USER MOD reduce.3.24.130724 H: found=0, std=0, add=836, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 837 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 739 SER OG : rot 95:sc= -1.36 USER MOD Set 1.2: A 782 THR OG1 : rot -177:sc= -2.95! USER MOD Set 2.1: A 778 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 781 LYS NZ :NH3+ 152:sc= 1.15 (180deg=0.612) USER MOD Set 3.1: A 748 GLN : amide:sc= 0.138 K(o=0.62,f=-0.16) USER MOD Set 3.2: A 776 ASN : amide:sc= 0.483 K(o=0.62,f=-1.9) USER MOD Set 4.1: A 722 SER OG : rot 120:sc= -0.913! USER MOD Set 4.2: A 746 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.3: A 810 GLN : amide:sc= -2.21 X(o=-3.1,f=-2.9!) USER MOD Set 5.1: A 732 LYS NZ :NH3+ -147:sc= 2.41 (180deg=1.16) USER MOD Set 5.2: A 816 GLN : amide:sc= -3.85! C(o=-1.4!,f=-9.1!) USER MOD Single : A 720 LYS NZ :NH3+ 165:sc= -0.036 (180deg=-0.249) USER MOD Single : A 724 SER OG : rot 10:sc= 1.28 USER MOD Single : A 726 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 728 HIS : no HD1:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 729 HIS : no HD1:sc= -0.148 X(o=-0.15,f=-0.0097) USER MOD Single : A 734 CYS SG : rot 87:sc= -3.65! USER MOD Single : A 738 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 740 SER OG : rot 40:sc= 0.368 USER MOD Single : A 752 THR OG1 : rot 60:sc= -0.333 USER MOD Single : A 754 THR OG1 : rot 180:sc= 0 USER MOD Single : A 755 TYR OH : rot -80:sc= -0.0312 USER MOD Single : A 760 THR OG1 : rot 180:sc= -0.0134 USER MOD Single : A 762 SER OG : rot 180:sc= 0 USER MOD Single : A 763 SER OG : rot -22:sc= 0.194 USER MOD Single : A 764 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 766 LYS NZ :NH3+ 167:sc= -0.0697 (180deg=-0.5) USER MOD Single : A 767 THR OG1 : rot -43:sc= 1.3 USER MOD Single : A 771 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 774 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 775 THR OG1 : rot 180:sc= 0 USER MOD Single : A 786 THR OG1 : rot 180:sc= 0.00402 USER MOD Single : A 787 THR OG1 : rot 180:sc= -0.0743 USER MOD Single : A 791 TYR OH : rot 180:sc= 0 USER MOD Single : A 794 SER OG : rot 180:sc= -0.0333 USER MOD Single : A 797 SER OG : rot 5:sc= 1.23 USER MOD Single : A 799 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 801 SER OG : rot -28:sc= 0.0967 USER MOD Single : A 802 THR OG1 : rot -85:sc= 1.34 USER MOD Single : A 804 CYS SG : rot 180:sc= 0 USER MOD Single : A 809 SER OG : rot 180:sc= -0.013 USER MOD Single : A 814 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 718 -23.409 2.002 -1.922 1.00 0.00 N ATOM 2 CA ARG A 718 -22.556 1.148 -2.720 1.00 0.00 C ATOM 3 C ARG A 718 -21.615 1.989 -3.550 1.00 0.00 C ATOM 4 O ARG A 718 -22.032 2.816 -4.360 1.00 0.00 O ATOM 5 CB ARG A 718 -23.370 0.222 -3.618 1.00 0.00 C ATOM 6 CG ARG A 718 -22.516 -0.720 -4.458 1.00 0.00 C ATOM 7 CD ARG A 718 -21.629 -1.593 -3.584 1.00 0.00 C ATOM 8 NE ARG A 718 -20.753 -2.460 -4.371 1.00 0.00 N ATOM 9 CZ ARG A 718 -19.525 -2.816 -3.991 1.00 0.00 C ATOM 10 NH1 ARG A 718 -19.017 -2.350 -2.855 1.00 0.00 N ATOM 11 NH2 ARG A 718 -18.803 -3.631 -4.752 1.00 0.00 N ATOM 0 HA ARG A 718 -21.977 0.523 -2.041 1.00 0.00 H new ATOM 0 HB2 ARG A 718 -24.046 -0.368 -2.999 1.00 0.00 H new ATOM 0 HB3 ARG A 718 -23.990 0.825 -4.281 1.00 0.00 H new ATOM 0 HG2 ARG A 718 -23.161 -1.351 -5.069 1.00 0.00 H new ATOM 0 HG3 ARG A 718 -21.897 -0.140 -5.142 1.00 0.00 H new ATOM 0 HD2 ARG A 718 -21.023 -0.958 -2.938 1.00 0.00 H new ATOM 0 HD3 ARG A 718 -22.254 -2.206 -2.934 1.00 0.00 H new ATOM 0 HE ARG A 718 -21.101 -2.813 -5.262 1.00 0.00 H new ATOM 0 HH11 ARG A 718 -19.566 -1.719 -2.272 1.00 0.00 H new ATOM 0 HH12 ARG A 718 -18.078 -2.624 -2.566 1.00 0.00 H new ATOM 0 HH21 ARG A 718 -19.188 -3.985 -5.628 1.00 0.00 H new ATOM 0 HH22 ARG A 718 -17.864 -3.903 -4.461 1.00 0.00 H new ATOM 25 N VAL A 719 -20.345 1.752 -3.346 1.00 0.00 N ATOM 26 CA VAL A 719 -19.302 2.495 -4.006 1.00 0.00 C ATOM 27 C VAL A 719 -18.178 1.550 -4.357 1.00 0.00 C ATOM 28 O VAL A 719 -17.971 0.540 -3.688 1.00 0.00 O ATOM 29 CB VAL A 719 -18.781 3.652 -3.119 1.00 0.00 C ATOM 30 CG1 VAL A 719 -18.358 3.145 -1.748 1.00 0.00 C ATOM 31 CG2 VAL A 719 -17.638 4.407 -3.786 1.00 0.00 C ATOM 0 H VAL A 719 -20.002 1.031 -2.711 1.00 0.00 H new ATOM 0 HA VAL A 719 -19.708 2.943 -4.913 1.00 0.00 H new ATOM 0 HB VAL A 719 -19.607 4.351 -2.988 1.00 0.00 H new ATOM 0 HG11 VAL A 719 -17.997 3.979 -1.147 1.00 0.00 H new ATOM 0 HG12 VAL A 719 -19.211 2.683 -1.252 1.00 0.00 H new ATOM 0 HG13 VAL A 719 -17.562 2.409 -1.862 1.00 0.00 H new ATOM 0 HG21 VAL A 719 -17.301 5.211 -3.131 1.00 0.00 H new ATOM 0 HG22 VAL A 719 -16.811 3.722 -3.975 1.00 0.00 H new ATOM 0 HG23 VAL A 719 -17.983 4.829 -4.730 1.00 0.00 H new ATOM 41 N LYS A 720 -17.489 1.868 -5.422 1.00 0.00 N ATOM 42 CA LYS A 720 -16.384 1.051 -5.885 1.00 0.00 C ATOM 43 C LYS A 720 -15.136 1.378 -5.078 1.00 0.00 C ATOM 44 O LYS A 720 -14.510 2.421 -5.277 1.00 0.00 O ATOM 45 CB LYS A 720 -16.135 1.274 -7.375 1.00 0.00 C ATOM 46 CG LYS A 720 -17.357 1.016 -8.243 1.00 0.00 C ATOM 47 CD LYS A 720 -17.075 1.297 -9.713 1.00 0.00 C ATOM 48 CE LYS A 720 -16.074 0.311 -10.297 1.00 0.00 C ATOM 49 NZ LYS A 720 -16.586 -1.086 -10.269 1.00 0.00 N ATOM 0 H LYS A 720 -17.671 2.693 -5.993 1.00 0.00 H new ATOM 0 HA LYS A 720 -16.635 0.000 -5.742 1.00 0.00 H new ATOM 0 HB2 LYS A 720 -15.801 2.300 -7.529 1.00 0.00 H new ATOM 0 HB3 LYS A 720 -15.324 0.622 -7.701 1.00 0.00 H new ATOM 0 HG2 LYS A 720 -17.675 -0.020 -8.125 1.00 0.00 H new ATOM 0 HG3 LYS A 720 -18.182 1.643 -7.905 1.00 0.00 H new ATOM 0 HD2 LYS A 720 -18.006 1.246 -10.277 1.00 0.00 H new ATOM 0 HD3 LYS A 720 -16.691 2.311 -9.822 1.00 0.00 H new ATOM 0 HE2 LYS A 720 -15.845 0.593 -11.325 1.00 0.00 H new ATOM 0 HE3 LYS A 720 -15.141 0.366 -9.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 720 -16.004 -1.682 -10.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 720 -16.540 -1.453 -9.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 720 -17.572 -1.101 -10.599 1.00 0.00 H new ATOM 63 N PRO A 721 -14.760 0.489 -4.154 1.00 0.00 N ATOM 64 CA PRO A 721 -13.693 0.740 -3.206 1.00 0.00 C ATOM 65 C PRO A 721 -12.329 0.349 -3.752 1.00 0.00 C ATOM 66 O PRO A 721 -12.218 -0.544 -4.594 1.00 0.00 O ATOM 67 CB PRO A 721 -14.087 -0.137 -2.022 1.00 0.00 C ATOM 68 CG PRO A 721 -14.880 -1.269 -2.604 1.00 0.00 C ATOM 69 CD PRO A 721 -15.314 -0.861 -3.990 1.00 0.00 C ATOM 0 HA PRO A 721 -13.591 1.796 -2.957 1.00 0.00 H new ATOM 0 HB2 PRO A 721 -13.206 -0.505 -1.497 1.00 0.00 H new ATOM 0 HB3 PRO A 721 -14.678 0.424 -1.298 1.00 0.00 H new ATOM 0 HG2 PRO A 721 -14.278 -2.177 -2.644 1.00 0.00 H new ATOM 0 HG3 PRO A 721 -15.747 -1.488 -1.981 1.00 0.00 H new ATOM 0 HD2 PRO A 721 -14.929 -1.545 -4.746 1.00 0.00 H new ATOM 0 HD3 PRO A 721 -16.400 -0.861 -4.084 1.00 0.00 H new ATOM 77 N SER A 722 -11.296 1.017 -3.263 1.00 0.00 N ATOM 78 CA SER A 722 -9.953 0.830 -3.775 1.00 0.00 C ATOM 79 C SER A 722 -8.980 1.676 -2.953 1.00 0.00 C ATOM 80 O SER A 722 -9.193 1.893 -1.762 1.00 0.00 O ATOM 81 CB SER A 722 -9.923 1.232 -5.257 1.00 0.00 C ATOM 82 OG SER A 722 -8.704 0.862 -5.882 1.00 0.00 O ATOM 0 H SER A 722 -11.366 1.698 -2.507 1.00 0.00 H new ATOM 0 HA SER A 722 -9.653 -0.215 -3.693 1.00 0.00 H new ATOM 0 HB2 SER A 722 -10.756 0.760 -5.778 1.00 0.00 H new ATOM 0 HB3 SER A 722 -10.063 2.310 -5.344 1.00 0.00 H new ATOM 0 HG SER A 722 -8.889 0.247 -6.622 1.00 0.00 H new ATOM 88 N ALA A 723 -7.921 2.145 -3.586 1.00 0.00 N ATOM 89 CA ALA A 723 -6.925 2.969 -2.924 1.00 0.00 C ATOM 90 C ALA A 723 -6.185 3.792 -3.963 1.00 0.00 C ATOM 91 O ALA A 723 -6.148 3.413 -5.125 1.00 0.00 O ATOM 92 CB ALA A 723 -5.961 2.087 -2.148 1.00 0.00 C ATOM 0 H ALA A 723 -7.727 1.966 -4.571 1.00 0.00 H new ATOM 0 HA ALA A 723 -7.412 3.645 -2.221 1.00 0.00 H new ATOM 0 HB1 ALA A 723 -5.216 2.710 -1.653 1.00 0.00 H new ATOM 0 HB2 ALA A 723 -6.512 1.516 -1.400 1.00 0.00 H new ATOM 0 HB3 ALA A 723 -5.463 1.401 -2.833 1.00 0.00 H new ATOM 98 N SER A 724 -5.622 4.920 -3.564 1.00 0.00 N ATOM 99 CA SER A 724 -4.802 5.704 -4.471 1.00 0.00 C ATOM 100 C SER A 724 -3.697 6.401 -3.697 1.00 0.00 C ATOM 101 O SER A 724 -3.951 7.331 -2.925 1.00 0.00 O ATOM 102 CB SER A 724 -5.653 6.710 -5.259 1.00 0.00 C ATOM 103 OG SER A 724 -6.496 7.479 -4.412 1.00 0.00 O ATOM 0 H SER A 724 -5.716 5.311 -2.626 1.00 0.00 H new ATOM 0 HA SER A 724 -4.345 5.032 -5.197 1.00 0.00 H new ATOM 0 HB2 SER A 724 -4.998 7.377 -5.820 1.00 0.00 H new ATOM 0 HB3 SER A 724 -6.263 6.176 -5.988 1.00 0.00 H new ATOM 0 HG SER A 724 -6.251 7.321 -3.476 1.00 0.00 H new ATOM 109 N LEU A 725 -2.476 5.915 -3.869 1.00 0.00 N ATOM 110 CA LEU A 725 -1.352 6.421 -3.126 1.00 0.00 C ATOM 111 C LEU A 725 -1.088 7.882 -3.435 1.00 0.00 C ATOM 112 O LEU A 725 -1.273 8.347 -4.560 1.00 0.00 O ATOM 113 CB LEU A 725 -0.119 5.596 -3.433 1.00 0.00 C ATOM 114 CG LEU A 725 -0.332 4.083 -3.434 1.00 0.00 C ATOM 115 CD1 LEU A 725 0.990 3.393 -3.571 1.00 0.00 C ATOM 116 CD2 LEU A 725 -1.018 3.623 -2.168 1.00 0.00 C ATOM 0 H LEU A 725 -2.247 5.166 -4.523 1.00 0.00 H new ATOM 0 HA LEU A 725 -1.590 6.344 -2.065 1.00 0.00 H new ATOM 0 HB2 LEU A 725 0.264 5.894 -4.409 1.00 0.00 H new ATOM 0 HB3 LEU A 725 0.652 5.838 -2.701 1.00 0.00 H new ATOM 0 HG LEU A 725 -0.974 3.829 -4.277 1.00 0.00 H new ATOM 0 HD11 LEU A 725 0.839 2.314 -3.572 1.00 0.00 H new ATOM 0 HD12 LEU A 725 1.462 3.694 -4.506 1.00 0.00 H new ATOM 0 HD13 LEU A 725 1.633 3.669 -2.735 1.00 0.00 H new ATOM 0 HD21 LEU A 725 -1.155 2.542 -2.200 1.00 0.00 H new ATOM 0 HD22 LEU A 725 -0.405 3.886 -1.306 1.00 0.00 H new ATOM 0 HD23 LEU A 725 -1.990 4.109 -2.084 1.00 0.00 H new ATOM 128 N LYS A 726 -0.646 8.586 -2.420 1.00 0.00 N ATOM 129 CA LYS A 726 -0.396 10.013 -2.510 1.00 0.00 C ATOM 130 C LYS A 726 1.072 10.269 -2.805 1.00 0.00 C ATOM 131 O LYS A 726 1.452 11.362 -3.224 1.00 0.00 O ATOM 132 CB LYS A 726 -0.775 10.692 -1.203 1.00 0.00 C ATOM 133 CG LYS A 726 -2.148 10.303 -0.690 1.00 0.00 C ATOM 134 CD LYS A 726 -2.591 11.209 0.442 1.00 0.00 C ATOM 135 CE LYS A 726 -2.849 12.622 -0.053 1.00 0.00 C ATOM 136 NZ LYS A 726 -2.950 13.592 1.067 1.00 0.00 N ATOM 0 H LYS A 726 -0.447 8.187 -1.502 1.00 0.00 H new ATOM 0 HA LYS A 726 -1.002 10.422 -3.318 1.00 0.00 H new ATOM 0 HB2 LYS A 726 -0.031 10.445 -0.446 1.00 0.00 H new ATOM 0 HB3 LYS A 726 -0.741 11.773 -1.342 1.00 0.00 H new ATOM 0 HG2 LYS A 726 -2.871 10.355 -1.504 1.00 0.00 H new ATOM 0 HG3 LYS A 726 -2.130 9.269 -0.345 1.00 0.00 H new ATOM 0 HD2 LYS A 726 -3.497 10.809 0.898 1.00 0.00 H new ATOM 0 HD3 LYS A 726 -1.825 11.227 1.218 1.00 0.00 H new ATOM 0 HE2 LYS A 726 -2.044 12.924 -0.723 1.00 0.00 H new ATOM 0 HE3 LYS A 726 -3.771 12.640 -0.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 726 -3.126 14.544 0.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 726 -3.734 13.319 1.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 726 -2.061 13.594 1.606 1.00 0.00 H new ATOM 150 N LEU A 727 1.890 9.253 -2.567 1.00 0.00 N ATOM 151 CA LEU A 727 3.318 9.349 -2.803 1.00 0.00 C ATOM 152 C LEU A 727 3.598 9.478 -4.298 1.00 0.00 C ATOM 153 O LEU A 727 3.319 8.564 -5.073 1.00 0.00 O ATOM 154 CB LEU A 727 4.041 8.129 -2.221 1.00 0.00 C ATOM 155 CG LEU A 727 5.550 8.096 -2.454 1.00 0.00 C ATOM 156 CD1 LEU A 727 6.194 9.380 -1.960 1.00 0.00 C ATOM 157 CD2 LEU A 727 6.168 6.895 -1.762 1.00 0.00 C ATOM 0 H LEU A 727 1.583 8.349 -2.208 1.00 0.00 H new ATOM 0 HA LEU A 727 3.696 10.240 -2.302 1.00 0.00 H new ATOM 0 HB2 LEU A 727 3.854 8.094 -1.148 1.00 0.00 H new ATOM 0 HB3 LEU A 727 3.603 7.228 -2.651 1.00 0.00 H new ATOM 0 HG LEU A 727 5.730 8.009 -3.526 1.00 0.00 H new ATOM 0 HD11 LEU A 727 7.269 9.338 -2.134 1.00 0.00 H new ATOM 0 HD12 LEU A 727 5.772 10.229 -2.498 1.00 0.00 H new ATOM 0 HD13 LEU A 727 6.004 9.495 -0.893 1.00 0.00 H new ATOM 0 HD21 LEU A 727 7.244 6.887 -1.938 1.00 0.00 H new ATOM 0 HD22 LEU A 727 5.976 6.954 -0.691 1.00 0.00 H new ATOM 0 HD23 LEU A 727 5.728 5.980 -2.159 1.00 0.00 H new ATOM 169 N HIS A 728 4.143 10.619 -4.698 1.00 0.00 N ATOM 170 CA HIS A 728 4.388 10.899 -6.108 1.00 0.00 C ATOM 171 C HIS A 728 5.876 10.885 -6.436 1.00 0.00 C ATOM 172 O HIS A 728 6.333 11.591 -7.334 1.00 0.00 O ATOM 173 CB HIS A 728 3.777 12.243 -6.501 1.00 0.00 C ATOM 174 CG HIS A 728 2.283 12.221 -6.585 1.00 0.00 C ATOM 175 ND1 HIS A 728 1.474 12.963 -5.755 1.00 0.00 N ATOM 176 CD2 HIS A 728 1.450 11.545 -7.412 1.00 0.00 C ATOM 177 CE1 HIS A 728 0.211 12.746 -6.064 1.00 0.00 C ATOM 178 NE2 HIS A 728 0.167 11.889 -7.068 1.00 0.00 N ATOM 0 H HIS A 728 4.425 11.368 -4.065 1.00 0.00 H new ATOM 0 HA HIS A 728 3.911 10.107 -6.685 1.00 0.00 H new ATOM 0 HB2 HIS A 728 4.081 12.997 -5.775 1.00 0.00 H new ATOM 0 HB3 HIS A 728 4.182 12.549 -7.466 1.00 0.00 H new ATOM 0 HD2 HIS A 728 1.741 10.862 -8.196 1.00 0.00 H new ATOM 0 HE1 HIS A 728 -0.644 13.193 -5.578 1.00 0.00 H new ATOM 0 HE2 HIS A 728 -0.681 11.540 -7.514 1.00 0.00 H new ATOM 187 N HIS A 729 6.624 10.083 -5.700 1.00 0.00 N ATOM 188 CA HIS A 729 8.044 9.881 -5.958 1.00 0.00 C ATOM 189 C HIS A 729 8.500 8.615 -5.255 1.00 0.00 C ATOM 190 O HIS A 729 7.693 7.947 -4.611 1.00 0.00 O ATOM 191 CB HIS A 729 8.896 11.090 -5.525 1.00 0.00 C ATOM 192 CG HIS A 729 8.675 11.544 -4.115 1.00 0.00 C ATOM 193 ND1 HIS A 729 9.630 11.447 -3.127 1.00 0.00 N ATOM 194 CD2 HIS A 729 7.603 12.129 -3.545 1.00 0.00 C ATOM 195 CE1 HIS A 729 9.147 11.953 -2.005 1.00 0.00 C ATOM 196 NE2 HIS A 729 7.918 12.375 -2.234 1.00 0.00 N ATOM 0 H HIS A 729 6.267 9.552 -4.906 1.00 0.00 H new ATOM 0 HA HIS A 729 8.186 9.777 -7.034 1.00 0.00 H new ATOM 0 HB2 HIS A 729 9.949 10.837 -5.649 1.00 0.00 H new ATOM 0 HB3 HIS A 729 8.687 11.923 -6.197 1.00 0.00 H new ATOM 0 HD2 HIS A 729 6.667 12.361 -4.032 1.00 0.00 H new ATOM 0 HE1 HIS A 729 9.670 12.011 -1.062 1.00 0.00 H new ATOM 0 HE2 HIS A 729 7.303 12.813 -1.548 1.00 0.00 H new ATOM 205 N ASP A 730 9.770 8.275 -5.384 1.00 0.00 N ATOM 206 CA ASP A 730 10.287 7.061 -4.772 1.00 0.00 C ATOM 207 C ASP A 730 10.830 7.360 -3.381 1.00 0.00 C ATOM 208 O ASP A 730 11.380 8.435 -3.131 1.00 0.00 O ATOM 209 CB ASP A 730 11.363 6.413 -5.656 1.00 0.00 C ATOM 210 CG ASP A 730 12.637 7.230 -5.774 1.00 0.00 C ATOM 211 OD1 ASP A 730 12.561 8.420 -6.154 1.00 0.00 O ATOM 212 OD2 ASP A 730 13.725 6.670 -5.532 1.00 0.00 O ATOM 0 H ASP A 730 10.460 8.818 -5.903 1.00 0.00 H new ATOM 0 HA ASP A 730 9.467 6.349 -4.675 1.00 0.00 H new ATOM 0 HB2 ASP A 730 11.609 5.431 -5.251 1.00 0.00 H new ATOM 0 HB3 ASP A 730 10.952 6.253 -6.653 1.00 0.00 H new ATOM 217 N LEU A 731 10.633 6.419 -2.470 1.00 0.00 N ATOM 218 CA LEU A 731 11.044 6.588 -1.082 1.00 0.00 C ATOM 219 C LEU A 731 12.533 6.363 -0.905 1.00 0.00 C ATOM 220 O LEU A 731 12.993 5.239 -0.984 1.00 0.00 O ATOM 221 CB LEU A 731 10.269 5.629 -0.188 1.00 0.00 C ATOM 222 CG LEU A 731 8.921 6.152 0.268 1.00 0.00 C ATOM 223 CD1 LEU A 731 8.177 5.107 1.074 1.00 0.00 C ATOM 224 CD2 LEU A 731 9.082 7.429 1.077 1.00 0.00 C ATOM 0 H LEU A 731 10.187 5.523 -2.668 1.00 0.00 H new ATOM 0 HA LEU A 731 10.824 7.617 -0.796 1.00 0.00 H new ATOM 0 HB2 LEU A 731 10.119 4.692 -0.724 1.00 0.00 H new ATOM 0 HB3 LEU A 731 10.873 5.401 0.690 1.00 0.00 H new ATOM 0 HG LEU A 731 8.334 6.379 -0.622 1.00 0.00 H new ATOM 0 HD11 LEU A 731 7.214 5.508 1.389 1.00 0.00 H new ATOM 0 HD12 LEU A 731 8.018 4.220 0.461 1.00 0.00 H new ATOM 0 HD13 LEU A 731 8.763 4.840 1.953 1.00 0.00 H new ATOM 0 HD21 LEU A 731 8.102 7.785 1.393 1.00 0.00 H new ATOM 0 HD22 LEU A 731 9.696 7.228 1.955 1.00 0.00 H new ATOM 0 HD23 LEU A 731 9.564 8.190 0.463 1.00 0.00 H new ATOM 236 N LYS A 732 13.275 7.434 -0.657 1.00 0.00 N ATOM 237 CA LYS A 732 14.714 7.342 -0.441 1.00 0.00 C ATOM 238 C LYS A 732 15.025 6.836 0.963 1.00 0.00 C ATOM 239 O LYS A 732 14.908 7.579 1.941 1.00 0.00 O ATOM 240 CB LYS A 732 15.370 8.703 -0.646 1.00 0.00 C ATOM 241 CG LYS A 732 15.267 9.205 -2.069 1.00 0.00 C ATOM 242 CD LYS A 732 15.823 8.191 -3.052 1.00 0.00 C ATOM 243 CE LYS A 732 15.836 8.747 -4.455 1.00 0.00 C ATOM 244 NZ LYS A 732 16.157 7.710 -5.463 1.00 0.00 N ATOM 0 H LYS A 732 12.902 8.382 -0.600 1.00 0.00 H new ATOM 0 HA LYS A 732 15.115 6.634 -1.166 1.00 0.00 H new ATOM 0 HB2 LYS A 732 14.905 9.428 0.023 1.00 0.00 H new ATOM 0 HB3 LYS A 732 16.421 8.639 -0.365 1.00 0.00 H new ATOM 0 HG2 LYS A 732 14.224 9.414 -2.309 1.00 0.00 H new ATOM 0 HG3 LYS A 732 15.811 10.145 -2.166 1.00 0.00 H new ATOM 0 HD2 LYS A 732 16.835 7.912 -2.758 1.00 0.00 H new ATOM 0 HD3 LYS A 732 15.221 7.283 -3.023 1.00 0.00 H new ATOM 0 HE2 LYS A 732 14.863 9.182 -4.681 1.00 0.00 H new ATOM 0 HE3 LYS A 732 16.568 9.552 -4.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 732 16.687 8.141 -6.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 732 16.734 6.965 -5.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 732 15.276 7.295 -5.827 1.00 0.00 H new ATOM 258 N LEU A 733 15.414 5.574 1.068 1.00 0.00 N ATOM 259 CA LEU A 733 15.678 4.964 2.363 1.00 0.00 C ATOM 260 C LEU A 733 17.128 4.516 2.492 1.00 0.00 C ATOM 261 O LEU A 733 17.856 4.417 1.502 1.00 0.00 O ATOM 262 CB LEU A 733 14.768 3.763 2.588 1.00 0.00 C ATOM 263 CG LEU A 733 13.280 4.004 2.334 1.00 0.00 C ATOM 264 CD1 LEU A 733 12.488 2.772 2.707 1.00 0.00 C ATOM 265 CD2 LEU A 733 12.773 5.203 3.118 1.00 0.00 C ATOM 0 H LEU A 733 15.554 4.952 0.272 1.00 0.00 H new ATOM 0 HA LEU A 733 15.479 5.725 3.117 1.00 0.00 H new ATOM 0 HB2 LEU A 733 15.102 2.951 1.942 1.00 0.00 H new ATOM 0 HB3 LEU A 733 14.892 3.423 3.616 1.00 0.00 H new ATOM 0 HG LEU A 733 13.148 4.214 1.273 1.00 0.00 H new ATOM 0 HD11 LEU A 733 11.429 2.951 2.523 1.00 0.00 H new ATOM 0 HD12 LEU A 733 12.823 1.928 2.104 1.00 0.00 H new ATOM 0 HD13 LEU A 733 12.640 2.547 3.763 1.00 0.00 H new ATOM 0 HD21 LEU A 733 11.712 5.348 2.916 1.00 0.00 H new ATOM 0 HD22 LEU A 733 12.919 5.029 4.184 1.00 0.00 H new ATOM 0 HD23 LEU A 733 13.324 6.094 2.817 1.00 0.00 H new ATOM 277 N CYS A 734 17.525 4.247 3.722 1.00 0.00 N ATOM 278 CA CYS A 734 18.870 3.787 4.039 1.00 0.00 C ATOM 279 C CYS A 734 18.782 2.425 4.726 1.00 0.00 C ATOM 280 O CYS A 734 17.702 1.843 4.827 1.00 0.00 O ATOM 281 CB CYS A 734 19.553 4.817 4.940 1.00 0.00 C ATOM 282 SG CYS A 734 21.342 4.631 5.076 1.00 0.00 S ATOM 0 H CYS A 734 16.920 4.341 4.538 1.00 0.00 H new ATOM 0 HA CYS A 734 19.462 3.679 3.130 1.00 0.00 H new ATOM 0 HB2 CYS A 734 19.333 5.815 4.560 1.00 0.00 H new ATOM 0 HB3 CYS A 734 19.118 4.753 5.937 1.00 0.00 H new ATOM 0 HG CYS A 734 21.920 5.275 4.106 1.00 0.00 H new ATOM 288 N LEU A 735 19.910 1.913 5.185 1.00 0.00 N ATOM 289 CA LEU A 735 19.970 0.553 5.688 1.00 0.00 C ATOM 290 C LEU A 735 19.270 0.442 7.035 1.00 0.00 C ATOM 291 O LEU A 735 19.657 1.094 8.010 1.00 0.00 O ATOM 292 CB LEU A 735 21.415 0.106 5.808 1.00 0.00 C ATOM 293 CG LEU A 735 21.709 -1.350 5.435 1.00 0.00 C ATOM 294 CD1 LEU A 735 23.140 -1.706 5.789 1.00 0.00 C ATOM 295 CD2 LEU A 735 20.746 -2.302 6.108 1.00 0.00 C ATOM 0 H LEU A 735 20.796 2.418 5.220 1.00 0.00 H new ATOM 0 HA LEU A 735 19.454 -0.098 4.982 1.00 0.00 H new ATOM 0 HB2 LEU A 735 22.026 0.751 5.176 1.00 0.00 H new ATOM 0 HB3 LEU A 735 21.739 0.268 6.836 1.00 0.00 H new ATOM 0 HG LEU A 735 21.575 -1.451 4.358 1.00 0.00 H new ATOM 0 HD11 LEU A 735 23.334 -2.744 5.518 1.00 0.00 H new ATOM 0 HD12 LEU A 735 23.823 -1.055 5.243 1.00 0.00 H new ATOM 0 HD13 LEU A 735 23.293 -1.576 6.860 1.00 0.00 H new ATOM 0 HD21 LEU A 735 20.985 -3.326 5.820 1.00 0.00 H new ATOM 0 HD22 LEU A 735 20.830 -2.200 7.190 1.00 0.00 H new ATOM 0 HD23 LEU A 735 19.727 -2.067 5.800 1.00 0.00 H new ATOM 307 N GLY A 736 18.239 -0.389 7.074 1.00 0.00 N ATOM 308 CA GLY A 736 17.474 -0.572 8.292 1.00 0.00 C ATOM 309 C GLY A 736 16.369 0.454 8.424 1.00 0.00 C ATOM 310 O GLY A 736 15.755 0.591 9.486 1.00 0.00 O ATOM 0 H GLY A 736 17.917 -0.943 6.280 1.00 0.00 H new ATOM 0 HA2 GLY A 736 17.043 -1.573 8.303 1.00 0.00 H new ATOM 0 HA3 GLY A 736 18.139 -0.502 9.153 1.00 0.00 H new ATOM 314 N ASP A 737 16.131 1.183 7.345 1.00 0.00 N ATOM 315 CA ASP A 737 15.060 2.176 7.306 1.00 0.00 C ATOM 316 C ASP A 737 13.700 1.489 7.172 1.00 0.00 C ATOM 317 O ASP A 737 13.617 0.290 6.902 1.00 0.00 O ATOM 318 CB ASP A 737 15.266 3.121 6.119 1.00 0.00 C ATOM 319 CG ASP A 737 14.754 4.533 6.361 1.00 0.00 C ATOM 320 OD1 ASP A 737 13.754 4.704 7.091 1.00 0.00 O ATOM 321 OD2 ASP A 737 15.352 5.483 5.808 1.00 0.00 O ATOM 0 H ASP A 737 16.665 1.108 6.480 1.00 0.00 H new ATOM 0 HA ASP A 737 15.084 2.745 8.236 1.00 0.00 H new ATOM 0 HB2 ASP A 737 16.329 3.166 5.883 1.00 0.00 H new ATOM 0 HB3 ASP A 737 14.762 2.707 5.245 1.00 0.00 H new ATOM 326 N HIS A 738 12.642 2.257 7.356 1.00 0.00 N ATOM 327 CA HIS A 738 11.285 1.778 7.162 1.00 0.00 C ATOM 328 C HIS A 738 10.592 2.722 6.196 1.00 0.00 C ATOM 329 O HIS A 738 10.960 3.893 6.106 1.00 0.00 O ATOM 330 CB HIS A 738 10.523 1.703 8.496 1.00 0.00 C ATOM 331 CG HIS A 738 10.198 3.036 9.106 1.00 0.00 C ATOM 332 ND1 HIS A 738 11.059 3.712 9.944 1.00 0.00 N ATOM 333 CD2 HIS A 738 9.093 3.813 9.001 1.00 0.00 C ATOM 334 CE1 HIS A 738 10.498 4.845 10.328 1.00 0.00 C ATOM 335 NE2 HIS A 738 9.305 4.930 9.769 1.00 0.00 N ATOM 0 H HIS A 738 12.699 3.234 7.645 1.00 0.00 H new ATOM 0 HA HIS A 738 11.304 0.767 6.754 1.00 0.00 H new ATOM 0 HB2 HIS A 738 9.595 1.154 8.339 1.00 0.00 H new ATOM 0 HB3 HIS A 738 11.117 1.128 9.207 1.00 0.00 H new ATOM 0 HD2 HIS A 738 8.209 3.594 8.420 1.00 0.00 H new ATOM 0 HE1 HIS A 738 10.940 5.577 10.987 1.00 0.00 H new ATOM 0 HE2 HIS A 738 8.648 5.701 9.889 1.00 0.00 H new ATOM 344 N SER A 739 9.601 2.242 5.479 1.00 0.00 N ATOM 345 CA SER A 739 9.002 3.057 4.440 1.00 0.00 C ATOM 346 C SER A 739 7.680 3.650 4.904 1.00 0.00 C ATOM 347 O SER A 739 7.003 3.090 5.763 1.00 0.00 O ATOM 348 CB SER A 739 8.804 2.230 3.180 1.00 0.00 C ATOM 349 OG SER A 739 9.881 1.329 3.005 1.00 0.00 O ATOM 0 H SER A 739 9.198 1.312 5.590 1.00 0.00 H new ATOM 0 HA SER A 739 9.678 3.883 4.218 1.00 0.00 H new ATOM 0 HB2 SER A 739 7.867 1.678 3.244 1.00 0.00 H new ATOM 0 HB3 SER A 739 8.728 2.888 2.314 1.00 0.00 H new ATOM 0 HG SER A 739 9.643 0.457 3.384 1.00 0.00 H new ATOM 355 N SER A 740 7.331 4.789 4.335 1.00 0.00 N ATOM 356 CA SER A 740 6.092 5.469 4.662 1.00 0.00 C ATOM 357 C SER A 740 5.474 6.064 3.402 1.00 0.00 C ATOM 358 O SER A 740 5.950 7.065 2.862 1.00 0.00 O ATOM 359 CB SER A 740 6.329 6.553 5.722 1.00 0.00 C ATOM 360 OG SER A 740 7.334 7.471 5.318 1.00 0.00 O ATOM 0 H SER A 740 7.897 5.268 3.635 1.00 0.00 H new ATOM 0 HA SER A 740 5.395 4.743 5.080 1.00 0.00 H new ATOM 0 HB2 SER A 740 5.399 7.090 5.908 1.00 0.00 H new ATOM 0 HB3 SER A 740 6.620 6.085 6.662 1.00 0.00 H new ATOM 0 HG SER A 740 7.236 7.663 4.362 1.00 0.00 H new ATOM 366 N VAL A 741 4.430 5.421 2.922 1.00 0.00 N ATOM 367 CA VAL A 741 3.731 5.867 1.734 1.00 0.00 C ATOM 368 C VAL A 741 2.287 6.201 2.077 1.00 0.00 C ATOM 369 O VAL A 741 1.512 5.336 2.490 1.00 0.00 O ATOM 370 CB VAL A 741 3.801 4.818 0.601 1.00 0.00 C ATOM 371 CG1 VAL A 741 3.557 3.415 1.130 1.00 0.00 C ATOM 372 CG2 VAL A 741 2.809 5.147 -0.506 1.00 0.00 C ATOM 0 H VAL A 741 4.042 4.577 3.343 1.00 0.00 H new ATOM 0 HA VAL A 741 4.225 6.767 1.367 1.00 0.00 H new ATOM 0 HB VAL A 741 4.808 4.852 0.185 1.00 0.00 H new ATOM 0 HG11 VAL A 741 3.613 2.701 0.308 1.00 0.00 H new ATOM 0 HG12 VAL A 741 4.314 3.170 1.875 1.00 0.00 H new ATOM 0 HG13 VAL A 741 2.569 3.365 1.587 1.00 0.00 H new ATOM 0 HG21 VAL A 741 2.877 4.394 -1.291 1.00 0.00 H new ATOM 0 HG22 VAL A 741 1.798 5.155 -0.098 1.00 0.00 H new ATOM 0 HG23 VAL A 741 3.040 6.128 -0.922 1.00 0.00 H new ATOM 382 N PRO A 742 1.918 7.473 1.948 1.00 0.00 N ATOM 383 CA PRO A 742 0.570 7.924 2.232 1.00 0.00 C ATOM 384 C PRO A 742 -0.383 7.535 1.115 1.00 0.00 C ATOM 385 O PRO A 742 -0.080 7.741 -0.054 1.00 0.00 O ATOM 386 CB PRO A 742 0.689 9.449 2.337 1.00 0.00 C ATOM 387 CG PRO A 742 2.121 9.792 2.052 1.00 0.00 C ATOM 388 CD PRO A 742 2.779 8.567 1.495 1.00 0.00 C ATOM 0 HA PRO A 742 0.170 7.474 3.140 1.00 0.00 H new ATOM 0 HB2 PRO A 742 0.025 9.939 1.625 1.00 0.00 H new ATOM 0 HB3 PRO A 742 0.400 9.792 3.330 1.00 0.00 H new ATOM 0 HG2 PRO A 742 2.183 10.616 1.342 1.00 0.00 H new ATOM 0 HG3 PRO A 742 2.625 10.117 2.962 1.00 0.00 H new ATOM 0 HD2 PRO A 742 2.839 8.605 0.407 1.00 0.00 H new ATOM 0 HD3 PRO A 742 3.797 8.455 1.867 1.00 0.00 H new ATOM 396 N VAL A 743 -1.508 6.935 1.464 1.00 0.00 N ATOM 397 CA VAL A 743 -2.517 6.606 0.472 1.00 0.00 C ATOM 398 C VAL A 743 -3.893 7.147 0.835 1.00 0.00 C ATOM 399 O VAL A 743 -4.453 6.828 1.878 1.00 0.00 O ATOM 400 CB VAL A 743 -2.629 5.092 0.228 1.00 0.00 C ATOM 401 CG1 VAL A 743 -2.617 4.328 1.526 1.00 0.00 C ATOM 402 CG2 VAL A 743 -3.870 4.764 -0.587 1.00 0.00 C ATOM 0 H VAL A 743 -1.745 6.667 2.419 1.00 0.00 H new ATOM 0 HA VAL A 743 -2.178 7.090 -0.444 1.00 0.00 H new ATOM 0 HB VAL A 743 -1.756 4.782 -0.347 1.00 0.00 H new ATOM 0 HG11 VAL A 743 -2.698 3.261 1.321 1.00 0.00 H new ATOM 0 HG12 VAL A 743 -1.686 4.526 2.056 1.00 0.00 H new ATOM 0 HG13 VAL A 743 -3.459 4.644 2.142 1.00 0.00 H new ATOM 0 HG21 VAL A 743 -3.927 3.687 -0.746 1.00 0.00 H new ATOM 0 HG22 VAL A 743 -4.757 5.099 -0.049 1.00 0.00 H new ATOM 0 HG23 VAL A 743 -3.817 5.271 -1.551 1.00 0.00 H new ATOM 412 N ALA A 744 -4.431 7.966 -0.042 1.00 0.00 N ATOM 413 CA ALA A 744 -5.815 8.368 0.043 1.00 0.00 C ATOM 414 C ALA A 744 -6.662 7.284 -0.589 1.00 0.00 C ATOM 415 O ALA A 744 -6.734 7.142 -1.808 1.00 0.00 O ATOM 416 CB ALA A 744 -6.038 9.717 -0.605 1.00 0.00 C ATOM 0 H ALA A 744 -3.923 8.369 -0.829 1.00 0.00 H new ATOM 0 HA ALA A 744 -6.106 8.487 1.087 1.00 0.00 H new ATOM 0 HB1 ALA A 744 -7.090 9.990 -0.524 1.00 0.00 H new ATOM 0 HB2 ALA A 744 -5.428 10.468 -0.102 1.00 0.00 H new ATOM 0 HB3 ALA A 744 -5.757 9.666 -1.657 1.00 0.00 H new ATOM 422 N LEU A 745 -7.263 6.500 0.271 1.00 0.00 N ATOM 423 CA LEU A 745 -7.914 5.272 -0.122 1.00 0.00 C ATOM 424 C LEU A 745 -9.300 5.538 -0.679 1.00 0.00 C ATOM 425 O LEU A 745 -9.819 6.647 -0.571 1.00 0.00 O ATOM 426 CB LEU A 745 -7.974 4.367 1.095 1.00 0.00 C ATOM 427 CG LEU A 745 -6.649 4.289 1.844 1.00 0.00 C ATOM 428 CD1 LEU A 745 -6.868 4.325 3.334 1.00 0.00 C ATOM 429 CD2 LEU A 745 -5.884 3.044 1.446 1.00 0.00 C ATOM 0 H LEU A 745 -7.315 6.696 1.271 1.00 0.00 H new ATOM 0 HA LEU A 745 -7.348 4.788 -0.918 1.00 0.00 H new ATOM 0 HB2 LEU A 745 -8.747 4.729 1.772 1.00 0.00 H new ATOM 0 HB3 LEU A 745 -8.268 3.365 0.782 1.00 0.00 H new ATOM 0 HG LEU A 745 -6.054 5.160 1.570 1.00 0.00 H new ATOM 0 HD11 LEU A 745 -5.907 4.268 3.845 1.00 0.00 H new ATOM 0 HD12 LEU A 745 -7.369 5.254 3.606 1.00 0.00 H new ATOM 0 HD13 LEU A 745 -7.487 3.479 3.631 1.00 0.00 H new ATOM 0 HD21 LEU A 745 -4.941 3.006 1.991 1.00 0.00 H new ATOM 0 HD22 LEU A 745 -6.477 2.161 1.685 1.00 0.00 H new ATOM 0 HD23 LEU A 745 -5.683 3.067 0.375 1.00 0.00 H new ATOM 441 N LYS A 746 -9.889 4.521 -1.280 1.00 0.00 N ATOM 442 CA LYS A 746 -11.183 4.664 -1.908 1.00 0.00 C ATOM 443 C LYS A 746 -12.172 3.677 -1.327 1.00 0.00 C ATOM 444 O LYS A 746 -11.800 2.613 -0.839 1.00 0.00 O ATOM 445 CB LYS A 746 -11.070 4.474 -3.409 1.00 0.00 C ATOM 446 CG LYS A 746 -12.317 4.889 -4.163 1.00 0.00 C ATOM 447 CD LYS A 746 -12.015 5.210 -5.615 1.00 0.00 C ATOM 448 CE LYS A 746 -11.084 6.409 -5.746 1.00 0.00 C ATOM 449 NZ LYS A 746 -10.902 6.828 -7.161 1.00 0.00 N ATOM 0 H LYS A 746 -9.488 3.585 -1.345 1.00 0.00 H new ATOM 0 HA LYS A 746 -11.547 5.673 -1.711 1.00 0.00 H new ATOM 0 HB2 LYS A 746 -10.222 5.051 -3.778 1.00 0.00 H new ATOM 0 HB3 LYS A 746 -10.858 3.426 -3.620 1.00 0.00 H new ATOM 0 HG2 LYS A 746 -13.055 4.089 -4.113 1.00 0.00 H new ATOM 0 HG3 LYS A 746 -12.760 5.761 -3.682 1.00 0.00 H new ATOM 0 HD2 LYS A 746 -11.560 4.342 -6.092 1.00 0.00 H new ATOM 0 HD3 LYS A 746 -12.946 5.413 -6.144 1.00 0.00 H new ATOM 0 HE2 LYS A 746 -11.486 7.243 -5.171 1.00 0.00 H new ATOM 0 HE3 LYS A 746 -10.114 6.162 -5.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 746 -10.261 7.646 -7.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 746 -10.494 6.042 -7.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 746 -11.823 7.089 -7.567 1.00 0.00 H new ATOM 463 N GLY A 747 -13.428 4.035 -1.420 1.00 0.00 N ATOM 464 CA GLY A 747 -14.479 3.256 -0.796 1.00 0.00 C ATOM 465 C GLY A 747 -14.775 3.763 0.596 1.00 0.00 C ATOM 466 O GLY A 747 -13.860 3.984 1.379 1.00 0.00 O ATOM 0 H GLY A 747 -13.753 4.862 -1.922 1.00 0.00 H new ATOM 0 HA2 GLY A 747 -15.382 3.304 -1.404 1.00 0.00 H new ATOM 0 HA3 GLY A 747 -14.181 2.208 -0.750 1.00 0.00 H new ATOM 470 N GLN A 748 -16.041 3.936 0.918 1.00 0.00 N ATOM 471 CA GLN A 748 -16.404 4.611 2.160 1.00 0.00 C ATOM 472 C GLN A 748 -16.827 3.638 3.249 1.00 0.00 C ATOM 473 O GLN A 748 -17.772 2.866 3.080 1.00 0.00 O ATOM 474 CB GLN A 748 -17.527 5.620 1.921 1.00 0.00 C ATOM 475 CG GLN A 748 -17.270 6.568 0.762 1.00 0.00 C ATOM 476 CD GLN A 748 -15.980 7.350 0.910 1.00 0.00 C ATOM 477 OE1 GLN A 748 -15.545 7.662 2.020 1.00 0.00 O ATOM 478 NE2 GLN A 748 -15.364 7.677 -0.212 1.00 0.00 N ATOM 0 H GLN A 748 -16.830 3.626 0.350 1.00 0.00 H new ATOM 0 HA GLN A 748 -15.508 5.130 2.501 1.00 0.00 H new ATOM 0 HB2 GLN A 748 -18.455 5.078 1.735 1.00 0.00 H new ATOM 0 HB3 GLN A 748 -17.676 6.205 2.829 1.00 0.00 H new ATOM 0 HG2 GLN A 748 -17.238 5.998 -0.166 1.00 0.00 H new ATOM 0 HG3 GLN A 748 -18.104 7.265 0.679 1.00 0.00 H new ATOM 0 HE21 GLN A 748 -15.759 7.399 -1.110 1.00 0.00 H new ATOM 0 HE22 GLN A 748 -14.494 8.208 -0.180 1.00 0.00 H new ATOM 487 N GLY A 749 -16.135 3.710 4.375 1.00 0.00 N ATOM 488 CA GLY A 749 -16.439 2.859 5.503 1.00 0.00 C ATOM 489 C GLY A 749 -15.394 1.800 5.703 1.00 0.00 C ATOM 490 O GLY A 749 -14.350 1.853 5.076 1.00 0.00 O ATOM 0 H GLY A 749 -15.358 4.353 4.527 1.00 0.00 H new ATOM 0 HA2 GLY A 749 -16.518 3.466 6.405 1.00 0.00 H new ATOM 0 HA3 GLY A 749 -17.410 2.387 5.351 1.00 0.00 H new ATOM 494 N PRO A 750 -15.662 0.821 6.574 1.00 0.00 N ATOM 495 CA PRO A 750 -14.724 -0.262 6.891 1.00 0.00 C ATOM 496 C PRO A 750 -14.473 -1.216 5.720 1.00 0.00 C ATOM 497 O PRO A 750 -15.270 -2.118 5.446 1.00 0.00 O ATOM 498 CB PRO A 750 -15.440 -0.975 8.034 1.00 0.00 C ATOM 499 CG PRO A 750 -16.868 -0.747 7.741 1.00 0.00 C ATOM 500 CD PRO A 750 -16.913 0.680 7.338 1.00 0.00 C ATOM 0 HA PRO A 750 -13.729 0.109 7.135 1.00 0.00 H new ATOM 0 HB2 PRO A 750 -15.200 -2.038 8.057 1.00 0.00 H new ATOM 0 HB3 PRO A 750 -15.158 -0.563 9.003 1.00 0.00 H new ATOM 0 HG2 PRO A 750 -17.224 -1.401 6.945 1.00 0.00 H new ATOM 0 HG3 PRO A 750 -17.493 -0.938 8.614 1.00 0.00 H new ATOM 0 HD2 PRO A 750 -17.790 0.905 6.731 1.00 0.00 H new ATOM 0 HD3 PRO A 750 -16.942 1.347 8.200 1.00 0.00 H new ATOM 508 N PHE A 751 -13.356 -1.014 5.039 1.00 0.00 N ATOM 509 CA PHE A 751 -12.971 -1.866 3.924 1.00 0.00 C ATOM 510 C PHE A 751 -11.691 -2.632 4.227 1.00 0.00 C ATOM 511 O PHE A 751 -10.783 -2.114 4.863 1.00 0.00 O ATOM 512 CB PHE A 751 -12.797 -1.032 2.657 1.00 0.00 C ATOM 513 CG PHE A 751 -14.104 -0.633 2.041 1.00 0.00 C ATOM 514 CD1 PHE A 751 -14.703 0.572 2.352 1.00 0.00 C ATOM 515 CD2 PHE A 751 -14.743 -1.482 1.159 1.00 0.00 C ATOM 516 CE1 PHE A 751 -15.914 0.920 1.792 1.00 0.00 C ATOM 517 CE2 PHE A 751 -15.954 -1.134 0.595 1.00 0.00 C ATOM 518 CZ PHE A 751 -16.540 0.068 0.914 1.00 0.00 C ATOM 0 H PHE A 751 -12.696 -0.263 5.240 1.00 0.00 H new ATOM 0 HA PHE A 751 -13.769 -2.592 3.767 1.00 0.00 H new ATOM 0 HB2 PHE A 751 -12.223 -0.136 2.893 1.00 0.00 H new ATOM 0 HB3 PHE A 751 -12.216 -1.600 1.930 1.00 0.00 H new ATOM 0 HD1 PHE A 751 -14.218 1.248 3.040 1.00 0.00 H new ATOM 0 HD2 PHE A 751 -14.290 -2.430 0.907 1.00 0.00 H new ATOM 0 HE1 PHE A 751 -16.372 1.865 2.044 1.00 0.00 H new ATOM 0 HE2 PHE A 751 -16.441 -1.806 -0.097 1.00 0.00 H new ATOM 0 HZ PHE A 751 -17.489 0.342 0.476 1.00 0.00 H new ATOM 528 N THR A 752 -11.619 -3.872 3.773 1.00 0.00 N ATOM 529 CA THR A 752 -10.429 -4.680 3.984 1.00 0.00 C ATOM 530 C THR A 752 -9.444 -4.447 2.861 1.00 0.00 C ATOM 531 O THR A 752 -9.594 -4.962 1.758 1.00 0.00 O ATOM 532 CB THR A 752 -10.772 -6.172 4.112 1.00 0.00 C ATOM 533 OG1 THR A 752 -11.613 -6.377 5.254 1.00 0.00 O ATOM 534 CG2 THR A 752 -9.512 -7.012 4.239 1.00 0.00 C ATOM 0 H THR A 752 -12.366 -4.339 3.259 1.00 0.00 H new ATOM 0 HA THR A 752 -9.972 -4.374 4.925 1.00 0.00 H new ATOM 0 HB THR A 752 -11.299 -6.484 3.210 1.00 0.00 H new ATOM 0 HG1 THR A 752 -12.439 -5.860 5.149 1.00 0.00 H new ATOM 0 HG21 THR A 752 -9.783 -8.064 4.328 1.00 0.00 H new ATOM 0 HG22 THR A 752 -8.890 -6.871 3.355 1.00 0.00 H new ATOM 0 HG23 THR A 752 -8.957 -6.704 5.125 1.00 0.00 H new ATOM 542 N LEU A 753 -8.436 -3.664 3.173 1.00 0.00 N ATOM 543 CA LEU A 753 -7.509 -3.166 2.183 1.00 0.00 C ATOM 544 C LEU A 753 -6.315 -4.099 2.053 1.00 0.00 C ATOM 545 O LEU A 753 -5.715 -4.488 3.050 1.00 0.00 O ATOM 546 CB LEU A 753 -7.039 -1.774 2.596 1.00 0.00 C ATOM 547 CG LEU A 753 -6.017 -1.133 1.663 1.00 0.00 C ATOM 548 CD1 LEU A 753 -6.687 -0.590 0.411 1.00 0.00 C ATOM 549 CD2 LEU A 753 -5.249 -0.055 2.391 1.00 0.00 C ATOM 0 H LEU A 753 -8.236 -3.354 4.124 1.00 0.00 H new ATOM 0 HA LEU A 753 -8.010 -3.115 1.216 1.00 0.00 H new ATOM 0 HB2 LEU A 753 -7.908 -1.119 2.663 1.00 0.00 H new ATOM 0 HB3 LEU A 753 -6.608 -1.835 3.595 1.00 0.00 H new ATOM 0 HG LEU A 753 -5.309 -1.898 1.345 1.00 0.00 H new ATOM 0 HD11 LEU A 753 -5.936 -0.138 -0.237 1.00 0.00 H new ATOM 0 HD12 LEU A 753 -7.182 -1.404 -0.119 1.00 0.00 H new ATOM 0 HD13 LEU A 753 -7.425 0.162 0.690 1.00 0.00 H new ATOM 0 HD21 LEU A 753 -4.523 0.395 1.714 1.00 0.00 H new ATOM 0 HD22 LEU A 753 -5.941 0.711 2.742 1.00 0.00 H new ATOM 0 HD23 LEU A 753 -4.729 -0.492 3.243 1.00 0.00 H new ATOM 561 N THR A 754 -5.978 -4.464 0.830 1.00 0.00 N ATOM 562 CA THR A 754 -4.854 -5.347 0.593 1.00 0.00 C ATOM 563 C THR A 754 -3.869 -4.737 -0.398 1.00 0.00 C ATOM 564 O THR A 754 -4.271 -4.207 -1.439 1.00 0.00 O ATOM 565 CB THR A 754 -5.318 -6.698 0.046 1.00 0.00 C ATOM 566 OG1 THR A 754 -6.620 -7.016 0.558 1.00 0.00 O ATOM 567 CG2 THR A 754 -4.335 -7.761 0.466 1.00 0.00 C ATOM 0 H THR A 754 -6.467 -4.162 -0.013 1.00 0.00 H new ATOM 0 HA THR A 754 -4.361 -5.491 1.554 1.00 0.00 H new ATOM 0 HB THR A 754 -5.370 -6.650 -1.042 1.00 0.00 H new ATOM 0 HG1 THR A 754 -6.909 -7.882 0.201 1.00 0.00 H new ATOM 0 HG21 THR A 754 -4.658 -8.728 0.080 1.00 0.00 H new ATOM 0 HG22 THR A 754 -3.349 -7.522 0.068 1.00 0.00 H new ATOM 0 HG23 THR A 754 -4.287 -7.802 1.554 1.00 0.00 H new ATOM 575 N TYR A 755 -2.585 -4.819 -0.080 1.00 0.00 N ATOM 576 CA TYR A 755 -1.549 -4.318 -0.967 1.00 0.00 C ATOM 577 C TYR A 755 -0.288 -5.178 -0.883 1.00 0.00 C ATOM 578 O TYR A 755 -0.040 -5.837 0.129 1.00 0.00 O ATOM 579 CB TYR A 755 -1.228 -2.850 -0.653 1.00 0.00 C ATOM 580 CG TYR A 755 -0.933 -2.567 0.804 1.00 0.00 C ATOM 581 CD1 TYR A 755 0.319 -2.823 1.342 1.00 0.00 C ATOM 582 CD2 TYR A 755 -1.906 -2.026 1.636 1.00 0.00 C ATOM 583 CE1 TYR A 755 0.595 -2.548 2.667 1.00 0.00 C ATOM 584 CE2 TYR A 755 -1.639 -1.751 2.964 1.00 0.00 C ATOM 585 CZ TYR A 755 -0.384 -2.015 3.473 1.00 0.00 C ATOM 586 OH TYR A 755 -0.103 -1.740 4.790 1.00 0.00 O ATOM 0 H TYR A 755 -2.237 -5.228 0.787 1.00 0.00 H new ATOM 0 HA TYR A 755 -1.926 -4.375 -1.988 1.00 0.00 H new ATOM 0 HB2 TYR A 755 -0.369 -2.544 -1.250 1.00 0.00 H new ATOM 0 HB3 TYR A 755 -2.070 -2.233 -0.966 1.00 0.00 H new ATOM 0 HD1 TYR A 755 1.091 -3.244 0.715 1.00 0.00 H new ATOM 0 HD2 TYR A 755 -2.888 -1.817 1.238 1.00 0.00 H new ATOM 0 HE1 TYR A 755 1.577 -2.751 3.069 1.00 0.00 H new ATOM 0 HE2 TYR A 755 -2.407 -1.333 3.598 1.00 0.00 H new ATOM 0 HH TYR A 755 -0.152 -2.566 5.314 1.00 0.00 H new ATOM 596 N ASP A 756 0.491 -5.165 -1.959 1.00 0.00 N ATOM 597 CA ASP A 756 1.723 -5.940 -2.049 1.00 0.00 C ATOM 598 C ASP A 756 2.928 -5.026 -2.194 1.00 0.00 C ATOM 599 O ASP A 756 2.997 -4.214 -3.116 1.00 0.00 O ATOM 600 CB ASP A 756 1.700 -6.897 -3.246 1.00 0.00 C ATOM 601 CG ASP A 756 0.932 -8.180 -2.993 1.00 0.00 C ATOM 602 OD1 ASP A 756 0.850 -8.622 -1.833 1.00 0.00 O ATOM 603 OD2 ASP A 756 0.428 -8.771 -3.975 1.00 0.00 O ATOM 0 H ASP A 756 0.286 -4.616 -2.794 1.00 0.00 H new ATOM 0 HA ASP A 756 1.799 -6.516 -1.127 1.00 0.00 H new ATOM 0 HB2 ASP A 756 1.259 -6.384 -4.100 1.00 0.00 H new ATOM 0 HB3 ASP A 756 2.725 -7.147 -3.519 1.00 0.00 H new ATOM 608 N ILE A 757 3.866 -5.156 -1.277 1.00 0.00 N ATOM 609 CA ILE A 757 5.154 -4.506 -1.400 1.00 0.00 C ATOM 610 C ILE A 757 6.094 -5.447 -2.136 1.00 0.00 C ATOM 611 O ILE A 757 6.664 -6.366 -1.549 1.00 0.00 O ATOM 612 CB ILE A 757 5.753 -4.126 -0.027 1.00 0.00 C ATOM 613 CG1 ILE A 757 4.888 -3.079 0.654 1.00 0.00 C ATOM 614 CG2 ILE A 757 7.161 -3.594 -0.192 1.00 0.00 C ATOM 615 CD1 ILE A 757 3.681 -3.642 1.373 1.00 0.00 C ATOM 0 H ILE A 757 3.757 -5.713 -0.429 1.00 0.00 H new ATOM 0 HA ILE A 757 5.022 -3.576 -1.953 1.00 0.00 H new ATOM 0 HB ILE A 757 5.784 -5.022 0.592 1.00 0.00 H new ATOM 0 HG12 ILE A 757 5.499 -2.529 1.370 1.00 0.00 H new ATOM 0 HG13 ILE A 757 4.549 -2.362 -0.094 1.00 0.00 H new ATOM 0 HG21 ILE A 757 7.567 -3.331 0.785 1.00 0.00 H new ATOM 0 HG22 ILE A 757 7.787 -4.358 -0.652 1.00 0.00 H new ATOM 0 HG23 ILE A 757 7.143 -2.709 -0.828 1.00 0.00 H new ATOM 0 HD11 ILE A 757 3.118 -2.829 1.831 1.00 0.00 H new ATOM 0 HD12 ILE A 757 3.045 -4.167 0.660 1.00 0.00 H new ATOM 0 HD13 ILE A 757 4.009 -4.337 2.146 1.00 0.00 H new ATOM 627 N ILE A 758 6.227 -5.234 -3.429 1.00 0.00 N ATOM 628 CA ILE A 758 6.916 -6.180 -4.279 1.00 0.00 C ATOM 629 C ILE A 758 8.367 -5.791 -4.506 1.00 0.00 C ATOM 630 O ILE A 758 8.714 -4.614 -4.499 1.00 0.00 O ATOM 631 CB ILE A 758 6.176 -6.338 -5.617 1.00 0.00 C ATOM 632 CG1 ILE A 758 6.208 -5.051 -6.440 1.00 0.00 C ATOM 633 CG2 ILE A 758 4.742 -6.737 -5.343 1.00 0.00 C ATOM 634 CD1 ILE A 758 7.245 -5.058 -7.541 1.00 0.00 C ATOM 0 H ILE A 758 5.866 -4.412 -3.914 1.00 0.00 H new ATOM 0 HA ILE A 758 6.919 -7.141 -3.765 1.00 0.00 H new ATOM 0 HB ILE A 758 6.680 -7.110 -6.198 1.00 0.00 H new ATOM 0 HG12 ILE A 758 5.224 -4.888 -6.881 1.00 0.00 H new ATOM 0 HG13 ILE A 758 6.403 -4.210 -5.775 1.00 0.00 H new ATOM 0 HG21 ILE A 758 4.209 -6.851 -6.287 1.00 0.00 H new ATOM 0 HG22 ILE A 758 4.725 -7.682 -4.800 1.00 0.00 H new ATOM 0 HG23 ILE A 758 4.258 -5.966 -4.744 1.00 0.00 H new ATOM 0 HD11 ILE A 758 7.208 -4.112 -8.082 1.00 0.00 H new ATOM 0 HD12 ILE A 758 8.236 -5.189 -7.107 1.00 0.00 H new ATOM 0 HD13 ILE A 758 7.039 -5.878 -8.229 1.00 0.00 H new ATOM 646 N GLU A 759 9.209 -6.791 -4.696 1.00 0.00 N ATOM 647 CA GLU A 759 10.633 -6.564 -4.857 1.00 0.00 C ATOM 648 C GLU A 759 10.999 -6.455 -6.323 1.00 0.00 C ATOM 649 O GLU A 759 10.935 -7.436 -7.063 1.00 0.00 O ATOM 650 CB GLU A 759 11.438 -7.692 -4.228 1.00 0.00 C ATOM 651 CG GLU A 759 10.908 -8.151 -2.885 1.00 0.00 C ATOM 652 CD GLU A 759 11.979 -8.806 -2.038 1.00 0.00 C ATOM 653 OE1 GLU A 759 11.800 -8.889 -0.807 1.00 0.00 O ATOM 654 OE2 GLU A 759 13.008 -9.234 -2.602 1.00 0.00 O ATOM 0 H GLU A 759 8.930 -7.771 -4.743 1.00 0.00 H new ATOM 0 HA GLU A 759 10.872 -5.627 -4.354 1.00 0.00 H new ATOM 0 HB2 GLU A 759 11.451 -8.541 -4.912 1.00 0.00 H new ATOM 0 HB3 GLU A 759 12.471 -7.364 -4.107 1.00 0.00 H new ATOM 0 HG2 GLU A 759 10.496 -7.297 -2.348 1.00 0.00 H new ATOM 0 HG3 GLU A 759 10.090 -8.855 -3.041 1.00 0.00 H new ATOM 661 N THR A 760 11.406 -5.268 -6.732 1.00 0.00 N ATOM 662 CA THR A 760 11.804 -5.037 -8.108 1.00 0.00 C ATOM 663 C THR A 760 13.319 -5.178 -8.224 1.00 0.00 C ATOM 664 O THR A 760 13.885 -5.232 -9.317 1.00 0.00 O ATOM 665 CB THR A 760 11.317 -3.652 -8.605 1.00 0.00 C ATOM 666 OG1 THR A 760 12.062 -3.214 -9.748 1.00 0.00 O ATOM 667 CG2 THR A 760 11.406 -2.614 -7.504 1.00 0.00 C ATOM 0 H THR A 760 11.470 -4.447 -6.130 1.00 0.00 H new ATOM 0 HA THR A 760 11.334 -5.783 -8.749 1.00 0.00 H new ATOM 0 HB THR A 760 10.273 -3.765 -8.897 1.00 0.00 H new ATOM 0 HG1 THR A 760 11.731 -2.339 -10.039 1.00 0.00 H new ATOM 0 HG21 THR A 760 11.058 -1.652 -7.881 1.00 0.00 H new ATOM 0 HG22 THR A 760 10.783 -2.921 -6.664 1.00 0.00 H new ATOM 0 HG23 THR A 760 12.441 -2.521 -7.174 1.00 0.00 H new ATOM 675 N PHE A 761 13.964 -5.269 -7.069 1.00 0.00 N ATOM 676 CA PHE A 761 15.400 -5.465 -6.998 1.00 0.00 C ATOM 677 C PHE A 761 15.731 -6.954 -7.036 1.00 0.00 C ATOM 678 O PHE A 761 16.825 -7.342 -7.439 1.00 0.00 O ATOM 679 CB PHE A 761 15.937 -4.819 -5.719 1.00 0.00 C ATOM 680 CG PHE A 761 17.408 -5.013 -5.479 1.00 0.00 C ATOM 681 CD1 PHE A 761 17.851 -5.987 -4.603 1.00 0.00 C ATOM 682 CD2 PHE A 761 18.343 -4.216 -6.120 1.00 0.00 C ATOM 683 CE1 PHE A 761 19.200 -6.167 -4.367 1.00 0.00 C ATOM 684 CE2 PHE A 761 19.695 -4.391 -5.891 1.00 0.00 C ATOM 685 CZ PHE A 761 20.123 -5.369 -5.013 1.00 0.00 C ATOM 0 H PHE A 761 13.506 -5.209 -6.160 1.00 0.00 H new ATOM 0 HA PHE A 761 15.876 -4.993 -7.858 1.00 0.00 H new ATOM 0 HB2 PHE A 761 15.728 -3.750 -5.754 1.00 0.00 H new ATOM 0 HB3 PHE A 761 15.389 -5.223 -4.868 1.00 0.00 H new ATOM 0 HD1 PHE A 761 17.133 -6.615 -4.097 1.00 0.00 H new ATOM 0 HD2 PHE A 761 18.012 -3.450 -6.806 1.00 0.00 H new ATOM 0 HE1 PHE A 761 19.532 -6.930 -3.679 1.00 0.00 H new ATOM 0 HE2 PHE A 761 20.415 -3.765 -6.397 1.00 0.00 H new ATOM 0 HZ PHE A 761 21.179 -5.509 -4.832 1.00 0.00 H new ATOM 695 N SER A 762 14.781 -7.786 -6.629 1.00 0.00 N ATOM 696 CA SER A 762 15.007 -9.218 -6.609 1.00 0.00 C ATOM 697 C SER A 762 13.938 -9.955 -7.414 1.00 0.00 C ATOM 698 O SER A 762 14.117 -10.187 -8.609 1.00 0.00 O ATOM 699 CB SER A 762 15.055 -9.722 -5.166 1.00 0.00 C ATOM 700 OG SER A 762 15.974 -8.961 -4.399 1.00 0.00 O ATOM 0 H SER A 762 13.857 -7.494 -6.312 1.00 0.00 H new ATOM 0 HA SER A 762 15.969 -9.423 -7.079 1.00 0.00 H new ATOM 0 HB2 SER A 762 14.062 -9.659 -4.720 1.00 0.00 H new ATOM 0 HB3 SER A 762 15.345 -10.773 -5.152 1.00 0.00 H new ATOM 0 HG SER A 762 15.989 -9.297 -3.479 1.00 0.00 H new ATOM 706 N SER A 763 12.817 -10.286 -6.773 1.00 0.00 N ATOM 707 CA SER A 763 11.747 -11.036 -7.431 1.00 0.00 C ATOM 708 C SER A 763 10.613 -11.344 -6.453 1.00 0.00 C ATOM 709 O SER A 763 9.523 -11.749 -6.858 1.00 0.00 O ATOM 710 CB SER A 763 12.293 -12.348 -8.015 1.00 0.00 C ATOM 711 OG SER A 763 11.301 -13.052 -8.746 1.00 0.00 O ATOM 0 H SER A 763 12.626 -10.047 -5.800 1.00 0.00 H new ATOM 0 HA SER A 763 11.354 -10.418 -8.239 1.00 0.00 H new ATOM 0 HB2 SER A 763 13.140 -12.131 -8.667 1.00 0.00 H new ATOM 0 HB3 SER A 763 12.665 -12.978 -7.207 1.00 0.00 H new ATOM 0 HG SER A 763 10.412 -12.761 -8.455 1.00 0.00 H new ATOM 717 N LYS A 764 10.866 -11.143 -5.167 1.00 0.00 N ATOM 718 CA LYS A 764 9.893 -11.498 -4.138 1.00 0.00 C ATOM 719 C LYS A 764 8.780 -10.463 -4.048 1.00 0.00 C ATOM 720 O LYS A 764 8.717 -9.518 -4.837 1.00 0.00 O ATOM 721 CB LYS A 764 10.579 -11.659 -2.783 1.00 0.00 C ATOM 722 CG LYS A 764 11.594 -12.788 -2.736 1.00 0.00 C ATOM 723 CD LYS A 764 12.254 -12.875 -1.371 1.00 0.00 C ATOM 724 CE LYS A 764 13.248 -14.020 -1.301 1.00 0.00 C ATOM 725 NZ LYS A 764 13.917 -14.096 0.025 1.00 0.00 N ATOM 0 H LYS A 764 11.732 -10.738 -4.811 1.00 0.00 H new ATOM 0 HA LYS A 764 9.445 -12.451 -4.420 1.00 0.00 H new ATOM 0 HB2 LYS A 764 11.078 -10.724 -2.526 1.00 0.00 H new ATOM 0 HB3 LYS A 764 9.820 -11.835 -2.021 1.00 0.00 H new ATOM 0 HG2 LYS A 764 11.102 -13.733 -2.966 1.00 0.00 H new ATOM 0 HG3 LYS A 764 12.354 -12.630 -3.501 1.00 0.00 H new ATOM 0 HD2 LYS A 764 12.764 -11.937 -1.153 1.00 0.00 H new ATOM 0 HD3 LYS A 764 11.490 -13.009 -0.605 1.00 0.00 H new ATOM 0 HE2 LYS A 764 12.733 -14.960 -1.502 1.00 0.00 H new ATOM 0 HE3 LYS A 764 14.000 -13.895 -2.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 764 14.587 -14.891 0.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 764 14.430 -13.209 0.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 764 13.202 -14.241 0.767 1.00 0.00 H new ATOM 739 N ARG A 765 7.902 -10.662 -3.086 1.00 0.00 N ATOM 740 CA ARG A 765 6.753 -9.815 -2.890 1.00 0.00 C ATOM 741 C ARG A 765 6.173 -10.022 -1.492 1.00 0.00 C ATOM 742 O ARG A 765 6.024 -11.156 -1.036 1.00 0.00 O ATOM 743 CB ARG A 765 5.712 -10.119 -3.969 1.00 0.00 C ATOM 744 CG ARG A 765 4.299 -9.776 -3.558 1.00 0.00 C ATOM 745 CD ARG A 765 3.355 -9.713 -4.751 1.00 0.00 C ATOM 746 NE ARG A 765 3.193 -11.005 -5.421 1.00 0.00 N ATOM 747 CZ ARG A 765 2.011 -11.515 -5.785 1.00 0.00 C ATOM 748 NH1 ARG A 765 0.882 -10.897 -5.464 1.00 0.00 N ATOM 749 NH2 ARG A 765 1.960 -12.657 -6.456 1.00 0.00 N ATOM 0 H ARG A 765 7.971 -11.426 -2.413 1.00 0.00 H new ATOM 0 HA ARG A 765 7.051 -8.770 -2.974 1.00 0.00 H new ATOM 0 HB2 ARG A 765 5.964 -9.564 -4.872 1.00 0.00 H new ATOM 0 HB3 ARG A 765 5.761 -11.178 -4.222 1.00 0.00 H new ATOM 0 HG2 ARG A 765 3.937 -10.521 -2.849 1.00 0.00 H new ATOM 0 HG3 ARG A 765 4.295 -8.816 -3.042 1.00 0.00 H new ATOM 0 HD2 ARG A 765 2.380 -9.358 -4.417 1.00 0.00 H new ATOM 0 HD3 ARG A 765 3.732 -8.983 -5.467 1.00 0.00 H new ATOM 0 HE ARG A 765 4.032 -11.549 -5.622 1.00 0.00 H new ATOM 0 HH11 ARG A 765 0.910 -10.025 -4.935 1.00 0.00 H new ATOM 0 HH12 ARG A 765 -0.014 -11.294 -5.746 1.00 0.00 H new ATOM 0 HH21 ARG A 765 2.822 -13.147 -6.695 1.00 0.00 H new ATOM 0 HH22 ARG A 765 1.059 -13.046 -6.733 1.00 0.00 H new ATOM 763 N LYS A 766 5.861 -8.927 -0.817 1.00 0.00 N ATOM 764 CA LYS A 766 5.306 -8.975 0.516 1.00 0.00 C ATOM 765 C LYS A 766 3.855 -8.541 0.460 1.00 0.00 C ATOM 766 O LYS A 766 3.489 -7.703 -0.347 1.00 0.00 O ATOM 767 CB LYS A 766 6.105 -8.067 1.454 1.00 0.00 C ATOM 768 CG LYS A 766 5.985 -8.451 2.921 1.00 0.00 C ATOM 769 CD LYS A 766 4.803 -7.789 3.608 1.00 0.00 C ATOM 770 CE LYS A 766 4.655 -8.285 5.038 1.00 0.00 C ATOM 771 NZ LYS A 766 5.919 -8.146 5.809 1.00 0.00 N ATOM 0 H LYS A 766 5.987 -7.983 -1.182 1.00 0.00 H new ATOM 0 HA LYS A 766 5.363 -9.993 0.903 1.00 0.00 H new ATOM 0 HB2 LYS A 766 7.156 -8.094 1.165 1.00 0.00 H new ATOM 0 HB3 LYS A 766 5.766 -7.039 1.327 1.00 0.00 H new ATOM 0 HG2 LYS A 766 5.887 -9.534 3.002 1.00 0.00 H new ATOM 0 HG3 LYS A 766 6.903 -8.175 3.440 1.00 0.00 H new ATOM 0 HD2 LYS A 766 4.936 -6.707 3.607 1.00 0.00 H new ATOM 0 HD3 LYS A 766 3.890 -7.998 3.051 1.00 0.00 H new ATOM 0 HE2 LYS A 766 3.863 -7.725 5.536 1.00 0.00 H new ATOM 0 HE3 LYS A 766 4.349 -9.331 5.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 766 5.725 -8.283 6.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 766 6.602 -8.861 5.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 766 6.315 -7.196 5.658 1.00 0.00 H new ATOM 785 N THR A 767 3.040 -9.121 1.299 1.00 0.00 N ATOM 786 CA THR A 767 1.613 -8.845 1.288 1.00 0.00 C ATOM 787 C THR A 767 1.145 -8.299 2.634 1.00 0.00 C ATOM 788 O THR A 767 1.514 -8.821 3.687 1.00 0.00 O ATOM 789 CB THR A 767 0.824 -10.122 0.957 1.00 0.00 C ATOM 790 OG1 THR A 767 1.263 -10.649 -0.303 1.00 0.00 O ATOM 791 CG2 THR A 767 -0.674 -9.849 0.903 1.00 0.00 C ATOM 0 H THR A 767 3.334 -9.794 2.007 1.00 0.00 H new ATOM 0 HA THR A 767 1.429 -8.092 0.522 1.00 0.00 H new ATOM 0 HB THR A 767 1.009 -10.849 1.747 1.00 0.00 H new ATOM 0 HG1 THR A 767 1.371 -9.916 -0.944 1.00 0.00 H new ATOM 0 HG21 THR A 767 -1.204 -10.772 0.667 1.00 0.00 H new ATOM 0 HG22 THR A 767 -1.011 -9.475 1.870 1.00 0.00 H new ATOM 0 HG23 THR A 767 -0.881 -9.105 0.134 1.00 0.00 H new ATOM 799 N PHE A 768 0.348 -7.242 2.600 1.00 0.00 N ATOM 800 CA PHE A 768 -0.242 -6.703 3.812 1.00 0.00 C ATOM 801 C PHE A 768 -1.724 -6.427 3.606 1.00 0.00 C ATOM 802 O PHE A 768 -2.124 -5.818 2.612 1.00 0.00 O ATOM 803 CB PHE A 768 0.466 -5.423 4.235 1.00 0.00 C ATOM 804 CG PHE A 768 0.708 -5.339 5.711 1.00 0.00 C ATOM 805 CD1 PHE A 768 1.903 -5.781 6.243 1.00 0.00 C ATOM 806 CD2 PHE A 768 -0.254 -4.824 6.562 1.00 0.00 C ATOM 807 CE1 PHE A 768 2.140 -5.714 7.602 1.00 0.00 C ATOM 808 CE2 PHE A 768 -0.026 -4.752 7.922 1.00 0.00 C ATOM 809 CZ PHE A 768 1.174 -5.199 8.443 1.00 0.00 C ATOM 0 H PHE A 768 0.096 -6.742 1.747 1.00 0.00 H new ATOM 0 HA PHE A 768 -0.125 -7.445 4.602 1.00 0.00 H new ATOM 0 HB2 PHE A 768 1.420 -5.355 3.713 1.00 0.00 H new ATOM 0 HB3 PHE A 768 -0.130 -4.566 3.922 1.00 0.00 H new ATOM 0 HD1 PHE A 768 2.662 -6.184 5.588 1.00 0.00 H new ATOM 0 HD2 PHE A 768 -1.193 -4.475 6.158 1.00 0.00 H new ATOM 0 HE1 PHE A 768 3.079 -6.064 8.006 1.00 0.00 H new ATOM 0 HE2 PHE A 768 -0.783 -4.347 8.577 1.00 0.00 H new ATOM 0 HZ PHE A 768 1.355 -5.145 9.506 1.00 0.00 H new ATOM 819 N GLU A 769 -2.524 -6.891 4.545 1.00 0.00 N ATOM 820 CA GLU A 769 -3.962 -6.715 4.500 1.00 0.00 C ATOM 821 C GLU A 769 -4.470 -6.100 5.799 1.00 0.00 C ATOM 822 O GLU A 769 -4.346 -6.695 6.871 1.00 0.00 O ATOM 823 CB GLU A 769 -4.625 -8.066 4.261 1.00 0.00 C ATOM 824 CG GLU A 769 -6.146 -8.021 4.279 1.00 0.00 C ATOM 825 CD GLU A 769 -6.765 -9.401 4.238 1.00 0.00 C ATOM 826 OE1 GLU A 769 -6.734 -10.097 5.275 1.00 0.00 O ATOM 827 OE2 GLU A 769 -7.293 -9.797 3.178 1.00 0.00 O ATOM 0 H GLU A 769 -2.194 -7.402 5.364 1.00 0.00 H new ATOM 0 HA GLU A 769 -4.213 -6.036 3.685 1.00 0.00 H new ATOM 0 HB2 GLU A 769 -4.295 -8.456 3.298 1.00 0.00 H new ATOM 0 HB3 GLU A 769 -4.283 -8.767 5.023 1.00 0.00 H new ATOM 0 HG2 GLU A 769 -6.481 -7.502 5.177 1.00 0.00 H new ATOM 0 HG3 GLU A 769 -6.500 -7.442 3.426 1.00 0.00 H new ATOM 834 N ILE A 770 -5.041 -4.911 5.695 1.00 0.00 N ATOM 835 CA ILE A 770 -5.584 -4.209 6.839 1.00 0.00 C ATOM 836 C ILE A 770 -7.092 -4.159 6.716 1.00 0.00 C ATOM 837 O ILE A 770 -7.626 -3.517 5.816 1.00 0.00 O ATOM 838 CB ILE A 770 -5.024 -2.780 6.917 1.00 0.00 C ATOM 839 CG1 ILE A 770 -3.517 -2.824 7.127 1.00 0.00 C ATOM 840 CG2 ILE A 770 -5.692 -1.995 8.035 1.00 0.00 C ATOM 841 CD1 ILE A 770 -2.798 -1.703 6.433 1.00 0.00 C ATOM 0 H ILE A 770 -5.140 -4.408 4.813 1.00 0.00 H new ATOM 0 HA ILE A 770 -5.300 -4.739 7.748 1.00 0.00 H new ATOM 0 HB ILE A 770 -5.237 -2.273 5.976 1.00 0.00 H new ATOM 0 HG12 ILE A 770 -3.302 -2.781 8.195 1.00 0.00 H new ATOM 0 HG13 ILE A 770 -3.132 -3.777 6.763 1.00 0.00 H new ATOM 0 HG21 ILE A 770 -5.278 -0.987 8.069 1.00 0.00 H new ATOM 0 HG22 ILE A 770 -6.765 -1.941 7.851 1.00 0.00 H new ATOM 0 HG23 ILE A 770 -5.512 -2.494 8.987 1.00 0.00 H new ATOM 0 HD11 ILE A 770 -1.727 -1.787 6.619 1.00 0.00 H new ATOM 0 HD12 ILE A 770 -2.986 -1.759 5.361 1.00 0.00 H new ATOM 0 HD13 ILE A 770 -3.159 -0.748 6.815 1.00 0.00 H new ATOM 853 N LYS A 771 -7.778 -4.860 7.590 1.00 0.00 N ATOM 854 CA LYS A 771 -9.207 -4.951 7.501 1.00 0.00 C ATOM 855 C LYS A 771 -9.884 -3.763 8.156 1.00 0.00 C ATOM 856 O LYS A 771 -9.344 -3.138 9.073 1.00 0.00 O ATOM 857 CB LYS A 771 -9.680 -6.246 8.128 1.00 0.00 C ATOM 858 CG LYS A 771 -8.640 -7.348 8.022 1.00 0.00 C ATOM 859 CD LYS A 771 -9.236 -8.720 8.240 1.00 0.00 C ATOM 860 CE LYS A 771 -10.144 -9.122 7.088 1.00 0.00 C ATOM 861 NZ LYS A 771 -10.778 -10.447 7.315 1.00 0.00 N ATOM 0 H LYS A 771 -7.364 -5.373 8.368 1.00 0.00 H new ATOM 0 HA LYS A 771 -9.483 -4.942 6.446 1.00 0.00 H new ATOM 0 HB2 LYS A 771 -9.919 -6.074 9.178 1.00 0.00 H new ATOM 0 HB3 LYS A 771 -10.600 -6.569 7.641 1.00 0.00 H new ATOM 0 HG2 LYS A 771 -8.172 -7.310 7.039 1.00 0.00 H new ATOM 0 HG3 LYS A 771 -7.854 -7.175 8.757 1.00 0.00 H new ATOM 0 HD2 LYS A 771 -8.436 -9.453 8.347 1.00 0.00 H new ATOM 0 HD3 LYS A 771 -9.802 -8.728 9.171 1.00 0.00 H new ATOM 0 HE2 LYS A 771 -10.919 -8.367 6.957 1.00 0.00 H new ATOM 0 HE3 LYS A 771 -9.567 -9.150 6.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 771 -11.388 -10.683 6.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 771 -10.040 -11.173 7.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 771 -11.350 -10.414 8.183 1.00 0.00 H new ATOM 875 N GLU A 772 -11.073 -3.480 7.656 1.00 0.00 N ATOM 876 CA GLU A 772 -11.931 -2.414 8.160 1.00 0.00 C ATOM 877 C GLU A 772 -11.244 -1.051 8.141 1.00 0.00 C ATOM 878 O GLU A 772 -11.309 -0.316 9.126 1.00 0.00 O ATOM 879 CB GLU A 772 -12.401 -2.716 9.586 1.00 0.00 C ATOM 880 CG GLU A 772 -12.644 -4.190 9.853 1.00 0.00 C ATOM 881 CD GLU A 772 -13.407 -4.436 11.134 1.00 0.00 C ATOM 882 OE1 GLU A 772 -14.650 -4.325 11.124 1.00 0.00 O ATOM 883 OE2 GLU A 772 -12.766 -4.749 12.157 1.00 0.00 O ATOM 0 H GLU A 772 -11.480 -3.992 6.874 1.00 0.00 H new ATOM 0 HA GLU A 772 -12.788 -2.373 7.488 1.00 0.00 H new ATOM 0 HB2 GLU A 772 -11.655 -2.347 10.290 1.00 0.00 H new ATOM 0 HB3 GLU A 772 -13.321 -2.165 9.779 1.00 0.00 H new ATOM 0 HG2 GLU A 772 -13.198 -4.619 9.018 1.00 0.00 H new ATOM 0 HG3 GLU A 772 -11.686 -4.708 9.901 1.00 0.00 H new ATOM 890 N ILE A 773 -10.586 -0.701 7.044 1.00 0.00 N ATOM 891 CA ILE A 773 -10.069 0.646 6.913 1.00 0.00 C ATOM 892 C ILE A 773 -11.247 1.565 6.635 1.00 0.00 C ATOM 893 O ILE A 773 -11.942 1.422 5.643 1.00 0.00 O ATOM 894 CB ILE A 773 -8.930 0.784 5.837 1.00 0.00 C ATOM 895 CG1 ILE A 773 -9.436 1.190 4.445 1.00 0.00 C ATOM 896 CG2 ILE A 773 -8.141 -0.510 5.721 1.00 0.00 C ATOM 897 CD1 ILE A 773 -9.576 2.692 4.253 1.00 0.00 C ATOM 0 H ILE A 773 -10.403 -1.317 6.252 1.00 0.00 H new ATOM 0 HA ILE A 773 -9.580 0.931 7.845 1.00 0.00 H new ATOM 0 HB ILE A 773 -8.291 1.591 6.194 1.00 0.00 H new ATOM 0 HG12 ILE A 773 -8.751 0.800 3.692 1.00 0.00 H new ATOM 0 HG13 ILE A 773 -10.404 0.720 4.270 1.00 0.00 H new ATOM 0 HG21 ILE A 773 -7.358 -0.393 4.971 1.00 0.00 H new ATOM 0 HG22 ILE A 773 -7.689 -0.748 6.684 1.00 0.00 H new ATOM 0 HG23 ILE A 773 -8.809 -1.318 5.424 1.00 0.00 H new ATOM 0 HD11 ILE A 773 -9.938 2.898 3.246 1.00 0.00 H new ATOM 0 HD12 ILE A 773 -10.284 3.087 4.981 1.00 0.00 H new ATOM 0 HD13 ILE A 773 -8.606 3.169 4.395 1.00 0.00 H new ATOM 909 N LYS A 774 -11.516 2.435 7.582 1.00 0.00 N ATOM 910 CA LYS A 774 -12.631 3.364 7.509 1.00 0.00 C ATOM 911 C LYS A 774 -12.076 4.758 7.248 1.00 0.00 C ATOM 912 O LYS A 774 -12.648 5.767 7.663 1.00 0.00 O ATOM 913 CB LYS A 774 -13.366 3.320 8.847 1.00 0.00 C ATOM 914 CG LYS A 774 -13.669 1.898 9.295 1.00 0.00 C ATOM 915 CD LYS A 774 -13.784 1.787 10.807 1.00 0.00 C ATOM 916 CE LYS A 774 -13.982 0.341 11.240 1.00 0.00 C ATOM 917 NZ LYS A 774 -13.944 0.197 12.719 1.00 0.00 N ATOM 0 H LYS A 774 -10.964 2.522 8.435 1.00 0.00 H new ATOM 0 HA LYS A 774 -13.322 3.102 6.708 1.00 0.00 H new ATOM 0 HB2 LYS A 774 -12.762 3.817 9.607 1.00 0.00 H new ATOM 0 HB3 LYS A 774 -14.298 3.879 8.765 1.00 0.00 H new ATOM 0 HG2 LYS A 774 -14.599 1.564 8.836 1.00 0.00 H new ATOM 0 HG3 LYS A 774 -12.882 1.232 8.942 1.00 0.00 H new ATOM 0 HD2 LYS A 774 -12.884 2.189 11.273 1.00 0.00 H new ATOM 0 HD3 LYS A 774 -14.621 2.392 11.156 1.00 0.00 H new ATOM 0 HE2 LYS A 774 -14.938 -0.023 10.864 1.00 0.00 H new ATOM 0 HE3 LYS A 774 -13.206 -0.281 10.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 774 -14.083 -0.802 12.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 774 -13.022 0.521 13.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 774 -14.701 0.771 13.143 1.00 0.00 H new ATOM 931 N THR A 775 -10.939 4.794 6.561 1.00 0.00 N ATOM 932 CA THR A 775 -10.144 6.009 6.451 1.00 0.00 C ATOM 933 C THR A 775 -10.419 6.813 5.171 1.00 0.00 C ATOM 934 O THR A 775 -11.186 7.770 5.204 1.00 0.00 O ATOM 935 CB THR A 775 -8.648 5.668 6.514 1.00 0.00 C ATOM 936 OG1 THR A 775 -8.460 4.465 7.271 1.00 0.00 O ATOM 937 CG2 THR A 775 -7.866 6.798 7.161 1.00 0.00 C ATOM 0 H THR A 775 -10.547 3.990 6.070 1.00 0.00 H new ATOM 0 HA THR A 775 -10.437 6.636 7.293 1.00 0.00 H new ATOM 0 HB THR A 775 -8.282 5.527 5.497 1.00 0.00 H new ATOM 0 HG1 THR A 775 -7.505 4.248 7.309 1.00 0.00 H new ATOM 0 HG21 THR A 775 -6.809 6.536 7.196 1.00 0.00 H new ATOM 0 HG22 THR A 775 -7.995 7.710 6.578 1.00 0.00 H new ATOM 0 HG23 THR A 775 -8.233 6.961 8.175 1.00 0.00 H new ATOM 945 N ASN A 776 -9.777 6.401 4.063 1.00 0.00 N ATOM 946 CA ASN A 776 -9.766 7.137 2.775 1.00 0.00 C ATOM 947 C ASN A 776 -8.614 8.130 2.716 1.00 0.00 C ATOM 948 O ASN A 776 -8.464 8.863 1.744 1.00 0.00 O ATOM 949 CB ASN A 776 -11.082 7.858 2.463 1.00 0.00 C ATOM 950 CG ASN A 776 -12.031 7.018 1.637 1.00 0.00 C ATOM 951 OD1 ASN A 776 -12.800 7.547 0.839 1.00 0.00 O ATOM 952 ND2 ASN A 776 -11.975 5.711 1.808 1.00 0.00 N ATOM 0 H ASN A 776 -9.241 5.534 4.032 1.00 0.00 H new ATOM 0 HA ASN A 776 -9.633 6.372 2.011 1.00 0.00 H new ATOM 0 HB2 ASN A 776 -11.569 8.135 3.398 1.00 0.00 H new ATOM 0 HB3 ASN A 776 -10.866 8.784 1.930 1.00 0.00 H new ATOM 0 HD21 ASN A 776 -12.585 5.099 1.266 1.00 0.00 H new ATOM 0 HD22 ASN A 776 -11.321 5.312 2.482 1.00 0.00 H new ATOM 959 N GLU A 777 -7.795 8.118 3.756 1.00 0.00 N ATOM 960 CA GLU A 777 -6.583 8.926 3.828 1.00 0.00 C ATOM 961 C GLU A 777 -5.662 8.343 4.886 1.00 0.00 C ATOM 962 O GLU A 777 -5.644 8.802 6.029 1.00 0.00 O ATOM 963 CB GLU A 777 -6.904 10.376 4.185 1.00 0.00 C ATOM 964 CG GLU A 777 -7.151 11.273 2.988 1.00 0.00 C ATOM 965 CD GLU A 777 -7.081 12.742 3.345 1.00 0.00 C ATOM 966 OE1 GLU A 777 -8.105 13.310 3.774 1.00 0.00 O ATOM 967 OE2 GLU A 777 -5.993 13.340 3.198 1.00 0.00 O ATOM 0 H GLU A 777 -7.953 7.542 4.583 1.00 0.00 H new ATOM 0 HA GLU A 777 -6.100 8.913 2.851 1.00 0.00 H new ATOM 0 HB2 GLU A 777 -7.786 10.394 4.826 1.00 0.00 H new ATOM 0 HB3 GLU A 777 -6.079 10.786 4.767 1.00 0.00 H new ATOM 0 HG2 GLU A 777 -6.414 11.054 2.215 1.00 0.00 H new ATOM 0 HG3 GLU A 777 -8.131 11.050 2.566 1.00 0.00 H new ATOM 974 N TYR A 778 -4.902 7.335 4.514 1.00 0.00 N ATOM 975 CA TYR A 778 -4.128 6.587 5.491 1.00 0.00 C ATOM 976 C TYR A 778 -2.668 6.509 5.088 1.00 0.00 C ATOM 977 O TYR A 778 -2.345 6.133 3.968 1.00 0.00 O ATOM 978 CB TYR A 778 -4.709 5.186 5.687 1.00 0.00 C ATOM 979 CG TYR A 778 -3.893 4.318 6.612 1.00 0.00 C ATOM 980 CD1 TYR A 778 -3.937 4.509 7.983 1.00 0.00 C ATOM 981 CD2 TYR A 778 -3.072 3.313 6.113 1.00 0.00 C ATOM 982 CE1 TYR A 778 -3.188 3.728 8.834 1.00 0.00 C ATOM 983 CE2 TYR A 778 -2.321 2.524 6.960 1.00 0.00 C ATOM 984 CZ TYR A 778 -2.382 2.738 8.320 1.00 0.00 C ATOM 985 OH TYR A 778 -1.633 1.963 9.171 1.00 0.00 O ATOM 0 H TYR A 778 -4.801 7.014 3.551 1.00 0.00 H new ATOM 0 HA TYR A 778 -4.187 7.118 6.441 1.00 0.00 H new ATOM 0 HB2 TYR A 778 -5.721 5.273 6.083 1.00 0.00 H new ATOM 0 HB3 TYR A 778 -4.788 4.695 4.717 1.00 0.00 H new ATOM 0 HD1 TYR A 778 -4.569 5.283 8.391 1.00 0.00 H new ATOM 0 HD2 TYR A 778 -3.021 3.147 5.047 1.00 0.00 H new ATOM 0 HE1 TYR A 778 -3.233 3.892 9.901 1.00 0.00 H new ATOM 0 HE2 TYR A 778 -1.690 1.744 6.560 1.00 0.00 H new ATOM 0 HH TYR A 778 -1.119 1.310 8.652 1.00 0.00 H new ATOM 995 N VAL A 779 -1.786 6.885 5.995 1.00 0.00 N ATOM 996 CA VAL A 779 -0.366 6.788 5.731 1.00 0.00 C ATOM 997 C VAL A 779 0.150 5.410 6.109 1.00 0.00 C ATOM 998 O VAL A 779 0.096 5.006 7.275 1.00 0.00 O ATOM 999 CB VAL A 779 0.441 7.876 6.461 1.00 0.00 C ATOM 1000 CG1 VAL A 779 1.889 7.871 5.994 1.00 0.00 C ATOM 1001 CG2 VAL A 779 -0.184 9.237 6.240 1.00 0.00 C ATOM 0 H VAL A 779 -2.027 7.257 6.914 1.00 0.00 H new ATOM 0 HA VAL A 779 -0.228 6.945 4.661 1.00 0.00 H new ATOM 0 HB VAL A 779 0.424 7.659 7.529 1.00 0.00 H new ATOM 0 HG11 VAL A 779 2.444 8.647 6.521 1.00 0.00 H new ATOM 0 HG12 VAL A 779 2.336 6.899 6.204 1.00 0.00 H new ATOM 0 HG13 VAL A 779 1.926 8.063 4.922 1.00 0.00 H new ATOM 0 HG21 VAL A 779 0.399 9.995 6.763 1.00 0.00 H new ATOM 0 HG22 VAL A 779 -0.198 9.462 5.174 1.00 0.00 H new ATOM 0 HG23 VAL A 779 -1.204 9.236 6.624 1.00 0.00 H new ATOM 1011 N ILE A 780 0.625 4.686 5.108 1.00 0.00 N ATOM 1012 CA ILE A 780 1.127 3.338 5.298 1.00 0.00 C ATOM 1013 C ILE A 780 2.596 3.370 5.699 1.00 0.00 C ATOM 1014 O ILE A 780 3.372 4.163 5.174 1.00 0.00 O ATOM 1015 CB ILE A 780 0.982 2.504 4.008 1.00 0.00 C ATOM 1016 CG1 ILE A 780 -0.476 2.377 3.595 1.00 0.00 C ATOM 1017 CG2 ILE A 780 1.591 1.119 4.177 1.00 0.00 C ATOM 1018 CD1 ILE A 780 -0.626 1.623 2.300 1.00 0.00 C ATOM 0 H ILE A 780 0.673 5.017 4.144 1.00 0.00 H new ATOM 0 HA ILE A 780 0.537 2.877 6.090 1.00 0.00 H new ATOM 0 HB ILE A 780 1.523 3.031 3.222 1.00 0.00 H new ATOM 0 HG12 ILE A 780 -1.033 1.866 4.380 1.00 0.00 H new ATOM 0 HG13 ILE A 780 -0.912 3.370 3.490 1.00 0.00 H new ATOM 0 HG21 ILE A 780 1.474 0.555 3.252 1.00 0.00 H new ATOM 0 HG22 ILE A 780 2.651 1.214 4.412 1.00 0.00 H new ATOM 0 HG23 ILE A 780 1.085 0.595 4.988 1.00 0.00 H new ATOM 0 HD11 ILE A 780 -1.682 1.554 2.039 1.00 0.00 H new ATOM 0 HD12 ILE A 780 -0.091 2.148 1.509 1.00 0.00 H new ATOM 0 HD13 ILE A 780 -0.214 0.620 2.413 1.00 0.00 H new ATOM 1030 N LYS A 781 2.965 2.510 6.630 1.00 0.00 N ATOM 1031 CA LYS A 781 4.350 2.385 7.050 1.00 0.00 C ATOM 1032 C LYS A 781 4.782 0.941 6.912 1.00 0.00 C ATOM 1033 O LYS A 781 4.405 0.093 7.724 1.00 0.00 O ATOM 1034 CB LYS A 781 4.566 2.845 8.502 1.00 0.00 C ATOM 1035 CG LYS A 781 4.384 4.340 8.739 1.00 0.00 C ATOM 1036 CD LYS A 781 2.919 4.749 8.774 1.00 0.00 C ATOM 1037 CE LYS A 781 2.170 4.077 9.917 1.00 0.00 C ATOM 1038 NZ LYS A 781 0.753 4.519 9.987 1.00 0.00 N ATOM 0 H LYS A 781 2.321 1.884 7.113 1.00 0.00 H new ATOM 0 HA LYS A 781 4.950 3.032 6.409 1.00 0.00 H new ATOM 0 HB2 LYS A 781 3.873 2.304 9.146 1.00 0.00 H new ATOM 0 HB3 LYS A 781 5.573 2.564 8.810 1.00 0.00 H new ATOM 0 HG2 LYS A 781 4.858 4.616 9.681 1.00 0.00 H new ATOM 0 HG3 LYS A 781 4.894 4.894 7.951 1.00 0.00 H new ATOM 0 HD2 LYS A 781 2.847 5.832 8.879 1.00 0.00 H new ATOM 0 HD3 LYS A 781 2.446 4.488 7.827 1.00 0.00 H new ATOM 0 HE2 LYS A 781 2.207 2.995 9.789 1.00 0.00 H new ATOM 0 HE3 LYS A 781 2.668 4.303 10.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 781 0.174 3.763 10.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 781 0.685 5.374 10.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 781 0.407 4.729 9.029 1.00 0.00 H new ATOM 1052 N THR A 782 5.555 0.654 5.884 1.00 0.00 N ATOM 1053 CA THR A 782 5.984 -0.702 5.639 1.00 0.00 C ATOM 1054 C THR A 782 7.115 -1.066 6.598 1.00 0.00 C ATOM 1055 O THR A 782 7.937 -0.206 6.949 1.00 0.00 O ATOM 1056 CB THR A 782 6.451 -0.904 4.193 1.00 0.00 C ATOM 1057 OG1 THR A 782 7.637 -0.164 3.952 1.00 0.00 O ATOM 1058 CG2 THR A 782 5.376 -0.468 3.236 1.00 0.00 C ATOM 0 H THR A 782 5.896 1.340 5.210 1.00 0.00 H new ATOM 0 HA THR A 782 5.127 -1.354 5.806 1.00 0.00 H new ATOM 0 HB THR A 782 6.657 -1.963 4.039 1.00 0.00 H new ATOM 0 HG1 THR A 782 7.900 -0.264 3.013 1.00 0.00 H new ATOM 0 HG21 THR A 782 5.719 -0.616 2.212 1.00 0.00 H new ATOM 0 HG22 THR A 782 4.476 -1.059 3.406 1.00 0.00 H new ATOM 0 HG23 THR A 782 5.153 0.587 3.395 1.00 0.00 H new ATOM 1066 N PRO A 783 7.158 -2.336 7.028 1.00 0.00 N ATOM 1067 CA PRO A 783 8.153 -2.840 7.988 1.00 0.00 C ATOM 1068 C PRO A 783 9.595 -2.497 7.611 1.00 0.00 C ATOM 1069 O PRO A 783 9.904 -2.224 6.451 1.00 0.00 O ATOM 1070 CB PRO A 783 7.945 -4.353 7.944 1.00 0.00 C ATOM 1071 CG PRO A 783 6.529 -4.530 7.522 1.00 0.00 C ATOM 1072 CD PRO A 783 6.219 -3.387 6.606 1.00 0.00 C ATOM 0 HA PRO A 783 8.015 -2.391 8.972 1.00 0.00 H new ATOM 0 HB2 PRO A 783 8.630 -4.826 7.240 1.00 0.00 H new ATOM 0 HB3 PRO A 783 8.127 -4.806 8.919 1.00 0.00 H new ATOM 0 HG2 PRO A 783 6.391 -5.484 7.014 1.00 0.00 H new ATOM 0 HG3 PRO A 783 5.863 -4.529 8.385 1.00 0.00 H new ATOM 0 HD2 PRO A 783 6.367 -3.660 5.561 1.00 0.00 H new ATOM 0 HD3 PRO A 783 5.183 -3.063 6.707 1.00 0.00 H new ATOM 1080 N VAL A 784 10.466 -2.530 8.614 1.00 0.00 N ATOM 1081 CA VAL A 784 11.869 -2.179 8.459 1.00 0.00 C ATOM 1082 C VAL A 784 12.572 -3.049 7.424 1.00 0.00 C ATOM 1083 O VAL A 784 12.528 -4.280 7.490 1.00 0.00 O ATOM 1084 CB VAL A 784 12.600 -2.296 9.813 1.00 0.00 C ATOM 1085 CG1 VAL A 784 14.109 -2.194 9.649 1.00 0.00 C ATOM 1086 CG2 VAL A 784 12.089 -1.237 10.770 1.00 0.00 C ATOM 0 H VAL A 784 10.214 -2.803 9.564 1.00 0.00 H new ATOM 0 HA VAL A 784 11.903 -1.149 8.105 1.00 0.00 H new ATOM 0 HB VAL A 784 12.388 -3.281 10.228 1.00 0.00 H new ATOM 0 HG11 VAL A 784 14.588 -2.281 10.624 1.00 0.00 H new ATOM 0 HG12 VAL A 784 14.460 -2.996 9.000 1.00 0.00 H new ATOM 0 HG13 VAL A 784 14.362 -1.231 9.205 1.00 0.00 H new ATOM 0 HG21 VAL A 784 12.610 -1.326 11.723 1.00 0.00 H new ATOM 0 HG22 VAL A 784 12.270 -0.248 10.349 1.00 0.00 H new ATOM 0 HG23 VAL A 784 11.019 -1.374 10.927 1.00 0.00 H new ATOM 1096 N PHE A 785 13.221 -2.394 6.475 1.00 0.00 N ATOM 1097 CA PHE A 785 13.990 -3.087 5.457 1.00 0.00 C ATOM 1098 C PHE A 785 15.474 -3.010 5.774 1.00 0.00 C ATOM 1099 O PHE A 785 16.120 -1.982 5.566 1.00 0.00 O ATOM 1100 CB PHE A 785 13.714 -2.519 4.066 1.00 0.00 C ATOM 1101 CG PHE A 785 12.379 -2.926 3.522 1.00 0.00 C ATOM 1102 CD1 PHE A 785 11.281 -2.108 3.683 1.00 0.00 C ATOM 1103 CD2 PHE A 785 12.225 -4.129 2.853 1.00 0.00 C ATOM 1104 CE1 PHE A 785 10.046 -2.476 3.186 1.00 0.00 C ATOM 1105 CE2 PHE A 785 10.993 -4.505 2.353 1.00 0.00 C ATOM 1106 CZ PHE A 785 9.902 -3.676 2.520 1.00 0.00 C ATOM 0 H PHE A 785 13.230 -1.378 6.389 1.00 0.00 H new ATOM 0 HA PHE A 785 13.681 -4.132 5.458 1.00 0.00 H new ATOM 0 HB2 PHE A 785 13.767 -1.431 4.107 1.00 0.00 H new ATOM 0 HB3 PHE A 785 14.495 -2.851 3.382 1.00 0.00 H new ATOM 0 HD1 PHE A 785 11.388 -1.168 4.204 1.00 0.00 H new ATOM 0 HD2 PHE A 785 13.077 -4.780 2.721 1.00 0.00 H new ATOM 0 HE1 PHE A 785 9.194 -1.825 3.318 1.00 0.00 H new ATOM 0 HE2 PHE A 785 10.884 -5.445 1.833 1.00 0.00 H new ATOM 0 HZ PHE A 785 8.937 -3.966 2.130 1.00 0.00 H new ATOM 1116 N THR A 786 16.013 -4.104 6.277 1.00 0.00 N ATOM 1117 CA THR A 786 17.411 -4.163 6.666 1.00 0.00 C ATOM 1118 C THR A 786 18.274 -4.629 5.509 1.00 0.00 C ATOM 1119 O THR A 786 19.309 -5.270 5.686 1.00 0.00 O ATOM 1120 CB THR A 786 17.579 -5.084 7.871 1.00 0.00 C ATOM 1121 OG1 THR A 786 16.990 -6.365 7.603 1.00 0.00 O ATOM 1122 CG2 THR A 786 16.906 -4.450 9.069 1.00 0.00 C ATOM 0 H THR A 786 15.499 -4.972 6.427 1.00 0.00 H new ATOM 0 HA THR A 786 17.738 -3.161 6.944 1.00 0.00 H new ATOM 0 HB THR A 786 18.640 -5.227 8.074 1.00 0.00 H new ATOM 0 HG1 THR A 786 17.106 -6.948 8.382 1.00 0.00 H new ATOM 0 HG21 THR A 786 17.020 -5.100 9.937 1.00 0.00 H new ATOM 0 HG22 THR A 786 17.367 -3.484 9.276 1.00 0.00 H new ATOM 0 HG23 THR A 786 15.846 -4.309 8.858 1.00 0.00 H new ATOM 1130 N THR A 787 17.825 -4.296 4.320 1.00 0.00 N ATOM 1131 CA THR A 787 18.533 -4.637 3.101 1.00 0.00 C ATOM 1132 C THR A 787 18.224 -3.623 2.008 1.00 0.00 C ATOM 1133 O THR A 787 17.106 -3.581 1.500 1.00 0.00 O ATOM 1134 CB THR A 787 18.157 -6.038 2.608 1.00 0.00 C ATOM 1135 OG1 THR A 787 18.311 -6.999 3.666 1.00 0.00 O ATOM 1136 CG2 THR A 787 19.020 -6.440 1.423 1.00 0.00 C ATOM 0 H THR A 787 16.958 -3.781 4.168 1.00 0.00 H new ATOM 0 HA THR A 787 19.599 -4.622 3.328 1.00 0.00 H new ATOM 0 HB THR A 787 17.114 -6.017 2.293 1.00 0.00 H new ATOM 0 HG1 THR A 787 18.066 -7.889 3.338 1.00 0.00 H new ATOM 0 HG21 THR A 787 18.737 -7.438 1.089 1.00 0.00 H new ATOM 0 HG22 THR A 787 18.874 -5.730 0.609 1.00 0.00 H new ATOM 0 HG23 THR A 787 20.069 -6.441 1.720 1.00 0.00 H new ATOM 1144 N GLY A 788 19.202 -2.776 1.697 1.00 0.00 N ATOM 1145 CA GLY A 788 19.066 -1.848 0.585 1.00 0.00 C ATOM 1146 C GLY A 788 18.638 -2.526 -0.712 1.00 0.00 C ATOM 1147 O GLY A 788 19.422 -3.226 -1.351 1.00 0.00 O ATOM 0 H GLY A 788 20.089 -2.715 2.197 1.00 0.00 H new ATOM 0 HA2 GLY A 788 18.335 -1.082 0.846 1.00 0.00 H new ATOM 0 HA3 GLY A 788 20.017 -1.340 0.425 1.00 0.00 H new ATOM 1151 N GLY A 789 17.396 -2.288 -1.097 1.00 0.00 N ATOM 1152 CA GLY A 789 16.837 -2.866 -2.298 1.00 0.00 C ATOM 1153 C GLY A 789 15.750 -1.975 -2.866 1.00 0.00 C ATOM 1154 O GLY A 789 15.532 -0.872 -2.363 1.00 0.00 O ATOM 0 H GLY A 789 16.750 -1.688 -0.583 1.00 0.00 H new ATOM 0 HA2 GLY A 789 17.623 -3.007 -3.040 1.00 0.00 H new ATOM 0 HA3 GLY A 789 16.427 -3.852 -2.077 1.00 0.00 H new ATOM 1158 N ASP A 790 15.054 -2.437 -3.888 1.00 0.00 N ATOM 1159 CA ASP A 790 14.027 -1.632 -4.520 1.00 0.00 C ATOM 1160 C ASP A 790 12.707 -2.368 -4.444 1.00 0.00 C ATOM 1161 O ASP A 790 12.624 -3.552 -4.787 1.00 0.00 O ATOM 1162 CB ASP A 790 14.368 -1.327 -5.986 1.00 0.00 C ATOM 1163 CG ASP A 790 15.674 -0.574 -6.161 1.00 0.00 C ATOM 1164 OD1 ASP A 790 15.639 0.609 -6.556 1.00 0.00 O ATOM 1165 OD2 ASP A 790 16.747 -1.167 -5.928 1.00 0.00 O ATOM 0 H ASP A 790 15.181 -3.363 -4.297 1.00 0.00 H new ATOM 0 HA ASP A 790 13.961 -0.681 -3.991 1.00 0.00 H new ATOM 0 HB2 ASP A 790 14.421 -2.264 -6.541 1.00 0.00 H new ATOM 0 HB3 ASP A 790 13.559 -0.742 -6.425 1.00 0.00 H new ATOM 1170 N TYR A 791 11.684 -1.677 -3.983 1.00 0.00 N ATOM 1171 CA TYR A 791 10.378 -2.276 -3.794 1.00 0.00 C ATOM 1172 C TYR A 791 9.301 -1.365 -4.354 1.00 0.00 C ATOM 1173 O TYR A 791 9.544 -0.189 -4.589 1.00 0.00 O ATOM 1174 CB TYR A 791 10.131 -2.536 -2.304 1.00 0.00 C ATOM 1175 CG TYR A 791 11.240 -3.327 -1.653 1.00 0.00 C ATOM 1176 CD1 TYR A 791 12.245 -2.688 -0.940 1.00 0.00 C ATOM 1177 CD2 TYR A 791 11.298 -4.706 -1.780 1.00 0.00 C ATOM 1178 CE1 TYR A 791 13.281 -3.407 -0.371 1.00 0.00 C ATOM 1179 CE2 TYR A 791 12.324 -5.430 -1.209 1.00 0.00 C ATOM 1180 CZ TYR A 791 13.312 -4.779 -0.508 1.00 0.00 C ATOM 1181 OH TYR A 791 14.343 -5.503 0.045 1.00 0.00 O ATOM 0 H TYR A 791 11.733 -0.690 -3.730 1.00 0.00 H new ATOM 0 HA TYR A 791 10.344 -3.226 -4.327 1.00 0.00 H new ATOM 0 HB2 TYR A 791 10.020 -1.582 -1.788 1.00 0.00 H new ATOM 0 HB3 TYR A 791 9.190 -3.074 -2.185 1.00 0.00 H new ATOM 0 HD1 TYR A 791 12.218 -1.614 -0.828 1.00 0.00 H new ATOM 0 HD2 TYR A 791 10.528 -5.222 -2.335 1.00 0.00 H new ATOM 0 HE1 TYR A 791 14.060 -2.897 0.177 1.00 0.00 H new ATOM 0 HE2 TYR A 791 12.351 -6.505 -1.312 1.00 0.00 H new ATOM 0 HH TYR A 791 14.211 -6.456 -0.143 1.00 0.00 H new ATOM 1191 N ILE A 792 8.132 -1.918 -4.601 1.00 0.00 N ATOM 1192 CA ILE A 792 6.998 -1.142 -5.061 1.00 0.00 C ATOM 1193 C ILE A 792 5.735 -1.589 -4.345 1.00 0.00 C ATOM 1194 O ILE A 792 5.362 -2.760 -4.396 1.00 0.00 O ATOM 1195 CB ILE A 792 6.817 -1.270 -6.588 1.00 0.00 C ATOM 1196 CG1 ILE A 792 7.975 -0.585 -7.312 1.00 0.00 C ATOM 1197 CG2 ILE A 792 5.496 -0.657 -7.018 1.00 0.00 C ATOM 1198 CD1 ILE A 792 8.406 -1.296 -8.569 1.00 0.00 C ATOM 0 H ILE A 792 7.941 -2.914 -4.489 1.00 0.00 H new ATOM 0 HA ILE A 792 7.189 -0.094 -4.830 1.00 0.00 H new ATOM 0 HB ILE A 792 6.811 -2.328 -6.851 1.00 0.00 H new ATOM 0 HG12 ILE A 792 7.683 0.435 -7.563 1.00 0.00 H new ATOM 0 HG13 ILE A 792 8.826 -0.515 -6.634 1.00 0.00 H new ATOM 0 HG21 ILE A 792 5.384 -0.755 -8.098 1.00 0.00 H new ATOM 0 HG22 ILE A 792 4.676 -1.173 -6.519 1.00 0.00 H new ATOM 0 HG23 ILE A 792 5.479 0.398 -6.746 1.00 0.00 H new ATOM 0 HD11 ILE A 792 9.231 -0.753 -9.029 1.00 0.00 H new ATOM 0 HD12 ILE A 792 8.730 -2.307 -8.322 1.00 0.00 H new ATOM 0 HD13 ILE A 792 7.569 -1.343 -9.266 1.00 0.00 H new ATOM 1210 N LEU A 793 5.093 -0.658 -3.662 1.00 0.00 N ATOM 1211 CA LEU A 793 3.855 -0.948 -2.971 1.00 0.00 C ATOM 1212 C LEU A 793 2.702 -0.819 -3.950 1.00 0.00 C ATOM 1213 O LEU A 793 2.355 0.281 -4.378 1.00 0.00 O ATOM 1214 CB LEU A 793 3.664 -0.006 -1.774 1.00 0.00 C ATOM 1215 CG LEU A 793 2.423 -0.279 -0.914 1.00 0.00 C ATOM 1216 CD1 LEU A 793 2.684 0.039 0.553 1.00 0.00 C ATOM 1217 CD2 LEU A 793 1.250 0.542 -1.408 1.00 0.00 C ATOM 0 H LEU A 793 5.412 0.307 -3.573 1.00 0.00 H new ATOM 0 HA LEU A 793 3.887 -1.966 -2.583 1.00 0.00 H new ATOM 0 HB2 LEU A 793 4.547 -0.070 -1.138 1.00 0.00 H new ATOM 0 HB3 LEU A 793 3.611 1.018 -2.144 1.00 0.00 H new ATOM 0 HG LEU A 793 2.188 -1.340 -1.001 1.00 0.00 H new ATOM 0 HD11 LEU A 793 1.785 -0.165 1.135 1.00 0.00 H new ATOM 0 HD12 LEU A 793 3.502 -0.581 0.920 1.00 0.00 H new ATOM 0 HD13 LEU A 793 2.951 1.091 0.655 1.00 0.00 H new ATOM 0 HD21 LEU A 793 0.377 0.338 -0.789 1.00 0.00 H new ATOM 0 HD22 LEU A 793 1.497 1.602 -1.349 1.00 0.00 H new ATOM 0 HD23 LEU A 793 1.031 0.278 -2.442 1.00 0.00 H new ATOM 1229 N SER A 794 2.140 -1.949 -4.325 1.00 0.00 N ATOM 1230 CA SER A 794 1.051 -1.989 -5.281 1.00 0.00 C ATOM 1231 C SER A 794 -0.232 -2.445 -4.601 1.00 0.00 C ATOM 1232 O SER A 794 -0.196 -3.203 -3.637 1.00 0.00 O ATOM 1233 CB SER A 794 1.409 -2.940 -6.420 1.00 0.00 C ATOM 1234 OG SER A 794 2.648 -2.576 -7.005 1.00 0.00 O ATOM 0 H SER A 794 2.424 -2.865 -3.977 1.00 0.00 H new ATOM 0 HA SER A 794 0.891 -0.989 -5.683 1.00 0.00 H new ATOM 0 HB2 SER A 794 1.465 -3.961 -6.044 1.00 0.00 H new ATOM 0 HB3 SER A 794 0.624 -2.921 -7.176 1.00 0.00 H new ATOM 0 HG SER A 794 2.862 -3.198 -7.732 1.00 0.00 H new ATOM 1240 N LEU A 795 -1.359 -1.984 -5.111 1.00 0.00 N ATOM 1241 CA LEU A 795 -2.653 -2.306 -4.534 1.00 0.00 C ATOM 1242 C LEU A 795 -3.141 -3.653 -5.047 1.00 0.00 C ATOM 1243 O LEU A 795 -3.099 -3.914 -6.248 1.00 0.00 O ATOM 1244 CB LEU A 795 -3.641 -1.213 -4.897 1.00 0.00 C ATOM 1245 CG LEU A 795 -3.168 0.194 -4.561 1.00 0.00 C ATOM 1246 CD1 LEU A 795 -4.104 1.207 -5.164 1.00 0.00 C ATOM 1247 CD2 LEU A 795 -3.076 0.381 -3.054 1.00 0.00 C ATOM 0 H LEU A 795 -1.405 -1.380 -5.931 1.00 0.00 H new ATOM 0 HA LEU A 795 -2.563 -2.369 -3.450 1.00 0.00 H new ATOM 0 HB2 LEU A 795 -3.850 -1.268 -5.965 1.00 0.00 H new ATOM 0 HB3 LEU A 795 -4.581 -1.402 -4.378 1.00 0.00 H new ATOM 0 HG LEU A 795 -2.173 0.341 -4.982 1.00 0.00 H new ATOM 0 HD11 LEU A 795 -3.759 2.212 -4.919 1.00 0.00 H new ATOM 0 HD12 LEU A 795 -4.125 1.084 -6.247 1.00 0.00 H new ATOM 0 HD13 LEU A 795 -5.107 1.060 -4.763 1.00 0.00 H new ATOM 0 HD21 LEU A 795 -2.736 1.393 -2.833 1.00 0.00 H new ATOM 0 HD22 LEU A 795 -4.057 0.222 -2.607 1.00 0.00 H new ATOM 0 HD23 LEU A 795 -2.368 -0.338 -2.641 1.00 0.00 H new ATOM 1259 N VAL A 796 -3.599 -4.507 -4.140 1.00 0.00 N ATOM 1260 CA VAL A 796 -4.002 -5.854 -4.517 1.00 0.00 C ATOM 1261 C VAL A 796 -5.508 -5.969 -4.673 1.00 0.00 C ATOM 1262 O VAL A 796 -6.004 -6.299 -5.752 1.00 0.00 O ATOM 1263 CB VAL A 796 -3.527 -6.889 -3.476 1.00 0.00 C ATOM 1264 CG1 VAL A 796 -4.077 -8.273 -3.788 1.00 0.00 C ATOM 1265 CG2 VAL A 796 -2.024 -6.914 -3.461 1.00 0.00 C ATOM 0 H VAL A 796 -3.700 -4.293 -3.148 1.00 0.00 H new ATOM 0 HA VAL A 796 -3.531 -6.061 -5.478 1.00 0.00 H new ATOM 0 HB VAL A 796 -3.900 -6.601 -2.493 1.00 0.00 H new ATOM 0 HG11 VAL A 796 -3.726 -8.982 -3.038 1.00 0.00 H new ATOM 0 HG12 VAL A 796 -5.167 -8.243 -3.777 1.00 0.00 H new ATOM 0 HG13 VAL A 796 -3.733 -8.588 -4.773 1.00 0.00 H new ATOM 0 HG21 VAL A 796 -1.680 -7.643 -2.728 1.00 0.00 H new ATOM 0 HG22 VAL A 796 -1.655 -7.190 -4.449 1.00 0.00 H new ATOM 0 HG23 VAL A 796 -1.646 -5.927 -3.196 1.00 0.00 H new ATOM 1275 N SER A 797 -6.229 -5.650 -3.610 1.00 0.00 N ATOM 1276 CA SER A 797 -7.670 -5.840 -3.570 1.00 0.00 C ATOM 1277 C SER A 797 -8.252 -5.216 -2.310 1.00 0.00 C ATOM 1278 O SER A 797 -7.521 -4.683 -1.476 1.00 0.00 O ATOM 1279 CB SER A 797 -8.022 -7.337 -3.611 1.00 0.00 C ATOM 1280 OG SER A 797 -7.849 -7.886 -4.911 1.00 0.00 O ATOM 0 H SER A 797 -5.835 -5.255 -2.756 1.00 0.00 H new ATOM 0 HA SER A 797 -8.099 -5.351 -4.445 1.00 0.00 H new ATOM 0 HB2 SER A 797 -7.394 -7.877 -2.902 1.00 0.00 H new ATOM 0 HB3 SER A 797 -9.055 -7.476 -3.293 1.00 0.00 H new ATOM 0 HG SER A 797 -7.462 -7.208 -5.503 1.00 0.00 H new ATOM 1286 N ILE A 798 -9.565 -5.278 -2.192 1.00 0.00 N ATOM 1287 CA ILE A 798 -10.269 -4.739 -1.043 1.00 0.00 C ATOM 1288 C ILE A 798 -11.543 -5.544 -0.833 1.00 0.00 C ATOM 1289 O ILE A 798 -12.034 -6.176 -1.764 1.00 0.00 O ATOM 1290 CB ILE A 798 -10.612 -3.244 -1.259 1.00 0.00 C ATOM 1291 CG1 ILE A 798 -10.839 -2.534 0.074 1.00 0.00 C ATOM 1292 CG2 ILE A 798 -11.845 -3.105 -2.139 1.00 0.00 C ATOM 1293 CD1 ILE A 798 -10.637 -1.036 -0.004 1.00 0.00 C ATOM 0 H ILE A 798 -10.174 -5.704 -2.890 1.00 0.00 H new ATOM 0 HA ILE A 798 -9.632 -4.811 -0.162 1.00 0.00 H new ATOM 0 HB ILE A 798 -9.764 -2.774 -1.757 1.00 0.00 H new ATOM 0 HG12 ILE A 798 -11.852 -2.740 0.419 1.00 0.00 H new ATOM 0 HG13 ILE A 798 -10.158 -2.947 0.818 1.00 0.00 H new ATOM 0 HG21 ILE A 798 -12.073 -2.049 -2.281 1.00 0.00 H new ATOM 0 HG22 ILE A 798 -11.655 -3.569 -3.107 1.00 0.00 H new ATOM 0 HG23 ILE A 798 -12.691 -3.598 -1.660 1.00 0.00 H new ATOM 0 HD11 ILE A 798 -10.814 -0.593 0.976 1.00 0.00 H new ATOM 0 HD12 ILE A 798 -9.616 -0.823 -0.320 1.00 0.00 H new ATOM 0 HD13 ILE A 798 -11.336 -0.612 -0.725 1.00 0.00 H new ATOM 1305 N LYS A 799 -12.070 -5.545 0.371 1.00 0.00 N ATOM 1306 CA LYS A 799 -13.312 -6.238 0.643 1.00 0.00 C ATOM 1307 C LYS A 799 -14.310 -5.278 1.256 1.00 0.00 C ATOM 1308 O LYS A 799 -14.052 -4.674 2.300 1.00 0.00 O ATOM 1309 CB LYS A 799 -13.074 -7.469 1.533 1.00 0.00 C ATOM 1310 CG LYS A 799 -14.306 -7.993 2.260 1.00 0.00 C ATOM 1311 CD LYS A 799 -14.332 -7.483 3.697 1.00 0.00 C ATOM 1312 CE LYS A 799 -15.326 -8.239 4.554 1.00 0.00 C ATOM 1313 NZ LYS A 799 -15.304 -7.777 5.968 1.00 0.00 N ATOM 0 H LYS A 799 -11.659 -5.075 1.178 1.00 0.00 H new ATOM 0 HA LYS A 799 -13.729 -6.606 -0.295 1.00 0.00 H new ATOM 0 HB2 LYS A 799 -12.668 -8.270 0.916 1.00 0.00 H new ATOM 0 HB3 LYS A 799 -12.314 -7.220 2.273 1.00 0.00 H new ATOM 0 HG2 LYS A 799 -15.208 -7.674 1.738 1.00 0.00 H new ATOM 0 HG3 LYS A 799 -14.303 -9.083 2.254 1.00 0.00 H new ATOM 0 HD2 LYS A 799 -13.337 -7.575 4.131 1.00 0.00 H new ATOM 0 HD3 LYS A 799 -14.585 -6.423 3.700 1.00 0.00 H new ATOM 0 HE2 LYS A 799 -16.329 -8.111 4.146 1.00 0.00 H new ATOM 0 HE3 LYS A 799 -15.101 -9.305 4.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 799 -15.998 -8.319 6.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 799 -14.354 -7.923 6.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 799 -15.544 -6.766 6.007 1.00 0.00 H new ATOM 1327 N ASP A 800 -15.420 -5.108 0.558 1.00 0.00 N ATOM 1328 CA ASP A 800 -16.521 -4.297 1.036 1.00 0.00 C ATOM 1329 C ASP A 800 -17.097 -4.917 2.294 1.00 0.00 C ATOM 1330 O ASP A 800 -17.005 -6.128 2.486 1.00 0.00 O ATOM 1331 CB ASP A 800 -17.601 -4.191 -0.048 1.00 0.00 C ATOM 1332 CG ASP A 800 -18.824 -3.416 0.403 1.00 0.00 C ATOM 1333 OD1 ASP A 800 -19.737 -4.029 0.991 1.00 0.00 O ATOM 1334 OD2 ASP A 800 -18.881 -2.195 0.170 1.00 0.00 O ATOM 0 H ASP A 800 -15.581 -5.530 -0.357 1.00 0.00 H new ATOM 0 HA ASP A 800 -16.160 -3.295 1.267 1.00 0.00 H new ATOM 0 HB2 ASP A 800 -17.177 -3.708 -0.929 1.00 0.00 H new ATOM 0 HB3 ASP A 800 -17.905 -5.194 -0.349 1.00 0.00 H new ATOM 1339 N SER A 801 -17.707 -4.079 3.124 1.00 0.00 N ATOM 1340 CA SER A 801 -18.164 -4.466 4.453 1.00 0.00 C ATOM 1341 C SER A 801 -19.208 -5.590 4.402 1.00 0.00 C ATOM 1342 O SER A 801 -19.527 -6.194 5.427 1.00 0.00 O ATOM 1343 CB SER A 801 -18.732 -3.235 5.164 1.00 0.00 C ATOM 1344 OG SER A 801 -18.943 -3.478 6.542 1.00 0.00 O ATOM 0 H SER A 801 -17.900 -3.105 2.892 1.00 0.00 H new ATOM 0 HA SER A 801 -17.311 -4.856 5.009 1.00 0.00 H new ATOM 0 HB2 SER A 801 -18.047 -2.396 5.043 1.00 0.00 H new ATOM 0 HB3 SER A 801 -19.674 -2.947 4.697 1.00 0.00 H new ATOM 0 HG SER A 801 -19.123 -4.431 6.682 1.00 0.00 H new ATOM 1350 N THR A 802 -19.726 -5.875 3.211 1.00 0.00 N ATOM 1351 CA THR A 802 -20.680 -6.959 3.023 1.00 0.00 C ATOM 1352 C THR A 802 -19.953 -8.254 2.669 1.00 0.00 C ATOM 1353 O THR A 802 -20.569 -9.302 2.459 1.00 0.00 O ATOM 1354 CB THR A 802 -21.685 -6.614 1.910 1.00 0.00 C ATOM 1355 OG1 THR A 802 -20.983 -6.250 0.713 1.00 0.00 O ATOM 1356 CG2 THR A 802 -22.587 -5.468 2.335 1.00 0.00 C ATOM 0 H THR A 802 -19.498 -5.365 2.357 1.00 0.00 H new ATOM 0 HA THR A 802 -21.222 -7.095 3.959 1.00 0.00 H new ATOM 0 HB THR A 802 -22.301 -7.493 1.721 1.00 0.00 H new ATOM 0 HG1 THR A 802 -20.751 -5.298 0.746 1.00 0.00 H new ATOM 0 HG21 THR A 802 -23.289 -5.241 1.533 1.00 0.00 H new ATOM 0 HG22 THR A 802 -23.139 -5.752 3.231 1.00 0.00 H new ATOM 0 HG23 THR A 802 -21.981 -4.587 2.547 1.00 0.00 H new ATOM 1364 N GLY A 803 -18.633 -8.160 2.621 1.00 0.00 N ATOM 1365 CA GLY A 803 -17.797 -9.274 2.239 1.00 0.00 C ATOM 1366 C GLY A 803 -17.719 -9.425 0.740 1.00 0.00 C ATOM 1367 O GLY A 803 -17.719 -10.537 0.211 1.00 0.00 O ATOM 0 H GLY A 803 -18.118 -7.309 2.846 1.00 0.00 H new ATOM 0 HA2 GLY A 803 -16.795 -9.132 2.643 1.00 0.00 H new ATOM 0 HA3 GLY A 803 -18.190 -10.191 2.677 1.00 0.00 H new ATOM 1371 N CYS A 804 -17.650 -8.298 0.056 1.00 0.00 N ATOM 1372 CA CYS A 804 -17.580 -8.296 -1.397 1.00 0.00 C ATOM 1373 C CYS A 804 -16.208 -7.806 -1.843 1.00 0.00 C ATOM 1374 O CYS A 804 -15.876 -6.635 -1.675 1.00 0.00 O ATOM 1375 CB CYS A 804 -18.691 -7.415 -1.978 1.00 0.00 C ATOM 1376 SG CYS A 804 -18.821 -7.467 -3.778 1.00 0.00 S ATOM 0 H CYS A 804 -17.641 -7.371 0.482 1.00 0.00 H new ATOM 0 HA CYS A 804 -17.724 -9.311 -1.768 1.00 0.00 H new ATOM 0 HB2 CYS A 804 -19.644 -7.723 -1.548 1.00 0.00 H new ATOM 0 HB3 CYS A 804 -18.520 -6.384 -1.668 1.00 0.00 H new ATOM 0 HG CYS A 804 -19.790 -6.691 -4.166 1.00 0.00 H new ATOM 1382 N VAL A 805 -15.409 -8.702 -2.400 1.00 0.00 N ATOM 1383 CA VAL A 805 -14.032 -8.374 -2.742 1.00 0.00 C ATOM 1384 C VAL A 805 -13.939 -7.738 -4.126 1.00 0.00 C ATOM 1385 O VAL A 805 -14.458 -8.260 -5.114 1.00 0.00 O ATOM 1386 CB VAL A 805 -13.104 -9.611 -2.639 1.00 0.00 C ATOM 1387 CG1 VAL A 805 -13.563 -10.732 -3.559 1.00 0.00 C ATOM 1388 CG2 VAL A 805 -11.659 -9.232 -2.930 1.00 0.00 C ATOM 0 H VAL A 805 -15.687 -9.657 -2.624 1.00 0.00 H new ATOM 0 HA VAL A 805 -13.687 -7.642 -2.011 1.00 0.00 H new ATOM 0 HB VAL A 805 -13.162 -9.979 -1.615 1.00 0.00 H new ATOM 0 HG11 VAL A 805 -12.889 -11.583 -3.460 1.00 0.00 H new ATOM 0 HG12 VAL A 805 -14.573 -11.036 -3.286 1.00 0.00 H new ATOM 0 HG13 VAL A 805 -13.556 -10.382 -4.591 1.00 0.00 H new ATOM 0 HG21 VAL A 805 -11.028 -10.117 -2.851 1.00 0.00 H new ATOM 0 HG22 VAL A 805 -11.586 -8.823 -3.938 1.00 0.00 H new ATOM 0 HG23 VAL A 805 -11.327 -8.484 -2.210 1.00 0.00 H new ATOM 1398 N VAL A 806 -13.291 -6.588 -4.168 1.00 0.00 N ATOM 1399 CA VAL A 806 -13.119 -5.825 -5.389 1.00 0.00 C ATOM 1400 C VAL A 806 -11.650 -5.818 -5.792 1.00 0.00 C ATOM 1401 O VAL A 806 -10.763 -5.707 -4.940 1.00 0.00 O ATOM 1402 CB VAL A 806 -13.622 -4.375 -5.200 1.00 0.00 C ATOM 1403 CG1 VAL A 806 -13.330 -3.521 -6.425 1.00 0.00 C ATOM 1404 CG2 VAL A 806 -15.111 -4.369 -4.898 1.00 0.00 C ATOM 0 H VAL A 806 -12.866 -6.154 -3.348 1.00 0.00 H new ATOM 0 HA VAL A 806 -13.706 -6.294 -6.178 1.00 0.00 H new ATOM 0 HB VAL A 806 -13.085 -3.943 -4.355 1.00 0.00 H new ATOM 0 HG11 VAL A 806 -13.697 -2.508 -6.258 1.00 0.00 H new ATOM 0 HG12 VAL A 806 -12.255 -3.493 -6.601 1.00 0.00 H new ATOM 0 HG13 VAL A 806 -13.829 -3.949 -7.294 1.00 0.00 H new ATOM 0 HG21 VAL A 806 -15.452 -3.342 -4.767 1.00 0.00 H new ATOM 0 HG22 VAL A 806 -15.652 -4.828 -5.725 1.00 0.00 H new ATOM 0 HG23 VAL A 806 -15.299 -4.933 -3.984 1.00 0.00 H new ATOM 1414 N GLY A 807 -11.398 -5.962 -7.082 1.00 0.00 N ATOM 1415 CA GLY A 807 -10.034 -5.974 -7.573 1.00 0.00 C ATOM 1416 C GLY A 807 -9.480 -4.583 -7.797 1.00 0.00 C ATOM 1417 O GLY A 807 -9.892 -3.873 -8.714 1.00 0.00 O ATOM 0 H GLY A 807 -12.113 -6.071 -7.801 1.00 0.00 H new ATOM 0 HA2 GLY A 807 -9.401 -6.502 -6.860 1.00 0.00 H new ATOM 0 HA3 GLY A 807 -9.994 -6.531 -8.509 1.00 0.00 H new ATOM 1421 N LEU A 808 -8.547 -4.201 -6.946 1.00 0.00 N ATOM 1422 CA LEU A 808 -7.885 -2.921 -7.022 1.00 0.00 C ATOM 1423 C LEU A 808 -6.870 -2.840 -8.146 1.00 0.00 C ATOM 1424 O LEU A 808 -6.057 -3.742 -8.345 1.00 0.00 O ATOM 1425 CB LEU A 808 -7.207 -2.648 -5.694 1.00 0.00 C ATOM 1426 CG LEU A 808 -8.113 -2.019 -4.651 1.00 0.00 C ATOM 1427 CD1 LEU A 808 -9.340 -2.865 -4.400 1.00 0.00 C ATOM 1428 CD2 LEU A 808 -7.353 -1.768 -3.359 1.00 0.00 C ATOM 0 H LEU A 808 -8.226 -4.783 -6.172 1.00 0.00 H new ATOM 0 HA LEU A 808 -8.643 -2.168 -7.238 1.00 0.00 H new ATOM 0 HB2 LEU A 808 -6.814 -3.585 -5.300 1.00 0.00 H new ATOM 0 HB3 LEU A 808 -6.354 -1.990 -5.862 1.00 0.00 H new ATOM 0 HG LEU A 808 -8.451 -1.059 -5.041 1.00 0.00 H new ATOM 0 HD11 LEU A 808 -9.966 -2.384 -3.648 1.00 0.00 H new ATOM 0 HD12 LEU A 808 -9.904 -2.972 -5.327 1.00 0.00 H new ATOM 0 HD13 LEU A 808 -9.037 -3.850 -4.044 1.00 0.00 H new ATOM 0 HD21 LEU A 808 -8.021 -1.317 -2.626 1.00 0.00 H new ATOM 0 HD22 LEU A 808 -6.973 -2.713 -2.971 1.00 0.00 H new ATOM 0 HD23 LEU A 808 -6.519 -1.094 -3.553 1.00 0.00 H new ATOM 1440 N SER A 809 -6.942 -1.746 -8.883 1.00 0.00 N ATOM 1441 CA SER A 809 -5.928 -1.401 -9.857 1.00 0.00 C ATOM 1442 C SER A 809 -5.819 0.118 -9.950 1.00 0.00 C ATOM 1443 O SER A 809 -6.453 0.756 -10.792 1.00 0.00 O ATOM 1444 CB SER A 809 -6.272 -2.009 -11.222 1.00 0.00 C ATOM 1445 OG SER A 809 -6.424 -3.418 -11.126 1.00 0.00 O ATOM 0 H SER A 809 -7.706 -1.073 -8.821 1.00 0.00 H new ATOM 0 HA SER A 809 -4.967 -1.808 -9.543 1.00 0.00 H new ATOM 0 HB2 SER A 809 -7.193 -1.565 -11.601 1.00 0.00 H new ATOM 0 HB3 SER A 809 -5.486 -1.772 -11.939 1.00 0.00 H new ATOM 0 HG SER A 809 -6.645 -3.784 -12.008 1.00 0.00 H new ATOM 1451 N GLN A 810 -5.017 0.686 -9.064 1.00 0.00 N ATOM 1452 CA GLN A 810 -4.777 2.121 -9.033 1.00 0.00 C ATOM 1453 C GLN A 810 -3.287 2.387 -8.766 1.00 0.00 C ATOM 1454 O GLN A 810 -2.542 1.432 -8.532 1.00 0.00 O ATOM 1455 CB GLN A 810 -5.681 2.798 -7.994 1.00 0.00 C ATOM 1456 CG GLN A 810 -6.954 3.376 -8.600 1.00 0.00 C ATOM 1457 CD GLN A 810 -7.781 4.180 -7.613 1.00 0.00 C ATOM 1458 OE1 GLN A 810 -7.624 5.393 -7.487 1.00 0.00 O ATOM 1459 NE2 GLN A 810 -8.662 3.499 -6.907 1.00 0.00 N ATOM 0 H GLN A 810 -4.514 0.166 -8.346 1.00 0.00 H new ATOM 0 HA GLN A 810 -5.028 2.555 -10.001 1.00 0.00 H new ATOM 0 HB2 GLN A 810 -5.948 2.073 -7.225 1.00 0.00 H new ATOM 0 HB3 GLN A 810 -5.125 3.596 -7.501 1.00 0.00 H new ATOM 0 HG2 GLN A 810 -6.689 4.013 -9.444 1.00 0.00 H new ATOM 0 HG3 GLN A 810 -7.562 2.562 -8.994 1.00 0.00 H new ATOM 0 HE21 GLN A 810 -8.758 2.493 -7.045 1.00 0.00 H new ATOM 0 HE22 GLN A 810 -9.247 3.978 -6.223 1.00 0.00 H new ATOM 1468 N PRO A 811 -2.822 3.660 -8.826 1.00 0.00 N ATOM 1469 CA PRO A 811 -1.395 4.006 -8.676 1.00 0.00 C ATOM 1470 C PRO A 811 -0.663 3.289 -7.531 1.00 0.00 C ATOM 1471 O PRO A 811 -1.200 3.096 -6.438 1.00 0.00 O ATOM 1472 CB PRO A 811 -1.436 5.504 -8.397 1.00 0.00 C ATOM 1473 CG PRO A 811 -2.631 5.989 -9.135 1.00 0.00 C ATOM 1474 CD PRO A 811 -3.636 4.867 -9.100 1.00 0.00 C ATOM 0 HA PRO A 811 -0.839 3.703 -9.564 1.00 0.00 H new ATOM 0 HB2 PRO A 811 -1.520 5.706 -7.329 1.00 0.00 H new ATOM 0 HB3 PRO A 811 -0.528 5.997 -8.744 1.00 0.00 H new ATOM 0 HG2 PRO A 811 -3.036 6.888 -8.670 1.00 0.00 H new ATOM 0 HG3 PRO A 811 -2.374 6.249 -10.162 1.00 0.00 H new ATOM 0 HD2 PRO A 811 -4.385 5.027 -8.324 1.00 0.00 H new ATOM 0 HD3 PRO A 811 -4.170 4.781 -10.046 1.00 0.00 H new ATOM 1482 N ASP A 812 0.577 2.913 -7.821 1.00 0.00 N ATOM 1483 CA ASP A 812 1.480 2.282 -6.856 1.00 0.00 C ATOM 1484 C ASP A 812 2.645 3.218 -6.553 1.00 0.00 C ATOM 1485 O ASP A 812 2.854 4.211 -7.257 1.00 0.00 O ATOM 1486 CB ASP A 812 2.017 0.952 -7.389 1.00 0.00 C ATOM 1487 CG ASP A 812 2.564 1.048 -8.797 1.00 0.00 C ATOM 1488 OD1 ASP A 812 1.821 0.722 -9.750 1.00 0.00 O ATOM 1489 OD2 ASP A 812 3.735 1.436 -8.961 1.00 0.00 O ATOM 0 H ASP A 812 0.992 3.038 -8.744 1.00 0.00 H new ATOM 0 HA ASP A 812 0.918 2.084 -5.944 1.00 0.00 H new ATOM 0 HB2 ASP A 812 2.803 0.593 -6.725 1.00 0.00 H new ATOM 0 HB3 ASP A 812 1.218 0.211 -7.367 1.00 0.00 H new ATOM 1494 N ALA A 813 3.391 2.910 -5.506 1.00 0.00 N ATOM 1495 CA ALA A 813 4.499 3.761 -5.086 1.00 0.00 C ATOM 1496 C ALA A 813 5.791 2.973 -5.020 1.00 0.00 C ATOM 1497 O ALA A 813 5.790 1.808 -4.632 1.00 0.00 O ATOM 1498 CB ALA A 813 4.228 4.390 -3.737 1.00 0.00 C ATOM 0 H ALA A 813 3.253 2.080 -4.930 1.00 0.00 H new ATOM 0 HA ALA A 813 4.597 4.551 -5.830 1.00 0.00 H new ATOM 0 HB1 ALA A 813 5.072 5.018 -3.452 1.00 0.00 H new ATOM 0 HB2 ALA A 813 3.326 4.999 -3.794 1.00 0.00 H new ATOM 0 HB3 ALA A 813 4.091 3.607 -2.991 1.00 0.00 H new ATOM 1504 N LYS A 814 6.891 3.602 -5.381 1.00 0.00 N ATOM 1505 CA LYS A 814 8.171 2.936 -5.344 1.00 0.00 C ATOM 1506 C LYS A 814 8.924 3.274 -4.064 1.00 0.00 C ATOM 1507 O LYS A 814 9.056 4.435 -3.682 1.00 0.00 O ATOM 1508 CB LYS A 814 9.014 3.306 -6.562 1.00 0.00 C ATOM 1509 CG LYS A 814 10.199 2.381 -6.755 1.00 0.00 C ATOM 1510 CD LYS A 814 11.032 2.758 -7.969 1.00 0.00 C ATOM 1511 CE LYS A 814 12.224 1.825 -8.127 1.00 0.00 C ATOM 1512 NZ LYS A 814 13.039 2.143 -9.330 1.00 0.00 N ATOM 0 H LYS A 814 6.922 4.570 -5.702 1.00 0.00 H new ATOM 0 HA LYS A 814 7.986 1.862 -5.364 1.00 0.00 H new ATOM 0 HB2 LYS A 814 8.388 3.279 -7.454 1.00 0.00 H new ATOM 0 HB3 LYS A 814 9.371 4.330 -6.454 1.00 0.00 H new ATOM 0 HG2 LYS A 814 10.826 2.407 -5.864 1.00 0.00 H new ATOM 0 HG3 LYS A 814 9.844 1.356 -6.865 1.00 0.00 H new ATOM 0 HD2 LYS A 814 10.413 2.717 -8.865 1.00 0.00 H new ATOM 0 HD3 LYS A 814 11.381 3.786 -7.869 1.00 0.00 H new ATOM 0 HE2 LYS A 814 12.852 1.890 -7.239 1.00 0.00 H new ATOM 0 HE3 LYS A 814 11.870 0.796 -8.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 814 13.838 1.480 -9.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 814 12.449 2.056 -10.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 814 13.401 3.115 -9.257 1.00 0.00 H new ATOM 1526 N ILE A 815 9.398 2.236 -3.412 1.00 0.00 N ATOM 1527 CA ILE A 815 10.207 2.357 -2.220 1.00 0.00 C ATOM 1528 C ILE A 815 11.648 2.004 -2.566 1.00 0.00 C ATOM 1529 O ILE A 815 11.924 0.894 -3.018 1.00 0.00 O ATOM 1530 CB ILE A 815 9.709 1.408 -1.108 1.00 0.00 C ATOM 1531 CG1 ILE A 815 8.289 1.775 -0.656 1.00 0.00 C ATOM 1532 CG2 ILE A 815 10.665 1.421 0.069 1.00 0.00 C ATOM 1533 CD1 ILE A 815 7.188 1.071 -1.426 1.00 0.00 C ATOM 0 H ILE A 815 9.230 1.272 -3.699 1.00 0.00 H new ATOM 0 HA ILE A 815 10.137 3.382 -1.855 1.00 0.00 H new ATOM 0 HB ILE A 815 9.677 0.399 -1.518 1.00 0.00 H new ATOM 0 HG12 ILE A 815 8.185 1.538 0.403 1.00 0.00 H new ATOM 0 HG13 ILE A 815 8.155 2.852 -0.756 1.00 0.00 H new ATOM 0 HG21 ILE A 815 10.298 0.747 0.843 1.00 0.00 H new ATOM 0 HG22 ILE A 815 11.651 1.094 -0.260 1.00 0.00 H new ATOM 0 HG23 ILE A 815 10.733 2.432 0.471 1.00 0.00 H new ATOM 0 HD11 ILE A 815 6.217 1.387 -1.043 1.00 0.00 H new ATOM 0 HD12 ILE A 815 7.262 1.327 -2.483 1.00 0.00 H new ATOM 0 HD13 ILE A 815 7.292 -0.007 -1.306 1.00 0.00 H new ATOM 1545 N GLN A 816 12.561 2.935 -2.379 1.00 0.00 N ATOM 1546 CA GLN A 816 13.947 2.695 -2.727 1.00 0.00 C ATOM 1547 C GLN A 816 14.830 2.756 -1.488 1.00 0.00 C ATOM 1548 O GLN A 816 15.129 3.828 -0.971 1.00 0.00 O ATOM 1549 CB GLN A 816 14.397 3.733 -3.748 1.00 0.00 C ATOM 1550 CG GLN A 816 15.758 3.448 -4.346 1.00 0.00 C ATOM 1551 CD GLN A 816 16.834 4.371 -3.817 1.00 0.00 C ATOM 1552 OE1 GLN A 816 17.105 5.419 -4.392 1.00 0.00 O ATOM 1553 NE2 GLN A 816 17.441 3.993 -2.709 1.00 0.00 N ATOM 0 H GLN A 816 12.371 3.859 -1.991 1.00 0.00 H new ATOM 0 HA GLN A 816 14.038 1.698 -3.158 1.00 0.00 H new ATOM 0 HB2 GLN A 816 13.661 3.784 -4.550 1.00 0.00 H new ATOM 0 HB3 GLN A 816 14.417 4.713 -3.272 1.00 0.00 H new ATOM 0 HG2 GLN A 816 16.034 2.415 -4.134 1.00 0.00 H new ATOM 0 HG3 GLN A 816 15.702 3.546 -5.430 1.00 0.00 H new ATOM 0 HE21 GLN A 816 17.185 3.113 -2.262 1.00 0.00 H new ATOM 0 HE22 GLN A 816 18.166 4.581 -2.299 1.00 0.00 H new ATOM 1562 N VAL A 817 15.292 1.613 -1.036 1.00 0.00 N ATOM 1563 CA VAL A 817 16.126 1.572 0.149 1.00 0.00 C ATOM 1564 C VAL A 817 17.545 1.181 -0.222 1.00 0.00 C ATOM 1565 O VAL A 817 17.768 0.416 -1.152 1.00 0.00 O ATOM 1566 CB VAL A 817 15.530 0.660 1.262 1.00 0.00 C ATOM 1567 CG1 VAL A 817 14.234 0.035 0.824 1.00 0.00 C ATOM 1568 CG2 VAL A 817 16.489 -0.374 1.735 1.00 0.00 C ATOM 0 H VAL A 817 15.108 0.706 -1.464 1.00 0.00 H new ATOM 0 HA VAL A 817 16.154 2.574 0.576 1.00 0.00 H new ATOM 0 HB VAL A 817 15.325 1.310 2.113 1.00 0.00 H new ATOM 0 HG11 VAL A 817 13.845 -0.595 1.624 1.00 0.00 H new ATOM 0 HG12 VAL A 817 13.511 0.818 0.595 1.00 0.00 H new ATOM 0 HG13 VAL A 817 14.405 -0.572 -0.065 1.00 0.00 H new ATOM 0 HG21 VAL A 817 16.019 -0.979 2.510 1.00 0.00 H new ATOM 0 HG22 VAL A 817 16.776 -1.013 0.900 1.00 0.00 H new ATOM 0 HG23 VAL A 817 17.376 0.111 2.142 1.00 0.00 H new ATOM 1578 N ARG A 818 18.499 1.767 0.468 1.00 0.00 N ATOM 1579 CA ARG A 818 19.909 1.505 0.208 1.00 0.00 C ATOM 1580 C ARG A 818 20.637 1.198 1.497 1.00 0.00 C ATOM 1581 O ARG A 818 20.043 1.180 2.557 1.00 0.00 O ATOM 1582 CB ARG A 818 20.592 2.687 -0.487 1.00 0.00 C ATOM 1583 CG ARG A 818 20.106 2.943 -1.899 1.00 0.00 C ATOM 1584 CD ARG A 818 20.244 1.715 -2.781 1.00 0.00 C ATOM 1585 NE ARG A 818 19.693 1.944 -4.113 1.00 0.00 N ATOM 1586 CZ ARG A 818 18.761 1.179 -4.683 1.00 0.00 C ATOM 1587 NH1 ARG A 818 18.271 0.120 -4.049 1.00 0.00 N ATOM 1588 NH2 ARG A 818 18.312 1.474 -5.891 1.00 0.00 N ATOM 0 H ARG A 818 18.328 2.434 1.220 1.00 0.00 H new ATOM 0 HA ARG A 818 19.955 0.643 -0.457 1.00 0.00 H new ATOM 0 HB2 ARG A 818 20.432 3.586 0.109 1.00 0.00 H new ATOM 0 HB3 ARG A 818 21.667 2.508 -0.512 1.00 0.00 H new ATOM 0 HG2 ARG A 818 19.062 3.254 -1.872 1.00 0.00 H new ATOM 0 HG3 ARG A 818 20.673 3.767 -2.333 1.00 0.00 H new ATOM 0 HD2 ARG A 818 21.296 1.443 -2.864 1.00 0.00 H new ATOM 0 HD3 ARG A 818 19.733 0.873 -2.315 1.00 0.00 H new ATOM 0 HE ARG A 818 20.044 2.742 -4.643 1.00 0.00 H new ATOM 0 HH11 ARG A 818 18.607 -0.116 -3.115 1.00 0.00 H new ATOM 0 HH12 ARG A 818 17.558 -0.457 -4.496 1.00 0.00 H new ATOM 0 HH21 ARG A 818 18.678 2.287 -6.387 1.00 0.00 H new ATOM 0 HH22 ARG A 818 17.599 0.889 -6.327 1.00 0.00 H new ATOM 1602 N ARG A 819 21.909 0.892 1.377 1.00 0.00 N ATOM 1603 CA ARG A 819 22.790 0.750 2.525 1.00 0.00 C ATOM 1604 C ARG A 819 23.301 2.117 2.956 1.00 0.00 C ATOM 1605 O ARG A 819 23.284 3.064 2.168 1.00 0.00 O ATOM 1606 CB ARG A 819 23.967 -0.127 2.162 1.00 0.00 C ATOM 1607 CG ARG A 819 23.791 -1.619 2.425 1.00 0.00 C ATOM 1608 CD ARG A 819 22.598 -2.216 1.699 1.00 0.00 C ATOM 1609 NE ARG A 819 22.544 -3.668 1.867 1.00 0.00 N ATOM 1610 CZ ARG A 819 22.263 -4.532 0.889 1.00 0.00 C ATOM 1611 NH1 ARG A 819 21.997 -4.102 -0.337 1.00 0.00 N ATOM 1612 NH2 ARG A 819 22.254 -5.834 1.140 1.00 0.00 N ATOM 0 H ARG A 819 22.368 0.733 0.480 1.00 0.00 H new ATOM 0 HA ARG A 819 22.233 0.294 3.343 1.00 0.00 H new ATOM 0 HB2 ARG A 819 24.187 0.012 1.103 1.00 0.00 H new ATOM 0 HB3 ARG A 819 24.839 0.220 2.717 1.00 0.00 H new ATOM 0 HG2 ARG A 819 24.695 -2.145 2.119 1.00 0.00 H new ATOM 0 HG3 ARG A 819 23.675 -1.782 3.497 1.00 0.00 H new ATOM 0 HD2 ARG A 819 21.679 -1.770 2.078 1.00 0.00 H new ATOM 0 HD3 ARG A 819 22.657 -1.973 0.638 1.00 0.00 H new ATOM 0 HE ARG A 819 22.734 -4.046 2.795 1.00 0.00 H new ATOM 0 HH11 ARG A 819 22.006 -3.102 -0.540 1.00 0.00 H new ATOM 0 HH12 ARG A 819 21.784 -4.771 -1.077 1.00 0.00 H new ATOM 0 HH21 ARG A 819 22.462 -6.174 2.079 1.00 0.00 H new ATOM 0 HH22 ARG A 819 22.039 -6.496 0.394 1.00 0.00 H new ATOM 1626 N ASP A 820 23.737 2.230 4.201 1.00 0.00 N ATOM 1627 CA ASP A 820 24.283 3.484 4.687 1.00 0.00 C ATOM 1628 C ASP A 820 25.690 3.684 4.145 1.00 0.00 C ATOM 1629 O ASP A 820 26.005 4.742 3.606 1.00 99.99 O ATOM 1630 CB ASP A 820 24.259 3.554 6.222 1.00 0.00 C ATOM 1631 CG ASP A 820 25.038 2.447 6.896 1.00 0.00 C ATOM 1632 OD1 ASP A 820 24.587 1.284 6.853 1.00 0.00 O ATOM 1633 OD2 ASP A 820 26.095 2.738 7.492 1.00 0.00 O ATOM 0 H ASP A 820 23.723 1.475 4.887 1.00 0.00 H new ATOM 0 HA ASP A 820 23.653 4.296 4.323 1.00 0.00 H new ATOM 0 HB2 ASP A 820 24.664 4.515 6.539 1.00 0.00 H new ATOM 0 HB3 ASP A 820 23.224 3.516 6.562 1.00 0.00 H new TER 1638 ASP A 820