00 0.00 N ATOM 2098 CA HIS B 39 18.228 3.227 -1.186 1.00 0.00 C ATOM 2099 C HIS B 39 19.013 2.734 0.027 1.00 0.00 C ATOM 2100 O HIS B 39 19.526 1.616 0.032 1.00 0.00 O ATOM 2101 CB HIS B 39 16.767 3.469 -0.801 1.00 0.00 C ATOM 2102 CG HIS B 39 15.799 3.168 -1.906 1.00 0.00 C ATOM 2103 ND1 HIS B 39 15.191 1.943 -2.054 1.00 0.00 N ATOM 2104 CD2 HIS B 39 15.340 3.936 -2.923 1.00 0.00 C ATOM 2105 CE1 HIS B 39 14.405 1.967 -3.115 1.00 0.00 C ATOM 2106 NE2 HIS B 39 14.476 3.166 -3.658 1.00 0.00 N ATOM 0 H HIS B 39 17.594 1.533 -2.244 1.00 0.00 H new ATOM 0 HA HIS B 39 18.671 4.164 -1.523 1.00 0.00 H new ATOM 0 HB2 HIS B 39 16.521 2.854 0.064 1.00 0.00 H new ATOM 0 HB3 HIS B 39 16.647 4.509 -0.497 1.00 0.00 H new ATOM 0 HD1 HIS B 39 15.326 1.140 -1.439 1.00 0.00 H new ATOM 0 HD2 HIS B 39 15.605 4.964 -3.119 1.00 0.00 H new ATOM 0 HE1 HIS B 39 13.806 1.144 -3.476 1.00 0.00 H new ATOM 0 HE2 HIS B 39 13.970 3.471 -4.490 1.00 0.00 H new ATOM 2115 N ARG B 40 19.099 3.578 1.052 1.00 0.00 N ATOM 2116 CA ARG B 40 19.823 3.229 2.270 1.00 0.00 C ATOM 2117 C ARG B 40 19.020 3.616 3.510 1.00 0.00 C ATOM 2118 O ARG B 40 19.255 4.664 4.113 1.00 0.00 O ATOM 2119 CB ARG B 40 21.187 3.925 2.295 1.00 0.00 C ATOM 2120 CG ARG B 40 22.074 3.580 1.110 1.00 0.00 C ATOM 2121 CD ARG B 40 22.536 2.132 1.157 1.00 0.00 C ATOM 2122 NE ARG B 40 23.381 1.791 0.016 1.00 0.00 N ATOM 2123 CZ ARG B 40 24.378 0.911 0.071 1.00 0.00 C ATOM 2124 NH1 ARG B 40 24.660 0.292 1.210 1.00 0.00 N ATOM 2125 NH2 ARG B 40 25.096 0.652 -1.013 1.00 0.00 N ATOM 0 H ARG B 40 18.677 4.507 1.063 1.00 0.00 H new ATOM 0 HA ARG B 40 19.973 2.149 2.277 1.00 0.00 H new ATOM 0 HB2 ARG B 40 21.033 5.004 2.320 1.00 0.00 H new ATOM 0 HB3 ARG B 40 21.705 3.655 3.215 1.00 0.00 H new ATOM 0 HG2 ARG B 40 21.529 3.758 0.183 1.00 0.00 H new ATOM 0 HG3 ARG B 40 22.942 4.239 1.101 1.00 0.00 H new ATOM 0 HD2 ARG B 40 23.087 1.957 2.081 1.00 0.00 H new ATOM 0 HD3 ARG B 40 21.667 1.474 1.174 1.00 0.00 H new ATOM 0 HE ARG B 40 23.197 2.254 -0.874 1.00 0.00 H new ATOM 0 HH11 ARG B 40 24.112 0.490 2.047 1.00 0.00 H new ATOM 0 HH12 ARG B 40 25.425 -0.382 1.248 1.00 0.00 H new ATOM 0 HH21 ARG B 40 24.885 1.127 -1.890 1.00 0.00 H new ATOM 0 HH22 ARG B 40 25.860 -0.023 -0.970 1.00 0.00 H new ATOM 2139 N TYR B 41 18.073 2.762 3.886 1.00 0.00 N ATOM 2140 CA TYR B 41 17.237 3.013 5.055 1.00 0.00 C ATOM 2141 C TYR B 41 17.603 2.072 6.199 1.00 0.00 C ATOM 2142 O TYR B 41 17.517 2.441 7.370 1.00 0.00 O ATOM 2143 CB TYR B 41 15.756 2.854 4.694 1.00 0.00 C ATOM 2144 CG TYR B 41 14.826 2.904 5.887 1.00 0.00 C ATOM 2145 CD1 TYR B 41 14.774 4.017 6.717 1.00 0.00 C ATOM 2146 CD2 TYR B 41 14.002 1.831 6.180 1.00 0.00 C ATOM 2147 CE1 TYR B 41 13.921 4.053 7.806 1.00 0.00 C ATOM 2148 CE2 TYR B 41 13.147 1.856 7.260 1.00 0.00 C ATOM 2149 CZ TYR B 41 13.109 2.969 8.072 1.00 0.00 C ATOM 2150 OH TYR B 41 12.258 2.999 9.153 1.00 0.00 O ATOM 0 H TYR B 41 17.865 1.890 3.398 1.00 0.00 H new ATOM 0 HA TYR B 41 17.413 4.037 5.384 1.00 0.00 H new ATOM 0 HB2 TYR B 41 15.476 3.641 3.994 1.00 0.00 H new ATOM 0 HB3 TYR B 41 15.618 1.904 4.177 1.00 0.00 H new ATOM 0 HD1 TYR B 41 15.408 4.866 6.509 1.00 0.00 H new ATOM 0 HD2 TYR B 41 14.030 0.955 5.548 1.00 0.00 H new ATOM 0 HE1 TYR B 41 13.891 4.924 8.444 1.00 0.00 H new ATOM 0 HE2 TYR B 41 12.511 1.009 7.469 1.00 0.00 H new ATOM 0 HH TYR B 41 11.756 2.158 9.198 1.00 0.00 H new ATOM 2160 N LYS B 42 18.015 0.858 5.852 1.00 0.00 N ATOM 2161 CA LYS B 42 18.394 -0.134 6.852 1.00 0.00 C ATOM 2162 C LYS B 42 19.601 -0.942 6.382 1.00 0.00 C ATOM 2163 O LYS B 42 19.473 -2.106 6.001 1.00 0.00 O ATOM 2164 CB LYS B 42 17.214 -1.064 7.147 1.00 0.00 C ATOM 2165 CG LYS B 42 17.453 -2.000 8.321 1.00 0.00 C ATOM 2166 CD LYS B 42 16.223 -2.843 8.619 1.00 0.00 C ATOM 2167 CE LYS B 42 16.464 -3.787 9.786 1.00 0.00 C ATOM 2168 NZ LYS B 42 16.848 -3.056 11.024 1.00 0.00 N ATOM 0 H LYS B 42 18.095 0.537 4.887 1.00 0.00 H new ATOM 0 HA LYS B 42 18.669 0.389 7.768 1.00 0.00 H new ATOM 0 HB2 LYS B 42 16.329 -0.461 7.349 1.00 0.00 H new ATOM 0 HB3 LYS B 42 16.999 -1.657 6.258 1.00 0.00 H new ATOM 0 HG2 LYS B 42 18.298 -2.652 8.102 1.00 0.00 H new ATOM 0 HG3 LYS B 42 17.720 -1.418 9.203 1.00 0.00 H new ATOM 0 HD2 LYS B 42 15.380 -2.191 8.846 1.00 0.00 H new ATOM 0 HD3 LYS B 42 15.952 -3.419 7.734 1.00 0.00 H new ATOM 0 HE2 LYS B 42 15.562 -4.369 9.974 1.00 0.00 H new ATOM 0 HE3 LYS B 42 17.251 -4.494 9.524 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 16.772 -3.694 11.842 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 17.828 -2.718 10.938 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 16.212 -2.244 11.159 1.00 0.00 H new ATOM 2182 N CYS B 43 20.772 -0.313 6.411 1.00 0.00 N ATOM 2183 CA CYS B 43 22.006 -0.968 5.990 1.00 0.00 C ATOM 2184 C CYS B 43 22.384 -2.089 6.952 1.00 0.00 C ATOM 2185 O CYS B 43 22.003 -3.249 6.687 1.00 0.00 O ATOM 2186 CB CYS B 43 23.144 0.051 5.902 1.00 0.00 C ATOM 2187 SG CYS B 43 22.827 1.415 4.759 1.00 0.00 S ATOM 2188 OXT CYS B 43 23.058 -1.799 7.963 1.00 0.00 O ATOM 0 H CYS B 43 20.892 0.651 6.722 1.00 0.00 H new ATOM 0 HA CYS B 43 21.839 -1.402 5.004 1.00 0.00 H new ATOM 0 HB2 CYS B 43 23.329 0.459 6.896 1.00 0.00 H new ATOM 0 HB3 CYS B 43 24.054 -0.463 5.594 1.00 0.00 H new ATOM 0 HG CYS B 43 23.845 2.224 4.756 1.00 0.00 H new TER 2194 CYS B 43