USER MOD reduce.3.24.130724 H: found=0, std=0, add=1093, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1100 hydrogens (14 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: B 36 ALY H2 : B 36 ALY N : B 35 VAL C :(H bumps) USER MOD NoAdj-H: B 36 ALY H : B 36 ALY N : B 35 VAL C :(H bumps) USER MOD Set 1.1: A 807 SER OG : rot -167:sc= -0.832 USER MOD Set 1.2: A 809 TYR OH : rot 175:sc= -2.68! USER MOD Set 2.1: A 799 CYS SG : rot 39:sc= -15.6! USER MOD Set 2.2: A 803 ASN : amide:sc= -3.71 X(o=-19,f=-19) USER MOD Set 3.1: A 789 MET CE :methyl -153:sc= -10.4! (180deg=-12.9!) USER MOD Set 3.2: A 793 GLN :FLIP amide:sc= -1.7 F(o=-17!,f=-12) USER MOD Set 3.3: A 832 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 773 MET CE :methyl -114:sc= -11.6! (180deg=-13.1!) USER MOD Set 4.2: A 782 TYR OH : rot -35:sc= -5.98! USER MOD Set 5.1: A 744 SER OG : rot -55:sc= 0.465 USER MOD Set 5.2: A 812 CYS SG : rot 99:sc= -0.589! USER MOD Set 6.1: A 738 GLN :FLIP amide:sc= -3.73! C(o=-9!,f=-3.7!) USER MOD Set 6.2: A 823 LYS NZ :NH3+ -173:sc= 0 (180deg=0) USER MOD Set 7.1: A 730 SER OG : rot 180:sc= 0 USER MOD Set 7.2: A 733 LYS NZ :NH3+ 170:sc= -0.412 (180deg=-0.787) USER MOD Set 8.1: A 717 HIS : no HD1:sc= 0 K(o=0,f=-0.54) USER MOD Set 8.2: A 718 MET CE :methyl -179:sc= 0 (180deg=0) USER MOD Single : A 716 SER OG : rot 180:sc= 0 USER MOD Single : A 719 SER OG : rot -45:sc= 0.916 USER MOD Single : A 720 LYS NZ :NH3+ -176:sc= -1.07 (180deg=-1.09) USER MOD Single : A 727 GLN :FLIP amide:sc= -1.07 F(o=-5.1!,f=-1.1) USER MOD Single : A 729 TYR OH : rot 180:sc= 0 USER MOD Single : A 731 THR OG1 : rot 106:sc= 1.13 USER MOD Single : A 734 SER OG : rot 66:sc= 0.0778 USER MOD Single : A 737 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 740 LYS NZ :NH3+ 146:sc= -3.03! (180deg=-3.77!) USER MOD Single : A 741 SER OG : rot -28:sc= 0.14 USER MOD Single : A 742 HIS : no HD1:sc= -9.65! C(o=-9.7!,f=-19!) USER MOD Single : A 743 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 749 MET CE :methyl -134:sc= -3.31! (180deg=-7.1!) 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 60:sc= -0.816 USER MOD Single : A 761 TYR OH : rot 180:sc= 0 USER MOD Single : A 768 MET CE :methyl -146:sc= -3.59 (180deg=-5.91!) USER MOD Single : A 771 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 772 THR OG1 : rot 180:sc= -1.92! USER MOD Single : A 774 SER OG : rot -21:sc= -0.64 USER MOD Single : A 778 LYS NZ :NH3+ -170:sc= -6.02! (180deg=-6.67!) USER MOD Single : A 779 ASN :FLIP amide:sc= -3.67! C(o=-7.1!,f=-3.7!) USER MOD Single : A 781 TYR OH : rot 180:sc= -0.963! USER MOD Single : A 784 SER OG : rot 41:sc= 0.734 USER MOD Single : A 785 LYS NZ :NH3+ -117:sc= 1.14 (180deg=-0.326) USER MOD Single : A 786 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 797 THR OG1 : rot -61:sc= 1.22 USER MOD Single : A 798 ASN : amide:sc= -4.65! C(o=-4.7!,f=-11!) USER MOD Single : A 800 LYS NZ :NH3+ -164:sc= -1.63 (180deg=-1.85!) USER MOD Single : A 802 TYR OH : rot 61:sc= -0.843 USER MOD Single : A 810 TYR OH : rot 129:sc= 0.123 USER MOD Single : A 811 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 814 ASN :FLIP amide:sc= -0.0535 F(o=-0.99!,f=-0.053) USER MOD Single : A 818 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0331) USER MOD Single : A 822 SER OG : rot 180:sc= 0 USER MOD Single : A 825 LYS NZ :NH3+ 156:sc= 0 (180deg=-0.21) USER MOD Single : B 31 SER OG : rot 44:sc= 0.475 USER MOD Single : B 32 THR OG1 : rot 180:sc= 0 USER MOD Single : B 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 HIS : no HD1:sc= -4.8! C(o=-4.8!,f=-9.8!) USER MOD Single : B 41 TYR OH : rot 180:sc= 0 USER MOD Single : B 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 715 -27.773 14.960 0.487 1.00 0.00 N ATOM 2 CA GLY A 715 -28.614 13.779 0.150 1.00 0.00 C ATOM 3 C GLY A 715 -27.812 12.494 0.084 1.00 0.00 C ATOM 4 O GLY A 715 -27.703 11.771 1.075 1.00 0.00 O ATOM 0 HA2 GLY A 715 -29.402 13.674 0.896 1.00 0.00 H new ATOM 0 HA3 GLY A 715 -29.103 13.948 -0.809 1.00 0.00 H new ATOM 10 N SER A 716 -27.249 12.209 -1.087 1.00 0.00 N ATOM 11 CA SER A 716 -26.452 11.003 -1.279 1.00 0.00 C ATOM 12 C SER A 716 -25.158 11.075 -0.475 1.00 0.00 C ATOM 13 O SER A 716 -24.358 11.995 -0.646 1.00 0.00 O ATOM 14 CB SER A 716 -26.135 10.807 -2.763 1.00 0.00 C ATOM 15 OG SER A 716 -25.385 9.622 -2.973 1.00 0.00 O ATOM 0 H SER A 716 -27.330 12.797 -1.916 1.00 0.00 H new ATOM 0 HA SER A 716 -27.033 10.152 -0.924 1.00 0.00 H new ATOM 0 HB2 SER A 716 -27.063 10.760 -3.333 1.00 0.00 H new ATOM 0 HB3 SER A 716 -25.576 11.666 -3.135 1.00 0.00 H new ATOM 0 HG SER A 716 -25.197 9.519 -3.929 1.00 0.00 H new ATOM 21 N HIS A 717 -24.957 10.095 0.403 1.00 0.00 N ATOM 22 CA HIS A 717 -23.761 10.048 1.236 1.00 0.00 C ATOM 23 C HIS A 717 -23.513 8.634 1.755 1.00 0.00 C ATOM 24 O HIS A 717 -22.367 8.223 1.944 1.00 0.00 O ATOM 25 CB HIS A 717 -23.895 11.021 2.411 1.00 0.00 C ATOM 26 CG HIS A 717 -22.718 11.010 3.339 1.00 0.00 C ATOM 27 ND1 HIS A 717 -22.753 10.434 4.591 1.00 0.00 N ATOM 28 CD2 HIS A 717 -21.468 11.509 3.191 1.00 0.00 C ATOM 29 CE1 HIS A 717 -21.577 10.580 5.174 1.00 0.00 C ATOM 30 NE2 HIS A 717 -20.780 11.229 4.346 1.00 0.00 N ATOM 0 H HIS A 717 -25.607 9.324 0.555 1.00 0.00 H new ATOM 0 HA HIS A 717 -22.909 10.344 0.623 1.00 0.00 H new ATOM 0 HB2 HIS A 717 -24.030 12.030 2.022 1.00 0.00 H new ATOM 0 HB3 HIS A 717 -24.794 10.774 2.976 1.00 0.00 H new ATOM 0 HD2 HIS A 717 -21.084 12.030 2.326 1.00 0.00 H new ATOM 0 HE1 HIS A 717 -21.313 10.228 6.160 1.00 0.00 H new ATOM 0 HE2 HIS A 717 -19.810 11.482 4.534 1.00 0.00 H new ATOM 39 N MET A 718 -24.595 7.894 1.980 1.00 0.00 N ATOM 40 CA MET A 718 -24.496 6.526 2.478 1.00 0.00 C ATOM 41 C MET A 718 -24.629 5.520 1.338 1.00 0.00 C ATOM 42 O MET A 718 -25.182 4.435 1.515 1.00 0.00 O ATOM 43 CB MET A 718 -25.574 6.269 3.533 1.00 0.00 C ATOM 44 CG MET A 718 -25.498 7.212 4.722 1.00 0.00 C ATOM 45 SD MET A 718 -23.917 7.120 5.583 1.00 0.00 S ATOM 46 CE MET A 718 -24.169 8.324 6.885 1.00 0.00 C ATOM 0 H MET A 718 -25.550 8.219 1.825 1.00 0.00 H new ATOM 0 HA MET A 718 -23.514 6.400 2.934 1.00 0.00 H new ATOM 0 HB2 MET A 718 -26.555 6.362 3.068 1.00 0.00 H new ATOM 0 HB3 MET A 718 -25.486 5.242 3.888 1.00 0.00 H new ATOM 0 HG2 MET A 718 -25.662 8.234 4.381 1.00 0.00 H new ATOM 0 HG3 MET A 718 -26.301 6.976 5.420 1.00 0.00 H new ATOM 0 HE1 MET A 718 -23.268 8.395 7.494 1.00 0.00 H new ATOM 0 HE2 MET A 718 -24.386 9.297 6.444 1.00 0.00 H new ATOM 0 HE3 MET A 718 -25.006 8.014 7.510 1.00 0.00 H new ATOM 56 N SER A 719 -24.116 5.889 0.168 1.00 0.00 N ATOM 57 CA SER A 719 -24.175 5.020 -1.002 1.00 0.00 C ATOM 58 C SER A 719 -22.819 4.957 -1.699 1.00 0.00 C ATOM 59 O SER A 719 -22.742 4.778 -2.915 1.00 0.00 O ATOM 60 CB SER A 719 -25.244 5.519 -1.979 1.00 0.00 C ATOM 61 OG SER A 719 -25.380 4.637 -3.080 1.00 0.00 O ATOM 0 H SER A 719 -23.655 6.784 0.005 1.00 0.00 H new ATOM 0 HA SER A 719 -24.439 4.016 -0.669 1.00 0.00 H new ATOM 0 HB2 SER A 719 -26.199 5.611 -1.462 1.00 0.00 H new ATOM 0 HB3 SER A 719 -24.978 6.514 -2.337 1.00 0.00 H new ATOM 0 HG SER A 719 -24.492 4.381 -3.406 1.00 0.00 H new ATOM 67 N LYS A 720 -21.752 5.102 -0.919 1.00 0.00 N ATOM 68 CA LYS A 720 -20.399 5.063 -1.460 1.00 0.00 C ATOM 69 C LYS A 720 -19.694 3.762 -1.086 1.00 0.00 C ATOM 70 O LYS A 720 -19.181 3.055 -1.955 1.00 0.00 O ATOM 71 CB LYS A 720 -19.591 6.264 -0.961 1.00 0.00 C ATOM 72 CG LYS A 720 -19.705 6.501 0.537 1.00 0.00 C ATOM 73 CD LYS A 720 -18.925 7.732 0.969 1.00 0.00 C ATOM 74 CE LYS A 720 -17.424 7.506 0.878 1.00 0.00 C ATOM 75 NZ LYS A 720 -16.956 6.483 1.854 1.00 0.00 N ATOM 0 H LYS A 720 -21.799 5.248 0.089 1.00 0.00 H new ATOM 0 HA LYS A 720 -20.470 5.111 -2.547 1.00 0.00 H new ATOM 0 HB2 LYS A 720 -18.542 6.116 -1.217 1.00 0.00 H new ATOM 0 HB3 LYS A 720 -19.924 7.158 -1.487 1.00 0.00 H new ATOM 0 HG2 LYS A 720 -20.754 6.620 0.808 1.00 0.00 H new ATOM 0 HG3 LYS A 720 -19.334 5.628 1.074 1.00 0.00 H new ATOM 0 HD2 LYS A 720 -19.204 8.579 0.342 1.00 0.00 H new ATOM 0 HD3 LYS A 720 -19.193 7.992 1.993 1.00 0.00 H new ATOM 0 HE2 LYS A 720 -17.165 7.189 -0.132 1.00 0.00 H new ATOM 0 HE3 LYS A 720 -16.904 8.446 1.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 720 -15.920 6.407 1.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 720 -17.240 6.764 2.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 720 -17.381 5.562 1.623 1.00 0.00 H new ATOM 89 N GLU A 721 -19.671 3.452 0.209 1.00 0.00 N ATOM 90 CA GLU A 721 -19.027 2.234 0.696 1.00 0.00 C ATOM 91 C GLU A 721 -19.541 1.014 -0.061 1.00 0.00 C ATOM 92 O GLU A 721 -20.719 0.665 0.016 1.00 0.00 O ATOM 93 CB GLU A 721 -19.270 2.067 2.197 1.00 0.00 C ATOM 94 CG GLU A 721 -18.543 0.877 2.803 1.00 0.00 C ATOM 95 CD GLU A 721 -18.678 0.819 4.313 1.00 0.00 C ATOM 96 OE1 GLU A 721 -19.658 0.214 4.798 1.00 0.00 O ATOM 97 OE2 GLU A 721 -17.803 1.375 5.009 1.00 0.00 O ATOM 0 H GLU A 721 -20.091 4.027 0.939 1.00 0.00 H new ATOM 0 HA GLU A 721 -17.954 2.321 0.522 1.00 0.00 H new ATOM 0 HB2 GLU A 721 -18.954 2.975 2.711 1.00 0.00 H new ATOM 0 HB3 GLU A 721 -20.340 1.957 2.373 1.00 0.00 H new ATOM 0 HG2 GLU A 721 -18.937 -0.043 2.371 1.00 0.00 H new ATOM 0 HG3 GLU A 721 -17.487 0.927 2.538 1.00 0.00 H new ATOM 104 N PRO A 722 -18.641 0.356 -0.809 1.00 0.00 N ATOM 105 CA PRO A 722 -18.946 -0.830 -1.615 1.00 0.00 C ATOM 106 C PRO A 722 -19.536 -1.969 -0.803 1.00 0.00 C ATOM 107 O PRO A 722 -20.599 -2.489 -1.134 1.00 0.00 O ATOM 108 CB PRO A 722 -17.567 -1.219 -2.135 1.00 0.00 C ATOM 109 CG PRO A 722 -16.885 0.066 -2.217 1.00 0.00 C ATOM 110 CD PRO A 722 -17.223 0.704 -0.942 1.00 0.00 C ATOM 0 HA PRO A 722 -19.693 -0.627 -2.382 1.00 0.00 H new ATOM 0 HB2 PRO A 722 -17.058 -1.906 -1.459 1.00 0.00 H new ATOM 0 HB3 PRO A 722 -17.624 -1.711 -3.106 1.00 0.00 H new ATOM 0 HG2 PRO A 722 -15.808 -0.056 -2.334 1.00 0.00 H new ATOM 0 HG3 PRO A 722 -17.233 0.654 -3.067 1.00 0.00 H new ATOM 0 HD2 PRO A 722 -16.626 0.315 -0.117 1.00 0.00 H new ATOM 0 HD3 PRO A 722 -17.066 1.782 -0.968 1.00 0.00 H new ATOM 118 N ARG A 723 -18.837 -2.347 0.265 1.00 0.00 N ATOM 119 CA ARG A 723 -19.271 -3.448 1.115 1.00 0.00 C ATOM 120 C ARG A 723 -19.265 -4.743 0.316 1.00 0.00 C ATOM 121 O ARG A 723 -19.308 -4.717 -0.909 1.00 0.00 O ATOM 122 CB ARG A 723 -20.660 -3.189 1.692 1.00 0.00 C ATOM 123 CG ARG A 723 -21.004 -4.133 2.825 1.00 0.00 C ATOM 124 CD ARG A 723 -20.297 -3.743 4.111 1.00 0.00 C ATOM 125 NE ARG A 723 -20.805 -2.484 4.652 1.00 0.00 N ATOM 126 CZ ARG A 723 -21.018 -2.270 5.947 1.00 0.00 C ATOM 127 NH1 ARG A 723 -20.763 -3.225 6.832 1.00 0.00 N ATOM 128 NH2 ARG A 723 -21.487 -1.101 6.360 1.00 0.00 N ATOM 0 H ARG A 723 -17.967 -1.905 0.561 1.00 0.00 H new ATOM 0 HA ARG A 723 -18.576 -3.533 1.950 1.00 0.00 H new ATOM 0 HB2 ARG A 723 -20.715 -2.161 2.051 1.00 0.00 H new ATOM 0 HB3 ARG A 723 -21.403 -3.290 0.901 1.00 0.00 H new ATOM 0 HG2 ARG A 723 -22.082 -4.131 2.987 1.00 0.00 H new ATOM 0 HG3 ARG A 723 -20.725 -5.150 2.550 1.00 0.00 H new ATOM 0 HD2 ARG A 723 -20.425 -4.534 4.850 1.00 0.00 H new ATOM 0 HD3 ARG A 723 -19.227 -3.652 3.924 1.00 0.00 H new ATOM 0 HE ARG A 723 -21.008 -1.727 3.999 1.00 0.00 H new ATOM 0 HH11 ARG A 723 -20.402 -4.127 6.520 1.00 0.00 H new ATOM 0 HH12 ARG A 723 -20.927 -3.058 7.825 1.00 0.00 H new ATOM 0 HH21 ARG A 723 -21.685 -0.363 5.684 1.00 0.00 H new ATOM 0 HH22 ARG A 723 -21.650 -0.939 7.354 1.00 0.00 H new ATOM 142 N ASP A 724 -19.206 -5.871 1.008 1.00 0.00 N ATOM 143 CA ASP A 724 -19.181 -7.169 0.345 1.00 0.00 C ATOM 144 C ASP A 724 -17.895 -7.348 -0.448 1.00 0.00 C ATOM 145 O ASP A 724 -17.431 -6.445 -1.144 1.00 0.00 O ATOM 146 CB ASP A 724 -20.392 -7.345 -0.566 1.00 0.00 C ATOM 147 CG ASP A 724 -20.379 -8.650 -1.334 1.00 0.00 C ATOM 148 OD1 ASP A 724 -20.734 -9.692 -0.743 1.00 0.00 O ATOM 149 OD2 ASP A 724 -20.028 -8.629 -2.529 1.00 0.00 O ATOM 0 H ASP A 724 -19.175 -5.915 2.027 1.00 0.00 H new ATOM 0 HA ASP A 724 -19.221 -7.936 1.119 1.00 0.00 H new ATOM 0 HB2 ASP A 724 -21.300 -7.294 0.035 1.00 0.00 H new ATOM 0 HB3 ASP A 724 -20.430 -6.516 -1.273 1.00 0.00 H new ATOM 154 N PRO A 725 -17.315 -8.540 -0.333 1.00 0.00 N ATOM 155 CA PRO A 725 -16.068 -8.905 -0.991 1.00 0.00 C ATOM 156 C PRO A 725 -16.106 -8.773 -2.509 1.00 0.00 C ATOM 157 O PRO A 725 -15.060 -8.748 -3.149 1.00 0.00 O ATOM 158 CB PRO A 725 -15.859 -10.373 -0.592 1.00 0.00 C ATOM 159 CG PRO A 725 -17.175 -10.835 -0.080 1.00 0.00 C ATOM 160 CD PRO A 725 -17.850 -9.629 0.475 1.00 0.00 C ATOM 0 HA PRO A 725 -15.263 -8.237 -0.684 1.00 0.00 H new ATOM 0 HB2 PRO A 725 -15.538 -10.970 -1.446 1.00 0.00 H new ATOM 0 HB3 PRO A 725 -15.086 -10.466 0.171 1.00 0.00 H new ATOM 0 HG2 PRO A 725 -17.769 -11.281 -0.878 1.00 0.00 H new ATOM 0 HG3 PRO A 725 -17.048 -11.598 0.688 1.00 0.00 H new ATOM 0 HD2 PRO A 725 -18.934 -9.699 0.387 1.00 0.00 H new ATOM 0 HD3 PRO A 725 -17.624 -9.493 1.533 1.00 0.00 H new ATOM 168 N ASP A 726 -17.301 -8.692 -3.084 1.00 0.00 N ATOM 169 CA ASP A 726 -17.436 -8.569 -4.534 1.00 0.00 C ATOM 170 C ASP A 726 -17.505 -7.107 -4.948 1.00 0.00 C ATOM 171 O ASP A 726 -16.753 -6.675 -5.822 1.00 0.00 O ATOM 172 CB ASP A 726 -18.671 -9.319 -5.035 1.00 0.00 C ATOM 173 CG ASP A 726 -18.794 -9.285 -6.545 1.00 0.00 C ATOM 174 OD1 ASP A 726 -19.410 -8.334 -7.069 1.00 0.00 O ATOM 175 OD2 ASP A 726 -18.274 -10.210 -7.204 1.00 0.00 O ATOM 0 H ASP A 726 -18.185 -8.709 -2.575 1.00 0.00 H new ATOM 0 HA ASP A 726 -16.553 -9.018 -4.989 1.00 0.00 H new ATOM 0 HB2 ASP A 726 -18.624 -10.355 -4.700 1.00 0.00 H new ATOM 0 HB3 ASP A 726 -19.564 -8.880 -4.590 1.00 0.00 H new ATOM 180 N GLN A 727 -18.412 -6.342 -4.332 1.00 0.00 N ATOM 181 CA GLN A 727 -18.522 -4.930 -4.665 1.00 0.00 C ATOM 182 C GLN A 727 -17.161 -4.281 -4.522 1.00 0.00 C ATOM 183 O GLN A 727 -16.759 -3.478 -5.352 1.00 0.00 O ATOM 184 CB GLN A 727 -19.557 -4.217 -3.810 1.00 0.00 C ATOM 185 CG GLN A 727 -20.893 -4.916 -3.806 1.00 0.00 C ATOM 186 CD GLN A 727 -21.923 -4.239 -2.921 1.00 0.00 C ATOM 187 OE1 GLN A 727 -22.007 -4.670 -1.669 1.00 0.00 O flip ATOM 188 NE2 GLN A 727 -22.641 -3.341 -3.363 1.00 0.00 N flip ATOM 0 H GLN A 727 -19.063 -6.671 -3.619 1.00 0.00 H new ATOM 0 HA GLN A 727 -18.864 -4.845 -5.697 1.00 0.00 H new ATOM 0 HB2 GLN A 727 -19.188 -4.143 -2.787 1.00 0.00 H new ATOM 0 HB3 GLN A 727 -19.686 -3.199 -4.177 1.00 0.00 H new ATOM 0 HG2 GLN A 727 -21.274 -4.961 -4.826 1.00 0.00 H new ATOM 0 HG3 GLN A 727 -20.756 -5.944 -3.471 1.00 0.00 H new ATOM 0 HE21 GLN A 727 -22.543 -3.040 -4.333 1.00 0.00 H new ATOM 0 HE22 GLN A 727 -23.334 -2.898 -2.759 1.00 0.00 H new ATOM 197 N LEU A 728 -16.443 -4.679 -3.473 1.00 0.00 N ATOM 198 CA LEU A 728 -15.103 -4.174 -3.212 1.00 0.00 C ATOM 199 C LEU A 728 -14.123 -4.778 -4.194 1.00 0.00 C ATOM 200 O LEU A 728 -13.426 -4.063 -4.890 1.00 0.00 O ATOM 201 CB LEU A 728 -14.691 -4.496 -1.783 1.00 0.00 C ATOM 202 CG LEU A 728 -15.272 -3.551 -0.746 1.00 0.00 C ATOM 203 CD1 LEU A 728 -15.148 -4.136 0.651 1.00 0.00 C ATOM 204 CD2 LEU A 728 -14.556 -2.220 -0.843 1.00 0.00 C ATOM 0 H LEU A 728 -16.774 -5.356 -2.786 1.00 0.00 H new ATOM 0 HA LEU A 728 -15.101 -3.091 -3.337 1.00 0.00 H new ATOM 0 HB2 LEU A 728 -15.001 -5.514 -1.547 1.00 0.00 H new ATOM 0 HB3 LEU A 728 -13.603 -4.470 -1.715 1.00 0.00 H new ATOM 0 HG LEU A 728 -16.334 -3.405 -0.941 1.00 0.00 H new ATOM 0 HD11 LEU A 728 -15.571 -3.440 1.376 1.00 0.00 H new ATOM 0 HD12 LEU A 728 -15.687 -5.082 0.698 1.00 0.00 H new ATOM 0 HD13 LEU A 728 -14.096 -4.306 0.882 1.00 0.00 H new ATOM 0 HD21 LEU A 728 -14.965 -1.532 -0.103 1.00 0.00 H new ATOM 0 HD22 LEU A 728 -13.492 -2.365 -0.656 1.00 0.00 H new ATOM 0 HD23 LEU A 728 -14.695 -1.804 -1.841 1.00 0.00 H new ATOM 216 N TYR A 729 -14.098 -6.099 -4.277 1.00 0.00 N ATOM 217 CA TYR A 729 -13.204 -6.773 -5.200 1.00 0.00 C ATOM 218 C TYR A 729 -13.052 -5.976 -6.470 1.00 0.00 C ATOM 219 O TYR A 729 -11.964 -5.502 -6.772 1.00 0.00 O ATOM 220 CB TYR A 729 -13.767 -8.152 -5.526 1.00 0.00 C ATOM 221 CG TYR A 729 -13.502 -8.632 -6.927 1.00 0.00 C ATOM 222 CD1 TYR A 729 -12.219 -8.859 -7.312 1.00 0.00 C ATOM 223 CD2 TYR A 729 -14.519 -8.873 -7.841 1.00 0.00 C ATOM 224 CE1 TYR A 729 -11.901 -9.312 -8.566 1.00 0.00 C ATOM 225 CE2 TYR A 729 -14.228 -9.329 -9.116 1.00 0.00 C ATOM 226 CZ TYR A 729 -12.910 -9.549 -9.475 1.00 0.00 C ATOM 227 OH TYR A 729 -12.607 -10.004 -10.737 1.00 0.00 O ATOM 0 H TYR A 729 -14.683 -6.721 -3.719 1.00 0.00 H new ATOM 0 HA TYR A 729 -12.224 -6.872 -4.734 1.00 0.00 H new ATOM 0 HB2 TYR A 729 -13.348 -8.874 -4.825 1.00 0.00 H new ATOM 0 HB3 TYR A 729 -14.844 -8.136 -5.361 1.00 0.00 H new ATOM 0 HD1 TYR A 729 -11.422 -8.676 -6.606 1.00 0.00 H new ATOM 0 HD2 TYR A 729 -15.547 -8.703 -7.555 1.00 0.00 H new ATOM 0 HE1 TYR A 729 -10.870 -9.482 -8.839 1.00 0.00 H new ATOM 0 HE2 TYR A 729 -15.023 -9.511 -9.824 1.00 0.00 H new ATOM 0 HH TYR A 729 -13.434 -10.120 -11.250 1.00 0.00 H new ATOM 237 N SER A 730 -14.134 -5.769 -7.189 1.00 0.00 N ATOM 238 CA SER A 730 -14.015 -5.038 -8.420 1.00 0.00 C ATOM 239 C SER A 730 -14.066 -3.530 -8.234 1.00 0.00 C ATOM 240 O SER A 730 -13.660 -2.788 -9.129 1.00 0.00 O ATOM 241 CB SER A 730 -14.934 -5.550 -9.498 1.00 0.00 C ATOM 242 OG SER A 730 -15.485 -4.493 -10.264 1.00 0.00 O ATOM 0 H SER A 730 -15.073 -6.086 -6.950 1.00 0.00 H new ATOM 0 HA SER A 730 -13.007 -5.237 -8.785 1.00 0.00 H new ATOM 0 HB2 SER A 730 -14.385 -6.226 -10.153 1.00 0.00 H new ATOM 0 HB3 SER A 730 -15.739 -6.129 -9.045 1.00 0.00 H new ATOM 0 HG SER A 730 -16.074 -4.862 -10.955 1.00 0.00 H new ATOM 248 N THR A 731 -14.568 -3.060 -7.092 1.00 0.00 N ATOM 249 CA THR A 731 -14.556 -1.624 -6.847 1.00 0.00 C ATOM 250 C THR A 731 -13.113 -1.258 -6.834 1.00 0.00 C ATOM 251 O THR A 731 -12.615 -0.493 -7.654 1.00 0.00 O ATOM 252 CB THR A 731 -15.176 -1.234 -5.487 1.00 0.00 C ATOM 253 OG1 THR A 731 -16.588 -1.045 -5.631 1.00 0.00 O ATOM 254 CG2 THR A 731 -14.549 0.043 -4.931 1.00 0.00 C ATOM 0 H THR A 731 -14.973 -3.630 -6.349 1.00 0.00 H new ATOM 0 HA THR A 731 -15.146 -1.111 -7.607 1.00 0.00 H new ATOM 0 HB THR A 731 -14.978 -2.046 -4.787 1.00 0.00 H new ATOM 0 HG1 THR A 731 -17.062 -1.804 -5.232 1.00 0.00 H new ATOM 0 HG21 THR A 731 -15.009 0.287 -3.974 1.00 0.00 H new ATOM 0 HG22 THR A 731 -13.479 -0.108 -4.791 1.00 0.00 H new ATOM 0 HG23 THR A 731 -14.711 0.863 -5.631 1.00 0.00 H new ATOM 262 N LEU A 732 -12.467 -1.890 -5.887 1.00 0.00 N ATOM 263 CA LEU A 732 -11.063 -1.785 -5.676 1.00 0.00 C ATOM 264 C LEU A 732 -10.325 -2.174 -6.948 1.00 0.00 C ATOM 265 O LEU A 732 -9.260 -1.645 -7.241 1.00 0.00 O ATOM 266 CB LEU A 732 -10.676 -2.731 -4.564 1.00 0.00 C ATOM 267 CG LEU A 732 -11.573 -2.773 -3.332 1.00 0.00 C ATOM 268 CD1 LEU A 732 -11.426 -4.110 -2.661 1.00 0.00 C ATOM 269 CD2 LEU A 732 -11.207 -1.678 -2.369 1.00 0.00 C ATOM 0 H LEU A 732 -12.929 -2.511 -5.223 1.00 0.00 H new ATOM 0 HA LEU A 732 -10.801 -0.761 -5.410 1.00 0.00 H new ATOM 0 HB2 LEU A 732 -10.628 -3.737 -4.980 1.00 0.00 H new ATOM 0 HB3 LEU A 732 -9.668 -2.473 -4.238 1.00 0.00 H new ATOM 0 HG LEU A 732 -12.607 -2.624 -3.642 1.00 0.00 H new ATOM 0 HD11 LEU A 732 -12.065 -4.147 -1.779 1.00 0.00 H new ATOM 0 HD12 LEU A 732 -11.718 -4.899 -3.354 1.00 0.00 H new ATOM 0 HD13 LEU A 732 -10.388 -4.255 -2.363 1.00 0.00 H new ATOM 0 HD21 LEU A 732 -11.860 -1.727 -1.497 1.00 0.00 H new ATOM 0 HD22 LEU A 732 -10.171 -1.802 -2.054 1.00 0.00 H new ATOM 0 HD23 LEU A 732 -11.325 -0.710 -2.857 1.00 0.00 H new ATOM 281 N LYS A 733 -10.899 -3.116 -7.702 1.00 0.00 N ATOM 282 CA LYS A 733 -10.286 -3.556 -8.952 1.00 0.00 C ATOM 283 C LYS A 733 -10.061 -2.347 -9.827 1.00 0.00 C ATOM 284 O LYS A 733 -9.149 -2.315 -10.639 1.00 0.00 O ATOM 285 CB LYS A 733 -11.168 -4.587 -9.664 1.00 0.00 C ATOM 286 CG LYS A 733 -10.591 -5.139 -10.953 1.00 0.00 C ATOM 287 CD LYS A 733 -10.975 -6.598 -11.160 1.00 0.00 C ATOM 288 CE LYS A 733 -12.415 -6.755 -11.602 1.00 0.00 C ATOM 289 NZ LYS A 733 -12.881 -5.608 -12.428 1.00 0.00 N ATOM 0 H LYS A 733 -11.776 -3.582 -7.470 1.00 0.00 H new ATOM 0 HA LYS A 733 -9.333 -4.040 -8.740 1.00 0.00 H new ATOM 0 HB2 LYS A 733 -11.355 -5.417 -8.982 1.00 0.00 H new ATOM 0 HB3 LYS A 733 -12.133 -4.130 -9.882 1.00 0.00 H new ATOM 0 HG2 LYS A 733 -10.947 -4.546 -11.795 1.00 0.00 H new ATOM 0 HG3 LYS A 733 -9.505 -5.047 -10.935 1.00 0.00 H new ATOM 0 HD2 LYS A 733 -10.317 -7.042 -11.907 1.00 0.00 H new ATOM 0 HD3 LYS A 733 -10.820 -7.148 -10.232 1.00 0.00 H new ATOM 0 HE2 LYS A 733 -12.519 -7.677 -12.174 1.00 0.00 H new ATOM 0 HE3 LYS A 733 -13.054 -6.851 -10.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 733 -13.806 -5.834 -12.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 733 -12.969 -4.762 -11.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 733 -12.194 -5.425 -13.187 1.00 0.00 H new ATOM 303 N SER A 734 -10.888 -1.337 -9.609 1.00 0.00 N ATOM 304 CA SER A 734 -10.799 -0.095 -10.364 1.00 0.00 C ATOM 305 C SER A 734 -9.817 0.839 -9.686 1.00 0.00 C ATOM 306 O SER A 734 -8.932 1.384 -10.344 1.00 0.00 O ATOM 307 CB SER A 734 -12.171 0.571 -10.492 1.00 0.00 C ATOM 308 OG SER A 734 -13.104 -0.298 -11.110 1.00 0.00 O ATOM 0 H SER A 734 -11.632 -1.352 -8.912 1.00 0.00 H new ATOM 0 HA SER A 734 -10.446 -0.321 -11.370 1.00 0.00 H new ATOM 0 HB2 SER A 734 -12.534 0.856 -9.505 1.00 0.00 H new ATOM 0 HB3 SER A 734 -12.081 1.487 -11.075 1.00 0.00 H new ATOM 0 HG SER A 734 -13.269 -1.068 -10.527 1.00 0.00 H new ATOM 314 N ILE A 735 -9.976 1.047 -8.370 1.00 0.00 N ATOM 315 CA ILE A 735 -9.039 1.888 -7.653 1.00 0.00 C ATOM 316 C ILE A 735 -7.655 1.398 -7.987 1.00 0.00 C ATOM 317 O ILE A 735 -6.888 2.096 -8.620 1.00 0.00 O ATOM 318 CB ILE A 735 -9.260 1.888 -6.130 1.00 0.00 C ATOM 319 CG1 ILE A 735 -10.631 2.465 -5.845 1.00 0.00 C ATOM 320 CG2 ILE A 735 -8.196 2.736 -5.430 1.00 0.00 C ATOM 321 CD1 ILE A 735 -11.726 1.458 -5.909 1.00 0.00 C ATOM 0 H ILE A 735 -10.727 0.651 -7.804 1.00 0.00 H new ATOM 0 HA ILE A 735 -9.186 2.922 -7.965 1.00 0.00 H new ATOM 0 HB ILE A 735 -9.188 0.867 -5.755 1.00 0.00 H new ATOM 0 HG12 ILE A 735 -10.626 2.921 -4.855 1.00 0.00 H new ATOM 0 HG13 ILE A 735 -10.838 3.260 -6.561 1.00 0.00 H new ATOM 0 HG21 ILE A 735 -8.370 2.723 -4.354 1.00 0.00 H new ATOM 0 HG22 ILE A 735 -7.208 2.328 -5.643 1.00 0.00 H new ATOM 0 HG23 ILE A 735 -8.251 3.762 -5.794 1.00 0.00 H new ATOM 0 HD11 ILE A 735 -12.679 1.942 -5.694 1.00 0.00 H new ATOM 0 HD12 ILE A 735 -11.759 1.019 -6.906 1.00 0.00 H new ATOM 0 HD13 ILE A 735 -11.543 0.675 -5.173 1.00 0.00 H new ATOM 333 N LEU A 736 -7.377 0.158 -7.615 1.00 0.00 N ATOM 334 CA LEU A 736 -6.099 -0.468 -7.914 1.00 0.00 C ATOM 335 C LEU A 736 -5.698 -0.174 -9.344 1.00 0.00 C ATOM 336 O LEU A 736 -4.653 0.409 -9.604 1.00 0.00 O ATOM 337 CB LEU A 736 -6.208 -1.978 -7.734 1.00 0.00 C ATOM 338 CG LEU A 736 -5.168 -2.581 -6.821 1.00 0.00 C ATOM 339 CD1 LEU A 736 -5.434 -4.046 -6.720 1.00 0.00 C ATOM 340 CD2 LEU A 736 -3.771 -2.277 -7.300 1.00 0.00 C ATOM 0 H LEU A 736 -8.026 -0.439 -7.101 1.00 0.00 H new ATOM 0 HA LEU A 736 -5.348 -0.067 -7.234 1.00 0.00 H new ATOM 0 HB2 LEU A 736 -7.197 -2.213 -7.341 1.00 0.00 H new ATOM 0 HB3 LEU A 736 -6.133 -2.453 -8.712 1.00 0.00 H new ATOM 0 HG LEU A 736 -5.237 -2.139 -5.827 1.00 0.00 H new ATOM 0 HD11 LEU A 736 -4.694 -4.506 -6.064 1.00 0.00 H new ATOM 0 HD12 LEU A 736 -6.431 -4.207 -6.311 1.00 0.00 H new ATOM 0 HD13 LEU A 736 -5.371 -4.496 -7.711 1.00 0.00 H new ATOM 0 HD21 LEU A 736 -3.047 -2.726 -6.620 1.00 0.00 H new ATOM 0 HD22 LEU A 736 -3.632 -2.687 -8.300 1.00 0.00 H new ATOM 0 HD23 LEU A 736 -3.622 -1.198 -7.327 1.00 0.00 H new ATOM 352 N GLN A 737 -6.553 -0.596 -10.259 1.00 0.00 N ATOM 353 CA GLN A 737 -6.342 -0.386 -11.687 1.00 0.00 C ATOM 354 C GLN A 737 -5.939 1.055 -11.978 1.00 0.00 C ATOM 355 O GLN A 737 -5.215 1.338 -12.932 1.00 0.00 O ATOM 356 CB GLN A 737 -7.632 -0.729 -12.442 1.00 0.00 C ATOM 357 CG GLN A 737 -7.675 -2.144 -12.981 1.00 0.00 C ATOM 358 CD GLN A 737 -8.821 -2.369 -13.947 1.00 0.00 C ATOM 359 OE1 GLN A 737 -9.920 -2.751 -13.545 1.00 0.00 O ATOM 360 NE2 GLN A 737 -8.570 -2.132 -15.230 1.00 0.00 N ATOM 0 H GLN A 737 -7.415 -1.095 -10.036 1.00 0.00 H new ATOM 0 HA GLN A 737 -5.532 -1.035 -12.019 1.00 0.00 H new ATOM 0 HB2 GLN A 737 -8.481 -0.580 -11.775 1.00 0.00 H new ATOM 0 HB3 GLN A 737 -7.751 -0.032 -13.271 1.00 0.00 H new ATOM 0 HG2 GLN A 737 -6.733 -2.366 -13.483 1.00 0.00 H new ATOM 0 HG3 GLN A 737 -7.764 -2.842 -12.149 1.00 0.00 H new ATOM 0 HE21 GLN A 737 -7.644 -1.816 -15.519 1.00 0.00 H new ATOM 0 HE22 GLN A 737 -9.303 -2.266 -15.926 1.00 0.00 H new ATOM 369 N GLN A 738 -6.420 1.952 -11.137 1.00 0.00 N ATOM 370 CA GLN A 738 -6.160 3.379 -11.269 1.00 0.00 C ATOM 371 C GLN A 738 -4.857 3.809 -10.580 1.00 0.00 C ATOM 372 O GLN A 738 -3.974 4.382 -11.215 1.00 0.00 O ATOM 373 CB GLN A 738 -7.361 4.144 -10.721 1.00 0.00 C ATOM 374 CG GLN A 738 -8.503 4.194 -11.723 1.00 0.00 C ATOM 375 CD GLN A 738 -9.853 4.484 -11.096 1.00 0.00 C ATOM 376 OE1 GLN A 738 -10.111 3.887 -9.941 1.00 0.00 O flip ATOM 377 NE2 GLN A 738 -10.667 5.217 -11.660 1.00 0.00 N flip ATOM 0 H GLN A 738 -7.006 1.712 -10.337 1.00 0.00 H new ATOM 0 HA GLN A 738 -6.022 3.612 -12.325 1.00 0.00 H new ATOM 0 HB2 GLN A 738 -7.705 3.671 -9.801 1.00 0.00 H new ATOM 0 HB3 GLN A 738 -7.059 5.159 -10.463 1.00 0.00 H new ATOM 0 HG2 GLN A 738 -8.287 4.959 -12.469 1.00 0.00 H new ATOM 0 HG3 GLN A 738 -8.554 3.241 -12.250 1.00 0.00 H new ATOM 0 HE21 GLN A 738 -10.427 5.657 -12.548 1.00 0.00 H new ATOM 0 HE22 GLN A 738 -11.581 5.384 -11.238 1.00 0.00 H new ATOM 386 N VAL A 739 -4.750 3.535 -9.279 1.00 0.00 N ATOM 387 CA VAL A 739 -3.577 3.869 -8.498 1.00 0.00 C ATOM 388 C VAL A 739 -2.367 3.246 -9.145 1.00 0.00 C ATOM 389 O VAL A 739 -1.252 3.736 -9.024 1.00 0.00 O ATOM 390 CB VAL A 739 -3.709 3.328 -7.056 1.00 0.00 C ATOM 391 CG1 VAL A 739 -5.145 3.053 -6.680 1.00 0.00 C ATOM 392 CG2 VAL A 739 -2.857 2.097 -6.884 1.00 0.00 C ATOM 0 H VAL A 739 -5.484 3.072 -8.742 1.00 0.00 H new ATOM 0 HA VAL A 739 -3.476 4.954 -8.459 1.00 0.00 H new ATOM 0 HB VAL A 739 -3.351 4.102 -6.377 1.00 0.00 H new ATOM 0 HG11 VAL A 739 -5.188 2.675 -5.659 1.00 0.00 H new ATOM 0 HG12 VAL A 739 -5.722 3.975 -6.750 1.00 0.00 H new ATOM 0 HG13 VAL A 739 -5.563 2.311 -7.360 1.00 0.00 H new ATOM 0 HG21 VAL A 739 -2.958 1.724 -5.865 1.00 0.00 H new ATOM 0 HG22 VAL A 739 -3.182 1.328 -7.585 1.00 0.00 H new ATOM 0 HG23 VAL A 739 -1.814 2.347 -7.078 1.00 0.00 H new ATOM 402 N LYS A 740 -2.612 2.133 -9.801 1.00 0.00 N ATOM 403 CA LYS A 740 -1.580 1.417 -10.496 1.00 0.00 C ATOM 404 C LYS A 740 -1.302 2.131 -11.793 1.00 0.00 C ATOM 405 O LYS A 740 -0.177 2.493 -12.072 1.00 0.00 O ATOM 406 CB LYS A 740 -2.020 -0.020 -10.729 1.00 0.00 C ATOM 407 CG LYS A 740 -1.200 -0.773 -11.764 1.00 0.00 C ATOM 408 CD LYS A 740 -2.022 -1.877 -12.410 1.00 0.00 C ATOM 409 CE LYS A 740 -1.777 -3.223 -11.745 1.00 0.00 C ATOM 410 NZ LYS A 740 -0.345 -3.624 -11.813 1.00 0.00 N ATOM 0 H LYS A 740 -3.535 1.704 -9.864 1.00 0.00 H new ATOM 0 HA LYS A 740 -0.664 1.386 -9.906 1.00 0.00 H new ATOM 0 HB2 LYS A 740 -1.970 -0.559 -9.783 1.00 0.00 H new ATOM 0 HB3 LYS A 740 -3.064 -0.020 -11.042 1.00 0.00 H new ATOM 0 HG2 LYS A 740 -0.849 -0.081 -12.529 1.00 0.00 H new ATOM 0 HG3 LYS A 740 -0.316 -1.201 -11.292 1.00 0.00 H new ATOM 0 HD2 LYS A 740 -3.081 -1.627 -12.346 1.00 0.00 H new ATOM 0 HD3 LYS A 740 -1.773 -1.944 -13.469 1.00 0.00 H new ATOM 0 HE2 LYS A 740 -2.091 -3.175 -10.702 1.00 0.00 H new ATOM 0 HE3 LYS A 740 -2.390 -3.984 -12.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 740 -0.091 -4.152 -10.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 740 -0.192 -4.226 -12.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 740 0.250 -2.774 -11.886 1.00 0.00 H new ATOM 424 N SER A 741 -2.345 2.381 -12.566 1.00 0.00 N ATOM 425 CA SER A 741 -2.180 3.092 -13.817 1.00 0.00 C ATOM 426 C SER A 741 -1.560 4.454 -13.549 1.00 0.00 C ATOM 427 O SER A 741 -1.149 5.162 -14.468 1.00 0.00 O ATOM 428 CB SER A 741 -3.519 3.254 -14.527 1.00 0.00 C ATOM 429 OG SER A 741 -3.347 3.790 -15.829 1.00 0.00 O ATOM 0 H SER A 741 -3.303 2.105 -12.351 1.00 0.00 H new ATOM 0 HA SER A 741 -1.520 2.515 -14.465 1.00 0.00 H new ATOM 0 HB2 SER A 741 -4.019 2.287 -14.592 1.00 0.00 H new ATOM 0 HB3 SER A 741 -4.166 3.909 -13.944 1.00 0.00 H new ATOM 0 HG SER A 741 -2.541 4.347 -15.850 1.00 0.00 H new ATOM 435 N HIS A 742 -1.502 4.808 -12.268 1.00 0.00 N ATOM 436 CA HIS A 742 -0.931 6.069 -11.842 1.00 0.00 C ATOM 437 C HIS A 742 0.528 6.182 -12.284 1.00 0.00 C ATOM 438 O HIS A 742 1.282 5.212 -12.268 1.00 0.00 O ATOM 439 CB HIS A 742 -1.045 6.219 -10.318 1.00 0.00 C ATOM 440 CG HIS A 742 -0.698 7.588 -9.820 1.00 0.00 C ATOM 441 ND1 HIS A 742 0.209 8.419 -10.440 1.00 0.00 N ATOM 442 CD2 HIS A 742 -1.149 8.272 -8.753 1.00 0.00 C ATOM 443 CE1 HIS A 742 0.301 9.549 -9.778 1.00 0.00 C ATOM 444 NE2 HIS A 742 -0.516 9.491 -8.747 1.00 0.00 N ATOM 0 H HIS A 742 -1.849 4.228 -11.504 1.00 0.00 H new ATOM 0 HA HIS A 742 -1.492 6.876 -12.314 1.00 0.00 H new ATOM 0 HB2 HIS A 742 -2.064 5.979 -10.013 1.00 0.00 H new ATOM 0 HB3 HIS A 742 -0.389 5.491 -9.840 1.00 0.00 H new ATOM 0 HD2 HIS A 742 -1.876 7.926 -8.033 1.00 0.00 H new ATOM 0 HE1 HIS A 742 0.937 10.383 -10.035 1.00 0.00 H new ATOM 0 HE2 HIS A 742 -0.656 10.230 -8.058 1.00 0.00 H new ATOM 453 N GLN A 743 0.894 7.379 -12.699 1.00 0.00 N ATOM 454 CA GLN A 743 2.238 7.691 -13.148 1.00 0.00 C ATOM 455 C GLN A 743 3.265 7.521 -12.034 1.00 0.00 C ATOM 456 O GLN A 743 4.463 7.440 -12.285 1.00 0.00 O ATOM 457 CB GLN A 743 2.235 9.121 -13.630 1.00 0.00 C ATOM 458 CG GLN A 743 3.472 9.490 -14.410 1.00 0.00 C ATOM 459 CD GLN A 743 3.579 10.977 -14.682 1.00 0.00 C ATOM 460 OE1 GLN A 743 2.569 11.671 -14.814 1.00 0.00 O ATOM 461 NE2 GLN A 743 4.806 11.477 -14.766 1.00 0.00 N ATOM 0 H GLN A 743 0.257 8.175 -12.734 1.00 0.00 H new ATOM 0 HA GLN A 743 2.520 7.004 -13.946 1.00 0.00 H new ATOM 0 HB2 GLN A 743 1.357 9.285 -14.255 1.00 0.00 H new ATOM 0 HB3 GLN A 743 2.143 9.786 -12.772 1.00 0.00 H new ATOM 0 HG2 GLN A 743 4.354 9.163 -13.859 1.00 0.00 H new ATOM 0 HG3 GLN A 743 3.471 8.952 -15.358 1.00 0.00 H new ATOM 0 HE21 GLN A 743 5.615 10.866 -14.650 1.00 0.00 H new ATOM 0 HE22 GLN A 743 4.940 12.472 -14.946 1.00 0.00 H new ATOM 470 N SER A 744 2.775 7.503 -10.808 1.00 0.00 N ATOM 471 CA SER A 744 3.621 7.333 -9.624 1.00 0.00 C ATOM 472 C SER A 744 3.579 5.901 -9.147 1.00 0.00 C ATOM 473 O SER A 744 4.049 5.571 -8.059 1.00 0.00 O ATOM 474 CB SER A 744 3.148 8.256 -8.500 1.00 0.00 C ATOM 475 OG SER A 744 3.723 9.546 -8.616 1.00 0.00 O ATOM 0 H SER A 744 1.782 7.605 -10.597 1.00 0.00 H new ATOM 0 HA SER A 744 4.645 7.589 -9.896 1.00 0.00 H new ATOM 0 HB2 SER A 744 2.061 8.336 -8.526 1.00 0.00 H new ATOM 0 HB3 SER A 744 3.413 7.823 -7.535 1.00 0.00 H new ATOM 0 HG SER A 744 4.699 9.467 -8.651 1.00 0.00 H new ATOM 481 N ALA A 745 2.999 5.061 -9.968 1.00 0.00 N ATOM 482 CA ALA A 745 2.841 3.665 -9.636 1.00 0.00 C ATOM 483 C ALA A 745 3.847 2.745 -10.319 1.00 0.00 C ATOM 484 O ALA A 745 3.790 1.540 -10.118 1.00 0.00 O ATOM 485 CB ALA A 745 1.432 3.258 -10.022 1.00 0.00 C ATOM 0 H ALA A 745 2.625 5.322 -10.880 1.00 0.00 H new ATOM 0 HA ALA A 745 3.024 3.556 -8.567 1.00 0.00 H new ATOM 0 HB1 ALA A 745 1.279 2.205 -9.784 1.00 0.00 H new ATOM 0 HB2 ALA A 745 0.714 3.863 -9.469 1.00 0.00 H new ATOM 0 HB3 ALA A 745 1.289 3.412 -11.091 1.00 0.00 H new ATOM 491 N TRP A 746 4.777 3.281 -11.101 1.00 0.00 N ATOM 492 CA TRP A 746 5.721 2.420 -11.808 1.00 0.00 C ATOM 493 C TRP A 746 6.625 1.587 -10.878 1.00 0.00 C ATOM 494 O TRP A 746 7.003 0.474 -11.248 1.00 0.00 O ATOM 495 CB TRP A 746 6.552 3.206 -12.821 1.00 0.00 C ATOM 496 CG TRP A 746 7.280 4.381 -12.259 1.00 0.00 C ATOM 497 CD1 TRP A 746 6.771 5.618 -12.012 1.00 0.00 C ATOM 498 CD2 TRP A 746 8.658 4.432 -11.893 1.00 0.00 C ATOM 499 NE1 TRP A 746 7.753 6.444 -11.519 1.00 0.00 N ATOM 500 CE2 TRP A 746 8.923 5.734 -11.437 1.00 0.00 C ATOM 501 CE3 TRP A 746 9.693 3.499 -11.909 1.00 0.00 C ATOM 502 CZ2 TRP A 746 10.185 6.126 -11.003 1.00 0.00 C ATOM 503 CZ3 TRP A 746 10.947 3.886 -11.476 1.00 0.00 C ATOM 504 CH2 TRP A 746 11.184 5.191 -11.029 1.00 0.00 C ATOM 0 H TRP A 746 4.898 4.281 -11.260 1.00 0.00 H new ATOM 0 HA TRP A 746 5.105 1.702 -12.349 1.00 0.00 H new ATOM 0 HB2 TRP A 746 7.277 2.531 -13.276 1.00 0.00 H new ATOM 0 HB3 TRP A 746 5.894 3.552 -13.618 1.00 0.00 H new ATOM 0 HD1 TRP A 746 5.744 5.909 -12.179 1.00 0.00 H new ATOM 0 HE1 TRP A 746 7.631 7.422 -11.258 1.00 0.00 H new ATOM 0 HE3 TRP A 746 9.518 2.491 -12.254 1.00 0.00 H new ATOM 0 HZ2 TRP A 746 10.370 7.132 -10.658 1.00 0.00 H new ATOM 0 HZ3 TRP A 746 11.756 3.171 -11.483 1.00 0.00 H new ATOM 0 HH2 TRP A 746 12.175 5.466 -10.698 1.00 0.00 H new ATOM 515 N PRO A 747 6.999 2.077 -9.673 1.00 0.00 N ATOM 516 CA PRO A 747 7.839 1.308 -8.755 1.00 0.00 C ATOM 517 C PRO A 747 7.029 0.254 -8.027 1.00 0.00 C ATOM 518 O PRO A 747 7.578 -0.673 -7.434 1.00 0.00 O ATOM 519 CB PRO A 747 8.369 2.350 -7.757 1.00 0.00 C ATOM 520 CG PRO A 747 7.801 3.664 -8.175 1.00 0.00 C ATOM 521 CD PRO A 747 6.647 3.377 -9.097 1.00 0.00 C ATOM 0 HA PRO A 747 8.635 0.778 -9.278 1.00 0.00 H new ATOM 0 HB2 PRO A 747 8.066 2.102 -6.740 1.00 0.00 H new ATOM 0 HB3 PRO A 747 9.459 2.378 -7.767 1.00 0.00 H new ATOM 0 HG2 PRO A 747 7.468 4.233 -7.307 1.00 0.00 H new ATOM 0 HG3 PRO A 747 8.556 4.266 -8.680 1.00 0.00 H new ATOM 0 HD2 PRO A 747 5.701 3.336 -8.558 1.00 0.00 H new ATOM 0 HD3 PRO A 747 6.544 4.144 -9.865 1.00 0.00 H new ATOM 529 N PHE A 748 5.710 0.396 -8.100 1.00 0.00 N ATOM 530 CA PHE A 748 4.803 -0.514 -7.421 1.00 0.00 C ATOM 531 C PHE A 748 4.011 -1.356 -8.416 1.00 0.00 C ATOM 532 O PHE A 748 3.442 -2.381 -8.059 1.00 0.00 O ATOM 533 CB PHE A 748 3.858 0.284 -6.521 1.00 0.00 C ATOM 534 CG PHE A 748 4.489 1.500 -5.917 1.00 0.00 C ATOM 535 CD1 PHE A 748 5.793 1.469 -5.502 1.00 0.00 C ATOM 536 CD2 PHE A 748 3.782 2.677 -5.791 1.00 0.00 C ATOM 537 CE1 PHE A 748 6.394 2.582 -4.967 1.00 0.00 C ATOM 538 CE2 PHE A 748 4.384 3.799 -5.254 1.00 0.00 C ATOM 539 CZ PHE A 748 5.685 3.747 -4.846 1.00 0.00 C ATOM 0 H PHE A 748 5.246 1.137 -8.626 1.00 0.00 H new ATOM 0 HA PHE A 748 5.392 -1.198 -6.811 1.00 0.00 H new ATOM 0 HB2 PHE A 748 2.987 0.587 -7.102 1.00 0.00 H new ATOM 0 HB3 PHE A 748 3.498 -0.364 -5.721 1.00 0.00 H new ATOM 0 HD1 PHE A 748 6.359 0.554 -5.597 1.00 0.00 H new ATOM 0 HD2 PHE A 748 2.752 2.722 -6.114 1.00 0.00 H new ATOM 0 HE1 PHE A 748 7.423 2.538 -4.643 1.00 0.00 H new ATOM 0 HE2 PHE A 748 3.824 4.718 -5.157 1.00 0.00 H new ATOM 0 HZ PHE A 748 6.155 4.625 -4.428 1.00 0.00 H new ATOM 549 N MET A 749 3.996 -0.910 -9.667 1.00 0.00 N ATOM 550 CA MET A 749 3.262 -1.574 -10.747 1.00 0.00 C ATOM 551 C MET A 749 3.312 -3.081 -10.625 1.00 0.00 C ATOM 552 O MET A 749 2.326 -3.775 -10.869 1.00 0.00 O ATOM 553 CB MET A 749 3.852 -1.143 -12.075 1.00 0.00 C ATOM 554 CG MET A 749 3.255 0.134 -12.580 1.00 0.00 C ATOM 555 SD MET A 749 2.029 -0.135 -13.859 1.00 0.00 S ATOM 556 CE MET A 749 1.405 1.522 -13.940 1.00 0.00 C ATOM 0 H MET A 749 4.495 -0.072 -9.966 1.00 0.00 H new ATOM 0 HA MET A 749 2.214 -1.281 -10.681 1.00 0.00 H new ATOM 0 HB2 MET A 749 4.930 -1.019 -11.967 1.00 0.00 H new ATOM 0 HB3 MET A 749 3.694 -1.931 -12.812 1.00 0.00 H new ATOM 0 HG2 MET A 749 2.796 0.669 -11.749 1.00 0.00 H new ATOM 0 HG3 MET A 749 4.048 0.772 -12.971 1.00 0.00 H new ATOM 0 HE1 MET A 749 0.315 1.500 -13.950 1.00 0.00 H new ATOM 0 HE2 MET A 749 1.749 2.083 -13.071 1.00 0.00 H new ATOM 0 HE3 MET A 749 1.766 2.003 -14.849 1.00 0.00 H new ATOM 566 N GLU A 750 4.470 -3.569 -10.247 1.00 0.00 N ATOM 567 CA GLU A 750 4.690 -4.980 -10.081 1.00 0.00 C ATOM 568 C GLU A 750 5.758 -5.192 -9.027 1.00 0.00 C ATOM 569 O GLU A 750 6.503 -4.268 -8.700 1.00 0.00 O ATOM 570 CB GLU A 750 5.119 -5.590 -11.409 1.00 0.00 C ATOM 571 CG GLU A 750 3.959 -5.969 -12.313 1.00 0.00 C ATOM 572 CD GLU A 750 4.417 -6.575 -13.625 1.00 0.00 C ATOM 573 OE1 GLU A 750 4.649 -5.809 -14.585 1.00 0.00 O ATOM 574 OE2 GLU A 750 4.544 -7.816 -13.694 1.00 0.00 O ATOM 0 H GLU A 750 5.287 -2.993 -10.046 1.00 0.00 H new ATOM 0 HA GLU A 750 3.770 -5.467 -9.759 1.00 0.00 H new ATOM 0 HB2 GLU A 750 5.760 -4.881 -11.934 1.00 0.00 H new ATOM 0 HB3 GLU A 750 5.720 -6.478 -11.213 1.00 0.00 H new ATOM 0 HG2 GLU A 750 3.316 -6.679 -11.794 1.00 0.00 H new ATOM 0 HG3 GLU A 750 3.357 -5.083 -12.516 1.00 0.00 H new ATOM 581 N PRO A 751 5.859 -6.404 -8.477 1.00 0.00 N ATOM 582 CA PRO A 751 6.842 -6.703 -7.452 1.00 0.00 C ATOM 583 C PRO A 751 8.241 -6.637 -8.012 1.00 0.00 C ATOM 584 O PRO A 751 8.558 -7.267 -9.021 1.00 0.00 O ATOM 585 CB PRO A 751 6.496 -8.116 -7.000 1.00 0.00 C ATOM 586 CG PRO A 751 5.137 -8.365 -7.546 1.00 0.00 C ATOM 587 CD PRO A 751 5.056 -7.577 -8.808 1.00 0.00 C ATOM 0 HA PRO A 751 6.818 -5.989 -6.629 1.00 0.00 H new ATOM 0 HB2 PRO A 751 7.215 -8.841 -7.382 1.00 0.00 H new ATOM 0 HB3 PRO A 751 6.507 -8.198 -5.913 1.00 0.00 H new ATOM 0 HG2 PRO A 751 4.981 -9.427 -7.737 1.00 0.00 H new ATOM 0 HG3 PRO A 751 4.368 -8.052 -6.839 1.00 0.00 H new ATOM 0 HD2 PRO A 751 5.462 -8.124 -9.659 1.00 0.00 H new ATOM 0 HD3 PRO A 751 4.029 -7.312 -9.060 1.00 0.00 H new ATOM 595 N VAL A 752 9.068 -5.868 -7.342 1.00 0.00 N ATOM 596 CA VAL A 752 10.440 -5.677 -7.760 1.00 0.00 C ATOM 597 C VAL A 752 11.162 -7.019 -7.810 1.00 0.00 C ATOM 598 O VAL A 752 10.630 -8.037 -7.366 1.00 0.00 O ATOM 599 CB VAL A 752 11.155 -4.633 -6.854 1.00 0.00 C ATOM 600 CG1 VAL A 752 10.185 -4.030 -5.875 1.00 0.00 C ATOM 601 CG2 VAL A 752 12.361 -5.181 -6.112 1.00 0.00 C ATOM 0 H VAL A 752 8.812 -5.359 -6.496 1.00 0.00 H new ATOM 0 HA VAL A 752 10.458 -5.266 -8.769 1.00 0.00 H new ATOM 0 HB VAL A 752 11.532 -3.866 -7.531 1.00 0.00 H new ATOM 0 HG11 VAL A 752 10.703 -3.303 -5.250 1.00 0.00 H new ATOM 0 HG12 VAL A 752 9.381 -3.534 -6.418 1.00 0.00 H new ATOM 0 HG13 VAL A 752 9.767 -4.816 -5.246 1.00 0.00 H new ATOM 0 HG21 VAL A 752 12.803 -4.392 -5.503 1.00 0.00 H new ATOM 0 HG22 VAL A 752 12.049 -6.004 -5.469 1.00 0.00 H new ATOM 0 HG23 VAL A 752 13.098 -5.541 -6.830 1.00 0.00 H new ATOM 611 N LYS A 753 12.371 -7.018 -8.343 1.00 0.00 N ATOM 612 CA LYS A 753 13.138 -8.254 -8.505 1.00 0.00 C ATOM 613 C LYS A 753 13.640 -8.760 -7.177 1.00 0.00 C ATOM 614 O LYS A 753 14.465 -9.674 -7.126 1.00 0.00 O ATOM 615 CB LYS A 753 14.344 -8.026 -9.418 1.00 0.00 C ATOM 616 CG LYS A 753 13.984 -7.491 -10.793 1.00 0.00 C ATOM 617 CD LYS A 753 14.034 -8.581 -11.855 1.00 0.00 C ATOM 618 CE LYS A 753 15.450 -9.096 -12.069 1.00 0.00 C ATOM 619 NZ LYS A 753 15.491 -10.214 -13.054 1.00 0.00 N ATOM 0 H LYS A 753 12.848 -6.179 -8.673 1.00 0.00 H new ATOM 0 HA LYS A 753 12.468 -8.991 -8.948 1.00 0.00 H new ATOM 0 HB2 LYS A 753 15.026 -7.327 -8.934 1.00 0.00 H new ATOM 0 HB3 LYS A 753 14.882 -8.967 -9.535 1.00 0.00 H new ATOM 0 HG2 LYS A 753 12.984 -7.057 -10.764 1.00 0.00 H new ATOM 0 HG3 LYS A 753 14.671 -6.689 -11.062 1.00 0.00 H new ATOM 0 HD2 LYS A 753 13.388 -9.407 -11.559 1.00 0.00 H new ATOM 0 HD3 LYS A 753 13.643 -8.191 -12.795 1.00 0.00 H new ATOM 0 HE2 LYS A 753 16.084 -8.281 -12.418 1.00 0.00 H new ATOM 0 HE3 LYS A 753 15.861 -9.435 -11.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 753 16.473 -10.537 -13.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 753 14.906 -11.002 -12.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 753 15.123 -9.884 -13.969 1.00 0.00 H new ATOM 633 N ARG A 754 13.145 -8.168 -6.101 1.00 0.00 N ATOM 634 CA ARG A 754 13.601 -8.525 -4.780 1.00 0.00 C ATOM 635 C ARG A 754 15.090 -8.230 -4.707 1.00 0.00 C ATOM 636 O ARG A 754 15.751 -8.514 -3.707 1.00 0.00 O ATOM 637 CB ARG A 754 13.312 -9.997 -4.476 1.00 0.00 C ATOM 638 CG ARG A 754 13.659 -10.414 -3.059 1.00 0.00 C ATOM 639 CD ARG A 754 13.044 -11.761 -2.713 1.00 0.00 C ATOM 640 NE ARG A 754 13.340 -12.168 -1.343 1.00 0.00 N ATOM 641 CZ ARG A 754 12.868 -13.280 -0.786 1.00 0.00 C ATOM 642 NH1 ARG A 754 12.086 -14.093 -1.483 1.00 0.00 N ATOM 643 NH2 ARG A 754 13.177 -13.580 0.468 1.00 0.00 N ATOM 0 H ARG A 754 12.430 -7.441 -6.123 1.00 0.00 H new ATOM 0 HA ARG A 754 13.068 -7.941 -4.029 1.00 0.00 H new ATOM 0 HB2 ARG A 754 12.254 -10.193 -4.653 1.00 0.00 H new ATOM 0 HB3 ARG A 754 13.873 -10.618 -5.174 1.00 0.00 H new ATOM 0 HG2 ARG A 754 14.742 -10.467 -2.948 1.00 0.00 H new ATOM 0 HG3 ARG A 754 13.304 -9.659 -2.358 1.00 0.00 H new ATOM 0 HD2 ARG A 754 11.964 -11.711 -2.850 1.00 0.00 H new ATOM 0 HD3 ARG A 754 13.418 -12.517 -3.403 1.00 0.00 H new ATOM 0 HE ARG A 754 13.942 -11.566 -0.781 1.00 0.00 H new ATOM 0 HH11 ARG A 754 11.845 -13.866 -2.448 1.00 0.00 H new ATOM 0 HH12 ARG A 754 11.725 -14.945 -1.054 1.00 0.00 H new ATOM 0 HH21 ARG A 754 13.778 -12.957 1.008 1.00 0.00 H new ATOM 0 HH22 ARG A 754 12.814 -14.433 0.893 1.00 0.00 H new ATOM 657 N THR A 755 15.609 -7.633 -5.790 1.00 0.00 N ATOM 658 CA THR A 755 17.016 -7.305 -5.870 1.00 0.00 C ATOM 659 C THR A 755 17.285 -5.997 -6.618 1.00 0.00 C ATOM 660 O THR A 755 18.362 -5.423 -6.451 1.00 0.00 O ATOM 661 CB THR A 755 17.842 -8.432 -6.510 1.00 0.00 C ATOM 662 OG1 THR A 755 17.659 -8.431 -7.931 1.00 0.00 O ATOM 663 CG2 THR A 755 17.450 -9.792 -5.949 1.00 0.00 C ATOM 0 H THR A 755 15.067 -7.373 -6.614 1.00 0.00 H new ATOM 0 HA THR A 755 17.332 -7.177 -4.835 1.00 0.00 H new ATOM 0 HB THR A 755 18.891 -8.251 -6.275 1.00 0.00 H new ATOM 0 HG1 THR A 755 18.191 -9.151 -8.330 1.00 0.00 H new ATOM 0 HG21 THR A 755 18.052 -10.568 -6.422 1.00 0.00 H new ATOM 0 HG22 THR A 755 17.622 -9.805 -4.873 1.00 0.00 H new ATOM 0 HG23 THR A 755 16.395 -9.978 -6.150 1.00 0.00 H new ATOM 671 N GLU A 756 16.343 -5.509 -7.448 1.00 0.00 N ATOM 672 CA GLU A 756 16.581 -4.218 -8.100 1.00 0.00 C ATOM 673 C GLU A 756 16.695 -3.294 -6.947 1.00 0.00 C ATOM 674 O GLU A 756 17.366 -2.263 -6.951 1.00 0.00 O ATOM 675 CB GLU A 756 15.426 -3.726 -8.970 1.00 0.00 C ATOM 676 CG GLU A 756 14.268 -4.665 -9.036 1.00 0.00 C ATOM 677 CD GLU A 756 13.060 -4.063 -9.725 1.00 0.00 C ATOM 678 OE1 GLU A 756 12.526 -3.055 -9.215 1.00 0.00 O ATOM 679 OE2 GLU A 756 12.648 -4.599 -10.775 1.00 0.00 O ATOM 0 H GLU A 756 15.458 -5.964 -7.672 1.00 0.00 H new ATOM 0 HA GLU A 756 17.440 -4.284 -8.767 1.00 0.00 H new ATOM 0 HB2 GLU A 756 15.080 -2.766 -8.586 1.00 0.00 H new ATOM 0 HB3 GLU A 756 15.796 -3.551 -9.980 1.00 0.00 H new ATOM 0 HG2 GLU A 756 14.569 -5.569 -9.566 1.00 0.00 H new ATOM 0 HG3 GLU A 756 13.992 -4.965 -8.025 1.00 0.00 H new ATOM 686 N ALA A 757 15.976 -3.765 -5.955 1.00 0.00 N ATOM 687 CA ALA A 757 15.844 -3.182 -4.681 1.00 0.00 C ATOM 688 C ALA A 757 16.736 -3.951 -3.730 1.00 0.00 C ATOM 689 O ALA A 757 16.389 -5.008 -3.214 1.00 0.00 O ATOM 690 CB ALA A 757 14.407 -3.274 -4.325 1.00 0.00 C ATOM 0 H ALA A 757 15.438 -4.627 -6.045 1.00 0.00 H new ATOM 0 HA ALA A 757 16.148 -2.136 -4.642 1.00 0.00 H new ATOM 0 HB1 ALA A 757 14.247 -2.834 -3.341 1.00 0.00 H new ATOM 0 HB2 ALA A 757 13.814 -2.735 -5.064 1.00 0.00 H new ATOM 0 HB3 ALA A 757 14.103 -4.320 -4.309 1.00 0.00 H new ATOM 696 N PRO A 758 17.930 -3.431 -3.566 1.00 0.00 N ATOM 697 CA PRO A 758 18.964 -4.019 -2.721 1.00 0.00 C ATOM 698 C PRO A 758 18.540 -4.108 -1.268 1.00 0.00 C ATOM 699 O PRO A 758 18.304 -3.096 -0.610 1.00 0.00 O ATOM 700 CB PRO A 758 20.143 -3.062 -2.900 1.00 0.00 C ATOM 701 CG PRO A 758 19.531 -1.792 -3.394 1.00 0.00 C ATOM 702 CD PRO A 758 18.353 -2.192 -4.203 1.00 0.00 C ATOM 0 HA PRO A 758 19.194 -5.048 -2.999 1.00 0.00 H new ATOM 0 HB2 PRO A 758 20.673 -2.907 -1.960 1.00 0.00 H new ATOM 0 HB3 PRO A 758 20.867 -3.456 -3.613 1.00 0.00 H new ATOM 0 HG2 PRO A 758 19.234 -1.153 -2.562 1.00 0.00 H new ATOM 0 HG3 PRO A 758 20.242 -1.224 -3.994 1.00 0.00 H new ATOM 0 HD2 PRO A 758 17.569 -1.436 -4.177 1.00 0.00 H new ATOM 0 HD3 PRO A 758 18.614 -2.344 -5.250 1.00 0.00 H new ATOM 710 N GLY A 759 18.458 -5.333 -0.768 1.00 0.00 N ATOM 711 CA GLY A 759 18.033 -5.536 0.595 1.00 0.00 C ATOM 712 C GLY A 759 16.558 -5.245 0.744 1.00 0.00 C ATOM 713 O GLY A 759 16.042 -5.179 1.855 1.00 0.00 O ATOM 0 H GLY A 759 18.678 -6.185 -1.283 1.00 0.00 H new ATOM 0 HA2 GLY A 759 18.238 -6.563 0.896 1.00 0.00 H new ATOM 0 HA3 GLY A 759 18.605 -4.889 1.260 1.00 0.00 H new ATOM 717 N TYR A 760 15.886 -5.078 -0.398 1.00 0.00 N ATOM 718 CA TYR A 760 14.461 -4.790 -0.443 1.00 0.00 C ATOM 719 C TYR A 760 13.671 -5.578 0.593 1.00 0.00 C ATOM 720 O TYR A 760 13.140 -5.008 1.532 1.00 0.00 O ATOM 721 CB TYR A 760 14.013 -5.142 -1.853 1.00 0.00 C ATOM 722 CG TYR A 760 12.560 -5.002 -2.192 1.00 0.00 C ATOM 723 CD1 TYR A 760 11.800 -3.965 -1.724 1.00 0.00 C ATOM 724 CD2 TYR A 760 11.965 -5.910 -3.034 1.00 0.00 C ATOM 725 CE1 TYR A 760 10.483 -3.840 -2.087 1.00 0.00 C ATOM 726 CE2 TYR A 760 10.648 -5.794 -3.400 1.00 0.00 C ATOM 727 CZ TYR A 760 9.912 -4.753 -2.924 1.00 0.00 C ATOM 728 OH TYR A 760 8.592 -4.618 -3.291 1.00 0.00 O ATOM 0 H TYR A 760 16.322 -5.140 -1.318 1.00 0.00 H new ATOM 0 HA TYR A 760 14.277 -3.742 -0.204 1.00 0.00 H new ATOM 0 HB2 TYR A 760 14.578 -4.519 -2.547 1.00 0.00 H new ATOM 0 HB3 TYR A 760 14.301 -6.175 -2.045 1.00 0.00 H new ATOM 0 HD1 TYR A 760 12.242 -3.236 -1.061 1.00 0.00 H new ATOM 0 HD2 TYR A 760 12.548 -6.735 -3.417 1.00 0.00 H new ATOM 0 HE1 TYR A 760 9.896 -3.016 -1.709 1.00 0.00 H new ATOM 0 HE2 TYR A 760 10.199 -6.522 -4.060 1.00 0.00 H new ATOM 0 HH TYR A 760 8.466 -3.762 -3.752 1.00 0.00 H new ATOM 738 N TYR A 761 13.635 -6.885 0.440 1.00 0.00 N ATOM 739 CA TYR A 761 12.885 -7.745 1.350 1.00 0.00 C ATOM 740 C TYR A 761 13.355 -7.660 2.799 1.00 0.00 C ATOM 741 O TYR A 761 12.646 -8.090 3.709 1.00 0.00 O ATOM 742 CB TYR A 761 12.901 -9.182 0.846 1.00 0.00 C ATOM 743 CG TYR A 761 11.793 -9.421 -0.144 1.00 0.00 C ATOM 744 CD1 TYR A 761 11.583 -8.509 -1.156 1.00 0.00 C ATOM 745 CD2 TYR A 761 10.930 -10.505 -0.042 1.00 0.00 C ATOM 746 CE1 TYR A 761 10.554 -8.653 -2.052 1.00 0.00 C ATOM 747 CE2 TYR A 761 9.894 -10.670 -0.946 1.00 0.00 C ATOM 748 CZ TYR A 761 9.709 -9.738 -1.950 1.00 0.00 C ATOM 749 OH TYR A 761 8.675 -9.890 -2.846 1.00 0.00 O ATOM 0 H TYR A 761 14.117 -7.383 -0.308 1.00 0.00 H new ATOM 0 HA TYR A 761 11.859 -7.377 1.356 1.00 0.00 H new ATOM 0 HB2 TYR A 761 13.862 -9.396 0.379 1.00 0.00 H new ATOM 0 HB3 TYR A 761 12.795 -9.867 1.687 1.00 0.00 H new ATOM 0 HD1 TYR A 761 12.245 -7.660 -1.246 1.00 0.00 H new ATOM 0 HD2 TYR A 761 11.068 -11.226 0.750 1.00 0.00 H new ATOM 0 HE1 TYR A 761 10.407 -7.921 -2.832 1.00 0.00 H new ATOM 0 HE2 TYR A 761 9.235 -11.522 -0.867 1.00 0.00 H new ATOM 0 HH TYR A 761 8.176 -10.707 -2.635 1.00 0.00 H new ATOM 759 N GLU A 762 14.540 -7.114 3.018 1.00 0.00 N ATOM 760 CA GLU A 762 15.072 -6.992 4.371 1.00 0.00 C ATOM 761 C GLU A 762 14.426 -5.806 5.087 1.00 0.00 C ATOM 762 O GLU A 762 13.975 -5.917 6.227 1.00 0.00 O ATOM 763 CB GLU A 762 16.594 -6.837 4.325 1.00 0.00 C ATOM 764 CG GLU A 762 17.086 -5.495 4.825 1.00 0.00 C ATOM 765 CD GLU A 762 18.571 -5.502 5.128 1.00 0.00 C ATOM 766 OE1 GLU A 762 19.352 -5.930 4.254 1.00 0.00 O ATOM 767 OE2 GLU A 762 18.951 -5.083 6.241 1.00 0.00 O ATOM 0 H GLU A 762 15.149 -6.750 2.285 1.00 0.00 H new ATOM 0 HA GLU A 762 14.836 -7.898 4.929 1.00 0.00 H new ATOM 0 HB2 GLU A 762 17.049 -7.626 4.924 1.00 0.00 H new ATOM 0 HB3 GLU A 762 16.934 -6.979 3.299 1.00 0.00 H new ATOM 0 HG2 GLU A 762 16.874 -4.731 4.077 1.00 0.00 H new ATOM 0 HG3 GLU A 762 16.535 -5.221 5.725 1.00 0.00 H new ATOM 774 N VAL A 763 14.392 -4.676 4.393 1.00 0.00 N ATOM 775 CA VAL A 763 13.804 -3.452 4.908 1.00 0.00 C ATOM 776 C VAL A 763 12.311 -3.549 4.770 1.00 0.00 C ATOM 777 O VAL A 763 11.540 -3.297 5.697 1.00 0.00 O ATOM 778 CB VAL A 763 14.304 -2.216 4.102 1.00 0.00 C ATOM 779 CG1 VAL A 763 14.928 -2.611 2.792 1.00 0.00 C ATOM 780 CG2 VAL A 763 13.195 -1.275 3.771 1.00 0.00 C ATOM 0 H VAL A 763 14.774 -4.585 3.452 1.00 0.00 H new ATOM 0 HA VAL A 763 14.094 -3.329 5.951 1.00 0.00 H new ATOM 0 HB VAL A 763 15.037 -1.737 4.751 1.00 0.00 H new ATOM 0 HG11 VAL A 763 15.262 -1.718 2.264 1.00 0.00 H new ATOM 0 HG12 VAL A 763 15.781 -3.263 2.977 1.00 0.00 H new ATOM 0 HG13 VAL A 763 14.194 -3.139 2.184 1.00 0.00 H new ATOM 0 HG21 VAL A 763 13.591 -0.429 3.209 1.00 0.00 H new ATOM 0 HG22 VAL A 763 12.447 -1.792 3.170 1.00 0.00 H new ATOM 0 HG23 VAL A 763 12.736 -0.916 4.692 1.00 0.00 H new ATOM 790 N ILE A 764 11.946 -3.924 3.579 1.00 0.00 N ATOM 791 CA ILE A 764 10.583 -4.065 3.178 1.00 0.00 C ATOM 792 C ILE A 764 9.991 -5.390 3.636 1.00 0.00 C ATOM 793 O ILE A 764 10.005 -6.380 2.904 1.00 0.00 O ATOM 794 CB ILE A 764 10.533 -3.939 1.661 1.00 0.00 C ATOM 795 CG1 ILE A 764 11.079 -2.582 1.262 1.00 0.00 C ATOM 796 CG2 ILE A 764 9.144 -4.108 1.143 1.00 0.00 C ATOM 797 CD1 ILE A 764 10.183 -1.435 1.655 1.00 0.00 C ATOM 0 H ILE A 764 12.612 -4.146 2.839 1.00 0.00 H new ATOM 0 HA ILE A 764 9.981 -3.286 3.646 1.00 0.00 H new ATOM 0 HB ILE A 764 11.142 -4.730 1.224 1.00 0.00 H new ATOM 0 HG12 ILE A 764 12.057 -2.443 1.722 1.00 0.00 H new ATOM 0 HG13 ILE A 764 11.229 -2.562 0.183 1.00 0.00 H new ATOM 0 HG21 ILE A 764 9.146 -4.012 0.057 1.00 0.00 H new ATOM 0 HG22 ILE A 764 8.770 -5.094 1.419 1.00 0.00 H new ATOM 0 HG23 ILE A 764 8.499 -3.342 1.574 1.00 0.00 H new ATOM 0 HD11 ILE A 764 10.635 -0.495 1.339 1.00 0.00 H new ATOM 0 HD12 ILE A 764 9.212 -1.550 1.174 1.00 0.00 H new ATOM 0 HD13 ILE A 764 10.053 -1.429 2.737 1.00 0.00 H new ATOM 809 N ARG A 765 9.490 -5.403 4.864 1.00 0.00 N ATOM 810 CA ARG A 765 8.882 -6.598 5.431 1.00 0.00 C ATOM 811 C ARG A 765 7.702 -7.068 4.582 1.00 0.00 C ATOM 812 O ARG A 765 7.526 -8.266 4.364 1.00 0.00 O ATOM 813 CB ARG A 765 8.422 -6.333 6.868 1.00 0.00 C ATOM 814 CG ARG A 765 9.417 -6.762 7.922 1.00 0.00 C ATOM 815 CD ARG A 765 9.667 -8.250 7.866 1.00 0.00 C ATOM 816 NE ARG A 765 10.384 -8.736 9.041 1.00 0.00 N ATOM 817 CZ ARG A 765 10.975 -9.927 9.105 1.00 0.00 C ATOM 818 NH1 ARG A 765 10.938 -10.746 8.063 1.00 0.00 N ATOM 819 NH2 ARG A 765 11.603 -10.296 10.212 1.00 0.00 N ATOM 0 H ARG A 765 9.493 -4.596 5.488 1.00 0.00 H new ATOM 0 HA ARG A 765 9.635 -7.386 5.439 1.00 0.00 H new ATOM 0 HB2 ARG A 765 8.222 -5.268 6.984 1.00 0.00 H new ATOM 0 HB3 ARG A 765 7.480 -6.854 7.039 1.00 0.00 H new ATOM 0 HG2 ARG A 765 10.356 -6.228 7.778 1.00 0.00 H new ATOM 0 HG3 ARG A 765 9.044 -6.491 8.910 1.00 0.00 H new ATOM 0 HD2 ARG A 765 8.714 -8.773 7.782 1.00 0.00 H new ATOM 0 HD3 ARG A 765 10.240 -8.486 6.970 1.00 0.00 H new ATOM 0 HE ARG A 765 10.435 -8.129 9.859 1.00 0.00 H new ATOM 0 HH11 ARG A 765 10.456 -10.464 7.210 1.00 0.00 H new ATOM 0 HH12 ARG A 765 11.392 -11.658 8.115 1.00 0.00 H new ATOM 0 HH21 ARG A 765 11.633 -9.667 11.015 1.00 0.00 H new ATOM 0 HH22 ARG A 765 12.056 -11.209 10.261 1.00 0.00 H new ATOM 833 N PHE A 766 6.893 -6.120 4.102 1.00 0.00 N ATOM 834 CA PHE A 766 5.734 -6.458 3.279 1.00 0.00 C ATOM 835 C PHE A 766 5.776 -5.744 1.935 1.00 0.00 C ATOM 836 O PHE A 766 5.018 -4.804 1.706 1.00 0.00 O ATOM 837 CB PHE A 766 4.429 -6.098 3.990 1.00 0.00 C ATOM 838 CG PHE A 766 4.162 -6.899 5.220 1.00 0.00 C ATOM 839 CD1 PHE A 766 5.056 -6.859 6.255 1.00 0.00 C ATOM 840 CD2 PHE A 766 3.018 -7.665 5.348 1.00 0.00 C ATOM 841 CE1 PHE A 766 4.834 -7.567 7.415 1.00 0.00 C ATOM 842 CE2 PHE A 766 2.782 -8.384 6.502 1.00 0.00 C ATOM 843 CZ PHE A 766 3.694 -8.332 7.539 1.00 0.00 C ATOM 0 H PHE A 766 7.019 -5.122 4.268 1.00 0.00 H new ATOM 0 HA PHE A 766 5.772 -7.534 3.112 1.00 0.00 H new ATOM 0 HB2 PHE A 766 4.453 -5.041 4.256 1.00 0.00 H new ATOM 0 HB3 PHE A 766 3.600 -6.233 3.295 1.00 0.00 H new ATOM 0 HD1 PHE A 766 5.951 -6.262 6.161 1.00 0.00 H new ATOM 0 HD2 PHE A 766 2.304 -7.701 4.539 1.00 0.00 H new ATOM 0 HE1 PHE A 766 5.549 -7.523 8.223 1.00 0.00 H new ATOM 0 HE2 PHE A 766 1.889 -8.984 6.594 1.00 0.00 H new ATOM 0 HZ PHE A 766 3.514 -8.890 8.446 1.00 0.00 H new ATOM 853 N PRO A 767 6.662 -6.172 1.026 1.00 0.00 N ATOM 854 CA PRO A 767 6.784 -5.555 -0.285 1.00 0.00 C ATOM 855 C PRO A 767 5.555 -5.739 -1.153 1.00 0.00 C ATOM 856 O PRO A 767 5.519 -6.593 -2.040 1.00 0.00 O ATOM 857 CB PRO A 767 8.019 -6.204 -0.902 1.00 0.00 C ATOM 858 CG PRO A 767 8.676 -6.953 0.183 1.00 0.00 C ATOM 859 CD PRO A 767 7.637 -7.247 1.219 1.00 0.00 C ATOM 0 HA PRO A 767 6.879 -4.472 -0.201 1.00 0.00 H new ATOM 0 HB2 PRO A 767 7.742 -6.868 -1.721 1.00 0.00 H new ATOM 0 HB3 PRO A 767 8.689 -5.450 -1.316 1.00 0.00 H new ATOM 0 HG2 PRO A 767 9.110 -7.877 -0.198 1.00 0.00 H new ATOM 0 HG3 PRO A 767 9.491 -6.371 0.612 1.00 0.00 H new ATOM 0 HD2 PRO A 767 7.188 -8.229 1.072 1.00 0.00 H new ATOM 0 HD3 PRO A 767 8.056 -7.235 2.225 1.00 0.00 H new ATOM 867 N MET A 768 4.546 -4.922 -0.880 1.00 0.00 N ATOM 868 CA MET A 768 3.312 -4.951 -1.636 1.00 0.00 C ATOM 869 C MET A 768 3.502 -4.180 -2.913 1.00 0.00 C ATOM 870 O MET A 768 4.400 -3.344 -3.028 1.00 0.00 O ATOM 871 CB MET A 768 2.172 -4.326 -0.834 1.00 0.00 C ATOM 872 CG MET A 768 0.783 -4.380 -1.495 1.00 0.00 C ATOM 873 SD MET A 768 0.392 -5.909 -2.348 1.00 0.00 S ATOM 874 CE MET A 768 0.430 -7.011 -0.967 1.00 0.00 C ATOM 0 H MET A 768 4.564 -4.228 -0.133 1.00 0.00 H new ATOM 0 HA MET A 768 3.056 -5.988 -1.854 1.00 0.00 H new ATOM 0 HB2 MET A 768 2.114 -4.828 0.132 1.00 0.00 H new ATOM 0 HB3 MET A 768 2.420 -3.283 -0.637 1.00 0.00 H new ATOM 0 HG2 MET A 768 0.028 -4.209 -0.728 1.00 0.00 H new ATOM 0 HG3 MET A 768 0.706 -3.558 -2.206 1.00 0.00 H new ATOM 0 HE1 MET A 768 0.807 -7.982 -1.287 1.00 0.00 H new ATOM 0 HE2 MET A 768 1.083 -6.605 -0.195 1.00 0.00 H new ATOM 0 HE3 MET A 768 -0.577 -7.127 -0.566 1.00 0.00 H new ATOM 884 N ASP A 769 2.657 -4.463 -3.862 1.00 0.00 N ATOM 885 CA ASP A 769 2.710 -3.805 -5.132 1.00 0.00 C ATOM 886 C ASP A 769 1.314 -3.692 -5.697 1.00 0.00 C ATOM 887 O ASP A 769 0.369 -4.202 -5.115 1.00 0.00 O ATOM 888 CB ASP A 769 3.614 -4.585 -6.080 1.00 0.00 C ATOM 889 CG ASP A 769 5.071 -4.529 -5.664 1.00 0.00 C ATOM 890 OD1 ASP A 769 5.490 -5.383 -4.855 1.00 0.00 O ATOM 891 OD2 ASP A 769 5.792 -3.630 -6.146 1.00 0.00 O ATOM 0 H ASP A 769 1.913 -5.156 -3.776 1.00 0.00 H new ATOM 0 HA ASP A 769 3.122 -2.803 -5.011 1.00 0.00 H new ATOM 0 HB2 ASP A 769 3.288 -5.625 -6.115 1.00 0.00 H new ATOM 0 HB3 ASP A 769 3.511 -4.184 -7.088 1.00 0.00 H new ATOM 896 N LEU A 770 1.182 -2.981 -6.792 1.00 0.00 N ATOM 897 CA LEU A 770 -0.104 -2.823 -7.445 1.00 0.00 C ATOM 898 C LEU A 770 -0.500 -4.102 -8.146 1.00 0.00 C ATOM 899 O LEU A 770 -1.683 -4.374 -8.326 1.00 0.00 O ATOM 900 CB LEU A 770 -0.052 -1.644 -8.393 1.00 0.00 C ATOM 901 CG LEU A 770 0.679 -0.476 -7.802 1.00 0.00 C ATOM 902 CD1 LEU A 770 1.404 0.249 -8.884 1.00 0.00 C ATOM 903 CD2 LEU A 770 -0.287 0.435 -7.095 1.00 0.00 C ATOM 0 H LEU A 770 1.952 -2.499 -7.255 1.00 0.00 H new ATOM 0 HA LEU A 770 -0.872 -2.617 -6.699 1.00 0.00 H new ATOM 0 HB2 LEU A 770 0.437 -1.946 -9.319 1.00 0.00 H new ATOM 0 HB3 LEU A 770 -1.067 -1.342 -8.652 1.00 0.00 H new ATOM 0 HG LEU A 770 1.404 -0.829 -7.069 1.00 0.00 H new ATOM 0 HD11 LEU A 770 1.937 1.099 -8.458 1.00 0.00 H new ATOM 0 HD12 LEU A 770 2.117 -0.425 -9.359 1.00 0.00 H new ATOM 0 HD13 LEU A 770 0.689 0.604 -9.627 1.00 0.00 H new ATOM 0 HD21 LEU A 770 0.255 1.280 -6.670 1.00 0.00 H new ATOM 0 HD22 LEU A 770 -1.029 0.800 -7.805 1.00 0.00 H new ATOM 0 HD23 LEU A 770 -0.787 -0.114 -6.297 1.00 0.00 H new ATOM 915 N LYS A 771 0.490 -4.873 -8.575 1.00 0.00 N ATOM 916 CA LYS A 771 0.203 -6.161 -9.177 1.00 0.00 C ATOM 917 C LYS A 771 -0.053 -7.154 -8.069 1.00 0.00 C ATOM 918 O LYS A 771 -0.894 -8.032 -8.196 1.00 0.00 O ATOM 919 CB LYS A 771 1.327 -6.673 -10.051 1.00 0.00 C ATOM 920 CG LYS A 771 0.816 -7.594 -11.133 1.00 0.00 C ATOM 921 CD LYS A 771 0.575 -6.825 -12.413 1.00 0.00 C ATOM 922 CE LYS A 771 -0.295 -7.610 -13.373 1.00 0.00 C ATOM 923 NZ LYS A 771 -0.594 -6.842 -14.612 1.00 0.00 N ATOM 0 H LYS A 771 1.480 -4.633 -8.518 1.00 0.00 H new ATOM 0 HA LYS A 771 -0.667 -6.039 -9.822 1.00 0.00 H new ATOM 0 HB2 LYS A 771 1.847 -5.830 -10.506 1.00 0.00 H new ATOM 0 HB3 LYS A 771 2.055 -7.202 -9.436 1.00 0.00 H new ATOM 0 HG2 LYS A 771 1.538 -8.391 -11.311 1.00 0.00 H new ATOM 0 HG3 LYS A 771 -0.109 -8.069 -10.807 1.00 0.00 H new ATOM 0 HD2 LYS A 771 0.098 -5.872 -12.183 1.00 0.00 H new ATOM 0 HD3 LYS A 771 1.529 -6.597 -12.888 1.00 0.00 H new ATOM 0 HE2 LYS A 771 0.206 -8.542 -13.636 1.00 0.00 H new ATOM 0 HE3 LYS A 771 -1.229 -7.878 -12.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 771 -1.191 -7.416 -15.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 771 -1.095 -5.965 -14.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 771 0.295 -6.608 -15.098 1.00 0.00 H new ATOM 937 N THR A 772 0.730 -7.038 -7.001 1.00 0.00 N ATOM 938 CA THR A 772 0.533 -7.883 -5.831 1.00 0.00 C ATOM 939 C THR A 772 -0.842 -7.558 -5.266 1.00 0.00 C ATOM 940 O THR A 772 -1.598 -8.438 -4.860 1.00 0.00 O ATOM 941 CB THR A 772 1.609 -7.670 -4.757 1.00 0.00 C ATOM 942 OG1 THR A 772 2.911 -7.879 -5.314 1.00 0.00 O ATOM 943 CG2 THR A 772 1.384 -8.627 -3.601 1.00 0.00 C ATOM 0 H THR A 772 1.500 -6.373 -6.922 1.00 0.00 H new ATOM 0 HA THR A 772 0.609 -8.928 -6.131 1.00 0.00 H new ATOM 0 HB THR A 772 1.541 -6.645 -4.391 1.00 0.00 H new ATOM 0 HG1 THR A 772 3.590 -7.739 -4.621 1.00 0.00 H new ATOM 0 HG21 THR A 772 2.152 -8.469 -2.843 1.00 0.00 H new ATOM 0 HG22 THR A 772 0.401 -8.446 -3.165 1.00 0.00 H new ATOM 0 HG23 THR A 772 1.437 -9.654 -3.963 1.00 0.00 H new ATOM 951 N MET A 773 -1.137 -6.260 -5.229 1.00 0.00 N ATOM 952 CA MET A 773 -2.448 -5.767 -4.826 1.00 0.00 C ATOM 953 C MET A 773 -3.459 -6.419 -5.758 1.00 0.00 C ATOM 954 O MET A 773 -4.323 -7.170 -5.331 1.00 0.00 O ATOM 955 CB MET A 773 -2.505 -4.246 -4.974 1.00 0.00 C ATOM 956 CG MET A 773 -2.177 -3.495 -3.704 1.00 0.00 C ATOM 957 SD MET A 773 -3.363 -3.813 -2.408 1.00 0.00 S ATOM 958 CE MET A 773 -4.800 -3.028 -3.108 1.00 0.00 C ATOM 0 H MET A 773 -0.475 -5.525 -5.477 1.00 0.00 H new ATOM 0 HA MET A 773 -2.657 -6.008 -3.784 1.00 0.00 H new ATOM 0 HB2 MET A 773 -1.809 -3.940 -5.755 1.00 0.00 H new ATOM 0 HB3 MET A 773 -3.503 -3.960 -5.306 1.00 0.00 H new ATOM 0 HG2 MET A 773 -1.182 -3.780 -3.362 1.00 0.00 H new ATOM 0 HG3 MET A 773 -2.148 -2.426 -3.913 1.00 0.00 H new ATOM 0 HE1 MET A 773 -5.078 -2.168 -2.498 1.00 0.00 H new ATOM 0 HE2 MET A 773 -4.576 -2.697 -4.122 1.00 0.00 H new ATOM 0 HE3 MET A 773 -5.627 -3.738 -3.133 1.00 0.00 H new ATOM 968 N SER A 774 -3.298 -6.153 -7.053 1.00 0.00 N ATOM 969 CA SER A 774 -4.173 -6.721 -8.077 1.00 0.00 C ATOM 970 C SER A 774 -4.183 -8.234 -8.010 1.00 0.00 C ATOM 971 O SER A 774 -5.124 -8.874 -8.455 1.00 0.00 O ATOM 972 CB SER A 774 -3.737 -6.273 -9.453 1.00 0.00 C ATOM 973 OG SER A 774 -2.632 -7.024 -9.919 1.00 0.00 O ATOM 0 H SER A 774 -2.566 -5.545 -7.419 1.00 0.00 H new ATOM 0 HA SER A 774 -5.184 -6.360 -7.887 1.00 0.00 H new ATOM 0 HB2 SER A 774 -4.568 -6.377 -10.150 1.00 0.00 H new ATOM 0 HB3 SER A 774 -3.474 -5.216 -9.426 1.00 0.00 H new ATOM 0 HG SER A 774 -2.174 -7.439 -9.158 1.00 0.00 H new ATOM 979 N GLU A 775 -3.112 -8.799 -7.481 1.00 0.00 N ATOM 980 CA GLU A 775 -3.010 -10.235 -7.318 1.00 0.00 C ATOM 981 C GLU A 775 -4.108 -10.658 -6.377 1.00 0.00 C ATOM 982 O GLU A 775 -4.953 -11.499 -6.694 1.00 0.00 O ATOM 983 CB GLU A 775 -1.640 -10.583 -6.747 1.00 0.00 C ATOM 984 CG GLU A 775 -0.825 -11.497 -7.631 1.00 0.00 C ATOM 985 CD GLU A 775 0.216 -12.286 -6.861 1.00 0.00 C ATOM 986 OE1 GLU A 775 -0.119 -13.383 -6.365 1.00 0.00 O ATOM 987 OE2 GLU A 775 1.364 -11.808 -6.752 1.00 0.00 O ATOM 0 H GLU A 775 -2.297 -8.280 -7.156 1.00 0.00 H new ATOM 0 HA GLU A 775 -3.117 -10.753 -8.271 1.00 0.00 H new ATOM 0 HB2 GLU A 775 -1.082 -9.662 -6.580 1.00 0.00 H new ATOM 0 HB3 GLU A 775 -1.772 -11.057 -5.774 1.00 0.00 H new ATOM 0 HG2 GLU A 775 -1.493 -12.189 -8.144 1.00 0.00 H new ATOM 0 HG3 GLU A 775 -0.329 -10.904 -8.400 1.00 0.00 H new ATOM 994 N ARG A 776 -4.103 -10.001 -5.233 1.00 0.00 N ATOM 995 CA ARG A 776 -5.084 -10.216 -4.204 1.00 0.00 C ATOM 996 C ARG A 776 -6.462 -9.924 -4.769 1.00 0.00 C ATOM 997 O ARG A 776 -7.414 -10.684 -4.606 1.00 0.00 O ATOM 998 CB ARG A 776 -4.737 -9.295 -3.056 1.00 0.00 C ATOM 999 CG ARG A 776 -3.677 -9.860 -2.165 1.00 0.00 C ATOM 1000 CD ARG A 776 -2.591 -8.846 -1.882 1.00 0.00 C ATOM 1001 NE ARG A 776 -1.431 -9.451 -1.231 1.00 0.00 N ATOM 1002 CZ ARG A 776 -0.647 -10.361 -1.804 1.00 0.00 C ATOM 1003 NH1 ARG A 776 -0.888 -10.767 -3.044 1.00 0.00 N ATOM 1004 NH2 ARG A 776 0.384 -10.861 -1.137 1.00 0.00 N ATOM 0 H ARG A 776 -3.406 -9.295 -4.996 1.00 0.00 H new ATOM 0 HA ARG A 776 -5.088 -11.246 -3.848 1.00 0.00 H new ATOM 0 HB2 ARG A 776 -4.400 -8.337 -3.453 1.00 0.00 H new ATOM 0 HB3 ARG A 776 -5.634 -9.099 -2.468 1.00 0.00 H new ATOM 0 HG2 ARG A 776 -4.125 -10.186 -1.226 1.00 0.00 H new ATOM 0 HG3 ARG A 776 -3.240 -10.742 -2.633 1.00 0.00 H new ATOM 0 HD2 ARG A 776 -2.279 -8.379 -2.816 1.00 0.00 H new ATOM 0 HD3 ARG A 776 -2.991 -8.055 -1.248 1.00 0.00 H new ATOM 0 HE ARG A 776 -1.209 -9.158 -0.280 1.00 0.00 H new ATOM 0 HH11 ARG A 776 -1.677 -10.381 -3.563 1.00 0.00 H new ATOM 0 HH12 ARG A 776 -0.284 -11.465 -3.479 1.00 0.00 H new ATOM 0 HH21 ARG A 776 0.576 -10.548 -0.185 1.00 0.00 H new ATOM 0 HH22 ARG A 776 0.985 -11.559 -1.576 1.00 0.00 H new ATOM 1018 N LEU A 777 -6.512 -8.830 -5.486 1.00 0.00 N ATOM 1019 CA LEU A 777 -7.720 -8.350 -6.131 1.00 0.00 C ATOM 1020 C LEU A 777 -8.306 -9.407 -7.011 1.00 0.00 C ATOM 1021 O LEU A 777 -9.488 -9.723 -6.929 1.00 0.00 O ATOM 1022 CB LEU A 777 -7.352 -7.121 -6.953 1.00 0.00 C ATOM 1023 CG LEU A 777 -8.483 -6.250 -7.479 1.00 0.00 C ATOM 1024 CD1 LEU A 777 -9.754 -7.002 -7.732 1.00 0.00 C ATOM 1025 CD2 LEU A 777 -8.739 -5.135 -6.501 1.00 0.00 C ATOM 0 H LEU A 777 -5.701 -8.232 -5.644 1.00 0.00 H new ATOM 0 HA LEU A 777 -8.469 -8.096 -5.381 1.00 0.00 H new ATOM 0 HB2 LEU A 777 -6.703 -6.493 -6.343 1.00 0.00 H new ATOM 0 HB3 LEU A 777 -6.762 -7.454 -7.807 1.00 0.00 H new ATOM 0 HG LEU A 777 -8.162 -5.860 -8.445 1.00 0.00 H new ATOM 0 HD11 LEU A 777 -10.514 -6.316 -8.105 1.00 0.00 H new ATOM 0 HD12 LEU A 777 -9.574 -7.782 -8.472 1.00 0.00 H new ATOM 0 HD13 LEU A 777 -10.099 -7.456 -6.803 1.00 0.00 H new ATOM 0 HD21 LEU A 777 -9.549 -4.506 -6.871 1.00 0.00 H new ATOM 0 HD22 LEU A 777 -9.018 -5.555 -5.535 1.00 0.00 H new ATOM 0 HD23 LEU A 777 -7.836 -4.535 -6.388 1.00 0.00 H new ATOM 1037 N LYS A 778 -7.468 -9.956 -7.843 1.00 0.00 N ATOM 1038 CA LYS A 778 -7.900 -10.957 -8.760 1.00 0.00 C ATOM 1039 C LYS A 778 -8.640 -12.062 -8.031 1.00 0.00 C ATOM 1040 O LYS A 778 -9.741 -12.453 -8.415 1.00 0.00 O ATOM 1041 CB LYS A 778 -6.723 -11.561 -9.473 1.00 0.00 C ATOM 1042 CG LYS A 778 -6.658 -11.174 -10.924 1.00 0.00 C ATOM 1043 CD LYS A 778 -5.902 -9.870 -11.124 1.00 0.00 C ATOM 1044 CE LYS A 778 -4.390 -10.089 -11.205 1.00 0.00 C ATOM 1045 NZ LYS A 778 -3.921 -11.132 -10.252 1.00 0.00 N ATOM 0 H LYS A 778 -6.477 -9.722 -7.901 1.00 0.00 H new ATOM 0 HA LYS A 778 -8.565 -10.482 -9.482 1.00 0.00 H new ATOM 0 HB2 LYS A 778 -5.804 -11.248 -8.977 1.00 0.00 H new ATOM 0 HB3 LYS A 778 -6.774 -12.647 -9.393 1.00 0.00 H new ATOM 0 HG2 LYS A 778 -6.171 -11.968 -11.491 1.00 0.00 H new ATOM 0 HG3 LYS A 778 -7.669 -11.073 -11.320 1.00 0.00 H new ATOM 0 HD2 LYS A 778 -6.248 -9.387 -12.038 1.00 0.00 H new ATOM 0 HD3 LYS A 778 -6.126 -9.191 -10.301 1.00 0.00 H new ATOM 0 HE2 LYS A 778 -4.121 -10.380 -12.220 1.00 0.00 H new ATOM 0 HE3 LYS A 778 -3.877 -9.150 -10.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 778 -2.882 -11.129 -10.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 778 -4.299 -10.931 -9.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 778 -4.254 -12.065 -10.567 1.00 0.00 H new ATOM 1059 N ASN A 779 -8.009 -12.564 -6.973 1.00 0.00 N ATOM 1060 CA ASN A 779 -8.577 -13.633 -6.175 1.00 0.00 C ATOM 1061 C ASN A 779 -9.775 -13.145 -5.373 1.00 0.00 C ATOM 1062 O ASN A 779 -10.390 -13.914 -4.635 1.00 0.00 O ATOM 1063 CB ASN A 779 -7.542 -14.139 -5.187 1.00 0.00 C ATOM 1064 CG ASN A 779 -6.113 -13.934 -5.623 1.00 0.00 C ATOM 1065 OD1 ASN A 779 -5.409 -13.063 -4.899 1.00 0.00 O flip ATOM 1066 ND2 ASN A 779 -5.640 -14.551 -6.578 1.00 0.00 N flip ATOM 0 H ASN A 779 -7.097 -12.241 -6.651 1.00 0.00 H new ATOM 0 HA ASN A 779 -8.889 -14.422 -6.859 1.00 0.00 H new ATOM 0 HB2 ASN A 779 -7.693 -13.637 -4.232 1.00 0.00 H new ATOM 0 HB3 ASN A 779 -7.709 -15.203 -5.018 1.00 0.00 H new ATOM 0 HD21 ASN A 779 -6.221 -15.207 -7.100 1.00 0.00 H new ATOM 0 HD22 ASN A 779 -4.667 -14.406 -6.847 1.00 0.00 H new ATOM 1073 N ARG A 780 -10.073 -11.860 -5.509 1.00 0.00 N ATOM 1074 CA ARG A 780 -11.166 -11.222 -4.785 1.00 0.00 C ATOM 1075 C ARG A 780 -10.763 -11.065 -3.334 1.00 0.00 C ATOM 1076 O ARG A 780 -11.561 -10.667 -2.485 1.00 0.00 O ATOM 1077 CB ARG A 780 -12.462 -12.022 -4.865 1.00 0.00 C ATOM 1078 CG ARG A 780 -13.159 -11.945 -6.202 1.00 0.00 C ATOM 1079 CD ARG A 780 -12.426 -12.754 -7.248 1.00 0.00 C ATOM 1080 NE ARG A 780 -13.247 -13.838 -7.784 1.00 0.00 N ATOM 1081 CZ ARG A 780 -12.793 -14.759 -8.629 1.00 0.00 C ATOM 1082 NH1 ARG A 780 -11.532 -14.729 -9.036 1.00 0.00 N ATOM 1083 NH2 ARG A 780 -13.603 -15.712 -9.069 1.00 0.00 N ATOM 0 H ARG A 780 -9.563 -11.228 -6.126 1.00 0.00 H new ATOM 0 HA ARG A 780 -11.353 -10.253 -5.247 1.00 0.00 H new ATOM 0 HB2 ARG A 780 -12.245 -13.066 -4.641 1.00 0.00 H new ATOM 0 HB3 ARG A 780 -13.143 -11.666 -4.092 1.00 0.00 H new ATOM 0 HG2 ARG A 780 -14.181 -12.312 -6.104 1.00 0.00 H new ATOM 0 HG3 ARG A 780 -13.224 -10.905 -6.522 1.00 0.00 H new ATOM 0 HD2 ARG A 780 -12.118 -12.098 -8.062 1.00 0.00 H new ATOM 0 HD3 ARG A 780 -11.518 -13.170 -6.812 1.00 0.00 H new ATOM 0 HE ARG A 780 -14.223 -13.891 -7.493 1.00 0.00 H new ATOM 0 HH11 ARG A 780 -10.905 -13.997 -8.701 1.00 0.00 H new ATOM 0 HH12 ARG A 780 -11.188 -15.438 -9.684 1.00 0.00 H new ATOM 0 HH21 ARG A 780 -14.575 -15.739 -8.759 1.00 0.00 H new ATOM 0 HH22 ARG A 780 -13.255 -16.418 -9.717 1.00 0.00 H new ATOM 1097 N TYR A 781 -9.503 -11.406 -3.074 1.00 0.00 N ATOM 1098 CA TYR A 781 -8.921 -11.341 -1.745 1.00 0.00 C ATOM 1099 C TYR A 781 -9.438 -10.145 -0.961 1.00 0.00 C ATOM 1100 O TYR A 781 -9.741 -10.276 0.221 1.00 0.00 O ATOM 1101 CB TYR A 781 -7.396 -11.290 -1.862 1.00 0.00 C ATOM 1102 CG TYR A 781 -6.657 -10.913 -0.608 1.00 0.00 C ATOM 1103 CD1 TYR A 781 -6.517 -9.588 -0.272 1.00 0.00 C ATOM 1104 CD2 TYR A 781 -6.070 -11.869 0.209 1.00 0.00 C ATOM 1105 CE1 TYR A 781 -5.815 -9.199 0.838 1.00 0.00 C ATOM 1106 CE2 TYR A 781 -5.366 -11.497 1.337 1.00 0.00 C ATOM 1107 CZ TYR A 781 -5.237 -10.159 1.648 1.00 0.00 C ATOM 1108 OH TYR A 781 -4.523 -9.782 2.763 1.00 0.00 O ATOM 0 H TYR A 781 -8.856 -11.737 -3.789 1.00 0.00 H new ATOM 0 HA TYR A 781 -9.216 -12.235 -1.196 1.00 0.00 H new ATOM 0 HB2 TYR A 781 -7.042 -12.268 -2.190 1.00 0.00 H new ATOM 0 HB3 TYR A 781 -7.134 -10.577 -2.644 1.00 0.00 H new ATOM 0 HD1 TYR A 781 -6.972 -8.835 -0.898 1.00 0.00 H new ATOM 0 HD2 TYR A 781 -6.165 -12.916 -0.040 1.00 0.00 H new ATOM 0 HE1 TYR A 781 -5.714 -8.151 1.079 1.00 0.00 H new ATOM 0 HE2 TYR A 781 -4.919 -12.248 1.972 1.00 0.00 H new ATOM 0 HH TYR A 781 -4.185 -10.580 3.221 1.00 0.00 H new ATOM 1118 N TYR A 782 -9.541 -8.984 -1.615 1.00 0.00 N ATOM 1119 CA TYR A 782 -10.017 -7.782 -0.941 1.00 0.00 C ATOM 1120 C TYR A 782 -11.463 -7.908 -0.533 1.00 0.00 C ATOM 1121 O TYR A 782 -12.360 -7.341 -1.159 1.00 0.00 O ATOM 1122 CB TYR A 782 -9.797 -6.549 -1.809 1.00 0.00 C ATOM 1123 CG TYR A 782 -8.379 -6.421 -2.177 1.00 0.00 C ATOM 1124 CD1 TYR A 782 -7.484 -5.990 -1.253 1.00 0.00 C ATOM 1125 CD2 TYR A 782 -7.924 -6.785 -3.411 1.00 0.00 C ATOM 1126 CE1 TYR A 782 -6.162 -5.924 -1.532 1.00 0.00 C ATOM 1127 CE2 TYR A 782 -6.590 -6.698 -3.711 1.00 0.00 C ATOM 1128 CZ TYR A 782 -5.716 -6.271 -2.759 1.00 0.00 C ATOM 1129 OH TYR A 782 -4.384 -6.223 -3.023 1.00 0.00 O ATOM 0 H TYR A 782 -9.303 -8.856 -2.599 1.00 0.00 H new ATOM 0 HA TYR A 782 -9.432 -7.664 -0.029 1.00 0.00 H new ATOM 0 HB2 TYR A 782 -10.407 -6.618 -2.710 1.00 0.00 H new ATOM 0 HB3 TYR A 782 -10.121 -5.657 -1.272 1.00 0.00 H new ATOM 0 HD1 TYR A 782 -7.834 -5.694 -0.275 1.00 0.00 H new ATOM 0 HD2 TYR A 782 -8.619 -7.144 -4.155 1.00 0.00 H new ATOM 0 HE1 TYR A 782 -5.465 -5.595 -0.776 1.00 0.00 H new ATOM 0 HE2 TYR A 782 -6.235 -6.966 -4.695 1.00 0.00 H new ATOM 0 HH TYR A 782 -3.982 -5.470 -2.541 1.00 0.00 H new ATOM 1139 N VAL A 783 -11.677 -8.664 0.530 1.00 0.00 N ATOM 1140 CA VAL A 783 -12.996 -8.845 1.076 1.00 0.00 C ATOM 1141 C VAL A 783 -13.303 -7.648 1.935 1.00 0.00 C ATOM 1142 O VAL A 783 -14.283 -7.608 2.680 1.00 0.00 O ATOM 1143 CB VAL A 783 -13.087 -10.121 1.914 1.00 0.00 C ATOM 1144 CG1 VAL A 783 -12.888 -11.325 1.033 1.00 0.00 C ATOM 1145 CG2 VAL A 783 -12.066 -10.083 3.021 1.00 0.00 C ATOM 0 H VAL A 783 -10.942 -9.163 1.031 1.00 0.00 H new ATOM 0 HA VAL A 783 -13.715 -8.941 0.262 1.00 0.00 H new ATOM 0 HB VAL A 783 -14.076 -10.189 2.367 1.00 0.00 H new ATOM 0 HG11 VAL A 783 -12.954 -12.231 1.635 1.00 0.00 H new ATOM 0 HG12 VAL A 783 -13.659 -11.344 0.263 1.00 0.00 H new ATOM 0 HG13 VAL A 783 -11.906 -11.273 0.562 1.00 0.00 H new ATOM 0 HG21 VAL A 783 -12.137 -10.995 3.613 1.00 0.00 H new ATOM 0 HG22 VAL A 783 -11.067 -10.006 2.592 1.00 0.00 H new ATOM 0 HG23 VAL A 783 -12.254 -9.220 3.660 1.00 0.00 H new ATOM 1155 N SER A 784 -12.423 -6.673 1.803 1.00 0.00 N ATOM 1156 CA SER A 784 -12.492 -5.453 2.555 1.00 0.00 C ATOM 1157 C SER A 784 -11.544 -4.425 1.952 1.00 0.00 C ATOM 1158 O SER A 784 -10.373 -4.730 1.729 1.00 0.00 O ATOM 1159 CB SER A 784 -12.080 -5.763 3.978 1.00 0.00 C ATOM 1160 OG SER A 784 -13.199 -6.082 4.785 1.00 0.00 O ATOM 0 H SER A 784 -11.633 -6.716 1.159 1.00 0.00 H new ATOM 0 HA SER A 784 -13.503 -5.046 2.533 1.00 0.00 H new ATOM 0 HB2 SER A 784 -11.378 -6.597 3.981 1.00 0.00 H new ATOM 0 HB3 SER A 784 -11.557 -4.905 4.402 1.00 0.00 H new ATOM 0 HG SER A 784 -13.821 -6.642 4.275 1.00 0.00 H new ATOM 1166 N LYS A 785 -12.033 -3.215 1.665 1.00 0.00 N ATOM 1167 CA LYS A 785 -11.157 -2.190 1.106 1.00 0.00 C ATOM 1168 C LYS A 785 -9.986 -1.977 2.027 1.00 0.00 C ATOM 1169 O LYS A 785 -9.036 -1.330 1.649 1.00 0.00 O ATOM 1170 CB LYS A 785 -11.847 -0.844 0.906 1.00 0.00 C ATOM 1171 CG LYS A 785 -12.500 -0.308 2.159 1.00 0.00 C ATOM 1172 CD LYS A 785 -13.910 -0.817 2.230 1.00 0.00 C ATOM 1173 CE LYS A 785 -14.915 0.307 2.202 1.00 0.00 C ATOM 1174 NZ LYS A 785 -14.847 1.147 3.428 1.00 0.00 N ATOM 0 H LYS A 785 -13.002 -2.929 1.806 1.00 0.00 H new ATOM 0 HA LYS A 785 -10.846 -2.554 0.127 1.00 0.00 H new ATOM 0 HB2 LYS A 785 -11.115 -0.119 0.549 1.00 0.00 H new ATOM 0 HB3 LYS A 785 -12.603 -0.944 0.127 1.00 0.00 H new ATOM 0 HG2 LYS A 785 -11.941 -0.624 3.040 1.00 0.00 H new ATOM 0 HG3 LYS A 785 -12.493 0.782 2.151 1.00 0.00 H new ATOM 0 HD2 LYS A 785 -14.095 -1.491 1.394 1.00 0.00 H new ATOM 0 HD3 LYS A 785 -14.041 -1.398 3.143 1.00 0.00 H new ATOM 0 HE2 LYS A 785 -14.737 0.930 1.325 1.00 0.00 H new ATOM 0 HE3 LYS A 785 -15.918 -0.106 2.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 785 -15.748 1.082 3.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 785 -14.075 0.810 4.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 785 -14.671 2.137 3.161 1.00 0.00 H new ATOM 1188 N LYS A 786 -10.080 -2.495 3.250 1.00 0.00 N ATOM 1189 CA LYS A 786 -8.997 -2.347 4.206 1.00 0.00 C ATOM 1190 C LYS A 786 -7.826 -3.219 3.796 1.00 0.00 C ATOM 1191 O LYS A 786 -6.676 -2.871 4.019 1.00 0.00 O ATOM 1192 CB LYS A 786 -9.457 -2.685 5.626 1.00 0.00 C ATOM 1193 CG LYS A 786 -10.619 -1.831 6.111 1.00 0.00 C ATOM 1194 CD LYS A 786 -11.070 -2.241 7.507 1.00 0.00 C ATOM 1195 CE LYS A 786 -10.020 -1.909 8.556 1.00 0.00 C ATOM 1196 NZ LYS A 786 -10.420 -2.380 9.911 1.00 0.00 N ATOM 0 H LYS A 786 -10.887 -3.014 3.595 1.00 0.00 H new ATOM 0 HA LYS A 786 -8.679 -1.305 4.207 1.00 0.00 H new ATOM 0 HB2 LYS A 786 -9.748 -3.735 5.664 1.00 0.00 H new ATOM 0 HB3 LYS A 786 -8.617 -2.562 6.310 1.00 0.00 H new ATOM 0 HG2 LYS A 786 -10.323 -0.782 6.117 1.00 0.00 H new ATOM 0 HG3 LYS A 786 -11.454 -1.923 5.416 1.00 0.00 H new ATOM 0 HD2 LYS A 786 -12.003 -1.733 7.752 1.00 0.00 H new ATOM 0 HD3 LYS A 786 -11.276 -3.311 7.524 1.00 0.00 H new ATOM 0 HE2 LYS A 786 -9.071 -2.368 8.278 1.00 0.00 H new ATOM 0 HE3 LYS A 786 -9.858 -0.831 8.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 786 -9.678 -2.134 10.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 786 -11.312 -1.923 10.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 786 -10.550 -3.412 9.896 1.00 0.00 H new ATOM 1210 N LEU A 787 -8.128 -4.379 3.239 1.00 0.00 N ATOM 1211 CA LEU A 787 -7.098 -5.254 2.719 1.00 0.00 C ATOM 1212 C LEU A 787 -6.417 -4.502 1.634 1.00 0.00 C ATOM 1213 O LEU A 787 -5.197 -4.440 1.507 1.00 0.00 O ATOM 1214 CB LEU A 787 -7.740 -6.474 2.091 1.00 0.00 C ATOM 1215 CG LEU A 787 -8.093 -7.556 3.055 1.00 0.00 C ATOM 1216 CD1 LEU A 787 -8.845 -8.648 2.339 1.00 0.00 C ATOM 1217 CD2 LEU A 787 -6.832 -8.045 3.723 1.00 0.00 C ATOM 0 H LEU A 787 -9.079 -4.735 3.136 1.00 0.00 H new ATOM 0 HA LEU A 787 -6.416 -5.562 3.511 1.00 0.00 H new ATOM 0 HB2 LEU A 787 -8.644 -6.163 1.567 1.00 0.00 H new ATOM 0 HB3 LEU A 787 -7.061 -6.881 1.342 1.00 0.00 H new ATOM 0 HG LEU A 787 -8.754 -7.183 3.837 1.00 0.00 H new ATOM 0 HD11 LEU A 787 -9.101 -9.437 3.046 1.00 0.00 H new ATOM 0 HD12 LEU A 787 -9.757 -8.238 1.906 1.00 0.00 H new ATOM 0 HD13 LEU A 787 -8.221 -9.060 1.546 1.00 0.00 H new ATOM 0 HD21 LEU A 787 -7.079 -8.837 4.430 1.00 0.00 H new ATOM 0 HD22 LEU A 787 -6.147 -8.433 2.969 1.00 0.00 H new ATOM 0 HD23 LEU A 787 -6.358 -7.219 4.253 1.00 0.00 H new ATOM 1229 N PHE A 788 -7.296 -3.940 0.860 1.00 0.00 N ATOM 1230 CA PHE A 788 -6.979 -3.147 -0.268 1.00 0.00 C ATOM 1231 C PHE A 788 -6.275 -1.885 0.123 1.00 0.00 C ATOM 1232 O PHE A 788 -5.384 -1.403 -0.576 1.00 0.00 O ATOM 1233 CB PHE A 788 -8.263 -2.849 -0.952 1.00 0.00 C ATOM 1234 CG PHE A 788 -7.962 -2.450 -2.308 1.00 0.00 C ATOM 1235 CD1 PHE A 788 -7.650 -1.174 -2.488 1.00 0.00 C ATOM 1236 CD2 PHE A 788 -7.933 -3.318 -3.365 1.00 0.00 C ATOM 1237 CE1 PHE A 788 -7.310 -0.694 -3.695 1.00 0.00 C ATOM 1238 CE2 PHE A 788 -7.593 -2.853 -4.608 1.00 0.00 C ATOM 1239 CZ PHE A 788 -7.282 -1.533 -4.770 1.00 0.00 C ATOM 0 H PHE A 788 -8.300 -4.032 1.014 1.00 0.00 H new ATOM 0 HA PHE A 788 -6.296 -3.681 -0.929 1.00 0.00 H new ATOM 0 HB2 PHE A 788 -8.910 -3.726 -0.947 1.00 0.00 H new ATOM 0 HB3 PHE A 788 -8.798 -2.055 -0.431 1.00 0.00 H new ATOM 0 HD1 PHE A 788 -7.670 -0.503 -1.642 1.00 0.00 H new ATOM 0 HD2 PHE A 788 -8.176 -4.360 -3.221 1.00 0.00 H new ATOM 0 HE1 PHE A 788 -7.060 0.350 -3.814 1.00 0.00 H new ATOM 0 HE2 PHE A 788 -7.571 -3.525 -5.453 1.00 0.00 H new ATOM 0 HZ PHE A 788 -7.015 -1.155 -5.746 1.00 0.00 H new ATOM 1249 N MET A 789 -6.671 -1.364 1.244 1.00 0.00 N ATOM 1250 CA MET A 789 -6.093 -0.163 1.738 1.00 0.00 C ATOM 1251 C MET A 789 -4.714 -0.479 2.242 1.00 0.00 C ATOM 1252 O MET A 789 -3.733 -0.056 1.675 1.00 0.00 O ATOM 1253 CB MET A 789 -6.956 0.394 2.835 1.00 0.00 C ATOM 1254 CG MET A 789 -8.123 1.193 2.301 1.00 0.00 C ATOM 1255 SD MET A 789 -8.302 2.738 3.175 1.00 0.00 S ATOM 1256 CE MET A 789 -7.651 3.836 1.937 1.00 0.00 C ATOM 0 H MET A 789 -7.401 -1.761 1.836 1.00 0.00 H new ATOM 0 HA MET A 789 -6.024 0.588 0.951 1.00 0.00 H new ATOM 0 HB2 MET A 789 -7.331 -0.424 3.450 1.00 0.00 H new ATOM 0 HB3 MET A 789 -6.351 1.028 3.483 1.00 0.00 H new ATOM 0 HG2 MET A 789 -7.978 1.388 1.239 1.00 0.00 H new ATOM 0 HG3 MET A 789 -9.039 0.610 2.396 1.00 0.00 H new ATOM 0 HE1 MET A 789 -7.236 4.722 2.418 1.00 0.00 H new ATOM 0 HE2 MET A 789 -6.867 3.328 1.376 1.00 0.00 H new ATOM 0 HE3 MET A 789 -8.450 4.133 1.257 1.00 0.00 H new ATOM 1266 N ALA A 790 -4.675 -1.306 3.268 1.00 0.00 N ATOM 1267 CA ALA A 790 -3.436 -1.737 3.892 1.00 0.00 C ATOM 1268 C ALA A 790 -2.385 -2.162 2.884 1.00 0.00 C ATOM 1269 O ALA A 790 -1.243 -1.734 2.969 1.00 0.00 O ATOM 1270 CB ALA A 790 -3.717 -2.915 4.799 1.00 0.00 C ATOM 0 H ALA A 790 -5.511 -1.703 3.698 1.00 0.00 H new ATOM 0 HA ALA A 790 -3.048 -0.883 4.447 1.00 0.00 H new ATOM 0 HB1 ALA A 790 -2.789 -3.242 5.269 1.00 0.00 H new ATOM 0 HB2 ALA A 790 -4.430 -2.620 5.569 1.00 0.00 H new ATOM 0 HB3 ALA A 790 -4.135 -3.734 4.213 1.00 0.00 H new ATOM 1276 N ASP A 791 -2.778 -3.021 1.948 1.00 0.00 N ATOM 1277 CA ASP A 791 -1.853 -3.546 0.952 1.00 0.00 C ATOM 1278 C ASP A 791 -1.411 -2.469 -0.043 1.00 0.00 C ATOM 1279 O ASP A 791 -0.224 -2.255 -0.236 1.00 0.00 O ATOM 1280 CB ASP A 791 -2.457 -4.753 0.246 1.00 0.00 C ATOM 1281 CG ASP A 791 -2.527 -5.973 1.144 1.00 0.00 C ATOM 1282 OD1 ASP A 791 -1.479 -6.362 1.702 1.00 0.00 O ATOM 1283 OD2 ASP A 791 -3.629 -6.543 1.288 1.00 0.00 O ATOM 0 H ASP A 791 -3.733 -3.368 1.859 1.00 0.00 H new ATOM 0 HA ASP A 791 -0.953 -3.874 1.472 1.00 0.00 H new ATOM 0 HB2 ASP A 791 -3.459 -4.503 -0.102 1.00 0.00 H new ATOM 0 HB3 ASP A 791 -1.863 -4.989 -0.637 1.00 0.00 H new ATOM 1288 N LEU A 792 -2.328 -1.792 -0.704 1.00 0.00 N ATOM 1289 CA LEU A 792 -1.894 -0.734 -1.605 1.00 0.00 C ATOM 1290 C LEU A 792 -1.089 0.246 -0.789 1.00 0.00 C ATOM 1291 O LEU A 792 -0.103 0.820 -1.248 1.00 0.00 O ATOM 1292 CB LEU A 792 -3.077 -0.009 -2.237 1.00 0.00 C ATOM 1293 CG LEU A 792 -3.149 -0.044 -3.740 1.00 0.00 C ATOM 1294 CD1 LEU A 792 -4.242 0.887 -4.195 1.00 0.00 C ATOM 1295 CD2 LEU A 792 -1.817 0.333 -4.342 1.00 0.00 C ATOM 0 H LEU A 792 -3.335 -1.941 -0.644 1.00 0.00 H new ATOM 0 HA LEU A 792 -1.307 -1.167 -2.415 1.00 0.00 H new ATOM 0 HB2 LEU A 792 -3.996 -0.440 -1.839 1.00 0.00 H new ATOM 0 HB3 LEU A 792 -3.050 1.033 -1.919 1.00 0.00 H new ATOM 0 HG LEU A 792 -3.381 -1.054 -4.077 1.00 0.00 H new ATOM 0 HD11 LEU A 792 -4.304 0.871 -5.283 1.00 0.00 H new ATOM 0 HD12 LEU A 792 -5.194 0.565 -3.772 1.00 0.00 H new ATOM 0 HD13 LEU A 792 -4.020 1.900 -3.859 1.00 0.00 H new ATOM 0 HD21 LEU A 792 -1.887 0.302 -5.429 1.00 0.00 H new ATOM 0 HD22 LEU A 792 -1.546 1.340 -4.024 1.00 0.00 H new ATOM 0 HD23 LEU A 792 -1.055 -0.371 -4.008 1.00 0.00 H new ATOM 1307 N GLN A 793 -1.521 0.392 0.452 1.00 0.00 N ATOM 1308 CA GLN A 793 -0.867 1.268 1.393 1.00 0.00 C ATOM 1309 C GLN A 793 0.431 0.623 1.805 1.00 0.00 C ATOM 1310 O GLN A 793 1.346 1.266 2.305 1.00 0.00 O ATOM 1311 CB GLN A 793 -1.759 1.525 2.599 1.00 0.00 C ATOM 1312 CG GLN A 793 -2.901 2.469 2.294 1.00 0.00 C ATOM 1313 CD GLN A 793 -3.867 2.619 3.456 1.00 0.00 C ATOM 1314 OE1 GLN A 793 -5.141 2.872 3.157 1.00 0.00 O flip ATOM 1315 NE2 GLN A 793 -3.474 2.506 4.617 1.00 0.00 N flip ATOM 0 H GLN A 793 -2.334 -0.095 0.829 1.00 0.00 H new ATOM 0 HA GLN A 793 -0.668 2.235 0.931 1.00 0.00 H new ATOM 0 HB2 GLN A 793 -2.163 0.577 2.955 1.00 0.00 H new ATOM 0 HB3 GLN A 793 -1.158 1.939 3.408 1.00 0.00 H new ATOM 0 HG2 GLN A 793 -2.498 3.448 2.034 1.00 0.00 H new ATOM 0 HG3 GLN A 793 -3.443 2.106 1.421 1.00 0.00 H new ATOM 0 HE21 GLN A 793 -2.491 2.312 4.806 1.00 0.00 H new ATOM 0 HE22 GLN A 793 -4.132 2.606 5.390 1.00 0.00 H new ATOM 1324 N ARG A 794 0.467 -0.676 1.582 1.00 0.00 N ATOM 1325 CA ARG A 794 1.619 -1.498 1.871 1.00 0.00 C ATOM 1326 C ARG A 794 2.690 -1.233 0.812 1.00 0.00 C ATOM 1327 O ARG A 794 3.877 -1.410 1.064 1.00 0.00 O ATOM 1328 CB ARG A 794 1.187 -2.972 1.905 1.00 0.00 C ATOM 1329 CG ARG A 794 2.208 -3.908 2.482 1.00 0.00 C ATOM 1330 CD ARG A 794 2.209 -3.799 3.986 1.00 0.00 C ATOM 1331 NE ARG A 794 1.677 -4.999 4.627 1.00 0.00 N ATOM 1332 CZ ARG A 794 0.998 -4.983 5.771 1.00 0.00 C ATOM 1333 NH1 ARG A 794 0.784 -3.837 6.403 1.00 0.00 N ATOM 1334 NH2 ARG A 794 0.529 -6.114 6.284 1.00 0.00 N ATOM 0 H ARG A 794 -0.318 -1.196 1.188 1.00 0.00 H new ATOM 0 HA ARG A 794 2.043 -1.255 2.845 1.00 0.00 H new ATOM 0 HB2 ARG A 794 0.268 -3.055 2.486 1.00 0.00 H new ATOM 0 HB3 ARG A 794 0.952 -3.292 0.890 1.00 0.00 H new ATOM 0 HG2 ARG A 794 1.986 -4.932 2.183 1.00 0.00 H new ATOM 0 HG3 ARG A 794 3.197 -3.669 2.090 1.00 0.00 H new ATOM 0 HD2 ARG A 794 3.227 -3.624 4.335 1.00 0.00 H new ATOM 0 HD3 ARG A 794 1.616 -2.935 4.286 1.00 0.00 H new ATOM 0 HE ARG A 794 1.835 -5.898 4.173 1.00 0.00 H new ATOM 0 HH11 ARG A 794 1.140 -2.965 6.012 1.00 0.00 H new ATOM 0 HH12 ARG A 794 0.263 -3.828 7.280 1.00 0.00 H new ATOM 0 HH21 ARG A 794 0.689 -6.998 5.801 1.00 0.00 H new ATOM 0 HH22 ARG A 794 0.009 -6.099 7.161 1.00 0.00 H new ATOM 1348 N VAL A 795 2.259 -0.783 -0.377 1.00 0.00 N ATOM 1349 CA VAL A 795 3.199 -0.457 -1.453 1.00 0.00 C ATOM 1350 C VAL A 795 3.742 0.954 -1.239 1.00 0.00 C ATOM 1351 O VAL A 795 4.935 1.205 -1.403 1.00 0.00 O ATOM 1352 CB VAL A 795 2.574 -0.575 -2.873 1.00 0.00 C ATOM 1353 CG1 VAL A 795 1.345 -1.440 -2.844 1.00 0.00 C ATOM 1354 CG2 VAL A 795 2.249 0.774 -3.484 1.00 0.00 C ATOM 0 H VAL A 795 1.277 -0.639 -0.613 1.00 0.00 H new ATOM 0 HA VAL A 795 4.004 -1.190 -1.408 1.00 0.00 H new ATOM 0 HB VAL A 795 3.328 -1.042 -3.506 1.00 0.00 H new ATOM 0 HG11 VAL A 795 0.925 -1.509 -3.847 1.00 0.00 H new ATOM 0 HG12 VAL A 795 1.610 -2.437 -2.493 1.00 0.00 H new ATOM 0 HG13 VAL A 795 0.608 -1.002 -2.171 1.00 0.00 H new ATOM 0 HG21 VAL A 795 1.816 0.630 -4.474 1.00 0.00 H new ATOM 0 HG22 VAL A 795 1.536 1.299 -2.849 1.00 0.00 H new ATOM 0 HG23 VAL A 795 3.161 1.364 -3.570 1.00 0.00 H new ATOM 1364 N PHE A 796 2.846 1.873 -0.868 1.00 0.00 N ATOM 1365 CA PHE A 796 3.236 3.260 -0.604 1.00 0.00 C ATOM 1366 C PHE A 796 4.098 3.316 0.650 1.00 0.00 C ATOM 1367 O PHE A 796 5.156 3.942 0.663 1.00 0.00 O ATOM 1368 CB PHE A 796 2.023 4.168 -0.388 1.00 0.00 C ATOM 1369 CG PHE A 796 0.802 3.808 -1.186 1.00 0.00 C ATOM 1370 CD1 PHE A 796 0.875 3.524 -2.530 1.00 0.00 C ATOM 1371 CD2 PHE A 796 -0.420 3.734 -0.575 1.00 0.00 C ATOM 1372 CE1 PHE A 796 -0.242 3.169 -3.245 1.00 0.00 C ATOM 1373 CE2 PHE A 796 -1.539 3.381 -1.288 1.00 0.00 C ATOM 1374 CZ PHE A 796 -1.441 3.097 -2.628 1.00 0.00 C ATOM 0 H PHE A 796 1.852 1.683 -0.744 1.00 0.00 H new ATOM 0 HA PHE A 796 3.785 3.613 -1.477 1.00 0.00 H new ATOM 0 HB2 PHE A 796 1.763 4.153 0.670 1.00 0.00 H new ATOM 0 HB3 PHE A 796 2.308 5.191 -0.632 1.00 0.00 H new ATOM 0 HD1 PHE A 796 1.829 3.581 -3.032 1.00 0.00 H new ATOM 0 HD2 PHE A 796 -0.505 3.955 0.479 1.00 0.00 H new ATOM 0 HE1 PHE A 796 -0.162 2.948 -4.299 1.00 0.00 H new ATOM 0 HE2 PHE A 796 -2.498 3.327 -0.794 1.00 0.00 H new ATOM 0 HZ PHE A 796 -2.321 2.817 -3.187 1.00 0.00 H new ATOM 1384 N THR A 797 3.620 2.655 1.708 1.00 0.00 N ATOM 1385 CA THR A 797 4.327 2.621 2.984 1.00 0.00 C ATOM 1386 C THR A 797 5.707 2.004 2.818 1.00 0.00 C ATOM 1387 O THR A 797 6.698 2.551 3.293 1.00 0.00 O ATOM 1388 CB THR A 797 3.545 1.829 4.067 1.00 0.00 C ATOM 1389 OG1 THR A 797 3.916 2.289 5.371 1.00 0.00 O ATOM 1390 CG2 THR A 797 3.810 0.333 3.969 1.00 0.00 C ATOM 0 H THR A 797 2.742 2.135 1.702 1.00 0.00 H new ATOM 0 HA THR A 797 4.420 3.655 3.316 1.00 0.00 H new ATOM 0 HB THR A 797 2.482 2.001 3.898 1.00 0.00 H new ATOM 0 HG1 THR A 797 4.875 2.142 5.509 1.00 0.00 H new ATOM 0 HG21 THR A 797 3.246 -0.188 4.743 1.00 0.00 H new ATOM 0 HG22 THR A 797 3.500 -0.028 2.988 1.00 0.00 H new ATOM 0 HG23 THR A 797 4.874 0.142 4.106 1.00 0.00 H new ATOM 1398 N ASN A 798 5.767 0.856 2.146 1.00 0.00 N ATOM 1399 CA ASN A 798 7.028 0.191 1.925 1.00 0.00 C ATOM 1400 C ASN A 798 7.870 1.028 0.982 1.00 0.00 C ATOM 1401 O ASN A 798 9.097 0.992 1.033 1.00 0.00 O ATOM 1402 CB ASN A 798 6.813 -1.224 1.418 1.00 0.00 C ATOM 1403 CG ASN A 798 6.707 -2.211 2.569 1.00 0.00 C ATOM 1404 OD1 ASN A 798 7.715 -2.686 3.089 1.00 0.00 O ATOM 1405 ND2 ASN A 798 5.484 -2.512 2.987 1.00 0.00 N ATOM 0 H ASN A 798 4.957 0.378 1.751 1.00 0.00 H new ATOM 0 HA ASN A 798 7.568 0.096 2.867 1.00 0.00 H new ATOM 0 HB2 ASN A 798 5.905 -1.263 0.817 1.00 0.00 H new ATOM 0 HB3 ASN A 798 7.639 -1.509 0.766 1.00 0.00 H new ATOM 0 HD21 ASN A 798 5.356 -3.158 3.766 1.00 0.00 H new ATOM 0 HD22 ASN A 798 4.672 -2.097 2.530 1.00 0.00 H new ATOM 1412 N CYS A 799 7.214 1.824 0.135 1.00 0.00 N ATOM 1413 CA CYS A 799 7.962 2.684 -0.747 1.00 0.00 C ATOM 1414 C CYS A 799 8.490 3.857 0.064 1.00 0.00 C ATOM 1415 O CYS A 799 9.495 4.463 -0.254 1.00 0.00 O ATOM 1416 CB CYS A 799 7.162 3.158 -1.937 1.00 0.00 C ATOM 1417 SG CYS A 799 7.934 4.547 -2.783 1.00 0.00 S ATOM 0 H CYS A 799 6.199 1.883 0.050 1.00 0.00 H new ATOM 0 HA CYS A 799 8.787 2.109 -1.167 1.00 0.00 H new ATOM 0 HB2 CYS A 799 7.039 2.333 -2.639 1.00 0.00 H new ATOM 0 HB3 CYS A 799 6.164 3.448 -1.607 1.00 0.00 H new ATOM 0 HG CYS A 799 9.223 4.378 -2.808 1.00 0.00 H new ATOM 1423 N LYS A 800 7.766 4.160 1.121 1.00 0.00 N ATOM 1424 CA LYS A 800 8.096 5.222 2.056 1.00 0.00 C ATOM 1425 C LYS A 800 9.101 4.725 3.098 1.00 0.00 C ATOM 1426 O LYS A 800 9.819 5.496 3.732 1.00 0.00 O ATOM 1427 CB LYS A 800 6.807 5.608 2.735 1.00 0.00 C ATOM 1428 CG LYS A 800 6.004 6.643 2.005 1.00 0.00 C ATOM 1429 CD LYS A 800 4.535 6.506 2.337 1.00 0.00 C ATOM 1430 CE LYS A 800 3.716 7.463 1.516 1.00 0.00 C ATOM 1431 NZ LYS A 800 2.563 8.014 2.276 1.00 0.00 N ATOM 0 H LYS A 800 6.909 3.663 1.362 1.00 0.00 H new ATOM 0 HA LYS A 800 8.547 6.069 1.539 1.00 0.00 H new ATOM 0 HB2 LYS A 800 6.196 4.714 2.860 1.00 0.00 H new ATOM 0 HB3 LYS A 800 7.035 5.981 3.733 1.00 0.00 H new ATOM 0 HG2 LYS A 800 6.353 7.640 2.276 1.00 0.00 H new ATOM 0 HG3 LYS A 800 6.152 6.535 0.930 1.00 0.00 H new ATOM 0 HD2 LYS A 800 4.208 5.484 2.148 1.00 0.00 H new ATOM 0 HD3 LYS A 800 4.377 6.700 3.398 1.00 0.00 H new ATOM 0 HE2 LYS A 800 4.350 8.282 1.177 1.00 0.00 H new ATOM 0 HE3 LYS A 800 3.351 6.953 0.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 800 1.884 8.443 1.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 800 2.097 7.248 2.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 800 2.901 8.737 2.943 1.00 0.00 H new ATOM 1445 N GLU A 801 9.110 3.408 3.257 1.00 0.00 N ATOM 1446 CA GLU A 801 9.945 2.702 4.231 1.00 0.00 C ATOM 1447 C GLU A 801 11.412 2.632 3.850 1.00 0.00 C ATOM 1448 O GLU A 801 12.295 3.147 4.535 1.00 0.00 O ATOM 1449 CB GLU A 801 9.453 1.263 4.250 1.00 0.00 C ATOM 1450 CG GLU A 801 8.740 0.820 5.515 1.00 0.00 C ATOM 1451 CD GLU A 801 7.832 1.888 6.095 1.00 0.00 C ATOM 1452 OE1 GLU A 801 8.334 2.760 6.835 1.00 0.00 O ATOM 1453 OE2 GLU A 801 6.616 1.850 5.813 1.00 0.00 O ATOM 0 H GLU A 801 8.525 2.783 2.702 1.00 0.00 H new ATOM 0 HA GLU A 801 9.868 3.236 5.178 1.00 0.00 H new ATOM 0 HB2 GLU A 801 8.777 1.120 3.407 1.00 0.00 H new ATOM 0 HB3 GLU A 801 10.307 0.606 4.089 1.00 0.00 H new ATOM 0 HG2 GLU A 801 8.150 -0.071 5.299 1.00 0.00 H new ATOM 0 HG3 GLU A 801 9.482 0.538 6.262 1.00 0.00 H new ATOM 1460 N TYR A 802 11.625 1.979 2.731 1.00 0.00 N ATOM 1461 CA TYR A 802 12.937 1.708 2.183 1.00 0.00 C ATOM 1462 C TYR A 802 13.507 2.907 1.465 1.00 0.00 C ATOM 1463 O TYR A 802 14.623 3.352 1.729 1.00 0.00 O ATOM 1464 CB TYR A 802 12.738 0.543 1.219 1.00 0.00 C ATOM 1465 CG TYR A 802 13.925 0.075 0.436 1.00 0.00 C ATOM 1466 CD1 TYR A 802 15.211 0.566 0.624 1.00 0.00 C ATOM 1467 CD2 TYR A 802 13.721 -0.881 -0.527 1.00 0.00 C ATOM 1468 CE1 TYR A 802 16.258 0.098 -0.141 1.00 0.00 C ATOM 1469 CE2 TYR A 802 14.747 -1.349 -1.293 1.00 0.00 C ATOM 1470 CZ TYR A 802 16.020 -0.859 -1.101 1.00 0.00 C ATOM 1471 OH TYR A 802 17.054 -1.320 -1.871 1.00 0.00 O ATOM 0 H TYR A 802 10.867 1.609 2.158 1.00 0.00 H new ATOM 0 HA TYR A 802 13.651 1.472 2.972 1.00 0.00 H new ATOM 0 HB2 TYR A 802 12.359 -0.304 1.791 1.00 0.00 H new ATOM 0 HB3 TYR A 802 11.959 0.824 0.510 1.00 0.00 H new ATOM 0 HD1 TYR A 802 15.392 1.320 1.375 1.00 0.00 H new ATOM 0 HD2 TYR A 802 12.726 -1.271 -0.681 1.00 0.00 H new ATOM 0 HE1 TYR A 802 17.257 0.479 0.012 1.00 0.00 H new ATOM 0 HE2 TYR A 802 14.563 -2.100 -2.047 1.00 0.00 H new ATOM 0 HH TYR A 802 17.726 -1.742 -1.297 1.00 0.00 H new ATOM 1481 N ASN A 803 12.711 3.417 0.570 1.00 0.00 N ATOM 1482 CA ASN A 803 13.083 4.548 -0.255 1.00 0.00 C ATOM 1483 C ASN A 803 13.265 5.826 0.536 1.00 0.00 C ATOM 1484 O ASN A 803 12.839 5.940 1.685 1.00 0.00 O ATOM 1485 CB ASN A 803 11.997 4.762 -1.283 1.00 0.00 C ATOM 1486 CG ASN A 803 11.617 3.475 -1.991 1.00 0.00 C ATOM 1487 OD1 ASN A 803 10.467 3.284 -2.375 1.00 0.00 O ATOM 1488 ND2 ASN A 803 12.587 2.585 -2.172 1.00 0.00 N ATOM 0 H ASN A 803 11.773 3.061 0.384 1.00 0.00 H new ATOM 0 HA ASN A 803 14.043 4.318 -0.717 1.00 0.00 H new ATOM 0 HB2 ASN A 803 11.116 5.181 -0.797 1.00 0.00 H new ATOM 0 HB3 ASN A 803 12.334 5.493 -2.018 1.00 0.00 H new ATOM 0 HD21 ASN A 803 12.389 1.704 -2.646 1.00 0.00 H new ATOM 0 HD22 ASN A 803 13.530 2.783 -1.837 1.00 0.00 H new ATOM 1495 N PRO A 804 13.939 6.797 -0.093 1.00 0.00 N ATOM 1496 CA PRO A 804 14.164 8.118 0.440 1.00 0.00 C ATOM 1497 C PRO A 804 13.205 9.108 -0.223 1.00 0.00 C ATOM 1498 O PRO A 804 12.914 8.985 -1.412 1.00 0.00 O ATOM 1499 CB PRO A 804 15.591 8.389 0.006 1.00 0.00 C ATOM 1500 CG PRO A 804 15.750 7.645 -1.291 1.00 0.00 C ATOM 1501 CD PRO A 804 14.589 6.680 -1.398 1.00 0.00 C ATOM 0 HA PRO A 804 14.008 8.207 1.515 1.00 0.00 H new ATOM 0 HB2 PRO A 804 15.767 9.456 -0.127 1.00 0.00 H new ATOM 0 HB3 PRO A 804 16.304 8.039 0.752 1.00 0.00 H new ATOM 0 HG2 PRO A 804 15.754 8.337 -2.133 1.00 0.00 H new ATOM 0 HG3 PRO A 804 16.699 7.109 -1.314 1.00 0.00 H new ATOM 0 HD2 PRO A 804 13.914 6.950 -2.210 1.00 0.00 H new ATOM 0 HD3 PRO A 804 14.927 5.662 -1.590 1.00 0.00 H new ATOM 1509 N PRO A 805 12.717 10.109 0.513 1.00 0.00 N ATOM 1510 CA PRO A 805 11.755 11.077 -0.018 1.00 0.00 C ATOM 1511 C PRO A 805 12.370 11.972 -1.093 1.00 0.00 C ATOM 1512 O PRO A 805 11.777 12.973 -1.494 1.00 0.00 O ATOM 1513 CB PRO A 805 11.346 11.901 1.209 1.00 0.00 C ATOM 1514 CG PRO A 805 11.889 11.159 2.388 1.00 0.00 C ATOM 1515 CD PRO A 805 13.091 10.415 1.889 1.00 0.00 C ATOM 0 HA PRO A 805 10.913 10.586 -0.506 1.00 0.00 H new ATOM 0 HB2 PRO A 805 11.755 12.910 1.158 1.00 0.00 H new ATOM 0 HB3 PRO A 805 10.262 11.999 1.272 1.00 0.00 H new ATOM 0 HG2 PRO A 805 12.160 11.845 3.190 1.00 0.00 H new ATOM 0 HG3 PRO A 805 11.146 10.473 2.793 1.00 0.00 H new ATOM 0 HD2 PRO A 805 13.995 11.022 1.939 1.00 0.00 H new ATOM 0 HD3 PRO A 805 13.280 9.512 2.469 1.00 0.00 H new ATOM 1523 N GLU A 806 13.565 11.599 -1.555 1.00 0.00 N ATOM 1524 CA GLU A 806 14.262 12.363 -2.582 1.00 0.00 C ATOM 1525 C GLU A 806 14.300 11.604 -3.912 1.00 0.00 C ATOM 1526 O GLU A 806 14.449 12.207 -4.974 1.00 0.00 O ATOM 1527 CB GLU A 806 15.685 12.692 -2.125 1.00 0.00 C ATOM 1528 CG GLU A 806 15.739 13.446 -0.806 1.00 0.00 C ATOM 1529 CD GLU A 806 17.153 13.816 -0.403 1.00 0.00 C ATOM 1530 OE1 GLU A 806 17.833 12.974 0.221 1.00 0.00 O ATOM 1531 OE2 GLU A 806 17.581 14.949 -0.710 1.00 0.00 O ATOM 0 H GLU A 806 14.067 10.772 -1.232 1.00 0.00 H new ATOM 0 HA GLU A 806 13.712 13.291 -2.738 1.00 0.00 H new ATOM 0 HB2 GLU A 806 16.250 11.765 -2.028 1.00 0.00 H new ATOM 0 HB3 GLU A 806 16.177 13.287 -2.895 1.00 0.00 H new ATOM 0 HG2 GLU A 806 15.139 14.352 -0.885 1.00 0.00 H new ATOM 0 HG3 GLU A 806 15.291 12.834 -0.023 1.00 0.00 H new ATOM 1538 N SER A 807 14.166 10.281 -3.840 1.00 0.00 N ATOM 1539 CA SER A 807 14.170 9.429 -5.030 1.00 0.00 C ATOM 1540 C SER A 807 12.967 9.722 -5.909 1.00 0.00 C ATOM 1541 O SER A 807 12.385 10.805 -5.847 1.00 0.00 O ATOM 1542 CB SER A 807 14.148 7.975 -4.619 1.00 0.00 C ATOM 1543 OG SER A 807 15.435 7.539 -4.217 1.00 0.00 O ATOM 0 H SER A 807 14.052 9.772 -2.964 1.00 0.00 H new ATOM 0 HA SER A 807 15.077 9.639 -5.597 1.00 0.00 H new ATOM 0 HB2 SER A 807 13.441 7.836 -3.801 1.00 0.00 H new ATOM 0 HB3 SER A 807 13.797 7.364 -5.451 1.00 0.00 H new ATOM 0 HG SER A 807 15.446 6.561 -4.161 1.00 0.00 H new ATOM 1549 N GLU A 808 12.599 8.749 -6.724 1.00 0.00 N ATOM 1550 CA GLU A 808 11.459 8.896 -7.604 1.00 0.00 C ATOM 1551 C GLU A 808 10.265 8.132 -7.052 1.00 0.00 C ATOM 1552 O GLU A 808 9.129 8.605 -7.120 1.00 0.00 O ATOM 1553 CB GLU A 808 11.792 8.374 -8.998 1.00 0.00 C ATOM 1554 CG GLU A 808 13.279 8.302 -9.294 1.00 0.00 C ATOM 1555 CD GLU A 808 13.577 8.260 -10.780 1.00 0.00 C ATOM 1556 OE1 GLU A 808 13.720 9.342 -11.388 1.00 0.00 O ATOM 1557 OE2 GLU A 808 13.668 7.145 -11.336 1.00 0.00 O ATOM 0 H GLU A 808 13.075 7.849 -6.793 1.00 0.00 H new ATOM 0 HA GLU A 808 11.212 9.956 -7.668 1.00 0.00 H new ATOM 0 HB2 GLU A 808 11.361 7.380 -9.115 1.00 0.00 H new ATOM 0 HB3 GLU A 808 11.316 9.017 -9.738 1.00 0.00 H new ATOM 0 HG2 GLU A 808 13.776 9.166 -8.852 1.00 0.00 H new ATOM 0 HG3 GLU A 808 13.698 7.415 -8.818 1.00 0.00 H new ATOM 1564 N TYR A 809 10.527 6.951 -6.494 1.00 0.00 N ATOM 1565 CA TYR A 809 9.453 6.119 -5.957 1.00 0.00 C ATOM 1566 C TYR A 809 8.799 6.671 -4.690 1.00 0.00 C ATOM 1567 O TYR A 809 7.573 6.709 -4.598 1.00 0.00 O ATOM 1568 CB TYR A 809 9.921 4.702 -5.675 1.00 0.00 C ATOM 1569 CG TYR A 809 11.361 4.561 -5.281 1.00 0.00 C ATOM 1570 CD1 TYR A 809 11.991 5.423 -4.414 1.00 0.00 C ATOM 1571 CD2 TYR A 809 12.088 3.533 -5.786 1.00 0.00 C ATOM 1572 CE1 TYR A 809 13.310 5.233 -4.076 1.00 0.00 C ATOM 1573 CE2 TYR A 809 13.379 3.342 -5.456 1.00 0.00 C ATOM 1574 CZ TYR A 809 14.000 4.190 -4.597 1.00 0.00 C ATOM 1575 OH TYR A 809 15.311 3.991 -4.250 1.00 0.00 O ATOM 0 H TYR A 809 11.462 6.553 -6.403 1.00 0.00 H new ATOM 0 HA TYR A 809 8.702 6.122 -6.747 1.00 0.00 H new ATOM 0 HB2 TYR A 809 9.303 4.286 -4.879 1.00 0.00 H new ATOM 0 HB3 TYR A 809 9.745 4.097 -6.564 1.00 0.00 H new ATOM 0 HD1 TYR A 809 11.445 6.256 -3.995 1.00 0.00 H new ATOM 0 HD2 TYR A 809 11.617 2.847 -6.474 1.00 0.00 H new ATOM 0 HE1 TYR A 809 13.796 5.916 -3.395 1.00 0.00 H new ATOM 0 HE2 TYR A 809 13.924 2.510 -5.877 1.00 0.00 H new ATOM 0 HH TYR A 809 15.632 3.156 -4.649 1.00 0.00 H new ATOM 1585 N TYR A 810 9.606 7.096 -3.718 1.00 0.00 N ATOM 1586 CA TYR A 810 9.084 7.564 -2.439 1.00 0.00 C ATOM 1587 C TYR A 810 7.956 8.546 -2.632 1.00 0.00 C ATOM 1588 O TYR A 810 6.840 8.327 -2.164 1.00 0.00 O ATOM 1589 CB TYR A 810 10.183 8.209 -1.608 1.00 0.00 C ATOM 1590 CG TYR A 810 9.856 8.262 -0.137 1.00 0.00 C ATOM 1591 CD1 TYR A 810 8.652 8.773 0.307 1.00 0.00 C ATOM 1592 CD2 TYR A 810 10.752 7.794 0.806 1.00 0.00 C ATOM 1593 CE1 TYR A 810 8.358 8.817 1.650 1.00 0.00 C ATOM 1594 CE2 TYR A 810 10.466 7.835 2.152 1.00 0.00 C ATOM 1595 CZ TYR A 810 9.266 8.349 2.571 1.00 0.00 C ATOM 1596 OH TYR A 810 8.969 8.395 3.913 1.00 0.00 O ATOM 0 H TYR A 810 10.623 7.125 -3.794 1.00 0.00 H new ATOM 0 HA TYR A 810 8.700 6.692 -1.909 1.00 0.00 H new ATOM 0 HB2 TYR A 810 11.110 7.654 -1.749 1.00 0.00 H new ATOM 0 HB3 TYR A 810 10.359 9.221 -1.972 1.00 0.00 H new ATOM 0 HD1 TYR A 810 7.933 9.142 -0.409 1.00 0.00 H new ATOM 0 HD2 TYR A 810 11.698 7.387 0.479 1.00 0.00 H new ATOM 0 HE1 TYR A 810 7.412 9.220 1.982 1.00 0.00 H new ATOM 0 HE2 TYR A 810 11.181 7.465 2.872 1.00 0.00 H new ATOM 0 HH TYR A 810 9.114 7.511 4.311 1.00 0.00 H new ATOM 1606 N LYS A 811 8.254 9.640 -3.292 1.00 0.00 N ATOM 1607 CA LYS A 811 7.244 10.635 -3.559 1.00 0.00 C ATOM 1608 C LYS A 811 6.079 9.948 -4.208 1.00 0.00 C ATOM 1609 O LYS A 811 4.964 10.003 -3.726 1.00 0.00 O ATOM 1610 CB LYS A 811 7.778 11.681 -4.518 1.00 0.00 C ATOM 1611 CG LYS A 811 9.272 11.875 -4.430 1.00 0.00 C ATOM 1612 CD LYS A 811 9.724 12.871 -5.469 1.00 0.00 C ATOM 1613 CE LYS A 811 9.360 14.278 -5.048 1.00 0.00 C ATOM 1614 NZ LYS A 811 10.433 14.910 -4.232 1.00 0.00 N ATOM 0 H LYS A 811 9.182 9.863 -3.652 1.00 0.00 H new ATOM 0 HA LYS A 811 6.952 11.120 -2.627 1.00 0.00 H new ATOM 0 HB2 LYS A 811 7.517 11.395 -5.537 1.00 0.00 H new ATOM 0 HB3 LYS A 811 7.284 12.632 -4.317 1.00 0.00 H new ATOM 0 HG2 LYS A 811 9.544 12.227 -3.435 1.00 0.00 H new ATOM 0 HG3 LYS A 811 9.780 10.923 -4.581 1.00 0.00 H new ATOM 0 HD2 LYS A 811 10.802 12.795 -5.610 1.00 0.00 H new ATOM 0 HD3 LYS A 811 9.260 12.641 -6.428 1.00 0.00 H new ATOM 0 HE2 LYS A 811 9.173 14.885 -5.934 1.00 0.00 H new ATOM 0 HE3 LYS A 811 8.433 14.257 -4.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 811 10.144 15.873 -3.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 811 10.594 14.345 -3.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 811 11.311 14.954 -4.787 1.00 0.00 H new ATOM 1628 N CYS A 812 6.383 9.300 -5.316 1.00 0.00 N ATOM 1629 CA CYS A 812 5.405 8.548 -6.077 1.00 0.00 C ATOM 1630 C CYS A 812 4.515 7.712 -5.163 1.00 0.00 C ATOM 1631 O CYS A 812 3.377 7.419 -5.502 1.00 0.00 O ATOM 1632 CB CYS A 812 6.126 7.643 -7.070 1.00 0.00 C ATOM 1633 SG CYS A 812 6.604 8.462 -8.610 1.00 0.00 S ATOM 0 H CYS A 812 7.321 9.281 -5.716 1.00 0.00 H new ATOM 0 HA CYS A 812 4.767 9.252 -6.612 1.00 0.00 H new ATOM 0 HB2 CYS A 812 7.020 7.240 -6.594 1.00 0.00 H new ATOM 0 HB3 CYS A 812 5.481 6.797 -7.307 1.00 0.00 H new ATOM 0 HG CYS A 812 7.856 8.805 -8.548 1.00 0.00 H new ATOM 1639 N ALA A 813 5.036 7.329 -4.005 1.00 0.00 N ATOM 1640 CA ALA A 813 4.266 6.542 -3.051 1.00 0.00 C ATOM 1641 C ALA A 813 3.248 7.436 -2.367 1.00 0.00 C ATOM 1642 O ALA A 813 2.087 7.085 -2.243 1.00 0.00 O ATOM 1643 CB ALA A 813 5.187 5.879 -2.042 1.00 0.00 C ATOM 0 H ALA A 813 5.985 7.550 -3.704 1.00 0.00 H new ATOM 0 HA ALA A 813 3.735 5.749 -3.578 1.00 0.00 H new ATOM 0 HB1 ALA A 813 4.595 5.295 -1.337 1.00 0.00 H new ATOM 0 HB2 ALA A 813 5.884 5.222 -2.562 1.00 0.00 H new ATOM 0 HB3 ALA A 813 5.745 6.644 -1.501 1.00 0.00 H new ATOM 1649 N ASN A 814 3.718 8.596 -1.937 1.00 0.00 N ATOM 1650 CA ASN A 814 2.898 9.603 -1.295 1.00 0.00 C ATOM 1651 C ASN A 814 1.871 10.140 -2.285 1.00 0.00 C ATOM 1652 O ASN A 814 0.687 10.302 -1.981 1.00 0.00 O ATOM 1653 CB ASN A 814 3.815 10.737 -0.860 1.00 0.00 C ATOM 1654 CG ASN A 814 3.233 11.597 0.249 1.00 0.00 C ATOM 1655 OD1 ASN A 814 1.910 11.709 0.290 1.00 0.00 O flip ATOM 1656 ND2 ASN A 814 3.969 12.154 1.065 1.00 0.00 N flip ATOM 0 H ASN A 814 4.697 8.866 -2.027 1.00 0.00 H new ATOM 0 HA ASN A 814 2.374 9.177 -0.440 1.00 0.00 H new ATOM 0 HB2 ASN A 814 4.763 10.318 -0.524 1.00 0.00 H new ATOM 0 HB3 ASN A 814 4.033 11.368 -1.722 1.00 0.00 H new ATOM 0 HD21 ASN A 814 4.981 12.042 0.999 1.00 0.00 H new ATOM 0 HD22 ASN A 814 3.567 12.727 1.807 1.00 0.00 H new ATOM 1663 N ILE A 815 2.369 10.385 -3.483 1.00 0.00 N ATOM 1664 CA ILE A 815 1.595 10.913 -4.588 1.00 0.00 C ATOM 1665 C ILE A 815 0.510 9.942 -4.973 1.00 0.00 C ATOM 1666 O ILE A 815 -0.670 10.284 -5.010 1.00 0.00 O ATOM 1667 CB ILE A 815 2.510 11.177 -5.780 1.00 0.00 C ATOM 1668 CG1 ILE A 815 3.290 12.453 -5.530 1.00 0.00 C ATOM 1669 CG2 ILE A 815 1.724 11.249 -7.076 1.00 0.00 C ATOM 1670 CD1 ILE A 815 4.639 12.444 -6.168 1.00 0.00 C ATOM 0 H ILE A 815 3.347 10.218 -3.719 1.00 0.00 H new ATOM 0 HA ILE A 815 1.131 11.850 -4.281 1.00 0.00 H new ATOM 0 HB ILE A 815 3.209 10.347 -5.887 1.00 0.00 H new ATOM 0 HG12 ILE A 815 2.720 13.301 -5.909 1.00 0.00 H new ATOM 0 HG13 ILE A 815 3.403 12.599 -4.456 1.00 0.00 H new ATOM 0 HG21 ILE A 815 2.406 11.438 -7.905 1.00 0.00 H new ATOM 0 HG22 ILE A 815 1.206 10.304 -7.240 1.00 0.00 H new ATOM 0 HG23 ILE A 815 0.995 12.057 -7.015 1.00 0.00 H new ATOM 0 HD11 ILE A 815 5.149 13.383 -5.954 1.00 0.00 H new ATOM 0 HD12 ILE A 815 5.224 11.615 -5.770 1.00 0.00 H new ATOM 0 HD13 ILE A 815 4.531 12.328 -7.246 1.00 0.00 H new ATOM 1682 N LEU A 816 0.928 8.733 -5.286 1.00 0.00 N ATOM 1683 CA LEU A 816 -0.001 7.687 -5.624 1.00 0.00 C ATOM 1684 C LEU A 816 -0.980 7.547 -4.485 1.00 0.00 C ATOM 1685 O LEU A 816 -2.183 7.623 -4.670 1.00 0.00 O ATOM 1686 CB LEU A 816 0.742 6.379 -5.835 1.00 0.00 C ATOM 1687 CG LEU A 816 0.077 5.389 -6.759 1.00 0.00 C ATOM 1688 CD1 LEU A 816 0.889 4.133 -6.812 1.00 0.00 C ATOM 1689 CD2 LEU A 816 -1.313 5.121 -6.295 1.00 0.00 C ATOM 0 H LEU A 816 1.909 8.455 -5.312 1.00 0.00 H new ATOM 0 HA LEU A 816 -0.527 7.933 -6.546 1.00 0.00 H new ATOM 0 HB2 LEU A 816 1.733 6.605 -6.228 1.00 0.00 H new ATOM 0 HB3 LEU A 816 0.885 5.903 -4.865 1.00 0.00 H new ATOM 0 HG LEU A 816 0.020 5.801 -7.767 1.00 0.00 H new ATOM 0 HD11 LEU A 816 0.409 3.417 -7.479 1.00 0.00 H new ATOM 0 HD12 LEU A 816 1.888 4.361 -7.183 1.00 0.00 H new ATOM 0 HD13 LEU A 816 0.962 3.704 -5.812 1.00 0.00 H new ATOM 0 HD21 LEU A 816 -1.789 4.406 -6.966 1.00 0.00 H new ATOM 0 HD22 LEU A 816 -1.287 4.710 -5.286 1.00 0.00 H new ATOM 0 HD23 LEU A 816 -1.882 6.051 -6.294 1.00 0.00 H new ATOM 1701 N GLU A 817 -0.431 7.376 -3.296 1.00 0.00 N ATOM 1702 CA GLU A 817 -1.224 7.240 -2.092 1.00 0.00 C ATOM 1703 C GLU A 817 -2.277 8.352 -2.010 1.00 0.00 C ATOM 1704 O GLU A 817 -3.308 8.209 -1.368 1.00 0.00 O ATOM 1705 CB GLU A 817 -0.307 7.301 -0.876 1.00 0.00 C ATOM 1706 CG GLU A 817 -1.001 6.895 0.411 1.00 0.00 C ATOM 1707 CD GLU A 817 -0.069 6.869 1.605 1.00 0.00 C ATOM 1708 OE1 GLU A 817 0.677 5.879 1.756 1.00 0.00 O ATOM 1709 OE2 GLU A 817 -0.089 7.839 2.392 1.00 0.00 O ATOM 0 H GLU A 817 0.576 7.328 -3.140 1.00 0.00 H new ATOM 0 HA GLU A 817 -1.741 6.281 -2.114 1.00 0.00 H new ATOM 0 HB2 GLU A 817 0.550 6.649 -1.041 1.00 0.00 H new ATOM 0 HB3 GLU A 817 0.079 8.315 -0.770 1.00 0.00 H new ATOM 0 HG2 GLU A 817 -1.818 7.588 0.610 1.00 0.00 H new ATOM 0 HG3 GLU A 817 -1.444 5.908 0.282 1.00 0.00 H new ATOM 1716 N LYS A 818 -1.985 9.472 -2.646 1.00 0.00 N ATOM 1717 CA LYS A 818 -2.871 10.604 -2.687 1.00 0.00 C ATOM 1718 C LYS A 818 -3.946 10.420 -3.769 1.00 0.00 C ATOM 1719 O LYS A 818 -5.143 10.508 -3.481 1.00 0.00 O ATOM 1720 CB LYS A 818 -1.982 11.785 -2.903 1.00 0.00 C ATOM 1721 CG LYS A 818 -2.433 12.694 -3.977 1.00 0.00 C ATOM 1722 CD LYS A 818 -1.256 13.437 -4.573 1.00 0.00 C ATOM 1723 CE LYS A 818 -1.273 13.362 -6.087 1.00 0.00 C ATOM 1724 NZ LYS A 818 -2.484 14.005 -6.665 1.00 0.00 N ATOM 0 H LYS A 818 -1.112 9.615 -3.153 1.00 0.00 H new ATOM 0 HA LYS A 818 -3.444 10.734 -1.769 1.00 0.00 H new ATOM 0 HB2 LYS A 818 -1.911 12.348 -1.972 1.00 0.00 H new ATOM 0 HB3 LYS A 818 -0.978 11.432 -3.139 1.00 0.00 H new ATOM 0 HG2 LYS A 818 -2.942 12.124 -4.754 1.00 0.00 H new ATOM 0 HG3 LYS A 818 -3.156 13.406 -3.579 1.00 0.00 H new ATOM 0 HD2 LYS A 818 -1.283 14.480 -4.257 1.00 0.00 H new ATOM 0 HD3 LYS A 818 -0.325 13.013 -4.195 1.00 0.00 H new ATOM 0 HE2 LYS A 818 -0.381 13.847 -6.484 1.00 0.00 H new ATOM 0 HE3 LYS A 818 -1.234 12.318 -6.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 818 -2.407 14.022 -7.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 818 -3.329 13.465 -6.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 818 -2.564 14.979 -6.308 1.00 0.00 H new ATOM 1738 N PHE A 819 -3.522 10.163 -5.010 1.00 0.00 N ATOM 1739 CA PHE A 819 -4.468 9.918 -6.098 1.00 0.00 C ATOM 1740 C PHE A 819 -5.363 8.783 -5.660 1.00 0.00 C ATOM 1741 O PHE A 819 -6.588 8.892 -5.646 1.00 0.00 O ATOM 1742 CB PHE A 819 -3.703 9.542 -7.372 1.00 0.00 C ATOM 1743 CG PHE A 819 -4.504 8.789 -8.412 1.00 0.00 C ATOM 1744 CD1 PHE A 819 -4.859 7.458 -8.216 1.00 0.00 C ATOM 1745 CD2 PHE A 819 -4.873 9.401 -9.598 1.00 0.00 C ATOM 1746 CE1 PHE A 819 -5.559 6.762 -9.163 1.00 0.00 C ATOM 1747 CE2 PHE A 819 -5.585 8.706 -10.558 1.00 0.00 C ATOM 1748 CZ PHE A 819 -5.927 7.385 -10.342 1.00 0.00 C ATOM 0 H PHE A 819 -2.540 10.120 -5.283 1.00 0.00 H new ATOM 0 HA PHE A 819 -5.061 10.806 -6.315 1.00 0.00 H new ATOM 0 HB2 PHE A 819 -3.317 10.455 -7.826 1.00 0.00 H new ATOM 0 HB3 PHE A 819 -2.841 8.936 -7.092 1.00 0.00 H new ATOM 0 HD1 PHE A 819 -4.576 6.965 -7.298 1.00 0.00 H new ATOM 0 HD2 PHE A 819 -4.602 10.431 -9.775 1.00 0.00 H new ATOM 0 HE1 PHE A 819 -5.824 5.729 -8.991 1.00 0.00 H new ATOM 0 HE2 PHE A 819 -5.874 9.196 -11.476 1.00 0.00 H new ATOM 0 HZ PHE A 819 -6.481 6.840 -11.092 1.00 0.00 H new ATOM 1758 N PHE A 820 -4.703 7.682 -5.333 1.00 0.00 N ATOM 1759 CA PHE A 820 -5.350 6.503 -4.817 1.00 0.00 C ATOM 1760 C PHE A 820 -6.347 6.929 -3.766 1.00 0.00 C ATOM 1761 O PHE A 820 -7.506 6.575 -3.862 1.00 0.00 O ATOM 1762 CB PHE A 820 -4.271 5.551 -4.306 1.00 0.00 C ATOM 1763 CG PHE A 820 -4.505 4.881 -3.004 1.00 0.00 C ATOM 1764 CD1 PHE A 820 -4.091 5.415 -1.810 1.00 0.00 C ATOM 1765 CD2 PHE A 820 -5.062 3.663 -3.006 1.00 0.00 C ATOM 1766 CE1 PHE A 820 -4.268 4.713 -0.633 1.00 0.00 C ATOM 1767 CE2 PHE A 820 -5.229 2.950 -1.869 1.00 0.00 C ATOM 1768 CZ PHE A 820 -4.841 3.465 -0.671 1.00 0.00 C ATOM 0 H PHE A 820 -3.691 7.589 -5.423 1.00 0.00 H new ATOM 0 HA PHE A 820 -5.911 5.962 -5.579 1.00 0.00 H new ATOM 0 HB2 PHE A 820 -4.122 4.778 -5.059 1.00 0.00 H new ATOM 0 HB3 PHE A 820 -3.338 6.109 -4.233 1.00 0.00 H new ATOM 0 HD1 PHE A 820 -3.624 6.389 -1.790 1.00 0.00 H new ATOM 0 HD2 PHE A 820 -5.388 3.237 -3.944 1.00 0.00 H new ATOM 0 HE1 PHE A 820 -3.959 5.142 0.309 1.00 0.00 H new ATOM 0 HE2 PHE A 820 -5.673 1.966 -1.912 1.00 0.00 H new ATOM 0 HZ PHE A 820 -4.982 2.900 0.239 1.00 0.00 H new ATOM 1778 N PHE A 821 -5.917 7.781 -2.829 1.00 0.00 N ATOM 1779 CA PHE A 821 -6.814 8.253 -1.779 1.00 0.00 C ATOM 1780 C PHE A 821 -8.097 8.842 -2.329 1.00 0.00 C ATOM 1781 O PHE A 821 -9.145 8.709 -1.711 1.00 0.00 O ATOM 1782 CB PHE A 821 -6.116 9.227 -0.845 1.00 0.00 C ATOM 1783 CG PHE A 821 -5.913 8.608 0.496 1.00 0.00 C ATOM 1784 CD1 PHE A 821 -5.210 7.443 0.556 1.00 0.00 C ATOM 1785 CD2 PHE A 821 -6.465 9.124 1.655 1.00 0.00 C ATOM 1786 CE1 PHE A 821 -5.030 6.768 1.738 1.00 0.00 C ATOM 1787 CE2 PHE A 821 -6.285 8.470 2.863 1.00 0.00 C ATOM 1788 CZ PHE A 821 -5.566 7.283 2.905 1.00 0.00 C ATOM 0 H PHE A 821 -4.968 8.151 -2.779 1.00 0.00 H new ATOM 0 HA PHE A 821 -7.096 7.375 -1.198 1.00 0.00 H new ATOM 0 HB2 PHE A 821 -5.154 9.519 -1.267 1.00 0.00 H new ATOM 0 HB3 PHE A 821 -6.710 10.136 -0.747 1.00 0.00 H new ATOM 0 HD1 PHE A 821 -4.783 7.039 -0.350 1.00 0.00 H new ATOM 0 HD2 PHE A 821 -7.038 10.039 1.618 1.00 0.00 H new ATOM 0 HE1 PHE A 821 -4.474 5.842 1.757 1.00 0.00 H new ATOM 0 HE2 PHE A 821 -6.703 8.882 3.770 1.00 0.00 H new ATOM 0 HZ PHE A 821 -5.426 6.765 3.842 1.00 0.00 H new ATOM 1798 N SER A 822 -8.026 9.485 -3.482 1.00 0.00 N ATOM 1799 CA SER A 822 -9.224 10.050 -4.088 1.00 0.00 C ATOM 1800 C SER A 822 -10.033 8.950 -4.770 1.00 0.00 C ATOM 1801 O SER A 822 -11.247 9.057 -4.909 1.00 0.00 O ATOM 1802 CB SER A 822 -8.860 11.142 -5.095 1.00 0.00 C ATOM 1803 OG SER A 822 -10.021 11.726 -5.659 1.00 0.00 O ATOM 0 H SER A 822 -7.167 9.629 -4.012 1.00 0.00 H new ATOM 0 HA SER A 822 -9.829 10.500 -3.301 1.00 0.00 H new ATOM 0 HB2 SER A 822 -8.265 11.911 -4.602 1.00 0.00 H new ATOM 0 HB3 SER A 822 -8.241 10.719 -5.886 1.00 0.00 H new ATOM 0 HG SER A 822 -9.760 12.422 -6.298 1.00 0.00 H new ATOM 1809 N LYS A 823 -9.339 7.896 -5.190 1.00 0.00 N ATOM 1810 CA LYS A 823 -9.969 6.749 -5.841 1.00 0.00 C ATOM 1811 C LYS A 823 -10.738 5.945 -4.818 1.00 0.00 C ATOM 1812 O LYS A 823 -11.943 5.749 -4.943 1.00 0.00 O ATOM 1813 CB LYS A 823 -8.889 5.897 -6.506 1.00 0.00 C ATOM 1814 CG LYS A 823 -8.891 5.902 -8.026 1.00 0.00 C ATOM 1815 CD LYS A 823 -9.739 7.017 -8.592 1.00 0.00 C ATOM 1816 CE LYS A 823 -9.207 7.523 -9.910 1.00 0.00 C ATOM 1817 NZ LYS A 823 -10.255 8.212 -10.711 1.00 0.00 N ATOM 0 H LYS A 823 -8.327 7.812 -5.090 1.00 0.00 H new ATOM 0 HA LYS A 823 -10.669 7.088 -6.605 1.00 0.00 H new ATOM 0 HB2 LYS A 823 -7.915 6.243 -6.161 1.00 0.00 H new ATOM 0 HB3 LYS A 823 -9.001 4.868 -6.164 1.00 0.00 H new ATOM 0 HG2 LYS A 823 -7.868 6.006 -8.389 1.00 0.00 H new ATOM 0 HG3 LYS A 823 -9.263 4.944 -8.390 1.00 0.00 H new ATOM 0 HD2 LYS A 823 -10.761 6.662 -8.726 1.00 0.00 H new ATOM 0 HD3 LYS A 823 -9.779 7.840 -7.878 1.00 0.00 H new ATOM 0 HE2 LYS A 823 -8.381 8.211 -9.727 1.00 0.00 H new ATOM 0 HE3 LYS A 823 -8.805 6.687 -10.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 823 -9.879 8.438 -11.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 823 -11.083 7.590 -10.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 823 -10.537 9.091 -10.231 1.00 0.00 H new ATOM 1831 N ILE A 824 -10.031 5.469 -3.815 1.00 0.00 N ATOM 1832 CA ILE A 824 -10.660 4.741 -2.733 1.00 0.00 C ATOM 1833 C ILE A 824 -11.820 5.568 -2.202 1.00 0.00 C ATOM 1834 O ILE A 824 -12.934 5.086 -2.037 1.00 0.00 O ATOM 1835 CB ILE A 824 -9.677 4.500 -1.603 1.00 0.00 C ATOM 1836 CG1 ILE A 824 -8.624 5.546 -1.629 1.00 0.00 C ATOM 1837 CG2 ILE A 824 -9.050 3.138 -1.715 1.00 0.00 C ATOM 1838 CD1 ILE A 824 -7.478 5.268 -0.727 1.00 0.00 C ATOM 0 H ILE A 824 -9.020 5.573 -3.726 1.00 0.00 H new ATOM 0 HA ILE A 824 -11.006 3.778 -3.109 1.00 0.00 H new ATOM 0 HB ILE A 824 -10.217 4.548 -0.658 1.00 0.00 H new ATOM 0 HG12 ILE A 824 -8.254 5.650 -2.649 1.00 0.00 H new ATOM 0 HG13 ILE A 824 -9.068 6.502 -1.352 1.00 0.00 H new ATOM 0 HG21 ILE A 824 -8.350 2.991 -0.893 1.00 0.00 H new ATOM 0 HG22 ILE A 824 -9.827 2.375 -1.670 1.00 0.00 H new ATOM 0 HG23 ILE A 824 -8.518 3.059 -2.663 1.00 0.00 H new ATOM 0 HD11 ILE A 824 -6.751 6.077 -0.802 1.00 0.00 H new ATOM 0 HD12 ILE A 824 -7.834 5.194 0.301 1.00 0.00 H new ATOM 0 HD13 ILE A 824 -7.007 4.329 -1.016 1.00 0.00 H new ATOM 1850 N LYS A 825 -11.524 6.845 -1.987 1.00 0.00 N ATOM 1851 CA LYS A 825 -12.494 7.814 -1.480 1.00 0.00 C ATOM 1852 C LYS A 825 -13.754 7.758 -2.314 1.00 0.00 C ATOM 1853 O LYS A 825 -14.868 7.613 -1.813 1.00 0.00 O ATOM 1854 CB LYS A 825 -11.928 9.237 -1.591 1.00 0.00 C ATOM 1855 CG LYS A 825 -11.512 9.877 -0.276 1.00 0.00 C ATOM 1856 CD LYS A 825 -12.668 10.580 0.398 1.00 0.00 C ATOM 1857 CE LYS A 825 -13.493 9.604 1.209 1.00 0.00 C ATOM 1858 NZ LYS A 825 -12.815 9.222 2.479 1.00 0.00 N ATOM 0 H LYS A 825 -10.600 7.241 -2.160 1.00 0.00 H new ATOM 0 HA LYS A 825 -12.707 7.571 -0.439 1.00 0.00 H new ATOM 0 HB2 LYS A 825 -11.064 9.215 -2.255 1.00 0.00 H new ATOM 0 HB3 LYS A 825 -12.677 9.872 -2.064 1.00 0.00 H new ATOM 0 HG2 LYS A 825 -11.114 9.112 0.390 1.00 0.00 H new ATOM 0 HG3 LYS A 825 -10.709 10.591 -0.458 1.00 0.00 H new ATOM 0 HD2 LYS A 825 -12.290 11.370 1.047 1.00 0.00 H new ATOM 0 HD3 LYS A 825 -13.297 11.058 -0.353 1.00 0.00 H new ATOM 0 HE2 LYS A 825 -14.462 10.049 1.435 1.00 0.00 H new ATOM 0 HE3 LYS A 825 -13.683 8.709 0.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 825 -13.525 8.908 3.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 825 -12.144 8.449 2.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 825 -12.301 10.043 2.859 1.00 0.00 H new ATOM 1872 N GLU A 826 -13.526 7.879 -3.609 1.00 0.00 N ATOM 1873 CA GLU A 826 -14.577 7.880 -4.605 1.00 0.00 C ATOM 1874 C GLU A 826 -15.333 6.569 -4.603 1.00 0.00 C ATOM 1875 O GLU A 826 -16.536 6.525 -4.858 1.00 0.00 O ATOM 1876 CB GLU A 826 -13.942 8.115 -5.981 1.00 0.00 C ATOM 1877 CG GLU A 826 -13.828 6.863 -6.834 1.00 0.00 C ATOM 1878 CD GLU A 826 -15.119 6.512 -7.550 1.00 0.00 C ATOM 1879 OE1 GLU A 826 -15.578 7.326 -8.380 1.00 0.00 O ATOM 1880 OE2 GLU A 826 -15.671 5.424 -7.281 1.00 0.00 O ATOM 0 H GLU A 826 -12.590 7.981 -4.002 1.00 0.00 H new ATOM 0 HA GLU A 826 -15.288 8.673 -4.374 1.00 0.00 H new ATOM 0 HB2 GLU A 826 -14.532 8.856 -6.520 1.00 0.00 H new ATOM 0 HB3 GLU A 826 -12.947 8.539 -5.843 1.00 0.00 H new ATOM 0 HG2 GLU A 826 -13.037 7.003 -7.571 1.00 0.00 H new ATOM 0 HG3 GLU A 826 -13.530 6.026 -6.202 1.00 0.00 H new ATOM 1887 N ALA A 827 -14.613 5.506 -4.311 1.00 0.00 N ATOM 1888 CA ALA A 827 -15.183 4.184 -4.324 1.00 0.00 C ATOM 1889 C ALA A 827 -15.668 3.726 -2.956 1.00 0.00 C ATOM 1890 O ALA A 827 -15.794 2.534 -2.721 1.00 0.00 O ATOM 1891 CB ALA A 827 -14.157 3.228 -4.875 1.00 0.00 C ATOM 0 H ALA A 827 -13.625 5.538 -4.061 1.00 0.00 H new ATOM 0 HA ALA A 827 -16.069 4.204 -4.958 1.00 0.00 H new ATOM 0 HB1 ALA A 827 -14.571 2.220 -4.893 1.00 0.00 H new ATOM 0 HB2 ALA A 827 -13.888 3.527 -5.888 1.00 0.00 H new ATOM 0 HB3 ALA A 827 -13.269 3.244 -4.244 1.00 0.00 H new ATOM 1897 N GLY A 828 -15.944 4.663 -2.060 1.00 0.00 N ATOM 1898 CA GLY A 828 -16.424 4.293 -0.737 1.00 0.00 C ATOM 1899 C GLY A 828 -15.460 3.395 0.008 1.00 0.00 C ATOM 1900 O GLY A 828 -15.874 2.609 0.856 1.00 0.00 O ATOM 0 H GLY A 828 -15.846 5.666 -2.220 1.00 0.00 H new ATOM 0 HA2 GLY A 828 -16.597 5.197 -0.153 1.00 0.00 H new ATOM 0 HA3 GLY A 828 -17.385 3.787 -0.833 1.00 0.00 H new ATOM 1904 N LEU A 829 -14.179 3.531 -0.288 1.00 0.00 N ATOM 1905 CA LEU A 829 -13.154 2.709 0.321 1.00 0.00 C ATOM 1906 C LEU A 829 -12.768 3.264 1.678 1.00 0.00 C ATOM 1907 O LEU A 829 -13.572 3.224 2.604 1.00 0.00 O ATOM 1908 CB LEU A 829 -11.977 2.638 -0.647 1.00 0.00 C ATOM 1909 CG LEU A 829 -12.351 2.016 -2.002 1.00 0.00 C ATOM 1910 CD1 LEU A 829 -11.192 1.346 -2.671 1.00 0.00 C ATOM 1911 CD2 LEU A 829 -13.486 1.012 -1.861 1.00 0.00 C ATOM 0 H LEU A 829 -13.823 4.214 -0.957 1.00 0.00 H new ATOM 0 HA LEU A 829 -13.517 1.698 0.503 1.00 0.00 H new ATOM 0 HB2 LEU A 829 -11.586 3.643 -0.810 1.00 0.00 H new ATOM 0 HB3 LEU A 829 -11.176 2.054 -0.194 1.00 0.00 H new ATOM 0 HG LEU A 829 -12.673 2.849 -2.627 1.00 0.00 H new ATOM 0 HD11 LEU A 829 -11.515 0.925 -3.623 1.00 0.00 H new ATOM 0 HD12 LEU A 829 -10.402 2.076 -2.846 1.00 0.00 H new ATOM 0 HD13 LEU A 829 -10.814 0.548 -2.031 1.00 0.00 H new ATOM 0 HD21 LEU A 829 -13.724 0.592 -2.838 1.00 0.00 H new ATOM 0 HD22 LEU A 829 -13.182 0.211 -1.187 1.00 0.00 H new ATOM 0 HD23 LEU A 829 -14.366 1.512 -1.457 1.00 0.00 H new ATOM 1923 N ILE A 830 -11.558 3.802 1.768 1.00 0.00 N ATOM 1924 CA ILE A 830 -11.033 4.398 2.984 1.00 0.00 C ATOM 1925 C ILE A 830 -11.958 4.224 4.203 1.00 0.00 C ATOM 1926 O ILE A 830 -12.227 3.092 4.608 1.00 0.00 O ATOM 1927 CB ILE A 830 -10.726 5.856 2.674 1.00 0.00 C ATOM 1928 CG1 ILE A 830 -10.680 6.004 1.169 1.00 0.00 C ATOM 1929 CG2 ILE A 830 -9.387 6.242 3.243 1.00 0.00 C ATOM 1930 CD1 ILE A 830 -9.912 7.193 0.701 1.00 0.00 C ATOM 0 H ILE A 830 -10.906 3.836 0.984 1.00 0.00 H new ATOM 0 HA ILE A 830 -10.123 3.878 3.283 1.00 0.00 H new ATOM 0 HB ILE A 830 -11.490 6.498 3.113 1.00 0.00 H new ATOM 0 HG12 ILE A 830 -10.237 5.106 0.739 1.00 0.00 H new ATOM 0 HG13 ILE A 830 -11.700 6.070 0.789 1.00 0.00 H new ATOM 0 HG21 ILE A 830 -9.182 7.287 3.013 1.00 0.00 H new ATOM 0 HG22 ILE A 830 -9.397 6.104 4.324 1.00 0.00 H new ATOM 0 HG23 ILE A 830 -8.611 5.615 2.804 1.00 0.00 H new ATOM 0 HD11 ILE A 830 -9.925 7.229 -0.388 1.00 0.00 H new ATOM 0 HD12 ILE A 830 -10.367 8.100 1.100 1.00 0.00 H new ATOM 0 HD13 ILE A 830 -8.882 7.121 1.049 1.00 0.00 H new ATOM 1942 N ASP A 831 -12.402 5.326 4.816 1.00 0.00 N ATOM 1943 CA ASP A 831 -13.309 5.271 5.957 1.00 0.00 C ATOM 1944 C ASP A 831 -12.616 4.779 7.228 1.00 0.00 C ATOM 1945 O ASP A 831 -13.075 5.062 8.335 1.00 0.00 O ATOM 1946 CB ASP A 831 -14.522 4.388 5.645 1.00 0.00 C ATOM 1947 CG ASP A 831 -15.524 4.359 6.782 1.00 0.00 C ATOM 1948 OD1 ASP A 831 -16.415 5.232 6.809 1.00 0.00 O ATOM 1949 OD2 ASP A 831 -15.418 3.461 7.644 1.00 0.00 O ATOM 0 H ASP A 831 -12.143 6.272 4.535 1.00 0.00 H new ATOM 0 HA ASP A 831 -13.645 6.291 6.140 1.00 0.00 H new ATOM 0 HB2 ASP A 831 -15.011 4.754 4.742 1.00 0.00 H new ATOM 0 HB3 ASP A 831 -14.185 3.373 5.436 1.00 0.00 H new ATOM 1954 N LYS A 832 -11.514 4.045 7.075 1.00 0.00 N ATOM 1955 CA LYS A 832 -10.786 3.525 8.228 1.00 0.00 C ATOM 1956 C LYS A 832 -10.323 4.659 9.143 1.00 0.00 C ATOM 1957 O LYS A 832 -10.941 4.840 10.213 1.00 0.00 O ATOM 1958 CB LYS A 832 -9.587 2.679 7.781 1.00 0.00 C ATOM 1959 CG LYS A 832 -8.686 3.361 6.761 1.00 0.00 C ATOM 1960 CD LYS A 832 -7.307 2.716 6.717 1.00 0.00 C ATOM 1961 CE LYS A 832 -7.379 1.260 6.283 1.00 0.00 C ATOM 1962 NZ LYS A 832 -6.047 0.596 6.341 1.00 0.00 N ATOM 1963 OXT LYS A 832 -9.355 5.361 8.782 1.00 0.00 O ATOM 0 H LYS A 832 -11.110 3.800 6.171 1.00 0.00 H new ATOM 0 HA LYS A 832 -11.468 2.888 8.791 1.00 0.00 H new ATOM 0 HB2 LYS A 832 -8.993 2.420 8.657 1.00 0.00 H new ATOM 0 HB3 LYS A 832 -9.954 1.744 7.357 1.00 0.00 H new ATOM 0 HG2 LYS A 832 -9.146 3.308 5.774 1.00 0.00 H new ATOM 0 HG3 LYS A 832 -8.587 4.418 7.010 1.00 0.00 H new ATOM 0 HD2 LYS A 832 -6.668 3.270 6.029 1.00 0.00 H new ATOM 0 HD3 LYS A 832 -6.844 2.779 7.702 1.00 0.00 H new ATOM 0 HE2 LYS A 832 -8.080 0.725 6.924 1.00 0.00 H new ATOM 0 HE3 LYS A 832 -7.769 1.203 5.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 832 -6.139 -0.394 6.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 832 -5.385 1.091 5.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 832 -5.686 0.627 7.316 1.00 0.00 H new TER 1977 LYS A 832 ATOM 1978 N SER B 31 11.065 0.238 -20.821 1.00 0.00 N ATOM 1979 CA SER B 31 10.967 1.624 -20.300 1.00 0.00 C ATOM 1980 C SER B 31 9.785 1.765 -19.345 1.00 0.00 C ATOM 1981 O SER B 31 8.766 2.367 -19.685 1.00 0.00 O ATOM 1982 CB SER B 31 10.820 2.614 -21.459 1.00 0.00 C ATOM 1983 OG SER B 31 9.680 2.315 -22.245 1.00 0.00 O ATOM 0 HA SER B 31 11.882 1.846 -19.751 1.00 0.00 H new ATOM 0 HB2 SER B 31 10.739 3.628 -21.067 1.00 0.00 H new ATOM 0 HB3 SER B 31 11.713 2.584 -22.083 1.00 0.00 H new ATOM 0 HG SER B 31 8.921 2.117 -21.658 1.00 0.00 H new ATOM 1991 N THR B 32 9.929 1.204 -18.148 1.00 0.00 N ATOM 1992 CA THR B 32 8.876 1.268 -17.142 1.00 0.00 C ATOM 1993 C THR B 32 9.431 1.732 -15.800 1.00 0.00 C ATOM 1994 O THR B 32 8.729 2.368 -15.012 1.00 0.00 O ATOM 1995 CB THR B 32 8.192 -0.100 -16.956 1.00 0.00 C ATOM 1996 OG1 THR B 32 7.158 -0.001 -15.969 1.00 0.00 O ATOM 1997 CG2 THR B 32 9.200 -1.160 -16.535 1.00 0.00 C ATOM 0 H THR B 32 10.765 0.700 -17.852 1.00 0.00 H new ATOM 0 HA THR B 32 8.139 1.988 -17.499 1.00 0.00 H new ATOM 0 HB THR B 32 7.757 -0.395 -17.911 1.00 0.00 H new ATOM 0 HG1 THR B 32 6.727 -0.874 -15.858 1.00 0.00 H new ATOM 0 HG21 THR B 32 8.692 -2.116 -16.410 1.00 0.00 H new ATOM 0 HG22 THR B 32 9.969 -1.255 -17.301 1.00 0.00 H new ATOM 0 HG23 THR B 32 9.662 -0.869 -15.591 1.00 0.00 H new ATOM 2005 N GLY B 33 10.697 1.412 -15.548 1.00 0.00 N ATOM 2006 CA GLY B 33 11.331 1.804 -14.304 1.00 0.00 C ATOM 2007 C GLY B 33 12.632 1.067 -14.062 1.00 0.00 C ATOM 2008 O GLY B 33 12.685 0.139 -13.253 1.00 0.00 O ATOM 0 H GLY B 33 11.295 0.887 -16.186 1.00 0.00 H new ATOM 0 HA2 GLY B 33 11.522 2.877 -14.319 1.00 0.00 H new ATOM 0 HA3 GLY B 33 10.649 1.613 -13.476 1.00 0.00 H new ATOM 2012 N GLY B 34 13.681 1.478 -14.767 1.00 0.00 N ATOM 2013 CA GLY B 34 14.976 0.842 -14.605 1.00 0.00 C ATOM 2014 C GLY B 34 15.448 0.868 -13.167 1.00 0.00 C ATOM 2015 O GLY B 34 15.202 1.839 -12.452 1.00 0.00 O ATOM 0 H GLY B 34 13.658 2.239 -15.446 1.00 0.00 H new ATOM 0 HA2 GLY B 34 14.917 -0.191 -14.948 1.00 0.00 H new ATOM 0 HA3 GLY B 34 15.708 1.346 -15.236 1.00 0.00 H new ATOM 2019 N VAL B 35 16.116 -0.208 -12.748 1.00 0.00 N ATOM 2020 CA VAL B 35 16.638 -0.334 -11.384 1.00 0.00 C ATOM 2021 C VAL B 35 15.590 0.036 -10.336 1.00 0.00 C ATOM 2022 O VAL B 35 14.421 0.256 -10.653 1.00 0.00 O ATOM 2023 CB VAL B 35 17.900 0.537 -11.166 1.00 0.00 C ATOM 2024 CG1 VAL B 35 18.850 0.402 -12.347 1.00 0.00 C ATOM 2025 CG2 VAL B 35 17.542 2.004 -10.928 1.00 0.00 C ATOM 0 H VAL B 35 16.311 -1.015 -13.341 1.00 0.00 H new ATOM 0 HA VAL B 35 16.906 -1.383 -11.262 1.00 0.00 H new ATOM 0 HB VAL B 35 18.401 0.173 -10.269 1.00 0.00 H new ATOM 0 HG11 VAL B 35 19.731 1.020 -12.178 1.00 0.00 H new ATOM 0 HG12 VAL B 35 19.153 -0.640 -12.453 1.00 0.00 H new ATOM 0 HG13 VAL B 35 18.347 0.728 -13.257 1.00 0.00 H new ATOM 0 HG21 VAL B 35 18.454 2.582 -10.779 1.00 0.00 H new ATOM 0 HG22 VAL B 35 17.004 2.392 -11.793 1.00 0.00 H new ATOM 0 HG23 VAL B 35 16.913 2.086 -10.042 1.00 0.00 H new HETATM 2035 OH ALY B 36 10.007 1.828 -4.348 1.00 0.00 O HETATM 2036 CH ALY B 36 9.961 0.713 -4.860 1.00 0.00 C HETATM 2037 CH3 ALY B 36 8.626 -0.045 -4.848 1.00 0.00 C HETATM 2038 NZ ALY B 36 10.996 0.206 -5.530 1.00 0.00 N HETATM 2039 CE ALY B 36 11.354 -1.213 -5.532 1.00 0.00 C HETATM 2040 CD ALY B 36 12.547 -1.506 -6.425 1.00 0.00 C HETATM 2041 CG ALY B 36 13.652 -0.549 -6.174 1.00 0.00 C HETATM 2042 CB ALY B 36 14.751 -0.799 -7.159 1.00 0.00 C HETATM 2043 CA ALY B 36 15.137 0.439 -7.983 1.00 0.00 C HETATM 2044 N ALY B 36 16.019 0.078 -9.081 1.00 0.00 N HETATM 2045 C ALY B 36 15.801 1.500 -7.119 1.00 0.00 C HETATM 2046 O ALY B 36 15.732 1.458 -5.889 1.00 0.00 O HETATM 0 HH33 ALY B 36 8.304 -0.199 -3.818 1.00 0.00 H new HETATM 0 HH32 ALY B 36 7.873 0.536 -5.380 1.00 0.00 H new HETATM 0 HH31 ALY B 36 8.752 -1.011 -5.337 1.00 0.00 H new HETATM 0 HZ ALY B 36 11.574 0.846 -6.075 1.00 0.00 H new HETATM 0 HG3 ALY B 36 14.026 -0.665 -5.157 1.00 0.00 H new HETATM 0 HG2 ALY B 36 13.290 0.475 -6.266 1.00 0.00 H new HETATM 0 HE3 ALY B 36 10.499 -1.800 -5.867 1.00 0.00 H new HETATM 0 HE2 ALY B 36 11.579 -1.530 -4.514 1.00 0.00 H new HETATM 0 HD3 ALY B 36 12.244 -1.450 -7.471 1.00 0.00 H new HETATM 0 HD2 ALY B 36 12.896 -2.523 -6.248 1.00 0.00 H new HETATM 0 HCA ALY B 36 14.215 0.854 -8.390 1.00 0.00 H new HETATM 0 HB3 ALY B 36 14.444 -1.595 -7.838 1.00 0.00 H new HETATM 0 HB2 ALY B 36 15.631 -1.157 -6.625 1.00 0.00 H new ATOM 2061 N LYS B 37 16.454 2.451 -7.801 1.00 0.00 N ATOM 2062 CA LYS B 37 17.174 3.541 -7.146 1.00 0.00 C ATOM 2063 C LYS B 37 17.781 3.066 -5.829 1.00 0.00 C ATOM 2064 O LYS B 37 17.609 3.710 -4.798 1.00 0.00 O ATOM 2065 CB LYS B 37 16.241 4.739 -6.916 1.00 0.00 C ATOM 2066 CG LYS B 37 16.555 5.935 -7.800 1.00 0.00 C ATOM 2067 CD LYS B 37 17.579 6.853 -7.153 1.00 0.00 C ATOM 2068 CE LYS B 37 18.000 7.972 -8.092 1.00 0.00 C ATOM 2069 NZ LYS B 37 18.994 8.883 -7.461 1.00 0.00 N ATOM 0 H LYS B 37 16.495 2.482 -8.820 1.00 0.00 H new ATOM 0 HA LYS B 37 17.986 3.861 -7.799 1.00 0.00 H new ATOM 0 HB2 LYS B 37 15.212 4.427 -7.094 1.00 0.00 H new ATOM 0 HB3 LYS B 37 16.305 5.043 -5.871 1.00 0.00 H new ATOM 0 HG2 LYS B 37 16.932 5.588 -8.762 1.00 0.00 H new ATOM 0 HG3 LYS B 37 15.639 6.492 -7.999 1.00 0.00 H new ATOM 0 HD2 LYS B 37 17.161 7.280 -6.241 1.00 0.00 H new ATOM 0 HD3 LYS B 37 18.455 6.274 -6.861 1.00 0.00 H new ATOM 0 HE2 LYS B 37 18.425 7.543 -8.999 1.00 0.00 H new ATOM 0 HE3 LYS B 37 17.122 8.544 -8.391 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 19.255 9.632 -8.134 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 18.580 9.312 -6.609 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 19.843 8.342 -7.199 1.00 0.00 H new ATOM 2083 N PRO B 38 18.536 1.942 -5.863 1.00 0.00 N ATOM 2084 CA PRO B 38 19.146 1.344 -4.682 1.00 0.00 C ATOM 2085 C PRO B 38 19.412 2.351 -3.563 1.00 0.00 C ATOM 2086 O PRO B 38 20.452 3.008 -3.544 1.00 0.00 O ATOM 2087 CB PRO B 38 20.455 0.823 -5.261 1.00 0.00 C ATOM 2088 CG PRO B 38 20.071 0.320 -6.611 1.00 0.00 C ATOM 2089 CD PRO B 38 18.919 1.185 -7.075 1.00 0.00 C ATOM 0 HA PRO B 38 18.512 0.594 -4.209 1.00 0.00 H new ATOM 0 HB2 PRO B 38 21.205 1.611 -5.326 1.00 0.00 H new ATOM 0 HB3 PRO B 38 20.878 0.030 -4.644 1.00 0.00 H new ATOM 0 HG2 PRO B 38 20.910 0.386 -7.304 1.00 0.00 H new ATOM 0 HG3 PRO B 38 19.776 -0.728 -6.566 1.00 0.00 H new ATOM 0 HD2 PRO B 38 19.219 1.851 -7.884 1.00 0.00 H new ATOM 0 HD3 PRO B 38 18.091 0.582 -7.449 1.00 0.00 H new ATOM 2097 N HIS B 39 18.462 2.466 -2.639 1.00 0.00 N ATOM 2098 CA HIS B 39 18.590 3.393 -1.520 1.00 0.00 C ATOM 2099 C HIS B 39 19.840 3.081 -0.700 1.00 0.00 C ATOM 2100 O HIS B 39 20.926 3.573 -1.005 1.00 0.00 O ATOM 2101 CB HIS B 39 17.337 3.336 -0.634 1.00 0.00 C ATOM 2102 CG HIS B 39 17.403 4.218 0.585 1.00 0.00 C ATOM 2103 ND1 HIS B 39 18.277 4.002 1.634 1.00 0.00 N ATOM 2104 CD2 HIS B 39 16.695 5.318 0.922 1.00 0.00 C ATOM 2105 CE1 HIS B 39 18.101 4.931 2.555 1.00 0.00 C ATOM 2106 NE2 HIS B 39 17.147 5.742 2.146 1.00 0.00 N ATOM 0 H HIS B 39 17.595 1.928 -2.644 1.00 0.00 H new ATOM 0 HA HIS B 39 18.688 4.403 -1.919 1.00 0.00 H new ATOM 0 HB2 HIS B 39 16.471 3.623 -1.230 1.00 0.00 H new ATOM 0 HB3 HIS B 39 17.177 2.306 -0.315 1.00 0.00 H new ATOM 0 HD2 HIS B 39 15.915 5.780 0.335 1.00 0.00 H new ATOM 0 HE1 HIS B 39 18.646 5.012 3.484 1.00 0.00 H new ATOM 0 HE2 HIS B 39 16.800 6.554 2.657 1.00 0.00 H new ATOM 2115 N ARG B 40 19.674 2.240 0.323 1.00 0.00 N ATOM 2116 CA ARG B 40 20.767 1.846 1.210 1.00 0.00 C ATOM 2117 C ARG B 40 20.210 1.118 2.429 1.00 0.00 C ATOM 2118 O ARG B 40 20.952 0.477 3.172 1.00 0.00 O ATOM 2119 CB ARG B 40 21.572 3.066 1.676 1.00 0.00 C ATOM 2120 CG ARG B 40 22.838 2.707 2.435 1.00 0.00 C ATOM 2121 CD ARG B 40 23.619 3.949 2.837 1.00 0.00 C ATOM 2122 NE ARG B 40 24.868 3.611 3.515 1.00 0.00 N ATOM 2123 CZ ARG B 40 25.664 4.511 4.086 1.00 0.00 C ATOM 2124 NH1 ARG B 40 25.344 5.797 4.064 1.00 0.00 N ATOM 2125 NH2 ARG B 40 26.784 4.122 4.681 1.00 0.00 N ATOM 0 H ARG B 40 18.778 1.814 0.559 1.00 0.00 H new ATOM 0 HA ARG B 40 21.429 1.185 0.651 1.00 0.00 H new ATOM 0 HB2 ARG B 40 21.838 3.668 0.807 1.00 0.00 H new ATOM 0 HB3 ARG B 40 20.940 3.686 2.313 1.00 0.00 H new ATOM 0 HG2 ARG B 40 22.579 2.135 3.326 1.00 0.00 H new ATOM 0 HG3 ARG B 40 23.465 2.066 1.815 1.00 0.00 H new ATOM 0 HD2 ARG B 40 23.837 4.544 1.950 1.00 0.00 H new ATOM 0 HD3 ARG B 40 23.006 4.567 3.493 1.00 0.00 H new ATOM 0 HE ARG B 40 25.145 2.630 3.553 1.00 0.00 H new ATOM 0 HH11 ARG B 40 24.484 6.101 3.608 1.00 0.00 H new ATOM 0 HH12 ARG B 40 25.958 6.483 4.503 1.00 0.00 H new ATOM 0 HH21 ARG B 40 27.034 3.133 4.700 1.00 0.00 H new ATOM 0 HH22 ARG B 40 27.395 4.812 5.119 1.00 0.00 H new ATOM 2139 N TYR B 41 18.895 1.233 2.626 1.00 0.00 N ATOM 2140 CA TYR B 41 18.220 0.595 3.755 1.00 0.00 C ATOM 2141 C TYR B 41 18.500 -0.902 3.779 1.00 0.00 C ATOM 2142 O TYR B 41 17.724 -1.693 3.246 1.00 0.00 O ATOM 2143 CB TYR B 41 16.708 0.834 3.678 1.00 0.00 C ATOM 2144 CG TYR B 41 16.035 0.973 5.029 1.00 0.00 C ATOM 2145 CD1 TYR B 41 16.364 0.129 6.087 1.00 0.00 C ATOM 2146 CD2 TYR B 41 15.072 1.949 5.246 1.00 0.00 C ATOM 2147 CE1 TYR B 41 15.750 0.257 7.318 1.00 0.00 C ATOM 2148 CE2 TYR B 41 14.453 2.083 6.475 1.00 0.00 C ATOM 2149 CZ TYR B 41 14.795 1.235 7.507 1.00 0.00 C ATOM 2150 OH TYR B 41 14.181 1.364 8.732 1.00 0.00 O ATOM 0 H TYR B 41 18.275 1.765 2.015 1.00 0.00 H new ATOM 0 HA TYR B 41 18.608 1.039 4.672 1.00 0.00 H new ATOM 0 HB2 TYR B 41 16.523 1.737 3.097 1.00 0.00 H new ATOM 0 HB3 TYR B 41 16.247 0.007 3.138 1.00 0.00 H new ATOM 0 HD1 TYR B 41 17.111 -0.638 5.943 1.00 0.00 H new ATOM 0 HD2 TYR B 41 14.801 2.616 4.440 1.00 0.00 H new ATOM 0 HE1 TYR B 41 16.016 -0.405 8.129 1.00 0.00 H new ATOM 0 HE2 TYR B 41 13.706 2.848 6.626 1.00 0.00 H new ATOM 0 HH TYR B 41 13.535 2.100 8.698 1.00 0.00 H new ATOM 2160 N LYS B 42 19.610 -1.282 4.401 1.00 0.00 N ATOM 2161 CA LYS B 42 19.993 -2.685 4.490 1.00 0.00 C ATOM 2162 C LYS B 42 21.298 -2.843 5.267 1.00 0.00 C ATOM 2163 O LYS B 42 22.205 -3.558 4.840 1.00 0.00 O ATOM 2164 CB LYS B 42 20.134 -3.284 3.088 1.00 0.00 C ATOM 2165 CG LYS B 42 21.095 -2.515 2.192 1.00 0.00 C ATOM 2166 CD LYS B 42 21.398 -3.274 0.909 1.00 0.00 C ATOM 2167 CE LYS B 42 22.235 -4.515 1.177 1.00 0.00 C ATOM 2168 NZ LYS B 42 22.617 -5.211 -0.082 1.00 0.00 N ATOM 0 H LYS B 42 20.260 -0.638 4.851 1.00 0.00 H new ATOM 0 HA LYS B 42 19.210 -3.221 5.026 1.00 0.00 H new ATOM 0 HB2 LYS B 42 20.477 -4.315 3.175 1.00 0.00 H new ATOM 0 HB3 LYS B 42 19.153 -3.314 2.614 1.00 0.00 H new ATOM 0 HG2 LYS B 42 20.666 -1.543 1.947 1.00 0.00 H new ATOM 0 HG3 LYS B 42 22.023 -2.327 2.731 1.00 0.00 H new ATOM 0 HD2 LYS B 42 20.464 -3.562 0.427 1.00 0.00 H new ATOM 0 HD3 LYS B 42 21.927 -2.621 0.215 1.00 0.00 H new ATOM 0 HE2 LYS B 42 23.135 -4.234 1.724 1.00 0.00 H new ATOM 0 HE3 LYS B 42 21.675 -5.199 1.814 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 23.186 -6.051 0.145 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 21.759 -5.502 -0.592 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 23.173 -4.567 -0.680 1.00 0.00 H new ATOM 2182 N CYS B 43 21.382 -2.170 6.410 1.00 0.00 N ATOM 2183 CA CYS B 43 22.574 -2.231 7.250 1.00 0.00 C ATOM 2184 C CYS B 43 22.809 -3.650 7.762 1.00 0.00 C ATOM 2185 O CYS B 43 22.226 -4.005 8.808 1.00 0.00 O ATOM 2186 CB CYS B 43 22.441 -1.266 8.431 1.00 0.00 C ATOM 2187 SG CYS B 43 23.889 -1.217 9.513 1.00 0.00 S ATOM 2188 OXT CYS B 43 23.574 -4.392 7.112 1.00 0.00 O ATOM 0 H CYS B 43 20.639 -1.576 6.776 1.00 0.00 H new ATOM 0 HA CYS B 43 23.430 -1.937 6.643 1.00 0.00 H new ATOM 0 HB2 CYS B 43 22.254 -0.263 8.047 1.00 0.00 H new ATOM 0 HB3 CYS B 43 21.569 -1.549 9.021 1.00 0.00 H new ATOM 0 HG CYS B 43 23.681 -0.372 10.479 1.00 0.00 H new TER 2194 CYS B 43