USER MOD reduce.3.24.130724 H: found=0, std=0, add=836, rem=0, adj=32 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 143:sc= -0.411 USER MOD Set 1.2: A 782 THR OG1 : rot 70:sc= -1.94 USER MOD Set 2.1: A 724 SER OG : rot -2:sc= 1.02 USER MOD Set 2.2: A 810 GLN : amide:sc= -1.41 K(o=-0.4,f=-5.7!) USER MOD Single : A 720 LYS NZ :NH3+ -132:sc= -0.453 (180deg=-2.13!) USER MOD Single : A 722 SER OG : rot -12:sc= 0.631 USER MOD Single : A 726 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 728 HIS : no HD1:sc= -0.238 X(o=-0.24,f=-0.24) USER MOD Single : A 729 HIS : no HD1:sc= -0.267 X(o=-0.27,f=-0.0015) USER MOD Single : A 732 LYS NZ :NH3+ -153:sc= 1.24 (180deg=0.14) USER MOD Single : A 734 CYS SG : rot 180:sc= 0.274 USER MOD Single : A 738 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 740 SER OG : rot 180:sc= -0.0372 USER MOD Single : A 746 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 748 GLN : amide:sc= -0.582 K(o=-0.58,f=-2) USER MOD Single : A 752 THR OG1 : rot 0:sc= -1.14 USER MOD Single : A 754 THR OG1 : rot 78:sc= 0.042 USER MOD Single : A 755 TYR OH : rot 150:sc= 0 USER MOD Single : A 760 THR OG1 : rot -1:sc= 0.659! USER MOD Single : A 762 SER OG : rot 180:sc= 0 USER MOD Single : A 763 SER OG : rot 180:sc= 0 USER MOD Single : A 764 LYS NZ :NH3+ 152:sc= 1.02 (180deg=0.0579) USER MOD Single : A 766 LYS NZ :NH3+ -162:sc= -0.0574 (180deg=-0.344) USER MOD Single : A 767 THR OG1 : rot 180:sc= 0 USER MOD Single : A 771 LYS NZ :NH3+ 151:sc= 1.24 (180deg=0.165) 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 776 ASN : amide:sc= -0.7! C(o=-0.7!,f=-3!) USER MOD Single : A 778 TYR OH : rot 180:sc= 0 USER MOD Single : A 781 LYS NZ :NH3+ 165:sc= -0.017 (180deg=-0.192) USER MOD Single : A 786 THR OG1 : rot 180:sc= 0 USER MOD Single : A 787 THR OG1 : rot 180:sc= -0.41 USER MOD Single : A 791 TYR OH : rot 11:sc= 0.526 USER MOD Single : A 794 SER OG : rot 180:sc= 0 USER MOD Single : A 797 SER OG : rot 3:sc= 1.17 USER MOD Single : A 799 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 801 SER OG : rot -28:sc= 0.0579 USER MOD Single : A 802 THR OG1 : rot -33:sc= 0.435 USER MOD Single : A 804 CYS SG : rot 180:sc= 0 USER MOD Single : A 809 SER OG : rot 180:sc= -0.0148 USER MOD Single : A 814 LYS NZ :NH3+ 147:sc= 1.09 (180deg=-1.07) USER MOD Single : A 816 GLN :FLIP amide:sc= -5.57! C(o=-7.6!,f=-5.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 718 -23.517 0.663 -4.074 1.00 0.00 N ATOM 2 CA ARG A 718 -22.176 0.129 -3.914 1.00 0.00 C ATOM 3 C ARG A 718 -21.191 1.026 -4.627 1.00 0.00 C ATOM 4 O ARG A 718 -21.529 1.674 -5.620 1.00 0.00 O ATOM 5 CB ARG A 718 -22.114 -1.298 -4.475 1.00 0.00 C ATOM 6 CG ARG A 718 -20.986 -2.148 -3.911 1.00 0.00 C ATOM 7 CD ARG A 718 -21.157 -2.391 -2.418 1.00 0.00 C ATOM 8 NE ARG A 718 -22.454 -2.986 -2.094 1.00 0.00 N ATOM 9 CZ ARG A 718 -22.894 -3.186 -0.853 1.00 0.00 C ATOM 10 NH1 ARG A 718 -22.114 -2.919 0.186 1.00 0.00 N ATOM 11 NH2 ARG A 718 -24.112 -3.671 -0.653 1.00 0.00 N ATOM 0 HA ARG A 718 -21.918 0.094 -2.856 1.00 0.00 H new ATOM 0 HB2 ARG A 718 -23.063 -1.796 -4.274 1.00 0.00 H new ATOM 0 HB3 ARG A 718 -22.005 -1.245 -5.558 1.00 0.00 H new ATOM 0 HG2 ARG A 718 -20.954 -3.104 -4.434 1.00 0.00 H new ATOM 0 HG3 ARG A 718 -20.032 -1.653 -4.092 1.00 0.00 H new ATOM 0 HD2 ARG A 718 -20.361 -3.048 -2.066 1.00 0.00 H new ATOM 0 HD3 ARG A 718 -21.050 -1.447 -1.884 1.00 0.00 H new ATOM 0 HE ARG A 718 -23.059 -3.265 -2.867 1.00 0.00 H new ATOM 0 HH11 ARG A 718 -21.172 -2.558 0.037 1.00 0.00 H new ATOM 0 HH12 ARG A 718 -22.457 -3.074 1.134 1.00 0.00 H new ATOM 0 HH21 ARG A 718 -24.711 -3.890 -1.449 1.00 0.00 H new ATOM 0 HH22 ARG A 718 -24.450 -3.825 0.297 1.00 0.00 H new ATOM 25 N VAL A 719 -19.982 1.069 -4.106 1.00 0.00 N ATOM 26 CA VAL A 719 -18.939 1.873 -4.676 1.00 0.00 C ATOM 27 C VAL A 719 -17.891 0.931 -5.202 1.00 0.00 C ATOM 28 O VAL A 719 -17.903 -0.260 -4.889 1.00 0.00 O ATOM 29 CB VAL A 719 -18.270 2.813 -3.638 1.00 0.00 C ATOM 30 CG1 VAL A 719 -17.614 4.005 -4.319 1.00 0.00 C ATOM 31 CG2 VAL A 719 -19.255 3.273 -2.579 1.00 0.00 C ATOM 0 H VAL A 719 -19.702 0.546 -3.276 1.00 0.00 H new ATOM 0 HA VAL A 719 -19.374 2.503 -5.452 1.00 0.00 H new ATOM 0 HB VAL A 719 -17.492 2.237 -3.136 1.00 0.00 H new ATOM 0 HG11 VAL A 719 -17.154 4.646 -3.567 1.00 0.00 H new ATOM 0 HG12 VAL A 719 -16.850 3.653 -5.012 1.00 0.00 H new ATOM 0 HG13 VAL A 719 -18.367 4.571 -4.866 1.00 0.00 H new ATOM 0 HG21 VAL A 719 -18.748 3.929 -1.871 1.00 0.00 H new ATOM 0 HG22 VAL A 719 -20.073 3.814 -3.054 1.00 0.00 H new ATOM 0 HG23 VAL A 719 -19.652 2.406 -2.050 1.00 0.00 H new ATOM 41 N LYS A 720 -17.023 1.440 -6.024 1.00 0.00 N ATOM 42 CA LYS A 720 -15.845 0.698 -6.395 1.00 0.00 C ATOM 43 C LYS A 720 -14.702 1.118 -5.483 1.00 0.00 C ATOM 44 O LYS A 720 -14.043 2.129 -5.726 1.00 0.00 O ATOM 45 CB LYS A 720 -15.475 0.922 -7.861 1.00 0.00 C ATOM 46 CG LYS A 720 -16.583 0.556 -8.833 1.00 0.00 C ATOM 47 CD LYS A 720 -16.203 0.841 -10.282 1.00 0.00 C ATOM 48 CE LYS A 720 -15.099 -0.079 -10.791 1.00 0.00 C ATOM 49 NZ LYS A 720 -13.736 0.414 -10.453 1.00 0.00 N ATOM 0 H LYS A 720 -17.103 2.362 -6.452 1.00 0.00 H new ATOM 0 HA LYS A 720 -16.045 -0.367 -6.279 1.00 0.00 H new ATOM 0 HB2 LYS A 720 -15.210 1.970 -8.004 1.00 0.00 H new ATOM 0 HB3 LYS A 720 -14.588 0.334 -8.097 1.00 0.00 H new ATOM 0 HG2 LYS A 720 -16.823 -0.502 -8.725 1.00 0.00 H new ATOM 0 HG3 LYS A 720 -17.484 1.115 -8.580 1.00 0.00 H new ATOM 0 HD2 LYS A 720 -17.084 0.729 -10.914 1.00 0.00 H new ATOM 0 HD3 LYS A 720 -15.877 1.877 -10.371 1.00 0.00 H new ATOM 0 HE2 LYS A 720 -15.236 -1.073 -10.366 1.00 0.00 H new ATOM 0 HE3 LYS A 720 -15.186 -0.180 -11.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 720 -13.134 0.380 -11.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 720 -13.796 1.394 -10.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 720 -13.323 -0.187 -9.711 1.00 0.00 H new ATOM 63 N PRO A 721 -14.460 0.352 -4.414 1.00 0.00 N ATOM 64 CA PRO A 721 -13.497 0.715 -3.395 1.00 0.00 C ATOM 65 C PRO A 721 -12.092 0.281 -3.784 1.00 0.00 C ATOM 66 O PRO A 721 -11.913 -0.727 -4.469 1.00 0.00 O ATOM 67 CB PRO A 721 -14.006 -0.029 -2.160 1.00 0.00 C ATOM 68 CG PRO A 721 -14.767 -1.211 -2.682 1.00 0.00 C ATOM 69 CD PRO A 721 -15.060 -0.963 -4.145 1.00 0.00 C ATOM 0 HA PRO A 721 -13.419 1.790 -3.236 1.00 0.00 H new ATOM 0 HB2 PRO A 721 -13.178 -0.346 -1.525 1.00 0.00 H new ATOM 0 HB3 PRO A 721 -14.646 0.612 -1.553 1.00 0.00 H new ATOM 0 HG2 PRO A 721 -14.185 -2.125 -2.558 1.00 0.00 H new ATOM 0 HG3 PRO A 721 -15.694 -1.345 -2.124 1.00 0.00 H new ATOM 0 HD2 PRO A 721 -14.623 -1.737 -4.776 1.00 0.00 H new ATOM 0 HD3 PRO A 721 -16.132 -0.960 -4.342 1.00 0.00 H new ATOM 77 N SER A 722 -11.103 1.048 -3.356 1.00 0.00 N ATOM 78 CA SER A 722 -9.725 0.858 -3.791 1.00 0.00 C ATOM 79 C SER A 722 -8.786 1.657 -2.898 1.00 0.00 C ATOM 80 O SER A 722 -9.157 2.041 -1.794 1.00 0.00 O ATOM 81 CB SER A 722 -9.566 1.310 -5.248 1.00 0.00 C ATOM 82 OG SER A 722 -10.395 0.570 -6.126 1.00 0.00 O ATOM 0 H SER A 722 -11.230 1.818 -2.699 1.00 0.00 H new ATOM 0 HA SER A 722 -9.474 -0.200 -3.719 1.00 0.00 H new ATOM 0 HB2 SER A 722 -9.808 2.370 -5.327 1.00 0.00 H new ATOM 0 HB3 SER A 722 -8.525 1.197 -5.551 1.00 0.00 H new ATOM 0 HG SER A 722 -10.763 -0.205 -5.653 1.00 0.00 H new ATOM 88 N ALA A 723 -7.567 1.896 -3.361 1.00 0.00 N ATOM 89 CA ALA A 723 -6.662 2.763 -2.646 1.00 0.00 C ATOM 90 C ALA A 723 -5.735 3.475 -3.617 1.00 0.00 C ATOM 91 O ALA A 723 -5.272 2.876 -4.580 1.00 0.00 O ATOM 92 CB ALA A 723 -5.874 1.963 -1.636 1.00 0.00 C ATOM 0 H ALA A 723 -7.191 1.501 -4.223 1.00 0.00 H new ATOM 0 HA ALA A 723 -7.239 3.520 -2.114 1.00 0.00 H new ATOM 0 HB1 ALA A 723 -5.193 2.624 -1.100 1.00 0.00 H new ATOM 0 HB2 ALA A 723 -6.558 1.496 -0.928 1.00 0.00 H new ATOM 0 HB3 ALA A 723 -5.301 1.191 -2.150 1.00 0.00 H new ATOM 98 N SER A 724 -5.457 4.743 -3.363 1.00 0.00 N ATOM 99 CA SER A 724 -4.623 5.527 -4.256 1.00 0.00 C ATOM 100 C SER A 724 -3.495 6.152 -3.462 1.00 0.00 C ATOM 101 O SER A 724 -3.715 7.097 -2.697 1.00 0.00 O ATOM 102 CB SER A 724 -5.447 6.623 -4.933 1.00 0.00 C ATOM 103 OG SER A 724 -6.592 6.087 -5.569 1.00 0.00 O ATOM 0 H SER A 724 -5.797 5.250 -2.546 1.00 0.00 H new ATOM 0 HA SER A 724 -4.215 4.874 -5.028 1.00 0.00 H new ATOM 0 HB2 SER A 724 -5.752 7.362 -4.192 1.00 0.00 H new ATOM 0 HB3 SER A 724 -4.831 7.143 -5.666 1.00 0.00 H new ATOM 0 HG SER A 724 -6.601 5.113 -5.461 1.00 0.00 H new ATOM 109 N LEU A 725 -2.297 5.613 -3.602 1.00 0.00 N ATOM 110 CA LEU A 725 -1.184 6.094 -2.835 1.00 0.00 C ATOM 111 C LEU A 725 -0.874 7.536 -3.181 1.00 0.00 C ATOM 112 O LEU A 725 -0.869 7.926 -4.344 1.00 0.00 O ATOM 113 CB LEU A 725 0.031 5.232 -3.073 1.00 0.00 C ATOM 114 CG LEU A 725 -0.214 3.726 -3.032 1.00 0.00 C ATOM 115 CD1 LEU A 725 1.102 3.018 -3.086 1.00 0.00 C ATOM 116 CD2 LEU A 725 -0.965 3.323 -1.783 1.00 0.00 C ATOM 0 H LEU A 725 -2.080 4.846 -4.239 1.00 0.00 H new ATOM 0 HA LEU A 725 -1.452 6.042 -1.780 1.00 0.00 H new ATOM 0 HB2 LEU A 725 0.452 5.488 -4.045 1.00 0.00 H new ATOM 0 HB3 LEU A 725 0.784 5.481 -2.325 1.00 0.00 H new ATOM 0 HG LEU A 725 -0.826 3.449 -3.890 1.00 0.00 H new ATOM 0 HD11 LEU A 725 0.937 1.941 -3.057 1.00 0.00 H new ATOM 0 HD12 LEU A 725 1.619 3.281 -4.009 1.00 0.00 H new ATOM 0 HD13 LEU A 725 1.710 3.315 -2.232 1.00 0.00 H new ATOM 0 HD21 LEU A 725 -1.123 2.244 -1.785 1.00 0.00 H new ATOM 0 HD22 LEU A 725 -0.385 3.603 -0.904 1.00 0.00 H new ATOM 0 HD23 LEU A 725 -1.929 3.831 -1.758 1.00 0.00 H new ATOM 128 N LYS A 726 -0.606 8.307 -2.154 1.00 0.00 N ATOM 129 CA LYS A 726 -0.385 9.736 -2.299 1.00 0.00 C ATOM 130 C LYS A 726 1.086 10.008 -2.544 1.00 0.00 C ATOM 131 O LYS A 726 1.462 11.085 -3.007 1.00 0.00 O ATOM 132 CB LYS A 726 -0.858 10.484 -1.057 1.00 0.00 C ATOM 133 CG LYS A 726 -2.281 10.146 -0.655 1.00 0.00 C ATOM 134 CD LYS A 726 -2.855 11.173 0.306 1.00 0.00 C ATOM 135 CE LYS A 726 -3.158 12.480 -0.411 1.00 0.00 C ATOM 136 NZ LYS A 726 -3.598 13.544 0.528 1.00 0.00 N ATOM 0 H LYS A 726 -0.534 7.968 -1.195 1.00 0.00 H new ATOM 0 HA LYS A 726 -0.962 10.092 -3.153 1.00 0.00 H new ATOM 0 HB2 LYS A 726 -0.190 10.254 -0.227 1.00 0.00 H new ATOM 0 HB3 LYS A 726 -0.785 11.556 -1.238 1.00 0.00 H new ATOM 0 HG2 LYS A 726 -2.907 10.092 -1.546 1.00 0.00 H new ATOM 0 HG3 LYS A 726 -2.303 9.161 -0.190 1.00 0.00 H new ATOM 0 HD2 LYS A 726 -3.766 10.783 0.759 1.00 0.00 H new ATOM 0 HD3 LYS A 726 -2.148 11.354 1.116 1.00 0.00 H new ATOM 0 HE2 LYS A 726 -2.269 12.814 -0.946 1.00 0.00 H new ATOM 0 HE3 LYS A 726 -3.934 12.312 -1.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 726 -3.794 14.417 -0.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 726 -4.461 13.237 1.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 726 -2.847 13.724 1.225 1.00 0.00 H new ATOM 150 N LEU A 727 1.916 9.027 -2.213 1.00 0.00 N ATOM 151 CA LEU A 727 3.338 9.111 -2.489 1.00 0.00 C ATOM 152 C LEU A 727 3.562 9.054 -3.998 1.00 0.00 C ATOM 153 O LEU A 727 3.362 8.010 -4.623 1.00 0.00 O ATOM 154 CB LEU A 727 4.090 7.973 -1.792 1.00 0.00 C ATOM 155 CG LEU A 727 5.592 7.911 -2.075 1.00 0.00 C ATOM 156 CD1 LEU A 727 6.235 9.263 -1.824 1.00 0.00 C ATOM 157 CD2 LEU A 727 6.251 6.839 -1.223 1.00 0.00 C ATOM 0 H LEU A 727 1.625 8.164 -1.753 1.00 0.00 H new ATOM 0 HA LEU A 727 3.723 10.055 -2.103 1.00 0.00 H new ATOM 0 HB2 LEU A 727 3.944 8.068 -0.716 1.00 0.00 H new ATOM 0 HB3 LEU A 727 3.641 7.026 -2.092 1.00 0.00 H new ATOM 0 HG LEU A 727 5.736 7.651 -3.124 1.00 0.00 H new ATOM 0 HD11 LEU A 727 7.304 9.202 -2.030 1.00 0.00 H new ATOM 0 HD12 LEU A 727 5.782 10.008 -2.477 1.00 0.00 H new ATOM 0 HD13 LEU A 727 6.082 9.551 -0.784 1.00 0.00 H new ATOM 0 HD21 LEU A 727 7.319 6.809 -1.438 1.00 0.00 H new ATOM 0 HD22 LEU A 727 6.099 7.068 -0.168 1.00 0.00 H new ATOM 0 HD23 LEU A 727 5.808 5.870 -1.451 1.00 0.00 H new ATOM 169 N HIS A 728 3.965 10.173 -4.582 1.00 0.00 N ATOM 170 CA HIS A 728 4.071 10.271 -6.032 1.00 0.00 C ATOM 171 C HIS A 728 5.529 10.367 -6.483 1.00 0.00 C ATOM 172 O HIS A 728 5.833 10.887 -7.558 1.00 0.00 O ATOM 173 CB HIS A 728 3.266 11.480 -6.525 1.00 0.00 C ATOM 174 CG HIS A 728 3.032 11.501 -8.007 1.00 0.00 C ATOM 175 ND1 HIS A 728 3.386 12.563 -8.810 1.00 0.00 N ATOM 176 CD2 HIS A 728 2.464 10.586 -8.826 1.00 0.00 C ATOM 177 CE1 HIS A 728 3.045 12.301 -10.058 1.00 0.00 C ATOM 178 NE2 HIS A 728 2.485 11.108 -10.095 1.00 0.00 N ATOM 0 H HIS A 728 4.223 11.022 -4.078 1.00 0.00 H new ATOM 0 HA HIS A 728 3.658 9.363 -6.471 1.00 0.00 H new ATOM 0 HB2 HIS A 728 2.302 11.492 -6.016 1.00 0.00 H new ATOM 0 HB3 HIS A 728 3.789 12.392 -6.238 1.00 0.00 H new ATOM 0 HD2 HIS A 728 2.068 9.624 -8.535 1.00 0.00 H new ATOM 0 HE1 HIS A 728 3.199 12.953 -10.905 1.00 0.00 H new ATOM 0 HE2 HIS A 728 2.126 10.648 -10.931 1.00 0.00 H new ATOM 187 N HIS A 729 6.429 9.849 -5.665 1.00 0.00 N ATOM 188 CA HIS A 729 7.852 9.864 -5.981 1.00 0.00 C ATOM 189 C HIS A 729 8.562 8.746 -5.241 1.00 0.00 C ATOM 190 O HIS A 729 8.029 8.204 -4.276 1.00 0.00 O ATOM 191 CB HIS A 729 8.491 11.225 -5.656 1.00 0.00 C ATOM 192 CG HIS A 729 8.202 11.743 -4.281 1.00 0.00 C ATOM 193 ND1 HIS A 729 9.158 11.868 -3.297 1.00 0.00 N ATOM 194 CD2 HIS A 729 7.051 12.192 -3.743 1.00 0.00 C ATOM 195 CE1 HIS A 729 8.602 12.373 -2.210 1.00 0.00 C ATOM 196 NE2 HIS A 729 7.321 12.580 -2.456 1.00 0.00 N ATOM 0 H HIS A 729 6.201 9.410 -4.773 1.00 0.00 H new ATOM 0 HA HIS A 729 7.961 9.703 -7.054 1.00 0.00 H new ATOM 0 HB2 HIS A 729 9.571 11.142 -5.778 1.00 0.00 H new ATOM 0 HB3 HIS A 729 8.143 11.957 -6.385 1.00 0.00 H new ATOM 0 HD2 HIS A 729 6.091 12.238 -4.236 1.00 0.00 H new ATOM 0 HE1 HIS A 729 9.109 12.581 -1.279 1.00 0.00 H new ATOM 0 HE2 HIS A 729 6.644 12.965 -1.797 1.00 0.00 H new ATOM 205 N ASP A 730 9.757 8.408 -5.701 1.00 0.00 N ATOM 206 CA ASP A 730 10.512 7.302 -5.133 1.00 0.00 C ATOM 207 C ASP A 730 11.054 7.652 -3.764 1.00 0.00 C ATOM 208 O ASP A 730 11.646 8.709 -3.552 1.00 0.00 O ATOM 209 CB ASP A 730 11.635 6.881 -6.079 1.00 0.00 C ATOM 210 CG ASP A 730 12.595 5.874 -5.479 1.00 0.00 C ATOM 211 OD1 ASP A 730 12.139 4.781 -5.087 1.00 0.00 O ATOM 212 OD2 ASP A 730 13.819 6.144 -5.463 1.00 0.00 O ATOM 0 H ASP A 730 10.226 8.887 -6.470 1.00 0.00 H new ATOM 0 HA ASP A 730 9.834 6.457 -5.009 1.00 0.00 H new ATOM 0 HB2 ASP A 730 11.197 6.457 -6.982 1.00 0.00 H new ATOM 0 HB3 ASP A 730 12.194 7.767 -6.381 1.00 0.00 H new ATOM 217 N LEU A 731 10.827 6.742 -2.850 1.00 0.00 N ATOM 218 CA LEU A 731 11.160 6.926 -1.450 1.00 0.00 C ATOM 219 C LEU A 731 12.598 6.502 -1.179 1.00 0.00 C ATOM 220 O LEU A 731 12.924 5.322 -1.222 1.00 0.00 O ATOM 221 CB LEU A 731 10.168 6.134 -0.606 1.00 0.00 C ATOM 222 CG LEU A 731 10.349 6.249 0.890 1.00 0.00 C ATOM 223 CD1 LEU A 731 10.422 7.707 1.318 1.00 0.00 C ATOM 224 CD2 LEU A 731 9.217 5.543 1.606 1.00 0.00 C ATOM 0 H LEU A 731 10.400 5.839 -3.055 1.00 0.00 H new ATOM 0 HA LEU A 731 11.087 7.981 -1.184 1.00 0.00 H new ATOM 0 HB2 LEU A 731 9.160 6.462 -0.859 1.00 0.00 H new ATOM 0 HB3 LEU A 731 10.240 5.082 -0.883 1.00 0.00 H new ATOM 0 HG LEU A 731 11.290 5.771 1.161 1.00 0.00 H new ATOM 0 HD11 LEU A 731 10.552 7.763 2.399 1.00 0.00 H new ATOM 0 HD12 LEU A 731 11.266 8.189 0.825 1.00 0.00 H new ATOM 0 HD13 LEU A 731 9.500 8.215 1.037 1.00 0.00 H new ATOM 0 HD21 LEU A 731 9.357 5.632 2.683 1.00 0.00 H new ATOM 0 HD22 LEU A 731 8.268 5.999 1.324 1.00 0.00 H new ATOM 0 HD23 LEU A 731 9.211 4.489 1.326 1.00 0.00 H new ATOM 236 N LYS A 732 13.451 7.482 -0.899 1.00 0.00 N ATOM 237 CA LYS A 732 14.886 7.246 -0.774 1.00 0.00 C ATOM 238 C LYS A 732 15.259 6.823 0.644 1.00 0.00 C ATOM 239 O LYS A 732 15.242 7.640 1.566 1.00 0.00 O ATOM 240 CB LYS A 732 15.663 8.505 -1.147 1.00 0.00 C ATOM 241 CG LYS A 732 15.165 9.177 -2.416 1.00 0.00 C ATOM 242 CD LYS A 732 15.153 8.240 -3.614 1.00 0.00 C ATOM 243 CE LYS A 732 16.523 7.654 -3.903 1.00 0.00 C ATOM 244 NZ LYS A 732 16.492 6.766 -5.094 1.00 0.00 N ATOM 0 H LYS A 732 13.172 8.452 -0.754 1.00 0.00 H new ATOM 0 HA LYS A 732 15.147 6.437 -1.457 1.00 0.00 H new ATOM 0 HB2 LYS A 732 15.603 9.216 -0.323 1.00 0.00 H new ATOM 0 HB3 LYS A 732 16.715 8.249 -1.271 1.00 0.00 H new ATOM 0 HG2 LYS A 732 14.158 9.558 -2.248 1.00 0.00 H new ATOM 0 HG3 LYS A 732 15.798 10.036 -2.639 1.00 0.00 H new ATOM 0 HD2 LYS A 732 14.446 7.431 -3.432 1.00 0.00 H new ATOM 0 HD3 LYS A 732 14.800 8.781 -4.492 1.00 0.00 H new ATOM 0 HE2 LYS A 732 17.238 8.460 -4.067 1.00 0.00 H new ATOM 0 HE3 LYS A 732 16.870 7.091 -3.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 732 17.245 6.053 -5.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 732 15.569 6.290 -5.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 732 16.640 7.333 -5.953 1.00 0.00 H new ATOM 258 N LEU A 733 15.591 5.554 0.821 1.00 0.00 N ATOM 259 CA LEU A 733 15.951 5.036 2.134 1.00 0.00 C ATOM 260 C LEU A 733 17.373 4.491 2.137 1.00 0.00 C ATOM 261 O LEU A 733 17.955 4.237 1.080 1.00 0.00 O ATOM 262 CB LEU A 733 15.006 3.915 2.552 1.00 0.00 C ATOM 263 CG LEU A 733 13.529 4.175 2.314 1.00 0.00 C ATOM 264 CD1 LEU A 733 12.723 3.035 2.886 1.00 0.00 C ATOM 265 CD2 LEU A 733 13.090 5.499 2.923 1.00 0.00 C ATOM 0 H LEU A 733 15.619 4.862 0.072 1.00 0.00 H new ATOM 0 HA LEU A 733 15.876 5.865 2.837 1.00 0.00 H new ATOM 0 HB2 LEU A 733 15.287 3.009 2.016 1.00 0.00 H new ATOM 0 HB3 LEU A 733 15.155 3.716 3.613 1.00 0.00 H new ATOM 0 HG LEU A 733 13.357 4.240 1.240 1.00 0.00 H new ATOM 0 HD11 LEU A 733 11.662 3.219 2.717 1.00 0.00 H new ATOM 0 HD12 LEU A 733 13.012 2.104 2.398 1.00 0.00 H new ATOM 0 HD13 LEU A 733 12.911 2.957 3.957 1.00 0.00 H new ATOM 0 HD21 LEU A 733 12.028 5.652 2.733 1.00 0.00 H new ATOM 0 HD22 LEU A 733 13.268 5.482 3.998 1.00 0.00 H new ATOM 0 HD23 LEU A 733 13.660 6.313 2.474 1.00 0.00 H new ATOM 277 N CYS A 734 17.916 4.304 3.330 1.00 0.00 N ATOM 278 CA CYS A 734 19.214 3.675 3.499 1.00 0.00 C ATOM 279 C CYS A 734 19.036 2.380 4.283 1.00 0.00 C ATOM 280 O CYS A 734 17.909 1.968 4.556 1.00 0.00 O ATOM 281 CB CYS A 734 20.181 4.623 4.215 1.00 0.00 C ATOM 282 SG CYS A 734 21.916 4.113 4.157 1.00 0.00 S ATOM 0 H CYS A 734 17.471 4.583 4.204 1.00 0.00 H new ATOM 0 HA CYS A 734 19.642 3.447 2.523 1.00 0.00 H new ATOM 0 HB2 CYS A 734 20.092 5.615 3.771 1.00 0.00 H new ATOM 0 HB3 CYS A 734 19.877 4.712 5.258 1.00 0.00 H new ATOM 0 HG CYS A 734 22.646 4.984 4.789 1.00 0.00 H new ATOM 288 N LEU A 735 20.129 1.738 4.640 1.00 0.00 N ATOM 289 CA LEU A 735 20.058 0.425 5.245 1.00 0.00 C ATOM 290 C LEU A 735 19.561 0.492 6.669 1.00 0.00 C ATOM 291 O LEU A 735 19.997 1.328 7.464 1.00 0.00 O ATOM 292 CB LEU A 735 21.404 -0.266 5.172 1.00 0.00 C ATOM 293 CG LEU A 735 21.550 -1.525 6.025 1.00 0.00 C ATOM 294 CD1 LEU A 735 20.777 -2.670 5.404 1.00 0.00 C ATOM 295 CD2 LEU A 735 23.012 -1.894 6.197 1.00 0.00 C ATOM 0 H LEU A 735 21.074 2.103 4.522 1.00 0.00 H new ATOM 0 HA LEU A 735 19.336 -0.163 4.679 1.00 0.00 H new ATOM 0 HB2 LEU A 735 21.601 -0.529 4.133 1.00 0.00 H new ATOM 0 HB3 LEU A 735 22.174 0.445 5.472 1.00 0.00 H new ATOM 0 HG LEU A 735 21.137 -1.323 7.013 1.00 0.00 H new ATOM 0 HD11 LEU A 735 20.889 -3.562 6.021 1.00 0.00 H new ATOM 0 HD12 LEU A 735 19.722 -2.404 5.339 1.00 0.00 H new ATOM 0 HD13 LEU A 735 21.163 -2.870 4.404 1.00 0.00 H new ATOM 0 HD21 LEU A 735 23.091 -2.793 6.808 1.00 0.00 H new ATOM 0 HD22 LEU A 735 23.458 -2.079 5.220 1.00 0.00 H new ATOM 0 HD23 LEU A 735 23.539 -1.075 6.687 1.00 0.00 H new ATOM 307 N GLY A 736 18.631 -0.394 6.970 1.00 0.00 N ATOM 308 CA GLY A 736 18.036 -0.424 8.283 1.00 0.00 C ATOM 309 C GLY A 736 16.946 0.611 8.418 1.00 0.00 C ATOM 310 O GLY A 736 16.472 0.883 9.520 1.00 0.00 O ATOM 0 H GLY A 736 18.275 -1.098 6.323 1.00 0.00 H new ATOM 0 HA2 GLY A 736 17.625 -1.415 8.475 1.00 0.00 H new ATOM 0 HA3 GLY A 736 18.804 -0.246 9.036 1.00 0.00 H new ATOM 314 N ASP A 737 16.573 1.212 7.297 1.00 0.00 N ATOM 315 CA ASP A 737 15.466 2.171 7.284 1.00 0.00 C ATOM 316 C ASP A 737 14.132 1.473 7.062 1.00 0.00 C ATOM 317 O ASP A 737 14.062 0.441 6.398 1.00 0.00 O ATOM 318 CB ASP A 737 15.656 3.220 6.185 1.00 0.00 C ATOM 319 CG ASP A 737 16.256 4.513 6.692 1.00 0.00 C ATOM 320 OD1 ASP A 737 15.589 5.214 7.485 1.00 0.00 O ATOM 321 OD2 ASP A 737 17.392 4.846 6.290 1.00 0.00 O ATOM 0 H ASP A 737 17.013 1.058 6.390 1.00 0.00 H new ATOM 0 HA ASP A 737 15.462 2.659 8.259 1.00 0.00 H new ATOM 0 HB2 ASP A 737 16.299 2.809 5.407 1.00 0.00 H new ATOM 0 HB3 ASP A 737 14.692 3.431 5.723 1.00 0.00 H new ATOM 326 N HIS A 738 13.072 2.045 7.619 1.00 0.00 N ATOM 327 CA HIS A 738 11.721 1.604 7.319 1.00 0.00 C ATOM 328 C HIS A 738 11.065 2.693 6.495 1.00 0.00 C ATOM 329 O HIS A 738 11.591 3.803 6.409 1.00 0.00 O ATOM 330 CB HIS A 738 10.911 1.318 8.601 1.00 0.00 C ATOM 331 CG HIS A 738 10.338 2.530 9.284 1.00 0.00 C ATOM 332 ND1 HIS A 738 11.054 3.310 10.161 1.00 0.00 N ATOM 333 CD2 HIS A 738 9.099 3.083 9.221 1.00 0.00 C ATOM 334 CE1 HIS A 738 10.288 4.285 10.609 1.00 0.00 C ATOM 335 NE2 HIS A 738 9.096 4.172 10.054 1.00 0.00 N ATOM 0 H HIS A 738 13.125 2.818 8.283 1.00 0.00 H new ATOM 0 HA HIS A 738 11.752 0.665 6.766 1.00 0.00 H new ATOM 0 HB2 HIS A 738 10.093 0.642 8.351 1.00 0.00 H new ATOM 0 HB3 HIS A 738 11.554 0.793 9.308 1.00 0.00 H new ATOM 0 HD2 HIS A 738 8.270 2.730 8.625 1.00 0.00 H new ATOM 0 HE1 HIS A 738 10.586 5.048 11.312 1.00 0.00 H new ATOM 0 HE2 HIS A 738 8.303 4.793 10.218 1.00 0.00 H new ATOM 344 N SER A 739 9.934 2.402 5.897 1.00 0.00 N ATOM 345 CA SER A 739 9.338 3.352 4.979 1.00 0.00 C ATOM 346 C SER A 739 7.937 3.758 5.418 1.00 0.00 C ATOM 347 O SER A 739 7.324 3.125 6.279 1.00 0.00 O ATOM 348 CB SER A 739 9.311 2.766 3.570 1.00 0.00 C ATOM 349 OG SER A 739 10.065 1.565 3.506 1.00 0.00 O ATOM 0 H SER A 739 9.414 1.534 6.023 1.00 0.00 H new ATOM 0 HA SER A 739 9.951 4.253 4.981 1.00 0.00 H new ATOM 0 HB2 SER A 739 8.281 2.569 3.273 1.00 0.00 H new ATOM 0 HB3 SER A 739 9.714 3.491 2.863 1.00 0.00 H new ATOM 0 HG SER A 739 9.619 0.931 2.906 1.00 0.00 H new ATOM 355 N SER A 740 7.457 4.836 4.831 1.00 0.00 N ATOM 356 CA SER A 740 6.129 5.345 5.093 1.00 0.00 C ATOM 357 C SER A 740 5.548 5.894 3.802 1.00 0.00 C ATOM 358 O SER A 740 6.185 6.693 3.116 1.00 0.00 O ATOM 359 CB SER A 740 6.165 6.436 6.166 1.00 0.00 C ATOM 360 OG SER A 740 6.664 5.934 7.396 1.00 0.00 O ATOM 0 H SER A 740 7.984 5.387 4.153 1.00 0.00 H new ATOM 0 HA SER A 740 5.502 4.534 5.464 1.00 0.00 H new ATOM 0 HB2 SER A 740 6.791 7.262 5.827 1.00 0.00 H new ATOM 0 HB3 SER A 740 5.162 6.836 6.314 1.00 0.00 H new ATOM 0 HG SER A 740 6.677 6.653 8.062 1.00 0.00 H new ATOM 366 N VAL A 741 4.359 5.453 3.466 1.00 0.00 N ATOM 367 CA VAL A 741 3.715 5.864 2.236 1.00 0.00 C ATOM 368 C VAL A 741 2.239 6.144 2.480 1.00 0.00 C ATOM 369 O VAL A 741 1.470 5.254 2.838 1.00 0.00 O ATOM 370 CB VAL A 741 3.909 4.810 1.121 1.00 0.00 C ATOM 371 CG1 VAL A 741 3.814 3.403 1.683 1.00 0.00 C ATOM 372 CG2 VAL A 741 2.898 5.005 -0.003 1.00 0.00 C ATOM 0 H VAL A 741 3.812 4.804 4.031 1.00 0.00 H new ATOM 0 HA VAL A 741 4.186 6.786 1.895 1.00 0.00 H new ATOM 0 HB VAL A 741 4.907 4.948 0.706 1.00 0.00 H new ATOM 0 HG11 VAL A 741 3.954 2.680 0.879 1.00 0.00 H new ATOM 0 HG12 VAL A 741 4.587 3.260 2.438 1.00 0.00 H new ATOM 0 HG13 VAL A 741 2.833 3.257 2.135 1.00 0.00 H new ATOM 0 HG21 VAL A 741 3.059 4.250 -0.772 1.00 0.00 H new ATOM 0 HG22 VAL A 741 1.888 4.908 0.395 1.00 0.00 H new ATOM 0 HG23 VAL A 741 3.023 5.997 -0.437 1.00 0.00 H new ATOM 382 N PRO A 742 1.837 7.403 2.315 1.00 0.00 N ATOM 383 CA PRO A 742 0.463 7.812 2.521 1.00 0.00 C ATOM 384 C PRO A 742 -0.419 7.400 1.354 1.00 0.00 C ATOM 385 O PRO A 742 -0.018 7.508 0.202 1.00 0.00 O ATOM 386 CB PRO A 742 0.533 9.338 2.648 1.00 0.00 C ATOM 387 CG PRO A 742 1.932 9.744 2.285 1.00 0.00 C ATOM 388 CD PRO A 742 2.692 8.513 1.889 1.00 0.00 C ATOM 0 HA PRO A 742 0.023 7.342 3.401 1.00 0.00 H new ATOM 0 HB2 PRO A 742 -0.191 9.814 1.986 1.00 0.00 H new ATOM 0 HB3 PRO A 742 0.291 9.652 3.663 1.00 0.00 H new ATOM 0 HG2 PRO A 742 1.918 10.462 1.465 1.00 0.00 H new ATOM 0 HG3 PRO A 742 2.416 10.234 3.130 1.00 0.00 H new ATOM 0 HD2 PRO A 742 2.872 8.486 0.814 1.00 0.00 H new ATOM 0 HD3 PRO A 742 3.666 8.474 2.376 1.00 0.00 H new ATOM 396 N VAL A 743 -1.594 6.880 1.661 1.00 0.00 N ATOM 397 CA VAL A 743 -2.559 6.516 0.639 1.00 0.00 C ATOM 398 C VAL A 743 -3.952 7.055 0.953 1.00 0.00 C ATOM 399 O VAL A 743 -4.542 6.735 1.981 1.00 0.00 O ATOM 400 CB VAL A 743 -2.648 4.993 0.445 1.00 0.00 C ATOM 401 CG1 VAL A 743 -2.680 4.277 1.771 1.00 0.00 C ATOM 402 CG2 VAL A 743 -3.854 4.631 -0.400 1.00 0.00 C ATOM 0 H VAL A 743 -1.904 6.699 2.616 1.00 0.00 H new ATOM 0 HA VAL A 743 -2.199 6.971 -0.284 1.00 0.00 H new ATOM 0 HB VAL A 743 -1.753 4.667 -0.084 1.00 0.00 H new ATOM 0 HG11 VAL A 743 -2.743 3.202 1.603 1.00 0.00 H new ATOM 0 HG12 VAL A 743 -1.772 4.504 2.329 1.00 0.00 H new ATOM 0 HG13 VAL A 743 -3.548 4.606 2.342 1.00 0.00 H new ATOM 0 HG21 VAL A 743 -3.899 3.549 -0.525 1.00 0.00 H new ATOM 0 HG22 VAL A 743 -4.762 4.977 0.094 1.00 0.00 H new ATOM 0 HG23 VAL A 743 -3.769 5.106 -1.377 1.00 0.00 H new ATOM 412 N ALA A 744 -4.464 7.884 0.069 1.00 0.00 N ATOM 413 CA ALA A 744 -5.855 8.280 0.120 1.00 0.00 C ATOM 414 C ALA A 744 -6.674 7.217 -0.579 1.00 0.00 C ATOM 415 O ALA A 744 -6.583 7.020 -1.791 1.00 0.00 O ATOM 416 CB ALA A 744 -6.063 9.647 -0.500 1.00 0.00 C ATOM 0 H ALA A 744 -3.934 8.299 -0.698 1.00 0.00 H new ATOM 0 HA ALA A 744 -6.179 8.365 1.157 1.00 0.00 H new ATOM 0 HB1 ALA A 744 -7.118 9.914 -0.446 1.00 0.00 H new ATOM 0 HB2 ALA A 744 -5.473 10.386 0.042 1.00 0.00 H new ATOM 0 HB3 ALA A 744 -5.748 9.625 -1.543 1.00 0.00 H new ATOM 422 N LEU A 745 -7.453 6.523 0.209 1.00 0.00 N ATOM 423 CA LEU A 745 -8.080 5.298 -0.218 1.00 0.00 C ATOM 424 C LEU A 745 -9.477 5.561 -0.747 1.00 0.00 C ATOM 425 O LEU A 745 -10.119 6.544 -0.378 1.00 0.00 O ATOM 426 CB LEU A 745 -8.109 4.341 0.966 1.00 0.00 C ATOM 427 CG LEU A 745 -6.862 4.420 1.839 1.00 0.00 C ATOM 428 CD1 LEU A 745 -7.234 4.661 3.278 1.00 0.00 C ATOM 429 CD2 LEU A 745 -6.035 3.159 1.712 1.00 0.00 C ATOM 0 H LEU A 745 -7.672 6.792 1.168 1.00 0.00 H new ATOM 0 HA LEU A 745 -7.511 4.853 -1.035 1.00 0.00 H new ATOM 0 HB2 LEU A 745 -8.985 4.557 1.577 1.00 0.00 H new ATOM 0 HB3 LEU A 745 -8.221 3.322 0.597 1.00 0.00 H new ATOM 0 HG LEU A 745 -6.261 5.260 1.492 1.00 0.00 H new ATOM 0 HD11 LEU A 745 -6.329 4.714 3.884 1.00 0.00 H new ATOM 0 HD12 LEU A 745 -7.781 5.600 3.360 1.00 0.00 H new ATOM 0 HD13 LEU A 745 -7.861 3.844 3.633 1.00 0.00 H new ATOM 0 HD21 LEU A 745 -5.150 3.239 2.344 1.00 0.00 H new ATOM 0 HD22 LEU A 745 -6.629 2.301 2.026 1.00 0.00 H new ATOM 0 HD23 LEU A 745 -5.729 3.028 0.674 1.00 0.00 H new ATOM 441 N LYS A 746 -9.934 4.676 -1.608 1.00 0.00 N ATOM 442 CA LYS A 746 -11.229 4.805 -2.230 1.00 0.00 C ATOM 443 C LYS A 746 -12.197 3.790 -1.641 1.00 0.00 C ATOM 444 O LYS A 746 -11.796 2.705 -1.231 1.00 0.00 O ATOM 445 CB LYS A 746 -11.103 4.627 -3.723 1.00 0.00 C ATOM 446 CG LYS A 746 -12.428 4.720 -4.458 1.00 0.00 C ATOM 447 CD LYS A 746 -12.241 4.914 -5.949 1.00 0.00 C ATOM 448 CE LYS A 746 -11.686 6.293 -6.280 1.00 0.00 C ATOM 449 NZ LYS A 746 -11.645 6.541 -7.748 1.00 0.00 N ATOM 0 H LYS A 746 -9.415 3.846 -1.895 1.00 0.00 H new ATOM 0 HA LYS A 746 -11.622 5.803 -2.035 1.00 0.00 H new ATOM 0 HB2 LYS A 746 -10.425 5.385 -4.115 1.00 0.00 H new ATOM 0 HB3 LYS A 746 -10.650 3.657 -3.928 1.00 0.00 H new ATOM 0 HG2 LYS A 746 -13.005 3.812 -4.281 1.00 0.00 H new ATOM 0 HG3 LYS A 746 -13.008 5.550 -4.055 1.00 0.00 H new ATOM 0 HD2 LYS A 746 -11.565 4.150 -6.332 1.00 0.00 H new ATOM 0 HD3 LYS A 746 -13.197 4.777 -6.455 1.00 0.00 H new ATOM 0 HE2 LYS A 746 -12.300 7.055 -5.801 1.00 0.00 H new ATOM 0 HE3 LYS A 746 -10.681 6.388 -5.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 746 -11.261 7.490 -7.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 746 -11.038 5.829 -8.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 746 -12.607 6.477 -8.138 1.00 0.00 H new ATOM 463 N GLY A 747 -13.465 4.141 -1.615 1.00 0.00 N ATOM 464 CA GLY A 747 -14.454 3.295 -0.975 1.00 0.00 C ATOM 465 C GLY A 747 -14.718 3.753 0.437 1.00 0.00 C ATOM 466 O GLY A 747 -13.822 3.747 1.275 1.00 0.00 O ATOM 0 H GLY A 747 -13.835 4.998 -2.025 1.00 0.00 H new ATOM 0 HA2 GLY A 747 -15.381 3.315 -1.548 1.00 0.00 H new ATOM 0 HA3 GLY A 747 -14.106 2.262 -0.968 1.00 0.00 H new ATOM 470 N GLN A 748 -15.946 4.134 0.708 1.00 0.00 N ATOM 471 CA GLN A 748 -16.261 4.800 1.967 1.00 0.00 C ATOM 472 C GLN A 748 -16.865 3.847 2.982 1.00 0.00 C ATOM 473 O GLN A 748 -17.902 3.222 2.735 1.00 0.00 O ATOM 474 CB GLN A 748 -17.195 5.990 1.750 1.00 0.00 C ATOM 475 CG GLN A 748 -16.570 7.143 0.973 1.00 0.00 C ATOM 476 CD GLN A 748 -16.395 6.847 -0.505 1.00 0.00 C ATOM 477 OE1 GLN A 748 -17.184 6.113 -1.105 1.00 0.00 O ATOM 478 NE2 GLN A 748 -15.349 7.398 -1.094 1.00 0.00 N ATOM 0 H GLN A 748 -16.742 3.999 0.084 1.00 0.00 H new ATOM 0 HA GLN A 748 -15.315 5.165 2.368 1.00 0.00 H new ATOM 0 HB2 GLN A 748 -18.083 5.648 1.219 1.00 0.00 H new ATOM 0 HB3 GLN A 748 -17.527 6.359 2.721 1.00 0.00 H new ATOM 0 HG2 GLN A 748 -17.194 8.029 1.087 1.00 0.00 H new ATOM 0 HG3 GLN A 748 -15.598 7.379 1.406 1.00 0.00 H new ATOM 0 HE21 GLN A 748 -14.721 7.999 -0.560 1.00 0.00 H new ATOM 0 HE22 GLN A 748 -15.169 7.222 -2.083 1.00 0.00 H new ATOM 487 N GLY A 749 -16.207 3.760 4.129 1.00 0.00 N ATOM 488 CA GLY A 749 -16.641 2.883 5.191 1.00 0.00 C ATOM 489 C GLY A 749 -15.626 1.813 5.468 1.00 0.00 C ATOM 490 O GLY A 749 -14.532 1.865 4.934 1.00 0.00 O ATOM 0 H GLY A 749 -15.364 4.294 4.343 1.00 0.00 H new ATOM 0 HA2 GLY A 749 -16.815 3.464 6.096 1.00 0.00 H new ATOM 0 HA3 GLY A 749 -17.591 2.423 4.920 1.00 0.00 H new ATOM 494 N PRO A 750 -15.976 0.824 6.291 1.00 0.00 N ATOM 495 CA PRO A 750 -15.072 -0.267 6.678 1.00 0.00 C ATOM 496 C PRO A 750 -14.758 -1.246 5.541 1.00 0.00 C ATOM 497 O PRO A 750 -15.515 -2.183 5.276 1.00 0.00 O ATOM 498 CB PRO A 750 -15.872 -0.949 7.780 1.00 0.00 C ATOM 499 CG PRO A 750 -17.272 -0.740 7.363 1.00 0.00 C ATOM 500 CD PRO A 750 -17.294 0.677 6.934 1.00 0.00 C ATOM 0 HA PRO A 750 -14.087 0.095 6.974 1.00 0.00 H new ATOM 0 HB2 PRO A 750 -15.629 -2.009 7.856 1.00 0.00 H new ATOM 0 HB3 PRO A 750 -15.672 -0.505 8.755 1.00 0.00 H new ATOM 0 HG2 PRO A 750 -17.554 -1.410 6.551 1.00 0.00 H new ATOM 0 HG3 PRO A 750 -17.967 -0.923 8.183 1.00 0.00 H new ATOM 0 HD2 PRO A 750 -18.111 0.881 6.241 1.00 0.00 H new ATOM 0 HD3 PRO A 750 -17.414 1.357 7.778 1.00 0.00 H new ATOM 508 N PHE A 751 -13.630 -1.031 4.882 1.00 0.00 N ATOM 509 CA PHE A 751 -13.194 -1.903 3.795 1.00 0.00 C ATOM 510 C PHE A 751 -11.900 -2.628 4.155 1.00 0.00 C ATOM 511 O PHE A 751 -11.071 -2.103 4.888 1.00 0.00 O ATOM 512 CB PHE A 751 -13.004 -1.093 2.513 1.00 0.00 C ATOM 513 CG PHE A 751 -14.298 -0.645 1.903 1.00 0.00 C ATOM 514 CD1 PHE A 751 -14.843 0.584 2.220 1.00 0.00 C ATOM 515 CD2 PHE A 751 -14.973 -1.462 1.018 1.00 0.00 C ATOM 516 CE1 PHE A 751 -16.039 0.988 1.667 1.00 0.00 C ATOM 517 CE2 PHE A 751 -16.170 -1.061 0.460 1.00 0.00 C ATOM 518 CZ PHE A 751 -16.704 0.166 0.787 1.00 0.00 C ATOM 0 H PHE A 751 -12.995 -0.257 5.080 1.00 0.00 H new ATOM 0 HA PHE A 751 -13.968 -2.653 3.632 1.00 0.00 H new ATOM 0 HB2 PHE A 751 -12.390 -0.219 2.730 1.00 0.00 H new ATOM 0 HB3 PHE A 751 -12.457 -1.695 1.788 1.00 0.00 H new ATOM 0 HD1 PHE A 751 -14.326 1.236 2.909 1.00 0.00 H new ATOM 0 HD2 PHE A 751 -14.560 -2.426 0.759 1.00 0.00 H new ATOM 0 HE1 PHE A 751 -16.455 1.951 1.925 1.00 0.00 H new ATOM 0 HE2 PHE A 751 -16.687 -1.709 -0.232 1.00 0.00 H new ATOM 0 HZ PHE A 751 -17.642 0.482 0.354 1.00 0.00 H new ATOM 528 N THR A 752 -11.733 -3.840 3.646 1.00 0.00 N ATOM 529 CA THR A 752 -10.518 -4.603 3.895 1.00 0.00 C ATOM 530 C THR A 752 -9.500 -4.310 2.811 1.00 0.00 C ATOM 531 O THR A 752 -9.607 -4.796 1.690 1.00 0.00 O ATOM 532 CB THR A 752 -10.796 -6.113 3.969 1.00 0.00 C ATOM 533 OG1 THR A 752 -11.702 -6.381 5.048 1.00 0.00 O ATOM 534 CG2 THR A 752 -9.506 -6.898 4.166 1.00 0.00 C ATOM 0 H THR A 752 -12.420 -4.315 3.060 1.00 0.00 H new ATOM 0 HA THR A 752 -10.121 -4.297 4.863 1.00 0.00 H new ATOM 0 HB THR A 752 -11.244 -6.429 3.027 1.00 0.00 H new ATOM 0 HG1 THR A 752 -11.937 -5.541 5.494 1.00 0.00 H new ATOM 0 HG21 THR A 752 -9.732 -7.963 4.215 1.00 0.00 H new ATOM 0 HG22 THR A 752 -8.833 -6.708 3.330 1.00 0.00 H new ATOM 0 HG23 THR A 752 -9.028 -6.586 5.095 1.00 0.00 H new ATOM 542 N LEU A 753 -8.517 -3.512 3.166 1.00 0.00 N ATOM 543 CA LEU A 753 -7.582 -2.973 2.209 1.00 0.00 C ATOM 544 C LEU A 753 -6.309 -3.818 2.182 1.00 0.00 C ATOM 545 O LEU A 753 -5.570 -3.885 3.166 1.00 0.00 O ATOM 546 CB LEU A 753 -7.286 -1.521 2.601 1.00 0.00 C ATOM 547 CG LEU A 753 -6.638 -0.624 1.544 1.00 0.00 C ATOM 548 CD1 LEU A 753 -5.273 -0.151 2.015 1.00 0.00 C ATOM 549 CD2 LEU A 753 -6.533 -1.312 0.190 1.00 0.00 C ATOM 0 H LEU A 753 -8.345 -3.220 4.128 1.00 0.00 H new ATOM 0 HA LEU A 753 -8.003 -2.996 1.204 1.00 0.00 H new ATOM 0 HB2 LEU A 753 -8.224 -1.057 2.907 1.00 0.00 H new ATOM 0 HB3 LEU A 753 -6.636 -1.534 3.476 1.00 0.00 H new ATOM 0 HG LEU A 753 -7.286 0.242 1.411 1.00 0.00 H new ATOM 0 HD11 LEU A 753 -4.825 0.486 1.252 1.00 0.00 H new ATOM 0 HD12 LEU A 753 -5.383 0.414 2.940 1.00 0.00 H new ATOM 0 HD13 LEU A 753 -4.630 -1.013 2.191 1.00 0.00 H new ATOM 0 HD21 LEU A 753 -6.067 -0.636 -0.527 1.00 0.00 H new ATOM 0 HD22 LEU A 753 -5.927 -2.213 0.286 1.00 0.00 H new ATOM 0 HD23 LEU A 753 -7.530 -1.580 -0.160 1.00 0.00 H new ATOM 561 N THR A 754 -6.080 -4.478 1.056 1.00 0.00 N ATOM 562 CA THR A 754 -4.917 -5.330 0.879 1.00 0.00 C ATOM 563 C THR A 754 -3.941 -4.701 -0.110 1.00 0.00 C ATOM 564 O THR A 754 -4.351 -4.233 -1.177 1.00 0.00 O ATOM 565 CB THR A 754 -5.328 -6.698 0.338 1.00 0.00 C ATOM 566 OG1 THR A 754 -6.589 -7.085 0.902 1.00 0.00 O ATOM 567 CG2 THR A 754 -4.275 -7.718 0.695 1.00 0.00 C ATOM 0 H THR A 754 -6.694 -4.437 0.243 1.00 0.00 H new ATOM 0 HA THR A 754 -4.442 -5.444 1.853 1.00 0.00 H new ATOM 0 HB THR A 754 -5.425 -6.643 -0.746 1.00 0.00 H new ATOM 0 HG1 THR A 754 -7.312 -6.602 0.450 1.00 0.00 H new ATOM 0 HG21 THR A 754 -4.568 -8.694 0.309 1.00 0.00 H new ATOM 0 HG22 THR A 754 -3.321 -7.426 0.255 1.00 0.00 H new ATOM 0 HG23 THR A 754 -4.174 -7.772 1.779 1.00 0.00 H new ATOM 575 N TYR A 755 -2.659 -4.699 0.225 1.00 0.00 N ATOM 576 CA TYR A 755 -1.655 -4.136 -0.665 1.00 0.00 C ATOM 577 C TYR A 755 -0.342 -4.921 -0.623 1.00 0.00 C ATOM 578 O TYR A 755 -0.016 -5.562 0.380 1.00 0.00 O ATOM 579 CB TYR A 755 -1.417 -2.658 -0.342 1.00 0.00 C ATOM 580 CG TYR A 755 -1.153 -2.356 1.122 1.00 0.00 C ATOM 581 CD1 TYR A 755 0.105 -2.529 1.683 1.00 0.00 C ATOM 582 CD2 TYR A 755 -2.166 -1.866 1.934 1.00 0.00 C ATOM 583 CE1 TYR A 755 0.344 -2.224 3.009 1.00 0.00 C ATOM 584 CE2 TYR A 755 -1.939 -1.564 3.265 1.00 0.00 C ATOM 585 CZ TYR A 755 -0.679 -1.744 3.796 1.00 0.00 C ATOM 586 OH TYR A 755 -0.438 -1.436 5.117 1.00 0.00 O ATOM 0 H TYR A 755 -2.292 -5.077 1.098 1.00 0.00 H new ATOM 0 HA TYR A 755 -2.042 -4.214 -1.681 1.00 0.00 H new ATOM 0 HB2 TYR A 755 -0.569 -2.305 -0.929 1.00 0.00 H new ATOM 0 HB3 TYR A 755 -2.287 -2.086 -0.664 1.00 0.00 H new ATOM 0 HD1 TYR A 755 0.911 -2.909 1.072 1.00 0.00 H new ATOM 0 HD2 TYR A 755 -3.152 -1.717 1.519 1.00 0.00 H new ATOM 0 HE1 TYR A 755 1.330 -2.362 3.427 1.00 0.00 H new ATOM 0 HE2 TYR A 755 -2.742 -1.190 3.883 1.00 0.00 H new ATOM 0 HH TYR A 755 -1.035 -0.711 5.398 1.00 0.00 H new ATOM 596 N ASP A 756 0.395 -4.867 -1.731 1.00 0.00 N ATOM 597 CA ASP A 756 1.658 -5.579 -1.875 1.00 0.00 C ATOM 598 C ASP A 756 2.830 -4.619 -1.976 1.00 0.00 C ATOM 599 O ASP A 756 2.876 -3.762 -2.847 1.00 0.00 O ATOM 600 CB ASP A 756 1.659 -6.501 -3.110 1.00 0.00 C ATOM 601 CG ASP A 756 1.328 -5.801 -4.427 1.00 0.00 C ATOM 602 OD1 ASP A 756 0.157 -5.856 -4.855 1.00 0.00 O ATOM 603 OD2 ASP A 756 2.240 -5.245 -5.066 1.00 0.00 O ATOM 0 H ASP A 756 0.130 -4.326 -2.554 1.00 0.00 H new ATOM 0 HA ASP A 756 1.768 -6.189 -0.978 1.00 0.00 H new ATOM 0 HB2 ASP A 756 2.640 -6.967 -3.198 1.00 0.00 H new ATOM 0 HB3 ASP A 756 0.939 -7.303 -2.949 1.00 0.00 H new ATOM 608 N ILE A 757 3.762 -4.748 -1.057 1.00 0.00 N ATOM 609 CA ILE A 757 5.054 -4.128 -1.216 1.00 0.00 C ATOM 610 C ILE A 757 5.979 -5.163 -1.844 1.00 0.00 C ATOM 611 O ILE A 757 6.531 -6.029 -1.162 1.00 0.00 O ATOM 612 CB ILE A 757 5.638 -3.609 0.119 1.00 0.00 C ATOM 613 CG1 ILE A 757 4.823 -2.433 0.645 1.00 0.00 C ATOM 614 CG2 ILE A 757 7.077 -3.184 -0.069 1.00 0.00 C ATOM 615 CD1 ILE A 757 3.593 -2.827 1.431 1.00 0.00 C ATOM 0 H ILE A 757 3.647 -5.277 -0.193 1.00 0.00 H new ATOM 0 HA ILE A 757 4.953 -3.249 -1.853 1.00 0.00 H new ATOM 0 HB ILE A 757 5.593 -4.420 0.846 1.00 0.00 H new ATOM 0 HG12 ILE A 757 5.462 -1.818 1.278 1.00 0.00 H new ATOM 0 HG13 ILE A 757 4.518 -1.813 -0.198 1.00 0.00 H new ATOM 0 HG21 ILE A 757 7.476 -2.821 0.878 1.00 0.00 H new ATOM 0 HG22 ILE A 757 7.667 -4.036 -0.408 1.00 0.00 H new ATOM 0 HG23 ILE A 757 7.127 -2.389 -0.813 1.00 0.00 H new ATOM 0 HD11 ILE A 757 3.073 -1.930 1.767 1.00 0.00 H new ATOM 0 HD12 ILE A 757 2.929 -3.415 0.797 1.00 0.00 H new ATOM 0 HD13 ILE A 757 3.889 -3.421 2.296 1.00 0.00 H new ATOM 627 N ILE A 758 6.105 -5.087 -3.154 1.00 0.00 N ATOM 628 CA ILE A 758 6.778 -6.115 -3.925 1.00 0.00 C ATOM 629 C ILE A 758 8.202 -5.710 -4.284 1.00 0.00 C ATOM 630 O ILE A 758 8.501 -4.531 -4.430 1.00 0.00 O ATOM 631 CB ILE A 758 5.970 -6.430 -5.199 1.00 0.00 C ATOM 632 CG1 ILE A 758 5.730 -5.164 -6.013 1.00 0.00 C ATOM 633 CG2 ILE A 758 4.646 -7.059 -4.839 1.00 0.00 C ATOM 634 CD1 ILE A 758 6.674 -5.023 -7.184 1.00 0.00 C ATOM 0 H ILE A 758 5.745 -4.314 -3.713 1.00 0.00 H new ATOM 0 HA ILE A 758 6.840 -7.011 -3.307 1.00 0.00 H new ATOM 0 HB ILE A 758 6.548 -7.131 -5.801 1.00 0.00 H new ATOM 0 HG12 ILE A 758 4.704 -5.164 -6.380 1.00 0.00 H new ATOM 0 HG13 ILE A 758 5.836 -4.296 -5.363 1.00 0.00 H new ATOM 0 HG21 ILE A 758 4.087 -7.276 -5.749 1.00 0.00 H new ATOM 0 HG22 ILE A 758 4.820 -7.985 -4.291 1.00 0.00 H new ATOM 0 HG23 ILE A 758 4.074 -6.371 -4.217 1.00 0.00 H new ATOM 0 HD11 ILE A 758 6.451 -4.102 -7.722 1.00 0.00 H new ATOM 0 HD12 ILE A 758 7.701 -4.992 -6.821 1.00 0.00 H new ATOM 0 HD13 ILE A 758 6.552 -5.874 -7.854 1.00 0.00 H new ATOM 646 N GLU A 759 9.080 -6.692 -4.416 1.00 0.00 N ATOM 647 CA GLU A 759 10.475 -6.422 -4.704 1.00 0.00 C ATOM 648 C GLU A 759 10.731 -6.453 -6.197 1.00 0.00 C ATOM 649 O GLU A 759 10.587 -7.494 -6.839 1.00 0.00 O ATOM 650 CB GLU A 759 11.373 -7.442 -4.028 1.00 0.00 C ATOM 651 CG GLU A 759 10.926 -7.822 -2.635 1.00 0.00 C ATOM 652 CD GLU A 759 12.058 -8.365 -1.798 1.00 0.00 C ATOM 653 OE1 GLU A 759 12.934 -9.063 -2.353 1.00 0.00 O ATOM 654 OE2 GLU A 759 12.075 -8.114 -0.577 1.00 0.00 O ATOM 0 H GLU A 759 8.849 -7.682 -4.328 1.00 0.00 H new ATOM 0 HA GLU A 759 10.703 -5.428 -4.318 1.00 0.00 H new ATOM 0 HB2 GLU A 759 11.414 -8.340 -4.644 1.00 0.00 H new ATOM 0 HB3 GLU A 759 12.386 -7.043 -3.978 1.00 0.00 H new ATOM 0 HG2 GLU A 759 10.499 -6.949 -2.142 1.00 0.00 H new ATOM 0 HG3 GLU A 759 10.135 -8.569 -2.701 1.00 0.00 H new ATOM 661 N THR A 760 11.113 -5.316 -6.741 1.00 0.00 N ATOM 662 CA THR A 760 11.428 -5.218 -8.151 1.00 0.00 C ATOM 663 C THR A 760 12.935 -5.350 -8.354 1.00 0.00 C ATOM 664 O THR A 760 13.428 -5.404 -9.481 1.00 0.00 O ATOM 665 CB THR A 760 10.886 -3.900 -8.752 1.00 0.00 C ATOM 666 OG1 THR A 760 11.533 -3.589 -9.994 1.00 0.00 O ATOM 667 CG2 THR A 760 11.049 -2.750 -7.774 1.00 0.00 C ATOM 0 H THR A 760 11.213 -4.442 -6.224 1.00 0.00 H new ATOM 0 HA THR A 760 10.937 -6.035 -8.680 1.00 0.00 H new ATOM 0 HB THR A 760 9.823 -4.043 -8.947 1.00 0.00 H new ATOM 0 HG1 THR A 760 12.203 -4.275 -10.194 1.00 0.00 H new ATOM 0 HG21 THR A 760 10.660 -1.835 -8.221 1.00 0.00 H new ATOM 0 HG22 THR A 760 10.499 -2.970 -6.859 1.00 0.00 H new ATOM 0 HG23 THR A 760 12.105 -2.619 -7.539 1.00 0.00 H new ATOM 675 N PHE A 761 13.661 -5.405 -7.242 1.00 0.00 N ATOM 676 CA PHE A 761 15.106 -5.553 -7.277 1.00 0.00 C ATOM 677 C PHE A 761 15.503 -7.020 -7.133 1.00 0.00 C ATOM 678 O PHE A 761 16.550 -7.435 -7.624 1.00 0.00 O ATOM 679 CB PHE A 761 15.737 -4.708 -6.170 1.00 0.00 C ATOM 680 CG PHE A 761 17.229 -4.842 -6.050 1.00 0.00 C ATOM 681 CD1 PHE A 761 17.781 -5.638 -5.062 1.00 0.00 C ATOM 682 CD2 PHE A 761 18.076 -4.170 -6.916 1.00 0.00 C ATOM 683 CE1 PHE A 761 19.151 -5.764 -4.939 1.00 0.00 C ATOM 684 CE2 PHE A 761 19.448 -4.292 -6.798 1.00 0.00 C ATOM 685 CZ PHE A 761 19.987 -5.090 -5.808 1.00 0.00 C ATOM 0 H PHE A 761 13.267 -5.349 -6.303 1.00 0.00 H new ATOM 0 HA PHE A 761 15.474 -5.202 -8.241 1.00 0.00 H new ATOM 0 HB2 PHE A 761 15.493 -3.661 -6.348 1.00 0.00 H new ATOM 0 HB3 PHE A 761 15.283 -4.984 -5.218 1.00 0.00 H new ATOM 0 HD1 PHE A 761 17.133 -6.167 -4.379 1.00 0.00 H new ATOM 0 HD2 PHE A 761 17.660 -3.544 -7.692 1.00 0.00 H new ATOM 0 HE1 PHE A 761 19.568 -6.389 -4.164 1.00 0.00 H new ATOM 0 HE2 PHE A 761 20.098 -3.764 -7.480 1.00 0.00 H new ATOM 0 HZ PHE A 761 21.058 -5.187 -5.714 1.00 0.00 H new ATOM 695 N SER A 762 14.675 -7.807 -6.459 1.00 0.00 N ATOM 696 CA SER A 762 14.947 -9.224 -6.330 1.00 0.00 C ATOM 697 C SER A 762 13.813 -10.058 -6.918 1.00 0.00 C ATOM 698 O SER A 762 13.688 -10.165 -8.138 1.00 0.00 O ATOM 699 CB SER A 762 15.199 -9.608 -4.873 1.00 0.00 C ATOM 700 OG SER A 762 16.302 -8.895 -4.335 1.00 0.00 O ATOM 0 H SER A 762 13.821 -7.490 -6.000 1.00 0.00 H new ATOM 0 HA SER A 762 15.853 -9.437 -6.897 1.00 0.00 H new ATOM 0 HB2 SER A 762 14.307 -9.403 -4.281 1.00 0.00 H new ATOM 0 HB3 SER A 762 15.387 -10.679 -4.804 1.00 0.00 H new ATOM 0 HG SER A 762 16.439 -9.160 -3.401 1.00 0.00 H new ATOM 706 N SER A 763 12.964 -10.613 -6.060 1.00 0.00 N ATOM 707 CA SER A 763 11.907 -11.502 -6.524 1.00 0.00 C ATOM 708 C SER A 763 10.869 -11.786 -5.438 1.00 0.00 C ATOM 709 O SER A 763 9.965 -12.596 -5.632 1.00 0.00 O ATOM 710 CB SER A 763 12.532 -12.812 -7.007 1.00 0.00 C ATOM 711 OG SER A 763 13.393 -13.355 -6.018 1.00 0.00 O ATOM 0 H SER A 763 12.986 -10.465 -5.051 1.00 0.00 H new ATOM 0 HA SER A 763 11.385 -11.006 -7.342 1.00 0.00 H new ATOM 0 HB2 SER A 763 11.746 -13.529 -7.245 1.00 0.00 H new ATOM 0 HB3 SER A 763 13.092 -12.636 -7.926 1.00 0.00 H new ATOM 0 HG SER A 763 13.781 -14.193 -6.346 1.00 0.00 H new ATOM 717 N LYS A 764 10.986 -11.123 -4.298 1.00 0.00 N ATOM 718 CA LYS A 764 10.059 -11.367 -3.204 1.00 0.00 C ATOM 719 C LYS A 764 8.922 -10.351 -3.213 1.00 0.00 C ATOM 720 O LYS A 764 8.838 -9.499 -4.102 1.00 0.00 O ATOM 721 CB LYS A 764 10.796 -11.382 -1.859 1.00 0.00 C ATOM 722 CG LYS A 764 11.738 -12.571 -1.708 1.00 0.00 C ATOM 723 CD LYS A 764 12.321 -12.685 -0.303 1.00 0.00 C ATOM 724 CE LYS A 764 13.696 -12.032 -0.181 1.00 0.00 C ATOM 725 NZ LYS A 764 13.635 -10.547 -0.186 1.00 0.00 N ATOM 0 H LYS A 764 11.702 -10.422 -4.107 1.00 0.00 H new ATOM 0 HA LYS A 764 9.614 -12.352 -3.346 1.00 0.00 H new ATOM 0 HB2 LYS A 764 11.366 -10.459 -1.753 1.00 0.00 H new ATOM 0 HB3 LYS A 764 10.065 -11.400 -1.051 1.00 0.00 H new ATOM 0 HG2 LYS A 764 11.201 -13.488 -1.950 1.00 0.00 H new ATOM 0 HG3 LYS A 764 12.551 -12.479 -2.428 1.00 0.00 H new ATOM 0 HD2 LYS A 764 11.638 -12.220 0.408 1.00 0.00 H new ATOM 0 HD3 LYS A 764 12.398 -13.737 -0.030 1.00 0.00 H new ATOM 0 HE2 LYS A 764 14.171 -12.368 0.741 1.00 0.00 H new ATOM 0 HE3 LYS A 764 14.326 -12.367 -1.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 764 14.442 -10.165 0.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 764 13.673 -10.201 -1.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 764 12.747 -10.235 0.257 1.00 0.00 H new ATOM 739 N ARG A 765 8.043 -10.466 -2.237 1.00 0.00 N ATOM 740 CA ARG A 765 6.854 -9.651 -2.152 1.00 0.00 C ATOM 741 C ARG A 765 6.262 -9.715 -0.749 1.00 0.00 C ATOM 742 O ARG A 765 6.192 -10.785 -0.146 1.00 0.00 O ATOM 743 CB ARG A 765 5.835 -10.133 -3.182 1.00 0.00 C ATOM 744 CG ARG A 765 4.400 -9.830 -2.807 1.00 0.00 C ATOM 745 CD ARG A 765 3.455 -10.009 -3.987 1.00 0.00 C ATOM 746 NE ARG A 765 3.389 -11.397 -4.444 1.00 0.00 N ATOM 747 CZ ARG A 765 2.285 -11.977 -4.923 1.00 0.00 C ATOM 748 NH1 ARG A 765 1.151 -11.294 -5.012 1.00 0.00 N ATOM 749 NH2 ARG A 765 2.319 -13.245 -5.312 1.00 0.00 N ATOM 0 H ARG A 765 8.138 -11.136 -1.474 1.00 0.00 H new ATOM 0 HA ARG A 765 7.115 -8.614 -2.362 1.00 0.00 H new ATOM 0 HB2 ARG A 765 6.056 -9.669 -4.143 1.00 0.00 H new ATOM 0 HB3 ARG A 765 5.947 -11.209 -3.315 1.00 0.00 H new ATOM 0 HG2 ARG A 765 4.092 -10.485 -1.992 1.00 0.00 H new ATOM 0 HG3 ARG A 765 4.330 -8.807 -2.437 1.00 0.00 H new ATOM 0 HD2 ARG A 765 2.457 -9.675 -3.703 1.00 0.00 H new ATOM 0 HD3 ARG A 765 3.782 -9.374 -4.810 1.00 0.00 H new ATOM 0 HE ARG A 765 4.240 -11.957 -4.394 1.00 0.00 H new ATOM 0 HH11 ARG A 765 1.118 -10.319 -4.714 1.00 0.00 H new ATOM 0 HH12 ARG A 765 0.312 -11.744 -5.379 1.00 0.00 H new ATOM 0 HH21 ARG A 765 3.187 -13.776 -5.245 1.00 0.00 H new ATOM 0 HH22 ARG A 765 1.477 -13.689 -5.678 1.00 0.00 H new ATOM 763 N LYS A 766 5.848 -8.573 -0.231 1.00 0.00 N ATOM 764 CA LYS A 766 5.214 -8.511 1.064 1.00 0.00 C ATOM 765 C LYS A 766 3.782 -8.044 0.883 1.00 0.00 C ATOM 766 O LYS A 766 3.484 -7.274 -0.018 1.00 0.00 O ATOM 767 CB LYS A 766 5.984 -7.570 1.993 1.00 0.00 C ATOM 768 CG LYS A 766 5.821 -7.906 3.471 1.00 0.00 C ATOM 769 CD LYS A 766 4.513 -7.393 4.049 1.00 0.00 C ATOM 770 CE LYS A 766 4.306 -7.887 5.476 1.00 0.00 C ATOM 771 NZ LYS A 766 4.195 -9.366 5.551 1.00 0.00 N ATOM 0 H LYS A 766 5.943 -7.670 -0.696 1.00 0.00 H new ATOM 0 HA LYS A 766 5.216 -9.499 1.524 1.00 0.00 H new ATOM 0 HB2 LYS A 766 7.043 -7.604 1.735 1.00 0.00 H new ATOM 0 HB3 LYS A 766 5.647 -6.548 1.822 1.00 0.00 H new ATOM 0 HG2 LYS A 766 5.872 -8.987 3.601 1.00 0.00 H new ATOM 0 HG3 LYS A 766 6.653 -7.478 4.030 1.00 0.00 H new ATOM 0 HD2 LYS A 766 4.510 -6.303 4.035 1.00 0.00 H new ATOM 0 HD3 LYS A 766 3.683 -7.722 3.424 1.00 0.00 H new ATOM 0 HE2 LYS A 766 5.138 -7.556 6.097 1.00 0.00 H new ATOM 0 HE3 LYS A 766 3.403 -7.436 5.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 766 3.761 -9.636 6.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 766 3.604 -9.710 4.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 766 5.142 -9.789 5.482 1.00 0.00 H new ATOM 785 N THR A 767 2.898 -8.539 1.709 1.00 0.00 N ATOM 786 CA THR A 767 1.489 -8.211 1.599 1.00 0.00 C ATOM 787 C THR A 767 0.897 -7.826 2.957 1.00 0.00 C ATOM 788 O THR A 767 1.178 -8.468 3.970 1.00 0.00 O ATOM 789 CB THR A 767 0.720 -9.407 1.012 1.00 0.00 C ATOM 790 OG1 THR A 767 1.277 -9.755 -0.265 1.00 0.00 O ATOM 791 CG2 THR A 767 -0.763 -9.097 0.856 1.00 0.00 C ATOM 0 H THR A 767 3.125 -9.176 2.473 1.00 0.00 H new ATOM 0 HA THR A 767 1.393 -7.352 0.935 1.00 0.00 H new ATOM 0 HB THR A 767 0.817 -10.244 1.703 1.00 0.00 H new ATOM 0 HG1 THR A 767 0.788 -10.518 -0.638 1.00 0.00 H new ATOM 0 HG21 THR A 767 -1.274 -9.965 0.439 1.00 0.00 H new ATOM 0 HG22 THR A 767 -1.189 -8.859 1.830 1.00 0.00 H new ATOM 0 HG23 THR A 767 -0.888 -8.246 0.187 1.00 0.00 H new ATOM 799 N PHE A 768 0.104 -6.760 2.969 1.00 0.00 N ATOM 800 CA PHE A 768 -0.630 -6.353 4.161 1.00 0.00 C ATOM 801 C PHE A 768 -2.119 -6.282 3.867 1.00 0.00 C ATOM 802 O PHE A 768 -2.530 -5.742 2.840 1.00 0.00 O ATOM 803 CB PHE A 768 -0.169 -4.995 4.675 1.00 0.00 C ATOM 804 CG PHE A 768 1.018 -5.049 5.586 1.00 0.00 C ATOM 805 CD1 PHE A 768 2.265 -4.672 5.135 1.00 0.00 C ATOM 806 CD2 PHE A 768 0.877 -5.460 6.900 1.00 0.00 C ATOM 807 CE1 PHE A 768 3.358 -4.702 5.977 1.00 0.00 C ATOM 808 CE2 PHE A 768 1.965 -5.498 7.748 1.00 0.00 C ATOM 809 CZ PHE A 768 3.208 -5.117 7.287 1.00 0.00 C ATOM 0 H PHE A 768 -0.047 -6.158 2.159 1.00 0.00 H new ATOM 0 HA PHE A 768 -0.432 -7.102 4.927 1.00 0.00 H new ATOM 0 HB2 PHE A 768 0.071 -4.360 3.822 1.00 0.00 H new ATOM 0 HB3 PHE A 768 -0.996 -4.520 5.203 1.00 0.00 H new ATOM 0 HD1 PHE A 768 2.388 -4.350 4.112 1.00 0.00 H new ATOM 0 HD2 PHE A 768 -0.096 -5.754 7.266 1.00 0.00 H new ATOM 0 HE1 PHE A 768 4.329 -4.402 5.613 1.00 0.00 H new ATOM 0 HE2 PHE A 768 1.844 -5.825 8.770 1.00 0.00 H new ATOM 0 HZ PHE A 768 4.062 -5.143 7.948 1.00 0.00 H new ATOM 819 N GLU A 769 -2.914 -6.831 4.765 1.00 0.00 N ATOM 820 CA GLU A 769 -4.358 -6.798 4.635 1.00 0.00 C ATOM 821 C GLU A 769 -4.998 -6.233 5.900 1.00 0.00 C ATOM 822 O GLU A 769 -5.062 -6.906 6.930 1.00 0.00 O ATOM 823 CB GLU A 769 -4.860 -8.208 4.361 1.00 0.00 C ATOM 824 CG GLU A 769 -6.369 -8.319 4.246 1.00 0.00 C ATOM 825 CD GLU A 769 -6.822 -9.745 3.996 1.00 0.00 C ATOM 826 OE1 GLU A 769 -7.026 -10.491 4.977 1.00 0.00 O ATOM 827 OE2 GLU A 769 -6.969 -10.132 2.822 1.00 0.00 O ATOM 0 H GLU A 769 -2.580 -7.310 5.601 1.00 0.00 H new ATOM 0 HA GLU A 769 -4.635 -6.147 3.805 1.00 0.00 H new ATOM 0 HB2 GLU A 769 -4.409 -8.569 3.437 1.00 0.00 H new ATOM 0 HB3 GLU A 769 -4.518 -8.865 5.161 1.00 0.00 H new ATOM 0 HG2 GLU A 769 -6.830 -7.949 5.162 1.00 0.00 H new ATOM 0 HG3 GLU A 769 -6.718 -7.681 3.434 1.00 0.00 H new ATOM 834 N ILE A 770 -5.455 -4.992 5.820 1.00 0.00 N ATOM 835 CA ILE A 770 -6.060 -4.323 6.954 1.00 0.00 C ATOM 836 C ILE A 770 -7.572 -4.251 6.784 1.00 0.00 C ATOM 837 O ILE A 770 -8.069 -3.651 5.839 1.00 0.00 O ATOM 838 CB ILE A 770 -5.483 -2.903 7.096 1.00 0.00 C ATOM 839 CG1 ILE A 770 -3.974 -2.973 7.309 1.00 0.00 C ATOM 840 CG2 ILE A 770 -6.148 -2.151 8.236 1.00 0.00 C ATOM 841 CD1 ILE A 770 -3.254 -1.755 6.798 1.00 0.00 C ATOM 0 H ILE A 770 -5.416 -4.427 4.972 1.00 0.00 H new ATOM 0 HA ILE A 770 -5.835 -4.894 7.855 1.00 0.00 H new ATOM 0 HB ILE A 770 -5.687 -2.357 6.175 1.00 0.00 H new ATOM 0 HG12 ILE A 770 -3.767 -3.092 8.373 1.00 0.00 H new ATOM 0 HG13 ILE A 770 -3.582 -3.858 6.808 1.00 0.00 H new ATOM 0 HG21 ILE A 770 -5.720 -1.152 8.311 1.00 0.00 H new ATOM 0 HG22 ILE A 770 -7.218 -2.073 8.045 1.00 0.00 H new ATOM 0 HG23 ILE A 770 -5.984 -2.688 9.170 1.00 0.00 H new ATOM 0 HD11 ILE A 770 -2.184 -1.863 6.977 1.00 0.00 H new ATOM 0 HD12 ILE A 770 -3.434 -1.648 5.728 1.00 0.00 H new ATOM 0 HD13 ILE A 770 -3.622 -0.870 7.318 1.00 0.00 H new ATOM 853 N LYS A 771 -8.296 -4.885 7.689 1.00 0.00 N ATOM 854 CA LYS A 771 -9.742 -4.907 7.630 1.00 0.00 C ATOM 855 C LYS A 771 -10.324 -3.603 8.123 1.00 0.00 C ATOM 856 O LYS A 771 -9.691 -2.860 8.877 1.00 0.00 O ATOM 857 CB LYS A 771 -10.300 -6.024 8.496 1.00 0.00 C ATOM 858 CG LYS A 771 -9.479 -7.285 8.434 1.00 0.00 C ATOM 859 CD LYS A 771 -9.989 -8.240 7.378 1.00 0.00 C ATOM 860 CE LYS A 771 -8.920 -9.242 7.010 1.00 0.00 C ATOM 861 NZ LYS A 771 -9.445 -10.356 6.183 1.00 0.00 N ATOM 0 H LYS A 771 -7.900 -5.395 8.479 1.00 0.00 H new ATOM 0 HA LYS A 771 -10.016 -5.066 6.587 1.00 0.00 H new ATOM 0 HB2 LYS A 771 -10.353 -5.682 9.530 1.00 0.00 H new ATOM 0 HB3 LYS A 771 -11.320 -6.245 8.181 1.00 0.00 H new ATOM 0 HG2 LYS A 771 -8.440 -7.032 8.223 1.00 0.00 H new ATOM 0 HG3 LYS A 771 -9.496 -7.777 9.407 1.00 0.00 H new ATOM 0 HD2 LYS A 771 -10.873 -8.761 7.747 1.00 0.00 H new ATOM 0 HD3 LYS A 771 -10.294 -7.683 6.492 1.00 0.00 H new ATOM 0 HE2 LYS A 771 -8.123 -8.735 6.466 1.00 0.00 H new ATOM 0 HE3 LYS A 771 -8.477 -9.647 7.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 771 -8.689 -10.718 5.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 771 -9.782 -11.120 6.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 771 -10.233 -10.012 5.598 1.00 0.00 H new ATOM 875 N GLU A 772 -11.554 -3.377 7.707 1.00 0.00 N ATOM 876 CA GLU A 772 -12.377 -2.271 8.176 1.00 0.00 C ATOM 877 C GLU A 772 -11.640 -0.935 8.157 1.00 0.00 C ATOM 878 O GLU A 772 -11.698 -0.185 9.133 1.00 0.00 O ATOM 879 CB GLU A 772 -12.880 -2.552 9.595 1.00 0.00 C ATOM 880 CG GLU A 772 -13.120 -4.025 9.871 1.00 0.00 C ATOM 881 CD GLU A 772 -13.829 -4.273 11.181 1.00 0.00 C ATOM 882 OE1 GLU A 772 -15.040 -3.988 11.274 1.00 0.00 O ATOM 883 OE2 GLU A 772 -13.184 -4.777 12.123 1.00 0.00 O ATOM 0 H GLU A 772 -12.022 -3.967 7.019 1.00 0.00 H new ATOM 0 HA GLU A 772 -13.217 -2.192 7.485 1.00 0.00 H new ATOM 0 HB2 GLU A 772 -12.153 -2.170 10.312 1.00 0.00 H new ATOM 0 HB3 GLU A 772 -13.808 -2.004 9.758 1.00 0.00 H new ATOM 0 HG2 GLU A 772 -13.710 -4.449 9.059 1.00 0.00 H new ATOM 0 HG3 GLU A 772 -12.164 -4.548 9.877 1.00 0.00 H new ATOM 890 N ILE A 773 -10.941 -0.627 7.072 1.00 0.00 N ATOM 891 CA ILE A 773 -10.370 0.694 6.941 1.00 0.00 C ATOM 892 C ILE A 773 -11.508 1.642 6.587 1.00 0.00 C ATOM 893 O ILE A 773 -12.120 1.539 5.535 1.00 0.00 O ATOM 894 CB ILE A 773 -9.170 0.765 5.928 1.00 0.00 C ATOM 895 CG1 ILE A 773 -9.574 1.202 4.515 1.00 0.00 C ATOM 896 CG2 ILE A 773 -8.451 -0.574 5.847 1.00 0.00 C ATOM 897 CD1 ILE A 773 -9.648 2.710 4.334 1.00 0.00 C ATOM 0 H ILE A 773 -10.762 -1.260 6.292 1.00 0.00 H new ATOM 0 HA ILE A 773 -9.914 0.990 7.886 1.00 0.00 H new ATOM 0 HB ILE A 773 -8.505 1.532 6.324 1.00 0.00 H new ATOM 0 HG12 ILE A 773 -8.858 0.795 3.801 1.00 0.00 H new ATOM 0 HG13 ILE A 773 -10.545 0.769 4.275 1.00 0.00 H new ATOM 0 HG21 ILE A 773 -7.625 -0.501 5.140 1.00 0.00 H new ATOM 0 HG22 ILE A 773 -8.065 -0.840 6.831 1.00 0.00 H new ATOM 0 HG23 ILE A 773 -9.148 -1.342 5.512 1.00 0.00 H new ATOM 0 HD11 ILE A 773 -9.940 2.940 3.309 1.00 0.00 H new ATOM 0 HD12 ILE A 773 -10.385 3.123 5.022 1.00 0.00 H new ATOM 0 HD13 ILE A 773 -8.672 3.150 4.541 1.00 0.00 H new ATOM 909 N LYS A 774 -11.850 2.487 7.535 1.00 0.00 N ATOM 910 CA LYS A 774 -12.942 3.436 7.394 1.00 0.00 C ATOM 911 C LYS A 774 -12.343 4.822 7.188 1.00 0.00 C ATOM 912 O LYS A 774 -12.937 5.843 7.538 1.00 0.00 O ATOM 913 CB LYS A 774 -13.776 3.393 8.676 1.00 0.00 C ATOM 914 CG LYS A 774 -14.147 1.974 9.089 1.00 0.00 C ATOM 915 CD LYS A 774 -14.424 1.869 10.580 1.00 0.00 C ATOM 916 CE LYS A 774 -14.690 0.427 10.992 1.00 0.00 C ATOM 917 NZ LYS A 774 -14.861 0.287 12.463 1.00 0.00 N ATOM 0 H LYS A 774 -11.375 2.538 8.436 1.00 0.00 H new ATOM 0 HA LYS A 774 -13.579 3.193 6.544 1.00 0.00 H new ATOM 0 HB2 LYS A 774 -13.219 3.868 9.483 1.00 0.00 H new ATOM 0 HB3 LYS A 774 -14.686 3.975 8.532 1.00 0.00 H new ATOM 0 HG2 LYS A 774 -15.028 1.653 8.533 1.00 0.00 H new ATOM 0 HG3 LYS A 774 -13.337 1.295 8.822 1.00 0.00 H new ATOM 0 HD2 LYS A 774 -13.573 2.258 11.139 1.00 0.00 H new ATOM 0 HD3 LYS A 774 -15.284 2.488 10.837 1.00 0.00 H new ATOM 0 HE2 LYS A 774 -15.586 0.066 10.487 1.00 0.00 H new ATOM 0 HE3 LYS A 774 -13.863 -0.202 10.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 774 -15.040 -0.710 12.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 774 -13.997 0.607 12.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 774 -15.666 0.866 12.776 1.00 0.00 H new ATOM 931 N THR A 775 -11.155 4.836 6.600 1.00 0.00 N ATOM 932 CA THR A 775 -10.315 6.022 6.577 1.00 0.00 C ATOM 933 C THR A 775 -10.476 6.846 5.302 1.00 0.00 C ATOM 934 O THR A 775 -11.075 7.917 5.323 1.00 0.00 O ATOM 935 CB THR A 775 -8.843 5.611 6.686 1.00 0.00 C ATOM 936 OG1 THR A 775 -8.736 4.406 7.453 1.00 0.00 O ATOM 937 CG2 THR A 775 -8.019 6.707 7.341 1.00 0.00 C ATOM 0 H THR A 775 -10.749 4.028 6.128 1.00 0.00 H new ATOM 0 HA THR A 775 -10.628 6.636 7.421 1.00 0.00 H new ATOM 0 HB THR A 775 -8.457 5.445 5.680 1.00 0.00 H new ATOM 0 HG1 THR A 775 -7.794 4.144 7.520 1.00 0.00 H new ATOM 0 HG21 THR A 775 -6.978 6.390 7.406 1.00 0.00 H new ATOM 0 HG22 THR A 775 -8.084 7.617 6.745 1.00 0.00 H new ATOM 0 HG23 THR A 775 -8.403 6.901 8.343 1.00 0.00 H new ATOM 945 N ASN A 776 -9.898 6.326 4.215 1.00 0.00 N ATOM 946 CA ASN A 776 -9.859 6.974 2.894 1.00 0.00 C ATOM 947 C ASN A 776 -8.697 7.950 2.803 1.00 0.00 C ATOM 948 O ASN A 776 -8.462 8.553 1.766 1.00 0.00 O ATOM 949 CB ASN A 776 -11.176 7.670 2.542 1.00 0.00 C ATOM 950 CG ASN A 776 -12.345 6.708 2.451 1.00 0.00 C ATOM 951 OD1 ASN A 776 -13.497 7.095 2.641 1.00 0.00 O ATOM 952 ND2 ASN A 776 -12.056 5.440 2.204 1.00 0.00 N ATOM 0 H ASN A 776 -9.431 5.419 4.226 1.00 0.00 H new ATOM 0 HA ASN A 776 -9.711 6.181 2.160 1.00 0.00 H new ATOM 0 HB2 ASN A 776 -11.393 8.428 3.295 1.00 0.00 H new ATOM 0 HB3 ASN A 776 -11.064 8.189 1.590 1.00 0.00 H new ATOM 0 HD21 ASN A 776 -12.802 4.745 2.166 1.00 0.00 H new ATOM 0 HD22 ASN A 776 -11.088 5.158 2.052 1.00 0.00 H new ATOM 959 N GLU A 777 -7.926 8.018 3.871 1.00 0.00 N ATOM 960 CA GLU A 777 -6.735 8.853 3.952 1.00 0.00 C ATOM 961 C GLU A 777 -5.809 8.265 5.006 1.00 0.00 C ATOM 962 O GLU A 777 -5.814 8.698 6.156 1.00 0.00 O ATOM 963 CB GLU A 777 -7.085 10.289 4.349 1.00 0.00 C ATOM 964 CG GLU A 777 -7.578 11.168 3.221 1.00 0.00 C ATOM 965 CD GLU A 777 -9.089 11.181 3.073 1.00 0.00 C ATOM 966 OE1 GLU A 777 -9.790 11.334 4.098 1.00 0.00 O ATOM 967 OE2 GLU A 777 -9.582 11.074 1.929 1.00 0.00 O ATOM 0 H GLU A 777 -8.109 7.487 4.723 1.00 0.00 H new ATOM 0 HA GLU A 777 -6.257 8.876 2.973 1.00 0.00 H new ATOM 0 HB2 GLU A 777 -7.850 10.258 5.125 1.00 0.00 H new ATOM 0 HB3 GLU A 777 -6.202 10.752 4.790 1.00 0.00 H new ATOM 0 HG2 GLU A 777 -7.229 12.187 3.387 1.00 0.00 H new ATOM 0 HG3 GLU A 777 -7.133 10.828 2.286 1.00 0.00 H new ATOM 974 N TYR A 778 -5.022 7.276 4.626 1.00 0.00 N ATOM 975 CA TYR A 778 -4.260 6.511 5.614 1.00 0.00 C ATOM 976 C TYR A 778 -2.780 6.486 5.280 1.00 0.00 C ATOM 977 O TYR A 778 -2.395 6.150 4.170 1.00 0.00 O ATOM 978 CB TYR A 778 -4.810 5.084 5.747 1.00 0.00 C ATOM 979 CG TYR A 778 -3.960 4.176 6.614 1.00 0.00 C ATOM 980 CD1 TYR A 778 -3.891 4.361 7.989 1.00 0.00 C ATOM 981 CD2 TYR A 778 -3.226 3.136 6.056 1.00 0.00 C ATOM 982 CE1 TYR A 778 -3.115 3.537 8.782 1.00 0.00 C ATOM 983 CE2 TYR A 778 -2.449 2.308 6.844 1.00 0.00 C ATOM 984 CZ TYR A 778 -2.396 2.514 8.205 1.00 0.00 C ATOM 985 OH TYR A 778 -1.624 1.688 8.992 1.00 0.00 O ATOM 0 H TYR A 778 -4.890 6.981 3.658 1.00 0.00 H new ATOM 0 HA TYR A 778 -4.374 7.014 6.574 1.00 0.00 H new ATOM 0 HB2 TYR A 778 -5.816 5.130 6.164 1.00 0.00 H new ATOM 0 HB3 TYR A 778 -4.897 4.644 4.753 1.00 0.00 H new ATOM 0 HD1 TYR A 778 -4.453 5.162 8.446 1.00 0.00 H new ATOM 0 HD2 TYR A 778 -3.263 2.972 4.989 1.00 0.00 H new ATOM 0 HE1 TYR A 778 -3.073 3.695 9.850 1.00 0.00 H new ATOM 0 HE2 TYR A 778 -1.886 1.503 6.395 1.00 0.00 H new ATOM 0 HH TYR A 778 -1.183 1.018 8.429 1.00 0.00 H new ATOM 995 N VAL A 779 -1.950 6.853 6.243 1.00 0.00 N ATOM 996 CA VAL A 779 -0.516 6.822 6.043 1.00 0.00 C ATOM 997 C VAL A 779 0.037 5.456 6.416 1.00 0.00 C ATOM 998 O VAL A 779 0.077 5.081 7.587 1.00 0.00 O ATOM 999 CB VAL A 779 0.212 7.923 6.835 1.00 0.00 C ATOM 1000 CG1 VAL A 779 1.671 8.023 6.408 1.00 0.00 C ATOM 1001 CG2 VAL A 779 -0.482 9.252 6.648 1.00 0.00 C ATOM 0 H VAL A 779 -2.245 7.174 7.165 1.00 0.00 H new ATOM 0 HA VAL A 779 -0.335 7.013 4.985 1.00 0.00 H new ATOM 0 HB VAL A 779 0.183 7.658 7.892 1.00 0.00 H new ATOM 0 HG11 VAL A 779 2.165 8.808 6.981 1.00 0.00 H new ATOM 0 HG12 VAL A 779 2.170 7.071 6.591 1.00 0.00 H new ATOM 0 HG13 VAL A 779 1.724 8.262 5.346 1.00 0.00 H new ATOM 0 HG21 VAL A 779 0.045 10.020 7.214 1.00 0.00 H new ATOM 0 HG22 VAL A 779 -0.482 9.517 5.591 1.00 0.00 H new ATOM 0 HG23 VAL A 779 -1.510 9.179 7.004 1.00 0.00 H new ATOM 1011 N ILE A 780 0.438 4.711 5.398 1.00 0.00 N ATOM 1012 CA ILE A 780 0.970 3.372 5.577 1.00 0.00 C ATOM 1013 C ILE A 780 2.401 3.428 6.094 1.00 0.00 C ATOM 1014 O ILE A 780 3.177 4.306 5.718 1.00 0.00 O ATOM 1015 CB ILE A 780 0.947 2.592 4.245 1.00 0.00 C ATOM 1016 CG1 ILE A 780 -0.477 2.366 3.763 1.00 0.00 C ATOM 1017 CG2 ILE A 780 1.672 1.258 4.364 1.00 0.00 C ATOM 1018 CD1 ILE A 780 -0.516 1.679 2.423 1.00 0.00 C ATOM 0 H ILE A 780 0.403 5.018 4.426 1.00 0.00 H new ATOM 0 HA ILE A 780 0.341 2.861 6.305 1.00 0.00 H new ATOM 0 HB ILE A 780 1.472 3.203 3.511 1.00 0.00 H new ATOM 0 HG12 ILE A 780 -1.016 1.765 4.495 1.00 0.00 H new ATOM 0 HG13 ILE A 780 -0.993 3.324 3.695 1.00 0.00 H new ATOM 0 HG21 ILE A 780 1.635 0.737 3.407 1.00 0.00 H new ATOM 0 HG22 ILE A 780 2.711 1.432 4.642 1.00 0.00 H new ATOM 0 HG23 ILE A 780 1.189 0.648 5.128 1.00 0.00 H new ATOM 0 HD11 ILE A 780 -1.552 1.537 2.117 1.00 0.00 H new ATOM 0 HD12 ILE A 780 -0.000 2.292 1.684 1.00 0.00 H new ATOM 0 HD13 ILE A 780 -0.024 0.709 2.497 1.00 0.00 H new ATOM 1030 N LYS A 781 2.737 2.488 6.956 1.00 0.00 N ATOM 1031 CA LYS A 781 4.094 2.360 7.463 1.00 0.00 C ATOM 1032 C LYS A 781 4.613 0.972 7.154 1.00 0.00 C ATOM 1033 O LYS A 781 4.195 -0.015 7.769 1.00 0.00 O ATOM 1034 CB LYS A 781 4.176 2.624 8.973 1.00 0.00 C ATOM 1035 CG LYS A 781 4.295 4.096 9.359 1.00 0.00 C ATOM 1036 CD LYS A 781 3.016 4.872 9.107 1.00 0.00 C ATOM 1037 CE LYS A 781 1.923 4.445 10.067 1.00 0.00 C ATOM 1038 NZ LYS A 781 2.213 4.849 11.468 1.00 0.00 N ATOM 0 H LYS A 781 2.085 1.795 7.324 1.00 0.00 H new ATOM 0 HA LYS A 781 4.709 3.113 6.969 1.00 0.00 H new ATOM 0 HB2 LYS A 781 3.288 2.209 9.449 1.00 0.00 H new ATOM 0 HB3 LYS A 781 5.035 2.087 9.376 1.00 0.00 H new ATOM 0 HG2 LYS A 781 4.559 4.171 10.414 1.00 0.00 H new ATOM 0 HG3 LYS A 781 5.109 4.551 8.794 1.00 0.00 H new ATOM 0 HD2 LYS A 781 3.206 5.939 9.219 1.00 0.00 H new ATOM 0 HD3 LYS A 781 2.686 4.713 8.080 1.00 0.00 H new ATOM 0 HE2 LYS A 781 0.976 4.883 9.754 1.00 0.00 H new ATOM 0 HE3 LYS A 781 1.804 3.362 10.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 781 1.347 4.770 12.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 781 2.947 4.227 11.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 781 2.549 5.833 11.483 1.00 0.00 H new ATOM 1052 N THR A 782 5.509 0.897 6.194 1.00 0.00 N ATOM 1053 CA THR A 782 6.045 -0.371 5.766 1.00 0.00 C ATOM 1054 C THR A 782 7.191 -0.799 6.680 1.00 0.00 C ATOM 1055 O THR A 782 7.967 0.043 7.156 1.00 0.00 O ATOM 1056 CB THR A 782 6.521 -0.302 4.314 1.00 0.00 C ATOM 1057 OG1 THR A 782 7.425 0.782 4.147 1.00 0.00 O ATOM 1058 CG2 THR A 782 5.350 -0.115 3.393 1.00 0.00 C ATOM 0 H THR A 782 5.881 1.705 5.695 1.00 0.00 H new ATOM 0 HA THR A 782 5.250 -1.114 5.828 1.00 0.00 H new ATOM 0 HB THR A 782 7.026 -1.237 4.072 1.00 0.00 H new ATOM 0 HG1 THR A 782 8.266 0.581 4.609 1.00 0.00 H new ATOM 0 HG21 THR A 782 5.702 -0.067 2.362 1.00 0.00 H new ATOM 0 HG22 THR A 782 4.663 -0.954 3.503 1.00 0.00 H new ATOM 0 HG23 THR A 782 4.834 0.812 3.644 1.00 0.00 H new ATOM 1066 N PRO A 783 7.297 -2.115 6.934 1.00 0.00 N ATOM 1067 CA PRO A 783 8.303 -2.695 7.836 1.00 0.00 C ATOM 1068 C PRO A 783 9.722 -2.260 7.495 1.00 0.00 C ATOM 1069 O PRO A 783 10.000 -1.817 6.382 1.00 0.00 O ATOM 1070 CB PRO A 783 8.144 -4.201 7.617 1.00 0.00 C ATOM 1071 CG PRO A 783 6.739 -4.364 7.162 1.00 0.00 C ATOM 1072 CD PRO A 783 6.438 -3.149 6.341 1.00 0.00 C ATOM 0 HA PRO A 783 8.152 -2.375 8.867 1.00 0.00 H new ATOM 0 HB2 PRO A 783 8.848 -4.570 6.871 1.00 0.00 H new ATOM 0 HB3 PRO A 783 8.331 -4.758 8.535 1.00 0.00 H new ATOM 0 HG2 PRO A 783 6.621 -5.274 6.574 1.00 0.00 H new ATOM 0 HG3 PRO A 783 6.059 -4.442 8.010 1.00 0.00 H new ATOM 0 HD2 PRO A 783 6.670 -3.308 5.288 1.00 0.00 H new ATOM 0 HD3 PRO A 783 5.384 -2.877 6.398 1.00 0.00 H new ATOM 1080 N VAL A 784 10.618 -2.397 8.463 1.00 0.00 N ATOM 1081 CA VAL A 784 11.993 -1.972 8.291 1.00 0.00 C ATOM 1082 C VAL A 784 12.689 -2.829 7.240 1.00 0.00 C ATOM 1083 O VAL A 784 12.546 -4.053 7.218 1.00 0.00 O ATOM 1084 CB VAL A 784 12.774 -2.031 9.623 1.00 0.00 C ATOM 1085 CG1 VAL A 784 12.869 -3.458 10.129 1.00 0.00 C ATOM 1086 CG2 VAL A 784 14.156 -1.421 9.467 1.00 0.00 C ATOM 0 H VAL A 784 10.412 -2.801 9.377 1.00 0.00 H new ATOM 0 HA VAL A 784 11.977 -0.936 7.953 1.00 0.00 H new ATOM 0 HB VAL A 784 12.227 -1.445 10.362 1.00 0.00 H new ATOM 0 HG11 VAL A 784 13.423 -3.475 11.068 1.00 0.00 H new ATOM 0 HG12 VAL A 784 11.867 -3.854 10.292 1.00 0.00 H new ATOM 0 HG13 VAL A 784 13.386 -4.072 9.391 1.00 0.00 H new ATOM 0 HG21 VAL A 784 14.687 -1.474 10.418 1.00 0.00 H new ATOM 0 HG22 VAL A 784 14.713 -1.972 8.709 1.00 0.00 H new ATOM 0 HG23 VAL A 784 14.061 -0.379 9.162 1.00 0.00 H new ATOM 1096 N PHE A 785 13.421 -2.181 6.357 1.00 0.00 N ATOM 1097 CA PHE A 785 14.147 -2.881 5.321 1.00 0.00 C ATOM 1098 C PHE A 785 15.617 -2.963 5.682 1.00 0.00 C ATOM 1099 O PHE A 785 16.382 -2.015 5.492 1.00 0.00 O ATOM 1100 CB PHE A 785 13.959 -2.209 3.963 1.00 0.00 C ATOM 1101 CG PHE A 785 12.563 -2.350 3.431 1.00 0.00 C ATOM 1102 CD1 PHE A 785 11.604 -1.404 3.726 1.00 0.00 C ATOM 1103 CD2 PHE A 785 12.211 -3.431 2.641 1.00 0.00 C ATOM 1104 CE1 PHE A 785 10.316 -1.527 3.244 1.00 0.00 C ATOM 1105 CE2 PHE A 785 10.925 -3.563 2.156 1.00 0.00 C ATOM 1106 CZ PHE A 785 9.975 -2.608 2.458 1.00 0.00 C ATOM 0 H PHE A 785 13.528 -1.167 6.338 1.00 0.00 H new ATOM 0 HA PHE A 785 13.747 -3.892 5.245 1.00 0.00 H new ATOM 0 HB2 PHE A 785 14.204 -1.151 4.050 1.00 0.00 H new ATOM 0 HB3 PHE A 785 14.660 -2.641 3.249 1.00 0.00 H new ATOM 0 HD1 PHE A 785 11.864 -0.556 4.342 1.00 0.00 H new ATOM 0 HD2 PHE A 785 12.951 -4.180 2.401 1.00 0.00 H new ATOM 0 HE1 PHE A 785 9.576 -0.777 3.482 1.00 0.00 H new ATOM 0 HE2 PHE A 785 10.663 -4.412 1.542 1.00 0.00 H new ATOM 0 HZ PHE A 785 8.968 -2.707 2.080 1.00 0.00 H new ATOM 1116 N THR A 786 16.007 -4.109 6.204 1.00 0.00 N ATOM 1117 CA THR A 786 17.372 -4.338 6.637 1.00 0.00 C ATOM 1118 C THR A 786 18.223 -4.809 5.470 1.00 0.00 C ATOM 1119 O THR A 786 19.245 -5.478 5.638 1.00 0.00 O ATOM 1120 CB THR A 786 17.394 -5.362 7.775 1.00 0.00 C ATOM 1121 OG1 THR A 786 16.774 -6.585 7.353 1.00 0.00 O ATOM 1122 CG2 THR A 786 16.645 -4.802 8.964 1.00 0.00 C ATOM 0 H THR A 786 15.387 -4.908 6.340 1.00 0.00 H new ATOM 0 HA THR A 786 17.790 -3.402 7.006 1.00 0.00 H new ATOM 0 HB THR A 786 18.428 -5.567 8.051 1.00 0.00 H new ATOM 0 HG1 THR A 786 16.795 -7.233 8.088 1.00 0.00 H new ATOM 0 HG21 THR A 786 16.658 -5.528 9.777 1.00 0.00 H new ATOM 0 HG22 THR A 786 17.123 -3.879 9.294 1.00 0.00 H new ATOM 0 HG23 THR A 786 15.613 -4.595 8.679 1.00 0.00 H new ATOM 1130 N THR A 787 17.774 -4.444 4.284 1.00 0.00 N ATOM 1131 CA THR A 787 18.449 -4.786 3.045 1.00 0.00 C ATOM 1132 C THR A 787 17.991 -3.855 1.926 1.00 0.00 C ATOM 1133 O THR A 787 16.828 -3.896 1.519 1.00 0.00 O ATOM 1134 CB THR A 787 18.173 -6.233 2.616 1.00 0.00 C ATOM 1135 OG1 THR A 787 18.261 -7.124 3.736 1.00 0.00 O ATOM 1136 CG2 THR A 787 19.176 -6.658 1.562 1.00 0.00 C ATOM 0 H THR A 787 16.923 -3.897 4.152 1.00 0.00 H new ATOM 0 HA THR A 787 19.518 -4.676 3.225 1.00 0.00 H new ATOM 0 HB THR A 787 17.163 -6.279 2.208 1.00 0.00 H new ATOM 0 HG1 THR A 787 18.080 -8.041 3.440 1.00 0.00 H new ATOM 0 HG21 THR A 787 18.975 -7.686 1.262 1.00 0.00 H new ATOM 0 HG22 THR A 787 19.092 -6.003 0.695 1.00 0.00 H new ATOM 0 HG23 THR A 787 20.184 -6.590 1.971 1.00 0.00 H new ATOM 1144 N GLY A 788 18.894 -2.984 1.477 1.00 0.00 N ATOM 1145 CA GLY A 788 18.621 -2.143 0.329 1.00 0.00 C ATOM 1146 C GLY A 788 18.094 -2.906 -0.877 1.00 0.00 C ATOM 1147 O GLY A 788 18.457 -4.064 -1.112 1.00 0.00 O ATOM 0 H GLY A 788 19.815 -2.848 1.894 1.00 0.00 H new ATOM 0 HA2 GLY A 788 17.894 -1.382 0.612 1.00 0.00 H new ATOM 0 HA3 GLY A 788 19.535 -1.621 0.046 1.00 0.00 H new ATOM 1151 N GLY A 789 17.248 -2.237 -1.638 1.00 0.00 N ATOM 1152 CA GLY A 789 16.611 -2.820 -2.794 1.00 0.00 C ATOM 1153 C GLY A 789 15.482 -1.934 -3.271 1.00 0.00 C ATOM 1154 O GLY A 789 15.193 -0.917 -2.640 1.00 0.00 O ATOM 0 H GLY A 789 16.985 -1.267 -1.466 1.00 0.00 H new ATOM 0 HA2 GLY A 789 17.341 -2.952 -3.592 1.00 0.00 H new ATOM 0 HA3 GLY A 789 16.227 -3.809 -2.546 1.00 0.00 H new ATOM 1158 N ASP A 790 14.832 -2.306 -4.356 1.00 0.00 N ATOM 1159 CA ASP A 790 13.745 -1.505 -4.884 1.00 0.00 C ATOM 1160 C ASP A 790 12.438 -2.231 -4.646 1.00 0.00 C ATOM 1161 O ASP A 790 12.306 -3.413 -4.980 1.00 0.00 O ATOM 1162 CB ASP A 790 13.907 -1.234 -6.380 1.00 0.00 C ATOM 1163 CG ASP A 790 15.237 -0.616 -6.752 1.00 0.00 C ATOM 1164 OD1 ASP A 790 16.223 -1.366 -6.897 1.00 0.00 O ATOM 1165 OD2 ASP A 790 15.289 0.616 -6.948 1.00 0.00 O ATOM 0 H ASP A 790 15.036 -3.153 -4.887 1.00 0.00 H new ATOM 0 HA ASP A 790 13.754 -0.544 -4.370 1.00 0.00 H new ATOM 0 HB2 ASP A 790 13.789 -2.171 -6.924 1.00 0.00 H new ATOM 0 HB3 ASP A 790 13.106 -0.572 -6.708 1.00 0.00 H new ATOM 1170 N TYR A 791 11.485 -1.535 -4.066 1.00 0.00 N ATOM 1171 CA TYR A 791 10.205 -2.128 -3.733 1.00 0.00 C ATOM 1172 C TYR A 791 9.084 -1.247 -4.256 1.00 0.00 C ATOM 1173 O TYR A 791 9.219 -0.032 -4.297 1.00 0.00 O ATOM 1174 CB TYR A 791 10.092 -2.294 -2.214 1.00 0.00 C ATOM 1175 CG TYR A 791 11.284 -2.998 -1.601 1.00 0.00 C ATOM 1176 CD1 TYR A 791 12.357 -2.276 -1.091 1.00 0.00 C ATOM 1177 CD2 TYR A 791 11.346 -4.381 -1.550 1.00 0.00 C ATOM 1178 CE1 TYR A 791 13.458 -2.916 -0.549 1.00 0.00 C ATOM 1179 CE2 TYR A 791 12.440 -5.028 -1.006 1.00 0.00 C ATOM 1180 CZ TYR A 791 13.493 -4.292 -0.509 1.00 0.00 C ATOM 1181 OH TYR A 791 14.587 -4.938 0.031 1.00 0.00 O ATOM 0 H TYR A 791 11.572 -0.551 -3.813 1.00 0.00 H new ATOM 0 HA TYR A 791 10.126 -3.110 -4.198 1.00 0.00 H new ATOM 0 HB2 TYR A 791 9.983 -1.312 -1.755 1.00 0.00 H new ATOM 0 HB3 TYR A 791 9.187 -2.856 -1.983 1.00 0.00 H new ATOM 0 HD1 TYR A 791 12.331 -1.197 -1.118 1.00 0.00 H new ATOM 0 HD2 TYR A 791 10.526 -4.964 -1.942 1.00 0.00 H new ATOM 0 HE1 TYR A 791 14.284 -2.340 -0.160 1.00 0.00 H new ATOM 0 HE2 TYR A 791 12.469 -6.107 -0.971 1.00 0.00 H new ATOM 0 HH TYR A 791 15.158 -4.287 0.490 1.00 0.00 H new ATOM 1191 N ILE A 792 7.996 -1.854 -4.685 1.00 0.00 N ATOM 1192 CA ILE A 792 6.851 -1.103 -5.150 1.00 0.00 C ATOM 1193 C ILE A 792 5.628 -1.499 -4.357 1.00 0.00 C ATOM 1194 O ILE A 792 5.270 -2.671 -4.291 1.00 0.00 O ATOM 1195 CB ILE A 792 6.610 -1.330 -6.654 1.00 0.00 C ATOM 1196 CG1 ILE A 792 7.756 -0.725 -7.461 1.00 0.00 C ATOM 1197 CG2 ILE A 792 5.286 -0.714 -7.075 1.00 0.00 C ATOM 1198 CD1 ILE A 792 8.035 -1.443 -8.756 1.00 0.00 C ATOM 0 H ILE A 792 7.882 -2.867 -4.721 1.00 0.00 H new ATOM 0 HA ILE A 792 7.050 -0.042 -5.001 1.00 0.00 H new ATOM 0 HB ILE A 792 6.569 -2.402 -6.847 1.00 0.00 H new ATOM 0 HG12 ILE A 792 7.524 0.318 -7.678 1.00 0.00 H new ATOM 0 HG13 ILE A 792 8.660 -0.731 -6.851 1.00 0.00 H new ATOM 0 HG21 ILE A 792 5.129 -0.882 -8.140 1.00 0.00 H new ATOM 0 HG22 ILE A 792 4.475 -1.175 -6.511 1.00 0.00 H new ATOM 0 HG23 ILE A 792 5.303 0.357 -6.876 1.00 0.00 H new ATOM 0 HD11 ILE A 792 8.862 -0.955 -9.272 1.00 0.00 H new ATOM 0 HD12 ILE A 792 8.299 -2.480 -8.548 1.00 0.00 H new ATOM 0 HD13 ILE A 792 7.146 -1.415 -9.386 1.00 0.00 H new ATOM 1210 N LEU A 793 5.016 -0.523 -3.723 1.00 0.00 N ATOM 1211 CA LEU A 793 3.803 -0.760 -2.989 1.00 0.00 C ATOM 1212 C LEU A 793 2.615 -0.570 -3.927 1.00 0.00 C ATOM 1213 O LEU A 793 2.372 0.524 -4.433 1.00 0.00 O ATOM 1214 CB LEU A 793 3.711 0.166 -1.769 1.00 0.00 C ATOM 1215 CG LEU A 793 2.476 -0.041 -0.884 1.00 0.00 C ATOM 1216 CD1 LEU A 793 1.982 -1.450 -0.971 1.00 0.00 C ATOM 1217 CD2 LEU A 793 2.724 0.373 0.559 1.00 0.00 C ATOM 0 H LEU A 793 5.343 0.443 -3.704 1.00 0.00 H new ATOM 0 HA LEU A 793 3.797 -1.782 -2.611 1.00 0.00 H new ATOM 0 HB2 LEU A 793 4.603 0.026 -1.159 1.00 0.00 H new ATOM 0 HB3 LEU A 793 3.721 1.199 -2.116 1.00 0.00 H new ATOM 0 HG LEU A 793 1.694 0.615 -1.268 1.00 0.00 H new ATOM 0 HD11 LEU A 793 1.106 -1.568 -0.334 1.00 0.00 H new ATOM 0 HD12 LEU A 793 1.714 -1.679 -2.003 1.00 0.00 H new ATOM 0 HD13 LEU A 793 2.766 -2.131 -0.640 1.00 0.00 H new ATOM 0 HD21 LEU A 793 1.820 0.207 1.145 1.00 0.00 H new ATOM 0 HD22 LEU A 793 3.539 -0.221 0.973 1.00 0.00 H new ATOM 0 HD23 LEU A 793 2.991 1.429 0.594 1.00 0.00 H new ATOM 1229 N SER A 794 1.903 -1.654 -4.158 1.00 0.00 N ATOM 1230 CA SER A 794 0.791 -1.684 -5.086 1.00 0.00 C ATOM 1231 C SER A 794 -0.436 -2.268 -4.387 1.00 0.00 C ATOM 1232 O SER A 794 -0.306 -3.071 -3.472 1.00 0.00 O ATOM 1233 CB SER A 794 1.166 -2.526 -6.309 1.00 0.00 C ATOM 1234 OG SER A 794 0.131 -2.526 -7.279 1.00 0.00 O ATOM 0 H SER A 794 2.082 -2.549 -3.702 1.00 0.00 H new ATOM 0 HA SER A 794 0.558 -0.672 -5.418 1.00 0.00 H new ATOM 0 HB2 SER A 794 2.082 -2.136 -6.753 1.00 0.00 H new ATOM 0 HB3 SER A 794 1.374 -3.550 -5.997 1.00 0.00 H new ATOM 0 HG SER A 794 0.403 -3.071 -8.047 1.00 0.00 H new ATOM 1240 N LEU A 795 -1.623 -1.846 -4.790 1.00 0.00 N ATOM 1241 CA LEU A 795 -2.848 -2.333 -4.192 1.00 0.00 C ATOM 1242 C LEU A 795 -3.220 -3.708 -4.730 1.00 0.00 C ATOM 1243 O LEU A 795 -3.261 -3.918 -5.943 1.00 0.00 O ATOM 1244 CB LEU A 795 -3.962 -1.351 -4.466 1.00 0.00 C ATOM 1245 CG LEU A 795 -3.706 0.059 -3.955 1.00 0.00 C ATOM 1246 CD1 LEU A 795 -2.970 0.053 -2.622 1.00 0.00 C ATOM 1247 CD2 LEU A 795 -2.977 0.894 -4.990 1.00 0.00 C ATOM 0 H LEU A 795 -1.761 -1.162 -5.534 1.00 0.00 H new ATOM 0 HA LEU A 795 -2.694 -2.428 -3.117 1.00 0.00 H new ATOM 0 HB2 LEU A 795 -4.133 -1.308 -5.542 1.00 0.00 H new ATOM 0 HB3 LEU A 795 -4.879 -1.727 -4.012 1.00 0.00 H new ATOM 0 HG LEU A 795 -4.677 0.523 -3.781 1.00 0.00 H new ATOM 0 HD11 LEU A 795 -2.807 1.079 -2.292 1.00 0.00 H new ATOM 0 HD12 LEU A 795 -3.567 -0.477 -1.879 1.00 0.00 H new ATOM 0 HD13 LEU A 795 -2.009 -0.448 -2.739 1.00 0.00 H new ATOM 0 HD21 LEU A 795 -2.808 1.896 -4.596 1.00 0.00 H new ATOM 0 HD22 LEU A 795 -2.019 0.430 -5.223 1.00 0.00 H new ATOM 0 HD23 LEU A 795 -3.579 0.957 -5.896 1.00 0.00 H new ATOM 1259 N VAL A 796 -3.512 -4.638 -3.826 1.00 0.00 N ATOM 1260 CA VAL A 796 -3.825 -6.007 -4.216 1.00 0.00 C ATOM 1261 C VAL A 796 -5.314 -6.178 -4.457 1.00 0.00 C ATOM 1262 O VAL A 796 -5.742 -6.546 -5.551 1.00 0.00 O ATOM 1263 CB VAL A 796 -3.383 -7.014 -3.133 1.00 0.00 C ATOM 1264 CG1 VAL A 796 -3.804 -8.431 -3.496 1.00 0.00 C ATOM 1265 CG2 VAL A 796 -1.890 -6.941 -2.954 1.00 0.00 C ATOM 0 H VAL A 796 -3.538 -4.468 -2.821 1.00 0.00 H new ATOM 0 HA VAL A 796 -3.279 -6.205 -5.138 1.00 0.00 H new ATOM 0 HB VAL A 796 -3.873 -6.751 -2.195 1.00 0.00 H new ATOM 0 HG11 VAL A 796 -3.479 -9.118 -2.715 1.00 0.00 H new ATOM 0 HG12 VAL A 796 -4.889 -8.475 -3.590 1.00 0.00 H new ATOM 0 HG13 VAL A 796 -3.346 -8.715 -4.443 1.00 0.00 H new ATOM 0 HG21 VAL A 796 -1.580 -7.653 -2.189 1.00 0.00 H new ATOM 0 HG22 VAL A 796 -1.398 -7.184 -3.896 1.00 0.00 H new ATOM 0 HG23 VAL A 796 -1.609 -5.933 -2.647 1.00 0.00 H new ATOM 1275 N SER A 797 -6.095 -5.856 -3.439 1.00 0.00 N ATOM 1276 CA SER A 797 -7.530 -6.089 -3.447 1.00 0.00 C ATOM 1277 C SER A 797 -8.163 -5.430 -2.228 1.00 0.00 C ATOM 1278 O SER A 797 -7.471 -5.105 -1.265 1.00 0.00 O ATOM 1279 CB SER A 797 -7.838 -7.592 -3.440 1.00 0.00 C ATOM 1280 OG SER A 797 -7.569 -8.190 -4.699 1.00 0.00 O ATOM 0 H SER A 797 -5.751 -5.424 -2.581 1.00 0.00 H new ATOM 0 HA SER A 797 -7.946 -5.655 -4.356 1.00 0.00 H new ATOM 0 HB2 SER A 797 -7.242 -8.082 -2.670 1.00 0.00 H new ATOM 0 HB3 SER A 797 -8.885 -7.748 -3.180 1.00 0.00 H new ATOM 0 HG SER A 797 -7.200 -7.517 -5.308 1.00 0.00 H new ATOM 1286 N ILE A 798 -9.459 -5.210 -2.285 1.00 0.00 N ATOM 1287 CA ILE A 798 -10.192 -4.652 -1.162 1.00 0.00 C ATOM 1288 C ILE A 798 -11.467 -5.459 -0.975 1.00 0.00 C ATOM 1289 O ILE A 798 -11.894 -6.151 -1.893 1.00 0.00 O ATOM 1290 CB ILE A 798 -10.535 -3.163 -1.398 1.00 0.00 C ATOM 1291 CG1 ILE A 798 -10.891 -2.465 -0.085 1.00 0.00 C ATOM 1292 CG2 ILE A 798 -11.691 -3.044 -2.375 1.00 0.00 C ATOM 1293 CD1 ILE A 798 -10.735 -0.958 -0.134 1.00 0.00 C ATOM 0 H ILE A 798 -10.034 -5.410 -3.104 1.00 0.00 H new ATOM 0 HA ILE A 798 -9.572 -4.706 -0.267 1.00 0.00 H new ATOM 0 HB ILE A 798 -9.655 -2.675 -1.817 1.00 0.00 H new ATOM 0 HG12 ILE A 798 -11.921 -2.706 0.177 1.00 0.00 H new ATOM 0 HG13 ILE A 798 -10.259 -2.861 0.710 1.00 0.00 H new ATOM 0 HG21 ILE A 798 -11.925 -1.992 -2.535 1.00 0.00 H new ATOM 0 HG22 ILE A 798 -11.414 -3.502 -3.324 1.00 0.00 H new ATOM 0 HG23 ILE A 798 -12.565 -3.553 -1.968 1.00 0.00 H new ATOM 0 HD11 ILE A 798 -11.005 -0.533 0.832 1.00 0.00 H new ATOM 0 HD12 ILE A 798 -9.700 -0.707 -0.364 1.00 0.00 H new ATOM 0 HD13 ILE A 798 -11.388 -0.550 -0.905 1.00 0.00 H new ATOM 1305 N LYS A 799 -12.066 -5.390 0.194 1.00 0.00 N ATOM 1306 CA LYS A 799 -13.293 -6.117 0.442 1.00 0.00 C ATOM 1307 C LYS A 799 -14.331 -5.211 1.079 1.00 0.00 C ATOM 1308 O LYS A 799 -14.090 -4.597 2.121 1.00 0.00 O ATOM 1309 CB LYS A 799 -13.017 -7.363 1.294 1.00 0.00 C ATOM 1310 CG LYS A 799 -14.228 -7.935 2.012 1.00 0.00 C ATOM 1311 CD LYS A 799 -14.248 -7.467 3.460 1.00 0.00 C ATOM 1312 CE LYS A 799 -15.197 -8.277 4.311 1.00 0.00 C ATOM 1313 NZ LYS A 799 -15.032 -7.971 5.754 1.00 0.00 N ATOM 0 H LYS A 799 -11.726 -4.841 0.984 1.00 0.00 H new ATOM 0 HA LYS A 799 -13.700 -6.457 -0.510 1.00 0.00 H new ATOM 0 HB2 LYS A 799 -12.596 -8.137 0.652 1.00 0.00 H new ATOM 0 HB3 LYS A 799 -12.258 -7.116 2.036 1.00 0.00 H new ATOM 0 HG2 LYS A 799 -15.142 -7.620 1.508 1.00 0.00 H new ATOM 0 HG3 LYS A 799 -14.202 -9.024 1.974 1.00 0.00 H new ATOM 0 HD2 LYS A 799 -13.243 -7.535 3.875 1.00 0.00 H new ATOM 0 HD3 LYS A 799 -14.537 -6.417 3.496 1.00 0.00 H new ATOM 0 HE2 LYS A 799 -16.224 -8.070 4.010 1.00 0.00 H new ATOM 0 HE3 LYS A 799 -15.023 -9.339 4.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 799 -15.699 -8.545 6.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 799 -14.059 -8.192 6.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 799 -15.223 -6.962 5.919 1.00 0.00 H new ATOM 1327 N ASP A 800 -15.463 -5.110 0.405 1.00 0.00 N ATOM 1328 CA ASP A 800 -16.605 -4.355 0.887 1.00 0.00 C ATOM 1329 C ASP A 800 -17.201 -5.042 2.104 1.00 0.00 C ATOM 1330 O ASP A 800 -17.039 -6.248 2.282 1.00 0.00 O ATOM 1331 CB ASP A 800 -17.652 -4.239 -0.230 1.00 0.00 C ATOM 1332 CG ASP A 800 -18.926 -3.550 0.219 1.00 0.00 C ATOM 1333 OD1 ASP A 800 -19.094 -2.346 -0.059 1.00 0.00 O ATOM 1334 OD2 ASP A 800 -19.762 -4.212 0.860 1.00 0.00 O ATOM 0 H ASP A 800 -15.616 -5.554 -0.500 1.00 0.00 H new ATOM 0 HA ASP A 800 -16.284 -3.354 1.176 1.00 0.00 H new ATOM 0 HB2 ASP A 800 -17.223 -3.687 -1.066 1.00 0.00 H new ATOM 0 HB3 ASP A 800 -17.895 -5.236 -0.597 1.00 0.00 H new ATOM 1339 N SER A 801 -17.908 -4.257 2.913 1.00 0.00 N ATOM 1340 CA SER A 801 -18.428 -4.685 4.207 1.00 0.00 C ATOM 1341 C SER A 801 -19.393 -5.877 4.097 1.00 0.00 C ATOM 1342 O SER A 801 -19.698 -6.520 5.103 1.00 0.00 O ATOM 1343 CB SER A 801 -19.120 -3.497 4.881 1.00 0.00 C ATOM 1344 OG SER A 801 -19.461 -3.781 6.227 1.00 0.00 O ATOM 0 H SER A 801 -18.139 -3.290 2.683 1.00 0.00 H new ATOM 0 HA SER A 801 -17.587 -5.027 4.810 1.00 0.00 H new ATOM 0 HB2 SER A 801 -18.464 -2.627 4.848 1.00 0.00 H new ATOM 0 HB3 SER A 801 -20.021 -3.238 4.325 1.00 0.00 H new ATOM 0 HG SER A 801 -19.604 -4.745 6.332 1.00 0.00 H new ATOM 1350 N THR A 802 -19.864 -6.183 2.889 1.00 0.00 N ATOM 1351 CA THR A 802 -20.730 -7.342 2.685 1.00 0.00 C ATOM 1352 C THR A 802 -19.880 -8.571 2.362 1.00 0.00 C ATOM 1353 O THR A 802 -20.393 -9.676 2.167 1.00 0.00 O ATOM 1354 CB THR A 802 -21.758 -7.097 1.552 1.00 0.00 C ATOM 1355 OG1 THR A 802 -22.691 -8.186 1.480 1.00 0.00 O ATOM 1356 CG2 THR A 802 -21.064 -6.941 0.205 1.00 0.00 C ATOM 0 H THR A 802 -19.662 -5.649 2.043 1.00 0.00 H new ATOM 0 HA THR A 802 -21.287 -7.511 3.607 1.00 0.00 H new ATOM 0 HB THR A 802 -22.290 -6.174 1.782 1.00 0.00 H new ATOM 0 HG1 THR A 802 -22.240 -9.020 1.729 1.00 0.00 H new ATOM 0 HG21 THR A 802 -21.810 -6.770 -0.571 1.00 0.00 H new ATOM 0 HG22 THR A 802 -20.380 -6.093 0.244 1.00 0.00 H new ATOM 0 HG23 THR A 802 -20.504 -7.848 -0.023 1.00 0.00 H new ATOM 1364 N GLY A 803 -18.575 -8.356 2.321 1.00 0.00 N ATOM 1365 CA GLY A 803 -17.637 -9.404 1.994 1.00 0.00 C ATOM 1366 C GLY A 803 -17.453 -9.550 0.502 1.00 0.00 C ATOM 1367 O GLY A 803 -17.337 -10.663 -0.014 1.00 0.00 O ATOM 0 H GLY A 803 -18.143 -7.452 2.513 1.00 0.00 H new ATOM 0 HA2 GLY A 803 -16.675 -9.188 2.459 1.00 0.00 H new ATOM 0 HA3 GLY A 803 -17.988 -10.348 2.411 1.00 0.00 H new ATOM 1371 N CYS A 804 -17.419 -8.422 -0.193 1.00 0.00 N ATOM 1372 CA CYS A 804 -17.270 -8.434 -1.642 1.00 0.00 C ATOM 1373 C CYS A 804 -15.902 -7.894 -2.029 1.00 0.00 C ATOM 1374 O CYS A 804 -15.599 -6.728 -1.791 1.00 0.00 O ATOM 1375 CB CYS A 804 -18.375 -7.610 -2.307 1.00 0.00 C ATOM 1376 SG CYS A 804 -18.375 -7.697 -4.114 1.00 0.00 S ATOM 0 H CYS A 804 -17.492 -7.492 0.219 1.00 0.00 H new ATOM 0 HA CYS A 804 -17.356 -9.463 -1.991 1.00 0.00 H new ATOM 0 HB2 CYS A 804 -19.341 -7.953 -1.937 1.00 0.00 H new ATOM 0 HB3 CYS A 804 -18.269 -6.568 -2.004 1.00 0.00 H new ATOM 0 HG CYS A 804 -19.346 -6.971 -4.583 1.00 0.00 H new ATOM 1382 N VAL A 805 -15.077 -8.742 -2.615 1.00 0.00 N ATOM 1383 CA VAL A 805 -13.718 -8.356 -2.955 1.00 0.00 C ATOM 1384 C VAL A 805 -13.665 -7.680 -4.324 1.00 0.00 C ATOM 1385 O VAL A 805 -14.279 -8.140 -5.287 1.00 0.00 O ATOM 1386 CB VAL A 805 -12.763 -9.573 -2.923 1.00 0.00 C ATOM 1387 CG1 VAL A 805 -13.214 -10.649 -3.897 1.00 0.00 C ATOM 1388 CG2 VAL A 805 -11.331 -9.150 -3.216 1.00 0.00 C ATOM 0 H VAL A 805 -15.322 -9.700 -2.865 1.00 0.00 H new ATOM 0 HA VAL A 805 -13.386 -7.641 -2.203 1.00 0.00 H new ATOM 0 HB VAL A 805 -12.795 -9.993 -1.918 1.00 0.00 H new ATOM 0 HG11 VAL A 805 -12.524 -11.492 -3.853 1.00 0.00 H new ATOM 0 HG12 VAL A 805 -14.216 -10.985 -3.629 1.00 0.00 H new ATOM 0 HG13 VAL A 805 -13.226 -10.242 -4.908 1.00 0.00 H new ATOM 0 HG21 VAL A 805 -10.680 -10.024 -3.187 1.00 0.00 H new ATOM 0 HG22 VAL A 805 -11.282 -8.693 -4.204 1.00 0.00 H new ATOM 0 HG23 VAL A 805 -11.004 -8.429 -2.466 1.00 0.00 H new ATOM 1398 N VAL A 806 -12.946 -6.573 -4.387 1.00 0.00 N ATOM 1399 CA VAL A 806 -12.783 -5.820 -5.615 1.00 0.00 C ATOM 1400 C VAL A 806 -11.311 -5.773 -6.010 1.00 0.00 C ATOM 1401 O VAL A 806 -10.443 -5.483 -5.182 1.00 0.00 O ATOM 1402 CB VAL A 806 -13.336 -4.385 -5.466 1.00 0.00 C ATOM 1403 CG1 VAL A 806 -13.019 -3.543 -6.693 1.00 0.00 C ATOM 1404 CG2 VAL A 806 -14.836 -4.426 -5.229 1.00 0.00 C ATOM 0 H VAL A 806 -12.459 -6.172 -3.586 1.00 0.00 H new ATOM 0 HA VAL A 806 -13.349 -6.324 -6.398 1.00 0.00 H new ATOM 0 HB VAL A 806 -12.851 -3.922 -4.606 1.00 0.00 H new ATOM 0 HG11 VAL A 806 -13.421 -2.539 -6.559 1.00 0.00 H new ATOM 0 HG12 VAL A 806 -11.939 -3.487 -6.827 1.00 0.00 H new ATOM 0 HG13 VAL A 806 -13.470 -3.999 -7.574 1.00 0.00 H new ATOM 0 HG21 VAL A 806 -15.216 -3.410 -5.125 1.00 0.00 H new ATOM 0 HG22 VAL A 806 -15.325 -4.912 -6.074 1.00 0.00 H new ATOM 0 HG23 VAL A 806 -15.045 -4.986 -4.318 1.00 0.00 H new ATOM 1414 N GLY A 807 -11.046 -6.084 -7.272 1.00 0.00 N ATOM 1415 CA GLY A 807 -9.684 -6.075 -7.779 1.00 0.00 C ATOM 1416 C GLY A 807 -9.128 -4.671 -7.879 1.00 0.00 C ATOM 1417 O GLY A 807 -9.640 -3.847 -8.639 1.00 0.00 O ATOM 0 H GLY A 807 -11.754 -6.344 -7.959 1.00 0.00 H new ATOM 0 HA2 GLY A 807 -9.049 -6.671 -7.124 1.00 0.00 H new ATOM 0 HA3 GLY A 807 -9.659 -6.546 -8.762 1.00 0.00 H new ATOM 1421 N LEU A 808 -8.086 -4.390 -7.112 1.00 0.00 N ATOM 1422 CA LEU A 808 -7.543 -3.047 -7.034 1.00 0.00 C ATOM 1423 C LEU A 808 -6.555 -2.751 -8.142 1.00 0.00 C ATOM 1424 O LEU A 808 -5.642 -3.532 -8.414 1.00 0.00 O ATOM 1425 CB LEU A 808 -6.886 -2.827 -5.684 1.00 0.00 C ATOM 1426 CG LEU A 808 -7.836 -2.921 -4.504 1.00 0.00 C ATOM 1427 CD1 LEU A 808 -7.159 -2.438 -3.243 1.00 0.00 C ATOM 1428 CD2 LEU A 808 -9.105 -2.155 -4.788 1.00 0.00 C ATOM 0 H LEU A 808 -7.600 -5.077 -6.535 1.00 0.00 H new ATOM 0 HA LEU A 808 -8.379 -2.359 -7.156 1.00 0.00 H new ATOM 0 HB2 LEU A 808 -6.092 -3.562 -5.555 1.00 0.00 H new ATOM 0 HB3 LEU A 808 -6.414 -1.844 -5.678 1.00 0.00 H new ATOM 0 HG LEU A 808 -8.110 -3.965 -4.350 1.00 0.00 H new ATOM 0 HD11 LEU A 808 -7.853 -2.512 -2.406 1.00 0.00 H new ATOM 0 HD12 LEU A 808 -6.282 -3.053 -3.042 1.00 0.00 H new ATOM 0 HD13 LEU A 808 -6.852 -1.400 -3.370 1.00 0.00 H new ATOM 0 HD21 LEU A 808 -9.776 -2.232 -3.932 1.00 0.00 H new ATOM 0 HD22 LEU A 808 -8.865 -1.107 -4.968 1.00 0.00 H new ATOM 0 HD23 LEU A 808 -9.592 -2.572 -5.670 1.00 0.00 H new ATOM 1440 N SER A 809 -6.756 -1.614 -8.785 1.00 0.00 N ATOM 1441 CA SER A 809 -5.828 -1.116 -9.777 1.00 0.00 C ATOM 1442 C SER A 809 -5.819 0.407 -9.750 1.00 0.00 C ATOM 1443 O SER A 809 -6.561 1.061 -10.481 1.00 0.00 O ATOM 1444 CB SER A 809 -6.224 -1.627 -11.163 1.00 0.00 C ATOM 1445 OG SER A 809 -6.286 -3.046 -11.176 1.00 0.00 O ATOM 0 H SER A 809 -7.566 -1.013 -8.632 1.00 0.00 H new ATOM 0 HA SER A 809 -4.825 -1.477 -9.549 1.00 0.00 H new ATOM 0 HB2 SER A 809 -7.192 -1.213 -11.446 1.00 0.00 H new ATOM 0 HB3 SER A 809 -5.502 -1.283 -11.903 1.00 0.00 H new ATOM 0 HG SER A 809 -6.542 -3.354 -12.070 1.00 0.00 H new ATOM 1451 N GLN A 810 -4.993 0.955 -8.873 1.00 0.00 N ATOM 1452 CA GLN A 810 -4.815 2.400 -8.754 1.00 0.00 C ATOM 1453 C GLN A 810 -3.328 2.711 -8.545 1.00 0.00 C ATOM 1454 O GLN A 810 -2.546 1.778 -8.340 1.00 0.00 O ATOM 1455 CB GLN A 810 -5.678 2.951 -7.610 1.00 0.00 C ATOM 1456 CG GLN A 810 -7.166 2.891 -7.910 1.00 0.00 C ATOM 1457 CD GLN A 810 -8.020 3.598 -6.878 1.00 0.00 C ATOM 1458 OE1 GLN A 810 -7.670 3.674 -5.709 1.00 0.00 O ATOM 1459 NE2 GLN A 810 -9.156 4.110 -7.300 1.00 0.00 N ATOM 0 H GLN A 810 -4.425 0.413 -8.222 1.00 0.00 H new ATOM 0 HA GLN A 810 -5.142 2.890 -9.671 1.00 0.00 H new ATOM 0 HB2 GLN A 810 -5.473 2.385 -6.702 1.00 0.00 H new ATOM 0 HB3 GLN A 810 -5.394 3.985 -7.413 1.00 0.00 H new ATOM 0 HG2 GLN A 810 -7.349 3.336 -8.888 1.00 0.00 H new ATOM 0 HG3 GLN A 810 -7.474 1.847 -7.972 1.00 0.00 H new ATOM 0 HE21 GLN A 810 -9.418 4.029 -8.282 1.00 0.00 H new ATOM 0 HE22 GLN A 810 -9.775 4.588 -6.645 1.00 0.00 H new ATOM 1468 N PRO A 811 -2.905 3.996 -8.623 1.00 0.00 N ATOM 1469 CA PRO A 811 -1.482 4.377 -8.535 1.00 0.00 C ATOM 1470 C PRO A 811 -0.708 3.694 -7.405 1.00 0.00 C ATOM 1471 O PRO A 811 -1.173 3.597 -6.266 1.00 0.00 O ATOM 1472 CB PRO A 811 -1.538 5.881 -8.302 1.00 0.00 C ATOM 1473 CG PRO A 811 -2.784 6.316 -8.988 1.00 0.00 C ATOM 1474 CD PRO A 811 -3.765 5.185 -8.828 1.00 0.00 C ATOM 0 HA PRO A 811 -0.947 4.071 -9.434 1.00 0.00 H new ATOM 0 HB2 PRO A 811 -1.567 6.117 -7.238 1.00 0.00 H new ATOM 0 HB3 PRO A 811 -0.662 6.380 -8.716 1.00 0.00 H new ATOM 0 HG2 PRO A 811 -3.172 7.234 -8.546 1.00 0.00 H new ATOM 0 HG3 PRO A 811 -2.597 6.524 -10.042 1.00 0.00 H new ATOM 0 HD2 PRO A 811 -4.429 5.349 -7.980 1.00 0.00 H new ATOM 0 HD3 PRO A 811 -4.396 5.075 -9.710 1.00 0.00 H new ATOM 1482 N ASP A 812 0.487 3.240 -7.748 1.00 0.00 N ATOM 1483 CA ASP A 812 1.379 2.553 -6.819 1.00 0.00 C ATOM 1484 C ASP A 812 2.542 3.456 -6.437 1.00 0.00 C ATOM 1485 O ASP A 812 2.758 4.501 -7.055 1.00 0.00 O ATOM 1486 CB ASP A 812 1.917 1.255 -7.429 1.00 0.00 C ATOM 1487 CG ASP A 812 2.524 1.453 -8.803 1.00 0.00 C ATOM 1488 OD1 ASP A 812 1.771 1.417 -9.799 1.00 0.00 O ATOM 1489 OD2 ASP A 812 3.752 1.641 -8.901 1.00 0.00 O ATOM 0 H ASP A 812 0.872 3.338 -8.688 1.00 0.00 H new ATOM 0 HA ASP A 812 0.804 2.306 -5.926 1.00 0.00 H new ATOM 0 HB2 ASP A 812 2.669 0.832 -6.763 1.00 0.00 H new ATOM 0 HB3 ASP A 812 1.107 0.529 -7.497 1.00 0.00 H new ATOM 1494 N ALA A 813 3.277 3.058 -5.412 1.00 0.00 N ATOM 1495 CA ALA A 813 4.403 3.846 -4.925 1.00 0.00 C ATOM 1496 C ALA A 813 5.689 3.049 -5.026 1.00 0.00 C ATOM 1497 O ALA A 813 5.667 1.826 -4.968 1.00 0.00 O ATOM 1498 CB ALA A 813 4.185 4.267 -3.485 1.00 0.00 C ATOM 0 H ALA A 813 3.116 2.192 -4.898 1.00 0.00 H new ATOM 0 HA ALA A 813 4.480 4.738 -5.547 1.00 0.00 H new ATOM 0 HB1 ALA A 813 5.038 4.854 -3.144 1.00 0.00 H new ATOM 0 HB2 ALA A 813 3.279 4.870 -3.415 1.00 0.00 H new ATOM 0 HB3 ALA A 813 4.080 3.381 -2.859 1.00 0.00 H new ATOM 1504 N LYS A 814 6.807 3.733 -5.163 1.00 0.00 N ATOM 1505 CA LYS A 814 8.082 3.060 -5.226 1.00 0.00 C ATOM 1506 C LYS A 814 8.968 3.485 -4.066 1.00 0.00 C ATOM 1507 O LYS A 814 9.186 4.672 -3.829 1.00 0.00 O ATOM 1508 CB LYS A 814 8.783 3.328 -6.554 1.00 0.00 C ATOM 1509 CG LYS A 814 9.726 2.203 -6.940 1.00 0.00 C ATOM 1510 CD LYS A 814 10.427 2.460 -8.264 1.00 0.00 C ATOM 1511 CE LYS A 814 11.503 3.526 -8.138 1.00 0.00 C ATOM 1512 NZ LYS A 814 12.543 3.156 -7.141 1.00 0.00 N ATOM 0 H LYS A 814 6.856 4.749 -5.232 1.00 0.00 H new ATOM 0 HA LYS A 814 7.897 1.988 -5.152 1.00 0.00 H new ATOM 0 HB2 LYS A 814 8.036 3.459 -7.337 1.00 0.00 H new ATOM 0 HB3 LYS A 814 9.342 4.261 -6.486 1.00 0.00 H new ATOM 0 HG2 LYS A 814 10.473 2.074 -6.156 1.00 0.00 H new ATOM 0 HG3 LYS A 814 9.166 1.270 -7.004 1.00 0.00 H new ATOM 0 HD2 LYS A 814 10.874 1.533 -8.624 1.00 0.00 H new ATOM 0 HD3 LYS A 814 9.694 2.770 -9.009 1.00 0.00 H new ATOM 0 HE2 LYS A 814 11.972 3.683 -9.109 1.00 0.00 H new ATOM 0 HE3 LYS A 814 11.044 4.471 -7.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 814 13.463 3.535 -7.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 814 12.292 3.554 -6.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 814 12.602 2.120 -7.069 1.00 0.00 H new ATOM 1526 N ILE A 815 9.453 2.496 -3.347 1.00 0.00 N ATOM 1527 CA ILE A 815 10.341 2.704 -2.225 1.00 0.00 C ATOM 1528 C ILE A 815 11.720 2.147 -2.570 1.00 0.00 C ATOM 1529 O ILE A 815 11.865 0.958 -2.857 1.00 0.00 O ATOM 1530 CB ILE A 815 9.812 1.998 -0.950 1.00 0.00 C ATOM 1531 CG1 ILE A 815 8.424 2.523 -0.550 1.00 0.00 C ATOM 1532 CG2 ILE A 815 10.790 2.164 0.200 1.00 0.00 C ATOM 1533 CD1 ILE A 815 7.263 1.728 -1.124 1.00 0.00 C ATOM 0 H ILE A 815 9.239 1.515 -3.527 1.00 0.00 H new ATOM 0 HA ILE A 815 10.399 3.774 -2.026 1.00 0.00 H new ATOM 0 HB ILE A 815 9.716 0.937 -1.179 1.00 0.00 H new ATOM 0 HG12 ILE A 815 8.348 2.521 0.537 1.00 0.00 H new ATOM 0 HG13 ILE A 815 8.334 3.560 -0.874 1.00 0.00 H new ATOM 0 HG21 ILE A 815 10.400 1.661 1.085 1.00 0.00 H new ATOM 0 HG22 ILE A 815 11.750 1.726 -0.073 1.00 0.00 H new ATOM 0 HG23 ILE A 815 10.923 3.224 0.414 1.00 0.00 H new ATOM 0 HD11 ILE A 815 6.322 2.167 -0.792 1.00 0.00 H new ATOM 0 HD12 ILE A 815 7.310 1.751 -2.213 1.00 0.00 H new ATOM 0 HD13 ILE A 815 7.323 0.696 -0.780 1.00 0.00 H new ATOM 1545 N GLN A 816 12.718 3.009 -2.569 1.00 0.00 N ATOM 1546 CA GLN A 816 14.076 2.605 -2.873 1.00 0.00 C ATOM 1547 C GLN A 816 14.912 2.606 -1.601 1.00 0.00 C ATOM 1548 O GLN A 816 15.172 3.655 -1.017 1.00 0.00 O ATOM 1549 CB GLN A 816 14.699 3.547 -3.884 1.00 0.00 C ATOM 1550 CG GLN A 816 15.625 2.850 -4.863 1.00 0.00 C ATOM 1551 CD GLN A 816 16.789 2.135 -4.201 1.00 0.00 C ATOM 1552 OE1 GLN A 816 17.280 2.673 -3.104 1.00 0.00 O flip ATOM 1553 NE2 GLN A 816 17.269 1.121 -4.693 1.00 0.00 N flip ATOM 0 H GLN A 816 12.612 4.001 -2.359 1.00 0.00 H new ATOM 0 HA GLN A 816 14.050 1.600 -3.295 1.00 0.00 H new ATOM 0 HB2 GLN A 816 13.906 4.049 -4.439 1.00 0.00 H new ATOM 0 HB3 GLN A 816 15.256 4.320 -3.355 1.00 0.00 H new ATOM 0 HG2 GLN A 816 15.049 2.128 -5.443 1.00 0.00 H new ATOM 0 HG3 GLN A 816 16.015 3.585 -5.567 1.00 0.00 H new ATOM 0 HE21 GLN A 816 16.867 0.727 -5.544 1.00 0.00 H new ATOM 0 HE22 GLN A 816 18.071 0.670 -4.252 1.00 0.00 H new ATOM 1562 N VAL A 817 15.366 1.442 -1.200 1.00 0.00 N ATOM 1563 CA VAL A 817 16.215 1.321 -0.026 1.00 0.00 C ATOM 1564 C VAL A 817 17.646 1.040 -0.469 1.00 0.00 C ATOM 1565 O VAL A 817 17.859 0.400 -1.493 1.00 0.00 O ATOM 1566 CB VAL A 817 15.704 0.196 0.899 1.00 0.00 C ATOM 1567 CG1 VAL A 817 16.312 0.294 2.291 1.00 0.00 C ATOM 1568 CG2 VAL A 817 14.192 0.246 0.969 1.00 0.00 C ATOM 0 H VAL A 817 15.164 0.559 -1.668 1.00 0.00 H new ATOM 0 HA VAL A 817 16.188 2.255 0.535 1.00 0.00 H new ATOM 0 HB VAL A 817 16.014 -0.761 0.480 1.00 0.00 H new ATOM 0 HG11 VAL A 817 15.928 -0.515 2.913 1.00 0.00 H new ATOM 0 HG12 VAL A 817 17.397 0.214 2.221 1.00 0.00 H new ATOM 0 HG13 VAL A 817 16.047 1.252 2.737 1.00 0.00 H new ATOM 0 HG21 VAL A 817 13.832 -0.549 1.622 1.00 0.00 H new ATOM 0 HG22 VAL A 817 13.878 1.212 1.365 1.00 0.00 H new ATOM 0 HG23 VAL A 817 13.777 0.111 -0.030 1.00 0.00 H new ATOM 1578 N ARG A 818 18.626 1.549 0.253 1.00 0.00 N ATOM 1579 CA ARG A 818 20.016 1.316 -0.117 1.00 0.00 C ATOM 1580 C ARG A 818 20.827 0.816 1.054 1.00 0.00 C ATOM 1581 O ARG A 818 20.328 0.700 2.162 1.00 0.00 O ATOM 1582 CB ARG A 818 20.663 2.590 -0.670 1.00 0.00 C ATOM 1583 CG ARG A 818 20.216 2.952 -2.071 1.00 0.00 C ATOM 1584 CD ARG A 818 20.584 1.866 -3.072 1.00 0.00 C ATOM 1585 NE ARG A 818 20.034 2.132 -4.399 1.00 0.00 N ATOM 1586 CZ ARG A 818 20.715 2.695 -5.394 1.00 0.00 C ATOM 1587 NH1 ARG A 818 21.965 3.100 -5.203 1.00 0.00 N ATOM 1588 NH2 ARG A 818 20.141 2.857 -6.580 1.00 0.00 N ATOM 0 H ARG A 818 18.493 2.119 1.088 1.00 0.00 H new ATOM 0 HA ARG A 818 20.010 0.550 -0.893 1.00 0.00 H new ATOM 0 HB2 ARG A 818 20.435 3.420 -0.001 1.00 0.00 H new ATOM 0 HB3 ARG A 818 21.746 2.466 -0.666 1.00 0.00 H new ATOM 0 HG2 ARG A 818 19.137 3.107 -2.081 1.00 0.00 H new ATOM 0 HG3 ARG A 818 20.676 3.894 -2.369 1.00 0.00 H new ATOM 0 HD2 ARG A 818 21.669 1.788 -3.139 1.00 0.00 H new ATOM 0 HD3 ARG A 818 20.217 0.904 -2.714 1.00 0.00 H new ATOM 0 HE ARG A 818 19.064 1.869 -4.574 1.00 0.00 H new ATOM 0 HH11 ARG A 818 22.406 2.980 -4.291 1.00 0.00 H new ATOM 0 HH12 ARG A 818 22.484 3.531 -5.968 1.00 0.00 H new ATOM 0 HH21 ARG A 818 19.179 2.550 -6.727 1.00 0.00 H new ATOM 0 HH22 ARG A 818 20.661 3.288 -7.344 1.00 0.00 H new ATOM 1602 N ARG A 819 22.065 0.468 0.773 1.00 0.00 N ATOM 1603 CA ARG A 819 23.013 0.087 1.795 1.00 0.00 C ATOM 1604 C ARG A 819 24.258 0.954 1.690 1.00 0.00 C ATOM 1605 O ARG A 819 24.872 1.046 0.627 1.00 0.00 O ATOM 1606 CB ARG A 819 23.341 -1.387 1.660 1.00 0.00 C ATOM 1607 CG ARG A 819 24.379 -1.876 2.645 1.00 0.00 C ATOM 1608 CD ARG A 819 24.200 -3.353 2.900 1.00 0.00 C ATOM 1609 NE ARG A 819 25.111 -3.854 3.926 1.00 0.00 N ATOM 1610 CZ ARG A 819 25.305 -5.146 4.183 1.00 0.00 C ATOM 1611 NH1 ARG A 819 24.682 -6.076 3.466 1.00 0.00 N ATOM 1612 NH2 ARG A 819 26.130 -5.508 5.156 1.00 0.00 N ATOM 0 H ARG A 819 22.442 0.442 -0.174 1.00 0.00 H new ATOM 0 HA ARG A 819 22.580 0.245 2.783 1.00 0.00 H new ATOM 0 HB2 ARG A 819 22.427 -1.966 1.793 1.00 0.00 H new ATOM 0 HB3 ARG A 819 23.696 -1.579 0.648 1.00 0.00 H new ATOM 0 HG2 ARG A 819 25.379 -1.685 2.255 1.00 0.00 H new ATOM 0 HG3 ARG A 819 24.291 -1.325 3.581 1.00 0.00 H new ATOM 0 HD2 ARG A 819 23.171 -3.544 3.206 1.00 0.00 H new ATOM 0 HD3 ARG A 819 24.364 -3.902 1.973 1.00 0.00 H new ATOM 0 HE ARG A 819 25.630 -3.172 4.479 1.00 0.00 H new ATOM 0 HH11 ARG A 819 24.051 -5.802 2.713 1.00 0.00 H new ATOM 0 HH12 ARG A 819 24.835 -7.064 3.668 1.00 0.00 H new ATOM 0 HH21 ARG A 819 26.614 -4.798 5.705 1.00 0.00 H new ATOM 0 HH22 ARG A 819 26.281 -6.497 5.355 1.00 0.00 H new ATOM 1626 N ASP A 820 24.609 1.609 2.781 1.00 0.00 N ATOM 1627 CA ASP A 820 25.746 2.512 2.794 1.00 0.00 C ATOM 1628 C ASP A 820 27.040 1.749 3.063 1.00 0.00 C ATOM 1629 O ASP A 820 28.018 1.907 2.335 1.00 99.99 O ATOM 1630 CB ASP A 820 25.532 3.634 3.819 1.00 0.00 C ATOM 1631 CG ASP A 820 25.376 3.136 5.245 1.00 0.00 C ATOM 1632 OD1 ASP A 820 24.477 2.305 5.504 1.00 0.00 O ATOM 1633 OD2 ASP A 820 26.135 3.599 6.123 1.00 0.00 O ATOM 0 H ASP A 820 24.121 1.532 3.673 1.00 0.00 H new ATOM 0 HA ASP A 820 25.834 2.972 1.810 1.00 0.00 H new ATOM 0 HB2 ASP A 820 26.377 4.321 3.774 1.00 0.00 H new ATOM 0 HB3 ASP A 820 24.644 4.202 3.543 1.00 0.00 H new TER 1638 ASP A 820