USER MOD reduce.3.24.130724 H: found=0, std=0, add=945, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 946 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 852 ASN : amide:sc= 0.814 K(o=2.9,f=-4.1!) USER MOD Set 1.2: A 855 LYS NZ :NH3+ -135:sc= 1.27 (180deg=-0.0239) USER MOD Set 1.3: A 907 ASN : amide:sc= 0.778 K(o=2.9,f=-8.4!) USER MOD Set 2.1: A 902 ASN : amide:sc= 0.664 K(o=1.3,f=-1) USER MOD Set 2.2: A 906 GLN : amide:sc= 0.658 K(o=1.3,f=-0.12) USER MOD Set 3.1: A 833 THR OG1 : rot 69:sc= 1.22 USER MOD Set 3.2: A 867 THR OG1 : rot 73:sc= -1.76! USER MOD Single : A 786 THR OG1 : rot 180:sc= 0 USER MOD Single : A 788 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 790 THR OG1 : rot 180:sc= 0 USER MOD Single : A 798 TYR OH : rot -165:sc= -0.278 USER MOD Single : A 800 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 802 THR OG1 : rot -93:sc= 1.27 USER MOD Single : A 804 THR OG1 : rot 180:sc= 0 USER MOD Single : A 807 THR OG1 : rot 79:sc= 0.274 USER MOD Single : A 809 THR OG1 : rot 61:sc= 1.23 USER MOD Single : A 811 ASN : amide:sc= -3.09! C(o=-3.1!,f=-2.7!) USER MOD Single : A 814 SER OG : rot 180:sc= 0 USER MOD Single : A 815 SER OG : rot 76:sc= 0.32 USER MOD Single : A 816 MET CE :methyl -137:sc= -1.44 (180deg=-2.79!) USER MOD Single : A 822 MET CE :methyl 149:sc= -0.155 (180deg=-0.693) USER MOD Single : A 825 GLN : amide:sc= -0.125 K(o=-0.12,f=-0.89) USER MOD Single : A 831 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 834 SER OG : rot 73:sc= 1.29 USER MOD Single : A 838 ASN : amide:sc=-0.00333 K(o=-0.0033,f=-0.95) USER MOD Single : A 841 LYS NZ :NH3+ -170:sc= -0.012 (180deg=-0.141) USER MOD Single : A 848 SER OG : rot 180:sc= 0.0255 USER MOD Single : A 853 SER OG : rot 85:sc= 0.966 USER MOD Single : A 858 SER OG : rot 180:sc= 0 USER MOD Single : A 861 LYS NZ :NH3+ 169:sc=-0.00564 (180deg=-0.131) USER MOD Single : A 869 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 870 MET CE :methyl 163:sc= -0.0939 (180deg=-0.36) USER MOD Single : A 875 LYS NZ :NH3+ 163:sc= 1.12 (180deg=0.886) USER MOD Single : A 880 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 883 SER OG : rot 180:sc= -0.198 USER MOD Single : A 886 GLN : amide:sc= -1.49 K(o=-1.5,f=-0.089) USER MOD Single : A 887 GLN : amide:sc= -0.0084 K(o=-0.0084,f=-0.76) USER MOD Single : A 888 GLN : amide:sc= 0.946 K(o=0.95,f=-0.9) USER MOD Single : A 899 MET CE :methyl 138:sc= -0.206 (180deg=-0.775) USER MOD Single : A 901 THR OG1 : rot 75:sc= 0.627 USER MOD Single : A 910 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0857) USER MOD Single : A 911 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 781 15.403 -26.948 -26.837 1.00 0.00 N ATOM 2 CA GLY A 781 14.787 -25.897 -25.994 1.00 0.00 C ATOM 3 C GLY A 781 15.551 -25.699 -24.704 1.00 0.00 C ATOM 4 O GLY A 781 16.622 -26.278 -24.518 1.00 0.00 O ATOM 0 HA2 GLY A 781 14.756 -24.958 -26.547 1.00 0.00 H new ATOM 0 HA3 GLY A 781 13.756 -26.169 -25.769 1.00 0.00 H new ATOM 10 N ILE A 782 15.007 -24.878 -23.817 1.00 0.00 N ATOM 11 CA ILE A 782 15.630 -24.620 -22.524 1.00 0.00 C ATOM 12 C ILE A 782 14.572 -24.642 -21.429 1.00 0.00 C ATOM 13 O ILE A 782 13.387 -24.826 -21.706 1.00 0.00 O ATOM 14 CB ILE A 782 16.379 -23.257 -22.469 1.00 0.00 C ATOM 15 CG1 ILE A 782 15.405 -22.061 -22.475 1.00 0.00 C ATOM 16 CG2 ILE A 782 17.377 -23.140 -23.613 1.00 0.00 C ATOM 17 CD1 ILE A 782 14.644 -21.860 -23.772 1.00 0.00 C ATOM 0 H ILE A 782 14.132 -24.377 -23.969 1.00 0.00 H new ATOM 0 HA ILE A 782 16.368 -25.408 -22.372 1.00 0.00 H new ATOM 0 HB ILE A 782 16.925 -23.229 -21.526 1.00 0.00 H new ATOM 0 HG12 ILE A 782 14.686 -22.193 -21.666 1.00 0.00 H new ATOM 0 HG13 ILE A 782 15.967 -21.153 -22.257 1.00 0.00 H new ATOM 0 HG21 ILE A 782 17.888 -22.179 -23.553 1.00 0.00 H new ATOM 0 HG22 ILE A 782 18.108 -23.945 -23.542 1.00 0.00 H new ATOM 0 HG23 ILE A 782 16.850 -23.212 -24.564 1.00 0.00 H new ATOM 0 HD11 ILE A 782 13.986 -20.996 -23.678 1.00 0.00 H new ATOM 0 HD12 ILE A 782 15.350 -21.692 -24.586 1.00 0.00 H new ATOM 0 HD13 ILE A 782 14.049 -22.748 -23.986 1.00 0.00 H new ATOM 29 N ASP A 783 15.001 -24.475 -20.192 1.00 0.00 N ATOM 30 CA ASP A 783 14.073 -24.360 -19.077 1.00 0.00 C ATOM 31 C ASP A 783 13.882 -22.892 -18.733 1.00 0.00 C ATOM 32 O ASP A 783 14.817 -22.232 -18.283 1.00 0.00 O ATOM 33 CB ASP A 783 14.585 -25.125 -17.851 1.00 0.00 C ATOM 34 CG ASP A 783 14.746 -26.610 -18.108 1.00 0.00 C ATOM 35 OD1 ASP A 783 15.837 -27.033 -18.546 1.00 0.00 O ATOM 36 OD2 ASP A 783 13.777 -27.365 -17.883 1.00 0.00 O ATOM 0 H ASP A 783 15.985 -24.416 -19.932 1.00 0.00 H new ATOM 0 HA ASP A 783 13.119 -24.798 -19.370 1.00 0.00 H new ATOM 0 HB2 ASP A 783 15.544 -24.708 -17.543 1.00 0.00 H new ATOM 0 HB3 ASP A 783 13.893 -24.978 -17.022 1.00 0.00 H new ATOM 41 N PRO A 784 12.674 -22.352 -18.972 1.00 0.00 N ATOM 42 CA PRO A 784 12.369 -20.943 -18.703 1.00 0.00 C ATOM 43 C PRO A 784 12.610 -20.580 -17.241 1.00 0.00 C ATOM 44 O PRO A 784 11.904 -21.052 -16.346 1.00 0.00 O ATOM 45 CB PRO A 784 10.884 -20.818 -19.057 1.00 0.00 C ATOM 46 CG PRO A 784 10.607 -21.960 -19.971 1.00 0.00 C ATOM 47 CD PRO A 784 11.515 -23.072 -19.527 1.00 0.00 C ATOM 0 HA PRO A 784 13.005 -20.268 -19.276 1.00 0.00 H new ATOM 0 HB2 PRO A 784 10.260 -20.867 -18.164 1.00 0.00 H new ATOM 0 HB3 PRO A 784 10.673 -19.865 -19.542 1.00 0.00 H new ATOM 0 HG2 PRO A 784 9.561 -22.262 -19.912 1.00 0.00 H new ATOM 0 HG3 PRO A 784 10.802 -21.687 -21.008 1.00 0.00 H new ATOM 0 HD2 PRO A 784 11.039 -23.708 -18.780 1.00 0.00 H new ATOM 0 HD3 PRO A 784 11.801 -23.716 -20.359 1.00 0.00 H new ATOM 55 N PHE A 785 13.608 -19.738 -17.010 1.00 0.00 N ATOM 56 CA PHE A 785 14.055 -19.418 -15.660 1.00 0.00 C ATOM 57 C PHE A 785 13.084 -18.475 -14.948 1.00 0.00 C ATOM 58 O PHE A 785 12.790 -18.656 -13.767 1.00 0.00 O ATOM 59 CB PHE A 785 15.454 -18.798 -15.713 1.00 0.00 C ATOM 60 CG PHE A 785 16.041 -18.503 -14.363 1.00 0.00 C ATOM 61 CD1 PHE A 785 16.465 -19.533 -13.539 1.00 0.00 C ATOM 62 CD2 PHE A 785 16.176 -17.197 -13.921 1.00 0.00 C ATOM 63 CE1 PHE A 785 17.012 -19.266 -12.299 1.00 0.00 C ATOM 64 CE2 PHE A 785 16.720 -16.924 -12.681 1.00 0.00 C ATOM 65 CZ PHE A 785 17.138 -17.960 -11.870 1.00 0.00 C ATOM 0 H PHE A 785 14.128 -19.260 -17.746 1.00 0.00 H new ATOM 0 HA PHE A 785 14.087 -20.345 -15.088 1.00 0.00 H new ATOM 0 HB2 PHE A 785 16.120 -19.475 -16.248 1.00 0.00 H new ATOM 0 HB3 PHE A 785 15.409 -17.873 -16.289 1.00 0.00 H new ATOM 0 HD1 PHE A 785 16.367 -20.556 -13.870 1.00 0.00 H new ATOM 0 HD2 PHE A 785 15.852 -16.383 -14.553 1.00 0.00 H new ATOM 0 HE1 PHE A 785 17.340 -20.077 -11.666 1.00 0.00 H new ATOM 0 HE2 PHE A 785 16.818 -15.902 -12.347 1.00 0.00 H new ATOM 0 HZ PHE A 785 17.564 -17.749 -10.900 1.00 0.00 H new ATOM 75 N THR A 786 12.576 -17.484 -15.662 1.00 0.00 N ATOM 76 CA THR A 786 11.703 -16.487 -15.060 1.00 0.00 C ATOM 77 C THR A 786 10.231 -16.827 -15.314 1.00 0.00 C ATOM 78 O THR A 786 9.343 -15.987 -15.156 1.00 0.00 O ATOM 79 CB THR A 786 12.027 -15.078 -15.605 1.00 0.00 C ATOM 80 OG1 THR A 786 13.449 -14.933 -15.748 1.00 0.00 O ATOM 81 CG2 THR A 786 11.510 -13.993 -14.670 1.00 0.00 C ATOM 0 H THR A 786 12.752 -17.348 -16.657 1.00 0.00 H new ATOM 0 HA THR A 786 11.878 -16.493 -13.984 1.00 0.00 H new ATOM 0 HB THR A 786 11.536 -14.968 -16.572 1.00 0.00 H new ATOM 0 HG1 THR A 786 13.653 -14.040 -16.095 1.00 0.00 H new ATOM 0 HG21 THR A 786 11.753 -13.013 -15.080 1.00 0.00 H new ATOM 0 HG22 THR A 786 10.429 -14.086 -14.568 1.00 0.00 H new ATOM 0 HG23 THR A 786 11.978 -14.103 -13.692 1.00 0.00 H new ATOM 89 N ALA A 787 9.972 -18.075 -15.692 1.00 0.00 N ATOM 90 CA ALA A 787 8.608 -18.524 -15.947 1.00 0.00 C ATOM 91 C ALA A 787 7.817 -18.596 -14.648 1.00 0.00 C ATOM 92 O ALA A 787 6.631 -18.275 -14.612 1.00 0.00 O ATOM 93 CB ALA A 787 8.606 -19.877 -16.638 1.00 0.00 C ATOM 0 H ALA A 787 10.686 -18.791 -15.828 1.00 0.00 H new ATOM 0 HA ALA A 787 8.131 -17.799 -16.607 1.00 0.00 H new ATOM 0 HB1 ALA A 787 7.578 -20.192 -16.818 1.00 0.00 H new ATOM 0 HB2 ALA A 787 9.134 -19.801 -17.588 1.00 0.00 H new ATOM 0 HB3 ALA A 787 9.104 -20.610 -16.004 1.00 0.00 H new ATOM 99 N HIS A 788 8.482 -19.025 -13.587 1.00 0.00 N ATOM 100 CA HIS A 788 7.867 -19.087 -12.270 1.00 0.00 C ATOM 101 C HIS A 788 8.147 -17.805 -11.499 1.00 0.00 C ATOM 102 O HIS A 788 8.730 -16.871 -12.048 1.00 0.00 O ATOM 103 CB HIS A 788 8.380 -20.304 -11.491 1.00 0.00 C ATOM 104 CG HIS A 788 7.941 -21.611 -12.074 1.00 0.00 C ATOM 105 ND1 HIS A 788 8.693 -22.326 -12.976 1.00 0.00 N ATOM 106 CD2 HIS A 788 6.810 -22.329 -11.882 1.00 0.00 C ATOM 107 CE1 HIS A 788 8.047 -23.423 -13.317 1.00 0.00 C ATOM 108 NE2 HIS A 788 6.900 -23.451 -12.667 1.00 0.00 N ATOM 0 H HIS A 788 9.453 -19.337 -13.613 1.00 0.00 H new ATOM 0 HA HIS A 788 6.789 -19.191 -12.395 1.00 0.00 H new ATOM 0 HB2 HIS A 788 9.469 -20.275 -11.462 1.00 0.00 H new ATOM 0 HB3 HIS A 788 8.032 -20.239 -10.460 1.00 0.00 H new ATOM 0 HD2 HIS A 788 5.989 -22.067 -11.231 1.00 0.00 H new ATOM 0 HE1 HIS A 788 8.398 -24.172 -14.011 1.00 0.00 H new ATOM 0 HE2 HIS A 788 6.196 -24.186 -12.736 1.00 0.00 H new ATOM 116 N ALA A 789 7.726 -17.775 -10.233 1.00 0.00 N ATOM 117 CA ALA A 789 7.893 -16.609 -9.367 1.00 0.00 C ATOM 118 C ALA A 789 7.067 -15.429 -9.869 1.00 0.00 C ATOM 119 O ALA A 789 7.463 -14.722 -10.800 1.00 0.00 O ATOM 120 CB ALA A 789 9.363 -16.225 -9.230 1.00 0.00 C ATOM 0 H ALA A 789 7.259 -18.560 -9.780 1.00 0.00 H new ATOM 0 HA ALA A 789 7.526 -16.880 -8.377 1.00 0.00 H new ATOM 0 HB1 ALA A 789 9.453 -15.355 -8.580 1.00 0.00 H new ATOM 0 HB2 ALA A 789 9.918 -17.058 -8.799 1.00 0.00 H new ATOM 0 HB3 ALA A 789 9.770 -15.987 -10.213 1.00 0.00 H new ATOM 126 N THR A 790 5.905 -15.238 -9.259 1.00 0.00 N ATOM 127 CA THR A 790 5.010 -14.148 -9.624 1.00 0.00 C ATOM 128 C THR A 790 5.723 -12.802 -9.525 1.00 0.00 C ATOM 129 O THR A 790 6.443 -12.530 -8.560 1.00 0.00 O ATOM 130 CB THR A 790 3.735 -14.140 -8.744 1.00 0.00 C ATOM 131 OG1 THR A 790 2.930 -12.991 -9.040 1.00 0.00 O ATOM 132 CG2 THR A 790 4.081 -14.145 -7.263 1.00 0.00 C ATOM 0 H THR A 790 5.558 -15.829 -8.503 1.00 0.00 H new ATOM 0 HA THR A 790 4.707 -14.311 -10.658 1.00 0.00 H new ATOM 0 HB THR A 790 3.175 -15.047 -8.972 1.00 0.00 H new ATOM 0 HG1 THR A 790 2.127 -13.000 -8.478 1.00 0.00 H new ATOM 0 HG21 THR A 790 3.163 -14.139 -6.675 1.00 0.00 H new ATOM 0 HG22 THR A 790 4.657 -15.039 -7.027 1.00 0.00 H new ATOM 0 HG23 THR A 790 4.671 -13.260 -7.024 1.00 0.00 H new ATOM 140 N GLY A 791 5.532 -11.972 -10.535 1.00 0.00 N ATOM 141 CA GLY A 791 6.206 -10.695 -10.590 1.00 0.00 C ATOM 142 C GLY A 791 6.954 -10.515 -11.889 1.00 0.00 C ATOM 143 O GLY A 791 6.831 -11.337 -12.796 1.00 0.00 O ATOM 0 H GLY A 791 4.916 -12.162 -11.325 1.00 0.00 H new ATOM 0 HA2 GLY A 791 5.477 -9.893 -10.476 1.00 0.00 H new ATOM 0 HA3 GLY A 791 6.902 -10.614 -9.755 1.00 0.00 H new ATOM 147 N ALA A 792 7.724 -9.448 -11.981 1.00 0.00 N ATOM 148 CA ALA A 792 8.506 -9.170 -13.175 1.00 0.00 C ATOM 149 C ALA A 792 9.892 -8.660 -12.805 1.00 0.00 C ATOM 150 O ALA A 792 10.887 -9.019 -13.434 1.00 0.00 O ATOM 151 CB ALA A 792 7.786 -8.162 -14.060 1.00 0.00 C ATOM 0 H ALA A 792 7.826 -8.755 -11.240 1.00 0.00 H new ATOM 0 HA ALA A 792 8.622 -10.100 -13.732 1.00 0.00 H new ATOM 0 HB1 ALA A 792 8.385 -7.965 -14.949 1.00 0.00 H new ATOM 0 HB2 ALA A 792 6.818 -8.565 -14.357 1.00 0.00 H new ATOM 0 HB3 ALA A 792 7.639 -7.233 -13.509 1.00 0.00 H new ATOM 157 N GLY A 793 9.951 -7.831 -11.774 1.00 0.00 N ATOM 158 CA GLY A 793 11.212 -7.280 -11.333 1.00 0.00 C ATOM 159 C GLY A 793 11.122 -6.733 -9.925 1.00 0.00 C ATOM 160 O GLY A 793 10.121 -6.109 -9.572 1.00 0.00 O ATOM 0 H GLY A 793 9.141 -7.529 -11.232 1.00 0.00 H new ATOM 0 HA2 GLY A 793 11.981 -8.051 -11.375 1.00 0.00 H new ATOM 0 HA3 GLY A 793 11.520 -6.486 -12.013 1.00 0.00 H new ATOM 164 N PRO A 794 12.148 -6.959 -9.092 1.00 0.00 N ATOM 165 CA PRO A 794 12.151 -6.494 -7.702 1.00 0.00 C ATOM 166 C PRO A 794 12.082 -4.972 -7.600 1.00 0.00 C ATOM 167 O PRO A 794 12.710 -4.254 -8.383 1.00 0.00 O ATOM 168 CB PRO A 794 13.483 -7.008 -7.144 1.00 0.00 C ATOM 169 CG PRO A 794 14.328 -7.283 -8.341 1.00 0.00 C ATOM 170 CD PRO A 794 13.382 -7.680 -9.437 1.00 0.00 C ATOM 0 HA PRO A 794 11.282 -6.858 -7.154 1.00 0.00 H new ATOM 0 HB2 PRO A 794 13.950 -6.268 -6.494 1.00 0.00 H new ATOM 0 HB3 PRO A 794 13.339 -7.909 -6.548 1.00 0.00 H new ATOM 0 HG2 PRO A 794 14.903 -6.401 -8.623 1.00 0.00 H new ATOM 0 HG3 PRO A 794 15.045 -8.079 -8.138 1.00 0.00 H new ATOM 0 HD2 PRO A 794 13.757 -7.389 -10.418 1.00 0.00 H new ATOM 0 HD3 PRO A 794 13.225 -8.758 -9.463 1.00 0.00 H new ATOM 178 N ALA A 795 11.324 -4.486 -6.625 1.00 0.00 N ATOM 179 CA ALA A 795 11.169 -3.050 -6.416 1.00 0.00 C ATOM 180 C ALA A 795 12.333 -2.479 -5.612 1.00 0.00 C ATOM 181 O ALA A 795 12.211 -1.442 -4.959 1.00 0.00 O ATOM 182 CB ALA A 795 9.841 -2.755 -5.728 1.00 0.00 C ATOM 0 H ALA A 795 10.806 -5.066 -5.965 1.00 0.00 H new ATOM 0 HA ALA A 795 11.171 -2.564 -7.392 1.00 0.00 H new ATOM 0 HB1 ALA A 795 9.739 -1.680 -5.579 1.00 0.00 H new ATOM 0 HB2 ALA A 795 9.021 -3.114 -6.350 1.00 0.00 H new ATOM 0 HB3 ALA A 795 9.811 -3.260 -4.762 1.00 0.00 H new ATOM 188 N GLY A 796 13.464 -3.159 -5.694 1.00 0.00 N ATOM 189 CA GLY A 796 14.678 -2.704 -5.045 1.00 0.00 C ATOM 190 C GLY A 796 14.601 -2.721 -3.532 1.00 0.00 C ATOM 191 O GLY A 796 14.950 -3.712 -2.894 1.00 0.00 O ATOM 0 H GLY A 796 13.565 -4.034 -6.208 1.00 0.00 H new ATOM 0 HA2 GLY A 796 15.509 -3.333 -5.365 1.00 0.00 H new ATOM 0 HA3 GLY A 796 14.900 -1.690 -5.378 1.00 0.00 H new ATOM 195 N ARG A 797 14.138 -1.621 -2.959 1.00 0.00 N ATOM 196 CA ARG A 797 14.160 -1.442 -1.516 1.00 0.00 C ATOM 197 C ARG A 797 12.885 -1.978 -0.866 1.00 0.00 C ATOM 198 O ARG A 797 12.943 -2.809 0.036 1.00 0.00 O ATOM 199 CB ARG A 797 14.331 0.040 -1.180 1.00 0.00 C ATOM 200 CG ARG A 797 14.644 0.299 0.283 1.00 0.00 C ATOM 201 CD ARG A 797 14.617 1.784 0.600 1.00 0.00 C ATOM 202 NE ARG A 797 15.558 2.549 -0.219 1.00 0.00 N ATOM 203 CZ ARG A 797 15.396 3.839 -0.519 1.00 0.00 C ATOM 204 NH1 ARG A 797 14.292 4.478 -0.144 1.00 0.00 N ATOM 205 NH2 ARG A 797 16.330 4.488 -1.204 1.00 0.00 N ATOM 0 H ARG A 797 13.741 -0.835 -3.474 1.00 0.00 H new ATOM 0 HA ARG A 797 15.003 -2.008 -1.119 1.00 0.00 H new ATOM 0 HB2 ARG A 797 15.132 0.453 -1.793 1.00 0.00 H new ATOM 0 HB3 ARG A 797 13.418 0.572 -1.447 1.00 0.00 H new ATOM 0 HG2 ARG A 797 13.920 -0.222 0.909 1.00 0.00 H new ATOM 0 HG3 ARG A 797 15.626 -0.109 0.524 1.00 0.00 H new ATOM 0 HD2 ARG A 797 13.609 2.167 0.443 1.00 0.00 H new ATOM 0 HD3 ARG A 797 14.854 1.932 1.654 1.00 0.00 H new ATOM 0 HE ARG A 797 16.383 2.070 -0.580 1.00 0.00 H new ATOM 0 HH11 ARG A 797 13.567 3.982 0.374 1.00 0.00 H new ATOM 0 HH12 ARG A 797 14.170 5.464 -0.374 1.00 0.00 H new ATOM 0 HH21 ARG A 797 17.175 4.000 -1.503 1.00 0.00 H new ATOM 0 HH22 ARG A 797 16.203 5.474 -1.432 1.00 0.00 H new ATOM 219 N TYR A 798 11.737 -1.511 -1.335 1.00 0.00 N ATOM 220 CA TYR A 798 10.457 -1.873 -0.727 1.00 0.00 C ATOM 221 C TYR A 798 9.776 -2.968 -1.536 1.00 0.00 C ATOM 222 O TYR A 798 8.553 -2.973 -1.682 1.00 0.00 O ATOM 223 CB TYR A 798 9.532 -0.650 -0.647 1.00 0.00 C ATOM 224 CG TYR A 798 10.153 0.562 0.013 1.00 0.00 C ATOM 225 CD1 TYR A 798 10.730 0.479 1.273 1.00 0.00 C ATOM 226 CD2 TYR A 798 10.172 1.790 -0.635 1.00 0.00 C ATOM 227 CE1 TYR A 798 11.304 1.587 1.867 1.00 0.00 C ATOM 228 CE2 TYR A 798 10.747 2.898 -0.052 1.00 0.00 C ATOM 229 CZ TYR A 798 11.312 2.794 1.199 1.00 0.00 C ATOM 230 OH TYR A 798 11.900 3.897 1.776 1.00 0.00 O ATOM 0 H TYR A 798 11.662 -0.881 -2.134 1.00 0.00 H new ATOM 0 HA TYR A 798 10.654 -2.239 0.281 1.00 0.00 H new ATOM 0 HB2 TYR A 798 9.220 -0.379 -1.656 1.00 0.00 H new ATOM 0 HB3 TYR A 798 8.632 -0.926 -0.098 1.00 0.00 H new ATOM 0 HD1 TYR A 798 10.730 -0.465 1.797 1.00 0.00 H new ATOM 0 HD2 TYR A 798 9.727 1.878 -1.615 1.00 0.00 H new ATOM 0 HE1 TYR A 798 11.744 1.508 2.850 1.00 0.00 H new ATOM 0 HE2 TYR A 798 10.754 3.844 -0.574 1.00 0.00 H new ATOM 0 HH TYR A 798 11.618 4.705 1.299 1.00 0.00 H new ATOM 240 N ASP A 799 10.562 -3.916 -2.028 1.00 0.00 N ATOM 241 CA ASP A 799 10.053 -4.932 -2.943 1.00 0.00 C ATOM 242 C ASP A 799 9.080 -5.881 -2.245 1.00 0.00 C ATOM 243 O ASP A 799 8.043 -6.230 -2.804 1.00 0.00 O ATOM 244 CB ASP A 799 11.210 -5.724 -3.571 1.00 0.00 C ATOM 245 CG ASP A 799 11.905 -6.655 -2.594 1.00 0.00 C ATOM 246 OD1 ASP A 799 12.690 -6.168 -1.754 1.00 0.00 O ATOM 247 OD2 ASP A 799 11.668 -7.876 -2.665 1.00 0.00 O ATOM 0 H ASP A 799 11.554 -4.004 -1.810 1.00 0.00 H new ATOM 0 HA ASP A 799 9.508 -4.416 -3.734 1.00 0.00 H new ATOM 0 HB2 ASP A 799 10.828 -6.308 -4.408 1.00 0.00 H new ATOM 0 HB3 ASP A 799 11.941 -5.025 -3.977 1.00 0.00 H new ATOM 252 N GLN A 800 9.405 -6.282 -1.022 1.00 0.00 N ATOM 253 CA GLN A 800 8.555 -7.201 -0.274 1.00 0.00 C ATOM 254 C GLN A 800 7.296 -6.500 0.227 1.00 0.00 C ATOM 255 O GLN A 800 6.185 -7.000 0.049 1.00 0.00 O ATOM 256 CB GLN A 800 9.322 -7.803 0.904 1.00 0.00 C ATOM 257 CG GLN A 800 8.494 -8.778 1.724 1.00 0.00 C ATOM 258 CD GLN A 800 9.251 -9.343 2.906 1.00 0.00 C ATOM 259 OE1 GLN A 800 10.471 -9.503 2.861 1.00 0.00 O ATOM 260 NE2 GLN A 800 8.535 -9.646 3.975 1.00 0.00 N ATOM 0 H GLN A 800 10.247 -5.987 -0.528 1.00 0.00 H new ATOM 0 HA GLN A 800 8.256 -8.003 -0.949 1.00 0.00 H new ATOM 0 HB2 GLN A 800 10.208 -8.315 0.528 1.00 0.00 H new ATOM 0 HB3 GLN A 800 9.670 -6.998 1.552 1.00 0.00 H new ATOM 0 HG2 GLN A 800 7.596 -8.274 2.081 1.00 0.00 H new ATOM 0 HG3 GLN A 800 8.166 -9.597 1.084 1.00 0.00 H new ATOM 0 HE21 GLN A 800 7.526 -9.498 3.972 1.00 0.00 H new ATOM 0 HE22 GLN A 800 8.992 -10.028 4.803 1.00 0.00 H new ATOM 269 N ALA A 801 7.486 -5.342 0.850 1.00 0.00 N ATOM 270 CA ALA A 801 6.386 -4.603 1.463 1.00 0.00 C ATOM 271 C ALA A 801 5.293 -4.271 0.451 1.00 0.00 C ATOM 272 O ALA A 801 4.105 -4.461 0.724 1.00 0.00 O ATOM 273 CB ALA A 801 6.910 -3.335 2.116 1.00 0.00 C ATOM 0 H ALA A 801 8.397 -4.892 0.944 1.00 0.00 H new ATOM 0 HA ALA A 801 5.940 -5.241 2.226 1.00 0.00 H new ATOM 0 HB1 ALA A 801 6.082 -2.791 2.570 1.00 0.00 H new ATOM 0 HB2 ALA A 801 7.638 -3.595 2.884 1.00 0.00 H new ATOM 0 HB3 ALA A 801 7.386 -2.708 1.362 1.00 0.00 H new ATOM 279 N THR A 802 5.692 -3.786 -0.717 1.00 0.00 N ATOM 280 CA THR A 802 4.732 -3.434 -1.751 1.00 0.00 C ATOM 281 C THR A 802 4.059 -4.682 -2.311 1.00 0.00 C ATOM 282 O THR A 802 2.843 -4.703 -2.501 1.00 0.00 O ATOM 283 CB THR A 802 5.394 -2.644 -2.898 1.00 0.00 C ATOM 284 OG1 THR A 802 6.545 -3.347 -3.380 1.00 0.00 O ATOM 285 CG2 THR A 802 5.799 -1.250 -2.437 1.00 0.00 C ATOM 0 H THR A 802 6.667 -3.629 -0.970 1.00 0.00 H new ATOM 0 HA THR A 802 3.979 -2.797 -1.286 1.00 0.00 H new ATOM 0 HB THR A 802 4.667 -2.544 -3.704 1.00 0.00 H new ATOM 0 HG1 THR A 802 7.343 -3.030 -2.908 1.00 0.00 H new ATOM 0 HG21 THR A 802 6.263 -0.714 -3.265 1.00 0.00 H new ATOM 0 HG22 THR A 802 4.915 -0.706 -2.103 1.00 0.00 H new ATOM 0 HG23 THR A 802 6.508 -1.331 -1.613 1.00 0.00 H new ATOM 293 N ASP A 803 4.859 -5.725 -2.540 1.00 0.00 N ATOM 294 CA ASP A 803 4.371 -6.986 -3.103 1.00 0.00 C ATOM 295 C ASP A 803 3.143 -7.481 -2.351 1.00 0.00 C ATOM 296 O ASP A 803 2.129 -7.835 -2.957 1.00 0.00 O ATOM 297 CB ASP A 803 5.470 -8.049 -3.044 1.00 0.00 C ATOM 298 CG ASP A 803 5.096 -9.325 -3.772 1.00 0.00 C ATOM 299 OD1 ASP A 803 4.398 -10.172 -3.183 1.00 0.00 O ATOM 300 OD2 ASP A 803 5.519 -9.490 -4.938 1.00 0.00 O ATOM 0 H ASP A 803 5.859 -5.720 -2.341 1.00 0.00 H new ATOM 0 HA ASP A 803 4.094 -6.806 -4.142 1.00 0.00 H new ATOM 0 HB2 ASP A 803 6.384 -7.644 -3.478 1.00 0.00 H new ATOM 0 HB3 ASP A 803 5.688 -8.282 -2.002 1.00 0.00 H new ATOM 305 N THR A 804 3.244 -7.484 -1.028 1.00 0.00 N ATOM 306 CA THR A 804 2.150 -7.903 -0.172 1.00 0.00 C ATOM 307 C THR A 804 0.896 -7.065 -0.432 1.00 0.00 C ATOM 308 O THR A 804 -0.181 -7.605 -0.681 1.00 0.00 O ATOM 309 CB THR A 804 2.552 -7.795 1.313 1.00 0.00 C ATOM 310 OG1 THR A 804 3.783 -8.499 1.532 1.00 0.00 O ATOM 311 CG2 THR A 804 1.471 -8.368 2.217 1.00 0.00 C ATOM 0 H THR A 804 4.083 -7.197 -0.524 1.00 0.00 H new ATOM 0 HA THR A 804 1.926 -8.944 -0.405 1.00 0.00 H new ATOM 0 HB THR A 804 2.680 -6.740 1.556 1.00 0.00 H new ATOM 0 HG1 THR A 804 4.037 -8.428 2.476 1.00 0.00 H new ATOM 0 HG21 THR A 804 1.782 -8.278 3.258 1.00 0.00 H new ATOM 0 HG22 THR A 804 0.542 -7.818 2.067 1.00 0.00 H new ATOM 0 HG23 THR A 804 1.313 -9.419 1.975 1.00 0.00 H new ATOM 319 N ILE A 805 1.050 -5.745 -0.408 1.00 0.00 N ATOM 320 CA ILE A 805 -0.080 -4.839 -0.573 1.00 0.00 C ATOM 321 C ILE A 805 -0.736 -5.000 -1.946 1.00 0.00 C ATOM 322 O ILE A 805 -1.962 -5.101 -2.041 1.00 0.00 O ATOM 323 CB ILE A 805 0.337 -3.367 -0.370 1.00 0.00 C ATOM 324 CG1 ILE A 805 0.851 -3.144 1.057 1.00 0.00 C ATOM 325 CG2 ILE A 805 -0.830 -2.436 -0.670 1.00 0.00 C ATOM 326 CD1 ILE A 805 1.342 -1.737 1.315 1.00 0.00 C ATOM 0 H ILE A 805 1.948 -5.279 -0.276 1.00 0.00 H new ATOM 0 HA ILE A 805 -0.806 -5.106 0.195 1.00 0.00 H new ATOM 0 HB ILE A 805 1.146 -3.140 -1.065 1.00 0.00 H new ATOM 0 HG12 ILE A 805 0.052 -3.375 1.761 1.00 0.00 H new ATOM 0 HG13 ILE A 805 1.663 -3.844 1.255 1.00 0.00 H new ATOM 0 HG21 ILE A 805 -0.518 -1.402 -0.522 1.00 0.00 H new ATOM 0 HG22 ILE A 805 -1.149 -2.574 -1.703 1.00 0.00 H new ATOM 0 HG23 ILE A 805 -1.659 -2.664 -0.000 1.00 0.00 H new ATOM 0 HD11 ILE A 805 1.690 -1.656 2.345 1.00 0.00 H new ATOM 0 HD12 ILE A 805 2.163 -1.508 0.636 1.00 0.00 H new ATOM 0 HD13 ILE A 805 0.528 -1.032 1.151 1.00 0.00 H new ATOM 338 N LEU A 806 0.081 -5.038 -3.003 1.00 0.00 N ATOM 339 CA LEU A 806 -0.431 -5.203 -4.362 1.00 0.00 C ATOM 340 C LEU A 806 -1.359 -6.416 -4.461 1.00 0.00 C ATOM 341 O LEU A 806 -2.434 -6.339 -5.060 1.00 0.00 O ATOM 342 CB LEU A 806 0.710 -5.347 -5.381 1.00 0.00 C ATOM 343 CG LEU A 806 1.233 -4.037 -5.991 1.00 0.00 C ATOM 344 CD1 LEU A 806 0.080 -3.120 -6.357 1.00 0.00 C ATOM 345 CD2 LEU A 806 2.193 -3.330 -5.050 1.00 0.00 C ATOM 0 H LEU A 806 1.096 -4.957 -2.942 1.00 0.00 H new ATOM 0 HA LEU A 806 -0.998 -4.302 -4.597 1.00 0.00 H new ATOM 0 HB2 LEU A 806 1.542 -5.857 -4.896 1.00 0.00 H new ATOM 0 HB3 LEU A 806 0.369 -5.992 -6.191 1.00 0.00 H new ATOM 0 HG LEU A 806 1.781 -4.291 -6.899 1.00 0.00 H new ATOM 0 HD11 LEU A 806 0.471 -2.198 -6.787 1.00 0.00 H new ATOM 0 HD12 LEU A 806 -0.563 -3.616 -7.084 1.00 0.00 H new ATOM 0 HD13 LEU A 806 -0.497 -2.887 -5.462 1.00 0.00 H new ATOM 0 HD21 LEU A 806 2.543 -2.408 -5.513 1.00 0.00 H new ATOM 0 HD22 LEU A 806 1.681 -3.096 -4.117 1.00 0.00 H new ATOM 0 HD23 LEU A 806 3.044 -3.979 -4.844 1.00 0.00 H new ATOM 357 N THR A 807 -0.946 -7.523 -3.856 1.00 0.00 N ATOM 358 CA THR A 807 -1.710 -8.759 -3.915 1.00 0.00 C ATOM 359 C THR A 807 -2.928 -8.726 -2.987 1.00 0.00 C ATOM 360 O THR A 807 -4.018 -9.129 -3.378 1.00 0.00 O ATOM 361 CB THR A 807 -0.825 -9.964 -3.557 1.00 0.00 C ATOM 362 OG1 THR A 807 0.363 -9.941 -4.359 1.00 0.00 O ATOM 363 CG2 THR A 807 -1.564 -11.275 -3.781 1.00 0.00 C ATOM 0 H THR A 807 -0.082 -7.588 -3.317 1.00 0.00 H new ATOM 0 HA THR A 807 -2.066 -8.861 -4.940 1.00 0.00 H new ATOM 0 HB THR A 807 -0.564 -9.895 -2.501 1.00 0.00 H new ATOM 0 HG1 THR A 807 0.995 -9.290 -3.989 1.00 0.00 H new ATOM 0 HG21 THR A 807 -0.913 -12.109 -3.519 1.00 0.00 H new ATOM 0 HG22 THR A 807 -2.456 -11.301 -3.156 1.00 0.00 H new ATOM 0 HG23 THR A 807 -1.853 -11.355 -4.829 1.00 0.00 H new ATOM 371 N VAL A 808 -2.753 -8.236 -1.764 1.00 0.00 N ATOM 372 CA VAL A 808 -3.856 -8.200 -0.807 1.00 0.00 C ATOM 373 C VAL A 808 -4.983 -7.295 -1.311 1.00 0.00 C ATOM 374 O VAL A 808 -6.152 -7.527 -1.013 1.00 0.00 O ATOM 375 CB VAL A 808 -3.394 -7.742 0.597 1.00 0.00 C ATOM 376 CG1 VAL A 808 -4.570 -7.652 1.559 1.00 0.00 C ATOM 377 CG2 VAL A 808 -2.345 -8.695 1.150 1.00 0.00 C ATOM 0 H VAL A 808 -1.871 -7.863 -1.414 1.00 0.00 H new ATOM 0 HA VAL A 808 -4.231 -9.219 -0.716 1.00 0.00 H new ATOM 0 HB VAL A 808 -2.955 -6.749 0.496 1.00 0.00 H new ATOM 0 HG11 VAL A 808 -4.216 -7.328 2.538 1.00 0.00 H new ATOM 0 HG12 VAL A 808 -5.296 -6.933 1.180 1.00 0.00 H new ATOM 0 HG13 VAL A 808 -5.042 -8.631 1.650 1.00 0.00 H new ATOM 0 HG21 VAL A 808 -2.032 -8.358 2.138 1.00 0.00 H new ATOM 0 HG22 VAL A 808 -2.768 -9.697 1.226 1.00 0.00 H new ATOM 0 HG23 VAL A 808 -1.483 -8.714 0.483 1.00 0.00 H new ATOM 387 N THR A 809 -4.622 -6.291 -2.104 1.00 0.00 N ATOM 388 CA THR A 809 -5.594 -5.367 -2.679 1.00 0.00 C ATOM 389 C THR A 809 -6.697 -6.098 -3.452 1.00 0.00 C ATOM 390 O THR A 809 -7.885 -5.894 -3.202 1.00 0.00 O ATOM 391 CB THR A 809 -4.912 -4.370 -3.632 1.00 0.00 C ATOM 392 OG1 THR A 809 -4.000 -3.536 -2.908 1.00 0.00 O ATOM 393 CG2 THR A 809 -5.951 -3.518 -4.343 1.00 0.00 C ATOM 0 H THR A 809 -3.655 -6.096 -2.365 1.00 0.00 H new ATOM 0 HA THR A 809 -6.042 -4.835 -1.840 1.00 0.00 H new ATOM 0 HB THR A 809 -4.354 -4.933 -4.380 1.00 0.00 H new ATOM 0 HG1 THR A 809 -3.303 -4.091 -2.500 1.00 0.00 H new ATOM 0 HG21 THR A 809 -5.451 -2.818 -5.013 1.00 0.00 H new ATOM 0 HG22 THR A 809 -6.616 -4.161 -4.920 1.00 0.00 H new ATOM 0 HG23 THR A 809 -6.532 -2.963 -3.607 1.00 0.00 H new ATOM 401 N GLU A 810 -6.297 -6.957 -4.382 1.00 0.00 N ATOM 402 CA GLU A 810 -7.251 -7.649 -5.240 1.00 0.00 C ATOM 403 C GLU A 810 -8.090 -8.629 -4.434 1.00 0.00 C ATOM 404 O GLU A 810 -9.211 -8.959 -4.815 1.00 0.00 O ATOM 405 CB GLU A 810 -6.533 -8.364 -6.389 1.00 0.00 C ATOM 406 CG GLU A 810 -5.454 -9.331 -5.937 1.00 0.00 C ATOM 407 CD GLU A 810 -4.581 -9.799 -7.078 1.00 0.00 C ATOM 408 OE1 GLU A 810 -3.737 -9.007 -7.545 1.00 0.00 O ATOM 409 OE2 GLU A 810 -4.740 -10.952 -7.523 1.00 0.00 O ATOM 0 H GLU A 810 -5.320 -7.191 -4.561 1.00 0.00 H new ATOM 0 HA GLU A 810 -7.920 -6.904 -5.671 1.00 0.00 H new ATOM 0 HB2 GLU A 810 -7.269 -8.908 -6.981 1.00 0.00 H new ATOM 0 HB3 GLU A 810 -6.085 -7.617 -7.045 1.00 0.00 H new ATOM 0 HG2 GLU A 810 -4.832 -8.850 -5.182 1.00 0.00 H new ATOM 0 HG3 GLU A 810 -5.920 -10.195 -5.463 1.00 0.00 H new ATOM 416 N ASN A 811 -7.544 -9.073 -3.309 1.00 0.00 N ATOM 417 CA ASN A 811 -8.217 -10.052 -2.470 1.00 0.00 C ATOM 418 C ASN A 811 -9.567 -9.544 -1.976 1.00 0.00 C ATOM 419 O ASN A 811 -10.475 -10.335 -1.730 1.00 0.00 O ATOM 420 CB ASN A 811 -7.346 -10.461 -1.277 1.00 0.00 C ATOM 421 CG ASN A 811 -6.121 -11.256 -1.686 1.00 0.00 C ATOM 422 OD1 ASN A 811 -6.125 -11.949 -2.703 1.00 0.00 O ATOM 423 ND2 ASN A 811 -5.069 -11.181 -0.889 1.00 0.00 N ATOM 0 H ASN A 811 -6.636 -8.769 -2.958 1.00 0.00 H new ATOM 0 HA ASN A 811 -8.390 -10.929 -3.093 1.00 0.00 H new ATOM 0 HB2 ASN A 811 -7.030 -9.566 -0.741 1.00 0.00 H new ATOM 0 HB3 ASN A 811 -7.943 -11.054 -0.584 1.00 0.00 H new ATOM 0 HD21 ASN A 811 -4.224 -11.708 -1.109 1.00 0.00 H new ATOM 0 HD22 ASN A 811 -5.102 -10.596 -0.054 1.00 0.00 H new ATOM 430 N ILE A 812 -9.709 -8.226 -1.848 1.00 0.00 N ATOM 431 CA ILE A 812 -10.980 -7.637 -1.434 1.00 0.00 C ATOM 432 C ILE A 812 -12.076 -7.970 -2.447 1.00 0.00 C ATOM 433 O ILE A 812 -13.224 -8.218 -2.076 1.00 0.00 O ATOM 434 CB ILE A 812 -10.889 -6.097 -1.251 1.00 0.00 C ATOM 435 CG1 ILE A 812 -10.102 -5.734 0.013 1.00 0.00 C ATOM 436 CG2 ILE A 812 -12.273 -5.465 -1.192 1.00 0.00 C ATOM 437 CD1 ILE A 812 -8.606 -5.876 -0.128 1.00 0.00 C ATOM 0 H ILE A 812 -8.965 -7.550 -2.024 1.00 0.00 H new ATOM 0 HA ILE A 812 -11.228 -8.070 -0.465 1.00 0.00 H new ATOM 0 HB ILE A 812 -10.361 -5.702 -2.119 1.00 0.00 H new ATOM 0 HG12 ILE A 812 -10.334 -4.705 0.289 1.00 0.00 H new ATOM 0 HG13 ILE A 812 -10.440 -6.368 0.833 1.00 0.00 H new ATOM 0 HG21 ILE A 812 -12.176 -4.387 -1.063 1.00 0.00 H new ATOM 0 HG22 ILE A 812 -12.808 -5.673 -2.119 1.00 0.00 H new ATOM 0 HG23 ILE A 812 -12.828 -5.882 -0.351 1.00 0.00 H new ATOM 0 HD11 ILE A 812 -8.124 -5.600 0.810 1.00 0.00 H new ATOM 0 HD12 ILE A 812 -8.360 -6.909 -0.372 1.00 0.00 H new ATOM 0 HD13 ILE A 812 -8.252 -5.221 -0.924 1.00 0.00 H new ATOM 449 N PHE A 813 -11.707 -8.006 -3.722 1.00 0.00 N ATOM 450 CA PHE A 813 -12.658 -8.309 -4.783 1.00 0.00 C ATOM 451 C PHE A 813 -12.972 -9.800 -4.811 1.00 0.00 C ATOM 452 O PHE A 813 -14.065 -10.209 -5.201 1.00 0.00 O ATOM 453 CB PHE A 813 -12.110 -7.862 -6.140 1.00 0.00 C ATOM 454 CG PHE A 813 -11.918 -6.375 -6.248 1.00 0.00 C ATOM 455 CD1 PHE A 813 -12.968 -5.556 -6.631 1.00 0.00 C ATOM 456 CD2 PHE A 813 -10.691 -5.798 -5.970 1.00 0.00 C ATOM 457 CE1 PHE A 813 -12.799 -4.190 -6.732 1.00 0.00 C ATOM 458 CE2 PHE A 813 -10.515 -4.431 -6.071 1.00 0.00 C ATOM 459 CZ PHE A 813 -11.570 -3.626 -6.451 1.00 0.00 C ATOM 0 H PHE A 813 -10.756 -7.829 -4.046 1.00 0.00 H new ATOM 0 HA PHE A 813 -13.579 -7.762 -4.581 1.00 0.00 H new ATOM 0 HB2 PHE A 813 -11.156 -8.358 -6.319 1.00 0.00 H new ATOM 0 HB3 PHE A 813 -12.792 -8.190 -6.924 1.00 0.00 H new ATOM 0 HD1 PHE A 813 -13.931 -5.992 -6.853 1.00 0.00 H new ATOM 0 HD2 PHE A 813 -9.862 -6.423 -5.671 1.00 0.00 H new ATOM 0 HE1 PHE A 813 -13.626 -3.563 -7.030 1.00 0.00 H new ATOM 0 HE2 PHE A 813 -9.552 -3.993 -5.853 1.00 0.00 H new ATOM 0 HZ PHE A 813 -11.435 -2.557 -6.528 1.00 0.00 H new ATOM 469 N SER A 814 -12.016 -10.606 -4.379 1.00 0.00 N ATOM 470 CA SER A 814 -12.197 -12.046 -4.327 1.00 0.00 C ATOM 471 C SER A 814 -13.063 -12.424 -3.129 1.00 0.00 C ATOM 472 O SER A 814 -13.933 -13.288 -3.219 1.00 0.00 O ATOM 473 CB SER A 814 -10.836 -12.731 -4.244 1.00 0.00 C ATOM 474 OG SER A 814 -9.962 -12.236 -5.246 1.00 0.00 O ATOM 0 H SER A 814 -11.103 -10.285 -4.058 1.00 0.00 H new ATOM 0 HA SER A 814 -12.703 -12.379 -5.233 1.00 0.00 H new ATOM 0 HB2 SER A 814 -10.399 -12.565 -3.259 1.00 0.00 H new ATOM 0 HB3 SER A 814 -10.958 -13.808 -4.361 1.00 0.00 H new ATOM 0 HG SER A 814 -9.094 -12.686 -5.175 1.00 0.00 H new ATOM 480 N SER A 815 -12.828 -11.752 -2.010 1.00 0.00 N ATOM 481 CA SER A 815 -13.592 -11.985 -0.794 1.00 0.00 C ATOM 482 C SER A 815 -14.915 -11.223 -0.826 1.00 0.00 C ATOM 483 O SER A 815 -15.737 -11.347 0.086 1.00 0.00 O ATOM 484 CB SER A 815 -12.768 -11.554 0.418 1.00 0.00 C ATOM 485 OG SER A 815 -11.494 -12.174 0.414 1.00 0.00 O ATOM 0 H SER A 815 -12.108 -11.035 -1.920 1.00 0.00 H new ATOM 0 HA SER A 815 -13.816 -13.049 -0.722 1.00 0.00 H new ATOM 0 HB2 SER A 815 -12.649 -10.471 0.414 1.00 0.00 H new ATOM 0 HB3 SER A 815 -13.299 -11.813 1.334 1.00 0.00 H new ATOM 0 HG SER A 815 -10.919 -11.736 -0.248 1.00 0.00 H new ATOM 491 N MET A 816 -15.110 -10.438 -1.884 1.00 0.00 N ATOM 492 CA MET A 816 -16.305 -9.616 -2.035 1.00 0.00 C ATOM 493 C MET A 816 -17.566 -10.465 -1.960 1.00 0.00 C ATOM 494 O MET A 816 -17.738 -11.417 -2.723 1.00 0.00 O ATOM 495 CB MET A 816 -16.260 -8.846 -3.353 1.00 0.00 C ATOM 496 CG MET A 816 -17.463 -7.945 -3.576 1.00 0.00 C ATOM 497 SD MET A 816 -17.249 -6.853 -4.991 1.00 0.00 S ATOM 498 CE MET A 816 -15.840 -5.889 -4.448 1.00 0.00 C ATOM 0 H MET A 816 -14.448 -10.355 -2.655 1.00 0.00 H new ATOM 0 HA MET A 816 -16.329 -8.901 -1.212 1.00 0.00 H new ATOM 0 HB2 MET A 816 -15.354 -8.240 -3.379 1.00 0.00 H new ATOM 0 HB3 MET A 816 -16.192 -9.557 -4.177 1.00 0.00 H new ATOM 0 HG2 MET A 816 -18.351 -8.559 -3.725 1.00 0.00 H new ATOM 0 HG3 MET A 816 -17.636 -7.347 -2.682 1.00 0.00 H new ATOM 0 HE1 MET A 816 -16.005 -4.838 -4.686 1.00 0.00 H new ATOM 0 HE2 MET A 816 -15.715 -6.002 -3.371 1.00 0.00 H new ATOM 0 HE3 MET A 816 -14.942 -6.240 -4.956 1.00 0.00 H new ATOM 508 N GLY A 817 -18.433 -10.110 -1.027 1.00 0.00 N ATOM 509 CA GLY A 817 -19.647 -10.863 -0.805 1.00 0.00 C ATOM 510 C GLY A 817 -19.863 -11.114 0.668 1.00 0.00 C ATOM 511 O GLY A 817 -20.992 -11.094 1.155 1.00 0.00 O ATOM 0 H GLY A 817 -18.315 -9.304 -0.413 1.00 0.00 H new ATOM 0 HA2 GLY A 817 -20.498 -10.318 -1.214 1.00 0.00 H new ATOM 0 HA3 GLY A 817 -19.593 -11.813 -1.336 1.00 0.00 H new ATOM 515 N ASP A 818 -18.768 -11.344 1.380 1.00 0.00 N ATOM 516 CA ASP A 818 -18.814 -11.513 2.824 1.00 0.00 C ATOM 517 C ASP A 818 -18.203 -10.300 3.504 1.00 0.00 C ATOM 518 O ASP A 818 -17.109 -9.858 3.141 1.00 0.00 O ATOM 519 CB ASP A 818 -18.077 -12.780 3.260 1.00 0.00 C ATOM 520 CG ASP A 818 -18.094 -12.957 4.767 1.00 0.00 C ATOM 521 OD1 ASP A 818 -19.039 -13.581 5.288 1.00 0.00 O ATOM 522 OD2 ASP A 818 -17.156 -12.486 5.439 1.00 0.00 O ATOM 0 H ASP A 818 -17.834 -11.418 0.978 1.00 0.00 H new ATOM 0 HA ASP A 818 -19.858 -11.611 3.120 1.00 0.00 H new ATOM 0 HB2 ASP A 818 -18.537 -13.648 2.788 1.00 0.00 H new ATOM 0 HB3 ASP A 818 -17.045 -12.737 2.912 1.00 0.00 H new ATOM 527 N ALA A 819 -18.908 -9.775 4.491 1.00 0.00 N ATOM 528 CA ALA A 819 -18.498 -8.557 5.168 1.00 0.00 C ATOM 529 C ALA A 819 -17.190 -8.751 5.929 1.00 0.00 C ATOM 530 O ALA A 819 -16.214 -8.033 5.694 1.00 0.00 O ATOM 531 CB ALA A 819 -19.605 -8.092 6.100 1.00 0.00 C ATOM 0 H ALA A 819 -19.776 -10.178 4.844 1.00 0.00 H new ATOM 0 HA ALA A 819 -18.320 -7.789 4.416 1.00 0.00 H new ATOM 0 HB1 ALA A 819 -19.294 -7.178 6.606 1.00 0.00 H new ATOM 0 HB2 ALA A 819 -20.509 -7.898 5.523 1.00 0.00 H new ATOM 0 HB3 ALA A 819 -19.807 -8.866 6.840 1.00 0.00 H new ATOM 537 N GLY A 820 -17.169 -9.733 6.819 1.00 0.00 N ATOM 538 CA GLY A 820 -15.994 -9.990 7.633 1.00 0.00 C ATOM 539 C GLY A 820 -14.735 -10.213 6.814 1.00 0.00 C ATOM 540 O GLY A 820 -13.662 -9.727 7.177 1.00 0.00 O ATOM 0 H GLY A 820 -17.952 -10.363 6.994 1.00 0.00 H new ATOM 0 HA2 GLY A 820 -15.836 -9.148 8.308 1.00 0.00 H new ATOM 0 HA3 GLY A 820 -16.175 -10.867 8.254 1.00 0.00 H new ATOM 544 N GLU A 821 -14.864 -10.945 5.712 1.00 0.00 N ATOM 545 CA GLU A 821 -13.727 -11.216 4.839 1.00 0.00 C ATOM 546 C GLU A 821 -13.170 -9.928 4.243 1.00 0.00 C ATOM 547 O GLU A 821 -11.968 -9.668 4.321 1.00 0.00 O ATOM 548 CB GLU A 821 -14.130 -12.170 3.711 1.00 0.00 C ATOM 549 CG GLU A 821 -14.526 -13.555 4.187 1.00 0.00 C ATOM 550 CD GLU A 821 -13.430 -14.227 4.984 1.00 0.00 C ATOM 551 OE1 GLU A 821 -12.432 -14.669 4.380 1.00 0.00 O ATOM 552 OE2 GLU A 821 -13.567 -14.329 6.218 1.00 0.00 O ATOM 0 H GLU A 821 -15.743 -11.360 5.403 1.00 0.00 H new ATOM 0 HA GLU A 821 -12.951 -11.683 5.445 1.00 0.00 H new ATOM 0 HB2 GLU A 821 -14.964 -11.734 3.161 1.00 0.00 H new ATOM 0 HB3 GLU A 821 -13.299 -12.261 3.012 1.00 0.00 H new ATOM 0 HG2 GLU A 821 -15.425 -13.482 4.800 1.00 0.00 H new ATOM 0 HG3 GLU A 821 -14.777 -14.174 3.326 1.00 0.00 H new ATOM 559 N MET A 822 -14.052 -9.118 3.667 1.00 0.00 N ATOM 560 CA MET A 822 -13.645 -7.887 2.998 1.00 0.00 C ATOM 561 C MET A 822 -13.010 -6.905 3.977 1.00 0.00 C ATOM 562 O MET A 822 -11.999 -6.271 3.666 1.00 0.00 O ATOM 563 CB MET A 822 -14.847 -7.234 2.312 1.00 0.00 C ATOM 564 CG MET A 822 -15.396 -8.039 1.142 1.00 0.00 C ATOM 565 SD MET A 822 -16.919 -7.344 0.466 1.00 0.00 S ATOM 566 CE MET A 822 -16.386 -5.677 0.089 1.00 0.00 C ATOM 0 H MET A 822 -15.057 -9.293 3.650 1.00 0.00 H new ATOM 0 HA MET A 822 -12.899 -8.148 2.247 1.00 0.00 H new ATOM 0 HB2 MET A 822 -15.640 -7.091 3.046 1.00 0.00 H new ATOM 0 HB3 MET A 822 -14.558 -6.245 1.957 1.00 0.00 H new ATOM 0 HG2 MET A 822 -14.643 -8.087 0.355 1.00 0.00 H new ATOM 0 HG3 MET A 822 -15.582 -9.063 1.467 1.00 0.00 H new ATOM 0 HE1 MET A 822 -16.939 -5.304 -0.773 1.00 0.00 H new ATOM 0 HE2 MET A 822 -16.574 -5.032 0.947 1.00 0.00 H new ATOM 0 HE3 MET A 822 -15.320 -5.678 -0.137 1.00 0.00 H new ATOM 576 N VAL A 823 -13.596 -6.791 5.162 1.00 0.00 N ATOM 577 CA VAL A 823 -13.078 -5.888 6.183 1.00 0.00 C ATOM 578 C VAL A 823 -11.688 -6.326 6.645 1.00 0.00 C ATOM 579 O VAL A 823 -10.802 -5.494 6.849 1.00 0.00 O ATOM 580 CB VAL A 823 -14.029 -5.796 7.398 1.00 0.00 C ATOM 581 CG1 VAL A 823 -13.437 -4.918 8.492 1.00 0.00 C ATOM 582 CG2 VAL A 823 -15.386 -5.260 6.972 1.00 0.00 C ATOM 0 H VAL A 823 -14.428 -7.311 5.440 1.00 0.00 H new ATOM 0 HA VAL A 823 -13.006 -4.899 5.730 1.00 0.00 H new ATOM 0 HB VAL A 823 -14.158 -6.801 7.800 1.00 0.00 H new ATOM 0 HG11 VAL A 823 -14.127 -4.871 9.334 1.00 0.00 H new ATOM 0 HG12 VAL A 823 -12.488 -5.340 8.823 1.00 0.00 H new ATOM 0 HG13 VAL A 823 -13.271 -3.914 8.103 1.00 0.00 H new ATOM 0 HG21 VAL A 823 -16.043 -5.202 7.840 1.00 0.00 H new ATOM 0 HG22 VAL A 823 -15.266 -4.266 6.541 1.00 0.00 H new ATOM 0 HG23 VAL A 823 -15.824 -5.927 6.230 1.00 0.00 H new ATOM 592 N ARG A 824 -11.490 -7.633 6.778 1.00 0.00 N ATOM 593 CA ARG A 824 -10.210 -8.161 7.235 1.00 0.00 C ATOM 594 C ARG A 824 -9.108 -7.844 6.236 1.00 0.00 C ATOM 595 O ARG A 824 -8.007 -7.458 6.622 1.00 0.00 O ATOM 596 CB ARG A 824 -10.289 -9.672 7.460 1.00 0.00 C ATOM 597 CG ARG A 824 -9.047 -10.251 8.121 1.00 0.00 C ATOM 598 CD ARG A 824 -9.218 -11.725 8.448 1.00 0.00 C ATOM 599 NE ARG A 824 -9.246 -12.563 7.251 1.00 0.00 N ATOM 600 CZ ARG A 824 -10.345 -13.135 6.766 1.00 0.00 C ATOM 601 NH1 ARG A 824 -11.524 -12.915 7.336 1.00 0.00 N ATOM 602 NH2 ARG A 824 -10.266 -13.921 5.703 1.00 0.00 N ATOM 0 H ARG A 824 -12.195 -8.342 6.577 1.00 0.00 H new ATOM 0 HA ARG A 824 -9.974 -7.680 8.184 1.00 0.00 H new ATOM 0 HB2 ARG A 824 -11.158 -9.895 8.079 1.00 0.00 H new ATOM 0 HB3 ARG A 824 -10.445 -10.167 6.501 1.00 0.00 H new ATOM 0 HG2 ARG A 824 -8.190 -10.122 7.460 1.00 0.00 H new ATOM 0 HG3 ARG A 824 -8.831 -9.698 9.035 1.00 0.00 H new ATOM 0 HD2 ARG A 824 -8.402 -12.048 9.095 1.00 0.00 H new ATOM 0 HD3 ARG A 824 -10.143 -11.865 9.008 1.00 0.00 H new ATOM 0 HE ARG A 824 -8.368 -12.719 6.756 1.00 0.00 H new ATOM 0 HH11 ARG A 824 -11.591 -12.305 8.150 1.00 0.00 H new ATOM 0 HH12 ARG A 824 -12.363 -13.356 6.959 1.00 0.00 H new ATOM 0 HH21 ARG A 824 -9.364 -14.087 5.257 1.00 0.00 H new ATOM 0 HH22 ARG A 824 -11.108 -14.360 5.330 1.00 0.00 H new ATOM 616 N GLN A 825 -9.415 -7.992 4.952 1.00 0.00 N ATOM 617 CA GLN A 825 -8.443 -7.718 3.898 1.00 0.00 C ATOM 618 C GLN A 825 -8.011 -6.253 3.931 1.00 0.00 C ATOM 619 O GLN A 825 -6.830 -5.939 3.780 1.00 0.00 O ATOM 620 CB GLN A 825 -9.026 -8.059 2.526 1.00 0.00 C ATOM 621 CG GLN A 825 -9.430 -9.517 2.371 1.00 0.00 C ATOM 622 CD GLN A 825 -8.277 -10.477 2.600 1.00 0.00 C ATOM 623 OE1 GLN A 825 -7.117 -10.156 2.344 1.00 0.00 O ATOM 624 NE2 GLN A 825 -8.593 -11.667 3.082 1.00 0.00 N ATOM 0 H GLN A 825 -10.327 -8.300 4.615 1.00 0.00 H new ATOM 0 HA GLN A 825 -7.569 -8.345 4.074 1.00 0.00 H new ATOM 0 HB2 GLN A 825 -9.898 -7.430 2.346 1.00 0.00 H new ATOM 0 HB3 GLN A 825 -8.292 -7.813 1.759 1.00 0.00 H new ATOM 0 HG2 GLN A 825 -10.230 -9.744 3.075 1.00 0.00 H new ATOM 0 HG3 GLN A 825 -9.833 -9.673 1.370 1.00 0.00 H new ATOM 0 HE21 GLN A 825 -9.567 -11.894 3.281 1.00 0.00 H new ATOM 0 HE22 GLN A 825 -7.863 -12.358 3.255 1.00 0.00 H new ATOM 633 N ALA A 826 -8.974 -5.364 4.139 1.00 0.00 N ATOM 634 CA ALA A 826 -8.688 -3.939 4.261 1.00 0.00 C ATOM 635 C ALA A 826 -7.800 -3.666 5.471 1.00 0.00 C ATOM 636 O ALA A 826 -6.883 -2.845 5.410 1.00 0.00 O ATOM 637 CB ALA A 826 -9.983 -3.148 4.369 1.00 0.00 C ATOM 0 H ALA A 826 -9.961 -5.604 4.227 1.00 0.00 H new ATOM 0 HA ALA A 826 -8.154 -3.620 3.366 1.00 0.00 H new ATOM 0 HB1 ALA A 826 -9.754 -2.086 4.460 1.00 0.00 H new ATOM 0 HB2 ALA A 826 -10.587 -3.314 3.477 1.00 0.00 H new ATOM 0 HB3 ALA A 826 -10.537 -3.476 5.248 1.00 0.00 H new ATOM 643 N ARG A 827 -8.075 -4.363 6.567 1.00 0.00 N ATOM 644 CA ARG A 827 -7.281 -4.226 7.784 1.00 0.00 C ATOM 645 C ARG A 827 -5.854 -4.712 7.554 1.00 0.00 C ATOM 646 O ARG A 827 -4.897 -4.108 8.042 1.00 0.00 O ATOM 647 CB ARG A 827 -7.932 -4.999 8.932 1.00 0.00 C ATOM 648 CG ARG A 827 -9.248 -4.397 9.393 1.00 0.00 C ATOM 649 CD ARG A 827 -9.954 -5.286 10.404 1.00 0.00 C ATOM 650 NE ARG A 827 -9.146 -5.525 11.600 1.00 0.00 N ATOM 651 CZ ARG A 827 -9.659 -5.845 12.787 1.00 0.00 C ATOM 652 NH1 ARG A 827 -10.976 -5.894 12.955 1.00 0.00 N ATOM 653 NH2 ARG A 827 -8.853 -6.096 13.811 1.00 0.00 N ATOM 0 H ARG A 827 -8.843 -5.030 6.639 1.00 0.00 H new ATOM 0 HA ARG A 827 -7.242 -3.170 8.053 1.00 0.00 H new ATOM 0 HB2 ARG A 827 -8.102 -6.028 8.617 1.00 0.00 H new ATOM 0 HB3 ARG A 827 -7.242 -5.034 9.775 1.00 0.00 H new ATOM 0 HG2 ARG A 827 -9.064 -3.418 9.836 1.00 0.00 H new ATOM 0 HG3 ARG A 827 -9.897 -4.240 8.532 1.00 0.00 H new ATOM 0 HD2 ARG A 827 -10.898 -4.823 10.693 1.00 0.00 H new ATOM 0 HD3 ARG A 827 -10.197 -6.240 9.937 1.00 0.00 H new ATOM 0 HE ARG A 827 -8.133 -5.442 11.520 1.00 0.00 H new ATOM 0 HH11 ARG A 827 -11.598 -5.686 12.174 1.00 0.00 H new ATOM 0 HH12 ARG A 827 -11.365 -6.139 13.865 1.00 0.00 H new ATOM 0 HH21 ARG A 827 -7.842 -6.044 13.689 1.00 0.00 H new ATOM 0 HH22 ARG A 827 -9.245 -6.341 14.720 1.00 0.00 H new ATOM 667 N ILE A 828 -5.717 -5.795 6.796 1.00 0.00 N ATOM 668 CA ILE A 828 -4.405 -6.304 6.415 1.00 0.00 C ATOM 669 C ILE A 828 -3.659 -5.257 5.591 1.00 0.00 C ATOM 670 O ILE A 828 -2.473 -5.002 5.817 1.00 0.00 O ATOM 671 CB ILE A 828 -4.513 -7.619 5.611 1.00 0.00 C ATOM 672 CG1 ILE A 828 -5.191 -8.703 6.456 1.00 0.00 C ATOM 673 CG2 ILE A 828 -3.136 -8.087 5.154 1.00 0.00 C ATOM 674 CD1 ILE A 828 -5.454 -9.992 5.703 1.00 0.00 C ATOM 0 H ILE A 828 -6.500 -6.338 6.433 1.00 0.00 H new ATOM 0 HA ILE A 828 -3.853 -6.515 7.331 1.00 0.00 H new ATOM 0 HB ILE A 828 -5.121 -7.432 4.726 1.00 0.00 H new ATOM 0 HG12 ILE A 828 -4.565 -8.920 7.321 1.00 0.00 H new ATOM 0 HG13 ILE A 828 -6.137 -8.316 6.836 1.00 0.00 H new ATOM 0 HG21 ILE A 828 -3.236 -9.014 4.590 1.00 0.00 H new ATOM 0 HG22 ILE A 828 -2.684 -7.324 4.521 1.00 0.00 H new ATOM 0 HG23 ILE A 828 -2.502 -8.258 6.024 1.00 0.00 H new ATOM 0 HD11 ILE A 828 -5.935 -10.710 6.367 1.00 0.00 H new ATOM 0 HD12 ILE A 828 -6.106 -9.790 4.853 1.00 0.00 H new ATOM 0 HD13 ILE A 828 -4.510 -10.404 5.346 1.00 0.00 H new ATOM 686 N LEU A 829 -4.369 -4.639 4.649 1.00 0.00 N ATOM 687 CA LEU A 829 -3.804 -3.560 3.846 1.00 0.00 C ATOM 688 C LEU A 829 -3.321 -2.418 4.727 1.00 0.00 C ATOM 689 O LEU A 829 -2.219 -1.915 4.541 1.00 0.00 O ATOM 690 CB LEU A 829 -4.830 -3.025 2.843 1.00 0.00 C ATOM 691 CG LEU A 829 -5.100 -3.922 1.638 1.00 0.00 C ATOM 692 CD1 LEU A 829 -6.161 -3.295 0.749 1.00 0.00 C ATOM 693 CD2 LEU A 829 -3.819 -4.155 0.852 1.00 0.00 C ATOM 0 H LEU A 829 -5.337 -4.868 4.424 1.00 0.00 H new ATOM 0 HA LEU A 829 -2.955 -3.974 3.301 1.00 0.00 H new ATOM 0 HB2 LEU A 829 -5.771 -2.857 3.367 1.00 0.00 H new ATOM 0 HB3 LEU A 829 -4.488 -2.055 2.482 1.00 0.00 H new ATOM 0 HG LEU A 829 -5.465 -4.886 1.993 1.00 0.00 H new ATOM 0 HD11 LEU A 829 -6.347 -3.942 -0.108 1.00 0.00 H new ATOM 0 HD12 LEU A 829 -7.083 -3.170 1.316 1.00 0.00 H new ATOM 0 HD13 LEU A 829 -5.815 -2.322 0.400 1.00 0.00 H new ATOM 0 HD21 LEU A 829 -4.029 -4.797 -0.004 1.00 0.00 H new ATOM 0 HD22 LEU A 829 -3.428 -3.200 0.502 1.00 0.00 H new ATOM 0 HD23 LEU A 829 -3.081 -4.636 1.494 1.00 0.00 H new ATOM 705 N ALA A 830 -4.151 -2.020 5.685 1.00 0.00 N ATOM 706 CA ALA A 830 -3.805 -0.938 6.599 1.00 0.00 C ATOM 707 C ALA A 830 -2.528 -1.261 7.368 1.00 0.00 C ATOM 708 O ALA A 830 -1.632 -0.424 7.482 1.00 0.00 O ATOM 709 CB ALA A 830 -4.953 -0.672 7.562 1.00 0.00 C ATOM 0 H ALA A 830 -5.070 -2.431 5.849 1.00 0.00 H new ATOM 0 HA ALA A 830 -3.627 -0.038 6.010 1.00 0.00 H new ATOM 0 HB1 ALA A 830 -4.680 0.138 8.238 1.00 0.00 H new ATOM 0 HB2 ALA A 830 -5.843 -0.391 6.999 1.00 0.00 H new ATOM 0 HB3 ALA A 830 -5.159 -1.573 8.140 1.00 0.00 H new ATOM 715 N GLN A 831 -2.448 -2.485 7.871 1.00 0.00 N ATOM 716 CA GLN A 831 -1.282 -2.934 8.621 1.00 0.00 C ATOM 717 C GLN A 831 -0.036 -2.945 7.734 1.00 0.00 C ATOM 718 O GLN A 831 1.025 -2.455 8.126 1.00 0.00 O ATOM 719 CB GLN A 831 -1.534 -4.331 9.187 1.00 0.00 C ATOM 720 CG GLN A 831 -0.406 -4.857 10.057 1.00 0.00 C ATOM 721 CD GLN A 831 -0.635 -6.288 10.484 1.00 0.00 C ATOM 722 OE1 GLN A 831 -1.245 -6.554 11.520 1.00 0.00 O ATOM 723 NE2 GLN A 831 -0.153 -7.224 9.689 1.00 0.00 N ATOM 0 H GLN A 831 -3.180 -3.188 7.773 1.00 0.00 H new ATOM 0 HA GLN A 831 -1.111 -2.238 9.443 1.00 0.00 H new ATOM 0 HB2 GLN A 831 -2.453 -4.314 9.772 1.00 0.00 H new ATOM 0 HB3 GLN A 831 -1.695 -5.023 8.361 1.00 0.00 H new ATOM 0 HG2 GLN A 831 0.534 -4.789 9.510 1.00 0.00 H new ATOM 0 HG3 GLN A 831 -0.307 -4.227 10.941 1.00 0.00 H new ATOM 0 HE21 GLN A 831 0.347 -6.963 8.839 1.00 0.00 H new ATOM 0 HE22 GLN A 831 -0.280 -8.208 9.924 1.00 0.00 H new ATOM 732 N ALA A 832 -0.178 -3.503 6.537 1.00 0.00 N ATOM 733 CA ALA A 832 0.926 -3.583 5.590 1.00 0.00 C ATOM 734 C ALA A 832 1.356 -2.199 5.125 1.00 0.00 C ATOM 735 O ALA A 832 2.547 -1.912 5.012 1.00 0.00 O ATOM 736 CB ALA A 832 0.529 -4.435 4.399 1.00 0.00 C ATOM 0 H ALA A 832 -1.051 -3.908 6.199 1.00 0.00 H new ATOM 0 HA ALA A 832 1.773 -4.046 6.096 1.00 0.00 H new ATOM 0 HB1 ALA A 832 1.361 -4.489 3.697 1.00 0.00 H new ATOM 0 HB2 ALA A 832 0.275 -5.439 4.738 1.00 0.00 H new ATOM 0 HB3 ALA A 832 -0.335 -3.990 3.905 1.00 0.00 H new ATOM 742 N THR A 833 0.378 -1.342 4.870 1.00 0.00 N ATOM 743 CA THR A 833 0.654 0.015 4.432 1.00 0.00 C ATOM 744 C THR A 833 1.404 0.789 5.510 1.00 0.00 C ATOM 745 O THR A 833 2.280 1.599 5.209 1.00 0.00 O ATOM 746 CB THR A 833 -0.645 0.766 4.071 1.00 0.00 C ATOM 747 OG1 THR A 833 -1.315 0.103 2.991 1.00 0.00 O ATOM 748 CG2 THR A 833 -0.357 2.205 3.687 1.00 0.00 C ATOM 0 H THR A 833 -0.614 -1.564 4.959 1.00 0.00 H new ATOM 0 HA THR A 833 1.276 -0.054 3.539 1.00 0.00 H new ATOM 0 HB THR A 833 -1.288 0.767 4.951 1.00 0.00 H new ATOM 0 HG1 THR A 833 -1.665 -0.758 3.302 1.00 0.00 H new ATOM 0 HG21 THR A 833 -1.291 2.709 3.438 1.00 0.00 H new ATOM 0 HG22 THR A 833 0.119 2.716 4.523 1.00 0.00 H new ATOM 0 HG23 THR A 833 0.308 2.225 2.823 1.00 0.00 H new ATOM 756 N SER A 834 1.082 0.506 6.766 1.00 0.00 N ATOM 757 CA SER A 834 1.690 1.214 7.890 1.00 0.00 C ATOM 758 C SER A 834 3.200 0.998 7.914 1.00 0.00 C ATOM 759 O SER A 834 3.957 1.893 8.292 1.00 0.00 O ATOM 760 CB SER A 834 1.062 0.765 9.209 1.00 0.00 C ATOM 761 OG SER A 834 -0.306 1.136 9.272 1.00 0.00 O ATOM 0 H SER A 834 0.404 -0.208 7.034 1.00 0.00 H new ATOM 0 HA SER A 834 1.501 2.280 7.763 1.00 0.00 H new ATOM 0 HB2 SER A 834 1.154 -0.316 9.311 1.00 0.00 H new ATOM 0 HB3 SER A 834 1.602 1.211 10.044 1.00 0.00 H new ATOM 0 HG SER A 834 -0.828 0.563 8.673 1.00 0.00 H new ATOM 767 N ASP A 835 3.629 -0.185 7.485 1.00 0.00 N ATOM 768 CA ASP A 835 5.051 -0.490 7.387 1.00 0.00 C ATOM 769 C ASP A 835 5.711 0.444 6.382 1.00 0.00 C ATOM 770 O ASP A 835 6.716 1.086 6.683 1.00 0.00 O ATOM 771 CB ASP A 835 5.259 -1.947 6.963 1.00 0.00 C ATOM 772 CG ASP A 835 6.719 -2.358 6.989 1.00 0.00 C ATOM 773 OD1 ASP A 835 7.199 -2.825 8.041 1.00 0.00 O ATOM 774 OD2 ASP A 835 7.398 -2.200 5.951 1.00 0.00 O ATOM 0 H ASP A 835 3.013 -0.946 7.200 1.00 0.00 H new ATOM 0 HA ASP A 835 5.508 -0.345 8.366 1.00 0.00 H new ATOM 0 HB2 ASP A 835 4.690 -2.599 7.625 1.00 0.00 H new ATOM 0 HB3 ASP A 835 4.863 -2.089 5.958 1.00 0.00 H new ATOM 779 N LEU A 836 5.112 0.542 5.199 1.00 0.00 N ATOM 780 CA LEU A 836 5.626 1.408 4.145 1.00 0.00 C ATOM 781 C LEU A 836 5.571 2.873 4.543 1.00 0.00 C ATOM 782 O LEU A 836 6.548 3.592 4.376 1.00 0.00 O ATOM 783 CB LEU A 836 4.857 1.197 2.841 1.00 0.00 C ATOM 784 CG LEU A 836 5.315 0.003 2.009 1.00 0.00 C ATOM 785 CD1 LEU A 836 4.435 -0.159 0.782 1.00 0.00 C ATOM 786 CD2 LEU A 836 6.769 0.175 1.601 1.00 0.00 C ATOM 0 H LEU A 836 4.267 0.030 4.946 1.00 0.00 H new ATOM 0 HA LEU A 836 6.670 1.136 3.991 1.00 0.00 H new ATOM 0 HB2 LEU A 836 3.800 1.073 3.076 1.00 0.00 H new ATOM 0 HB3 LEU A 836 4.945 2.099 2.235 1.00 0.00 H new ATOM 0 HG LEU A 836 5.227 -0.898 2.616 1.00 0.00 H new ATOM 0 HD11 LEU A 836 4.776 -1.015 0.200 1.00 0.00 H new ATOM 0 HD12 LEU A 836 3.403 -0.320 1.093 1.00 0.00 H new ATOM 0 HD13 LEU A 836 4.494 0.742 0.171 1.00 0.00 H new ATOM 0 HD21 LEU A 836 7.084 -0.683 1.008 1.00 0.00 H new ATOM 0 HD22 LEU A 836 6.876 1.084 1.009 1.00 0.00 H new ATOM 0 HD23 LEU A 836 7.391 0.248 2.493 1.00 0.00 H new ATOM 798 N VAL A 837 4.432 3.312 5.072 1.00 0.00 N ATOM 799 CA VAL A 837 4.267 4.706 5.477 1.00 0.00 C ATOM 800 C VAL A 837 5.406 5.140 6.393 1.00 0.00 C ATOM 801 O VAL A 837 6.026 6.182 6.176 1.00 0.00 O ATOM 802 CB VAL A 837 2.915 4.943 6.189 1.00 0.00 C ATOM 803 CG1 VAL A 837 2.818 6.366 6.722 1.00 0.00 C ATOM 804 CG2 VAL A 837 1.760 4.658 5.243 1.00 0.00 C ATOM 0 H VAL A 837 3.612 2.726 5.230 1.00 0.00 H new ATOM 0 HA VAL A 837 4.284 5.305 4.567 1.00 0.00 H new ATOM 0 HB VAL A 837 2.856 4.258 7.035 1.00 0.00 H new ATOM 0 HG11 VAL A 837 1.857 6.504 7.218 1.00 0.00 H new ATOM 0 HG12 VAL A 837 3.623 6.543 7.435 1.00 0.00 H new ATOM 0 HG13 VAL A 837 2.904 7.071 5.895 1.00 0.00 H new ATOM 0 HG21 VAL A 837 0.816 4.830 5.760 1.00 0.00 H new ATOM 0 HG22 VAL A 837 1.826 5.319 4.379 1.00 0.00 H new ATOM 0 HG23 VAL A 837 1.809 3.621 4.911 1.00 0.00 H new ATOM 814 N ASN A 838 5.702 4.319 7.388 1.00 0.00 N ATOM 815 CA ASN A 838 6.764 4.629 8.332 1.00 0.00 C ATOM 816 C ASN A 838 8.137 4.472 7.687 1.00 0.00 C ATOM 817 O ASN A 838 9.000 5.333 7.848 1.00 0.00 O ATOM 818 CB ASN A 838 6.655 3.749 9.581 1.00 0.00 C ATOM 819 CG ASN A 838 5.432 4.078 10.417 1.00 0.00 C ATOM 820 OD1 ASN A 838 4.971 5.220 10.449 1.00 0.00 O ATOM 821 ND2 ASN A 838 4.890 3.081 11.098 1.00 0.00 N ATOM 0 H ASN A 838 5.223 3.435 7.563 1.00 0.00 H new ATOM 0 HA ASN A 838 6.648 5.670 8.632 1.00 0.00 H new ATOM 0 HB2 ASN A 838 6.616 2.702 9.282 1.00 0.00 H new ATOM 0 HB3 ASN A 838 7.551 3.873 10.189 1.00 0.00 H new ATOM 0 HD21 ASN A 838 4.064 3.246 11.673 1.00 0.00 H new ATOM 0 HD22 ASN A 838 5.299 2.148 11.048 1.00 0.00 H new ATOM 828 N ALA A 839 8.330 3.388 6.940 1.00 0.00 N ATOM 829 CA ALA A 839 9.619 3.104 6.315 1.00 0.00 C ATOM 830 C ALA A 839 9.997 4.160 5.276 1.00 0.00 C ATOM 831 O ALA A 839 11.119 4.665 5.277 1.00 0.00 O ATOM 832 CB ALA A 839 9.609 1.723 5.680 1.00 0.00 C ATOM 0 H ALA A 839 7.609 2.691 6.753 1.00 0.00 H new ATOM 0 HA ALA A 839 10.373 3.131 7.101 1.00 0.00 H new ATOM 0 HB1 ALA A 839 10.577 1.528 5.219 1.00 0.00 H new ATOM 0 HB2 ALA A 839 9.413 0.972 6.445 1.00 0.00 H new ATOM 0 HB3 ALA A 839 8.829 1.678 4.920 1.00 0.00 H new ATOM 838 N ILE A 840 9.055 4.494 4.395 1.00 0.00 N ATOM 839 CA ILE A 840 9.302 5.479 3.347 1.00 0.00 C ATOM 840 C ILE A 840 9.645 6.841 3.950 1.00 0.00 C ATOM 841 O ILE A 840 10.580 7.508 3.506 1.00 0.00 O ATOM 842 CB ILE A 840 8.088 5.623 2.397 1.00 0.00 C ATOM 843 CG1 ILE A 840 7.767 4.283 1.725 1.00 0.00 C ATOM 844 CG2 ILE A 840 8.358 6.685 1.343 1.00 0.00 C ATOM 845 CD1 ILE A 840 6.522 4.315 0.861 1.00 0.00 C ATOM 0 H ILE A 840 8.116 4.097 4.387 1.00 0.00 H new ATOM 0 HA ILE A 840 10.151 5.119 2.766 1.00 0.00 H new ATOM 0 HB ILE A 840 7.227 5.931 2.990 1.00 0.00 H new ATOM 0 HG12 ILE A 840 8.616 3.982 1.111 1.00 0.00 H new ATOM 0 HG13 ILE A 840 7.644 3.521 2.495 1.00 0.00 H new ATOM 0 HG21 ILE A 840 7.494 6.772 0.685 1.00 0.00 H new ATOM 0 HG22 ILE A 840 8.541 7.643 1.830 1.00 0.00 H new ATOM 0 HG23 ILE A 840 9.233 6.403 0.758 1.00 0.00 H new ATOM 0 HD11 ILE A 840 6.360 3.332 0.420 1.00 0.00 H new ATOM 0 HD12 ILE A 840 5.661 4.584 1.473 1.00 0.00 H new ATOM 0 HD13 ILE A 840 6.648 5.052 0.068 1.00 0.00 H new ATOM 857 N LYS A 841 8.901 7.239 4.977 1.00 0.00 N ATOM 858 CA LYS A 841 9.157 8.503 5.659 1.00 0.00 C ATOM 859 C LYS A 841 10.489 8.460 6.401 1.00 0.00 C ATOM 860 O LYS A 841 11.222 9.447 6.435 1.00 0.00 O ATOM 861 CB LYS A 841 8.029 8.825 6.638 1.00 0.00 C ATOM 862 CG LYS A 841 6.721 9.208 5.966 1.00 0.00 C ATOM 863 CD LYS A 841 5.636 9.466 6.997 1.00 0.00 C ATOM 864 CE LYS A 841 4.315 9.851 6.352 1.00 0.00 C ATOM 865 NZ LYS A 841 4.412 11.128 5.596 1.00 0.00 N ATOM 0 H LYS A 841 8.118 6.706 5.355 1.00 0.00 H new ATOM 0 HA LYS A 841 9.203 9.287 4.903 1.00 0.00 H new ATOM 0 HB2 LYS A 841 7.858 7.959 7.277 1.00 0.00 H new ATOM 0 HB3 LYS A 841 8.346 9.642 7.286 1.00 0.00 H new ATOM 0 HG2 LYS A 841 6.868 10.100 5.357 1.00 0.00 H new ATOM 0 HG3 LYS A 841 6.406 8.410 5.293 1.00 0.00 H new ATOM 0 HD2 LYS A 841 5.495 8.573 7.606 1.00 0.00 H new ATOM 0 HD3 LYS A 841 5.957 10.262 7.669 1.00 0.00 H new ATOM 0 HE2 LYS A 841 3.995 9.055 5.679 1.00 0.00 H new ATOM 0 HE3 LYS A 841 3.549 9.944 7.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 841 3.460 11.439 5.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 841 4.852 11.854 6.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 841 4.992 10.984 4.745 1.00 0.00 H new ATOM 879 N ALA A 842 10.796 7.307 6.985 1.00 0.00 N ATOM 880 CA ALA A 842 12.044 7.127 7.714 1.00 0.00 C ATOM 881 C ALA A 842 13.238 7.289 6.786 1.00 0.00 C ATOM 882 O ALA A 842 14.251 7.884 7.157 1.00 0.00 O ATOM 883 CB ALA A 842 12.075 5.762 8.383 1.00 0.00 C ATOM 0 H ALA A 842 10.196 6.482 6.967 1.00 0.00 H new ATOM 0 HA ALA A 842 12.103 7.895 8.485 1.00 0.00 H new ATOM 0 HB1 ALA A 842 13.014 5.643 8.924 1.00 0.00 H new ATOM 0 HB2 ALA A 842 11.242 5.680 9.081 1.00 0.00 H new ATOM 0 HB3 ALA A 842 11.992 4.983 7.625 1.00 0.00 H new ATOM 889 N ASP A 843 13.111 6.765 5.573 1.00 0.00 N ATOM 890 CA ASP A 843 14.171 6.886 4.582 1.00 0.00 C ATOM 891 C ASP A 843 14.254 8.316 4.069 1.00 0.00 C ATOM 892 O ASP A 843 15.336 8.812 3.762 1.00 0.00 O ATOM 893 CB ASP A 843 13.948 5.929 3.412 1.00 0.00 C ATOM 894 CG ASP A 843 15.132 5.901 2.466 1.00 0.00 C ATOM 895 OD1 ASP A 843 16.077 5.116 2.700 1.00 0.00 O ATOM 896 OD2 ASP A 843 15.121 6.660 1.473 1.00 0.00 O ATOM 0 H ASP A 843 12.288 6.254 5.254 1.00 0.00 H new ATOM 0 HA ASP A 843 15.111 6.622 5.067 1.00 0.00 H new ATOM 0 HB2 ASP A 843 13.766 4.925 3.795 1.00 0.00 H new ATOM 0 HB3 ASP A 843 13.054 6.228 2.865 1.00 0.00 H new ATOM 901 N ALA A 844 13.106 8.981 4.000 1.00 0.00 N ATOM 902 CA ALA A 844 13.046 10.374 3.574 1.00 0.00 C ATOM 903 C ALA A 844 13.795 11.275 4.552 1.00 0.00 C ATOM 904 O ALA A 844 14.274 12.348 4.180 1.00 0.00 O ATOM 905 CB ALA A 844 11.602 10.826 3.435 1.00 0.00 C ATOM 0 H ALA A 844 12.200 8.575 4.235 1.00 0.00 H new ATOM 0 HA ALA A 844 13.530 10.452 2.601 1.00 0.00 H new ATOM 0 HB1 ALA A 844 11.576 11.868 3.116 1.00 0.00 H new ATOM 0 HB2 ALA A 844 11.097 10.207 2.694 1.00 0.00 H new ATOM 0 HB3 ALA A 844 11.096 10.728 4.395 1.00 0.00 H new ATOM 911 N GLU A 845 13.892 10.832 5.801 1.00 0.00 N ATOM 912 CA GLU A 845 14.656 11.546 6.815 1.00 0.00 C ATOM 913 C GLU A 845 16.151 11.387 6.572 1.00 0.00 C ATOM 914 O GLU A 845 16.952 12.235 6.964 1.00 0.00 O ATOM 915 CB GLU A 845 14.308 11.036 8.215 1.00 0.00 C ATOM 916 CG GLU A 845 12.859 11.257 8.607 1.00 0.00 C ATOM 917 CD GLU A 845 12.444 12.707 8.496 1.00 0.00 C ATOM 918 OE1 GLU A 845 13.146 13.572 9.055 1.00 0.00 O ATOM 919 OE2 GLU A 845 11.406 12.988 7.860 1.00 0.00 O ATOM 0 H GLU A 845 13.448 9.977 6.136 1.00 0.00 H new ATOM 0 HA GLU A 845 14.395 12.602 6.748 1.00 0.00 H new ATOM 0 HB2 GLU A 845 14.530 9.970 8.268 1.00 0.00 H new ATOM 0 HB3 GLU A 845 14.951 11.532 8.942 1.00 0.00 H new ATOM 0 HG2 GLU A 845 12.217 10.649 7.970 1.00 0.00 H new ATOM 0 HG3 GLU A 845 12.707 10.916 9.631 1.00 0.00 H new ATOM 926 N GLY A 846 16.524 10.287 5.931 1.00 0.00 N ATOM 927 CA GLY A 846 17.916 10.039 5.626 1.00 0.00 C ATOM 928 C GLY A 846 18.282 10.521 4.239 1.00 0.00 C ATOM 929 O GLY A 846 19.460 10.692 3.919 1.00 0.00 O ATOM 0 H GLY A 846 15.882 9.560 5.616 1.00 0.00 H new ATOM 0 HA2 GLY A 846 18.544 10.540 6.362 1.00 0.00 H new ATOM 0 HA3 GLY A 846 18.121 8.971 5.706 1.00 0.00 H new ATOM 933 N GLU A 847 17.264 10.730 3.418 1.00 0.00 N ATOM 934 CA GLU A 847 17.451 11.217 2.065 1.00 0.00 C ATOM 935 C GLU A 847 17.951 12.658 2.084 1.00 0.00 C ATOM 936 O GLU A 847 17.285 13.552 2.608 1.00 0.00 O ATOM 937 CB GLU A 847 16.143 11.114 1.277 1.00 0.00 C ATOM 938 CG GLU A 847 16.264 11.571 -0.167 1.00 0.00 C ATOM 939 CD GLU A 847 17.372 10.857 -0.913 1.00 0.00 C ATOM 940 OE1 GLU A 847 18.519 11.354 -0.903 1.00 0.00 O ATOM 941 OE2 GLU A 847 17.103 9.799 -1.514 1.00 0.00 O ATOM 0 H GLU A 847 16.290 10.567 3.672 1.00 0.00 H new ATOM 0 HA GLU A 847 18.201 10.598 1.573 1.00 0.00 H new ATOM 0 HB2 GLU A 847 15.799 10.080 1.294 1.00 0.00 H new ATOM 0 HB3 GLU A 847 15.380 11.712 1.776 1.00 0.00 H new ATOM 0 HG2 GLU A 847 15.317 11.400 -0.679 1.00 0.00 H new ATOM 0 HG3 GLU A 847 16.449 12.645 -0.190 1.00 0.00 H new ATOM 948 N SER A 848 19.132 12.867 1.529 1.00 0.00 N ATOM 949 CA SER A 848 19.730 14.189 1.463 1.00 0.00 C ATOM 950 C SER A 848 19.210 14.957 0.250 1.00 0.00 C ATOM 951 O SER A 848 19.353 16.179 0.163 1.00 0.00 O ATOM 952 CB SER A 848 21.255 14.069 1.422 1.00 0.00 C ATOM 953 OG SER A 848 21.670 13.114 0.458 1.00 0.00 O ATOM 0 H SER A 848 19.701 12.129 1.113 1.00 0.00 H new ATOM 0 HA SER A 848 19.449 14.748 2.356 1.00 0.00 H new ATOM 0 HB2 SER A 848 21.692 15.040 1.188 1.00 0.00 H new ATOM 0 HB3 SER A 848 21.626 13.781 2.406 1.00 0.00 H new ATOM 0 HG SER A 848 22.648 13.059 0.452 1.00 0.00 H new ATOM 959 N ASP A 849 18.600 14.234 -0.682 1.00 0.00 N ATOM 960 CA ASP A 849 17.973 14.855 -1.843 1.00 0.00 C ATOM 961 C ASP A 849 16.632 15.425 -1.423 1.00 0.00 C ATOM 962 O ASP A 849 15.744 14.681 -1.018 1.00 0.00 O ATOM 963 CB ASP A 849 17.769 13.838 -2.967 1.00 0.00 C ATOM 964 CG ASP A 849 17.426 14.493 -4.289 1.00 0.00 C ATOM 965 OD1 ASP A 849 16.223 14.710 -4.545 1.00 0.00 O ATOM 966 OD2 ASP A 849 18.352 14.807 -5.069 1.00 0.00 O ATOM 0 H ASP A 849 18.526 13.217 -0.656 1.00 0.00 H new ATOM 0 HA ASP A 849 18.623 15.646 -2.217 1.00 0.00 H new ATOM 0 HB2 ASP A 849 18.676 13.244 -3.084 1.00 0.00 H new ATOM 0 HB3 ASP A 849 16.971 13.150 -2.689 1.00 0.00 H new ATOM 971 N LEU A 850 16.488 16.735 -1.496 1.00 0.00 N ATOM 972 CA LEU A 850 15.290 17.383 -0.992 1.00 0.00 C ATOM 973 C LEU A 850 14.064 16.990 -1.800 1.00 0.00 C ATOM 974 O LEU A 850 13.007 16.712 -1.238 1.00 0.00 O ATOM 975 CB LEU A 850 15.430 18.887 -1.003 1.00 0.00 C ATOM 976 CG LEU A 850 14.333 19.597 -0.225 1.00 0.00 C ATOM 977 CD1 LEU A 850 14.289 19.089 1.209 1.00 0.00 C ATOM 978 CD2 LEU A 850 14.561 21.083 -0.249 1.00 0.00 C ATOM 0 H LEU A 850 17.180 17.368 -1.896 1.00 0.00 H new ATOM 0 HA LEU A 850 15.161 17.045 0.036 1.00 0.00 H new ATOM 0 HB2 LEU A 850 16.398 19.158 -0.583 1.00 0.00 H new ATOM 0 HB3 LEU A 850 15.421 19.239 -2.035 1.00 0.00 H new ATOM 0 HG LEU A 850 13.374 19.384 -0.696 1.00 0.00 H new ATOM 0 HD11 LEU A 850 13.499 19.606 1.754 1.00 0.00 H new ATOM 0 HD12 LEU A 850 14.089 18.018 1.209 1.00 0.00 H new ATOM 0 HD13 LEU A 850 15.247 19.279 1.692 1.00 0.00 H new ATOM 0 HD21 LEU A 850 13.770 21.582 0.311 1.00 0.00 H new ATOM 0 HD22 LEU A 850 15.526 21.310 0.205 1.00 0.00 H new ATOM 0 HD23 LEU A 850 14.553 21.436 -1.280 1.00 0.00 H new ATOM 990 N GLU A 851 14.211 16.959 -3.117 1.00 0.00 N ATOM 991 CA GLU A 851 13.103 16.615 -3.993 1.00 0.00 C ATOM 992 C GLU A 851 12.656 15.187 -3.744 1.00 0.00 C ATOM 993 O GLU A 851 11.464 14.916 -3.638 1.00 0.00 O ATOM 994 CB GLU A 851 13.494 16.787 -5.459 1.00 0.00 C ATOM 995 CG GLU A 851 13.963 18.188 -5.797 1.00 0.00 C ATOM 996 CD GLU A 851 12.990 19.242 -5.323 1.00 0.00 C ATOM 997 OE1 GLU A 851 11.918 19.382 -5.946 1.00 0.00 O ATOM 998 OE2 GLU A 851 13.300 19.943 -4.336 1.00 0.00 O ATOM 0 H GLU A 851 15.085 17.167 -3.600 1.00 0.00 H new ATOM 0 HA GLU A 851 12.277 17.291 -3.772 1.00 0.00 H new ATOM 0 HB2 GLU A 851 14.286 16.078 -5.702 1.00 0.00 H new ATOM 0 HB3 GLU A 851 12.639 16.537 -6.087 1.00 0.00 H new ATOM 0 HG2 GLU A 851 14.938 18.364 -5.341 1.00 0.00 H new ATOM 0 HG3 GLU A 851 14.095 18.276 -6.875 1.00 0.00 H new ATOM 1005 N ASN A 852 13.616 14.274 -3.636 1.00 0.00 N ATOM 1006 CA ASN A 852 13.295 12.882 -3.364 1.00 0.00 C ATOM 1007 C ASN A 852 12.751 12.739 -1.950 1.00 0.00 C ATOM 1008 O ASN A 852 11.882 11.913 -1.699 1.00 0.00 O ATOM 1009 CB ASN A 852 14.509 11.971 -3.550 1.00 0.00 C ATOM 1010 CG ASN A 852 14.118 10.503 -3.603 1.00 0.00 C ATOM 1011 OD1 ASN A 852 13.043 10.151 -4.091 1.00 0.00 O ATOM 1012 ND2 ASN A 852 14.977 9.636 -3.094 1.00 0.00 N ATOM 0 H ASN A 852 14.612 14.472 -3.732 1.00 0.00 H new ATOM 0 HA ASN A 852 12.535 12.573 -4.082 1.00 0.00 H new ATOM 0 HB2 ASN A 852 15.027 12.241 -4.470 1.00 0.00 H new ATOM 0 HB3 ASN A 852 15.210 12.130 -2.731 1.00 0.00 H new ATOM 0 HD21 ASN A 852 14.758 8.640 -3.097 1.00 0.00 H new ATOM 0 HD22 ASN A 852 15.858 9.964 -2.698 1.00 0.00 H new ATOM 1019 N SER A 853 13.248 13.561 -1.029 1.00 0.00 N ATOM 1020 CA SER A 853 12.740 13.558 0.337 1.00 0.00 C ATOM 1021 C SER A 853 11.276 13.985 0.326 1.00 0.00 C ATOM 1022 O SER A 853 10.421 13.328 0.923 1.00 0.00 O ATOM 1023 CB SER A 853 13.572 14.490 1.228 1.00 0.00 C ATOM 1024 OG SER A 853 13.183 14.400 2.591 1.00 0.00 O ATOM 0 H SER A 853 13.996 14.232 -1.203 1.00 0.00 H new ATOM 0 HA SER A 853 12.818 12.552 0.749 1.00 0.00 H new ATOM 0 HB2 SER A 853 14.628 14.237 1.134 1.00 0.00 H new ATOM 0 HB3 SER A 853 13.459 15.518 0.885 1.00 0.00 H new ATOM 0 HG SER A 853 13.652 13.652 3.016 1.00 0.00 H new ATOM 1030 N ARG A 854 10.992 15.077 -0.383 1.00 0.00 N ATOM 1031 CA ARG A 854 9.623 15.536 -0.572 1.00 0.00 C ATOM 1032 C ARG A 854 8.791 14.472 -1.283 1.00 0.00 C ATOM 1033 O ARG A 854 7.639 14.233 -0.927 1.00 0.00 O ATOM 1034 CB ARG A 854 9.586 16.836 -1.385 1.00 0.00 C ATOM 1035 CG ARG A 854 10.182 18.037 -0.669 1.00 0.00 C ATOM 1036 CD ARG A 854 9.794 19.331 -1.366 1.00 0.00 C ATOM 1037 NE ARG A 854 10.890 19.939 -2.118 1.00 0.00 N ATOM 1038 CZ ARG A 854 11.026 21.258 -2.282 1.00 0.00 C ATOM 1039 NH1 ARG A 854 10.188 22.101 -1.690 1.00 0.00 N ATOM 1040 NH2 ARG A 854 12.001 21.731 -3.038 1.00 0.00 N ATOM 0 H ARG A 854 11.696 15.659 -0.836 1.00 0.00 H new ATOM 0 HA ARG A 854 9.200 15.724 0.415 1.00 0.00 H new ATOM 0 HB2 ARG A 854 10.124 16.681 -2.320 1.00 0.00 H new ATOM 0 HB3 ARG A 854 8.551 17.059 -1.645 1.00 0.00 H new ATOM 0 HG2 ARG A 854 9.836 18.058 0.364 1.00 0.00 H new ATOM 0 HG3 ARG A 854 11.268 17.946 -0.640 1.00 0.00 H new ATOM 0 HD2 ARG A 854 8.964 19.134 -2.044 1.00 0.00 H new ATOM 0 HD3 ARG A 854 9.436 20.042 -0.622 1.00 0.00 H new ATOM 0 HE ARG A 854 11.587 19.325 -2.539 1.00 0.00 H new ATOM 0 HH11 ARG A 854 9.433 21.743 -1.105 1.00 0.00 H new ATOM 0 HH12 ARG A 854 10.299 23.106 -1.821 1.00 0.00 H new ATOM 0 HH21 ARG A 854 12.649 21.089 -3.496 1.00 0.00 H new ATOM 0 HH22 ARG A 854 12.106 22.738 -3.164 1.00 0.00 H new ATOM 1054 N LYS A 855 9.386 13.836 -2.284 1.00 0.00 N ATOM 1055 CA LYS A 855 8.699 12.826 -3.079 1.00 0.00 C ATOM 1056 C LYS A 855 8.382 11.585 -2.247 1.00 0.00 C ATOM 1057 O LYS A 855 7.288 11.033 -2.345 1.00 0.00 O ATOM 1058 CB LYS A 855 9.546 12.455 -4.301 1.00 0.00 C ATOM 1059 CG LYS A 855 8.841 11.538 -5.289 1.00 0.00 C ATOM 1060 CD LYS A 855 9.630 11.400 -6.583 1.00 0.00 C ATOM 1061 CE LYS A 855 10.973 10.719 -6.364 1.00 0.00 C ATOM 1062 NZ LYS A 855 10.819 9.272 -6.062 1.00 0.00 N ATOM 0 H LYS A 855 10.352 14.004 -2.566 1.00 0.00 H new ATOM 0 HA LYS A 855 7.752 13.245 -3.419 1.00 0.00 H new ATOM 0 HB2 LYS A 855 9.841 13.369 -4.817 1.00 0.00 H new ATOM 0 HB3 LYS A 855 10.462 11.971 -3.962 1.00 0.00 H new ATOM 0 HG2 LYS A 855 8.703 10.555 -4.839 1.00 0.00 H new ATOM 0 HG3 LYS A 855 7.848 11.931 -5.507 1.00 0.00 H new ATOM 0 HD2 LYS A 855 9.047 10.827 -7.304 1.00 0.00 H new ATOM 0 HD3 LYS A 855 9.791 12.387 -7.016 1.00 0.00 H new ATOM 0 HE2 LYS A 855 11.591 10.840 -7.254 1.00 0.00 H new ATOM 0 HE3 LYS A 855 11.498 11.207 -5.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 855 11.435 9.017 -5.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 855 9.829 9.073 -5.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 855 11.085 8.713 -6.897 1.00 0.00 H new ATOM 1076 N LEU A 856 9.333 11.155 -1.425 1.00 0.00 N ATOM 1077 CA LEU A 856 9.120 10.011 -0.546 1.00 0.00 C ATOM 1078 C LEU A 856 8.037 10.323 0.481 1.00 0.00 C ATOM 1079 O LEU A 856 7.160 9.498 0.744 1.00 0.00 O ATOM 1080 CB LEU A 856 10.422 9.606 0.155 1.00 0.00 C ATOM 1081 CG LEU A 856 11.516 9.058 -0.767 1.00 0.00 C ATOM 1082 CD1 LEU A 856 12.776 8.734 0.026 1.00 0.00 C ATOM 1083 CD2 LEU A 856 11.020 7.822 -1.508 1.00 0.00 C ATOM 0 H LEU A 856 10.257 11.580 -1.349 1.00 0.00 H new ATOM 0 HA LEU A 856 8.790 9.171 -1.158 1.00 0.00 H new ATOM 0 HB2 LEU A 856 10.816 10.474 0.684 1.00 0.00 H new ATOM 0 HB3 LEU A 856 10.191 8.852 0.907 1.00 0.00 H new ATOM 0 HG LEU A 856 11.761 9.826 -1.501 1.00 0.00 H new ATOM 0 HD11 LEU A 856 13.540 8.346 -0.648 1.00 0.00 H new ATOM 0 HD12 LEU A 856 13.144 9.639 0.510 1.00 0.00 H new ATOM 0 HD13 LEU A 856 12.546 7.985 0.784 1.00 0.00 H new ATOM 0 HD21 LEU A 856 11.810 7.446 -2.158 1.00 0.00 H new ATOM 0 HD22 LEU A 856 10.746 7.051 -0.787 1.00 0.00 H new ATOM 0 HD23 LEU A 856 10.149 8.083 -2.109 1.00 0.00 H new ATOM 1095 N LEU A 857 8.089 11.524 1.046 1.00 0.00 N ATOM 1096 CA LEU A 857 7.052 11.974 1.970 1.00 0.00 C ATOM 1097 C LEU A 857 5.704 12.016 1.264 1.00 0.00 C ATOM 1098 O LEU A 857 4.691 11.587 1.818 1.00 0.00 O ATOM 1099 CB LEU A 857 7.387 13.355 2.537 1.00 0.00 C ATOM 1100 CG LEU A 857 8.613 13.408 3.450 1.00 0.00 C ATOM 1101 CD1 LEU A 857 8.858 14.831 3.926 1.00 0.00 C ATOM 1102 CD2 LEU A 857 8.436 12.473 4.637 1.00 0.00 C ATOM 0 H LEU A 857 8.834 12.201 0.882 1.00 0.00 H new ATOM 0 HA LEU A 857 7.002 11.266 2.797 1.00 0.00 H new ATOM 0 HB2 LEU A 857 7.544 14.042 1.706 1.00 0.00 H new ATOM 0 HB3 LEU A 857 6.524 13.720 3.094 1.00 0.00 H new ATOM 0 HG LEU A 857 9.482 13.079 2.880 1.00 0.00 H new ATOM 0 HD11 LEU A 857 9.734 14.852 4.575 1.00 0.00 H new ATOM 0 HD12 LEU A 857 9.028 15.478 3.066 1.00 0.00 H new ATOM 0 HD13 LEU A 857 7.988 15.184 4.479 1.00 0.00 H new ATOM 0 HD21 LEU A 857 9.318 12.524 5.275 1.00 0.00 H new ATOM 0 HD22 LEU A 857 7.557 12.772 5.208 1.00 0.00 H new ATOM 0 HD23 LEU A 857 8.306 11.452 4.279 1.00 0.00 H new ATOM 1114 N SER A 858 5.711 12.522 0.035 1.00 0.00 N ATOM 1115 CA SER A 858 4.513 12.594 -0.787 1.00 0.00 C ATOM 1116 C SER A 858 3.952 11.196 -1.034 1.00 0.00 C ATOM 1117 O SER A 858 2.769 10.951 -0.810 1.00 0.00 O ATOM 1118 CB SER A 858 4.836 13.281 -2.120 1.00 0.00 C ATOM 1119 OG SER A 858 3.666 13.510 -2.891 1.00 0.00 O ATOM 0 H SER A 858 6.547 12.893 -0.417 1.00 0.00 H new ATOM 0 HA SER A 858 3.759 13.179 -0.260 1.00 0.00 H new ATOM 0 HB2 SER A 858 5.337 14.230 -1.928 1.00 0.00 H new ATOM 0 HB3 SER A 858 5.531 12.663 -2.689 1.00 0.00 H new ATOM 0 HG SER A 858 3.909 13.950 -3.732 1.00 0.00 H new ATOM 1125 N ALA A 859 4.817 10.282 -1.468 1.00 0.00 N ATOM 1126 CA ALA A 859 4.413 8.910 -1.759 1.00 0.00 C ATOM 1127 C ALA A 859 3.750 8.260 -0.548 1.00 0.00 C ATOM 1128 O ALA A 859 2.683 7.660 -0.666 1.00 0.00 O ATOM 1129 CB ALA A 859 5.612 8.089 -2.206 1.00 0.00 C ATOM 0 H ALA A 859 5.807 10.469 -1.626 1.00 0.00 H new ATOM 0 HA ALA A 859 3.683 8.940 -2.568 1.00 0.00 H new ATOM 0 HB1 ALA A 859 5.295 7.068 -2.419 1.00 0.00 H new ATOM 0 HB2 ALA A 859 6.041 8.531 -3.105 1.00 0.00 H new ATOM 0 HB3 ALA A 859 6.361 8.078 -1.414 1.00 0.00 H new ATOM 1135 N ALA A 860 4.382 8.395 0.614 1.00 0.00 N ATOM 1136 CA ALA A 860 3.846 7.828 1.845 1.00 0.00 C ATOM 1137 C ALA A 860 2.529 8.498 2.226 1.00 0.00 C ATOM 1138 O ALA A 860 1.595 7.840 2.683 1.00 0.00 O ATOM 1139 CB ALA A 860 4.857 7.962 2.971 1.00 0.00 C ATOM 0 H ALA A 860 5.265 8.892 0.728 1.00 0.00 H new ATOM 0 HA ALA A 860 3.649 6.769 1.676 1.00 0.00 H new ATOM 0 HB1 ALA A 860 4.443 7.534 3.884 1.00 0.00 H new ATOM 0 HB2 ALA A 860 5.771 7.432 2.704 1.00 0.00 H new ATOM 0 HB3 ALA A 860 5.083 9.016 3.134 1.00 0.00 H new ATOM 1145 N LYS A 861 2.467 9.811 2.026 1.00 0.00 N ATOM 1146 CA LYS A 861 1.266 10.591 2.312 1.00 0.00 C ATOM 1147 C LYS A 861 0.108 10.138 1.426 1.00 0.00 C ATOM 1148 O LYS A 861 -0.975 9.809 1.916 1.00 0.00 O ATOM 1149 CB LYS A 861 1.553 12.077 2.081 1.00 0.00 C ATOM 1150 CG LYS A 861 0.367 12.989 2.335 1.00 0.00 C ATOM 1151 CD LYS A 861 0.698 14.428 1.979 1.00 0.00 C ATOM 1152 CE LYS A 861 -0.471 15.359 2.259 1.00 0.00 C ATOM 1153 NZ LYS A 861 -0.776 15.450 3.709 1.00 0.00 N ATOM 0 H LYS A 861 3.244 10.363 1.663 1.00 0.00 H new ATOM 0 HA LYS A 861 0.984 10.434 3.353 1.00 0.00 H new ATOM 0 HB2 LYS A 861 2.375 12.381 2.728 1.00 0.00 H new ATOM 0 HB3 LYS A 861 1.889 12.215 1.053 1.00 0.00 H new ATOM 0 HG2 LYS A 861 -0.487 12.653 1.747 1.00 0.00 H new ATOM 0 HG3 LYS A 861 0.076 12.928 3.384 1.00 0.00 H new ATOM 0 HD2 LYS A 861 1.567 14.754 2.550 1.00 0.00 H new ATOM 0 HD3 LYS A 861 0.968 14.489 0.925 1.00 0.00 H new ATOM 0 HE2 LYS A 861 -0.243 16.353 1.874 1.00 0.00 H new ATOM 0 HE3 LYS A 861 -1.353 15.004 1.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 861 -1.447 16.227 3.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 861 -1.196 14.555 4.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 861 0.101 15.632 4.238 1.00 0.00 H new ATOM 1167 N ILE A 862 0.364 10.119 0.121 1.00 0.00 N ATOM 1168 CA ILE A 862 -0.622 9.702 -0.869 1.00 0.00 C ATOM 1169 C ILE A 862 -1.085 8.275 -0.602 1.00 0.00 C ATOM 1170 O ILE A 862 -2.282 7.973 -0.649 1.00 0.00 O ATOM 1171 CB ILE A 862 -0.034 9.792 -2.295 1.00 0.00 C ATOM 1172 CG1 ILE A 862 0.300 11.246 -2.642 1.00 0.00 C ATOM 1173 CG2 ILE A 862 -0.997 9.206 -3.320 1.00 0.00 C ATOM 1174 CD1 ILE A 862 1.037 11.404 -3.955 1.00 0.00 C ATOM 0 H ILE A 862 1.261 10.393 -0.279 1.00 0.00 H new ATOM 0 HA ILE A 862 -1.477 10.374 -0.791 1.00 0.00 H new ATOM 0 HB ILE A 862 0.885 9.206 -2.322 1.00 0.00 H new ATOM 0 HG12 ILE A 862 -0.624 11.822 -2.683 1.00 0.00 H new ATOM 0 HG13 ILE A 862 0.906 11.671 -1.842 1.00 0.00 H new ATOM 0 HG21 ILE A 862 -0.559 9.282 -4.315 1.00 0.00 H new ATOM 0 HG22 ILE A 862 -1.185 8.158 -3.085 1.00 0.00 H new ATOM 0 HG23 ILE A 862 -1.936 9.758 -3.294 1.00 0.00 H new ATOM 0 HD11 ILE A 862 1.239 12.460 -4.134 1.00 0.00 H new ATOM 0 HD12 ILE A 862 1.978 10.856 -3.912 1.00 0.00 H new ATOM 0 HD13 ILE A 862 0.425 11.010 -4.766 1.00 0.00 H new ATOM 1186 N LEU A 863 -0.128 7.405 -0.314 1.00 0.00 N ATOM 1187 CA LEU A 863 -0.419 6.017 -0.007 1.00 0.00 C ATOM 1188 C LEU A 863 -1.318 5.897 1.215 1.00 0.00 C ATOM 1189 O LEU A 863 -2.390 5.302 1.143 1.00 0.00 O ATOM 1190 CB LEU A 863 0.879 5.240 0.223 1.00 0.00 C ATOM 1191 CG LEU A 863 0.700 3.871 0.875 1.00 0.00 C ATOM 1192 CD1 LEU A 863 -0.328 3.051 0.115 1.00 0.00 C ATOM 1193 CD2 LEU A 863 2.030 3.145 0.956 1.00 0.00 C ATOM 0 H LEU A 863 0.864 7.641 -0.287 1.00 0.00 H new ATOM 0 HA LEU A 863 -0.946 5.591 -0.861 1.00 0.00 H new ATOM 0 HB2 LEU A 863 1.381 5.107 -0.735 1.00 0.00 H new ATOM 0 HB3 LEU A 863 1.539 5.841 0.848 1.00 0.00 H new ATOM 0 HG LEU A 863 0.332 4.013 1.891 1.00 0.00 H new ATOM 0 HD11 LEU A 863 -0.443 2.078 0.593 1.00 0.00 H new ATOM 0 HD12 LEU A 863 -1.285 3.573 0.119 1.00 0.00 H new ATOM 0 HD13 LEU A 863 0.005 2.912 -0.913 1.00 0.00 H new ATOM 0 HD21 LEU A 863 1.885 2.171 1.423 1.00 0.00 H new ATOM 0 HD22 LEU A 863 2.432 3.010 -0.048 1.00 0.00 H new ATOM 0 HD23 LEU A 863 2.729 3.732 1.551 1.00 0.00 H new ATOM 1205 N ALA A 864 -0.883 6.479 2.324 1.00 0.00 N ATOM 1206 CA ALA A 864 -1.607 6.372 3.584 1.00 0.00 C ATOM 1207 C ALA A 864 -3.050 6.840 3.438 1.00 0.00 C ATOM 1208 O ALA A 864 -3.943 6.362 4.140 1.00 0.00 O ATOM 1209 CB ALA A 864 -0.892 7.162 4.666 1.00 0.00 C ATOM 0 H ALA A 864 -0.028 7.033 2.377 1.00 0.00 H new ATOM 0 HA ALA A 864 -1.631 5.321 3.873 1.00 0.00 H new ATOM 0 HB1 ALA A 864 -1.442 7.075 5.603 1.00 0.00 H new ATOM 0 HB2 ALA A 864 0.116 6.768 4.798 1.00 0.00 H new ATOM 0 HB3 ALA A 864 -0.836 8.211 4.374 1.00 0.00 H new ATOM 1215 N ASP A 865 -3.278 7.759 2.510 1.00 0.00 N ATOM 1216 CA ASP A 865 -4.618 8.268 2.277 1.00 0.00 C ATOM 1217 C ASP A 865 -5.406 7.341 1.376 1.00 0.00 C ATOM 1218 O ASP A 865 -6.595 7.103 1.605 1.00 0.00 O ATOM 1219 CB ASP A 865 -4.574 9.677 1.680 1.00 0.00 C ATOM 1220 CG ASP A 865 -5.956 10.254 1.432 1.00 0.00 C ATOM 1221 OD1 ASP A 865 -6.551 10.820 2.372 1.00 0.00 O ATOM 1222 OD2 ASP A 865 -6.458 10.133 0.295 1.00 0.00 O ATOM 0 H ASP A 865 -2.558 8.163 1.912 1.00 0.00 H new ATOM 0 HA ASP A 865 -5.122 8.318 3.242 1.00 0.00 H new ATOM 0 HB2 ASP A 865 -4.026 10.335 2.354 1.00 0.00 H new ATOM 0 HB3 ASP A 865 -4.022 9.652 0.741 1.00 0.00 H new ATOM 1227 N ALA A 866 -4.743 6.804 0.366 1.00 0.00 N ATOM 1228 CA ALA A 866 -5.361 5.821 -0.502 1.00 0.00 C ATOM 1229 C ALA A 866 -5.837 4.635 0.325 1.00 0.00 C ATOM 1230 O ALA A 866 -6.897 4.068 0.064 1.00 0.00 O ATOM 1231 CB ALA A 866 -4.384 5.371 -1.574 1.00 0.00 C ATOM 0 H ALA A 866 -3.778 7.033 0.128 1.00 0.00 H new ATOM 0 HA ALA A 866 -6.221 6.272 -0.997 1.00 0.00 H new ATOM 0 HB1 ALA A 866 -4.864 4.633 -2.217 1.00 0.00 H new ATOM 0 HB2 ALA A 866 -4.079 6.230 -2.172 1.00 0.00 H new ATOM 0 HB3 ALA A 866 -3.507 4.927 -1.104 1.00 0.00 H new ATOM 1237 N THR A 867 -5.053 4.289 1.339 1.00 0.00 N ATOM 1238 CA THR A 867 -5.397 3.215 2.252 1.00 0.00 C ATOM 1239 C THR A 867 -6.594 3.587 3.120 1.00 0.00 C ATOM 1240 O THR A 867 -7.514 2.794 3.277 1.00 0.00 O ATOM 1241 CB THR A 867 -4.207 2.856 3.157 1.00 0.00 C ATOM 1242 OG1 THR A 867 -3.021 2.758 2.367 1.00 0.00 O ATOM 1243 CG2 THR A 867 -4.446 1.539 3.881 1.00 0.00 C ATOM 0 H THR A 867 -4.165 4.745 1.548 1.00 0.00 H new ATOM 0 HA THR A 867 -5.657 2.350 1.643 1.00 0.00 H new ATOM 0 HB THR A 867 -4.094 3.642 3.904 1.00 0.00 H new ATOM 0 HG1 THR A 867 -2.736 3.654 2.092 1.00 0.00 H new ATOM 0 HG21 THR A 867 -3.588 1.311 4.514 1.00 0.00 H new ATOM 0 HG22 THR A 867 -5.341 1.620 4.498 1.00 0.00 H new ATOM 0 HG23 THR A 867 -4.581 0.741 3.150 1.00 0.00 H new ATOM 1251 N ALA A 868 -6.579 4.795 3.676 1.00 0.00 N ATOM 1252 CA ALA A 868 -7.674 5.267 4.514 1.00 0.00 C ATOM 1253 C ALA A 868 -9.001 5.210 3.764 1.00 0.00 C ATOM 1254 O ALA A 868 -9.990 4.686 4.282 1.00 0.00 O ATOM 1255 CB ALA A 868 -7.398 6.681 4.997 1.00 0.00 C ATOM 0 H ALA A 868 -5.819 5.465 3.560 1.00 0.00 H new ATOM 0 HA ALA A 868 -7.747 4.609 5.380 1.00 0.00 H new ATOM 0 HB1 ALA A 868 -8.224 7.020 5.622 1.00 0.00 H new ATOM 0 HB2 ALA A 868 -6.476 6.694 5.577 1.00 0.00 H new ATOM 0 HB3 ALA A 868 -7.296 7.345 4.139 1.00 0.00 H new ATOM 1261 N LYS A 869 -9.012 5.733 2.539 1.00 0.00 N ATOM 1262 CA LYS A 869 -10.211 5.704 1.708 1.00 0.00 C ATOM 1263 C LYS A 869 -10.576 4.268 1.348 1.00 0.00 C ATOM 1264 O LYS A 869 -11.750 3.906 1.315 1.00 0.00 O ATOM 1265 CB LYS A 869 -10.012 6.515 0.424 1.00 0.00 C ATOM 1266 CG LYS A 869 -9.650 7.972 0.655 1.00 0.00 C ATOM 1267 CD LYS A 869 -9.687 8.768 -0.642 1.00 0.00 C ATOM 1268 CE LYS A 869 -8.747 8.191 -1.691 1.00 0.00 C ATOM 1269 NZ LYS A 869 -8.868 8.899 -2.992 1.00 0.00 N ATOM 0 H LYS A 869 -8.206 6.180 2.102 1.00 0.00 H new ATOM 0 HA LYS A 869 -11.022 6.151 2.283 1.00 0.00 H new ATOM 0 HB2 LYS A 869 -9.226 6.047 -0.169 1.00 0.00 H new ATOM 0 HB3 LYS A 869 -10.927 6.469 -0.166 1.00 0.00 H new ATOM 0 HG2 LYS A 869 -10.343 8.411 1.373 1.00 0.00 H new ATOM 0 HG3 LYS A 869 -8.654 8.036 1.094 1.00 0.00 H new ATOM 0 HD2 LYS A 869 -10.705 8.778 -1.033 1.00 0.00 H new ATOM 0 HD3 LYS A 869 -9.413 9.804 -0.440 1.00 0.00 H new ATOM 0 HE2 LYS A 869 -7.719 8.259 -1.335 1.00 0.00 H new ATOM 0 HE3 LYS A 869 -8.966 7.133 -1.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 869 -8.212 8.477 -3.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 869 -9.842 8.812 -3.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 869 -8.634 9.904 -2.863 1.00 0.00 H new ATOM 1283 N MET A 870 -9.556 3.463 1.074 1.00 0.00 N ATOM 1284 CA MET A 870 -9.738 2.057 0.734 1.00 0.00 C ATOM 1285 C MET A 870 -10.372 1.290 1.890 1.00 0.00 C ATOM 1286 O MET A 870 -11.396 0.628 1.727 1.00 0.00 O ATOM 1287 CB MET A 870 -8.382 1.443 0.373 1.00 0.00 C ATOM 1288 CG MET A 870 -8.390 -0.068 0.269 1.00 0.00 C ATOM 1289 SD MET A 870 -9.568 -0.676 -0.942 1.00 0.00 S ATOM 1290 CE MET A 870 -9.237 -2.426 -0.839 1.00 0.00 C ATOM 0 H MET A 870 -8.582 3.766 1.081 1.00 0.00 H new ATOM 0 HA MET A 870 -10.411 1.988 -0.121 1.00 0.00 H new ATOM 0 HB2 MET A 870 -8.049 1.859 -0.578 1.00 0.00 H new ATOM 0 HB3 MET A 870 -7.650 1.740 1.124 1.00 0.00 H new ATOM 0 HG2 MET A 870 -7.391 -0.415 0.003 1.00 0.00 H new ATOM 0 HG3 MET A 870 -8.626 -0.494 1.244 1.00 0.00 H new ATOM 0 HE1 MET A 870 -10.063 -2.979 -1.285 1.00 0.00 H new ATOM 0 HE2 MET A 870 -8.316 -2.654 -1.375 1.00 0.00 H new ATOM 0 HE3 MET A 870 -9.129 -2.715 0.206 1.00 0.00 H new ATOM 1300 N VAL A 871 -9.755 1.402 3.054 1.00 0.00 N ATOM 1301 CA VAL A 871 -10.188 0.684 4.240 1.00 0.00 C ATOM 1302 C VAL A 871 -11.619 1.051 4.627 1.00 0.00 C ATOM 1303 O VAL A 871 -12.453 0.168 4.829 1.00 0.00 O ATOM 1304 CB VAL A 871 -9.221 0.951 5.414 1.00 0.00 C ATOM 1305 CG1 VAL A 871 -9.772 0.424 6.725 1.00 0.00 C ATOM 1306 CG2 VAL A 871 -7.869 0.320 5.125 1.00 0.00 C ATOM 0 H VAL A 871 -8.938 1.995 3.203 1.00 0.00 H new ATOM 0 HA VAL A 871 -10.173 -0.381 4.009 1.00 0.00 H new ATOM 0 HB VAL A 871 -9.106 2.030 5.513 1.00 0.00 H new ATOM 0 HG11 VAL A 871 -9.063 0.631 7.527 1.00 0.00 H new ATOM 0 HG12 VAL A 871 -10.721 0.914 6.944 1.00 0.00 H new ATOM 0 HG13 VAL A 871 -9.929 -0.652 6.648 1.00 0.00 H new ATOM 0 HG21 VAL A 871 -7.192 0.513 5.957 1.00 0.00 H new ATOM 0 HG22 VAL A 871 -7.990 -0.756 4.997 1.00 0.00 H new ATOM 0 HG23 VAL A 871 -7.454 0.750 4.213 1.00 0.00 H new ATOM 1316 N GLU A 872 -11.911 2.345 4.697 1.00 0.00 N ATOM 1317 CA GLU A 872 -13.245 2.799 5.072 1.00 0.00 C ATOM 1318 C GLU A 872 -14.285 2.365 4.042 1.00 0.00 C ATOM 1319 O GLU A 872 -15.403 1.985 4.399 1.00 0.00 O ATOM 1320 CB GLU A 872 -13.272 4.317 5.248 1.00 0.00 C ATOM 1321 CG GLU A 872 -12.507 4.797 6.471 1.00 0.00 C ATOM 1322 CD GLU A 872 -13.038 4.201 7.761 1.00 0.00 C ATOM 1323 OE1 GLU A 872 -14.177 4.535 8.156 1.00 0.00 O ATOM 1324 OE2 GLU A 872 -12.323 3.390 8.384 1.00 0.00 O ATOM 0 H GLU A 872 -11.247 3.094 4.500 1.00 0.00 H new ATOM 0 HA GLU A 872 -13.497 2.335 6.025 1.00 0.00 H new ATOM 0 HB2 GLU A 872 -12.851 4.786 4.358 1.00 0.00 H new ATOM 0 HB3 GLU A 872 -14.308 4.648 5.323 1.00 0.00 H new ATOM 0 HG2 GLU A 872 -11.454 4.538 6.361 1.00 0.00 H new ATOM 0 HG3 GLU A 872 -12.563 5.884 6.527 1.00 0.00 H new ATOM 1331 N ALA A 873 -13.912 2.411 2.767 1.00 0.00 N ATOM 1332 CA ALA A 873 -14.808 1.985 1.701 1.00 0.00 C ATOM 1333 C ALA A 873 -15.087 0.491 1.804 1.00 0.00 C ATOM 1334 O ALA A 873 -16.235 0.058 1.699 1.00 0.00 O ATOM 1335 CB ALA A 873 -14.222 2.323 0.342 1.00 0.00 C ATOM 0 H ALA A 873 -12.999 2.738 2.449 1.00 0.00 H new ATOM 0 HA ALA A 873 -15.751 2.521 1.811 1.00 0.00 H new ATOM 0 HB1 ALA A 873 -14.907 1.997 -0.441 1.00 0.00 H new ATOM 0 HB2 ALA A 873 -14.073 3.400 0.268 1.00 0.00 H new ATOM 0 HB3 ALA A 873 -13.265 1.815 0.222 1.00 0.00 H new ATOM 1341 N ALA A 874 -14.031 -0.289 2.023 1.00 0.00 N ATOM 1342 CA ALA A 874 -14.153 -1.733 2.185 1.00 0.00 C ATOM 1343 C ALA A 874 -15.041 -2.069 3.375 1.00 0.00 C ATOM 1344 O ALA A 874 -15.943 -2.896 3.268 1.00 0.00 O ATOM 1345 CB ALA A 874 -12.778 -2.362 2.355 1.00 0.00 C ATOM 0 H ALA A 874 -13.075 0.060 2.092 1.00 0.00 H new ATOM 0 HA ALA A 874 -14.617 -2.142 1.287 1.00 0.00 H new ATOM 0 HB1 ALA A 874 -12.883 -3.440 2.475 1.00 0.00 H new ATOM 0 HB2 ALA A 874 -12.171 -2.153 1.474 1.00 0.00 H new ATOM 0 HB3 ALA A 874 -12.293 -1.944 3.238 1.00 0.00 H new ATOM 1351 N LYS A 875 -14.787 -1.411 4.499 1.00 0.00 N ATOM 1352 CA LYS A 875 -15.576 -1.614 5.712 1.00 0.00 C ATOM 1353 C LYS A 875 -17.055 -1.337 5.459 1.00 0.00 C ATOM 1354 O LYS A 875 -17.919 -2.107 5.883 1.00 0.00 O ATOM 1355 CB LYS A 875 -15.063 -0.709 6.833 1.00 0.00 C ATOM 1356 CG LYS A 875 -13.682 -1.094 7.340 1.00 0.00 C ATOM 1357 CD LYS A 875 -13.060 0.013 8.180 1.00 0.00 C ATOM 1358 CE LYS A 875 -13.908 0.355 9.393 1.00 0.00 C ATOM 1359 NZ LYS A 875 -13.290 1.429 10.213 1.00 0.00 N ATOM 0 H LYS A 875 -14.036 -0.728 4.598 1.00 0.00 H new ATOM 0 HA LYS A 875 -15.469 -2.656 6.012 1.00 0.00 H new ATOM 0 HB2 LYS A 875 -15.036 0.320 6.475 1.00 0.00 H new ATOM 0 HB3 LYS A 875 -15.768 -0.739 7.664 1.00 0.00 H new ATOM 0 HG2 LYS A 875 -13.754 -2.005 7.934 1.00 0.00 H new ATOM 0 HG3 LYS A 875 -13.033 -1.316 6.493 1.00 0.00 H new ATOM 0 HD2 LYS A 875 -12.067 -0.295 8.508 1.00 0.00 H new ATOM 0 HD3 LYS A 875 -12.930 0.904 7.566 1.00 0.00 H new ATOM 0 HE2 LYS A 875 -14.899 0.671 9.066 1.00 0.00 H new ATOM 0 HE3 LYS A 875 -14.044 -0.537 10.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 875 -14.005 1.834 10.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 875 -12.510 1.032 10.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 875 -12.922 2.174 9.588 1.00 0.00 H new ATOM 1373 N GLY A 876 -17.334 -0.246 4.757 1.00 0.00 N ATOM 1374 CA GLY A 876 -18.707 0.125 4.473 1.00 0.00 C ATOM 1375 C GLY A 876 -19.371 -0.807 3.479 1.00 0.00 C ATOM 1376 O GLY A 876 -20.519 -1.209 3.671 1.00 0.00 O ATOM 0 H GLY A 876 -16.632 0.390 4.378 1.00 0.00 H new ATOM 0 HA2 GLY A 876 -19.278 0.126 5.401 1.00 0.00 H new ATOM 0 HA3 GLY A 876 -18.731 1.142 4.083 1.00 0.00 H new ATOM 1380 N ALA A 877 -18.641 -1.157 2.422 1.00 0.00 N ATOM 1381 CA ALA A 877 -19.176 -2.007 1.363 1.00 0.00 C ATOM 1382 C ALA A 877 -19.374 -3.430 1.852 1.00 0.00 C ATOM 1383 O ALA A 877 -20.220 -4.163 1.345 1.00 0.00 O ATOM 1384 CB ALA A 877 -18.252 -1.993 0.155 1.00 0.00 C ATOM 0 H ALA A 877 -17.675 -0.864 2.277 1.00 0.00 H new ATOM 0 HA ALA A 877 -20.148 -1.608 1.071 1.00 0.00 H new ATOM 0 HB1 ALA A 877 -18.665 -2.632 -0.626 1.00 0.00 H new ATOM 0 HB2 ALA A 877 -18.160 -0.974 -0.221 1.00 0.00 H new ATOM 0 HB3 ALA A 877 -17.269 -2.364 0.445 1.00 0.00 H new ATOM 1390 N ALA A 878 -18.578 -3.819 2.832 1.00 0.00 N ATOM 1391 CA ALA A 878 -18.666 -5.148 3.394 1.00 0.00 C ATOM 1392 C ALA A 878 -19.792 -5.240 4.411 1.00 0.00 C ATOM 1393 O ALA A 878 -20.737 -6.005 4.227 1.00 0.00 O ATOM 1394 CB ALA A 878 -17.346 -5.535 4.031 1.00 0.00 C ATOM 0 H ALA A 878 -17.862 -3.228 3.254 1.00 0.00 H new ATOM 0 HA ALA A 878 -18.886 -5.845 2.585 1.00 0.00 H new ATOM 0 HB1 ALA A 878 -17.425 -6.538 4.451 1.00 0.00 H new ATOM 0 HB2 ALA A 878 -16.559 -5.518 3.277 1.00 0.00 H new ATOM 0 HB3 ALA A 878 -17.104 -4.828 4.824 1.00 0.00 H new ATOM 1400 N ALA A 879 -19.691 -4.449 5.478 1.00 0.00 N ATOM 1401 CA ALA A 879 -20.653 -4.513 6.576 1.00 0.00 C ATOM 1402 C ALA A 879 -22.064 -4.228 6.082 1.00 0.00 C ATOM 1403 O ALA A 879 -23.033 -4.828 6.554 1.00 0.00 O ATOM 1404 CB ALA A 879 -20.263 -3.550 7.684 1.00 0.00 C ATOM 0 H ALA A 879 -18.953 -3.757 5.605 1.00 0.00 H new ATOM 0 HA ALA A 879 -20.639 -5.525 6.981 1.00 0.00 H new ATOM 0 HB1 ALA A 879 -20.991 -3.612 8.493 1.00 0.00 H new ATOM 0 HB2 ALA A 879 -19.276 -3.813 8.064 1.00 0.00 H new ATOM 0 HB3 ALA A 879 -20.242 -2.533 7.292 1.00 0.00 H new ATOM 1410 N HIS A 880 -22.176 -3.295 5.146 1.00 0.00 N ATOM 1411 CA HIS A 880 -23.424 -3.076 4.429 1.00 0.00 C ATOM 1412 C HIS A 880 -23.276 -3.615 3.010 1.00 0.00 C ATOM 1413 O HIS A 880 -23.015 -2.853 2.076 1.00 0.00 O ATOM 1414 CB HIS A 880 -23.797 -1.589 4.386 1.00 0.00 C ATOM 1415 CG HIS A 880 -24.011 -0.963 5.729 1.00 0.00 C ATOM 1416 ND1 HIS A 880 -23.936 0.394 5.939 1.00 0.00 N ATOM 1417 CD2 HIS A 880 -24.313 -1.508 6.930 1.00 0.00 C ATOM 1418 CE1 HIS A 880 -24.177 0.659 7.207 1.00 0.00 C ATOM 1419 NE2 HIS A 880 -24.411 -0.478 7.831 1.00 0.00 N ATOM 0 H HIS A 880 -21.415 -2.676 4.865 1.00 0.00 H new ATOM 0 HA HIS A 880 -24.224 -3.600 4.953 1.00 0.00 H new ATOM 0 HB2 HIS A 880 -23.008 -1.045 3.867 1.00 0.00 H new ATOM 0 HB3 HIS A 880 -24.706 -1.472 3.796 1.00 0.00 H new ATOM 0 HD2 HIS A 880 -24.451 -2.558 7.140 1.00 0.00 H new ATOM 0 HE1 HIS A 880 -24.182 1.640 7.658 1.00 0.00 H new ATOM 0 HE2 HIS A 880 -24.629 -0.576 8.822 1.00 0.00 H new ATOM 1427 N PRO A 881 -23.434 -4.937 2.829 1.00 0.00 N ATOM 1428 CA PRO A 881 -23.089 -5.609 1.575 1.00 0.00 C ATOM 1429 C PRO A 881 -23.905 -5.096 0.385 1.00 0.00 C ATOM 1430 O PRO A 881 -23.400 -4.977 -0.733 1.00 0.00 O ATOM 1431 CB PRO A 881 -23.421 -7.083 1.846 1.00 0.00 C ATOM 1432 CG PRO A 881 -24.367 -7.066 2.996 1.00 0.00 C ATOM 1433 CD PRO A 881 -23.985 -5.875 3.823 1.00 0.00 C ATOM 0 HA PRO A 881 -22.048 -5.433 1.304 1.00 0.00 H new ATOM 0 HB2 PRO A 881 -23.873 -7.552 0.972 1.00 0.00 H new ATOM 0 HB3 PRO A 881 -22.522 -7.652 2.084 1.00 0.00 H new ATOM 0 HG2 PRO A 881 -25.399 -6.989 2.652 1.00 0.00 H new ATOM 0 HG3 PRO A 881 -24.293 -7.985 3.577 1.00 0.00 H new ATOM 0 HD2 PRO A 881 -24.845 -5.452 4.342 1.00 0.00 H new ATOM 0 HD3 PRO A 881 -23.249 -6.133 4.584 1.00 0.00 H new ATOM 1441 N ASP A 882 -25.168 -4.782 0.649 1.00 0.00 N ATOM 1442 CA ASP A 882 -26.117 -4.409 -0.397 1.00 0.00 C ATOM 1443 C ASP A 882 -25.909 -2.974 -0.887 1.00 0.00 C ATOM 1444 O ASP A 882 -26.451 -2.584 -1.922 1.00 0.00 O ATOM 1445 CB ASP A 882 -27.553 -4.562 0.110 1.00 0.00 C ATOM 1446 CG ASP A 882 -27.837 -5.930 0.693 1.00 0.00 C ATOM 1447 OD1 ASP A 882 -28.174 -6.856 -0.074 1.00 0.00 O ATOM 1448 OD2 ASP A 882 -27.739 -6.081 1.930 1.00 0.00 O ATOM 0 H ASP A 882 -25.563 -4.778 1.589 1.00 0.00 H new ATOM 0 HA ASP A 882 -25.941 -5.081 -1.237 1.00 0.00 H new ATOM 0 HB2 ASP A 882 -27.746 -3.804 0.869 1.00 0.00 H new ATOM 0 HB3 ASP A 882 -28.244 -4.374 -0.712 1.00 0.00 H new ATOM 1453 N SER A 883 -25.134 -2.190 -0.144 1.00 0.00 N ATOM 1454 CA SER A 883 -24.964 -0.775 -0.455 1.00 0.00 C ATOM 1455 C SER A 883 -24.109 -0.568 -1.705 1.00 0.00 C ATOM 1456 O SER A 883 -22.883 -0.693 -1.663 1.00 0.00 O ATOM 1457 CB SER A 883 -24.342 -0.040 0.733 1.00 0.00 C ATOM 1458 OG SER A 883 -25.192 -0.093 1.867 1.00 0.00 O ATOM 0 H SER A 883 -24.616 -2.509 0.675 1.00 0.00 H new ATOM 0 HA SER A 883 -25.953 -0.363 -0.656 1.00 0.00 H new ATOM 0 HB2 SER A 883 -23.378 -0.486 0.976 1.00 0.00 H new ATOM 0 HB3 SER A 883 -24.154 0.999 0.464 1.00 0.00 H new ATOM 0 HG SER A 883 -24.771 0.382 2.614 1.00 0.00 H new ATOM 1464 N GLU A 884 -24.773 -0.243 -2.810 1.00 0.00 N ATOM 1465 CA GLU A 884 -24.106 0.026 -4.080 1.00 0.00 C ATOM 1466 C GLU A 884 -23.128 1.187 -3.942 1.00 0.00 C ATOM 1467 O GLU A 884 -22.014 1.144 -4.470 1.00 0.00 O ATOM 1468 CB GLU A 884 -25.149 0.355 -5.149 1.00 0.00 C ATOM 1469 CG GLU A 884 -24.559 0.687 -6.507 1.00 0.00 C ATOM 1470 CD GLU A 884 -25.594 1.243 -7.458 1.00 0.00 C ATOM 1471 OE1 GLU A 884 -26.379 0.451 -8.019 1.00 0.00 O ATOM 1472 OE2 GLU A 884 -25.639 2.480 -7.637 1.00 0.00 O ATOM 0 H GLU A 884 -25.789 -0.159 -2.851 1.00 0.00 H new ATOM 0 HA GLU A 884 -23.548 -0.863 -4.374 1.00 0.00 H new ATOM 0 HB2 GLU A 884 -25.825 -0.494 -5.256 1.00 0.00 H new ATOM 0 HB3 GLU A 884 -25.749 1.199 -4.809 1.00 0.00 H new ATOM 0 HG2 GLU A 884 -23.754 1.412 -6.384 1.00 0.00 H new ATOM 0 HG3 GLU A 884 -24.117 -0.211 -6.938 1.00 0.00 H new ATOM 1479 N GLU A 885 -23.561 2.223 -3.230 1.00 0.00 N ATOM 1480 CA GLU A 885 -22.745 3.410 -2.999 1.00 0.00 C ATOM 1481 C GLU A 885 -21.385 3.025 -2.425 1.00 0.00 C ATOM 1482 O GLU A 885 -20.344 3.439 -2.930 1.00 0.00 O ATOM 1483 CB GLU A 885 -23.448 4.377 -2.037 1.00 0.00 C ATOM 1484 CG GLU A 885 -24.855 4.777 -2.458 1.00 0.00 C ATOM 1485 CD GLU A 885 -25.914 3.778 -2.031 1.00 0.00 C ATOM 1486 OE1 GLU A 885 -26.118 2.773 -2.744 1.00 0.00 O ATOM 1487 OE2 GLU A 885 -26.553 3.998 -0.981 1.00 0.00 O ATOM 0 H GLU A 885 -24.484 2.263 -2.798 1.00 0.00 H new ATOM 0 HA GLU A 885 -22.602 3.905 -3.959 1.00 0.00 H new ATOM 0 HB2 GLU A 885 -23.495 3.917 -1.050 1.00 0.00 H new ATOM 0 HB3 GLU A 885 -22.842 5.278 -1.940 1.00 0.00 H new ATOM 0 HG2 GLU A 885 -25.091 5.752 -2.031 1.00 0.00 H new ATOM 0 HG3 GLU A 885 -24.885 4.888 -3.542 1.00 0.00 H new ATOM 1494 N GLN A 886 -21.410 2.208 -1.381 1.00 0.00 N ATOM 1495 CA GLN A 886 -20.190 1.766 -0.722 1.00 0.00 C ATOM 1496 C GLN A 886 -19.365 0.876 -1.647 1.00 0.00 C ATOM 1497 O GLN A 886 -18.135 0.941 -1.645 1.00 0.00 O ATOM 1498 CB GLN A 886 -20.527 1.022 0.568 1.00 0.00 C ATOM 1499 CG GLN A 886 -21.207 1.892 1.615 1.00 0.00 C ATOM 1500 CD GLN A 886 -20.314 3.008 2.130 1.00 0.00 C ATOM 1501 OE1 GLN A 886 -20.793 4.081 2.493 1.00 0.00 O ATOM 1502 NE2 GLN A 886 -19.014 2.764 2.174 1.00 0.00 N ATOM 0 H GLN A 886 -22.267 1.837 -0.971 1.00 0.00 H new ATOM 0 HA GLN A 886 -19.595 2.646 -0.476 1.00 0.00 H new ATOM 0 HB2 GLN A 886 -21.176 0.179 0.332 1.00 0.00 H new ATOM 0 HB3 GLN A 886 -19.610 0.610 0.990 1.00 0.00 H new ATOM 0 HG2 GLN A 886 -22.111 2.326 1.188 1.00 0.00 H new ATOM 0 HG3 GLN A 886 -21.518 1.267 2.452 1.00 0.00 H new ATOM 0 HE21 GLN A 886 -18.654 1.861 1.864 1.00 0.00 H new ATOM 0 HE22 GLN A 886 -18.372 3.478 2.518 1.00 0.00 H new ATOM 1511 N GLN A 887 -20.051 0.056 -2.440 1.00 0.00 N ATOM 1512 CA GLN A 887 -19.386 -0.810 -3.409 1.00 0.00 C ATOM 1513 C GLN A 887 -18.570 0.020 -4.392 1.00 0.00 C ATOM 1514 O GLN A 887 -17.385 -0.240 -4.604 1.00 0.00 O ATOM 1515 CB GLN A 887 -20.414 -1.651 -4.171 1.00 0.00 C ATOM 1516 CG GLN A 887 -21.157 -2.654 -3.304 1.00 0.00 C ATOM 1517 CD GLN A 887 -20.242 -3.711 -2.717 1.00 0.00 C ATOM 1518 OE1 GLN A 887 -19.221 -4.062 -3.306 1.00 0.00 O ATOM 1519 NE2 GLN A 887 -20.613 -4.236 -1.562 1.00 0.00 N ATOM 0 H GLN A 887 -21.068 -0.026 -2.430 1.00 0.00 H new ATOM 0 HA GLN A 887 -18.716 -1.477 -2.866 1.00 0.00 H new ATOM 0 HB2 GLN A 887 -21.138 -0.984 -4.639 1.00 0.00 H new ATOM 0 HB3 GLN A 887 -19.907 -2.186 -4.974 1.00 0.00 H new ATOM 0 HG2 GLN A 887 -21.661 -2.126 -2.495 1.00 0.00 H new ATOM 0 HG3 GLN A 887 -21.931 -3.139 -3.899 1.00 0.00 H new ATOM 0 HE21 GLN A 887 -21.468 -3.915 -1.107 1.00 0.00 H new ATOM 0 HE22 GLN A 887 -20.044 -4.962 -1.126 1.00 0.00 H new ATOM 1528 N GLN A 888 -19.208 1.032 -4.970 1.00 0.00 N ATOM 1529 CA GLN A 888 -18.551 1.915 -5.927 1.00 0.00 C ATOM 1530 C GLN A 888 -17.343 2.601 -5.295 1.00 0.00 C ATOM 1531 O GLN A 888 -16.269 2.666 -5.898 1.00 0.00 O ATOM 1532 CB GLN A 888 -19.539 2.964 -6.443 1.00 0.00 C ATOM 1533 CG GLN A 888 -18.936 3.912 -7.467 1.00 0.00 C ATOM 1534 CD GLN A 888 -18.454 3.199 -8.716 1.00 0.00 C ATOM 1535 OE1 GLN A 888 -19.004 2.171 -9.112 1.00 0.00 O ATOM 1536 NE2 GLN A 888 -17.419 3.732 -9.339 1.00 0.00 N ATOM 0 H GLN A 888 -20.185 1.262 -4.791 1.00 0.00 H new ATOM 0 HA GLN A 888 -18.203 1.310 -6.765 1.00 0.00 H new ATOM 0 HB2 GLN A 888 -20.395 2.457 -6.888 1.00 0.00 H new ATOM 0 HB3 GLN A 888 -19.915 3.544 -5.600 1.00 0.00 H new ATOM 0 HG2 GLN A 888 -19.679 4.660 -7.745 1.00 0.00 H new ATOM 0 HG3 GLN A 888 -18.101 4.446 -7.014 1.00 0.00 H new ATOM 0 HE21 GLN A 888 -16.991 4.585 -8.979 1.00 0.00 H new ATOM 0 HE22 GLN A 888 -17.047 3.291 -10.180 1.00 0.00 H new ATOM 1545 N ARG A 889 -17.525 3.095 -4.073 1.00 0.00 N ATOM 1546 CA ARG A 889 -16.452 3.758 -3.341 1.00 0.00 C ATOM 1547 C ARG A 889 -15.256 2.828 -3.180 1.00 0.00 C ATOM 1548 O ARG A 889 -14.110 3.249 -3.312 1.00 0.00 O ATOM 1549 CB ARG A 889 -16.940 4.206 -1.964 1.00 0.00 C ATOM 1550 CG ARG A 889 -18.063 5.226 -2.011 1.00 0.00 C ATOM 1551 CD ARG A 889 -18.579 5.530 -0.618 1.00 0.00 C ATOM 1552 NE ARG A 889 -19.672 6.499 -0.630 1.00 0.00 N ATOM 1553 CZ ARG A 889 -19.998 7.254 0.417 1.00 0.00 C ATOM 1554 NH1 ARG A 889 -19.310 7.157 1.549 1.00 0.00 N ATOM 1555 NH2 ARG A 889 -21.016 8.102 0.328 1.00 0.00 N ATOM 0 H ARG A 889 -18.410 3.048 -3.568 1.00 0.00 H new ATOM 0 HA ARG A 889 -16.146 4.633 -3.914 1.00 0.00 H new ATOM 0 HB2 ARG A 889 -17.279 3.332 -1.408 1.00 0.00 H new ATOM 0 HB3 ARG A 889 -16.101 4.629 -1.412 1.00 0.00 H new ATOM 0 HG2 ARG A 889 -17.706 6.144 -2.479 1.00 0.00 H new ATOM 0 HG3 ARG A 889 -18.877 4.848 -2.630 1.00 0.00 H new ATOM 0 HD2 ARG A 889 -18.920 4.607 -0.150 1.00 0.00 H new ATOM 0 HD3 ARG A 889 -17.763 5.914 -0.007 1.00 0.00 H new ATOM 0 HE ARG A 889 -20.215 6.603 -1.487 1.00 0.00 H new ATOM 0 HH11 ARG A 889 -18.530 6.503 1.617 1.00 0.00 H new ATOM 0 HH12 ARG A 889 -19.561 7.736 2.350 1.00 0.00 H new ATOM 0 HH21 ARG A 889 -21.546 8.174 -0.541 1.00 0.00 H new ATOM 0 HH22 ARG A 889 -21.268 8.682 1.128 1.00 0.00 H new ATOM 1569 N LEU A 890 -15.539 1.564 -2.898 1.00 0.00 N ATOM 1570 CA LEU A 890 -14.500 0.559 -2.723 1.00 0.00 C ATOM 1571 C LEU A 890 -13.740 0.323 -4.022 1.00 0.00 C ATOM 1572 O LEU A 890 -12.513 0.237 -4.025 1.00 0.00 O ATOM 1573 CB LEU A 890 -15.117 -0.751 -2.233 1.00 0.00 C ATOM 1574 CG LEU A 890 -14.156 -1.937 -2.155 1.00 0.00 C ATOM 1575 CD1 LEU A 890 -13.018 -1.646 -1.189 1.00 0.00 C ATOM 1576 CD2 LEU A 890 -14.903 -3.188 -1.735 1.00 0.00 C ATOM 0 H LEU A 890 -16.488 1.208 -2.785 1.00 0.00 H new ATOM 0 HA LEU A 890 -13.794 0.926 -1.978 1.00 0.00 H new ATOM 0 HB2 LEU A 890 -15.544 -0.585 -1.244 1.00 0.00 H new ATOM 0 HB3 LEU A 890 -15.941 -1.015 -2.895 1.00 0.00 H new ATOM 0 HG LEU A 890 -13.728 -2.100 -3.144 1.00 0.00 H new ATOM 0 HD11 LEU A 890 -12.346 -2.504 -1.149 1.00 0.00 H new ATOM 0 HD12 LEU A 890 -12.467 -0.769 -1.529 1.00 0.00 H new ATOM 0 HD13 LEU A 890 -13.424 -1.457 -0.195 1.00 0.00 H new ATOM 0 HD21 LEU A 890 -14.208 -4.026 -1.683 1.00 0.00 H new ATOM 0 HD22 LEU A 890 -15.355 -3.030 -0.756 1.00 0.00 H new ATOM 0 HD23 LEU A 890 -15.683 -3.408 -2.464 1.00 0.00 H new ATOM 1588 N ARG A 891 -14.479 0.229 -5.119 1.00 0.00 N ATOM 1589 CA ARG A 891 -13.891 -0.025 -6.432 1.00 0.00 C ATOM 1590 C ARG A 891 -12.833 1.021 -6.764 1.00 0.00 C ATOM 1591 O ARG A 891 -11.697 0.689 -7.111 1.00 0.00 O ATOM 1592 CB ARG A 891 -14.986 -0.022 -7.500 1.00 0.00 C ATOM 1593 CG ARG A 891 -16.073 -1.052 -7.250 1.00 0.00 C ATOM 1594 CD ARG A 891 -17.239 -0.883 -8.206 1.00 0.00 C ATOM 1595 NE ARG A 891 -18.319 -1.827 -7.923 1.00 0.00 N ATOM 1596 CZ ARG A 891 -19.506 -1.804 -8.528 1.00 0.00 C ATOM 1597 NH1 ARG A 891 -19.782 -0.860 -9.418 1.00 0.00 N ATOM 1598 NH2 ARG A 891 -20.421 -2.719 -8.231 1.00 0.00 N ATOM 0 H ARG A 891 -15.494 0.325 -5.127 1.00 0.00 H new ATOM 0 HA ARG A 891 -13.410 -1.003 -6.412 1.00 0.00 H new ATOM 0 HB2 ARG A 891 -15.438 0.969 -7.544 1.00 0.00 H new ATOM 0 HB3 ARG A 891 -14.534 -0.210 -8.474 1.00 0.00 H new ATOM 0 HG2 ARG A 891 -15.657 -2.054 -7.358 1.00 0.00 H new ATOM 0 HG3 ARG A 891 -16.429 -0.963 -6.223 1.00 0.00 H new ATOM 0 HD2 ARG A 891 -17.620 0.136 -8.137 1.00 0.00 H new ATOM 0 HD3 ARG A 891 -16.892 -1.025 -9.230 1.00 0.00 H new ATOM 0 HE ARG A 891 -18.154 -2.547 -7.220 1.00 0.00 H new ATOM 0 HH11 ARG A 891 -19.085 -0.150 -9.641 1.00 0.00 H new ATOM 0 HH12 ARG A 891 -20.691 -0.845 -9.880 1.00 0.00 H new ATOM 0 HH21 ARG A 891 -20.215 -3.440 -7.539 1.00 0.00 H new ATOM 0 HH22 ARG A 891 -21.329 -2.701 -8.694 1.00 0.00 H new ATOM 1612 N GLU A 892 -13.206 2.285 -6.626 1.00 0.00 N ATOM 1613 CA GLU A 892 -12.305 3.386 -6.931 1.00 0.00 C ATOM 1614 C GLU A 892 -11.208 3.514 -5.875 1.00 0.00 C ATOM 1615 O GLU A 892 -10.097 3.965 -6.169 1.00 0.00 O ATOM 1616 CB GLU A 892 -13.091 4.693 -7.041 1.00 0.00 C ATOM 1617 CG GLU A 892 -14.100 4.690 -8.179 1.00 0.00 C ATOM 1618 CD GLU A 892 -14.877 5.984 -8.281 1.00 0.00 C ATOM 1619 OE1 GLU A 892 -14.254 7.038 -8.530 1.00 0.00 O ATOM 1620 OE2 GLU A 892 -16.114 5.954 -8.108 1.00 0.00 O ATOM 0 H GLU A 892 -14.130 2.574 -6.304 1.00 0.00 H new ATOM 0 HA GLU A 892 -11.826 3.176 -7.887 1.00 0.00 H new ATOM 0 HB2 GLU A 892 -13.613 4.876 -6.102 1.00 0.00 H new ATOM 0 HB3 GLU A 892 -12.393 5.518 -7.184 1.00 0.00 H new ATOM 0 HG2 GLU A 892 -13.579 4.510 -9.119 1.00 0.00 H new ATOM 0 HG3 GLU A 892 -14.797 3.864 -8.038 1.00 0.00 H new ATOM 1627 N ALA A 893 -11.521 3.107 -4.651 1.00 0.00 N ATOM 1628 CA ALA A 893 -10.568 3.187 -3.553 1.00 0.00 C ATOM 1629 C ALA A 893 -9.467 2.150 -3.702 1.00 0.00 C ATOM 1630 O ALA A 893 -8.290 2.462 -3.527 1.00 0.00 O ATOM 1631 CB ALA A 893 -11.273 3.007 -2.220 1.00 0.00 C ATOM 0 H ALA A 893 -12.428 2.718 -4.394 1.00 0.00 H new ATOM 0 HA ALA A 893 -10.112 4.177 -3.583 1.00 0.00 H new ATOM 0 HB1 ALA A 893 -10.544 3.070 -1.412 1.00 0.00 H new ATOM 0 HB2 ALA A 893 -12.021 3.790 -2.096 1.00 0.00 H new ATOM 0 HB3 ALA A 893 -11.760 2.032 -2.195 1.00 0.00 H new ATOM 1637 N ALA A 894 -9.852 0.923 -4.031 1.00 0.00 N ATOM 1638 CA ALA A 894 -8.900 -0.173 -4.155 1.00 0.00 C ATOM 1639 C ALA A 894 -7.884 0.101 -5.254 1.00 0.00 C ATOM 1640 O ALA A 894 -6.684 -0.103 -5.065 1.00 0.00 O ATOM 1641 CB ALA A 894 -9.624 -1.483 -4.413 1.00 0.00 C ATOM 0 H ALA A 894 -10.820 0.662 -4.217 1.00 0.00 H new ATOM 0 HA ALA A 894 -8.360 -0.255 -3.212 1.00 0.00 H new ATOM 0 HB1 ALA A 894 -8.896 -2.289 -4.503 1.00 0.00 H new ATOM 0 HB2 ALA A 894 -10.300 -1.695 -3.584 1.00 0.00 H new ATOM 0 HB3 ALA A 894 -10.196 -1.406 -5.337 1.00 0.00 H new ATOM 1647 N GLU A 895 -8.361 0.578 -6.396 1.00 0.00 N ATOM 1648 CA GLU A 895 -7.475 0.894 -7.507 1.00 0.00 C ATOM 1649 C GLU A 895 -6.585 2.085 -7.162 1.00 0.00 C ATOM 1650 O GLU A 895 -5.423 2.135 -7.561 1.00 0.00 O ATOM 1651 CB GLU A 895 -8.275 1.171 -8.781 1.00 0.00 C ATOM 1652 CG GLU A 895 -9.110 -0.014 -9.240 1.00 0.00 C ATOM 1653 CD GLU A 895 -9.617 0.148 -10.657 1.00 0.00 C ATOM 1654 OE1 GLU A 895 -10.569 0.929 -10.864 1.00 0.00 O ATOM 1655 OE2 GLU A 895 -9.081 -0.513 -11.566 1.00 0.00 O ATOM 0 H GLU A 895 -9.349 0.753 -6.576 1.00 0.00 H new ATOM 0 HA GLU A 895 -6.837 0.029 -7.689 1.00 0.00 H new ATOM 0 HB2 GLU A 895 -8.932 2.024 -8.610 1.00 0.00 H new ATOM 0 HB3 GLU A 895 -7.588 1.452 -9.579 1.00 0.00 H new ATOM 0 HG2 GLU A 895 -8.512 -0.923 -9.173 1.00 0.00 H new ATOM 0 HG3 GLU A 895 -9.958 -0.140 -8.566 1.00 0.00 H new ATOM 1662 N GLY A 896 -7.130 3.029 -6.401 1.00 0.00 N ATOM 1663 CA GLY A 896 -6.343 4.160 -5.944 1.00 0.00 C ATOM 1664 C GLY A 896 -5.280 3.736 -4.948 1.00 0.00 C ATOM 1665 O GLY A 896 -4.164 4.258 -4.954 1.00 0.00 O ATOM 0 H GLY A 896 -8.102 3.031 -6.093 1.00 0.00 H new ATOM 0 HA2 GLY A 896 -5.869 4.643 -6.799 1.00 0.00 H new ATOM 0 HA3 GLY A 896 -7.000 4.898 -5.484 1.00 0.00 H new ATOM 1669 N LEU A 897 -5.635 2.780 -4.098 1.00 0.00 N ATOM 1670 CA LEU A 897 -4.710 2.218 -3.122 1.00 0.00 C ATOM 1671 C LEU A 897 -3.607 1.448 -3.842 1.00 0.00 C ATOM 1672 O LEU A 897 -2.422 1.607 -3.537 1.00 0.00 O ATOM 1673 CB LEU A 897 -5.488 1.319 -2.138 1.00 0.00 C ATOM 1674 CG LEU A 897 -4.689 0.675 -0.992 1.00 0.00 C ATOM 1675 CD1 LEU A 897 -4.043 -0.623 -1.440 1.00 0.00 C ATOM 1676 CD2 LEU A 897 -3.637 1.632 -0.455 1.00 0.00 C ATOM 0 H LEU A 897 -6.570 2.373 -4.066 1.00 0.00 H new ATOM 0 HA LEU A 897 -4.237 3.016 -2.549 1.00 0.00 H new ATOM 0 HB2 LEU A 897 -6.289 1.913 -1.699 1.00 0.00 H new ATOM 0 HB3 LEU A 897 -5.960 0.521 -2.711 1.00 0.00 H new ATOM 0 HG LEU A 897 -5.389 0.449 -0.188 1.00 0.00 H new ATOM 0 HD11 LEU A 897 -3.485 -1.057 -0.610 1.00 0.00 H new ATOM 0 HD12 LEU A 897 -4.815 -1.321 -1.762 1.00 0.00 H new ATOM 0 HD13 LEU A 897 -3.364 -0.424 -2.270 1.00 0.00 H new ATOM 0 HD21 LEU A 897 -3.087 1.151 0.354 1.00 0.00 H new ATOM 0 HD22 LEU A 897 -2.946 1.899 -1.255 1.00 0.00 H new ATOM 0 HD23 LEU A 897 -4.122 2.532 -0.079 1.00 0.00 H new ATOM 1688 N ARG A 898 -3.998 0.628 -4.810 1.00 0.00 N ATOM 1689 CA ARG A 898 -3.037 -0.109 -5.619 1.00 0.00 C ATOM 1690 C ARG A 898 -2.119 0.851 -6.368 1.00 0.00 C ATOM 1691 O ARG A 898 -0.906 0.659 -6.394 1.00 0.00 O ATOM 1692 CB ARG A 898 -3.755 -1.042 -6.599 1.00 0.00 C ATOM 1693 CG ARG A 898 -2.847 -1.594 -7.690 1.00 0.00 C ATOM 1694 CD ARG A 898 -3.510 -2.727 -8.454 1.00 0.00 C ATOM 1695 NE ARG A 898 -3.519 -3.974 -7.685 1.00 0.00 N ATOM 1696 CZ ARG A 898 -4.526 -4.842 -7.684 1.00 0.00 C ATOM 1697 NH1 ARG A 898 -5.639 -4.583 -8.363 1.00 0.00 N ATOM 1698 NH2 ARG A 898 -4.422 -5.972 -7.000 1.00 0.00 N ATOM 0 H ARG A 898 -4.974 0.457 -5.053 1.00 0.00 H new ATOM 0 HA ARG A 898 -2.427 -0.719 -4.952 1.00 0.00 H new ATOM 0 HB2 ARG A 898 -4.190 -1.873 -6.044 1.00 0.00 H new ATOM 0 HB3 ARG A 898 -4.581 -0.502 -7.063 1.00 0.00 H new ATOM 0 HG2 ARG A 898 -2.582 -0.795 -8.382 1.00 0.00 H new ATOM 0 HG3 ARG A 898 -1.918 -1.950 -7.244 1.00 0.00 H new ATOM 0 HD2 ARG A 898 -4.534 -2.447 -8.703 1.00 0.00 H new ATOM 0 HD3 ARG A 898 -2.985 -2.885 -9.396 1.00 0.00 H new ATOM 0 HE ARG A 898 -2.701 -4.190 -7.115 1.00 0.00 H new ATOM 0 HH11 ARG A 898 -5.725 -3.714 -8.889 1.00 0.00 H new ATOM 0 HH12 ARG A 898 -6.407 -5.254 -8.358 1.00 0.00 H new ATOM 0 HH21 ARG A 898 -3.571 -6.174 -6.476 1.00 0.00 H new ATOM 0 HH22 ARG A 898 -5.193 -6.640 -6.998 1.00 0.00 H new ATOM 1712 N MET A 899 -2.700 1.894 -6.950 1.00 0.00 N ATOM 1713 CA MET A 899 -1.929 2.893 -7.686 1.00 0.00 C ATOM 1714 C MET A 899 -0.903 3.567 -6.778 1.00 0.00 C ATOM 1715 O MET A 899 0.258 3.730 -7.156 1.00 0.00 O ATOM 1716 CB MET A 899 -2.852 3.949 -8.297 1.00 0.00 C ATOM 1717 CG MET A 899 -2.111 5.017 -9.089 1.00 0.00 C ATOM 1718 SD MET A 899 -3.207 6.279 -9.762 1.00 0.00 S ATOM 1719 CE MET A 899 -3.891 6.973 -8.260 1.00 0.00 C ATOM 0 H MET A 899 -3.704 2.071 -6.927 1.00 0.00 H new ATOM 0 HA MET A 899 -1.401 2.378 -8.489 1.00 0.00 H new ATOM 0 HB2 MET A 899 -3.572 3.457 -8.951 1.00 0.00 H new ATOM 0 HB3 MET A 899 -3.421 4.428 -7.500 1.00 0.00 H new ATOM 0 HG2 MET A 899 -1.371 5.492 -8.445 1.00 0.00 H new ATOM 0 HG3 MET A 899 -1.566 4.544 -9.906 1.00 0.00 H new ATOM 0 HE1 MET A 899 -3.934 8.059 -8.347 1.00 0.00 H new ATOM 0 HE2 MET A 899 -4.896 6.582 -8.103 1.00 0.00 H new ATOM 0 HE3 MET A 899 -3.260 6.702 -7.414 1.00 0.00 H new ATOM 1729 N ALA A 900 -1.336 3.952 -5.580 1.00 0.00 N ATOM 1730 CA ALA A 900 -0.456 4.611 -4.619 1.00 0.00 C ATOM 1731 C ALA A 900 0.659 3.675 -4.169 1.00 0.00 C ATOM 1732 O ALA A 900 1.829 4.059 -4.126 1.00 0.00 O ATOM 1733 CB ALA A 900 -1.250 5.101 -3.419 1.00 0.00 C ATOM 0 H ALA A 900 -2.292 3.819 -5.251 1.00 0.00 H new ATOM 0 HA ALA A 900 -0.001 5.470 -5.112 1.00 0.00 H new ATOM 0 HB1 ALA A 900 -0.578 5.589 -2.713 1.00 0.00 H new ATOM 0 HB2 ALA A 900 -2.008 5.811 -3.750 1.00 0.00 H new ATOM 0 HB3 ALA A 900 -1.734 4.254 -2.933 1.00 0.00 H new ATOM 1739 N THR A 901 0.291 2.444 -3.848 1.00 0.00 N ATOM 1740 CA THR A 901 1.254 1.446 -3.418 1.00 0.00 C ATOM 1741 C THR A 901 2.242 1.128 -4.534 1.00 0.00 C ATOM 1742 O THR A 901 3.452 1.067 -4.312 1.00 0.00 O ATOM 1743 CB THR A 901 0.552 0.148 -2.993 1.00 0.00 C ATOM 1744 OG1 THR A 901 -0.422 0.435 -1.985 1.00 0.00 O ATOM 1745 CG2 THR A 901 1.560 -0.862 -2.467 1.00 0.00 C ATOM 0 H THR A 901 -0.673 2.113 -3.878 1.00 0.00 H new ATOM 0 HA THR A 901 1.790 1.862 -2.565 1.00 0.00 H new ATOM 0 HB THR A 901 0.057 -0.282 -3.864 1.00 0.00 H new ATOM 0 HG1 THR A 901 -1.202 0.863 -2.396 1.00 0.00 H new ATOM 0 HG21 THR A 901 1.041 -1.774 -2.172 1.00 0.00 H new ATOM 0 HG22 THR A 901 2.284 -1.093 -3.248 1.00 0.00 H new ATOM 0 HG23 THR A 901 2.078 -0.444 -1.604 1.00 0.00 H new ATOM 1753 N ASN A 902 1.714 0.930 -5.735 1.00 0.00 N ATOM 1754 CA ASN A 902 2.535 0.632 -6.890 1.00 0.00 C ATOM 1755 C ASN A 902 3.483 1.804 -7.153 1.00 0.00 C ATOM 1756 O ASN A 902 4.647 1.615 -7.477 1.00 0.00 O ATOM 1757 CB ASN A 902 1.663 0.375 -8.124 1.00 0.00 C ATOM 1758 CG ASN A 902 2.387 -0.401 -9.216 1.00 0.00 C ATOM 1759 OD1 ASN A 902 3.612 -0.364 -9.329 1.00 0.00 O ATOM 1760 ND2 ASN A 902 1.625 -1.105 -10.040 1.00 0.00 N ATOM 0 H ASN A 902 0.714 0.972 -5.930 1.00 0.00 H new ATOM 0 HA ASN A 902 3.114 -0.269 -6.689 1.00 0.00 H new ATOM 0 HB2 ASN A 902 0.773 -0.177 -7.824 1.00 0.00 H new ATOM 0 HB3 ASN A 902 1.325 1.329 -8.528 1.00 0.00 H new ATOM 0 HD21 ASN A 902 2.051 -1.639 -10.798 1.00 0.00 H new ATOM 0 HD22 ASN A 902 0.612 -1.113 -9.917 1.00 0.00 H new ATOM 1767 N ALA A 903 2.973 3.021 -6.981 1.00 0.00 N ATOM 1768 CA ALA A 903 3.783 4.226 -7.142 1.00 0.00 C ATOM 1769 C ALA A 903 4.927 4.245 -6.136 1.00 0.00 C ATOM 1770 O ALA A 903 6.054 4.601 -6.471 1.00 0.00 O ATOM 1771 CB ALA A 903 2.927 5.475 -6.994 1.00 0.00 C ATOM 0 H ALA A 903 2.001 3.199 -6.730 1.00 0.00 H new ATOM 0 HA ALA A 903 4.207 4.216 -8.146 1.00 0.00 H new ATOM 0 HB1 ALA A 903 3.551 6.360 -7.118 1.00 0.00 H new ATOM 0 HB2 ALA A 903 2.146 5.473 -7.754 1.00 0.00 H new ATOM 0 HB3 ALA A 903 2.471 5.488 -6.004 1.00 0.00 H new ATOM 1777 N ALA A 904 4.631 3.858 -4.901 1.00 0.00 N ATOM 1778 CA ALA A 904 5.658 3.733 -3.871 1.00 0.00 C ATOM 1779 C ALA A 904 6.672 2.660 -4.257 1.00 0.00 C ATOM 1780 O ALA A 904 7.846 2.731 -3.887 1.00 0.00 O ATOM 1781 CB ALA A 904 5.024 3.413 -2.524 1.00 0.00 C ATOM 0 H ALA A 904 3.689 3.625 -4.587 1.00 0.00 H new ATOM 0 HA ALA A 904 6.182 4.685 -3.786 1.00 0.00 H new ATOM 0 HB1 ALA A 904 5.803 3.323 -1.767 1.00 0.00 H new ATOM 0 HB2 ALA A 904 4.338 4.213 -2.245 1.00 0.00 H new ATOM 0 HB3 ALA A 904 4.476 2.473 -2.594 1.00 0.00 H new ATOM 1787 N ALA A 905 6.206 1.675 -5.017 1.00 0.00 N ATOM 1788 CA ALA A 905 7.060 0.609 -5.522 1.00 0.00 C ATOM 1789 C ALA A 905 8.056 1.151 -6.551 1.00 0.00 C ATOM 1790 O ALA A 905 9.181 0.662 -6.654 1.00 0.00 O ATOM 1791 CB ALA A 905 6.207 -0.506 -6.116 1.00 0.00 C ATOM 0 H ALA A 905 5.229 1.594 -5.299 1.00 0.00 H new ATOM 0 HA ALA A 905 7.635 0.198 -4.692 1.00 0.00 H new ATOM 0 HB1 ALA A 905 6.854 -1.299 -6.491 1.00 0.00 H new ATOM 0 HB2 ALA A 905 5.548 -0.909 -5.347 1.00 0.00 H new ATOM 0 HB3 ALA A 905 5.608 -0.109 -6.935 1.00 0.00 H new ATOM 1797 N GLN A 906 7.639 2.164 -7.312 1.00 0.00 N ATOM 1798 CA GLN A 906 8.548 2.849 -8.234 1.00 0.00 C ATOM 1799 C GLN A 906 9.440 3.819 -7.471 1.00 0.00 C ATOM 1800 O GLN A 906 10.617 3.974 -7.789 1.00 0.00 O ATOM 1801 CB GLN A 906 7.792 3.614 -9.326 1.00 0.00 C ATOM 1802 CG GLN A 906 7.283 2.759 -10.480 1.00 0.00 C ATOM 1803 CD GLN A 906 6.061 1.944 -10.122 1.00 0.00 C ATOM 1804 OE1 GLN A 906 4.932 2.426 -10.238 1.00 0.00 O ATOM 1805 NE2 GLN A 906 6.265 0.700 -9.723 1.00 0.00 N ATOM 0 H GLN A 906 6.686 2.527 -7.309 1.00 0.00 H new ATOM 0 HA GLN A 906 9.155 2.081 -8.714 1.00 0.00 H new ATOM 0 HB2 GLN A 906 6.943 4.123 -8.870 1.00 0.00 H new ATOM 0 HB3 GLN A 906 8.448 4.386 -9.728 1.00 0.00 H new ATOM 0 HG2 GLN A 906 7.046 3.405 -11.326 1.00 0.00 H new ATOM 0 HG3 GLN A 906 8.078 2.087 -10.804 1.00 0.00 H new ATOM 0 HE21 GLN A 906 7.216 0.340 -9.640 1.00 0.00 H new ATOM 0 HE22 GLN A 906 5.471 0.100 -9.498 1.00 0.00 H new ATOM 1814 N ASN A 907 8.864 4.472 -6.463 1.00 0.00 N ATOM 1815 CA ASN A 907 9.607 5.403 -5.608 1.00 0.00 C ATOM 1816 C ASN A 907 10.765 4.702 -4.914 1.00 0.00 C ATOM 1817 O ASN A 907 11.766 5.328 -4.562 1.00 0.00 O ATOM 1818 CB ASN A 907 8.688 6.029 -4.554 1.00 0.00 C ATOM 1819 CG ASN A 907 7.996 7.289 -5.038 1.00 0.00 C ATOM 1820 OD1 ASN A 907 8.517 8.391 -4.879 1.00 0.00 O ATOM 1821 ND2 ASN A 907 6.818 7.137 -5.621 1.00 0.00 N ATOM 0 H ASN A 907 7.879 4.374 -6.216 1.00 0.00 H new ATOM 0 HA ASN A 907 10.002 6.190 -6.250 1.00 0.00 H new ATOM 0 HB2 ASN A 907 7.934 5.299 -4.258 1.00 0.00 H new ATOM 0 HB3 ASN A 907 9.272 6.262 -3.664 1.00 0.00 H new ATOM 0 HD21 ASN A 907 6.307 7.953 -5.958 1.00 0.00 H new ATOM 0 HD22 ASN A 907 6.421 6.204 -5.733 1.00 0.00 H new ATOM 1828 N ALA A 908 10.613 3.403 -4.713 1.00 0.00 N ATOM 1829 CA ALA A 908 11.641 2.595 -4.088 1.00 0.00 C ATOM 1830 C ALA A 908 12.886 2.515 -4.962 1.00 0.00 C ATOM 1831 O ALA A 908 12.872 1.905 -6.033 1.00 0.00 O ATOM 1832 CB ALA A 908 11.109 1.201 -3.804 1.00 0.00 C ATOM 0 H ALA A 908 9.776 2.883 -4.978 1.00 0.00 H new ATOM 0 HA ALA A 908 11.920 3.070 -3.147 1.00 0.00 H new ATOM 0 HB1 ALA A 908 11.890 0.602 -3.334 1.00 0.00 H new ATOM 0 HB2 ALA A 908 10.251 1.268 -3.135 1.00 0.00 H new ATOM 0 HB3 ALA A 908 10.804 0.731 -4.739 1.00 0.00 H new ATOM 1838 N ILE A 909 13.952 3.152 -4.507 1.00 0.00 N ATOM 1839 CA ILE A 909 15.233 3.081 -5.189 1.00 0.00 C ATOM 1840 C ILE A 909 15.826 1.685 -5.050 1.00 0.00 C ATOM 1841 O ILE A 909 15.834 1.112 -3.959 1.00 0.00 O ATOM 1842 CB ILE A 909 16.227 4.120 -4.626 1.00 0.00 C ATOM 1843 CG1 ILE A 909 15.723 5.540 -4.903 1.00 0.00 C ATOM 1844 CG2 ILE A 909 17.617 3.911 -5.218 1.00 0.00 C ATOM 1845 CD1 ILE A 909 16.606 6.627 -4.327 1.00 0.00 C ATOM 0 H ILE A 909 13.955 3.727 -3.664 1.00 0.00 H new ATOM 0 HA ILE A 909 15.061 3.303 -6.242 1.00 0.00 H new ATOM 0 HB ILE A 909 16.298 3.985 -3.547 1.00 0.00 H new ATOM 0 HG12 ILE A 909 15.643 5.683 -5.981 1.00 0.00 H new ATOM 0 HG13 ILE A 909 14.719 5.645 -4.492 1.00 0.00 H new ATOM 0 HG21 ILE A 909 18.302 4.653 -4.808 1.00 0.00 H new ATOM 0 HG22 ILE A 909 17.973 2.912 -4.968 1.00 0.00 H new ATOM 0 HG23 ILE A 909 17.571 4.019 -6.302 1.00 0.00 H new ATOM 0 HD11 ILE A 909 16.183 7.603 -4.565 1.00 0.00 H new ATOM 0 HD12 ILE A 909 16.666 6.511 -3.245 1.00 0.00 H new ATOM 0 HD13 ILE A 909 17.605 6.550 -4.756 1.00 0.00 H new ATOM 1857 N LYS A 910 16.290 1.134 -6.163 1.00 0.00 N ATOM 1858 CA LYS A 910 16.948 -0.161 -6.153 1.00 0.00 C ATOM 1859 C LYS A 910 18.240 -0.094 -5.343 1.00 0.00 C ATOM 1860 O LYS A 910 19.085 0.774 -5.565 1.00 0.00 O ATOM 1861 CB LYS A 910 17.233 -0.637 -7.585 1.00 0.00 C ATOM 1862 CG LYS A 910 18.058 0.339 -8.415 1.00 0.00 C ATOM 1863 CD LYS A 910 18.385 -0.234 -9.788 1.00 0.00 C ATOM 1864 CE LYS A 910 19.257 -1.478 -9.684 1.00 0.00 C ATOM 1865 NZ LYS A 910 20.616 -1.169 -9.162 1.00 0.00 N ATOM 0 H LYS A 910 16.222 1.566 -7.085 1.00 0.00 H new ATOM 0 HA LYS A 910 16.280 -0.882 -5.682 1.00 0.00 H new ATOM 0 HB2 LYS A 910 17.757 -1.592 -7.541 1.00 0.00 H new ATOM 0 HB3 LYS A 910 16.285 -0.816 -8.092 1.00 0.00 H new ATOM 0 HG2 LYS A 910 17.510 1.274 -8.531 1.00 0.00 H new ATOM 0 HG3 LYS A 910 18.983 0.575 -7.888 1.00 0.00 H new ATOM 0 HD2 LYS A 910 17.460 -0.480 -10.310 1.00 0.00 H new ATOM 0 HD3 LYS A 910 18.897 0.521 -10.385 1.00 0.00 H new ATOM 0 HE2 LYS A 910 18.775 -2.204 -9.030 1.00 0.00 H new ATOM 0 HE3 LYS A 910 19.344 -1.942 -10.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 910 21.217 -2.015 -9.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 910 21.035 -0.398 -9.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 910 20.547 -0.878 -8.166 1.00 0.00 H new ATOM 1879 N LYS A 911 18.364 -0.989 -4.382 1.00 0.00 N ATOM 1880 CA LYS A 911 19.560 -1.065 -3.563 1.00 0.00 C ATOM 1881 C LYS A 911 20.554 -2.042 -4.178 1.00 0.00 C ATOM 1882 O LYS A 911 20.285 -3.261 -4.167 1.00 0.00 O ATOM 1883 CB LYS A 911 19.213 -1.451 -2.117 1.00 0.00 C ATOM 1884 CG LYS A 911 18.324 -2.680 -1.988 1.00 0.00 C ATOM 1885 CD LYS A 911 18.011 -2.984 -0.531 1.00 0.00 C ATOM 1886 CE LYS A 911 17.171 -4.246 -0.390 1.00 0.00 C ATOM 1887 NZ LYS A 911 16.872 -4.554 1.034 1.00 0.00 N ATOM 1888 OXT LYS A 911 21.591 -1.578 -4.699 1.00 0.00 O ATOM 0 H LYS A 911 17.648 -1.677 -4.148 1.00 0.00 H new ATOM 0 HA LYS A 911 20.026 -0.080 -3.532 1.00 0.00 H new ATOM 0 HB2 LYS A 911 20.139 -1.629 -1.570 1.00 0.00 H new ATOM 0 HB3 LYS A 911 18.716 -0.607 -1.638 1.00 0.00 H new ATOM 0 HG2 LYS A 911 17.396 -2.519 -2.536 1.00 0.00 H new ATOM 0 HG3 LYS A 911 18.818 -3.538 -2.443 1.00 0.00 H new ATOM 0 HD2 LYS A 911 18.941 -3.101 0.025 1.00 0.00 H new ATOM 0 HD3 LYS A 911 17.480 -2.141 -0.089 1.00 0.00 H new ATOM 0 HE2 LYS A 911 16.237 -4.125 -0.939 1.00 0.00 H new ATOM 0 HE3 LYS A 911 17.699 -5.086 -0.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 911 16.299 -5.420 1.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 911 17.762 -4.695 1.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 911 16.346 -3.763 1.457 1.00 0.00 H new TER 1902 LYS A 911