USER MOD reduce.3.24.130724 H: found=0, std=0, add=836, rem=0, adj=30 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 802 THR OG1 : rot -93:sc= 2.31 USER MOD Set 1.2: A 804 CYS SG : rot 80:sc= 1.2 USER MOD Set 2.1: A 739 SER OG : rot -67:sc= 0.503 USER MOD Set 2.2: A 782 THR OG1 : rot 117:sc= 3.03 USER MOD Set 3.1: A 778 TYR OH : rot 180:sc= 0.00347 USER MOD Set 3.2: A 781 LYS NZ :NH3+ 143:sc= 1.25 (180deg=1.11) USER MOD Set 4.1: A 748 GLN : amide:sc= -0.279 X(o=0.09,f=0.3) USER MOD Set 4.2: A 776 ASN : amide:sc= 0.369 X(o=0.09,f=-0.34) USER MOD Set 5.1: A 732 LYS NZ :NH3+ 155:sc= 1.27 (180deg=0) USER MOD Set 5.2: A 816 GLN : amide:sc= 0.489 K(o=1.8,f=-12!) USER MOD Set 6.1: A 722 SER OG : rot 160:sc= 0.671 USER MOD Set 6.2: A 810 GLN : amide:sc= -4.27! C(o=-3.6!,f=-3.2!) USER MOD Single : A 720 LYS NZ :NH3+ 169:sc= -0.0135 (180deg=-0.145) USER MOD Single : A 724 SER OG : rot 180:sc= 0 USER MOD Single : A 726 LYS NZ :NH3+ -137:sc= 1.23 (180deg=0.54) USER MOD Single : A 728 HIS : no HD1:sc= -0.0642 X(o=-0.064,f=-0.064) USER MOD Single : A 729 HIS : no HD1:sc= -0.0909 X(o=-0.091,f=-0.014) USER MOD Single : A 734 CYS SG : rot 180:sc= 0 USER MOD Single : A 738 HIS : no HD1:sc=-0.00224 X(o=-0.0022,f=0) USER MOD Single : A 740 SER OG : rot 180:sc= 0 USER MOD Single : A 746 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 752 THR OG1 : rot 180:sc= 0 USER MOD Single : A 754 THR OG1 : rot -112:sc= 0.862 USER MOD Single : A 755 TYR OH : rot -83:sc= 0.485 USER MOD Single : A 760 THR OG1 : rot -7:sc= 0.408! USER MOD Single : A 762 SER OG : rot 180:sc= 0.32 USER MOD Single : A 763 SER OG : rot 180:sc= 0 USER MOD Single : A 764 LYS NZ :NH3+ 169:sc= -0.0368 (180deg=-0.23) USER MOD Single : A 766 LYS NZ :NH3+ -165:sc= -0.0303 (180deg=-0.294) USER MOD Single : A 767 THR OG1 : rot 180:sc= 0 USER MOD Single : A 771 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 774 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 775 THR OG1 : rot 180:sc= 0 USER MOD Single : A 786 THR OG1 : rot 180:sc= 0.00303 USER MOD Single : A 787 THR OG1 : rot 180:sc= -0.0853 USER MOD Single : A 791 TYR OH : rot 180:sc= 0 USER MOD Single : A 794 SER OG : rot 180:sc= 0 USER MOD Single : A 797 SER OG : rot 1:sc= 0.989 USER MOD Single : A 799 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 801 SER OG : rot -45:sc= 0.831 USER MOD Single : A 809 SER OG : rot 180:sc= -0.0179 USER MOD Single : A 814 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 718 -23.294 2.218 -2.907 1.00 0.00 N ATOM 2 CA ARG A 718 -22.270 1.418 -3.544 1.00 0.00 C ATOM 3 C ARG A 718 -21.165 2.281 -4.074 1.00 0.00 C ATOM 4 O ARG A 718 -21.388 3.354 -4.641 1.00 0.00 O ATOM 5 CB ARG A 718 -22.833 0.545 -4.656 1.00 0.00 C ATOM 6 CG ARG A 718 -23.730 -0.557 -4.139 1.00 0.00 C ATOM 7 CD ARG A 718 -23.007 -1.471 -3.164 1.00 0.00 C ATOM 8 NE ARG A 718 -21.739 -1.971 -3.696 1.00 0.00 N ATOM 9 CZ ARG A 718 -20.691 -2.281 -2.935 1.00 0.00 C ATOM 10 NH1 ARG A 718 -20.755 -2.118 -1.619 1.00 0.00 N ATOM 11 NH2 ARG A 718 -19.576 -2.744 -3.490 1.00 0.00 N ATOM 0 HA ARG A 718 -21.865 0.758 -2.777 1.00 0.00 H new ATOM 0 HB2 ARG A 718 -23.395 1.168 -5.352 1.00 0.00 H new ATOM 0 HB3 ARG A 718 -22.009 0.104 -5.217 1.00 0.00 H new ATOM 0 HG2 ARG A 718 -24.598 -0.117 -3.648 1.00 0.00 H new ATOM 0 HG3 ARG A 718 -24.103 -1.145 -4.978 1.00 0.00 H new ATOM 0 HD2 ARG A 718 -22.820 -0.931 -2.236 1.00 0.00 H new ATOM 0 HD3 ARG A 718 -23.651 -2.315 -2.917 1.00 0.00 H new ATOM 0 HE ARG A 718 -21.653 -2.089 -4.706 1.00 0.00 H new ATOM 0 HH11 ARG A 718 -21.607 -1.755 -1.191 1.00 0.00 H new ATOM 0 HH12 ARG A 718 -19.952 -2.355 -1.036 1.00 0.00 H new ATOM 0 HH21 ARG A 718 -19.521 -2.863 -4.502 1.00 0.00 H new ATOM 0 HH22 ARG A 718 -18.775 -2.981 -2.904 1.00 0.00 H new ATOM 25 N VAL A 719 -19.977 1.779 -3.882 1.00 0.00 N ATOM 26 CA VAL A 719 -18.772 2.488 -4.222 1.00 0.00 C ATOM 27 C VAL A 719 -17.751 1.527 -4.764 1.00 0.00 C ATOM 28 O VAL A 719 -17.819 0.322 -4.517 1.00 0.00 O ATOM 29 CB VAL A 719 -18.158 3.225 -3.011 1.00 0.00 C ATOM 30 CG1 VAL A 719 -18.878 4.538 -2.765 1.00 0.00 C ATOM 31 CG2 VAL A 719 -18.193 2.350 -1.764 1.00 0.00 C ATOM 0 H VAL A 719 -19.815 0.855 -3.480 1.00 0.00 H new ATOM 0 HA VAL A 719 -19.044 3.232 -4.971 1.00 0.00 H new ATOM 0 HB VAL A 719 -17.115 3.442 -3.240 1.00 0.00 H new ATOM 0 HG11 VAL A 719 -18.432 5.043 -1.908 1.00 0.00 H new ATOM 0 HG12 VAL A 719 -18.789 5.172 -3.647 1.00 0.00 H new ATOM 0 HG13 VAL A 719 -19.931 4.343 -2.563 1.00 0.00 H new ATOM 0 HG21 VAL A 719 -17.755 2.893 -0.926 1.00 0.00 H new ATOM 0 HG22 VAL A 719 -19.226 2.092 -1.529 1.00 0.00 H new ATOM 0 HG23 VAL A 719 -17.623 1.438 -1.943 1.00 0.00 H new ATOM 41 N LYS A 720 -16.826 2.064 -5.513 1.00 0.00 N ATOM 42 CA LYS A 720 -15.703 1.293 -6.002 1.00 0.00 C ATOM 43 C LYS A 720 -14.525 1.505 -5.066 1.00 0.00 C ATOM 44 O LYS A 720 -13.811 2.497 -5.181 1.00 0.00 O ATOM 45 CB LYS A 720 -15.327 1.714 -7.422 1.00 0.00 C ATOM 46 CG LYS A 720 -16.472 1.618 -8.417 1.00 0.00 C ATOM 47 CD LYS A 720 -16.053 2.087 -9.803 1.00 0.00 C ATOM 48 CE LYS A 720 -14.933 1.232 -10.380 1.00 0.00 C ATOM 49 NZ LYS A 720 -15.345 -0.185 -10.549 1.00 0.00 N ATOM 0 H LYS A 720 -16.824 3.042 -5.803 1.00 0.00 H new ATOM 0 HA LYS A 720 -15.976 0.238 -6.029 1.00 0.00 H new ATOM 0 HB2 LYS A 720 -14.962 2.741 -7.401 1.00 0.00 H new ATOM 0 HB3 LYS A 720 -14.504 1.090 -7.769 1.00 0.00 H new ATOM 0 HG2 LYS A 720 -16.821 0.587 -8.472 1.00 0.00 H new ATOM 0 HG3 LYS A 720 -17.310 2.220 -8.067 1.00 0.00 H new ATOM 0 HD2 LYS A 720 -16.913 2.057 -10.471 1.00 0.00 H new ATOM 0 HD3 LYS A 720 -15.726 3.126 -9.751 1.00 0.00 H new ATOM 0 HE2 LYS A 720 -14.627 1.638 -11.344 1.00 0.00 H new ATOM 0 HE3 LYS A 720 -14.064 1.281 -9.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 720 -14.630 -0.690 -11.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 720 -15.433 -0.635 -9.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 720 -16.261 -0.224 -11.040 1.00 0.00 H new ATOM 63 N PRO A 721 -14.309 0.588 -4.120 1.00 0.00 N ATOM 64 CA PRO A 721 -13.321 0.776 -3.076 1.00 0.00 C ATOM 65 C PRO A 721 -11.926 0.356 -3.526 1.00 0.00 C ATOM 66 O PRO A 721 -11.772 -0.579 -4.316 1.00 0.00 O ATOM 67 CB PRO A 721 -13.853 -0.102 -1.947 1.00 0.00 C ATOM 68 CG PRO A 721 -14.655 -1.182 -2.610 1.00 0.00 C ATOM 69 CD PRO A 721 -14.968 -0.724 -4.016 1.00 0.00 C ATOM 0 HA PRO A 721 -13.198 1.819 -2.783 1.00 0.00 H new ATOM 0 HB2 PRO A 721 -13.036 -0.525 -1.363 1.00 0.00 H new ATOM 0 HB3 PRO A 721 -14.470 0.477 -1.260 1.00 0.00 H new ATOM 0 HG2 PRO A 721 -14.096 -2.117 -2.628 1.00 0.00 H new ATOM 0 HG3 PRO A 721 -15.574 -1.371 -2.056 1.00 0.00 H new ATOM 0 HD2 PRO A 721 -14.583 -1.423 -4.758 1.00 0.00 H new ATOM 0 HD3 PRO A 721 -16.043 -0.645 -4.180 1.00 0.00 H new ATOM 77 N SER A 722 -10.918 1.056 -3.020 1.00 0.00 N ATOM 78 CA SER A 722 -9.550 0.891 -3.483 1.00 0.00 C ATOM 79 C SER A 722 -8.619 1.787 -2.663 1.00 0.00 C ATOM 80 O SER A 722 -8.943 2.156 -1.537 1.00 0.00 O ATOM 81 CB SER A 722 -9.489 1.251 -4.974 1.00 0.00 C ATOM 82 OG SER A 722 -8.218 0.971 -5.538 1.00 0.00 O ATOM 0 H SER A 722 -11.027 1.750 -2.281 1.00 0.00 H new ATOM 0 HA SER A 722 -9.226 -0.142 -3.354 1.00 0.00 H new ATOM 0 HB2 SER A 722 -10.255 0.694 -5.513 1.00 0.00 H new ATOM 0 HB3 SER A 722 -9.716 2.309 -5.101 1.00 0.00 H new ATOM 0 HG SER A 722 -8.300 0.903 -6.512 1.00 0.00 H new ATOM 88 N ALA A 723 -7.460 2.122 -3.212 1.00 0.00 N ATOM 89 CA ALA A 723 -6.537 3.027 -2.548 1.00 0.00 C ATOM 90 C ALA A 723 -5.746 3.823 -3.577 1.00 0.00 C ATOM 91 O ALA A 723 -5.371 3.283 -4.612 1.00 0.00 O ATOM 92 CB ALA A 723 -5.608 2.242 -1.644 1.00 0.00 C ATOM 0 H ALA A 723 -7.138 1.779 -4.117 1.00 0.00 H new ATOM 0 HA ALA A 723 -7.103 3.730 -1.938 1.00 0.00 H new ATOM 0 HB1 ALA A 723 -4.918 2.926 -1.149 1.00 0.00 H new ATOM 0 HB2 ALA A 723 -6.194 1.711 -0.894 1.00 0.00 H new ATOM 0 HB3 ALA A 723 -5.043 1.524 -2.238 1.00 0.00 H new ATOM 98 N SER A 724 -5.486 5.096 -3.300 1.00 0.00 N ATOM 99 CA SER A 724 -4.760 5.938 -4.239 1.00 0.00 C ATOM 100 C SER A 724 -3.644 6.662 -3.511 1.00 0.00 C ATOM 101 O SER A 724 -3.887 7.607 -2.755 1.00 0.00 O ATOM 102 CB SER A 724 -5.700 6.945 -4.902 1.00 0.00 C ATOM 103 OG SER A 724 -5.046 7.654 -5.943 1.00 0.00 O ATOM 0 H SER A 724 -5.766 5.564 -2.438 1.00 0.00 H new ATOM 0 HA SER A 724 -4.333 5.309 -5.020 1.00 0.00 H new ATOM 0 HB2 SER A 724 -6.569 6.424 -5.304 1.00 0.00 H new ATOM 0 HB3 SER A 724 -6.068 7.649 -4.155 1.00 0.00 H new ATOM 0 HG SER A 724 -5.672 8.289 -6.349 1.00 0.00 H new ATOM 109 N LEU A 725 -2.421 6.207 -3.724 1.00 0.00 N ATOM 110 CA LEU A 725 -1.292 6.708 -2.986 1.00 0.00 C ATOM 111 C LEU A 725 -1.013 8.174 -3.282 1.00 0.00 C ATOM 112 O LEU A 725 -1.260 8.673 -4.378 1.00 0.00 O ATOM 113 CB LEU A 725 -0.072 5.867 -3.295 1.00 0.00 C ATOM 114 CG LEU A 725 -0.325 4.361 -3.330 1.00 0.00 C ATOM 115 CD1 LEU A 725 0.971 3.639 -3.534 1.00 0.00 C ATOM 116 CD2 LEU A 725 -0.989 3.883 -2.054 1.00 0.00 C ATOM 0 H LEU A 725 -2.192 5.486 -4.409 1.00 0.00 H new ATOM 0 HA LEU A 725 -1.530 6.638 -1.925 1.00 0.00 H new ATOM 0 HB2 LEU A 725 0.330 6.176 -4.260 1.00 0.00 H new ATOM 0 HB3 LEU A 725 0.694 6.075 -2.548 1.00 0.00 H new ATOM 0 HG LEU A 725 -1.000 4.147 -4.159 1.00 0.00 H new ATOM 0 HD11 LEU A 725 0.789 2.565 -3.559 1.00 0.00 H new ATOM 0 HD12 LEU A 725 1.418 3.953 -4.477 1.00 0.00 H new ATOM 0 HD13 LEU A 725 1.651 3.873 -2.715 1.00 0.00 H new ATOM 0 HD21 LEU A 725 -1.155 2.807 -2.111 1.00 0.00 H new ATOM 0 HD22 LEU A 725 -0.345 4.106 -1.203 1.00 0.00 H new ATOM 0 HD23 LEU A 725 -1.945 4.392 -1.929 1.00 0.00 H new ATOM 128 N LYS A 726 -0.491 8.836 -2.271 1.00 0.00 N ATOM 129 CA LYS A 726 -0.189 10.258 -2.316 1.00 0.00 C ATOM 130 C LYS A 726 1.300 10.455 -2.569 1.00 0.00 C ATOM 131 O LYS A 726 1.746 11.543 -2.940 1.00 0.00 O ATOM 132 CB LYS A 726 -0.589 10.898 -0.996 1.00 0.00 C ATOM 133 CG LYS A 726 -1.978 10.486 -0.555 1.00 0.00 C ATOM 134 CD LYS A 726 -2.401 11.195 0.713 1.00 0.00 C ATOM 135 CE LYS A 726 -2.658 12.659 0.449 1.00 0.00 C ATOM 136 NZ LYS A 726 -2.954 13.391 1.709 1.00 0.00 N ATOM 0 H LYS A 726 -0.260 8.398 -1.379 1.00 0.00 H new ATOM 0 HA LYS A 726 -0.748 10.729 -3.124 1.00 0.00 H new ATOM 0 HB2 LYS A 726 0.131 10.620 -0.227 1.00 0.00 H new ATOM 0 HB3 LYS A 726 -0.548 11.983 -1.094 1.00 0.00 H new ATOM 0 HG2 LYS A 726 -2.691 10.706 -1.349 1.00 0.00 H new ATOM 0 HG3 LYS A 726 -2.003 9.408 -0.394 1.00 0.00 H new ATOM 0 HD2 LYS A 726 -3.302 10.729 1.112 1.00 0.00 H new ATOM 0 HD3 LYS A 726 -1.625 11.088 1.471 1.00 0.00 H new ATOM 0 HE2 LYS A 726 -1.788 13.102 -0.035 1.00 0.00 H new ATOM 0 HE3 LYS A 726 -3.495 12.765 -0.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 726 -3.750 14.042 1.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 726 -3.204 12.711 2.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 726 -2.116 13.933 2.001 1.00 0.00 H new ATOM 150 N LEU A 727 2.062 9.383 -2.345 1.00 0.00 N ATOM 151 CA LEU A 727 3.498 9.384 -2.589 1.00 0.00 C ATOM 152 C LEU A 727 3.769 9.531 -4.081 1.00 0.00 C ATOM 153 O LEU A 727 3.389 8.670 -4.876 1.00 0.00 O ATOM 154 CB LEU A 727 4.129 8.091 -2.050 1.00 0.00 C ATOM 155 CG LEU A 727 5.637 7.942 -2.280 1.00 0.00 C ATOM 156 CD1 LEU A 727 6.373 9.185 -1.821 1.00 0.00 C ATOM 157 CD2 LEU A 727 6.172 6.718 -1.553 1.00 0.00 C ATOM 0 H LEU A 727 1.700 8.497 -1.992 1.00 0.00 H new ATOM 0 HA LEU A 727 3.948 10.229 -2.067 1.00 0.00 H new ATOM 0 HB2 LEU A 727 3.936 8.033 -0.979 1.00 0.00 H new ATOM 0 HB3 LEU A 727 3.624 7.242 -2.511 1.00 0.00 H new ATOM 0 HG LEU A 727 5.805 7.813 -3.349 1.00 0.00 H new ATOM 0 HD11 LEU A 727 7.442 9.059 -1.993 1.00 0.00 H new ATOM 0 HD12 LEU A 727 6.014 10.048 -2.382 1.00 0.00 H new ATOM 0 HD13 LEU A 727 6.193 9.343 -0.758 1.00 0.00 H new ATOM 0 HD21 LEU A 727 7.244 6.630 -1.729 1.00 0.00 H new ATOM 0 HD22 LEU A 727 5.987 6.820 -0.484 1.00 0.00 H new ATOM 0 HD23 LEU A 727 5.669 5.825 -1.925 1.00 0.00 H new ATOM 169 N HIS A 728 4.426 10.619 -4.458 1.00 0.00 N ATOM 170 CA HIS A 728 4.568 10.962 -5.866 1.00 0.00 C ATOM 171 C HIS A 728 6.015 10.833 -6.341 1.00 0.00 C ATOM 172 O HIS A 728 6.463 11.591 -7.198 1.00 0.00 O ATOM 173 CB HIS A 728 4.063 12.392 -6.094 1.00 0.00 C ATOM 174 CG HIS A 728 3.694 12.696 -7.518 1.00 0.00 C ATOM 175 ND1 HIS A 728 4.375 13.610 -8.294 1.00 0.00 N ATOM 176 CD2 HIS A 728 2.694 12.219 -8.295 1.00 0.00 C ATOM 177 CE1 HIS A 728 3.809 13.681 -9.485 1.00 0.00 C ATOM 178 NE2 HIS A 728 2.788 12.848 -9.512 1.00 0.00 N ATOM 0 H HIS A 728 4.866 11.275 -3.813 1.00 0.00 H new ATOM 0 HA HIS A 728 3.972 10.259 -6.448 1.00 0.00 H new ATOM 0 HB2 HIS A 728 3.193 12.563 -5.461 1.00 0.00 H new ATOM 0 HB3 HIS A 728 4.834 13.093 -5.773 1.00 0.00 H new ATOM 0 HD2 HIS A 728 1.959 11.481 -8.011 1.00 0.00 H new ATOM 0 HE1 HIS A 728 4.129 14.314 -10.299 1.00 0.00 H new ATOM 0 HE2 HIS A 728 2.168 12.695 -10.308 1.00 0.00 H new ATOM 187 N HIS A 729 6.746 9.878 -5.783 1.00 0.00 N ATOM 188 CA HIS A 729 8.137 9.659 -6.172 1.00 0.00 C ATOM 189 C HIS A 729 8.681 8.402 -5.519 1.00 0.00 C ATOM 190 O HIS A 729 8.055 7.844 -4.619 1.00 0.00 O ATOM 191 CB HIS A 729 9.027 10.856 -5.799 1.00 0.00 C ATOM 192 CG HIS A 729 9.059 11.154 -4.335 1.00 0.00 C ATOM 193 ND1 HIS A 729 10.177 10.985 -3.547 1.00 0.00 N ATOM 194 CD2 HIS A 729 8.090 11.614 -3.520 1.00 0.00 C ATOM 195 CE1 HIS A 729 9.889 11.327 -2.304 1.00 0.00 C ATOM 196 NE2 HIS A 729 8.629 11.713 -2.262 1.00 0.00 N ATOM 0 H HIS A 729 6.403 9.243 -5.062 1.00 0.00 H new ATOM 0 HA HIS A 729 8.154 9.544 -7.256 1.00 0.00 H new ATOM 0 HB2 HIS A 729 10.043 10.662 -6.142 1.00 0.00 H new ATOM 0 HB3 HIS A 729 8.674 11.739 -6.332 1.00 0.00 H new ATOM 0 HD2 HIS A 729 7.077 11.859 -3.804 1.00 0.00 H new ATOM 0 HE1 HIS A 729 10.569 11.296 -1.466 1.00 0.00 H new ATOM 0 HE2 HIS A 729 8.135 12.033 -1.429 1.00 0.00 H new ATOM 205 N ASP A 730 9.848 7.975 -5.975 1.00 0.00 N ATOM 206 CA ASP A 730 10.523 6.827 -5.395 1.00 0.00 C ATOM 207 C ASP A 730 11.104 7.195 -4.034 1.00 0.00 C ATOM 208 O ASP A 730 11.826 8.180 -3.889 1.00 0.00 O ATOM 209 CB ASP A 730 11.614 6.300 -6.335 1.00 0.00 C ATOM 210 CG ASP A 730 12.618 7.362 -6.737 1.00 0.00 C ATOM 211 OD1 ASP A 730 13.754 7.337 -6.226 1.00 0.00 O ATOM 212 OD2 ASP A 730 12.275 8.227 -7.573 1.00 0.00 O ATOM 0 H ASP A 730 10.349 8.410 -6.750 1.00 0.00 H new ATOM 0 HA ASP A 730 9.794 6.028 -5.256 1.00 0.00 H new ATOM 0 HB2 ASP A 730 12.139 5.478 -5.848 1.00 0.00 H new ATOM 0 HB3 ASP A 730 11.147 5.893 -7.232 1.00 0.00 H new ATOM 217 N LEU A 731 10.752 6.400 -3.045 1.00 0.00 N ATOM 218 CA LEU A 731 11.098 6.659 -1.659 1.00 0.00 C ATOM 219 C LEU A 731 12.479 6.109 -1.316 1.00 0.00 C ATOM 220 O LEU A 731 12.644 4.915 -1.092 1.00 0.00 O ATOM 221 CB LEU A 731 10.023 6.036 -0.781 1.00 0.00 C ATOM 222 CG LEU A 731 10.151 6.307 0.703 1.00 0.00 C ATOM 223 CD1 LEU A 731 10.395 7.786 0.973 1.00 0.00 C ATOM 224 CD2 LEU A 731 8.902 5.841 1.425 1.00 0.00 C ATOM 0 H LEU A 731 10.211 5.546 -3.180 1.00 0.00 H new ATOM 0 HA LEU A 731 11.143 7.734 -1.486 1.00 0.00 H new ATOM 0 HB2 LEU A 731 9.051 6.398 -1.116 1.00 0.00 H new ATOM 0 HB3 LEU A 731 10.032 4.957 -0.937 1.00 0.00 H new ATOM 0 HG LEU A 731 11.010 5.751 1.078 1.00 0.00 H new ATOM 0 HD11 LEU A 731 10.483 7.950 2.047 1.00 0.00 H new ATOM 0 HD12 LEU A 731 11.317 8.098 0.482 1.00 0.00 H new ATOM 0 HD13 LEU A 731 9.561 8.369 0.584 1.00 0.00 H new ATOM 0 HD21 LEU A 731 9.003 6.040 2.492 1.00 0.00 H new ATOM 0 HD22 LEU A 731 8.036 6.377 1.036 1.00 0.00 H new ATOM 0 HD23 LEU A 731 8.768 4.771 1.266 1.00 0.00 H new ATOM 236 N LYS A 732 13.460 7.001 -1.279 1.00 0.00 N ATOM 237 CA LYS A 732 14.846 6.624 -1.018 1.00 0.00 C ATOM 238 C LYS A 732 15.069 6.367 0.471 1.00 0.00 C ATOM 239 O LYS A 732 14.943 7.278 1.295 1.00 0.00 O ATOM 240 CB LYS A 732 15.778 7.735 -1.499 1.00 0.00 C ATOM 241 CG LYS A 732 15.577 8.114 -2.958 1.00 0.00 C ATOM 242 CD LYS A 732 16.116 7.059 -3.911 1.00 0.00 C ATOM 243 CE LYS A 732 17.627 6.944 -3.816 1.00 0.00 C ATOM 244 NZ LYS A 732 18.196 6.148 -4.934 1.00 0.00 N ATOM 0 H LYS A 732 13.321 8.000 -1.428 1.00 0.00 H new ATOM 0 HA LYS A 732 15.064 5.704 -1.560 1.00 0.00 H new ATOM 0 HB2 LYS A 732 15.625 8.619 -0.879 1.00 0.00 H new ATOM 0 HB3 LYS A 732 16.811 7.418 -1.354 1.00 0.00 H new ATOM 0 HG2 LYS A 732 14.514 8.263 -3.149 1.00 0.00 H new ATOM 0 HG3 LYS A 732 16.072 9.065 -3.155 1.00 0.00 H new ATOM 0 HD2 LYS A 732 15.662 6.095 -3.683 1.00 0.00 H new ATOM 0 HD3 LYS A 732 15.833 7.311 -4.933 1.00 0.00 H new ATOM 0 HE2 LYS A 732 18.067 7.941 -3.820 1.00 0.00 H new ATOM 0 HE3 LYS A 732 17.896 6.480 -2.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 732 19.186 6.427 -5.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 732 18.155 5.136 -4.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 732 17.646 6.322 -5.799 1.00 0.00 H new ATOM 258 N LEU A 733 15.398 5.125 0.808 1.00 0.00 N ATOM 259 CA LEU A 733 15.599 4.729 2.197 1.00 0.00 C ATOM 260 C LEU A 733 17.023 4.235 2.435 1.00 0.00 C ATOM 261 O LEU A 733 17.763 3.963 1.488 1.00 0.00 O ATOM 262 CB LEU A 733 14.628 3.621 2.598 1.00 0.00 C ATOM 263 CG LEU A 733 13.147 3.911 2.363 1.00 0.00 C ATOM 264 CD1 LEU A 733 12.292 2.856 3.043 1.00 0.00 C ATOM 265 CD2 LEU A 733 12.766 5.302 2.850 1.00 0.00 C ATOM 0 H LEU A 733 15.532 4.371 0.134 1.00 0.00 H new ATOM 0 HA LEU A 733 15.417 5.615 2.805 1.00 0.00 H new ATOM 0 HB2 LEU A 733 14.892 2.717 2.049 1.00 0.00 H new ATOM 0 HB3 LEU A 733 14.772 3.405 3.657 1.00 0.00 H new ATOM 0 HG LEU A 733 12.965 3.877 1.289 1.00 0.00 H new ATOM 0 HD11 LEU A 733 11.238 3.074 2.868 1.00 0.00 H new ATOM 0 HD12 LEU A 733 12.532 1.874 2.635 1.00 0.00 H new ATOM 0 HD13 LEU A 733 12.491 2.862 4.115 1.00 0.00 H new ATOM 0 HD21 LEU A 733 11.705 5.474 2.667 1.00 0.00 H new ATOM 0 HD22 LEU A 733 12.967 5.381 3.918 1.00 0.00 H new ATOM 0 HD23 LEU A 733 13.352 6.048 2.314 1.00 0.00 H new ATOM 277 N CYS A 734 17.396 4.138 3.705 1.00 0.00 N ATOM 278 CA CYS A 734 18.683 3.576 4.106 1.00 0.00 C ATOM 279 C CYS A 734 18.493 2.186 4.706 1.00 0.00 C ATOM 280 O CYS A 734 17.379 1.663 4.744 1.00 0.00 O ATOM 281 CB CYS A 734 19.372 4.493 5.119 1.00 0.00 C ATOM 282 SG CYS A 734 19.663 6.172 4.517 1.00 0.00 S ATOM 0 H CYS A 734 16.817 4.446 4.486 1.00 0.00 H new ATOM 0 HA CYS A 734 19.313 3.493 3.220 1.00 0.00 H new ATOM 0 HB2 CYS A 734 18.762 4.543 6.021 1.00 0.00 H new ATOM 0 HB3 CYS A 734 20.326 4.050 5.403 1.00 0.00 H new ATOM 0 HG CYS A 734 20.247 6.871 5.445 1.00 0.00 H new ATOM 288 N LEU A 735 19.583 1.596 5.170 1.00 0.00 N ATOM 289 CA LEU A 735 19.566 0.232 5.678 1.00 0.00 C ATOM 290 C LEU A 735 18.681 0.136 6.913 1.00 0.00 C ATOM 291 O LEU A 735 18.792 0.946 7.835 1.00 0.00 O ATOM 292 CB LEU A 735 20.981 -0.208 6.019 1.00 0.00 C ATOM 293 CG LEU A 735 21.281 -1.711 5.935 1.00 0.00 C ATOM 294 CD1 LEU A 735 22.753 -1.972 6.189 1.00 0.00 C ATOM 295 CD2 LEU A 735 20.441 -2.499 6.917 1.00 0.00 C ATOM 0 H LEU A 735 20.498 2.044 5.206 1.00 0.00 H new ATOM 0 HA LEU A 735 19.161 -0.424 4.908 1.00 0.00 H new ATOM 0 HB2 LEU A 735 21.668 0.313 5.352 1.00 0.00 H new ATOM 0 HB3 LEU A 735 21.205 0.126 7.032 1.00 0.00 H new ATOM 0 HG LEU A 735 21.026 -2.042 4.928 1.00 0.00 H new ATOM 0 HD11 LEU A 735 22.949 -3.042 6.126 1.00 0.00 H new ATOM 0 HD12 LEU A 735 23.350 -1.449 5.441 1.00 0.00 H new ATOM 0 HD13 LEU A 735 23.020 -1.612 7.183 1.00 0.00 H new ATOM 0 HD21 LEU A 735 20.679 -3.559 6.831 1.00 0.00 H new ATOM 0 HD22 LEU A 735 20.654 -2.161 7.931 1.00 0.00 H new ATOM 0 HD23 LEU A 735 19.384 -2.345 6.697 1.00 0.00 H new ATOM 307 N GLY A 736 17.789 -0.841 6.913 1.00 0.00 N ATOM 308 CA GLY A 736 16.960 -1.087 8.076 1.00 0.00 C ATOM 309 C GLY A 736 15.909 -0.021 8.263 1.00 0.00 C ATOM 310 O GLY A 736 15.324 0.109 9.338 1.00 0.00 O ATOM 0 H GLY A 736 17.623 -1.470 6.127 1.00 0.00 H new ATOM 0 HA2 GLY A 736 16.476 -2.058 7.976 1.00 0.00 H new ATOM 0 HA3 GLY A 736 17.589 -1.134 8.965 1.00 0.00 H new ATOM 314 N ASP A 737 15.682 0.757 7.220 1.00 0.00 N ATOM 315 CA ASP A 737 14.669 1.796 7.262 1.00 0.00 C ATOM 316 C ASP A 737 13.292 1.194 7.022 1.00 0.00 C ATOM 317 O ASP A 737 13.163 0.081 6.511 1.00 0.00 O ATOM 318 CB ASP A 737 14.942 2.870 6.204 1.00 0.00 C ATOM 319 CG ASP A 737 14.325 4.212 6.560 1.00 0.00 C ATOM 320 OD1 ASP A 737 14.508 5.181 5.793 1.00 0.00 O ATOM 321 OD2 ASP A 737 13.673 4.309 7.622 1.00 0.00 O ATOM 0 H ASP A 737 16.184 0.689 6.335 1.00 0.00 H new ATOM 0 HA ASP A 737 14.701 2.258 8.249 1.00 0.00 H new ATOM 0 HB2 ASP A 737 16.019 2.990 6.083 1.00 0.00 H new ATOM 0 HB3 ASP A 737 14.549 2.537 5.244 1.00 0.00 H new ATOM 326 N HIS A 738 12.275 1.932 7.403 1.00 0.00 N ATOM 327 CA HIS A 738 10.903 1.568 7.122 1.00 0.00 C ATOM 328 C HIS A 738 10.312 2.699 6.309 1.00 0.00 C ATOM 329 O HIS A 738 10.770 3.834 6.420 1.00 0.00 O ATOM 330 CB HIS A 738 10.112 1.340 8.419 1.00 0.00 C ATOM 331 CG HIS A 738 9.880 2.581 9.232 1.00 0.00 C ATOM 332 ND1 HIS A 738 10.779 3.048 10.165 1.00 0.00 N ATOM 333 CD2 HIS A 738 8.845 3.456 9.241 1.00 0.00 C ATOM 334 CE1 HIS A 738 10.309 4.153 10.712 1.00 0.00 C ATOM 335 NE2 HIS A 738 9.136 4.426 10.169 1.00 0.00 N ATOM 0 H HIS A 738 12.375 2.806 7.919 1.00 0.00 H new ATOM 0 HA HIS A 738 10.856 0.630 6.569 1.00 0.00 H new ATOM 0 HB2 HIS A 738 9.147 0.899 8.169 1.00 0.00 H new ATOM 0 HB3 HIS A 738 10.645 0.613 9.032 1.00 0.00 H new ATOM 0 HD2 HIS A 738 7.955 3.401 8.631 1.00 0.00 H new ATOM 0 HE1 HIS A 738 10.801 4.737 11.476 1.00 0.00 H new ATOM 0 HE2 HIS A 738 8.545 5.224 10.400 1.00 0.00 H new ATOM 344 N SER A 739 9.322 2.422 5.494 1.00 0.00 N ATOM 345 CA SER A 739 8.868 3.442 4.569 1.00 0.00 C ATOM 346 C SER A 739 7.596 4.106 5.059 1.00 0.00 C ATOM 347 O SER A 739 6.877 3.569 5.904 1.00 0.00 O ATOM 348 CB SER A 739 8.669 2.871 3.165 1.00 0.00 C ATOM 349 OG SER A 739 7.329 2.486 2.944 1.00 0.00 O ATOM 0 H SER A 739 8.827 1.531 5.448 1.00 0.00 H new ATOM 0 HA SER A 739 9.648 4.202 4.518 1.00 0.00 H new ATOM 0 HB2 SER A 739 8.961 3.616 2.424 1.00 0.00 H new ATOM 0 HB3 SER A 739 9.323 2.010 3.026 1.00 0.00 H new ATOM 0 HG SER A 739 7.108 1.724 3.520 1.00 0.00 H new ATOM 355 N SER A 740 7.339 5.278 4.515 1.00 0.00 N ATOM 356 CA SER A 740 6.169 6.054 4.846 1.00 0.00 C ATOM 357 C SER A 740 5.521 6.534 3.556 1.00 0.00 C ATOM 358 O SER A 740 5.975 7.496 2.930 1.00 0.00 O ATOM 359 CB SER A 740 6.556 7.239 5.738 1.00 0.00 C ATOM 360 OG SER A 740 5.421 8.004 6.114 1.00 0.00 O ATOM 0 H SER A 740 7.945 5.720 3.824 1.00 0.00 H new ATOM 0 HA SER A 740 5.458 5.440 5.399 1.00 0.00 H new ATOM 0 HB2 SER A 740 7.060 6.872 6.632 1.00 0.00 H new ATOM 0 HB3 SER A 740 7.266 7.876 5.210 1.00 0.00 H new ATOM 0 HG SER A 740 5.703 8.750 6.683 1.00 0.00 H new ATOM 366 N VAL A 741 4.475 5.844 3.155 1.00 0.00 N ATOM 367 CA VAL A 741 3.780 6.149 1.926 1.00 0.00 C ATOM 368 C VAL A 741 2.330 6.494 2.224 1.00 0.00 C ATOM 369 O VAL A 741 1.532 5.641 2.610 1.00 0.00 O ATOM 370 CB VAL A 741 3.882 4.986 0.909 1.00 0.00 C ATOM 371 CG1 VAL A 741 3.719 3.639 1.596 1.00 0.00 C ATOM 372 CG2 VAL A 741 2.859 5.143 -0.209 1.00 0.00 C ATOM 0 H VAL A 741 4.084 5.057 3.672 1.00 0.00 H new ATOM 0 HA VAL A 741 4.259 7.014 1.467 1.00 0.00 H new ATOM 0 HB VAL A 741 4.878 5.023 0.467 1.00 0.00 H new ATOM 0 HG11 VAL A 741 3.795 2.842 0.857 1.00 0.00 H new ATOM 0 HG12 VAL A 741 4.501 3.515 2.345 1.00 0.00 H new ATOM 0 HG13 VAL A 741 2.743 3.593 2.080 1.00 0.00 H new ATOM 0 HG21 VAL A 741 2.954 4.312 -0.908 1.00 0.00 H new ATOM 0 HG22 VAL A 741 1.855 5.148 0.215 1.00 0.00 H new ATOM 0 HG23 VAL A 741 3.036 6.081 -0.735 1.00 0.00 H new ATOM 382 N PRO A 742 1.985 7.770 2.080 1.00 0.00 N ATOM 383 CA PRO A 742 0.639 8.241 2.331 1.00 0.00 C ATOM 384 C PRO A 742 -0.298 7.826 1.210 1.00 0.00 C ATOM 385 O PRO A 742 0.075 7.869 0.042 1.00 0.00 O ATOM 386 CB PRO A 742 0.776 9.768 2.407 1.00 0.00 C ATOM 387 CG PRO A 742 2.224 10.082 2.176 1.00 0.00 C ATOM 388 CD PRO A 742 2.872 8.845 1.635 1.00 0.00 C ATOM 0 HA PRO A 742 0.214 7.822 3.243 1.00 0.00 H new ATOM 0 HB2 PRO A 742 0.151 10.251 1.656 1.00 0.00 H new ATOM 0 HB3 PRO A 742 0.450 10.138 3.379 1.00 0.00 H new ATOM 0 HG2 PRO A 742 2.330 10.909 1.474 1.00 0.00 H new ATOM 0 HG3 PRO A 742 2.703 10.390 3.106 1.00 0.00 H new ATOM 0 HD2 PRO A 742 2.951 8.876 0.548 1.00 0.00 H new ATOM 0 HD3 PRO A 742 3.882 8.718 2.024 1.00 0.00 H new ATOM 396 N VAL A 743 -1.488 7.376 1.564 1.00 0.00 N ATOM 397 CA VAL A 743 -2.484 7.007 0.574 1.00 0.00 C ATOM 398 C VAL A 743 -3.872 7.538 0.924 1.00 0.00 C ATOM 399 O VAL A 743 -4.430 7.232 1.975 1.00 0.00 O ATOM 400 CB VAL A 743 -2.560 5.485 0.375 1.00 0.00 C ATOM 401 CG1 VAL A 743 -2.535 4.766 1.695 1.00 0.00 C ATOM 402 CG2 VAL A 743 -3.787 5.108 -0.433 1.00 0.00 C ATOM 0 H VAL A 743 -1.789 7.257 2.531 1.00 0.00 H new ATOM 0 HA VAL A 743 -2.159 7.470 -0.358 1.00 0.00 H new ATOM 0 HB VAL A 743 -1.680 5.173 -0.187 1.00 0.00 H new ATOM 0 HG11 VAL A 743 -2.590 3.691 1.525 1.00 0.00 H new ATOM 0 HG12 VAL A 743 -1.610 5.003 2.221 1.00 0.00 H new ATOM 0 HG13 VAL A 743 -3.387 5.082 2.298 1.00 0.00 H new ATOM 0 HG21 VAL A 743 -3.820 4.026 -0.561 1.00 0.00 H new ATOM 0 HG22 VAL A 743 -4.684 5.439 0.091 1.00 0.00 H new ATOM 0 HG23 VAL A 743 -3.740 5.588 -1.411 1.00 0.00 H new ATOM 412 N ALA A 744 -4.415 8.346 0.037 1.00 0.00 N ATOM 413 CA ALA A 744 -5.806 8.731 0.108 1.00 0.00 C ATOM 414 C ALA A 744 -6.629 7.640 -0.541 1.00 0.00 C ATOM 415 O ALA A 744 -6.708 7.518 -1.765 1.00 0.00 O ATOM 416 CB ALA A 744 -6.040 10.081 -0.537 1.00 0.00 C ATOM 0 H ALA A 744 -3.906 8.751 -0.749 1.00 0.00 H new ATOM 0 HA ALA A 744 -6.110 8.842 1.149 1.00 0.00 H new ATOM 0 HB1 ALA A 744 -7.096 10.340 -0.466 1.00 0.00 H new ATOM 0 HB2 ALA A 744 -5.446 10.837 -0.024 1.00 0.00 H new ATOM 0 HB3 ALA A 744 -5.746 10.039 -1.586 1.00 0.00 H new ATOM 422 N LEU A 745 -7.204 6.831 0.311 1.00 0.00 N ATOM 423 CA LEU A 745 -7.804 5.581 -0.085 1.00 0.00 C ATOM 424 C LEU A 745 -9.205 5.794 -0.616 1.00 0.00 C ATOM 425 O LEU A 745 -9.777 6.873 -0.478 1.00 0.00 O ATOM 426 CB LEU A 745 -7.812 4.658 1.122 1.00 0.00 C ATOM 427 CG LEU A 745 -6.583 4.824 2.001 1.00 0.00 C ATOM 428 CD1 LEU A 745 -6.982 5.076 3.426 1.00 0.00 C ATOM 429 CD2 LEU A 745 -5.685 3.616 1.906 1.00 0.00 C ATOM 0 H LEU A 745 -7.270 7.023 1.311 1.00 0.00 H new ATOM 0 HA LEU A 745 -7.225 5.131 -0.892 1.00 0.00 H new ATOM 0 HB2 LEU A 745 -8.706 4.851 1.715 1.00 0.00 H new ATOM 0 HB3 LEU A 745 -7.873 3.624 0.782 1.00 0.00 H new ATOM 0 HG LEU A 745 -6.025 5.689 1.642 1.00 0.00 H new ATOM 0 HD11 LEU A 745 -6.088 5.192 4.039 1.00 0.00 H new ATOM 0 HD12 LEU A 745 -7.580 5.985 3.481 1.00 0.00 H new ATOM 0 HD13 LEU A 745 -7.568 4.234 3.794 1.00 0.00 H new ATOM 0 HD21 LEU A 745 -4.813 3.760 2.544 1.00 0.00 H new ATOM 0 HD22 LEU A 745 -6.231 2.730 2.232 1.00 0.00 H new ATOM 0 HD23 LEU A 745 -5.361 3.484 0.874 1.00 0.00 H new ATOM 441 N LYS A 746 -9.753 4.760 -1.217 1.00 0.00 N ATOM 442 CA LYS A 746 -11.044 4.851 -1.850 1.00 0.00 C ATOM 443 C LYS A 746 -11.998 3.816 -1.275 1.00 0.00 C ATOM 444 O LYS A 746 -11.594 2.716 -0.907 1.00 0.00 O ATOM 445 CB LYS A 746 -10.903 4.680 -3.339 1.00 0.00 C ATOM 446 CG LYS A 746 -12.181 4.979 -4.099 1.00 0.00 C ATOM 447 CD LYS A 746 -11.956 5.000 -5.595 1.00 0.00 C ATOM 448 CE LYS A 746 -11.080 6.168 -6.015 1.00 0.00 C ATOM 449 NZ LYS A 746 -10.980 6.287 -7.493 1.00 0.00 N ATOM 0 H LYS A 746 -9.317 3.840 -1.279 1.00 0.00 H new ATOM 0 HA LYS A 746 -11.461 5.838 -1.652 1.00 0.00 H new ATOM 0 HB2 LYS A 746 -10.111 5.336 -3.700 1.00 0.00 H new ATOM 0 HB3 LYS A 746 -10.592 3.658 -3.553 1.00 0.00 H new ATOM 0 HG2 LYS A 746 -12.932 4.228 -3.855 1.00 0.00 H new ATOM 0 HG3 LYS A 746 -12.577 5.942 -3.778 1.00 0.00 H new ATOM 0 HD2 LYS A 746 -11.490 4.065 -5.906 1.00 0.00 H new ATOM 0 HD3 LYS A 746 -12.916 5.063 -6.107 1.00 0.00 H new ATOM 0 HE2 LYS A 746 -11.486 7.092 -5.604 1.00 0.00 H new ATOM 0 HE3 LYS A 746 -10.083 6.043 -5.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 746 -10.373 7.096 -7.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 746 -10.568 5.416 -7.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 746 -11.928 6.432 -7.895 1.00 0.00 H new ATOM 463 N GLY A 747 -13.257 4.178 -1.204 1.00 0.00 N ATOM 464 CA GLY A 747 -14.259 3.292 -0.640 1.00 0.00 C ATOM 465 C GLY A 747 -14.626 3.684 0.772 1.00 0.00 C ATOM 466 O GLY A 747 -13.764 3.761 1.640 1.00 0.00 O ATOM 0 H GLY A 747 -13.616 5.076 -1.528 1.00 0.00 H new ATOM 0 HA2 GLY A 747 -15.152 3.309 -1.265 1.00 0.00 H new ATOM 0 HA3 GLY A 747 -13.884 2.269 -0.647 1.00 0.00 H new ATOM 470 N GLN A 748 -15.904 3.928 1.006 1.00 0.00 N ATOM 471 CA GLN A 748 -16.348 4.419 2.305 1.00 0.00 C ATOM 472 C GLN A 748 -16.997 3.306 3.111 1.00 0.00 C ATOM 473 O GLN A 748 -17.987 2.710 2.681 1.00 0.00 O ATOM 474 CB GLN A 748 -17.326 5.589 2.173 1.00 0.00 C ATOM 475 CG GLN A 748 -16.763 6.829 1.489 1.00 0.00 C ATOM 476 CD GLN A 748 -16.948 6.814 -0.016 1.00 0.00 C ATOM 477 OE1 GLN A 748 -17.978 7.249 -0.528 1.00 0.00 O ATOM 478 NE2 GLN A 748 -15.947 6.346 -0.737 1.00 0.00 N ATOM 0 H GLN A 748 -16.649 3.797 0.322 1.00 0.00 H new ATOM 0 HA GLN A 748 -15.459 4.775 2.826 1.00 0.00 H new ATOM 0 HB2 GLN A 748 -18.200 5.251 1.616 1.00 0.00 H new ATOM 0 HB3 GLN A 748 -17.671 5.868 3.169 1.00 0.00 H new ATOM 0 HG2 GLN A 748 -17.248 7.715 1.900 1.00 0.00 H new ATOM 0 HG3 GLN A 748 -15.700 6.912 1.718 1.00 0.00 H new ATOM 0 HE21 GLN A 748 -15.108 5.993 -0.276 1.00 0.00 H new ATOM 0 HE22 GLN A 748 -16.012 6.337 -1.755 1.00 0.00 H new ATOM 487 N GLY A 749 -16.434 3.035 4.274 1.00 0.00 N ATOM 488 CA GLY A 749 -16.942 1.985 5.125 1.00 0.00 C ATOM 489 C GLY A 749 -15.858 1.019 5.527 1.00 0.00 C ATOM 490 O GLY A 749 -14.708 1.197 5.145 1.00 0.00 O ATOM 0 H GLY A 749 -15.624 3.530 4.648 1.00 0.00 H new ATOM 0 HA2 GLY A 749 -17.388 2.424 6.018 1.00 0.00 H new ATOM 0 HA3 GLY A 749 -17.734 1.447 4.605 1.00 0.00 H new ATOM 494 N PRO A 750 -16.184 -0.004 6.319 1.00 0.00 N ATOM 495 CA PRO A 750 -15.208 -0.996 6.753 1.00 0.00 C ATOM 496 C PRO A 750 -14.768 -1.902 5.607 1.00 0.00 C ATOM 497 O PRO A 750 -15.408 -2.919 5.313 1.00 0.00 O ATOM 498 CB PRO A 750 -15.947 -1.798 7.833 1.00 0.00 C ATOM 499 CG PRO A 750 -17.193 -1.026 8.123 1.00 0.00 C ATOM 500 CD PRO A 750 -17.511 -0.266 6.874 1.00 0.00 C ATOM 0 HA PRO A 750 -14.292 -0.533 7.120 1.00 0.00 H new ATOM 0 HB2 PRO A 750 -16.181 -2.804 7.483 1.00 0.00 H new ATOM 0 HB3 PRO A 750 -15.335 -1.906 8.729 1.00 0.00 H new ATOM 0 HG2 PRO A 750 -18.011 -1.694 8.392 1.00 0.00 H new ATOM 0 HG3 PRO A 750 -17.045 -0.349 8.964 1.00 0.00 H new ATOM 0 HD2 PRO A 750 -18.129 -0.848 6.191 1.00 0.00 H new ATOM 0 HD3 PRO A 750 -18.052 0.656 7.086 1.00 0.00 H new ATOM 508 N PHE A 751 -13.675 -1.525 4.962 1.00 0.00 N ATOM 509 CA PHE A 751 -13.128 -2.295 3.859 1.00 0.00 C ATOM 510 C PHE A 751 -11.791 -2.913 4.239 1.00 0.00 C ATOM 511 O PHE A 751 -10.990 -2.293 4.933 1.00 0.00 O ATOM 512 CB PHE A 751 -12.952 -1.409 2.626 1.00 0.00 C ATOM 513 CG PHE A 751 -14.251 -1.009 1.983 1.00 0.00 C ATOM 514 CD1 PHE A 751 -14.858 0.201 2.279 1.00 0.00 C ATOM 515 CD2 PHE A 751 -14.862 -1.848 1.068 1.00 0.00 C ATOM 516 CE1 PHE A 751 -16.049 0.556 1.676 1.00 0.00 C ATOM 517 CE2 PHE A 751 -16.053 -1.495 0.466 1.00 0.00 C ATOM 518 CZ PHE A 751 -16.646 -0.291 0.770 1.00 0.00 C ATOM 0 H PHE A 751 -13.146 -0.682 5.187 1.00 0.00 H new ATOM 0 HA PHE A 751 -13.831 -3.096 3.628 1.00 0.00 H new ATOM 0 HB2 PHE A 751 -12.405 -0.510 2.910 1.00 0.00 H new ATOM 0 HB3 PHE A 751 -12.341 -1.937 1.894 1.00 0.00 H new ATOM 0 HD1 PHE A 751 -14.396 0.872 2.987 1.00 0.00 H new ATOM 0 HD2 PHE A 751 -14.400 -2.793 0.821 1.00 0.00 H new ATOM 0 HE1 PHE A 751 -16.513 1.501 1.916 1.00 0.00 H new ATOM 0 HE2 PHE A 751 -16.519 -2.163 -0.243 1.00 0.00 H new ATOM 0 HZ PHE A 751 -17.577 -0.012 0.299 1.00 0.00 H new ATOM 528 N THR A 752 -11.548 -4.131 3.784 1.00 0.00 N ATOM 529 CA THR A 752 -10.280 -4.786 4.056 1.00 0.00 C ATOM 530 C THR A 752 -9.316 -4.501 2.927 1.00 0.00 C ATOM 531 O THR A 752 -9.448 -5.030 1.827 1.00 0.00 O ATOM 532 CB THR A 752 -10.437 -6.305 4.275 1.00 0.00 C ATOM 533 OG1 THR A 752 -11.331 -6.546 5.370 1.00 0.00 O ATOM 534 CG2 THR A 752 -9.093 -6.953 4.563 1.00 0.00 C ATOM 0 H THR A 752 -12.205 -4.681 3.230 1.00 0.00 H new ATOM 0 HA THR A 752 -9.884 -4.380 4.987 1.00 0.00 H new ATOM 0 HB THR A 752 -10.844 -6.743 3.364 1.00 0.00 H new ATOM 0 HG1 THR A 752 -11.430 -7.512 5.505 1.00 0.00 H new ATOM 0 HG21 THR A 752 -9.230 -8.024 4.714 1.00 0.00 H new ATOM 0 HG22 THR A 752 -8.422 -6.788 3.720 1.00 0.00 H new ATOM 0 HG23 THR A 752 -8.662 -6.512 5.462 1.00 0.00 H new ATOM 542 N LEU A 753 -8.364 -3.637 3.214 1.00 0.00 N ATOM 543 CA LEU A 753 -7.459 -3.131 2.207 1.00 0.00 C ATOM 544 C LEU A 753 -6.178 -3.945 2.171 1.00 0.00 C ATOM 545 O LEU A 753 -5.410 -3.957 3.132 1.00 0.00 O ATOM 546 CB LEU A 753 -7.139 -1.668 2.492 1.00 0.00 C ATOM 547 CG LEU A 753 -6.189 -1.008 1.492 1.00 0.00 C ATOM 548 CD1 LEU A 753 -6.771 -1.030 0.088 1.00 0.00 C ATOM 549 CD2 LEU A 753 -5.891 0.413 1.916 1.00 0.00 C ATOM 0 H LEU A 753 -8.197 -3.268 4.150 1.00 0.00 H new ATOM 0 HA LEU A 753 -7.943 -3.214 1.234 1.00 0.00 H new ATOM 0 HB2 LEU A 753 -8.072 -1.105 2.510 1.00 0.00 H new ATOM 0 HB3 LEU A 753 -6.702 -1.594 3.488 1.00 0.00 H new ATOM 0 HG LEU A 753 -5.259 -1.576 1.480 1.00 0.00 H new ATOM 0 HD11 LEU A 753 -6.074 -0.554 -0.602 1.00 0.00 H new ATOM 0 HD12 LEU A 753 -6.939 -2.062 -0.220 1.00 0.00 H new ATOM 0 HD13 LEU A 753 -7.718 -0.490 0.078 1.00 0.00 H new ATOM 0 HD21 LEU A 753 -5.214 0.873 1.196 1.00 0.00 H new ATOM 0 HD22 LEU A 753 -6.819 0.983 1.956 1.00 0.00 H new ATOM 0 HD23 LEU A 753 -5.425 0.409 2.901 1.00 0.00 H new ATOM 561 N THR A 754 -5.959 -4.627 1.067 1.00 0.00 N ATOM 562 CA THR A 754 -4.770 -5.430 0.891 1.00 0.00 C ATOM 563 C THR A 754 -3.892 -4.856 -0.212 1.00 0.00 C ATOM 564 O THR A 754 -4.386 -4.492 -1.283 1.00 0.00 O ATOM 565 CB THR A 754 -5.133 -6.868 0.526 1.00 0.00 C ATOM 566 OG1 THR A 754 -6.333 -7.264 1.207 1.00 0.00 O ATOM 567 CG2 THR A 754 -4.004 -7.781 0.924 1.00 0.00 C ATOM 0 H THR A 754 -6.597 -4.640 0.271 1.00 0.00 H new ATOM 0 HA THR A 754 -4.227 -5.420 1.836 1.00 0.00 H new ATOM 0 HB THR A 754 -5.300 -6.933 -0.549 1.00 0.00 H new ATOM 0 HG1 THR A 754 -6.120 -7.950 1.874 1.00 0.00 H new ATOM 0 HG21 THR A 754 -4.259 -8.809 0.665 1.00 0.00 H new ATOM 0 HG22 THR A 754 -3.096 -7.488 0.396 1.00 0.00 H new ATOM 0 HG23 THR A 754 -3.839 -7.708 1.999 1.00 0.00 H new ATOM 575 N TYR A 755 -2.596 -4.770 0.045 1.00 0.00 N ATOM 576 CA TYR A 755 -1.663 -4.266 -0.948 1.00 0.00 C ATOM 577 C TYR A 755 -0.339 -5.018 -0.891 1.00 0.00 C ATOM 578 O TYR A 755 0.016 -5.608 0.135 1.00 0.00 O ATOM 579 CB TYR A 755 -1.432 -2.765 -0.760 1.00 0.00 C ATOM 580 CG TYR A 755 -1.093 -2.366 0.656 1.00 0.00 C ATOM 581 CD1 TYR A 755 0.200 -2.472 1.142 1.00 0.00 C ATOM 582 CD2 TYR A 755 -2.072 -1.872 1.502 1.00 0.00 C ATOM 583 CE1 TYR A 755 0.505 -2.098 2.434 1.00 0.00 C ATOM 584 CE2 TYR A 755 -1.778 -1.498 2.795 1.00 0.00 C ATOM 585 CZ TYR A 755 -0.482 -1.612 3.255 1.00 0.00 C ATOM 586 OH TYR A 755 -0.172 -1.243 4.542 1.00 0.00 O ATOM 0 H TYR A 755 -2.168 -5.042 0.930 1.00 0.00 H new ATOM 0 HA TYR A 755 -2.103 -4.430 -1.932 1.00 0.00 H new ATOM 0 HB2 TYR A 755 -0.624 -2.447 -1.419 1.00 0.00 H new ATOM 0 HB3 TYR A 755 -2.328 -2.228 -1.073 1.00 0.00 H new ATOM 0 HD1 TYR A 755 0.980 -2.853 0.500 1.00 0.00 H new ATOM 0 HD2 TYR A 755 -3.086 -1.778 1.141 1.00 0.00 H new ATOM 0 HE1 TYR A 755 1.518 -2.187 2.799 1.00 0.00 H new ATOM 0 HE2 TYR A 755 -2.555 -1.119 3.443 1.00 0.00 H new ATOM 0 HH TYR A 755 -0.170 -2.036 5.118 1.00 0.00 H new ATOM 596 N ASP A 756 0.378 -4.993 -2.001 1.00 0.00 N ATOM 597 CA ASP A 756 1.647 -5.679 -2.120 1.00 0.00 C ATOM 598 C ASP A 756 2.802 -4.701 -2.102 1.00 0.00 C ATOM 599 O ASP A 756 2.833 -3.734 -2.854 1.00 0.00 O ATOM 600 CB ASP A 756 1.714 -6.527 -3.401 1.00 0.00 C ATOM 601 CG ASP A 756 1.363 -5.769 -4.675 1.00 0.00 C ATOM 602 OD1 ASP A 756 0.200 -5.862 -5.121 1.00 0.00 O ATOM 603 OD2 ASP A 756 2.246 -5.118 -5.262 1.00 0.00 O ATOM 0 H ASP A 756 0.094 -4.495 -2.845 1.00 0.00 H new ATOM 0 HA ASP A 756 1.729 -6.342 -1.259 1.00 0.00 H new ATOM 0 HB2 ASP A 756 2.720 -6.935 -3.500 1.00 0.00 H new ATOM 0 HB3 ASP A 756 1.036 -7.374 -3.298 1.00 0.00 H new ATOM 608 N ILE A 757 3.729 -4.938 -1.201 1.00 0.00 N ATOM 609 CA ILE A 757 5.028 -4.323 -1.281 1.00 0.00 C ATOM 610 C ILE A 757 5.934 -5.306 -1.998 1.00 0.00 C ATOM 611 O ILE A 757 6.517 -6.195 -1.388 1.00 0.00 O ATOM 612 CB ILE A 757 5.593 -3.989 0.120 1.00 0.00 C ATOM 613 CG1 ILE A 757 4.831 -2.826 0.743 1.00 0.00 C ATOM 614 CG2 ILE A 757 7.072 -3.669 0.056 1.00 0.00 C ATOM 615 CD1 ILE A 757 3.546 -3.225 1.431 1.00 0.00 C ATOM 0 H ILE A 757 3.602 -5.557 -0.400 1.00 0.00 H new ATOM 0 HA ILE A 757 4.962 -3.377 -1.819 1.00 0.00 H new ATOM 0 HB ILE A 757 5.464 -4.871 0.747 1.00 0.00 H new ATOM 0 HG12 ILE A 757 5.478 -2.328 1.466 1.00 0.00 H new ATOM 0 HG13 ILE A 757 4.602 -2.098 -0.035 1.00 0.00 H new ATOM 0 HG21 ILE A 757 7.438 -3.439 1.057 1.00 0.00 H new ATOM 0 HG22 ILE A 757 7.613 -4.528 -0.340 1.00 0.00 H new ATOM 0 HG23 ILE A 757 7.230 -2.809 -0.595 1.00 0.00 H new ATOM 0 HD11 ILE A 757 3.066 -2.339 1.847 1.00 0.00 H new ATOM 0 HD12 ILE A 757 2.878 -3.695 0.709 1.00 0.00 H new ATOM 0 HD13 ILE A 757 3.766 -3.929 2.233 1.00 0.00 H new ATOM 627 N ILE A 758 6.038 -5.155 -3.299 1.00 0.00 N ATOM 628 CA ILE A 758 6.702 -6.153 -4.107 1.00 0.00 C ATOM 629 C ILE A 758 8.159 -5.799 -4.347 1.00 0.00 C ATOM 630 O ILE A 758 8.512 -4.631 -4.504 1.00 0.00 O ATOM 631 CB ILE A 758 5.962 -6.374 -5.440 1.00 0.00 C ATOM 632 CG1 ILE A 758 5.801 -5.069 -6.201 1.00 0.00 C ATOM 633 CG2 ILE A 758 4.607 -6.990 -5.198 1.00 0.00 C ATOM 634 CD1 ILE A 758 6.831 -4.907 -7.294 1.00 0.00 C ATOM 0 H ILE A 758 5.674 -4.356 -3.818 1.00 0.00 H new ATOM 0 HA ILE A 758 6.678 -7.089 -3.550 1.00 0.00 H new ATOM 0 HB ILE A 758 6.563 -7.055 -6.042 1.00 0.00 H new ATOM 0 HG12 ILE A 758 4.803 -5.027 -6.637 1.00 0.00 H new ATOM 0 HG13 ILE A 758 5.880 -4.234 -5.505 1.00 0.00 H new ATOM 0 HG21 ILE A 758 4.099 -7.139 -6.151 1.00 0.00 H new ATOM 0 HG22 ILE A 758 4.728 -7.951 -4.698 1.00 0.00 H new ATOM 0 HG23 ILE A 758 4.013 -6.326 -4.570 1.00 0.00 H new ATOM 0 HD11 ILE A 758 6.671 -3.958 -7.807 1.00 0.00 H new ATOM 0 HD12 ILE A 758 7.830 -4.920 -6.858 1.00 0.00 H new ATOM 0 HD13 ILE A 758 6.736 -5.726 -8.008 1.00 0.00 H new ATOM 646 N GLU A 759 9.001 -6.818 -4.366 1.00 0.00 N ATOM 647 CA GLU A 759 10.422 -6.631 -4.504 1.00 0.00 C ATOM 648 C GLU A 759 10.816 -6.670 -5.967 1.00 0.00 C ATOM 649 O GLU A 759 10.943 -7.742 -6.561 1.00 0.00 O ATOM 650 CB GLU A 759 11.174 -7.713 -3.734 1.00 0.00 C ATOM 651 CG GLU A 759 10.672 -7.904 -2.314 1.00 0.00 C ATOM 652 CD GLU A 759 11.769 -8.339 -1.361 1.00 0.00 C ATOM 653 OE1 GLU A 759 11.528 -9.246 -0.538 1.00 0.00 O ATOM 654 OE2 GLU A 759 12.882 -7.776 -1.434 1.00 0.00 O ATOM 0 H GLU A 759 8.713 -7.793 -4.286 1.00 0.00 H new ATOM 0 HA GLU A 759 10.686 -5.657 -4.093 1.00 0.00 H new ATOM 0 HB2 GLU A 759 11.088 -8.657 -4.272 1.00 0.00 H new ATOM 0 HB3 GLU A 759 12.233 -7.458 -3.705 1.00 0.00 H new ATOM 0 HG2 GLU A 759 10.236 -6.971 -1.958 1.00 0.00 H new ATOM 0 HG3 GLU A 759 9.877 -8.649 -2.311 1.00 0.00 H new ATOM 661 N THR A 760 11.032 -5.501 -6.534 1.00 0.00 N ATOM 662 CA THR A 760 11.392 -5.394 -7.936 1.00 0.00 C ATOM 663 C THR A 760 12.898 -5.584 -8.076 1.00 0.00 C ATOM 664 O THR A 760 13.440 -5.697 -9.177 1.00 0.00 O ATOM 665 CB THR A 760 10.921 -4.049 -8.540 1.00 0.00 C ATOM 666 OG1 THR A 760 11.598 -3.768 -9.770 1.00 0.00 O ATOM 667 CG2 THR A 760 11.126 -2.908 -7.561 1.00 0.00 C ATOM 0 H THR A 760 10.965 -4.608 -6.045 1.00 0.00 H new ATOM 0 HA THR A 760 10.884 -6.176 -8.500 1.00 0.00 H new ATOM 0 HB THR A 760 9.855 -4.142 -8.746 1.00 0.00 H new ATOM 0 HG1 THR A 760 12.301 -4.435 -9.917 1.00 0.00 H new ATOM 0 HG21 THR A 760 10.786 -1.976 -8.012 1.00 0.00 H new ATOM 0 HG22 THR A 760 10.555 -3.101 -6.653 1.00 0.00 H new ATOM 0 HG23 THR A 760 12.184 -2.827 -7.313 1.00 0.00 H new ATOM 675 N PHE A 761 13.559 -5.647 -6.924 1.00 0.00 N ATOM 676 CA PHE A 761 14.976 -5.945 -6.845 1.00 0.00 C ATOM 677 C PHE A 761 15.266 -7.344 -7.379 1.00 0.00 C ATOM 678 O PHE A 761 16.316 -7.590 -7.970 1.00 0.00 O ATOM 679 CB PHE A 761 15.427 -5.841 -5.388 1.00 0.00 C ATOM 680 CG PHE A 761 16.907 -5.972 -5.195 1.00 0.00 C ATOM 681 CD1 PHE A 761 17.730 -4.883 -5.394 1.00 0.00 C ATOM 682 CD2 PHE A 761 17.472 -7.177 -4.809 1.00 0.00 C ATOM 683 CE1 PHE A 761 19.095 -4.987 -5.212 1.00 0.00 C ATOM 684 CE2 PHE A 761 18.835 -7.288 -4.627 1.00 0.00 C ATOM 685 CZ PHE A 761 19.649 -6.192 -4.829 1.00 0.00 C ATOM 0 H PHE A 761 13.120 -5.491 -6.017 1.00 0.00 H new ATOM 0 HA PHE A 761 15.524 -5.228 -7.456 1.00 0.00 H new ATOM 0 HB2 PHE A 761 15.103 -4.881 -4.986 1.00 0.00 H new ATOM 0 HB3 PHE A 761 14.926 -6.616 -4.808 1.00 0.00 H new ATOM 0 HD1 PHE A 761 17.302 -3.938 -5.696 1.00 0.00 H new ATOM 0 HD2 PHE A 761 16.839 -8.038 -4.649 1.00 0.00 H new ATOM 0 HE1 PHE A 761 19.728 -4.126 -5.369 1.00 0.00 H new ATOM 0 HE2 PHE A 761 19.265 -8.232 -4.327 1.00 0.00 H new ATOM 0 HZ PHE A 761 20.716 -6.277 -4.688 1.00 0.00 H new ATOM 695 N SER A 762 14.334 -8.262 -7.164 1.00 0.00 N ATOM 696 CA SER A 762 14.506 -9.629 -7.614 1.00 0.00 C ATOM 697 C SER A 762 13.203 -10.200 -8.172 1.00 0.00 C ATOM 698 O SER A 762 12.886 -10.013 -9.350 1.00 0.00 O ATOM 699 CB SER A 762 15.029 -10.492 -6.464 1.00 0.00 C ATOM 700 OG SER A 762 14.254 -10.292 -5.288 1.00 0.00 O ATOM 0 H SER A 762 13.454 -8.082 -6.681 1.00 0.00 H new ATOM 0 HA SER A 762 15.237 -9.635 -8.423 1.00 0.00 H new ATOM 0 HB2 SER A 762 14.999 -11.543 -6.750 1.00 0.00 H new ATOM 0 HB3 SER A 762 16.072 -10.246 -6.264 1.00 0.00 H new ATOM 0 HG SER A 762 14.604 -10.854 -4.566 1.00 0.00 H new ATOM 706 N SER A 763 12.444 -10.869 -7.313 1.00 0.00 N ATOM 707 CA SER A 763 11.180 -11.474 -7.707 1.00 0.00 C ATOM 708 C SER A 763 10.315 -11.774 -6.484 1.00 0.00 C ATOM 709 O SER A 763 9.338 -12.518 -6.567 1.00 0.00 O ATOM 710 CB SER A 763 11.450 -12.757 -8.494 1.00 0.00 C ATOM 711 OG SER A 763 12.366 -13.592 -7.803 1.00 0.00 O ATOM 0 H SER A 763 12.685 -11.006 -6.332 1.00 0.00 H new ATOM 0 HA SER A 763 10.637 -10.771 -8.338 1.00 0.00 H new ATOM 0 HB2 SER A 763 10.515 -13.293 -8.656 1.00 0.00 H new ATOM 0 HB3 SER A 763 11.849 -12.508 -9.477 1.00 0.00 H new ATOM 0 HG SER A 763 12.523 -14.407 -8.324 1.00 0.00 H new ATOM 717 N LYS A 764 10.676 -11.185 -5.354 1.00 0.00 N ATOM 718 CA LYS A 764 9.955 -11.416 -4.110 1.00 0.00 C ATOM 719 C LYS A 764 8.809 -10.426 -3.965 1.00 0.00 C ATOM 720 O LYS A 764 8.656 -9.515 -4.779 1.00 0.00 O ATOM 721 CB LYS A 764 10.902 -11.313 -2.919 1.00 0.00 C ATOM 722 CG LYS A 764 11.992 -12.371 -2.913 1.00 0.00 C ATOM 723 CD LYS A 764 12.878 -12.261 -1.681 1.00 0.00 C ATOM 724 CE LYS A 764 12.082 -12.446 -0.396 1.00 0.00 C ATOM 725 NZ LYS A 764 11.381 -13.758 -0.355 1.00 0.00 N ATOM 0 H LYS A 764 11.464 -10.543 -5.272 1.00 0.00 H new ATOM 0 HA LYS A 764 9.538 -12.423 -4.135 1.00 0.00 H new ATOM 0 HB2 LYS A 764 11.365 -10.326 -2.919 1.00 0.00 H new ATOM 0 HB3 LYS A 764 10.324 -11.394 -1.998 1.00 0.00 H new ATOM 0 HG2 LYS A 764 11.538 -13.361 -2.947 1.00 0.00 H new ATOM 0 HG3 LYS A 764 12.602 -12.269 -3.810 1.00 0.00 H new ATOM 0 HD2 LYS A 764 13.667 -13.012 -1.732 1.00 0.00 H new ATOM 0 HD3 LYS A 764 13.366 -11.286 -1.670 1.00 0.00 H new ATOM 0 HE2 LYS A 764 12.753 -12.367 0.460 1.00 0.00 H new ATOM 0 HE3 LYS A 764 11.352 -11.642 -0.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 764 11.008 -13.923 0.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 764 10.595 -13.753 -1.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 764 12.049 -14.516 -0.602 1.00 0.00 H new ATOM 739 N ARG A 765 8.013 -10.600 -2.922 1.00 0.00 N ATOM 740 CA ARG A 765 6.840 -9.793 -2.711 1.00 0.00 C ATOM 741 C ARG A 765 6.364 -9.887 -1.262 1.00 0.00 C ATOM 742 O ARG A 765 6.475 -10.934 -0.625 1.00 0.00 O ATOM 743 CB ARG A 765 5.740 -10.238 -3.675 1.00 0.00 C ATOM 744 CG ARG A 765 4.354 -9.829 -3.236 1.00 0.00 C ATOM 745 CD ARG A 765 3.347 -9.926 -4.375 1.00 0.00 C ATOM 746 NE ARG A 765 3.171 -11.302 -4.839 1.00 0.00 N ATOM 747 CZ ARG A 765 2.199 -11.701 -5.661 1.00 0.00 C ATOM 748 NH1 ARG A 765 1.308 -10.834 -6.115 1.00 0.00 N ATOM 749 NH2 ARG A 765 2.120 -12.973 -6.025 1.00 0.00 N ATOM 0 H ARG A 765 8.169 -11.306 -2.203 1.00 0.00 H new ATOM 0 HA ARG A 765 7.087 -8.749 -2.907 1.00 0.00 H new ATOM 0 HB2 ARG A 765 5.939 -9.817 -4.661 1.00 0.00 H new ATOM 0 HB3 ARG A 765 5.775 -11.323 -3.778 1.00 0.00 H new ATOM 0 HG2 ARG A 765 4.032 -10.465 -2.411 1.00 0.00 H new ATOM 0 HG3 ARG A 765 4.379 -8.806 -2.859 1.00 0.00 H new ATOM 0 HD2 ARG A 765 2.387 -9.530 -4.044 1.00 0.00 H new ATOM 0 HD3 ARG A 765 3.679 -9.304 -5.206 1.00 0.00 H new ATOM 0 HE ARG A 765 3.836 -12.003 -4.512 1.00 0.00 H new ATOM 0 HH11 ARG A 765 1.362 -9.854 -5.837 1.00 0.00 H new ATOM 0 HH12 ARG A 765 0.567 -11.146 -6.743 1.00 0.00 H new ATOM 0 HH21 ARG A 765 2.802 -13.646 -5.677 1.00 0.00 H new ATOM 0 HH22 ARG A 765 1.377 -13.278 -6.653 1.00 0.00 H new ATOM 763 N LYS A 766 5.859 -8.776 -0.752 1.00 0.00 N ATOM 764 CA LYS A 766 5.268 -8.712 0.566 1.00 0.00 C ATOM 765 C LYS A 766 3.812 -8.317 0.412 1.00 0.00 C ATOM 766 O LYS A 766 3.459 -7.585 -0.500 1.00 0.00 O ATOM 767 CB LYS A 766 6.008 -7.690 1.445 1.00 0.00 C ATOM 768 CG LYS A 766 5.777 -7.873 2.946 1.00 0.00 C ATOM 769 CD LYS A 766 4.464 -7.267 3.416 1.00 0.00 C ATOM 770 CE LYS A 766 4.209 -7.555 4.889 1.00 0.00 C ATOM 771 NZ LYS A 766 4.105 -9.013 5.176 1.00 0.00 N ATOM 0 H LYS A 766 5.850 -7.886 -1.250 1.00 0.00 H new ATOM 0 HA LYS A 766 5.345 -9.684 1.053 1.00 0.00 H new ATOM 0 HB2 LYS A 766 7.077 -7.759 1.242 1.00 0.00 H new ATOM 0 HB3 LYS A 766 5.693 -6.686 1.160 1.00 0.00 H new ATOM 0 HG2 LYS A 766 5.787 -8.937 3.184 1.00 0.00 H new ATOM 0 HG3 LYS A 766 6.600 -7.416 3.495 1.00 0.00 H new ATOM 0 HD2 LYS A 766 4.481 -6.189 3.253 1.00 0.00 H new ATOM 0 HD3 LYS A 766 3.644 -7.667 2.819 1.00 0.00 H new ATOM 0 HE2 LYS A 766 5.016 -7.128 5.484 1.00 0.00 H new ATOM 0 HE3 LYS A 766 3.288 -7.061 5.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 766 3.686 -9.152 6.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 766 3.503 -9.466 4.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 766 5.053 -9.440 5.152 1.00 0.00 H new ATOM 785 N THR A 767 2.975 -8.826 1.273 1.00 0.00 N ATOM 786 CA THR A 767 1.568 -8.491 1.251 1.00 0.00 C ATOM 787 C THR A 767 1.138 -7.952 2.610 1.00 0.00 C ATOM 788 O THR A 767 1.355 -8.597 3.634 1.00 0.00 O ATOM 789 CB THR A 767 0.728 -9.724 0.898 1.00 0.00 C ATOM 790 OG1 THR A 767 1.215 -10.304 -0.320 1.00 0.00 O ATOM 791 CG2 THR A 767 -0.739 -9.357 0.739 1.00 0.00 C ATOM 0 H THR A 767 3.241 -9.481 2.008 1.00 0.00 H new ATOM 0 HA THR A 767 1.408 -7.726 0.492 1.00 0.00 H new ATOM 0 HB THR A 767 0.815 -10.445 1.711 1.00 0.00 H new ATOM 0 HG1 THR A 767 0.679 -11.093 -0.544 1.00 0.00 H new ATOM 0 HG21 THR A 767 -1.312 -10.250 0.489 1.00 0.00 H new ATOM 0 HG22 THR A 767 -1.112 -8.936 1.673 1.00 0.00 H new ATOM 0 HG23 THR A 767 -0.846 -8.622 -0.059 1.00 0.00 H new ATOM 799 N PHE A 768 0.553 -6.766 2.623 1.00 0.00 N ATOM 800 CA PHE A 768 0.107 -6.160 3.856 1.00 0.00 C ATOM 801 C PHE A 768 -1.379 -5.873 3.751 1.00 0.00 C ATOM 802 O PHE A 768 -1.860 -5.418 2.712 1.00 0.00 O ATOM 803 CB PHE A 768 0.876 -4.870 4.130 1.00 0.00 C ATOM 804 CG PHE A 768 0.911 -4.484 5.579 1.00 0.00 C ATOM 805 CD1 PHE A 768 -0.241 -4.063 6.209 1.00 0.00 C ATOM 806 CD2 PHE A 768 2.090 -4.533 6.304 1.00 0.00 C ATOM 807 CE1 PHE A 768 -0.229 -3.697 7.541 1.00 0.00 C ATOM 808 CE2 PHE A 768 2.112 -4.170 7.638 1.00 0.00 C ATOM 809 CZ PHE A 768 0.950 -3.750 8.257 1.00 0.00 C ATOM 0 H PHE A 768 0.378 -6.206 1.789 1.00 0.00 H new ATOM 0 HA PHE A 768 0.293 -6.844 4.684 1.00 0.00 H new ATOM 0 HB2 PHE A 768 1.898 -4.983 3.769 1.00 0.00 H new ATOM 0 HB3 PHE A 768 0.424 -4.060 3.558 1.00 0.00 H new ATOM 0 HD1 PHE A 768 -1.166 -4.019 5.653 1.00 0.00 H new ATOM 0 HD2 PHE A 768 3.001 -4.858 5.823 1.00 0.00 H new ATOM 0 HE1 PHE A 768 -1.140 -3.370 8.021 1.00 0.00 H new ATOM 0 HE2 PHE A 768 3.036 -4.215 8.195 1.00 0.00 H new ATOM 0 HZ PHE A 768 0.964 -3.464 9.298 1.00 0.00 H new ATOM 819 N GLU A 769 -2.099 -6.152 4.815 1.00 0.00 N ATOM 820 CA GLU A 769 -3.537 -6.018 4.811 1.00 0.00 C ATOM 821 C GLU A 769 -4.030 -5.285 6.051 1.00 0.00 C ATOM 822 O GLU A 769 -3.653 -5.617 7.178 1.00 0.00 O ATOM 823 CB GLU A 769 -4.148 -7.407 4.728 1.00 0.00 C ATOM 824 CG GLU A 769 -5.666 -7.424 4.705 1.00 0.00 C ATOM 825 CD GLU A 769 -6.216 -8.808 4.458 1.00 0.00 C ATOM 826 OE1 GLU A 769 -6.476 -9.534 5.439 1.00 0.00 O ATOM 827 OE2 GLU A 769 -6.386 -9.180 3.280 1.00 0.00 O ATOM 0 H GLU A 769 -1.708 -6.475 5.700 1.00 0.00 H new ATOM 0 HA GLU A 769 -3.842 -5.424 3.949 1.00 0.00 H new ATOM 0 HB2 GLU A 769 -3.778 -7.901 3.829 1.00 0.00 H new ATOM 0 HB3 GLU A 769 -3.803 -7.994 5.579 1.00 0.00 H new ATOM 0 HG2 GLU A 769 -6.046 -7.048 5.655 1.00 0.00 H new ATOM 0 HG3 GLU A 769 -6.024 -6.748 3.928 1.00 0.00 H new ATOM 834 N ILE A 770 -4.869 -4.285 5.832 1.00 0.00 N ATOM 835 CA ILE A 770 -5.475 -3.528 6.905 1.00 0.00 C ATOM 836 C ILE A 770 -6.978 -3.633 6.771 1.00 0.00 C ATOM 837 O ILE A 770 -7.558 -3.129 5.813 1.00 0.00 O ATOM 838 CB ILE A 770 -5.039 -2.046 6.866 1.00 0.00 C ATOM 839 CG1 ILE A 770 -3.543 -1.930 7.140 1.00 0.00 C ATOM 840 CG2 ILE A 770 -5.813 -1.222 7.884 1.00 0.00 C ATOM 841 CD1 ILE A 770 -2.801 -1.127 6.106 1.00 0.00 C ATOM 0 H ILE A 770 -5.147 -3.978 4.900 1.00 0.00 H new ATOM 0 HA ILE A 770 -5.148 -3.937 7.861 1.00 0.00 H new ATOM 0 HB ILE A 770 -5.255 -1.657 5.871 1.00 0.00 H new ATOM 0 HG12 ILE A 770 -3.396 -1.472 8.118 1.00 0.00 H new ATOM 0 HG13 ILE A 770 -3.113 -2.930 7.189 1.00 0.00 H new ATOM 0 HG21 ILE A 770 -5.486 -0.183 7.835 1.00 0.00 H new ATOM 0 HG22 ILE A 770 -6.879 -1.278 7.663 1.00 0.00 H new ATOM 0 HG23 ILE A 770 -5.629 -1.614 8.884 1.00 0.00 H new ATOM 0 HD11 ILE A 770 -1.743 -1.087 6.366 1.00 0.00 H new ATOM 0 HD12 ILE A 770 -2.917 -1.596 5.129 1.00 0.00 H new ATOM 0 HD13 ILE A 770 -3.205 -0.115 6.073 1.00 0.00 H new ATOM 853 N LYS A 771 -7.605 -4.334 7.691 1.00 0.00 N ATOM 854 CA LYS A 771 -9.019 -4.565 7.602 1.00 0.00 C ATOM 855 C LYS A 771 -9.793 -3.398 8.173 1.00 0.00 C ATOM 856 O LYS A 771 -9.326 -2.702 9.080 1.00 0.00 O ATOM 857 CB LYS A 771 -9.386 -5.846 8.326 1.00 0.00 C ATOM 858 CG LYS A 771 -8.233 -6.829 8.381 1.00 0.00 C ATOM 859 CD LYS A 771 -8.682 -8.213 8.798 1.00 0.00 C ATOM 860 CE LYS A 771 -9.520 -8.874 7.714 1.00 0.00 C ATOM 861 NZ LYS A 771 -9.950 -10.242 8.104 1.00 0.00 N ATOM 0 H LYS A 771 -7.154 -4.751 8.505 1.00 0.00 H new ATOM 0 HA LYS A 771 -9.284 -4.666 6.550 1.00 0.00 H new ATOM 0 HB2 LYS A 771 -9.706 -5.608 9.340 1.00 0.00 H new ATOM 0 HB3 LYS A 771 -10.234 -6.313 7.826 1.00 0.00 H new ATOM 0 HG2 LYS A 771 -7.757 -6.883 7.402 1.00 0.00 H new ATOM 0 HG3 LYS A 771 -7.481 -6.466 9.082 1.00 0.00 H new ATOM 0 HD2 LYS A 771 -7.810 -8.831 9.013 1.00 0.00 H new ATOM 0 HD3 LYS A 771 -9.262 -8.147 9.719 1.00 0.00 H new ATOM 0 HE2 LYS A 771 -10.398 -8.262 7.510 1.00 0.00 H new ATOM 0 HE3 LYS A 771 -8.944 -8.924 6.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 771 -10.519 -10.658 7.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 771 -9.112 -10.834 8.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 771 -10.521 -10.192 8.972 1.00 0.00 H new ATOM 875 N GLU A 772 -10.979 -3.214 7.630 1.00 0.00 N ATOM 876 CA GLU A 772 -11.910 -2.175 8.057 1.00 0.00 C ATOM 877 C GLU A 772 -11.279 -0.783 8.003 1.00 0.00 C ATOM 878 O GLU A 772 -11.331 -0.045 8.988 1.00 0.00 O ATOM 879 CB GLU A 772 -12.406 -2.443 9.481 1.00 0.00 C ATOM 880 CG GLU A 772 -12.461 -3.913 9.854 1.00 0.00 C ATOM 881 CD GLU A 772 -13.000 -4.140 11.244 1.00 0.00 C ATOM 882 OE1 GLU A 772 -14.153 -4.600 11.374 1.00 0.00 O ATOM 883 OE2 GLU A 772 -12.275 -3.856 12.219 1.00 0.00 O ATOM 0 H GLU A 772 -11.334 -3.789 6.866 1.00 0.00 H new ATOM 0 HA GLU A 772 -12.749 -2.202 7.362 1.00 0.00 H new ATOM 0 HB2 GLU A 772 -11.754 -1.925 10.184 1.00 0.00 H new ATOM 0 HB3 GLU A 772 -13.401 -2.013 9.594 1.00 0.00 H new ATOM 0 HG2 GLU A 772 -13.086 -4.443 9.135 1.00 0.00 H new ATOM 0 HG3 GLU A 772 -11.461 -4.340 9.782 1.00 0.00 H new ATOM 890 N ILE A 773 -10.673 -0.412 6.880 1.00 0.00 N ATOM 891 CA ILE A 773 -10.191 0.947 6.740 1.00 0.00 C ATOM 892 C ILE A 773 -11.383 1.837 6.429 1.00 0.00 C ATOM 893 O ILE A 773 -12.087 1.647 5.441 1.00 0.00 O ATOM 894 CB ILE A 773 -9.033 1.102 5.694 1.00 0.00 C ATOM 895 CG1 ILE A 773 -9.502 1.636 4.337 1.00 0.00 C ATOM 896 CG2 ILE A 773 -8.302 -0.219 5.492 1.00 0.00 C ATOM 897 CD1 ILE A 773 -9.602 3.157 4.266 1.00 0.00 C ATOM 0 H ILE A 773 -10.509 -1.018 6.076 1.00 0.00 H new ATOM 0 HA ILE A 773 -9.732 1.254 7.680 1.00 0.00 H new ATOM 0 HB ILE A 773 -8.355 1.844 6.116 1.00 0.00 H new ATOM 0 HG12 ILE A 773 -8.813 1.292 3.566 1.00 0.00 H new ATOM 0 HG13 ILE A 773 -10.478 1.207 4.108 1.00 0.00 H new ATOM 0 HG21 ILE A 773 -7.504 -0.085 4.762 1.00 0.00 H new ATOM 0 HG22 ILE A 773 -7.876 -0.548 6.440 1.00 0.00 H new ATOM 0 HG23 ILE A 773 -9.003 -0.971 5.129 1.00 0.00 H new ATOM 0 HD11 ILE A 773 -9.940 3.453 3.273 1.00 0.00 H new ATOM 0 HD12 ILE A 773 -10.314 3.510 5.012 1.00 0.00 H new ATOM 0 HD13 ILE A 773 -8.623 3.595 4.462 1.00 0.00 H new ATOM 909 N LYS A 774 -11.647 2.752 7.333 1.00 0.00 N ATOM 910 CA LYS A 774 -12.775 3.654 7.215 1.00 0.00 C ATOM 911 C LYS A 774 -12.244 5.075 7.124 1.00 0.00 C ATOM 912 O LYS A 774 -12.883 6.036 7.554 1.00 0.00 O ATOM 913 CB LYS A 774 -13.677 3.478 8.440 1.00 0.00 C ATOM 914 CG LYS A 774 -13.933 2.013 8.775 1.00 0.00 C ATOM 915 CD LYS A 774 -14.512 1.837 10.166 1.00 0.00 C ATOM 916 CE LYS A 774 -14.504 0.371 10.576 1.00 0.00 C ATOM 917 NZ LYS A 774 -14.949 0.183 11.982 1.00 0.00 N ATOM 0 H LYS A 774 -11.086 2.894 8.173 1.00 0.00 H new ATOM 0 HA LYS A 774 -13.361 3.439 6.321 1.00 0.00 H new ATOM 0 HB2 LYS A 774 -13.217 3.968 9.298 1.00 0.00 H new ATOM 0 HB3 LYS A 774 -14.629 3.977 8.260 1.00 0.00 H new ATOM 0 HG2 LYS A 774 -14.618 1.589 8.041 1.00 0.00 H new ATOM 0 HG3 LYS A 774 -12.999 1.456 8.699 1.00 0.00 H new ATOM 0 HD2 LYS A 774 -13.934 2.422 10.882 1.00 0.00 H new ATOM 0 HD3 LYS A 774 -15.532 2.220 10.191 1.00 0.00 H new ATOM 0 HE2 LYS A 774 -15.156 -0.195 9.911 1.00 0.00 H new ATOM 0 HE3 LYS A 774 -13.499 -0.033 10.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 774 -14.929 -0.829 12.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 774 -14.312 0.702 12.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 774 -15.918 0.545 12.091 1.00 0.00 H new ATOM 931 N THR A 775 -11.044 5.185 6.569 1.00 0.00 N ATOM 932 CA THR A 775 -10.324 6.443 6.552 1.00 0.00 C ATOM 933 C THR A 775 -10.491 7.208 5.232 1.00 0.00 C ATOM 934 O THR A 775 -11.158 8.240 5.194 1.00 0.00 O ATOM 935 CB THR A 775 -8.831 6.203 6.817 1.00 0.00 C ATOM 936 OG1 THR A 775 -8.673 5.148 7.775 1.00 0.00 O ATOM 937 CG2 THR A 775 -8.173 7.462 7.344 1.00 0.00 C ATOM 0 H THR A 775 -10.550 4.412 6.124 1.00 0.00 H new ATOM 0 HA THR A 775 -10.753 7.058 7.343 1.00 0.00 H new ATOM 0 HB THR A 775 -8.354 5.923 5.878 1.00 0.00 H new ATOM 0 HG1 THR A 775 -7.719 4.996 7.940 1.00 0.00 H new ATOM 0 HG21 THR A 775 -7.115 7.271 7.525 1.00 0.00 H new ATOM 0 HG22 THR A 775 -8.277 8.261 6.610 1.00 0.00 H new ATOM 0 HG23 THR A 775 -8.653 7.761 8.276 1.00 0.00 H new ATOM 945 N ASN A 776 -9.839 6.697 4.177 1.00 0.00 N ATOM 946 CA ASN A 776 -9.831 7.298 2.825 1.00 0.00 C ATOM 947 C ASN A 776 -8.714 8.319 2.720 1.00 0.00 C ATOM 948 O ASN A 776 -8.575 9.020 1.722 1.00 0.00 O ATOM 949 CB ASN A 776 -11.175 7.929 2.430 1.00 0.00 C ATOM 950 CG ASN A 776 -12.160 6.933 1.841 1.00 0.00 C ATOM 951 OD1 ASN A 776 -13.015 7.296 1.033 1.00 0.00 O ATOM 952 ND2 ASN A 776 -12.045 5.674 2.230 1.00 0.00 N ATOM 0 H ASN A 776 -9.291 5.839 4.235 1.00 0.00 H new ATOM 0 HA ASN A 776 -9.658 6.485 2.120 1.00 0.00 H new ATOM 0 HB2 ASN A 776 -11.622 8.394 3.309 1.00 0.00 H new ATOM 0 HB3 ASN A 776 -10.996 8.723 1.705 1.00 0.00 H new ATOM 0 HD21 ASN A 776 -12.678 4.966 1.858 1.00 0.00 H new ATOM 0 HD22 ASN A 776 -11.324 5.412 2.902 1.00 0.00 H new ATOM 959 N GLU A 777 -7.914 8.376 3.769 1.00 0.00 N ATOM 960 CA GLU A 777 -6.785 9.263 3.854 1.00 0.00 C ATOM 961 C GLU A 777 -5.862 8.758 4.950 1.00 0.00 C ATOM 962 O GLU A 777 -5.965 9.170 6.107 1.00 0.00 O ATOM 963 CB GLU A 777 -7.300 10.627 4.191 1.00 0.00 C ATOM 964 CG GLU A 777 -6.437 11.763 3.679 1.00 0.00 C ATOM 965 CD GLU A 777 -5.036 11.786 4.251 1.00 0.00 C ATOM 966 OE1 GLU A 777 -4.887 12.056 5.460 1.00 0.00 O ATOM 967 OE2 GLU A 777 -4.076 11.550 3.487 1.00 0.00 O ATOM 0 H GLU A 777 -8.039 7.794 4.597 1.00 0.00 H new ATOM 0 HA GLU A 777 -6.233 9.303 2.915 1.00 0.00 H new ATOM 0 HB2 GLU A 777 -8.304 10.735 3.781 1.00 0.00 H new ATOM 0 HB3 GLU A 777 -7.388 10.712 5.274 1.00 0.00 H new ATOM 0 HG2 GLU A 777 -6.373 11.694 2.593 1.00 0.00 H new ATOM 0 HG3 GLU A 777 -6.927 12.709 3.910 1.00 0.00 H new ATOM 974 N TYR A 778 -4.986 7.851 4.597 1.00 0.00 N ATOM 975 CA TYR A 778 -4.182 7.152 5.603 1.00 0.00 C ATOM 976 C TYR A 778 -2.732 7.020 5.170 1.00 0.00 C ATOM 977 O TYR A 778 -2.447 6.678 4.032 1.00 0.00 O ATOM 978 CB TYR A 778 -4.779 5.775 5.918 1.00 0.00 C ATOM 979 CG TYR A 778 -3.952 4.953 6.881 1.00 0.00 C ATOM 980 CD1 TYR A 778 -3.931 5.248 8.236 1.00 0.00 C ATOM 981 CD2 TYR A 778 -3.190 3.883 6.427 1.00 0.00 C ATOM 982 CE1 TYR A 778 -3.171 4.501 9.115 1.00 0.00 C ATOM 983 CE2 TYR A 778 -2.430 3.131 7.300 1.00 0.00 C ATOM 984 CZ TYR A 778 -2.422 3.445 8.642 1.00 0.00 C ATOM 985 OH TYR A 778 -1.658 2.701 9.513 1.00 0.00 O ATOM 0 H TYR A 778 -4.803 7.572 3.633 1.00 0.00 H new ATOM 0 HA TYR A 778 -4.202 7.754 6.511 1.00 0.00 H new ATOM 0 HB2 TYR A 778 -5.777 5.910 6.335 1.00 0.00 H new ATOM 0 HB3 TYR A 778 -4.895 5.219 4.988 1.00 0.00 H new ATOM 0 HD1 TYR A 778 -4.518 6.074 8.610 1.00 0.00 H new ATOM 0 HD2 TYR A 778 -3.193 3.636 5.376 1.00 0.00 H new ATOM 0 HE1 TYR A 778 -3.164 4.743 10.167 1.00 0.00 H new ATOM 0 HE2 TYR A 778 -1.845 2.301 6.933 1.00 0.00 H new ATOM 0 HH TYR A 778 -1.193 1.994 9.018 1.00 0.00 H new ATOM 995 N VAL A 779 -1.815 7.312 6.079 1.00 0.00 N ATOM 996 CA VAL A 779 -0.403 7.168 5.796 1.00 0.00 C ATOM 997 C VAL A 779 0.075 5.772 6.164 1.00 0.00 C ATOM 998 O VAL A 779 0.008 5.363 7.325 1.00 0.00 O ATOM 999 CB VAL A 779 0.446 8.223 6.526 1.00 0.00 C ATOM 1000 CG1 VAL A 779 1.895 8.154 6.071 1.00 0.00 C ATOM 1001 CG2 VAL A 779 -0.120 9.608 6.297 1.00 0.00 C ATOM 0 H VAL A 779 -2.027 7.650 7.018 1.00 0.00 H new ATOM 0 HA VAL A 779 -0.274 7.324 4.725 1.00 0.00 H new ATOM 0 HB VAL A 779 0.414 8.011 7.595 1.00 0.00 H new ATOM 0 HG11 VAL A 779 2.478 8.908 6.599 1.00 0.00 H new ATOM 0 HG12 VAL A 779 2.298 7.165 6.289 1.00 0.00 H new ATOM 0 HG13 VAL A 779 1.949 8.339 4.998 1.00 0.00 H new ATOM 0 HG21 VAL A 779 0.492 10.342 6.820 1.00 0.00 H new ATOM 0 HG22 VAL A 779 -0.119 9.829 5.230 1.00 0.00 H new ATOM 0 HG23 VAL A 779 -1.141 9.651 6.676 1.00 0.00 H new ATOM 1011 N ILE A 780 0.542 5.046 5.164 1.00 0.00 N ATOM 1012 CA ILE A 780 1.009 3.685 5.349 1.00 0.00 C ATOM 1013 C ILE A 780 2.486 3.666 5.715 1.00 0.00 C ATOM 1014 O ILE A 780 3.271 4.473 5.226 1.00 0.00 O ATOM 1015 CB ILE A 780 0.791 2.844 4.073 1.00 0.00 C ATOM 1016 CG1 ILE A 780 -0.688 2.646 3.793 1.00 0.00 C ATOM 1017 CG2 ILE A 780 1.475 1.488 4.176 1.00 0.00 C ATOM 1018 CD1 ILE A 780 -0.920 1.858 2.530 1.00 0.00 C ATOM 0 H ILE A 780 0.608 5.383 4.203 1.00 0.00 H new ATOM 0 HA ILE A 780 0.430 3.250 6.164 1.00 0.00 H new ATOM 0 HB ILE A 780 1.237 3.398 3.247 1.00 0.00 H new ATOM 0 HG12 ILE A 780 -1.151 2.129 4.634 1.00 0.00 H new ATOM 0 HG13 ILE A 780 -1.175 3.618 3.709 1.00 0.00 H new ATOM 0 HG21 ILE A 780 1.301 0.922 3.261 1.00 0.00 H new ATOM 0 HG22 ILE A 780 2.546 1.631 4.316 1.00 0.00 H new ATOM 0 HG23 ILE A 780 1.068 0.939 5.025 1.00 0.00 H new ATOM 0 HD11 ILE A 780 -1.991 1.739 2.367 1.00 0.00 H new ATOM 0 HD12 ILE A 780 -0.481 2.388 1.685 1.00 0.00 H new ATOM 0 HD13 ILE A 780 -0.456 0.876 2.623 1.00 0.00 H new ATOM 1030 N LYS A 781 2.849 2.743 6.585 1.00 0.00 N ATOM 1031 CA LYS A 781 4.237 2.546 6.962 1.00 0.00 C ATOM 1032 C LYS A 781 4.615 1.100 6.702 1.00 0.00 C ATOM 1033 O LYS A 781 4.137 0.195 7.391 1.00 0.00 O ATOM 1034 CB LYS A 781 4.491 2.891 8.439 1.00 0.00 C ATOM 1035 CG LYS A 781 4.456 4.382 8.769 1.00 0.00 C ATOM 1036 CD LYS A 781 3.043 4.950 8.784 1.00 0.00 C ATOM 1037 CE LYS A 781 2.190 4.323 9.877 1.00 0.00 C ATOM 1038 NZ LYS A 781 0.813 4.878 9.889 1.00 0.00 N ATOM 0 H LYS A 781 2.195 2.112 7.048 1.00 0.00 H new ATOM 0 HA LYS A 781 4.851 3.218 6.362 1.00 0.00 H new ATOM 0 HB2 LYS A 781 3.745 2.382 9.049 1.00 0.00 H new ATOM 0 HB3 LYS A 781 5.464 2.493 8.727 1.00 0.00 H new ATOM 0 HG2 LYS A 781 4.919 4.545 9.742 1.00 0.00 H new ATOM 0 HG3 LYS A 781 5.053 4.926 8.037 1.00 0.00 H new ATOM 0 HD2 LYS A 781 3.087 6.029 8.932 1.00 0.00 H new ATOM 0 HD3 LYS A 781 2.573 4.780 7.815 1.00 0.00 H new ATOM 0 HE2 LYS A 781 2.146 3.244 9.729 1.00 0.00 H new ATOM 0 HE3 LYS A 781 2.659 4.493 10.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 781 0.136 4.123 10.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 781 0.748 5.630 10.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 781 0.589 5.270 8.952 1.00 0.00 H new ATOM 1052 N THR A 782 5.444 0.877 5.698 1.00 0.00 N ATOM 1053 CA THR A 782 5.831 -0.473 5.342 1.00 0.00 C ATOM 1054 C THR A 782 6.886 -0.984 6.311 1.00 0.00 C ATOM 1055 O THR A 782 7.740 -0.211 6.766 1.00 0.00 O ATOM 1056 CB THR A 782 6.382 -0.563 3.916 1.00 0.00 C ATOM 1057 OG1 THR A 782 7.627 0.125 3.823 1.00 0.00 O ATOM 1058 CG2 THR A 782 5.394 0.019 2.943 1.00 0.00 C ATOM 0 H THR A 782 5.859 1.608 5.120 1.00 0.00 H new ATOM 0 HA THR A 782 4.932 -1.087 5.397 1.00 0.00 H new ATOM 0 HB THR A 782 6.544 -1.612 3.669 1.00 0.00 H new ATOM 0 HG1 THR A 782 8.337 -0.512 3.598 1.00 0.00 H new ATOM 0 HG21 THR A 782 5.795 -0.050 1.932 1.00 0.00 H new ATOM 0 HG22 THR A 782 4.457 -0.535 3.000 1.00 0.00 H new ATOM 0 HG23 THR A 782 5.212 1.065 3.191 1.00 0.00 H new ATOM 1066 N PRO A 783 6.840 -2.291 6.620 1.00 0.00 N ATOM 1067 CA PRO A 783 7.770 -2.935 7.557 1.00 0.00 C ATOM 1068 C PRO A 783 9.237 -2.650 7.240 1.00 0.00 C ATOM 1069 O PRO A 783 9.594 -2.310 6.110 1.00 0.00 O ATOM 1070 CB PRO A 783 7.469 -4.424 7.380 1.00 0.00 C ATOM 1071 CG PRO A 783 6.057 -4.469 6.916 1.00 0.00 C ATOM 1072 CD PRO A 783 5.863 -3.246 6.071 1.00 0.00 C ATOM 0 HA PRO A 783 7.632 -2.566 8.573 1.00 0.00 H new ATOM 0 HB2 PRO A 783 8.140 -4.880 6.652 1.00 0.00 H new ATOM 0 HB3 PRO A 783 7.596 -4.968 8.316 1.00 0.00 H new ATOM 0 HG2 PRO A 783 5.863 -5.375 6.342 1.00 0.00 H new ATOM 0 HG3 PRO A 783 5.368 -4.473 7.761 1.00 0.00 H new ATOM 0 HD2 PRO A 783 6.051 -3.452 5.017 1.00 0.00 H new ATOM 0 HD3 PRO A 783 4.844 -2.865 6.144 1.00 0.00 H new ATOM 1080 N VAL A 784 10.073 -2.808 8.258 1.00 0.00 N ATOM 1081 CA VAL A 784 11.492 -2.513 8.171 1.00 0.00 C ATOM 1082 C VAL A 784 12.184 -3.329 7.088 1.00 0.00 C ATOM 1083 O VAL A 784 12.082 -4.556 7.054 1.00 0.00 O ATOM 1084 CB VAL A 784 12.172 -2.776 9.527 1.00 0.00 C ATOM 1085 CG1 VAL A 784 13.684 -2.702 9.416 1.00 0.00 C ATOM 1086 CG2 VAL A 784 11.659 -1.789 10.555 1.00 0.00 C ATOM 0 H VAL A 784 9.780 -3.148 9.174 1.00 0.00 H new ATOM 0 HA VAL A 784 11.586 -1.460 7.906 1.00 0.00 H new ATOM 0 HB VAL A 784 11.921 -3.788 9.847 1.00 0.00 H new ATOM 0 HG11 VAL A 784 14.130 -2.893 10.392 1.00 0.00 H new ATOM 0 HG12 VAL A 784 14.034 -3.450 8.705 1.00 0.00 H new ATOM 0 HG13 VAL A 784 13.975 -1.710 9.071 1.00 0.00 H new ATOM 0 HG21 VAL A 784 12.142 -1.978 11.514 1.00 0.00 H new ATOM 0 HG22 VAL A 784 11.884 -0.774 10.229 1.00 0.00 H new ATOM 0 HG23 VAL A 784 10.581 -1.904 10.663 1.00 0.00 H new ATOM 1096 N PHE A 785 12.881 -2.633 6.207 1.00 0.00 N ATOM 1097 CA PHE A 785 13.652 -3.278 5.154 1.00 0.00 C ATOM 1098 C PHE A 785 15.134 -3.247 5.504 1.00 0.00 C ATOM 1099 O PHE A 785 15.816 -2.246 5.280 1.00 0.00 O ATOM 1100 CB PHE A 785 13.435 -2.585 3.806 1.00 0.00 C ATOM 1101 CG PHE A 785 11.995 -2.434 3.412 1.00 0.00 C ATOM 1102 CD1 PHE A 785 11.151 -3.534 3.344 1.00 0.00 C ATOM 1103 CD2 PHE A 785 11.488 -1.187 3.095 1.00 0.00 C ATOM 1104 CE1 PHE A 785 9.830 -3.386 2.967 1.00 0.00 C ATOM 1105 CE2 PHE A 785 10.171 -1.035 2.719 1.00 0.00 C ATOM 1106 CZ PHE A 785 9.340 -2.136 2.656 1.00 0.00 C ATOM 0 H PHE A 785 12.930 -1.614 6.199 1.00 0.00 H new ATOM 0 HA PHE A 785 13.312 -4.310 5.072 1.00 0.00 H new ATOM 0 HB2 PHE A 785 13.895 -1.598 3.841 1.00 0.00 H new ATOM 0 HB3 PHE A 785 13.953 -3.151 3.032 1.00 0.00 H new ATOM 0 HD1 PHE A 785 11.531 -4.515 3.588 1.00 0.00 H new ATOM 0 HD2 PHE A 785 12.132 -0.322 3.143 1.00 0.00 H new ATOM 0 HE1 PHE A 785 9.182 -4.249 2.916 1.00 0.00 H new ATOM 0 HE2 PHE A 785 9.789 -0.055 2.474 1.00 0.00 H new ATOM 0 HZ PHE A 785 8.307 -2.018 2.363 1.00 0.00 H new ATOM 1116 N THR A 786 15.633 -4.345 6.046 1.00 0.00 N ATOM 1117 CA THR A 786 17.029 -4.432 6.450 1.00 0.00 C ATOM 1118 C THR A 786 17.902 -4.879 5.294 1.00 0.00 C ATOM 1119 O THR A 786 18.914 -5.559 5.472 1.00 0.00 O ATOM 1120 CB THR A 786 17.180 -5.379 7.637 1.00 0.00 C ATOM 1121 OG1 THR A 786 16.573 -6.647 7.349 1.00 0.00 O ATOM 1122 CG2 THR A 786 16.522 -4.756 8.845 1.00 0.00 C ATOM 0 H THR A 786 15.091 -5.192 6.217 1.00 0.00 H new ATOM 0 HA THR A 786 17.359 -3.439 6.754 1.00 0.00 H new ATOM 0 HB THR A 786 18.239 -5.544 7.835 1.00 0.00 H new ATOM 0 HG1 THR A 786 16.680 -7.243 8.119 1.00 0.00 H new ATOM 0 HG21 THR A 786 16.624 -5.424 9.700 1.00 0.00 H new ATOM 0 HG22 THR A 786 17.002 -3.803 9.070 1.00 0.00 H new ATOM 0 HG23 THR A 786 15.465 -4.590 8.638 1.00 0.00 H new ATOM 1130 N THR A 787 17.490 -4.476 4.110 1.00 0.00 N ATOM 1131 CA THR A 787 18.200 -4.799 2.886 1.00 0.00 C ATOM 1132 C THR A 787 17.938 -3.744 1.821 1.00 0.00 C ATOM 1133 O THR A 787 16.811 -3.611 1.345 1.00 0.00 O ATOM 1134 CB THR A 787 17.779 -6.165 2.327 1.00 0.00 C ATOM 1135 OG1 THR A 787 17.008 -6.894 3.296 1.00 0.00 O ATOM 1136 CG2 THR A 787 19.001 -6.977 1.931 1.00 0.00 C ATOM 0 H THR A 787 16.651 -3.914 3.967 1.00 0.00 H new ATOM 0 HA THR A 787 19.260 -4.828 3.136 1.00 0.00 H new ATOM 0 HB THR A 787 17.164 -5.993 1.444 1.00 0.00 H new ATOM 0 HG1 THR A 787 16.747 -7.761 2.921 1.00 0.00 H new ATOM 0 HG21 THR A 787 18.684 -7.943 1.537 1.00 0.00 H new ATOM 0 HG22 THR A 787 19.563 -6.440 1.167 1.00 0.00 H new ATOM 0 HG23 THR A 787 19.634 -7.132 2.805 1.00 0.00 H new ATOM 1144 N GLY A 788 18.964 -2.964 1.489 1.00 0.00 N ATOM 1145 CA GLY A 788 18.871 -2.065 0.359 1.00 0.00 C ATOM 1146 C GLY A 788 18.442 -2.778 -0.908 1.00 0.00 C ATOM 1147 O GLY A 788 19.177 -3.603 -1.451 1.00 0.00 O ATOM 0 H GLY A 788 19.856 -2.941 1.984 1.00 0.00 H new ATOM 0 HA2 GLY A 788 18.159 -1.272 0.586 1.00 0.00 H new ATOM 0 HA3 GLY A 788 19.838 -1.588 0.196 1.00 0.00 H new ATOM 1151 N GLY A 789 17.251 -2.451 -1.367 1.00 0.00 N ATOM 1152 CA GLY A 789 16.695 -3.069 -2.546 1.00 0.00 C ATOM 1153 C GLY A 789 15.690 -2.157 -3.206 1.00 0.00 C ATOM 1154 O GLY A 789 15.781 -0.933 -3.079 1.00 0.00 O ATOM 0 H GLY A 789 16.647 -1.753 -0.934 1.00 0.00 H new ATOM 0 HA2 GLY A 789 17.494 -3.306 -3.249 1.00 0.00 H new ATOM 0 HA3 GLY A 789 16.217 -4.011 -2.277 1.00 0.00 H new ATOM 1158 N ASP A 790 14.716 -2.730 -3.891 1.00 0.00 N ATOM 1159 CA ASP A 790 13.710 -1.938 -4.566 1.00 0.00 C ATOM 1160 C ASP A 790 12.346 -2.567 -4.347 1.00 0.00 C ATOM 1161 O ASP A 790 12.143 -3.747 -4.645 1.00 0.00 O ATOM 1162 CB ASP A 790 13.991 -1.833 -6.071 1.00 0.00 C ATOM 1163 CG ASP A 790 15.314 -1.173 -6.415 1.00 0.00 C ATOM 1164 OD1 ASP A 790 15.301 0.006 -6.828 1.00 0.00 O ATOM 1165 OD2 ASP A 790 16.368 -1.839 -6.317 1.00 0.00 O ATOM 0 H ASP A 790 14.603 -3.739 -3.993 1.00 0.00 H new ATOM 0 HA ASP A 790 13.733 -0.931 -4.149 1.00 0.00 H new ATOM 0 HB2 ASP A 790 13.975 -2.834 -6.502 1.00 0.00 H new ATOM 0 HB3 ASP A 790 13.185 -1.270 -6.541 1.00 0.00 H new ATOM 1170 N TYR A 791 11.423 -1.790 -3.813 1.00 0.00 N ATOM 1171 CA TYR A 791 10.074 -2.264 -3.552 1.00 0.00 C ATOM 1172 C TYR A 791 9.066 -1.360 -4.234 1.00 0.00 C ATOM 1173 O TYR A 791 9.344 -0.190 -4.477 1.00 0.00 O ATOM 1174 CB TYR A 791 9.790 -2.282 -2.048 1.00 0.00 C ATOM 1175 CG TYR A 791 10.731 -3.153 -1.252 1.00 0.00 C ATOM 1176 CD1 TYR A 791 11.943 -2.657 -0.800 1.00 0.00 C ATOM 1177 CD2 TYR A 791 10.407 -4.468 -0.956 1.00 0.00 C ATOM 1178 CE1 TYR A 791 12.813 -3.451 -0.075 1.00 0.00 C ATOM 1179 CE2 TYR A 791 11.265 -5.266 -0.230 1.00 0.00 C ATOM 1180 CZ TYR A 791 12.466 -4.757 0.208 1.00 0.00 C ATOM 1181 OH TYR A 791 13.326 -5.562 0.921 1.00 0.00 O ATOM 0 H TYR A 791 11.584 -0.818 -3.549 1.00 0.00 H new ATOM 0 HA TYR A 791 9.988 -3.277 -3.945 1.00 0.00 H new ATOM 0 HB2 TYR A 791 9.846 -1.262 -1.667 1.00 0.00 H new ATOM 0 HB3 TYR A 791 8.769 -2.627 -1.886 1.00 0.00 H new ATOM 0 HD1 TYR A 791 12.213 -1.634 -1.017 1.00 0.00 H new ATOM 0 HD2 TYR A 791 9.467 -4.874 -1.300 1.00 0.00 H new ATOM 0 HE1 TYR A 791 13.757 -3.052 0.267 1.00 0.00 H new ATOM 0 HE2 TYR A 791 10.995 -6.287 -0.006 1.00 0.00 H new ATOM 0 HH TYR A 791 12.926 -6.450 1.032 1.00 0.00 H new ATOM 1191 N ILE A 792 7.913 -1.905 -4.568 1.00 0.00 N ATOM 1192 CA ILE A 792 6.811 -1.108 -5.066 1.00 0.00 C ATOM 1193 C ILE A 792 5.532 -1.505 -4.355 1.00 0.00 C ATOM 1194 O ILE A 792 5.153 -2.675 -4.350 1.00 0.00 O ATOM 1195 CB ILE A 792 6.644 -1.266 -6.588 1.00 0.00 C ATOM 1196 CG1 ILE A 792 7.863 -0.694 -7.311 1.00 0.00 C ATOM 1197 CG2 ILE A 792 5.380 -0.565 -7.055 1.00 0.00 C ATOM 1198 CD1 ILE A 792 8.208 -1.419 -8.587 1.00 0.00 C ATOM 0 H ILE A 792 7.715 -2.903 -4.503 1.00 0.00 H new ATOM 0 HA ILE A 792 7.030 -0.059 -4.864 1.00 0.00 H new ATOM 0 HB ILE A 792 6.560 -2.327 -6.823 1.00 0.00 H new ATOM 0 HG12 ILE A 792 7.679 0.356 -7.539 1.00 0.00 H new ATOM 0 HG13 ILE A 792 8.721 -0.729 -6.640 1.00 0.00 H new ATOM 0 HG21 ILE A 792 5.275 -0.685 -8.133 1.00 0.00 H new ATOM 0 HG22 ILE A 792 4.516 -1.002 -6.555 1.00 0.00 H new ATOM 0 HG23 ILE A 792 5.441 0.496 -6.812 1.00 0.00 H new ATOM 0 HD11 ILE A 792 9.083 -0.956 -9.043 1.00 0.00 H new ATOM 0 HD12 ILE A 792 8.424 -2.464 -8.365 1.00 0.00 H new ATOM 0 HD13 ILE A 792 7.366 -1.362 -9.277 1.00 0.00 H new ATOM 1210 N LEU A 793 4.897 -0.536 -3.725 1.00 0.00 N ATOM 1211 CA LEU A 793 3.648 -0.767 -3.036 1.00 0.00 C ATOM 1212 C LEU A 793 2.496 -0.593 -4.014 1.00 0.00 C ATOM 1213 O LEU A 793 2.195 0.521 -4.447 1.00 0.00 O ATOM 1214 CB LEU A 793 3.513 0.185 -1.841 1.00 0.00 C ATOM 1215 CG LEU A 793 2.269 -0.019 -0.965 1.00 0.00 C ATOM 1216 CD1 LEU A 793 2.541 0.391 0.474 1.00 0.00 C ATOM 1217 CD2 LEU A 793 1.102 0.783 -1.502 1.00 0.00 C ATOM 0 H LEU A 793 5.232 0.426 -3.678 1.00 0.00 H new ATOM 0 HA LEU A 793 3.626 -1.785 -2.648 1.00 0.00 H new ATOM 0 HB2 LEU A 793 4.398 0.079 -1.214 1.00 0.00 H new ATOM 0 HB3 LEU A 793 3.508 1.209 -2.214 1.00 0.00 H new ATOM 0 HG LEU A 793 2.020 -1.080 -0.989 1.00 0.00 H new ATOM 0 HD11 LEU A 793 1.643 0.236 1.072 1.00 0.00 H new ATOM 0 HD12 LEU A 793 3.354 -0.213 0.877 1.00 0.00 H new ATOM 0 HD13 LEU A 793 2.821 1.444 0.506 1.00 0.00 H new ATOM 0 HD21 LEU A 793 0.230 0.625 -0.868 1.00 0.00 H new ATOM 0 HD22 LEU A 793 1.360 1.842 -1.507 1.00 0.00 H new ATOM 0 HD23 LEU A 793 0.875 0.460 -2.518 1.00 0.00 H new ATOM 1229 N SER A 794 1.885 -1.702 -4.374 1.00 0.00 N ATOM 1230 CA SER A 794 0.765 -1.709 -5.291 1.00 0.00 C ATOM 1231 C SER A 794 -0.444 -2.343 -4.602 1.00 0.00 C ATOM 1232 O SER A 794 -0.288 -3.229 -3.773 1.00 0.00 O ATOM 1233 CB SER A 794 1.138 -2.488 -6.555 1.00 0.00 C ATOM 1234 OG SER A 794 0.107 -2.432 -7.528 1.00 0.00 O ATOM 0 H SER A 794 2.152 -2.627 -4.038 1.00 0.00 H new ATOM 0 HA SER A 794 0.513 -0.688 -5.578 1.00 0.00 H new ATOM 0 HB2 SER A 794 2.058 -2.081 -6.975 1.00 0.00 H new ATOM 0 HB3 SER A 794 1.338 -3.528 -6.296 1.00 0.00 H new ATOM 0 HG SER A 794 0.379 -2.938 -8.322 1.00 0.00 H new ATOM 1240 N LEU A 795 -1.642 -1.873 -4.911 1.00 0.00 N ATOM 1241 CA LEU A 795 -2.846 -2.394 -4.299 1.00 0.00 C ATOM 1242 C LEU A 795 -3.188 -3.783 -4.832 1.00 0.00 C ATOM 1243 O LEU A 795 -3.142 -4.025 -6.041 1.00 0.00 O ATOM 1244 CB LEU A 795 -3.988 -1.436 -4.552 1.00 0.00 C ATOM 1245 CG LEU A 795 -3.780 -0.033 -3.990 1.00 0.00 C ATOM 1246 CD1 LEU A 795 -3.034 -0.058 -2.662 1.00 0.00 C ATOM 1247 CD2 LEU A 795 -3.086 0.871 -4.993 1.00 0.00 C ATOM 0 H LEU A 795 -1.803 -1.126 -5.587 1.00 0.00 H new ATOM 0 HA LEU A 795 -2.677 -2.490 -3.226 1.00 0.00 H new ATOM 0 HB2 LEU A 795 -4.150 -1.361 -5.627 1.00 0.00 H new ATOM 0 HB3 LEU A 795 -4.897 -1.854 -4.121 1.00 0.00 H new ATOM 0 HG LEU A 795 -4.769 0.383 -3.798 1.00 0.00 H new ATOM 0 HD11 LEU A 795 -2.907 0.961 -2.297 1.00 0.00 H new ATOM 0 HD12 LEU A 795 -3.605 -0.636 -1.935 1.00 0.00 H new ATOM 0 HD13 LEU A 795 -2.056 -0.517 -2.803 1.00 0.00 H new ATOM 0 HD21 LEU A 795 -2.954 1.862 -4.559 1.00 0.00 H new ATOM 0 HD22 LEU A 795 -2.112 0.453 -5.246 1.00 0.00 H new ATOM 0 HD23 LEU A 795 -3.693 0.948 -5.895 1.00 0.00 H new ATOM 1259 N VAL A 796 -3.540 -4.691 -3.924 1.00 0.00 N ATOM 1260 CA VAL A 796 -3.843 -6.067 -4.297 1.00 0.00 C ATOM 1261 C VAL A 796 -5.335 -6.271 -4.476 1.00 0.00 C ATOM 1262 O VAL A 796 -5.798 -6.636 -5.557 1.00 0.00 O ATOM 1263 CB VAL A 796 -3.325 -7.064 -3.235 1.00 0.00 C ATOM 1264 CG1 VAL A 796 -3.819 -8.476 -3.515 1.00 0.00 C ATOM 1265 CG2 VAL A 796 -1.820 -7.034 -3.219 1.00 0.00 C ATOM 0 H VAL A 796 -3.622 -4.497 -2.926 1.00 0.00 H new ATOM 0 HA VAL A 796 -3.337 -6.256 -5.244 1.00 0.00 H new ATOM 0 HB VAL A 796 -3.710 -6.766 -2.260 1.00 0.00 H new ATOM 0 HG11 VAL A 796 -3.438 -9.153 -2.751 1.00 0.00 H new ATOM 0 HG12 VAL A 796 -4.909 -8.490 -3.501 1.00 0.00 H new ATOM 0 HG13 VAL A 796 -3.465 -8.798 -4.494 1.00 0.00 H new ATOM 0 HG21 VAL A 796 -1.450 -7.736 -2.471 1.00 0.00 H new ATOM 0 HG22 VAL A 796 -1.440 -7.316 -4.201 1.00 0.00 H new ATOM 0 HG23 VAL A 796 -1.479 -6.028 -2.973 1.00 0.00 H new ATOM 1275 N SER A 797 -6.085 -5.978 -3.428 1.00 0.00 N ATOM 1276 CA SER A 797 -7.513 -6.241 -3.394 1.00 0.00 C ATOM 1277 C SER A 797 -8.123 -5.604 -2.154 1.00 0.00 C ATOM 1278 O SER A 797 -7.417 -5.334 -1.183 1.00 0.00 O ATOM 1279 CB SER A 797 -7.776 -7.753 -3.384 1.00 0.00 C ATOM 1280 OG SER A 797 -7.507 -8.342 -4.649 1.00 0.00 O ATOM 0 H SER A 797 -5.721 -5.551 -2.576 1.00 0.00 H new ATOM 0 HA SER A 797 -7.972 -5.811 -4.284 1.00 0.00 H new ATOM 0 HB2 SER A 797 -7.155 -8.225 -2.623 1.00 0.00 H new ATOM 0 HB3 SER A 797 -8.814 -7.940 -3.109 1.00 0.00 H new ATOM 0 HG SER A 797 -7.186 -7.654 -5.269 1.00 0.00 H new ATOM 1286 N ILE A 798 -9.413 -5.339 -2.193 1.00 0.00 N ATOM 1287 CA ILE A 798 -10.109 -4.781 -1.046 1.00 0.00 C ATOM 1288 C ILE A 798 -11.384 -5.573 -0.807 1.00 0.00 C ATOM 1289 O ILE A 798 -11.841 -6.277 -1.691 1.00 0.00 O ATOM 1290 CB ILE A 798 -10.436 -3.288 -1.253 1.00 0.00 C ATOM 1291 CG1 ILE A 798 -10.776 -2.620 0.076 1.00 0.00 C ATOM 1292 CG2 ILE A 798 -11.594 -3.142 -2.223 1.00 0.00 C ATOM 1293 CD1 ILE A 798 -10.632 -1.116 0.051 1.00 0.00 C ATOM 0 H ILE A 798 -10.004 -5.501 -3.008 1.00 0.00 H new ATOM 0 HA ILE A 798 -9.458 -4.853 -0.174 1.00 0.00 H new ATOM 0 HB ILE A 798 -9.557 -2.795 -1.669 1.00 0.00 H new ATOM 0 HG12 ILE A 798 -11.800 -2.874 0.349 1.00 0.00 H new ATOM 0 HG13 ILE A 798 -10.129 -3.026 0.853 1.00 0.00 H new ATOM 0 HG21 ILE A 798 -11.819 -2.085 -2.364 1.00 0.00 H new ATOM 0 HG22 ILE A 798 -11.324 -3.587 -3.181 1.00 0.00 H new ATOM 0 HG23 ILE A 798 -12.471 -3.649 -1.821 1.00 0.00 H new ATOM 0 HD11 ILE A 798 -10.890 -0.709 1.029 1.00 0.00 H new ATOM 0 HD12 ILE A 798 -9.602 -0.853 -0.191 1.00 0.00 H new ATOM 0 HD13 ILE A 798 -11.300 -0.699 -0.703 1.00 0.00 H new ATOM 1305 N LYS A 799 -11.957 -5.464 0.370 1.00 0.00 N ATOM 1306 CA LYS A 799 -13.104 -6.277 0.712 1.00 0.00 C ATOM 1307 C LYS A 799 -14.225 -5.427 1.263 1.00 0.00 C ATOM 1308 O LYS A 799 -14.068 -4.755 2.281 1.00 0.00 O ATOM 1309 CB LYS A 799 -12.693 -7.325 1.723 1.00 0.00 C ATOM 1310 CG LYS A 799 -13.810 -8.174 2.277 1.00 0.00 C ATOM 1311 CD LYS A 799 -13.516 -8.521 3.724 1.00 0.00 C ATOM 1312 CE LYS A 799 -14.201 -9.797 4.144 1.00 0.00 C ATOM 1313 NZ LYS A 799 -13.938 -10.132 5.569 1.00 0.00 N ATOM 0 H LYS A 799 -11.651 -4.825 1.103 1.00 0.00 H new ATOM 0 HA LYS A 799 -13.469 -6.766 -0.191 1.00 0.00 H new ATOM 0 HB2 LYS A 799 -11.958 -7.982 1.259 1.00 0.00 H new ATOM 0 HB3 LYS A 799 -12.195 -6.826 2.554 1.00 0.00 H new ATOM 0 HG2 LYS A 799 -14.757 -7.639 2.206 1.00 0.00 H new ATOM 0 HG3 LYS A 799 -13.914 -9.085 1.688 1.00 0.00 H new ATOM 0 HD2 LYS A 799 -12.440 -8.624 3.862 1.00 0.00 H new ATOM 0 HD3 LYS A 799 -13.843 -7.704 4.367 1.00 0.00 H new ATOM 0 HE2 LYS A 799 -15.275 -9.699 3.988 1.00 0.00 H new ATOM 0 HE3 LYS A 799 -13.860 -10.616 3.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 799 -14.428 -11.016 5.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 799 -12.915 -10.251 5.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 799 -14.287 -9.363 6.176 1.00 0.00 H new ATOM 1327 N ASP A 800 -15.340 -5.443 0.561 1.00 0.00 N ATOM 1328 CA ASP A 800 -16.553 -4.801 1.031 1.00 0.00 C ATOM 1329 C ASP A 800 -17.034 -5.516 2.279 1.00 0.00 C ATOM 1330 O ASP A 800 -16.778 -6.709 2.442 1.00 0.00 O ATOM 1331 CB ASP A 800 -17.630 -4.855 -0.054 1.00 0.00 C ATOM 1332 CG ASP A 800 -18.917 -4.171 0.357 1.00 0.00 C ATOM 1333 OD1 ASP A 800 -19.829 -4.861 0.865 1.00 0.00 O ATOM 1334 OD2 ASP A 800 -19.027 -2.947 0.169 1.00 0.00 O ATOM 0 H ASP A 800 -15.432 -5.899 -0.347 1.00 0.00 H new ATOM 0 HA ASP A 800 -16.349 -3.756 1.263 1.00 0.00 H new ATOM 0 HB2 ASP A 800 -17.249 -4.385 -0.961 1.00 0.00 H new ATOM 0 HB3 ASP A 800 -17.840 -5.896 -0.298 1.00 0.00 H new ATOM 1339 N SER A 801 -17.746 -4.790 3.134 1.00 0.00 N ATOM 1340 CA SER A 801 -18.131 -5.275 4.458 1.00 0.00 C ATOM 1341 C SER A 801 -19.040 -6.504 4.390 1.00 0.00 C ATOM 1342 O SER A 801 -19.344 -7.115 5.414 1.00 0.00 O ATOM 1343 CB SER A 801 -18.837 -4.159 5.215 1.00 0.00 C ATOM 1344 OG SER A 801 -18.151 -2.926 5.068 1.00 0.00 O ATOM 0 H SER A 801 -18.074 -3.846 2.930 1.00 0.00 H new ATOM 0 HA SER A 801 -17.221 -5.575 4.977 1.00 0.00 H new ATOM 0 HB2 SER A 801 -19.858 -4.056 4.848 1.00 0.00 H new ATOM 0 HB3 SER A 801 -18.903 -4.418 6.272 1.00 0.00 H new ATOM 0 HG SER A 801 -17.190 -3.069 5.196 1.00 0.00 H new ATOM 1350 N THR A 802 -19.490 -6.847 3.192 1.00 0.00 N ATOM 1351 CA THR A 802 -20.300 -8.037 2.989 1.00 0.00 C ATOM 1352 C THR A 802 -19.424 -9.198 2.529 1.00 0.00 C ATOM 1353 O THR A 802 -19.913 -10.279 2.195 1.00 0.00 O ATOM 1354 CB THR A 802 -21.396 -7.777 1.942 1.00 0.00 C ATOM 1355 OG1 THR A 802 -20.804 -7.269 0.739 1.00 0.00 O ATOM 1356 CG2 THR A 802 -22.419 -6.785 2.468 1.00 0.00 C ATOM 0 H THR A 802 -19.306 -6.314 2.342 1.00 0.00 H new ATOM 0 HA THR A 802 -20.772 -8.292 3.938 1.00 0.00 H new ATOM 0 HB THR A 802 -21.904 -8.718 1.731 1.00 0.00 H new ATOM 0 HG1 THR A 802 -20.807 -6.289 0.761 1.00 0.00 H new ATOM 0 HG21 THR A 802 -23.185 -6.616 1.711 1.00 0.00 H new ATOM 0 HG22 THR A 802 -22.883 -7.184 3.370 1.00 0.00 H new ATOM 0 HG23 THR A 802 -21.925 -5.842 2.701 1.00 0.00 H new ATOM 1364 N GLY A 803 -18.123 -8.952 2.516 1.00 0.00 N ATOM 1365 CA GLY A 803 -17.166 -9.926 2.046 1.00 0.00 C ATOM 1366 C GLY A 803 -17.116 -9.989 0.538 1.00 0.00 C ATOM 1367 O GLY A 803 -17.060 -11.069 -0.049 1.00 0.00 O ATOM 0 H GLY A 803 -17.708 -8.075 2.830 1.00 0.00 H new ATOM 0 HA2 GLY A 803 -16.177 -9.678 2.431 1.00 0.00 H new ATOM 0 HA3 GLY A 803 -17.425 -10.908 2.441 1.00 0.00 H new ATOM 1371 N CYS A 804 -17.145 -8.826 -0.092 1.00 0.00 N ATOM 1372 CA CYS A 804 -17.033 -8.754 -1.543 1.00 0.00 C ATOM 1373 C CYS A 804 -15.692 -8.143 -1.921 1.00 0.00 C ATOM 1374 O CYS A 804 -15.474 -6.944 -1.755 1.00 0.00 O ATOM 1375 CB CYS A 804 -18.188 -7.949 -2.144 1.00 0.00 C ATOM 1376 SG CYS A 804 -19.824 -8.617 -1.751 1.00 0.00 S ATOM 0 H CYS A 804 -17.244 -7.924 0.373 1.00 0.00 H new ATOM 0 HA CYS A 804 -17.091 -9.763 -1.951 1.00 0.00 H new ATOM 0 HB2 CYS A 804 -18.129 -6.922 -1.784 1.00 0.00 H new ATOM 0 HB3 CYS A 804 -18.070 -7.915 -3.227 1.00 0.00 H new ATOM 0 HG CYS A 804 -20.166 -8.250 -0.552 1.00 0.00 H new ATOM 1382 N VAL A 805 -14.791 -8.977 -2.415 1.00 0.00 N ATOM 1383 CA VAL A 805 -13.427 -8.552 -2.676 1.00 0.00 C ATOM 1384 C VAL A 805 -13.303 -7.924 -4.065 1.00 0.00 C ATOM 1385 O VAL A 805 -13.450 -8.597 -5.087 1.00 0.00 O ATOM 1386 CB VAL A 805 -12.438 -9.728 -2.550 1.00 0.00 C ATOM 1387 CG1 VAL A 805 -11.014 -9.218 -2.413 1.00 0.00 C ATOM 1388 CG2 VAL A 805 -12.804 -10.621 -1.372 1.00 0.00 C ATOM 0 H VAL A 805 -14.981 -9.953 -2.643 1.00 0.00 H new ATOM 0 HA VAL A 805 -13.175 -7.803 -1.925 1.00 0.00 H new ATOM 0 HB VAL A 805 -12.503 -10.324 -3.460 1.00 0.00 H new ATOM 0 HG11 VAL A 805 -10.332 -10.063 -2.325 1.00 0.00 H new ATOM 0 HG12 VAL A 805 -10.752 -8.630 -3.292 1.00 0.00 H new ATOM 0 HG13 VAL A 805 -10.935 -8.594 -1.523 1.00 0.00 H new ATOM 0 HG21 VAL A 805 -12.092 -11.443 -1.304 1.00 0.00 H new ATOM 0 HG22 VAL A 805 -12.775 -10.039 -0.451 1.00 0.00 H new ATOM 0 HG23 VAL A 805 -13.808 -11.021 -1.517 1.00 0.00 H new ATOM 1398 N VAL A 806 -13.041 -6.627 -4.079 1.00 0.00 N ATOM 1399 CA VAL A 806 -12.878 -5.868 -5.308 1.00 0.00 C ATOM 1400 C VAL A 806 -11.416 -5.877 -5.741 1.00 0.00 C ATOM 1401 O VAL A 806 -10.513 -5.691 -4.920 1.00 0.00 O ATOM 1402 CB VAL A 806 -13.349 -4.404 -5.122 1.00 0.00 C ATOM 1403 CG1 VAL A 806 -13.044 -3.566 -6.355 1.00 0.00 C ATOM 1404 CG2 VAL A 806 -14.835 -4.354 -4.815 1.00 0.00 C ATOM 0 H VAL A 806 -12.935 -6.068 -3.233 1.00 0.00 H new ATOM 0 HA VAL A 806 -13.490 -6.339 -6.077 1.00 0.00 H new ATOM 0 HB VAL A 806 -12.800 -3.985 -4.279 1.00 0.00 H new ATOM 0 HG11 VAL A 806 -13.386 -2.544 -6.194 1.00 0.00 H new ATOM 0 HG12 VAL A 806 -11.969 -3.564 -6.537 1.00 0.00 H new ATOM 0 HG13 VAL A 806 -13.558 -3.989 -7.218 1.00 0.00 H new ATOM 0 HG21 VAL A 806 -15.146 -3.317 -4.688 1.00 0.00 H new ATOM 0 HG22 VAL A 806 -15.392 -4.801 -5.638 1.00 0.00 H new ATOM 0 HG23 VAL A 806 -15.036 -4.908 -3.898 1.00 0.00 H new ATOM 1414 N GLY A 807 -11.194 -6.106 -7.026 1.00 0.00 N ATOM 1415 CA GLY A 807 -9.847 -6.116 -7.562 1.00 0.00 C ATOM 1416 C GLY A 807 -9.276 -4.718 -7.660 1.00 0.00 C ATOM 1417 O GLY A 807 -9.842 -3.857 -8.340 1.00 0.00 O ATOM 0 H GLY A 807 -11.927 -6.286 -7.712 1.00 0.00 H new ATOM 0 HA2 GLY A 807 -9.206 -6.728 -6.926 1.00 0.00 H new ATOM 0 HA3 GLY A 807 -9.851 -6.578 -8.549 1.00 0.00 H new ATOM 1421 N LEU A 808 -8.165 -4.482 -6.978 1.00 0.00 N ATOM 1422 CA LEU A 808 -7.584 -3.157 -6.918 1.00 0.00 C ATOM 1423 C LEU A 808 -6.613 -2.891 -8.051 1.00 0.00 C ATOM 1424 O LEU A 808 -5.759 -3.720 -8.371 1.00 0.00 O ATOM 1425 CB LEU A 808 -6.891 -2.947 -5.584 1.00 0.00 C ATOM 1426 CG LEU A 808 -7.810 -3.036 -4.376 1.00 0.00 C ATOM 1427 CD1 LEU A 808 -7.072 -2.624 -3.122 1.00 0.00 C ATOM 1428 CD2 LEU A 808 -9.047 -2.198 -4.595 1.00 0.00 C ATOM 0 H LEU A 808 -7.651 -5.194 -6.459 1.00 0.00 H new ATOM 0 HA LEU A 808 -8.405 -2.448 -7.024 1.00 0.00 H new ATOM 0 HB2 LEU A 808 -6.100 -3.690 -5.479 1.00 0.00 H new ATOM 0 HB3 LEU A 808 -6.411 -1.968 -5.588 1.00 0.00 H new ATOM 0 HG LEU A 808 -8.129 -4.070 -4.247 1.00 0.00 H new ATOM 0 HD11 LEU A 808 -7.743 -2.693 -2.266 1.00 0.00 H new ATOM 0 HD12 LEU A 808 -6.219 -3.285 -2.968 1.00 0.00 H new ATOM 0 HD13 LEU A 808 -6.722 -1.597 -3.227 1.00 0.00 H new ATOM 0 HD21 LEU A 808 -9.696 -2.272 -3.722 1.00 0.00 H new ATOM 0 HD22 LEU A 808 -8.759 -1.158 -4.747 1.00 0.00 H new ATOM 0 HD23 LEU A 808 -9.580 -2.559 -5.474 1.00 0.00 H new ATOM 1440 N SER A 809 -6.776 -1.732 -8.667 1.00 0.00 N ATOM 1441 CA SER A 809 -5.844 -1.242 -9.661 1.00 0.00 C ATOM 1442 C SER A 809 -5.825 0.283 -9.638 1.00 0.00 C ATOM 1443 O SER A 809 -6.586 0.937 -10.353 1.00 0.00 O ATOM 1444 CB SER A 809 -6.230 -1.751 -11.052 1.00 0.00 C ATOM 1445 OG SER A 809 -6.274 -3.169 -11.077 1.00 0.00 O ATOM 0 H SER A 809 -7.561 -1.105 -8.489 1.00 0.00 H new ATOM 0 HA SER A 809 -4.846 -1.613 -9.427 1.00 0.00 H new ATOM 0 HB2 SER A 809 -7.202 -1.348 -11.334 1.00 0.00 H new ATOM 0 HB3 SER A 809 -5.510 -1.392 -11.788 1.00 0.00 H new ATOM 0 HG SER A 809 -6.524 -3.473 -11.975 1.00 0.00 H new ATOM 1451 N GLN A 810 -4.984 0.836 -8.779 1.00 0.00 N ATOM 1452 CA GLN A 810 -4.764 2.278 -8.730 1.00 0.00 C ATOM 1453 C GLN A 810 -3.266 2.585 -8.624 1.00 0.00 C ATOM 1454 O GLN A 810 -2.467 1.656 -8.477 1.00 0.00 O ATOM 1455 CB GLN A 810 -5.546 2.916 -7.583 1.00 0.00 C ATOM 1456 CG GLN A 810 -6.904 3.440 -8.022 1.00 0.00 C ATOM 1457 CD GLN A 810 -7.551 4.356 -7.005 1.00 0.00 C ATOM 1458 OE1 GLN A 810 -7.405 5.577 -7.061 1.00 0.00 O ATOM 1459 NE2 GLN A 810 -8.250 3.765 -6.066 1.00 0.00 N ATOM 0 H GLN A 810 -4.437 0.306 -8.100 1.00 0.00 H new ATOM 0 HA GLN A 810 -5.135 2.714 -9.657 1.00 0.00 H new ATOM 0 HB2 GLN A 810 -5.683 2.182 -6.789 1.00 0.00 H new ATOM 0 HB3 GLN A 810 -4.963 3.735 -7.162 1.00 0.00 H new ATOM 0 HG2 GLN A 810 -6.791 3.977 -8.964 1.00 0.00 H new ATOM 0 HG3 GLN A 810 -7.567 2.596 -8.214 1.00 0.00 H new ATOM 0 HE21 GLN A 810 -8.342 2.749 -6.062 1.00 0.00 H new ATOM 0 HE22 GLN A 810 -8.701 4.321 -5.340 1.00 0.00 H new ATOM 1468 N PRO A 811 -2.856 3.869 -8.735 1.00 0.00 N ATOM 1469 CA PRO A 811 -1.441 4.268 -8.661 1.00 0.00 C ATOM 1470 C PRO A 811 -0.662 3.621 -7.511 1.00 0.00 C ATOM 1471 O PRO A 811 -1.145 3.513 -6.382 1.00 0.00 O ATOM 1472 CB PRO A 811 -1.516 5.777 -8.464 1.00 0.00 C ATOM 1473 CG PRO A 811 -2.765 6.178 -9.165 1.00 0.00 C ATOM 1474 CD PRO A 811 -3.730 5.037 -8.986 1.00 0.00 C ATOM 0 HA PRO A 811 -0.901 3.949 -9.553 1.00 0.00 H new ATOM 0 HB2 PRO A 811 -1.552 6.039 -7.406 1.00 0.00 H new ATOM 0 HB3 PRO A 811 -0.645 6.277 -8.887 1.00 0.00 H new ATOM 0 HG2 PRO A 811 -3.169 7.099 -8.745 1.00 0.00 H new ATOM 0 HG3 PRO A 811 -2.575 6.366 -10.222 1.00 0.00 H new ATOM 0 HD2 PRO A 811 -4.409 5.215 -8.152 1.00 0.00 H new ATOM 0 HD3 PRO A 811 -4.346 4.892 -9.873 1.00 0.00 H new ATOM 1482 N ASP A 812 0.555 3.206 -7.833 1.00 0.00 N ATOM 1483 CA ASP A 812 1.463 2.555 -6.889 1.00 0.00 C ATOM 1484 C ASP A 812 2.613 3.486 -6.539 1.00 0.00 C ATOM 1485 O ASP A 812 2.816 4.516 -7.187 1.00 0.00 O ATOM 1486 CB ASP A 812 2.026 1.267 -7.488 1.00 0.00 C ATOM 1487 CG ASP A 812 2.643 1.485 -8.854 1.00 0.00 C ATOM 1488 OD1 ASP A 812 1.895 1.491 -9.854 1.00 0.00 O ATOM 1489 OD2 ASP A 812 3.872 1.661 -8.938 1.00 0.00 O ATOM 0 H ASP A 812 0.948 3.312 -8.768 1.00 0.00 H new ATOM 0 HA ASP A 812 0.900 2.315 -5.987 1.00 0.00 H new ATOM 0 HB2 ASP A 812 2.778 0.855 -6.815 1.00 0.00 H new ATOM 0 HB3 ASP A 812 1.229 0.528 -7.566 1.00 0.00 H new ATOM 1494 N ALA A 813 3.355 3.124 -5.507 1.00 0.00 N ATOM 1495 CA ALA A 813 4.489 3.924 -5.058 1.00 0.00 C ATOM 1496 C ALA A 813 5.740 3.074 -4.974 1.00 0.00 C ATOM 1497 O ALA A 813 5.684 1.923 -4.552 1.00 0.00 O ATOM 1498 CB ALA A 813 4.221 4.558 -3.712 1.00 0.00 C ATOM 0 H ALA A 813 3.194 2.278 -4.960 1.00 0.00 H new ATOM 0 HA ALA A 813 4.637 4.717 -5.791 1.00 0.00 H new ATOM 0 HB1 ALA A 813 5.087 5.147 -3.408 1.00 0.00 H new ATOM 0 HB2 ALA A 813 3.348 5.207 -3.783 1.00 0.00 H new ATOM 0 HB3 ALA A 813 4.035 3.778 -2.973 1.00 0.00 H new ATOM 1504 N LYS A 814 6.865 3.634 -5.358 1.00 0.00 N ATOM 1505 CA LYS A 814 8.112 2.906 -5.322 1.00 0.00 C ATOM 1506 C LYS A 814 8.918 3.288 -4.090 1.00 0.00 C ATOM 1507 O LYS A 814 9.115 4.464 -3.800 1.00 0.00 O ATOM 1508 CB LYS A 814 8.918 3.184 -6.587 1.00 0.00 C ATOM 1509 CG LYS A 814 10.074 2.226 -6.788 1.00 0.00 C ATOM 1510 CD LYS A 814 10.893 2.600 -8.011 1.00 0.00 C ATOM 1511 CE LYS A 814 12.097 1.690 -8.184 1.00 0.00 C ATOM 1512 NZ LYS A 814 12.913 2.076 -9.366 1.00 0.00 N ATOM 0 H LYS A 814 6.941 4.592 -5.699 1.00 0.00 H new ATOM 0 HA LYS A 814 7.890 1.840 -5.272 1.00 0.00 H new ATOM 0 HB2 LYS A 814 8.255 3.128 -7.451 1.00 0.00 H new ATOM 0 HB3 LYS A 814 9.303 4.203 -6.547 1.00 0.00 H new ATOM 0 HG2 LYS A 814 10.712 2.232 -5.904 1.00 0.00 H new ATOM 0 HG3 LYS A 814 9.693 1.211 -6.899 1.00 0.00 H new ATOM 0 HD2 LYS A 814 10.265 2.544 -8.900 1.00 0.00 H new ATOM 0 HD3 LYS A 814 11.228 3.633 -7.922 1.00 0.00 H new ATOM 0 HE2 LYS A 814 12.715 1.729 -7.287 1.00 0.00 H new ATOM 0 HE3 LYS A 814 11.761 0.659 -8.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 814 13.726 1.433 -9.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 814 12.330 2.014 -10.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 814 13.254 3.051 -9.249 1.00 0.00 H new ATOM 1526 N ILE A 815 9.361 2.281 -3.366 1.00 0.00 N ATOM 1527 CA ILE A 815 10.207 2.462 -2.201 1.00 0.00 C ATOM 1528 C ILE A 815 11.592 1.893 -2.508 1.00 0.00 C ATOM 1529 O ILE A 815 11.761 0.682 -2.631 1.00 0.00 O ATOM 1530 CB ILE A 815 9.626 1.747 -0.958 1.00 0.00 C ATOM 1531 CG1 ILE A 815 8.215 2.255 -0.629 1.00 0.00 C ATOM 1532 CG2 ILE A 815 10.544 1.935 0.236 1.00 0.00 C ATOM 1533 CD1 ILE A 815 7.097 1.443 -1.260 1.00 0.00 C ATOM 0 H ILE A 815 9.143 1.306 -3.570 1.00 0.00 H new ATOM 0 HA ILE A 815 10.265 3.527 -1.978 1.00 0.00 H new ATOM 0 HB ILE A 815 9.555 0.684 -1.187 1.00 0.00 H new ATOM 0 HG12 ILE A 815 8.084 2.253 0.453 1.00 0.00 H new ATOM 0 HG13 ILE A 815 8.128 3.290 -0.959 1.00 0.00 H new ATOM 0 HG21 ILE A 815 10.122 1.426 1.103 1.00 0.00 H new ATOM 0 HG22 ILE A 815 11.524 1.515 0.011 1.00 0.00 H new ATOM 0 HG23 ILE A 815 10.646 2.998 0.453 1.00 0.00 H new ATOM 0 HD11 ILE A 815 6.134 1.869 -0.978 1.00 0.00 H new ATOM 0 HD12 ILE A 815 7.199 1.465 -2.345 1.00 0.00 H new ATOM 0 HD13 ILE A 815 7.154 0.412 -0.911 1.00 0.00 H new ATOM 1545 N GLN A 816 12.573 2.764 -2.649 1.00 0.00 N ATOM 1546 CA GLN A 816 13.912 2.348 -3.033 1.00 0.00 C ATOM 1547 C GLN A 816 14.845 2.418 -1.829 1.00 0.00 C ATOM 1548 O GLN A 816 15.212 3.499 -1.373 1.00 0.00 O ATOM 1549 CB GLN A 816 14.420 3.232 -4.160 1.00 0.00 C ATOM 1550 CG GLN A 816 15.483 2.571 -5.016 1.00 0.00 C ATOM 1551 CD GLN A 816 16.868 2.608 -4.404 1.00 0.00 C ATOM 1552 OE1 GLN A 816 17.619 3.559 -4.602 1.00 0.00 O ATOM 1553 NE2 GLN A 816 17.221 1.571 -3.666 1.00 0.00 N ATOM 0 H GLN A 816 12.469 3.768 -2.503 1.00 0.00 H new ATOM 0 HA GLN A 816 13.884 1.317 -3.385 1.00 0.00 H new ATOM 0 HB2 GLN A 816 13.580 3.517 -4.794 1.00 0.00 H new ATOM 0 HB3 GLN A 816 14.826 4.150 -3.736 1.00 0.00 H new ATOM 0 HG2 GLN A 816 15.201 1.533 -5.192 1.00 0.00 H new ATOM 0 HG3 GLN A 816 15.512 3.063 -5.988 1.00 0.00 H new ATOM 0 HE21 GLN A 816 16.569 0.800 -3.525 1.00 0.00 H new ATOM 0 HE22 GLN A 816 18.146 1.541 -3.237 1.00 0.00 H new ATOM 1562 N VAL A 817 15.237 1.261 -1.333 1.00 0.00 N ATOM 1563 CA VAL A 817 16.034 1.173 -0.116 1.00 0.00 C ATOM 1564 C VAL A 817 17.510 0.970 -0.456 1.00 0.00 C ATOM 1565 O VAL A 817 17.845 0.253 -1.390 1.00 0.00 O ATOM 1566 CB VAL A 817 15.549 0.004 0.768 1.00 0.00 C ATOM 1567 CG1 VAL A 817 16.102 0.111 2.182 1.00 0.00 C ATOM 1568 CG2 VAL A 817 14.031 -0.048 0.782 1.00 0.00 C ATOM 0 H VAL A 817 15.016 0.359 -1.755 1.00 0.00 H new ATOM 0 HA VAL A 817 15.916 2.109 0.431 1.00 0.00 H new ATOM 0 HB VAL A 817 15.926 -0.925 0.340 1.00 0.00 H new ATOM 0 HG11 VAL A 817 15.741 -0.727 2.778 1.00 0.00 H new ATOM 0 HG12 VAL A 817 17.191 0.091 2.149 1.00 0.00 H new ATOM 0 HG13 VAL A 817 15.770 1.046 2.633 1.00 0.00 H new ATOM 0 HG21 VAL A 817 13.701 -0.877 1.409 1.00 0.00 H new ATOM 0 HG22 VAL A 817 13.639 0.887 1.181 1.00 0.00 H new ATOM 0 HG23 VAL A 817 13.663 -0.192 -0.234 1.00 0.00 H new ATOM 1578 N ARG A 818 18.388 1.607 0.295 1.00 0.00 N ATOM 1579 CA ARG A 818 19.823 1.454 0.106 1.00 0.00 C ATOM 1580 C ARG A 818 20.458 1.093 1.431 1.00 0.00 C ATOM 1581 O ARG A 818 19.768 0.991 2.435 1.00 0.00 O ATOM 1582 CB ARG A 818 20.451 2.744 -0.434 1.00 0.00 C ATOM 1583 CG ARG A 818 20.060 3.094 -1.859 1.00 0.00 C ATOM 1584 CD ARG A 818 20.583 2.072 -2.855 1.00 0.00 C ATOM 1585 NE ARG A 818 20.379 2.508 -4.236 1.00 0.00 N ATOM 1586 CZ ARG A 818 20.583 1.744 -5.310 1.00 0.00 C ATOM 1587 NH1 ARG A 818 20.980 0.485 -5.174 1.00 0.00 N ATOM 1588 NH2 ARG A 818 20.388 2.247 -6.523 1.00 0.00 N ATOM 0 H ARG A 818 18.131 2.243 1.050 1.00 0.00 H new ATOM 0 HA ARG A 818 19.998 0.663 -0.624 1.00 0.00 H new ATOM 0 HB2 ARG A 818 20.169 3.570 0.219 1.00 0.00 H new ATOM 0 HB3 ARG A 818 21.536 2.653 -0.382 1.00 0.00 H new ATOM 0 HG2 ARG A 818 18.974 3.152 -1.934 1.00 0.00 H new ATOM 0 HG3 ARG A 818 20.450 4.080 -2.111 1.00 0.00 H new ATOM 0 HD2 ARG A 818 21.646 1.904 -2.680 1.00 0.00 H new ATOM 0 HD3 ARG A 818 20.079 1.119 -2.696 1.00 0.00 H new ATOM 0 HE ARG A 818 20.058 3.464 -4.389 1.00 0.00 H new ATOM 0 HH11 ARG A 818 21.131 0.096 -4.243 1.00 0.00 H new ATOM 0 HH12 ARG A 818 21.134 -0.093 -6.000 1.00 0.00 H new ATOM 0 HH21 ARG A 818 20.083 3.214 -6.631 1.00 0.00 H new ATOM 0 HH22 ARG A 818 20.543 1.666 -7.347 1.00 0.00 H new ATOM 1602 N ARG A 819 21.755 0.855 1.437 1.00 0.00 N ATOM 1603 CA ARG A 819 22.446 0.547 2.673 1.00 0.00 C ATOM 1604 C ARG A 819 23.504 1.597 2.973 1.00 0.00 C ATOM 1605 O ARG A 819 24.300 1.961 2.105 1.00 0.00 O ATOM 1606 CB ARG A 819 23.078 -0.831 2.610 1.00 0.00 C ATOM 1607 CG ARG A 819 22.098 -1.932 2.246 1.00 0.00 C ATOM 1608 CD ARG A 819 22.490 -3.255 2.876 1.00 0.00 C ATOM 1609 NE ARG A 819 23.818 -3.699 2.453 1.00 0.00 N ATOM 1610 CZ ARG A 819 24.324 -4.906 2.715 1.00 0.00 C ATOM 1611 NH1 ARG A 819 23.633 -5.784 3.431 1.00 0.00 N ATOM 1612 NH2 ARG A 819 25.528 -5.230 2.265 1.00 0.00 N ATOM 0 H ARG A 819 22.347 0.869 0.607 1.00 0.00 H new ATOM 0 HA ARG A 819 21.712 0.553 3.479 1.00 0.00 H new ATOM 0 HB2 ARG A 819 23.886 -0.818 1.878 1.00 0.00 H new ATOM 0 HB3 ARG A 819 23.527 -1.060 3.576 1.00 0.00 H new ATOM 0 HG2 ARG A 819 21.097 -1.653 2.575 1.00 0.00 H new ATOM 0 HG3 ARG A 819 22.058 -2.041 1.162 1.00 0.00 H new ATOM 0 HD2 ARG A 819 22.470 -3.158 3.961 1.00 0.00 H new ATOM 0 HD3 ARG A 819 21.754 -4.014 2.610 1.00 0.00 H new ATOM 0 HE ARG A 819 24.394 -3.044 1.924 1.00 0.00 H new ATOM 0 HH11 ARG A 819 22.709 -5.538 3.785 1.00 0.00 H new ATOM 0 HH12 ARG A 819 24.026 -6.704 3.627 1.00 0.00 H new ATOM 0 HH21 ARG A 819 26.067 -4.557 1.719 1.00 0.00 H new ATOM 0 HH22 ARG A 819 25.916 -6.152 2.464 1.00 0.00 H new ATOM 1626 N ASP A 820 23.494 2.096 4.197 1.00 0.00 N ATOM 1627 CA ASP A 820 24.449 3.104 4.623 1.00 0.00 C ATOM 1628 C ASP A 820 25.507 2.484 5.533 1.00 0.00 C ATOM 1629 O ASP A 820 26.702 2.675 5.319 1.00 99.99 O ATOM 1630 CB ASP A 820 23.721 4.270 5.318 1.00 0.00 C ATOM 1631 CG ASP A 820 22.873 3.846 6.510 1.00 0.00 C ATOM 1632 OD1 ASP A 820 23.056 4.416 7.607 1.00 0.00 O ATOM 1633 OD2 ASP A 820 22.017 2.941 6.358 1.00 0.00 O ATOM 0 H ASP A 820 22.829 1.817 4.918 1.00 0.00 H new ATOM 0 HA ASP A 820 24.958 3.503 3.746 1.00 0.00 H new ATOM 0 HB2 ASP A 820 24.459 4.999 5.651 1.00 0.00 H new ATOM 0 HB3 ASP A 820 23.083 4.772 4.591 1.00 0.00 H new TER 1638 ASP A 820