USER MOD reduce.3.24.130724 H: found=0, std=0, add=836, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 837 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 786 THR OG1 : rot -9:sc= 1.07 USER MOD Set 1.2: A 787 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 739 SER OG : rot -150:sc= 0.943 USER MOD Set 2.2: A 782 THR OG1 : rot -70:sc= -0.277 USER MOD Set 3.1: A 752 THR OG1 : rot 90:sc= 0.667 USER MOD Set 3.2: A 771 LYS NZ :NH3+ -142:sc= -0.634 (180deg=-3.36!) USER MOD Single : A 720 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 722 SER OG : rot -11:sc= 0.867 USER MOD Single : A 724 SER OG : rot 180:sc= 0 USER MOD Single : A 726 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 728 HIS : no HD1:sc= 0 X(o=0,f=-0.0036) USER MOD Single : A 729 HIS : no HD1:sc= -0.191 X(o=-0.19,f=-0.013) USER MOD Single : A 732 LYS NZ :NH3+ 163:sc= -1.07 (180deg=-1.58) USER MOD Single : A 734 CYS SG : rot 180:sc= 0 USER MOD Single : A 738 HIS : no HD1:sc=-0.00332 X(o=-0.0033,f=0) USER MOD Single : A 740 SER OG : rot 180:sc= 0 USER MOD Single : A 746 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00502) USER MOD Single : A 748 GLN : amide:sc= -0.389 X(o=-0.39,f=-0.1) USER MOD Single : A 754 THR OG1 : rot 78:sc= 0.0519 USER MOD Single : A 755 TYR OH : rot -76:sc= -0.0754 USER MOD Single : A 760 THR OG1 : rot 21:sc= 0.599! USER MOD Single : A 762 SER OG : rot 81:sc= 1.23 USER MOD Single : A 763 SER OG : rot 180:sc= 0 USER MOD Single : A 764 LYS NZ :NH3+ 149:sc= -0.346 (180deg=-2.17!) USER MOD Single : A 766 LYS NZ :NH3+ -174:sc= 1.24 (180deg=1.02) USER MOD Single : A 767 THR OG1 : rot 180:sc= 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 776 ASN : amide:sc= -0.426! K(o=-0.43!,f=-0.99) USER MOD Single : A 778 TYR OH : rot 180:sc= 0 USER MOD Single : A 781 LYS NZ :NH3+ 165:sc= 1.24 (180deg=0.971) USER MOD Single : A 791 TYR OH : rot 180:sc= 0 USER MOD Single : A 794 SER OG : rot 180:sc= -0.23 USER MOD Single : A 797 SER OG : rot 5:sc= 1.16 USER MOD Single : A 799 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 801 SER OG : rot -44:sc= 0.188 USER MOD Single : A 802 THR OG1 : rot -45:sc= 0.67 USER MOD Single : A 804 CYS SG : rot 180:sc= 0 USER MOD Single : A 809 SER OG : rot 180:sc= 0 USER MOD Single : A 810 GLN : amide:sc= -3.67! C(o=-3.7!,f=-4!) USER MOD Single : A 814 LYS NZ :NH3+ -127:sc= 1.24 (180deg=-0.213) USER MOD Single : A 816 GLN :FLIP amide:sc= -0.198 F(o=-0.91,f=-0.2) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 718 -23.424 -0.884 -3.044 1.00 0.00 N ATOM 2 CA ARG A 718 -21.984 -1.063 -3.150 1.00 0.00 C ATOM 3 C ARG A 718 -21.336 0.097 -3.851 1.00 0.00 C ATOM 4 O ARG A 718 -21.982 0.895 -4.530 1.00 0.00 O ATOM 5 CB ARG A 718 -21.631 -2.363 -3.872 1.00 0.00 C ATOM 6 CG ARG A 718 -21.788 -3.611 -3.018 1.00 0.00 C ATOM 7 CD ARG A 718 -20.967 -3.532 -1.738 1.00 0.00 C ATOM 8 NE ARG A 718 -21.659 -2.792 -0.681 1.00 0.00 N ATOM 9 CZ ARG A 718 -21.069 -1.959 0.180 1.00 0.00 C ATOM 10 NH1 ARG A 718 -19.770 -1.699 0.095 1.00 0.00 N ATOM 11 NH2 ARG A 718 -21.791 -1.372 1.123 1.00 0.00 N ATOM 0 HA ARG A 718 -21.599 -1.115 -2.132 1.00 0.00 H new ATOM 0 HB2 ARG A 718 -22.263 -2.458 -4.755 1.00 0.00 H new ATOM 0 HB3 ARG A 718 -20.601 -2.303 -4.222 1.00 0.00 H new ATOM 0 HG2 ARG A 718 -22.840 -3.748 -2.766 1.00 0.00 H new ATOM 0 HG3 ARG A 718 -21.481 -4.485 -3.593 1.00 0.00 H new ATOM 0 HD2 ARG A 718 -20.745 -4.540 -1.388 1.00 0.00 H new ATOM 0 HD3 ARG A 718 -20.012 -3.051 -1.950 1.00 0.00 H new ATOM 0 HE ARG A 718 -22.667 -2.922 -0.596 1.00 0.00 H new ATOM 0 HH11 ARG A 718 -19.209 -2.138 -0.635 1.00 0.00 H new ATOM 0 HH12 ARG A 718 -19.333 -1.061 0.760 1.00 0.00 H new ATOM 0 HH21 ARG A 718 -22.792 -1.557 1.189 1.00 0.00 H new ATOM 0 HH22 ARG A 718 -21.346 -0.735 1.784 1.00 0.00 H new ATOM 25 N VAL A 719 -20.045 0.165 -3.671 1.00 0.00 N ATOM 26 CA VAL A 719 -19.250 1.227 -4.208 1.00 0.00 C ATOM 27 C VAL A 719 -18.045 0.599 -4.879 1.00 0.00 C ATOM 28 O VAL A 719 -17.907 -0.625 -4.896 1.00 0.00 O ATOM 29 CB VAL A 719 -18.820 2.212 -3.086 1.00 0.00 C ATOM 30 CG1 VAL A 719 -17.713 1.626 -2.220 1.00 0.00 C ATOM 31 CG2 VAL A 719 -18.412 3.569 -3.645 1.00 0.00 C ATOM 0 H VAL A 719 -19.513 -0.525 -3.141 1.00 0.00 H new ATOM 0 HA VAL A 719 -19.822 1.806 -4.933 1.00 0.00 H new ATOM 0 HB VAL A 719 -19.694 2.368 -2.453 1.00 0.00 H new ATOM 0 HG11 VAL A 719 -17.438 2.343 -1.446 1.00 0.00 H new ATOM 0 HG12 VAL A 719 -18.065 0.706 -1.754 1.00 0.00 H new ATOM 0 HG13 VAL A 719 -16.843 1.409 -2.839 1.00 0.00 H new ATOM 0 HG21 VAL A 719 -18.119 4.226 -2.827 1.00 0.00 H new ATOM 0 HG22 VAL A 719 -17.572 3.443 -4.328 1.00 0.00 H new ATOM 0 HG23 VAL A 719 -19.253 4.009 -4.181 1.00 0.00 H new ATOM 41 N LYS A 720 -17.205 1.423 -5.435 1.00 0.00 N ATOM 42 CA LYS A 720 -15.984 0.972 -6.070 1.00 0.00 C ATOM 43 C LYS A 720 -14.796 1.386 -5.219 1.00 0.00 C ATOM 44 O LYS A 720 -14.232 2.468 -5.394 1.00 0.00 O ATOM 45 CB LYS A 720 -15.846 1.534 -7.483 1.00 0.00 C ATOM 46 CG LYS A 720 -16.910 1.039 -8.452 1.00 0.00 C ATOM 47 CD LYS A 720 -16.705 1.609 -9.848 1.00 0.00 C ATOM 48 CE LYS A 720 -15.340 1.242 -10.410 1.00 0.00 C ATOM 49 NZ LYS A 720 -15.125 1.794 -11.773 1.00 0.00 N ATOM 0 H LYS A 720 -17.341 2.433 -5.465 1.00 0.00 H new ATOM 0 HA LYS A 720 -16.018 -0.114 -6.154 1.00 0.00 H new ATOM 0 HB2 LYS A 720 -15.890 2.622 -7.436 1.00 0.00 H new ATOM 0 HB3 LYS A 720 -14.863 1.271 -7.873 1.00 0.00 H new ATOM 0 HG2 LYS A 720 -16.885 -0.050 -8.496 1.00 0.00 H new ATOM 0 HG3 LYS A 720 -17.897 1.321 -8.085 1.00 0.00 H new ATOM 0 HD2 LYS A 720 -17.484 1.235 -10.512 1.00 0.00 H new ATOM 0 HD3 LYS A 720 -16.806 2.694 -9.817 1.00 0.00 H new ATOM 0 HE2 LYS A 720 -14.563 1.614 -9.743 1.00 0.00 H new ATOM 0 HE3 LYS A 720 -15.242 0.157 -10.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 720 -14.182 1.518 -12.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 720 -15.850 1.419 -12.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 720 -15.192 2.831 -11.742 1.00 0.00 H new ATOM 63 N PRO A 721 -14.428 0.532 -4.266 1.00 0.00 N ATOM 64 CA PRO A 721 -13.390 0.818 -3.297 1.00 0.00 C ATOM 65 C PRO A 721 -12.005 0.423 -3.795 1.00 0.00 C ATOM 66 O PRO A 721 -11.847 -0.578 -4.496 1.00 0.00 O ATOM 67 CB PRO A 721 -13.819 -0.021 -2.096 1.00 0.00 C ATOM 68 CG PRO A 721 -14.630 -1.153 -2.657 1.00 0.00 C ATOM 69 CD PRO A 721 -14.986 -0.812 -4.077 1.00 0.00 C ATOM 0 HA PRO A 721 -13.296 1.881 -3.076 1.00 0.00 H new ATOM 0 HB2 PRO A 721 -12.952 -0.394 -1.550 1.00 0.00 H new ATOM 0 HB3 PRO A 721 -14.407 0.571 -1.395 1.00 0.00 H new ATOM 0 HG2 PRO A 721 -14.063 -2.083 -2.619 1.00 0.00 H new ATOM 0 HG3 PRO A 721 -15.532 -1.306 -2.064 1.00 0.00 H new ATOM 0 HD2 PRO A 721 -14.556 -1.526 -4.779 1.00 0.00 H new ATOM 0 HD3 PRO A 721 -16.065 -0.822 -4.232 1.00 0.00 H new ATOM 77 N SER A 722 -11.007 1.211 -3.417 1.00 0.00 N ATOM 78 CA SER A 722 -9.646 1.072 -3.924 1.00 0.00 C ATOM 79 C SER A 722 -8.708 1.949 -3.094 1.00 0.00 C ATOM 80 O SER A 722 -9.017 2.271 -1.949 1.00 0.00 O ATOM 81 CB SER A 722 -9.579 1.478 -5.405 1.00 0.00 C ATOM 82 OG SER A 722 -10.403 0.664 -6.221 1.00 0.00 O ATOM 0 H SER A 722 -11.119 1.970 -2.745 1.00 0.00 H new ATOM 0 HA SER A 722 -9.338 0.030 -3.842 1.00 0.00 H new ATOM 0 HB2 SER A 722 -9.884 2.519 -5.509 1.00 0.00 H new ATOM 0 HB3 SER A 722 -8.548 1.411 -5.752 1.00 0.00 H new ATOM 0 HG SER A 722 -10.713 -0.109 -5.705 1.00 0.00 H new ATOM 88 N ALA A 723 -7.570 2.334 -3.655 1.00 0.00 N ATOM 89 CA ALA A 723 -6.629 3.176 -2.943 1.00 0.00 C ATOM 90 C ALA A 723 -5.810 4.016 -3.915 1.00 0.00 C ATOM 91 O ALA A 723 -5.466 3.552 -4.995 1.00 0.00 O ATOM 92 CB ALA A 723 -5.727 2.318 -2.078 1.00 0.00 C ATOM 0 H ALA A 723 -7.280 2.076 -4.598 1.00 0.00 H new ATOM 0 HA ALA A 723 -7.184 3.860 -2.301 1.00 0.00 H new ATOM 0 HB1 ALA A 723 -5.021 2.955 -1.545 1.00 0.00 H new ATOM 0 HB2 ALA A 723 -6.331 1.765 -1.359 1.00 0.00 H new ATOM 0 HB3 ALA A 723 -5.179 1.617 -2.707 1.00 0.00 H new ATOM 98 N SER A 724 -5.503 5.248 -3.536 1.00 0.00 N ATOM 99 CA SER A 724 -4.729 6.127 -4.394 1.00 0.00 C ATOM 100 C SER A 724 -3.621 6.772 -3.582 1.00 0.00 C ATOM 101 O SER A 724 -3.858 7.720 -2.827 1.00 0.00 O ATOM 102 CB SER A 724 -5.628 7.199 -5.015 1.00 0.00 C ATOM 103 OG SER A 724 -4.919 7.986 -5.957 1.00 0.00 O ATOM 0 H SER A 724 -5.778 5.658 -2.644 1.00 0.00 H new ATOM 0 HA SER A 724 -4.291 5.543 -5.203 1.00 0.00 H new ATOM 0 HB2 SER A 724 -6.479 6.724 -5.503 1.00 0.00 H new ATOM 0 HB3 SER A 724 -6.027 7.841 -4.230 1.00 0.00 H new ATOM 0 HG SER A 724 -5.519 8.661 -6.338 1.00 0.00 H new ATOM 109 N LEU A 725 -2.420 6.229 -3.695 1.00 0.00 N ATOM 110 CA LEU A 725 -1.309 6.691 -2.929 1.00 0.00 C ATOM 111 C LEU A 725 -0.958 8.126 -3.233 1.00 0.00 C ATOM 112 O LEU A 725 -1.033 8.598 -4.368 1.00 0.00 O ATOM 113 CB LEU A 725 -0.115 5.791 -3.152 1.00 0.00 C ATOM 114 CG LEU A 725 -0.224 4.402 -2.527 1.00 0.00 C ATOM 115 CD1 LEU A 725 -1.505 3.714 -2.914 1.00 0.00 C ATOM 116 CD2 LEU A 725 0.959 3.576 -2.923 1.00 0.00 C ATOM 0 H LEU A 725 -2.203 5.456 -4.325 1.00 0.00 H new ATOM 0 HA LEU A 725 -1.598 6.653 -1.879 1.00 0.00 H new ATOM 0 HB2 LEU A 725 0.040 5.678 -4.225 1.00 0.00 H new ATOM 0 HB3 LEU A 725 0.771 6.284 -2.752 1.00 0.00 H new ATOM 0 HG LEU A 725 -0.236 4.518 -1.443 1.00 0.00 H new ATOM 0 HD11 LEU A 725 -1.544 2.729 -2.449 1.00 0.00 H new ATOM 0 HD12 LEU A 725 -2.354 4.309 -2.576 1.00 0.00 H new ATOM 0 HD13 LEU A 725 -1.547 3.605 -3.998 1.00 0.00 H new ATOM 0 HD21 LEU A 725 0.878 2.586 -2.475 1.00 0.00 H new ATOM 0 HD22 LEU A 725 0.990 3.482 -4.008 1.00 0.00 H new ATOM 0 HD23 LEU A 725 1.872 4.058 -2.574 1.00 0.00 H new ATOM 128 N LYS A 726 -0.565 8.794 -2.183 1.00 0.00 N ATOM 129 CA LYS A 726 -0.242 10.206 -2.230 1.00 0.00 C ATOM 130 C LYS A 726 1.252 10.402 -2.441 1.00 0.00 C ATOM 131 O LYS A 726 1.699 11.488 -2.799 1.00 0.00 O ATOM 132 CB LYS A 726 -0.681 10.895 -0.942 1.00 0.00 C ATOM 133 CG LYS A 726 -2.100 10.552 -0.533 1.00 0.00 C ATOM 134 CD LYS A 726 -2.641 11.529 0.494 1.00 0.00 C ATOM 135 CE LYS A 726 -2.956 12.872 -0.145 1.00 0.00 C ATOM 136 NZ LYS A 726 -3.349 13.890 0.864 1.00 0.00 N ATOM 0 H LYS A 726 -0.457 8.376 -1.259 1.00 0.00 H new ATOM 0 HA LYS A 726 -0.777 10.653 -3.068 1.00 0.00 H new ATOM 0 HB2 LYS A 726 -0.001 10.615 -0.138 1.00 0.00 H new ATOM 0 HB3 LYS A 726 -0.597 11.974 -1.069 1.00 0.00 H new ATOM 0 HG2 LYS A 726 -2.743 10.556 -1.413 1.00 0.00 H new ATOM 0 HG3 LYS A 726 -2.126 9.542 -0.124 1.00 0.00 H new ATOM 0 HD2 LYS A 726 -3.542 11.120 0.951 1.00 0.00 H new ATOM 0 HD3 LYS A 726 -1.911 11.664 1.292 1.00 0.00 H new ATOM 0 HE2 LYS A 726 -2.084 13.225 -0.696 1.00 0.00 H new ATOM 0 HE3 LYS A 726 -3.762 12.749 -0.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 726 -3.555 14.791 0.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 726 -4.196 13.566 1.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 726 -2.571 14.027 1.540 1.00 0.00 H new ATOM 150 N LEU A 727 2.024 9.346 -2.208 1.00 0.00 N ATOM 151 CA LEU A 727 3.460 9.403 -2.426 1.00 0.00 C ATOM 152 C LEU A 727 3.723 9.327 -3.928 1.00 0.00 C ATOM 153 O LEU A 727 3.530 8.281 -4.545 1.00 0.00 O ATOM 154 CB LEU A 727 4.165 8.250 -1.693 1.00 0.00 C ATOM 155 CG LEU A 727 5.593 8.543 -1.206 1.00 0.00 C ATOM 156 CD1 LEU A 727 6.165 7.333 -0.489 1.00 0.00 C ATOM 157 CD2 LEU A 727 6.503 8.943 -2.353 1.00 0.00 C ATOM 0 H LEU A 727 1.680 8.447 -1.870 1.00 0.00 H new ATOM 0 HA LEU A 727 3.858 10.337 -2.029 1.00 0.00 H new ATOM 0 HB2 LEU A 727 3.559 7.966 -0.833 1.00 0.00 H new ATOM 0 HB3 LEU A 727 4.198 7.387 -2.358 1.00 0.00 H new ATOM 0 HG LEU A 727 5.538 9.381 -0.511 1.00 0.00 H new ATOM 0 HD11 LEU A 727 7.177 7.556 -0.150 1.00 0.00 H new ATOM 0 HD12 LEU A 727 5.540 7.090 0.370 1.00 0.00 H new ATOM 0 HD13 LEU A 727 6.190 6.484 -1.172 1.00 0.00 H new ATOM 0 HD21 LEU A 727 7.504 9.142 -1.971 1.00 0.00 H new ATOM 0 HD22 LEU A 727 6.547 8.133 -3.082 1.00 0.00 H new ATOM 0 HD23 LEU A 727 6.112 9.841 -2.832 1.00 0.00 H new ATOM 169 N HIS A 728 4.156 10.433 -4.515 1.00 0.00 N ATOM 170 CA HIS A 728 4.267 10.521 -5.967 1.00 0.00 C ATOM 171 C HIS A 728 5.719 10.569 -6.434 1.00 0.00 C ATOM 172 O HIS A 728 6.089 11.424 -7.235 1.00 0.00 O ATOM 173 CB HIS A 728 3.506 11.749 -6.476 1.00 0.00 C ATOM 174 CG HIS A 728 2.028 11.672 -6.228 1.00 0.00 C ATOM 175 ND1 HIS A 728 1.304 12.684 -5.636 1.00 0.00 N ATOM 176 CD2 HIS A 728 1.142 10.684 -6.488 1.00 0.00 C ATOM 177 CE1 HIS A 728 0.038 12.318 -5.539 1.00 0.00 C ATOM 178 NE2 HIS A 728 -0.086 11.109 -6.047 1.00 0.00 N ATOM 0 H HIS A 728 4.435 11.277 -4.015 1.00 0.00 H new ATOM 0 HA HIS A 728 3.824 9.617 -6.385 1.00 0.00 H new ATOM 0 HB2 HIS A 728 3.903 12.641 -5.992 1.00 0.00 H new ATOM 0 HB3 HIS A 728 3.683 11.861 -7.546 1.00 0.00 H new ATOM 0 HD2 HIS A 728 1.361 9.736 -6.956 1.00 0.00 H new ATOM 0 HE1 HIS A 728 -0.760 12.910 -5.115 1.00 0.00 H new ATOM 0 HE2 HIS A 728 -0.954 10.576 -6.103 1.00 0.00 H new ATOM 187 N HIS A 729 6.535 9.651 -5.923 1.00 0.00 N ATOM 188 CA HIS A 729 7.936 9.521 -6.336 1.00 0.00 C ATOM 189 C HIS A 729 8.589 8.351 -5.613 1.00 0.00 C ATOM 190 O HIS A 729 7.948 7.691 -4.796 1.00 0.00 O ATOM 191 CB HIS A 729 8.744 10.810 -6.089 1.00 0.00 C ATOM 192 CG HIS A 729 8.652 11.347 -4.695 1.00 0.00 C ATOM 193 ND1 HIS A 729 9.703 11.340 -3.802 1.00 0.00 N ATOM 194 CD2 HIS A 729 7.619 11.931 -4.054 1.00 0.00 C ATOM 195 CE1 HIS A 729 9.314 11.897 -2.669 1.00 0.00 C ATOM 196 NE2 HIS A 729 8.053 12.266 -2.797 1.00 0.00 N ATOM 0 H HIS A 729 6.248 8.977 -5.213 1.00 0.00 H new ATOM 0 HA HIS A 729 7.939 9.338 -7.410 1.00 0.00 H new ATOM 0 HB2 HIS A 729 9.791 10.616 -6.321 1.00 0.00 H new ATOM 0 HB3 HIS A 729 8.400 11.577 -6.783 1.00 0.00 H new ATOM 0 HD2 HIS A 729 6.632 12.103 -4.457 1.00 0.00 H new ATOM 0 HE1 HIS A 729 9.924 12.028 -1.788 1.00 0.00 H new ATOM 0 HE2 HIS A 729 7.493 12.725 -2.079 1.00 0.00 H new ATOM 205 N ASP A 730 9.850 8.090 -5.928 1.00 0.00 N ATOM 206 CA ASP A 730 10.613 7.062 -5.231 1.00 0.00 C ATOM 207 C ASP A 730 10.847 7.473 -3.788 1.00 0.00 C ATOM 208 O ASP A 730 11.184 8.624 -3.503 1.00 0.00 O ATOM 209 CB ASP A 730 11.954 6.800 -5.920 1.00 0.00 C ATOM 210 CG ASP A 730 11.831 5.964 -7.180 1.00 0.00 C ATOM 211 OD1 ASP A 730 11.302 6.472 -8.195 1.00 0.00 O ATOM 212 OD2 ASP A 730 12.292 4.800 -7.175 1.00 0.00 O ATOM 0 H ASP A 730 10.367 8.575 -6.661 1.00 0.00 H new ATOM 0 HA ASP A 730 10.032 6.140 -5.256 1.00 0.00 H new ATOM 0 HB2 ASP A 730 12.418 7.754 -6.170 1.00 0.00 H new ATOM 0 HB3 ASP A 730 12.620 6.295 -5.221 1.00 0.00 H new ATOM 217 N LEU A 731 10.642 6.542 -2.880 1.00 0.00 N ATOM 218 CA LEU A 731 10.825 6.797 -1.467 1.00 0.00 C ATOM 219 C LEU A 731 12.236 6.417 -1.034 1.00 0.00 C ATOM 220 O LEU A 731 12.565 5.238 -0.920 1.00 0.00 O ATOM 221 CB LEU A 731 9.777 6.026 -0.669 1.00 0.00 C ATOM 222 CG LEU A 731 9.858 6.201 0.834 1.00 0.00 C ATOM 223 CD1 LEU A 731 9.875 7.676 1.213 1.00 0.00 C ATOM 224 CD2 LEU A 731 8.696 5.496 1.509 1.00 0.00 C ATOM 0 H LEU A 731 10.345 5.591 -3.099 1.00 0.00 H new ATOM 0 HA LEU A 731 10.696 7.862 -1.273 1.00 0.00 H new ATOM 0 HB2 LEU A 731 8.787 6.337 -1.003 1.00 0.00 H new ATOM 0 HB3 LEU A 731 9.873 4.965 -0.902 1.00 0.00 H new ATOM 0 HG LEU A 731 10.790 5.753 1.178 1.00 0.00 H new ATOM 0 HD11 LEU A 731 9.933 7.772 2.297 1.00 0.00 H new ATOM 0 HD12 LEU A 731 10.740 8.158 0.759 1.00 0.00 H new ATOM 0 HD13 LEU A 731 8.963 8.154 0.855 1.00 0.00 H new ATOM 0 HD21 LEU A 731 8.767 5.630 2.588 1.00 0.00 H new ATOM 0 HD22 LEU A 731 7.757 5.919 1.152 1.00 0.00 H new ATOM 0 HD23 LEU A 731 8.729 4.432 1.272 1.00 0.00 H new ATOM 236 N LYS A 732 13.062 7.429 -0.801 1.00 0.00 N ATOM 237 CA LYS A 732 14.475 7.232 -0.492 1.00 0.00 C ATOM 238 C LYS A 732 14.678 6.777 0.951 1.00 0.00 C ATOM 239 O LYS A 732 14.566 7.571 1.886 1.00 0.00 O ATOM 240 CB LYS A 732 15.242 8.533 -0.743 1.00 0.00 C ATOM 241 CG LYS A 732 15.123 9.034 -2.173 1.00 0.00 C ATOM 242 CD LYS A 732 15.759 8.073 -3.169 1.00 0.00 C ATOM 243 CE LYS A 732 17.240 8.358 -3.385 1.00 0.00 C ATOM 244 NZ LYS A 732 18.035 8.294 -2.128 1.00 0.00 N ATOM 0 H LYS A 732 12.774 8.407 -0.820 1.00 0.00 H new ATOM 0 HA LYS A 732 14.857 6.446 -1.144 1.00 0.00 H new ATOM 0 HB2 LYS A 732 14.872 9.301 -0.064 1.00 0.00 H new ATOM 0 HB3 LYS A 732 16.295 8.378 -0.506 1.00 0.00 H new ATOM 0 HG2 LYS A 732 14.071 9.171 -2.423 1.00 0.00 H new ATOM 0 HG3 LYS A 732 15.600 10.010 -2.256 1.00 0.00 H new ATOM 0 HD2 LYS A 732 15.637 7.050 -2.812 1.00 0.00 H new ATOM 0 HD3 LYS A 732 15.235 8.143 -4.122 1.00 0.00 H new ATOM 0 HE2 LYS A 732 17.642 7.640 -4.099 1.00 0.00 H new ATOM 0 HE3 LYS A 732 17.353 9.347 -3.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 732 19.045 8.208 -2.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 732 17.880 9.161 -1.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 732 17.736 7.469 -1.570 1.00 0.00 H new ATOM 258 N LEU A 733 14.973 5.495 1.123 1.00 0.00 N ATOM 259 CA LEU A 733 15.250 4.934 2.438 1.00 0.00 C ATOM 260 C LEU A 733 16.677 4.417 2.506 1.00 0.00 C ATOM 261 O LEU A 733 17.279 4.074 1.485 1.00 0.00 O ATOM 262 CB LEU A 733 14.295 3.785 2.752 1.00 0.00 C ATOM 263 CG LEU A 733 12.818 4.155 2.840 1.00 0.00 C ATOM 264 CD1 LEU A 733 12.002 2.925 3.182 1.00 0.00 C ATOM 265 CD2 LEU A 733 12.595 5.242 3.879 1.00 0.00 C ATOM 0 H LEU A 733 15.027 4.819 0.361 1.00 0.00 H new ATOM 0 HA LEU A 733 15.111 5.729 3.171 1.00 0.00 H new ATOM 0 HB2 LEU A 733 14.413 3.019 1.985 1.00 0.00 H new ATOM 0 HB3 LEU A 733 14.595 3.337 3.699 1.00 0.00 H new ATOM 0 HG LEU A 733 12.496 4.541 1.873 1.00 0.00 H new ATOM 0 HD11 LEU A 733 10.947 3.194 3.244 1.00 0.00 H new ATOM 0 HD12 LEU A 733 12.139 2.170 2.408 1.00 0.00 H new ATOM 0 HD13 LEU A 733 12.331 2.525 4.141 1.00 0.00 H new ATOM 0 HD21 LEU A 733 11.535 5.490 3.924 1.00 0.00 H new ATOM 0 HD22 LEU A 733 12.927 4.886 4.855 1.00 0.00 H new ATOM 0 HD23 LEU A 733 13.164 6.130 3.604 1.00 0.00 H new ATOM 277 N CYS A 734 17.207 4.355 3.710 1.00 0.00 N ATOM 278 CA CYS A 734 18.550 3.865 3.930 1.00 0.00 C ATOM 279 C CYS A 734 18.498 2.466 4.532 1.00 0.00 C ATOM 280 O CYS A 734 17.428 1.862 4.631 1.00 0.00 O ATOM 281 CB CYS A 734 19.308 4.822 4.850 1.00 0.00 C ATOM 282 SG CYS A 734 19.253 6.548 4.309 1.00 0.00 S ATOM 0 H CYS A 734 16.721 4.642 4.560 1.00 0.00 H new ATOM 0 HA CYS A 734 19.077 3.812 2.977 1.00 0.00 H new ATOM 0 HB2 CYS A 734 18.892 4.752 5.855 1.00 0.00 H new ATOM 0 HB3 CYS A 734 20.348 4.503 4.913 1.00 0.00 H new ATOM 0 HG CYS A 734 19.918 7.287 5.147 1.00 0.00 H new ATOM 288 N LEU A 735 19.645 1.942 4.913 1.00 0.00 N ATOM 289 CA LEU A 735 19.707 0.634 5.528 1.00 0.00 C ATOM 290 C LEU A 735 19.034 0.664 6.892 1.00 0.00 C ATOM 291 O LEU A 735 19.232 1.598 7.670 1.00 0.00 O ATOM 292 CB LEU A 735 21.148 0.202 5.674 1.00 0.00 C ATOM 293 CG LEU A 735 21.381 -1.240 6.110 1.00 0.00 C ATOM 294 CD1 LEU A 735 20.658 -2.182 5.177 1.00 0.00 C ATOM 295 CD2 LEU A 735 22.866 -1.546 6.131 1.00 0.00 C ATOM 0 H LEU A 735 20.548 2.404 4.807 1.00 0.00 H new ATOM 0 HA LEU A 735 19.183 -0.080 4.892 1.00 0.00 H new ATOM 0 HB2 LEU A 735 21.649 0.356 4.718 1.00 0.00 H new ATOM 0 HB3 LEU A 735 21.631 0.860 6.397 1.00 0.00 H new ATOM 0 HG LEU A 735 20.987 -1.376 7.117 1.00 0.00 H new ATOM 0 HD11 LEU A 735 20.829 -3.211 5.494 1.00 0.00 H new ATOM 0 HD12 LEU A 735 19.589 -1.968 5.200 1.00 0.00 H new ATOM 0 HD13 LEU A 735 21.033 -2.048 4.162 1.00 0.00 H new ATOM 0 HD21 LEU A 735 23.020 -2.579 6.444 1.00 0.00 H new ATOM 0 HD22 LEU A 735 23.281 -1.403 5.133 1.00 0.00 H new ATOM 0 HD23 LEU A 735 23.366 -0.876 6.831 1.00 0.00 H new ATOM 307 N GLY A 736 18.232 -0.348 7.169 1.00 0.00 N ATOM 308 CA GLY A 736 17.547 -0.413 8.450 1.00 0.00 C ATOM 309 C GLY A 736 16.313 0.466 8.498 1.00 0.00 C ATOM 310 O GLY A 736 15.710 0.647 9.556 1.00 0.00 O ATOM 0 H GLY A 736 18.040 -1.125 6.537 1.00 0.00 H new ATOM 0 HA2 GLY A 736 17.261 -1.445 8.653 1.00 0.00 H new ATOM 0 HA3 GLY A 736 18.234 -0.111 9.241 1.00 0.00 H new ATOM 314 N ASP A 737 15.945 1.025 7.357 1.00 0.00 N ATOM 315 CA ASP A 737 14.761 1.876 7.275 1.00 0.00 C ATOM 316 C ASP A 737 13.484 1.082 7.005 1.00 0.00 C ATOM 317 O ASP A 737 13.504 0.024 6.366 1.00 0.00 O ATOM 318 CB ASP A 737 14.924 2.930 6.179 1.00 0.00 C ATOM 319 CG ASP A 737 15.377 4.273 6.710 1.00 0.00 C ATOM 320 OD1 ASP A 737 16.556 4.632 6.523 1.00 0.00 O ATOM 321 OD2 ASP A 737 14.548 4.989 7.309 1.00 0.00 O ATOM 0 H ASP A 737 16.445 0.908 6.475 1.00 0.00 H new ATOM 0 HA ASP A 737 14.666 2.357 8.249 1.00 0.00 H new ATOM 0 HB2 ASP A 737 15.647 2.574 5.445 1.00 0.00 H new ATOM 0 HB3 ASP A 737 13.975 3.053 5.658 1.00 0.00 H new ATOM 326 N HIS A 738 12.384 1.602 7.535 1.00 0.00 N ATOM 327 CA HIS A 738 11.046 1.177 7.162 1.00 0.00 C ATOM 328 C HIS A 738 10.416 2.336 6.405 1.00 0.00 C ATOM 329 O HIS A 738 10.922 3.456 6.474 1.00 0.00 O ATOM 330 CB HIS A 738 10.208 0.802 8.398 1.00 0.00 C ATOM 331 CG HIS A 738 9.774 1.957 9.257 1.00 0.00 C ATOM 332 ND1 HIS A 738 10.522 2.438 10.308 1.00 0.00 N ATOM 333 CD2 HIS A 738 8.643 2.706 9.233 1.00 0.00 C ATOM 334 CE1 HIS A 738 9.873 3.427 10.893 1.00 0.00 C ATOM 335 NE2 HIS A 738 8.732 3.610 10.261 1.00 0.00 N ATOM 0 H HIS A 738 12.399 2.337 8.242 1.00 0.00 H new ATOM 0 HA HIS A 738 11.087 0.282 6.542 1.00 0.00 H new ATOM 0 HB2 HIS A 738 9.320 0.265 8.065 1.00 0.00 H new ATOM 0 HB3 HIS A 738 10.786 0.111 9.012 1.00 0.00 H new ATOM 0 HD2 HIS A 738 7.825 2.609 8.535 1.00 0.00 H new ATOM 0 HE1 HIS A 738 10.219 3.991 11.746 1.00 0.00 H new ATOM 0 HE2 HIS A 738 8.029 4.310 10.497 1.00 0.00 H new ATOM 344 N SER A 739 9.327 2.104 5.703 1.00 0.00 N ATOM 345 CA SER A 739 8.816 3.141 4.818 1.00 0.00 C ATOM 346 C SER A 739 7.515 3.736 5.330 1.00 0.00 C ATOM 347 O SER A 739 6.838 3.155 6.180 1.00 0.00 O ATOM 348 CB SER A 739 8.621 2.608 3.396 1.00 0.00 C ATOM 349 OG SER A 739 7.336 2.052 3.223 1.00 0.00 O ATOM 0 H SER A 739 8.790 1.237 5.721 1.00 0.00 H new ATOM 0 HA SER A 739 9.565 3.933 4.799 1.00 0.00 H new ATOM 0 HB2 SER A 739 8.768 3.417 2.680 1.00 0.00 H new ATOM 0 HB3 SER A 739 9.377 1.852 3.183 1.00 0.00 H new ATOM 0 HG SER A 739 7.376 1.337 2.554 1.00 0.00 H new ATOM 355 N SER A 740 7.184 4.897 4.794 1.00 0.00 N ATOM 356 CA SER A 740 5.954 5.585 5.112 1.00 0.00 C ATOM 357 C SER A 740 5.372 6.170 3.828 1.00 0.00 C ATOM 358 O SER A 740 5.824 7.204 3.334 1.00 0.00 O ATOM 359 CB SER A 740 6.209 6.689 6.147 1.00 0.00 C ATOM 360 OG SER A 740 4.996 7.282 6.582 1.00 0.00 O ATOM 0 H SER A 740 7.770 5.390 4.120 1.00 0.00 H new ATOM 0 HA SER A 740 5.241 4.883 5.545 1.00 0.00 H new ATOM 0 HB2 SER A 740 6.739 6.272 7.003 1.00 0.00 H new ATOM 0 HB3 SER A 740 6.855 7.453 5.714 1.00 0.00 H new ATOM 0 HG SER A 740 5.191 7.980 7.242 1.00 0.00 H new ATOM 366 N VAL A 741 4.384 5.485 3.288 1.00 0.00 N ATOM 367 CA VAL A 741 3.740 5.898 2.057 1.00 0.00 C ATOM 368 C VAL A 741 2.273 6.214 2.314 1.00 0.00 C ATOM 369 O VAL A 741 1.474 5.334 2.635 1.00 0.00 O ATOM 370 CB VAL A 741 3.896 4.828 0.951 1.00 0.00 C ATOM 371 CG1 VAL A 741 3.675 3.428 1.498 1.00 0.00 C ATOM 372 CG2 VAL A 741 2.950 5.101 -0.209 1.00 0.00 C ATOM 0 H VAL A 741 4.005 4.627 3.690 1.00 0.00 H new ATOM 0 HA VAL A 741 4.232 6.803 1.700 1.00 0.00 H new ATOM 0 HB VAL A 741 4.920 4.887 0.582 1.00 0.00 H new ATOM 0 HG11 VAL A 741 3.792 2.701 0.695 1.00 0.00 H new ATOM 0 HG12 VAL A 741 4.405 3.224 2.281 1.00 0.00 H new ATOM 0 HG13 VAL A 741 2.669 3.353 1.911 1.00 0.00 H new ATOM 0 HG21 VAL A 741 3.080 4.334 -0.973 1.00 0.00 H new ATOM 0 HG22 VAL A 741 1.921 5.085 0.149 1.00 0.00 H new ATOM 0 HG23 VAL A 741 3.171 6.079 -0.636 1.00 0.00 H new ATOM 382 N PRO A 742 1.911 7.492 2.209 1.00 0.00 N ATOM 383 CA PRO A 742 0.553 7.940 2.443 1.00 0.00 C ATOM 384 C PRO A 742 -0.352 7.614 1.270 1.00 0.00 C ATOM 385 O PRO A 742 0.024 7.811 0.120 1.00 0.00 O ATOM 386 CB PRO A 742 0.678 9.457 2.633 1.00 0.00 C ATOM 387 CG PRO A 742 2.099 9.823 2.317 1.00 0.00 C ATOM 388 CD PRO A 742 2.802 8.590 1.828 1.00 0.00 C ATOM 0 HA PRO A 742 0.104 7.446 3.305 1.00 0.00 H new ATOM 0 HB2 PRO A 742 -0.012 9.986 1.976 1.00 0.00 H new ATOM 0 HB3 PRO A 742 0.425 9.740 3.655 1.00 0.00 H new ATOM 0 HG2 PRO A 742 2.131 10.605 1.558 1.00 0.00 H new ATOM 0 HG3 PRO A 742 2.596 10.218 3.203 1.00 0.00 H new ATOM 0 HD2 PRO A 742 2.957 8.621 0.749 1.00 0.00 H new ATOM 0 HD3 PRO A 742 3.784 8.483 2.288 1.00 0.00 H new ATOM 396 N VAL A 743 -1.527 7.080 1.559 1.00 0.00 N ATOM 397 CA VAL A 743 -2.508 6.797 0.526 1.00 0.00 C ATOM 398 C VAL A 743 -3.896 7.325 0.886 1.00 0.00 C ATOM 399 O VAL A 743 -4.473 6.968 1.910 1.00 0.00 O ATOM 400 CB VAL A 743 -2.602 5.293 0.211 1.00 0.00 C ATOM 401 CG1 VAL A 743 -2.608 4.477 1.481 1.00 0.00 C ATOM 402 CG2 VAL A 743 -3.825 4.995 -0.633 1.00 0.00 C ATOM 0 H VAL A 743 -1.825 6.833 2.503 1.00 0.00 H new ATOM 0 HA VAL A 743 -2.156 7.320 -0.363 1.00 0.00 H new ATOM 0 HB VAL A 743 -1.720 5.011 -0.364 1.00 0.00 H new ATOM 0 HG11 VAL A 743 -2.675 3.418 1.233 1.00 0.00 H new ATOM 0 HG12 VAL A 743 -1.689 4.662 2.037 1.00 0.00 H new ATOM 0 HG13 VAL A 743 -3.465 4.761 2.092 1.00 0.00 H new ATOM 0 HG21 VAL A 743 -3.871 3.926 -0.843 1.00 0.00 H new ATOM 0 HG22 VAL A 743 -4.722 5.297 -0.093 1.00 0.00 H new ATOM 0 HG23 VAL A 743 -3.763 5.547 -1.571 1.00 0.00 H new ATOM 412 N ALA A 744 -4.412 8.195 0.039 1.00 0.00 N ATOM 413 CA ALA A 744 -5.800 8.608 0.113 1.00 0.00 C ATOM 414 C ALA A 744 -6.647 7.576 -0.603 1.00 0.00 C ATOM 415 O ALA A 744 -6.694 7.509 -1.832 1.00 0.00 O ATOM 416 CB ALA A 744 -5.990 9.992 -0.470 1.00 0.00 C ATOM 0 H ALA A 744 -3.884 8.633 -0.716 1.00 0.00 H new ATOM 0 HA ALA A 744 -6.113 8.667 1.155 1.00 0.00 H new ATOM 0 HB1 ALA A 744 -7.040 10.275 -0.401 1.00 0.00 H new ATOM 0 HB2 ALA A 744 -5.384 10.707 0.086 1.00 0.00 H new ATOM 0 HB3 ALA A 744 -5.683 9.992 -1.516 1.00 0.00 H new ATOM 422 N LEU A 745 -7.300 6.759 0.190 1.00 0.00 N ATOM 423 CA LEU A 745 -7.934 5.553 -0.293 1.00 0.00 C ATOM 424 C LEU A 745 -9.327 5.830 -0.821 1.00 0.00 C ATOM 425 O LEU A 745 -9.900 6.889 -0.573 1.00 0.00 O ATOM 426 CB LEU A 745 -7.978 4.548 0.846 1.00 0.00 C ATOM 427 CG LEU A 745 -6.721 4.554 1.701 1.00 0.00 C ATOM 428 CD1 LEU A 745 -7.071 4.675 3.158 1.00 0.00 C ATOM 429 CD2 LEU A 745 -5.897 3.307 1.453 1.00 0.00 C ATOM 0 H LEU A 745 -7.407 6.912 1.193 1.00 0.00 H new ATOM 0 HA LEU A 745 -7.357 5.150 -1.125 1.00 0.00 H new ATOM 0 HB2 LEU A 745 -8.840 4.763 1.478 1.00 0.00 H new ATOM 0 HB3 LEU A 745 -8.125 3.549 0.435 1.00 0.00 H new ATOM 0 HG LEU A 745 -6.122 5.420 1.419 1.00 0.00 H new ATOM 0 HD11 LEU A 745 -6.158 4.677 3.753 1.00 0.00 H new ATOM 0 HD12 LEU A 745 -7.615 5.604 3.325 1.00 0.00 H new ATOM 0 HD13 LEU A 745 -7.694 3.831 3.454 1.00 0.00 H new ATOM 0 HD21 LEU A 745 -5.002 3.332 2.075 1.00 0.00 H new ATOM 0 HD22 LEU A 745 -6.487 2.425 1.702 1.00 0.00 H new ATOM 0 HD23 LEU A 745 -5.608 3.265 0.403 1.00 0.00 H new ATOM 441 N LYS A 746 -9.867 4.861 -1.532 1.00 0.00 N ATOM 442 CA LYS A 746 -11.159 5.001 -2.166 1.00 0.00 C ATOM 443 C LYS A 746 -12.115 3.941 -1.635 1.00 0.00 C ATOM 444 O LYS A 746 -11.698 2.842 -1.280 1.00 0.00 O ATOM 445 CB LYS A 746 -10.999 4.896 -3.670 1.00 0.00 C ATOM 446 CG LYS A 746 -12.274 5.153 -4.468 1.00 0.00 C ATOM 447 CD LYS A 746 -12.890 6.514 -4.151 1.00 0.00 C ATOM 448 CE LYS A 746 -11.975 7.673 -4.527 1.00 0.00 C ATOM 449 NZ LYS A 746 -11.822 7.822 -5.997 1.00 0.00 N ATOM 0 H LYS A 746 -9.422 3.956 -1.686 1.00 0.00 H new ATOM 0 HA LYS A 746 -11.580 5.979 -1.934 1.00 0.00 H new ATOM 0 HB2 LYS A 746 -10.237 5.606 -3.991 1.00 0.00 H new ATOM 0 HB3 LYS A 746 -10.629 3.900 -3.913 1.00 0.00 H new ATOM 0 HG2 LYS A 746 -12.051 5.097 -5.533 1.00 0.00 H new ATOM 0 HG3 LYS A 746 -13.000 4.369 -4.252 1.00 0.00 H new ATOM 0 HD2 LYS A 746 -13.835 6.614 -4.685 1.00 0.00 H new ATOM 0 HD3 LYS A 746 -13.118 6.566 -3.086 1.00 0.00 H new ATOM 0 HE2 LYS A 746 -12.375 8.598 -4.111 1.00 0.00 H new ATOM 0 HE3 LYS A 746 -10.995 7.519 -4.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 746 -11.218 8.644 -6.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 746 -11.384 6.964 -6.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 746 -12.757 7.963 -6.431 1.00 0.00 H new ATOM 463 N GLY A 747 -13.388 4.272 -1.588 1.00 0.00 N ATOM 464 CA GLY A 747 -14.363 3.389 -0.976 1.00 0.00 C ATOM 465 C GLY A 747 -14.698 3.851 0.423 1.00 0.00 C ATOM 466 O GLY A 747 -13.804 4.051 1.238 1.00 0.00 O ATOM 0 H GLY A 747 -13.772 5.139 -1.963 1.00 0.00 H new ATOM 0 HA2 GLY A 747 -15.268 3.363 -1.582 1.00 0.00 H new ATOM 0 HA3 GLY A 747 -13.971 2.372 -0.945 1.00 0.00 H new ATOM 470 N GLN A 748 -15.974 4.021 0.716 1.00 0.00 N ATOM 471 CA GLN A 748 -16.362 4.659 1.968 1.00 0.00 C ATOM 472 C GLN A 748 -16.821 3.651 3.011 1.00 0.00 C ATOM 473 O GLN A 748 -17.744 2.865 2.781 1.00 0.00 O ATOM 474 CB GLN A 748 -17.470 5.699 1.760 1.00 0.00 C ATOM 475 CG GLN A 748 -17.138 6.836 0.796 1.00 0.00 C ATOM 476 CD GLN A 748 -17.386 6.482 -0.660 1.00 0.00 C ATOM 477 OE1 GLN A 748 -18.504 6.612 -1.158 1.00 0.00 O ATOM 478 NE2 GLN A 748 -16.342 6.083 -1.365 1.00 0.00 N ATOM 0 H GLN A 748 -16.749 3.734 0.119 1.00 0.00 H new ATOM 0 HA GLN A 748 -15.465 5.159 2.334 1.00 0.00 H new ATOM 0 HB2 GLN A 748 -18.360 5.187 1.396 1.00 0.00 H new ATOM 0 HB3 GLN A 748 -17.724 6.131 2.728 1.00 0.00 H new ATOM 0 HG2 GLN A 748 -17.735 7.710 1.057 1.00 0.00 H new ATOM 0 HG3 GLN A 748 -16.092 7.115 0.922 1.00 0.00 H new ATOM 0 HE21 GLN A 748 -15.431 5.987 -0.917 1.00 0.00 H new ATOM 0 HE22 GLN A 748 -16.447 5.871 -2.357 1.00 0.00 H new ATOM 487 N GLY A 749 -16.175 3.703 4.167 1.00 0.00 N ATOM 488 CA GLY A 749 -16.519 2.826 5.262 1.00 0.00 C ATOM 489 C GLY A 749 -15.470 1.774 5.476 1.00 0.00 C ATOM 490 O GLY A 749 -14.442 1.803 4.821 1.00 0.00 O ATOM 0 H GLY A 749 -15.409 4.347 4.365 1.00 0.00 H new ATOM 0 HA2 GLY A 749 -16.640 3.411 6.174 1.00 0.00 H new ATOM 0 HA3 GLY A 749 -17.478 2.349 5.060 1.00 0.00 H new ATOM 494 N PRO A 750 -15.718 0.824 6.378 1.00 0.00 N ATOM 495 CA PRO A 750 -14.763 -0.233 6.716 1.00 0.00 C ATOM 496 C PRO A 750 -14.487 -1.201 5.564 1.00 0.00 C ATOM 497 O PRO A 750 -15.275 -2.111 5.285 1.00 0.00 O ATOM 498 CB PRO A 750 -15.466 -0.936 7.870 1.00 0.00 C ATOM 499 CG PRO A 750 -16.898 -0.731 7.579 1.00 0.00 C ATOM 500 CD PRO A 750 -16.960 0.688 7.157 1.00 0.00 C ATOM 0 HA PRO A 750 -13.775 0.161 6.955 1.00 0.00 H new ATOM 0 HB2 PRO A 750 -15.212 -1.995 7.909 1.00 0.00 H new ATOM 0 HB3 PRO A 750 -15.187 -0.506 8.832 1.00 0.00 H new ATOM 0 HG2 PRO A 750 -17.249 -1.400 6.793 1.00 0.00 H new ATOM 0 HG3 PRO A 750 -17.518 -0.917 8.456 1.00 0.00 H new ATOM 0 HD2 PRO A 750 -17.845 0.898 6.556 1.00 0.00 H new ATOM 0 HD3 PRO A 750 -16.985 1.367 8.009 1.00 0.00 H new ATOM 508 N PHE A 751 -13.362 -0.992 4.901 1.00 0.00 N ATOM 509 CA PHE A 751 -12.936 -1.854 3.808 1.00 0.00 C ATOM 510 C PHE A 751 -11.662 -2.607 4.180 1.00 0.00 C ATOM 511 O PHE A 751 -10.805 -2.075 4.882 1.00 0.00 O ATOM 512 CB PHE A 751 -12.724 -1.025 2.537 1.00 0.00 C ATOM 513 CG PHE A 751 -14.014 -0.625 1.884 1.00 0.00 C ATOM 514 CD1 PHE A 751 -14.584 0.606 2.134 1.00 0.00 C ATOM 515 CD2 PHE A 751 -14.664 -1.494 1.029 1.00 0.00 C ATOM 516 CE1 PHE A 751 -15.778 0.961 1.544 1.00 0.00 C ATOM 517 CE2 PHE A 751 -15.858 -1.140 0.435 1.00 0.00 C ATOM 518 CZ PHE A 751 -16.415 0.089 0.693 1.00 0.00 C ATOM 0 H PHE A 751 -12.721 -0.225 5.103 1.00 0.00 H new ATOM 0 HA PHE A 751 -13.718 -2.589 3.618 1.00 0.00 H new ATOM 0 HB2 PHE A 751 -12.153 -0.130 2.783 1.00 0.00 H new ATOM 0 HB3 PHE A 751 -12.126 -1.599 1.829 1.00 0.00 H new ATOM 0 HD1 PHE A 751 -14.090 1.299 2.799 1.00 0.00 H new ATOM 0 HD2 PHE A 751 -14.232 -2.462 0.823 1.00 0.00 H new ATOM 0 HE1 PHE A 751 -16.214 1.927 1.751 1.00 0.00 H new ATOM 0 HE2 PHE A 751 -16.354 -1.829 -0.232 1.00 0.00 H new ATOM 0 HZ PHE A 751 -17.349 0.369 0.229 1.00 0.00 H new ATOM 528 N THR A 752 -11.538 -3.852 3.729 1.00 0.00 N ATOM 529 CA THR A 752 -10.332 -4.617 4.003 1.00 0.00 C ATOM 530 C THR A 752 -9.332 -4.362 2.898 1.00 0.00 C ATOM 531 O THR A 752 -9.460 -4.869 1.787 1.00 0.00 O ATOM 532 CB THR A 752 -10.591 -6.132 4.192 1.00 0.00 C ATOM 533 OG1 THR A 752 -11.478 -6.337 5.301 1.00 0.00 O ATOM 534 CG2 THR A 752 -9.287 -6.874 4.444 1.00 0.00 C ATOM 0 H THR A 752 -12.245 -4.343 3.182 1.00 0.00 H new ATOM 0 HA THR A 752 -9.931 -4.277 4.958 1.00 0.00 H new ATOM 0 HB THR A 752 -11.045 -6.520 3.280 1.00 0.00 H new ATOM 0 HG1 THR A 752 -12.405 -6.329 4.984 1.00 0.00 H new ATOM 0 HG21 THR A 752 -9.492 -7.937 4.574 1.00 0.00 H new ATOM 0 HG22 THR A 752 -8.619 -6.735 3.594 1.00 0.00 H new ATOM 0 HG23 THR A 752 -8.814 -6.483 5.345 1.00 0.00 H new ATOM 542 N LEU A 753 -8.360 -3.537 3.224 1.00 0.00 N ATOM 543 CA LEU A 753 -7.410 -3.030 2.257 1.00 0.00 C ATOM 544 C LEU A 753 -6.196 -3.942 2.190 1.00 0.00 C ATOM 545 O LEU A 753 -5.541 -4.185 3.200 1.00 0.00 O ATOM 546 CB LEU A 753 -6.980 -1.622 2.660 1.00 0.00 C ATOM 547 CG LEU A 753 -5.931 -0.983 1.752 1.00 0.00 C ATOM 548 CD1 LEU A 753 -6.544 -0.537 0.433 1.00 0.00 C ATOM 549 CD2 LEU A 753 -5.257 0.167 2.459 1.00 0.00 C ATOM 0 H LEU A 753 -8.206 -3.197 4.173 1.00 0.00 H new ATOM 0 HA LEU A 753 -7.879 -2.999 1.274 1.00 0.00 H new ATOM 0 HB2 LEU A 753 -7.861 -0.981 2.679 1.00 0.00 H new ATOM 0 HB3 LEU A 753 -6.587 -1.655 3.676 1.00 0.00 H new ATOM 0 HG LEU A 753 -5.174 -1.733 1.521 1.00 0.00 H new ATOM 0 HD11 LEU A 753 -5.773 -0.086 -0.192 1.00 0.00 H new ATOM 0 HD12 LEU A 753 -6.969 -1.399 -0.080 1.00 0.00 H new ATOM 0 HD13 LEU A 753 -7.329 0.194 0.625 1.00 0.00 H new ATOM 0 HD21 LEU A 753 -4.512 0.613 1.800 1.00 0.00 H new ATOM 0 HD22 LEU A 753 -6.002 0.917 2.725 1.00 0.00 H new ATOM 0 HD23 LEU A 753 -4.770 -0.197 3.364 1.00 0.00 H new ATOM 561 N THR A 754 -5.902 -4.455 1.012 1.00 0.00 N ATOM 562 CA THR A 754 -4.764 -5.333 0.835 1.00 0.00 C ATOM 563 C THR A 754 -3.815 -4.779 -0.213 1.00 0.00 C ATOM 564 O THR A 754 -4.241 -4.403 -1.310 1.00 0.00 O ATOM 565 CB THR A 754 -5.206 -6.726 0.396 1.00 0.00 C ATOM 566 OG1 THR A 754 -6.497 -7.019 0.941 1.00 0.00 O ATOM 567 CG2 THR A 754 -4.202 -7.746 0.878 1.00 0.00 C ATOM 0 H THR A 754 -6.437 -4.278 0.162 1.00 0.00 H new ATOM 0 HA THR A 754 -4.257 -5.399 1.798 1.00 0.00 H new ATOM 0 HB THR A 754 -5.264 -6.762 -0.692 1.00 0.00 H new ATOM 0 HG1 THR A 754 -7.185 -6.554 0.421 1.00 0.00 H new ATOM 0 HG21 THR A 754 -4.516 -8.742 0.565 1.00 0.00 H new ATOM 0 HG22 THR A 754 -3.224 -7.523 0.452 1.00 0.00 H new ATOM 0 HG23 THR A 754 -4.140 -7.710 1.966 1.00 0.00 H new ATOM 575 N TYR A 755 -2.536 -4.735 0.110 1.00 0.00 N ATOM 576 CA TYR A 755 -1.546 -4.227 -0.820 1.00 0.00 C ATOM 577 C TYR A 755 -0.267 -5.055 -0.780 1.00 0.00 C ATOM 578 O TYR A 755 0.048 -5.694 0.230 1.00 0.00 O ATOM 579 CB TYR A 755 -1.247 -2.751 -0.534 1.00 0.00 C ATOM 580 CG TYR A 755 -0.913 -2.449 0.910 1.00 0.00 C ATOM 581 CD1 TYR A 755 0.356 -2.686 1.421 1.00 0.00 C ATOM 582 CD2 TYR A 755 -1.869 -1.908 1.756 1.00 0.00 C ATOM 583 CE1 TYR A 755 0.658 -2.392 2.736 1.00 0.00 C ATOM 584 CE2 TYR A 755 -1.576 -1.615 3.070 1.00 0.00 C ATOM 585 CZ TYR A 755 -0.310 -1.858 3.555 1.00 0.00 C ATOM 586 OH TYR A 755 -0.006 -1.568 4.865 1.00 0.00 O ATOM 0 H TYR A 755 -2.159 -5.044 1.006 1.00 0.00 H new ATOM 0 HA TYR A 755 -1.960 -4.309 -1.825 1.00 0.00 H new ATOM 0 HB2 TYR A 755 -0.414 -2.434 -1.161 1.00 0.00 H new ATOM 0 HB3 TYR A 755 -2.111 -2.155 -0.827 1.00 0.00 H new ATOM 0 HD1 TYR A 755 1.118 -3.106 0.781 1.00 0.00 H new ATOM 0 HD2 TYR A 755 -2.862 -1.713 1.378 1.00 0.00 H new ATOM 0 HE1 TYR A 755 1.650 -2.580 3.120 1.00 0.00 H new ATOM 0 HE2 TYR A 755 -2.334 -1.197 3.716 1.00 0.00 H new ATOM 0 HH TYR A 755 0.023 -2.398 5.386 1.00 0.00 H new ATOM 596 N ASP A 756 0.454 -5.042 -1.890 1.00 0.00 N ATOM 597 CA ASP A 756 1.697 -5.781 -2.023 1.00 0.00 C ATOM 598 C ASP A 756 2.882 -4.842 -2.025 1.00 0.00 C ATOM 599 O ASP A 756 2.870 -3.798 -2.668 1.00 0.00 O ATOM 600 CB ASP A 756 1.724 -6.618 -3.309 1.00 0.00 C ATOM 601 CG ASP A 756 1.371 -5.827 -4.556 1.00 0.00 C ATOM 602 OD1 ASP A 756 2.267 -5.194 -5.143 1.00 0.00 O ATOM 603 OD2 ASP A 756 0.197 -5.869 -4.973 1.00 0.00 O ATOM 0 H ASP A 756 0.192 -4.517 -2.725 1.00 0.00 H new ATOM 0 HA ASP A 756 1.760 -6.451 -1.166 1.00 0.00 H new ATOM 0 HB2 ASP A 756 2.718 -7.049 -3.431 1.00 0.00 H new ATOM 0 HB3 ASP A 756 1.026 -7.449 -3.206 1.00 0.00 H new ATOM 608 N ILE A 757 3.884 -5.205 -1.266 1.00 0.00 N ATOM 609 CA ILE A 757 5.168 -4.568 -1.361 1.00 0.00 C ATOM 610 C ILE A 757 6.080 -5.517 -2.113 1.00 0.00 C ATOM 611 O ILE A 757 6.656 -6.443 -1.541 1.00 0.00 O ATOM 612 CB ILE A 757 5.754 -4.231 0.026 1.00 0.00 C ATOM 613 CG1 ILE A 757 4.865 -3.220 0.739 1.00 0.00 C ATOM 614 CG2 ILE A 757 7.155 -3.679 -0.115 1.00 0.00 C ATOM 615 CD1 ILE A 757 3.677 -3.830 1.454 1.00 0.00 C ATOM 0 H ILE A 757 3.831 -5.947 -0.568 1.00 0.00 H new ATOM 0 HA ILE A 757 5.070 -3.617 -1.885 1.00 0.00 H new ATOM 0 HB ILE A 757 5.796 -5.146 0.618 1.00 0.00 H new ATOM 0 HG12 ILE A 757 5.467 -2.671 1.463 1.00 0.00 H new ATOM 0 HG13 ILE A 757 4.503 -2.495 0.010 1.00 0.00 H new ATOM 0 HG21 ILE A 757 7.555 -3.446 0.872 1.00 0.00 H new ATOM 0 HG22 ILE A 757 7.791 -4.420 -0.599 1.00 0.00 H new ATOM 0 HG23 ILE A 757 7.130 -2.772 -0.720 1.00 0.00 H new ATOM 0 HD11 ILE A 757 3.097 -3.042 1.934 1.00 0.00 H new ATOM 0 HD12 ILE A 757 3.049 -4.355 0.734 1.00 0.00 H new ATOM 0 HD13 ILE A 757 4.029 -4.533 2.209 1.00 0.00 H new ATOM 627 N ILE A 758 6.174 -5.304 -3.408 1.00 0.00 N ATOM 628 CA ILE A 758 6.822 -6.255 -4.284 1.00 0.00 C ATOM 629 C ILE A 758 8.233 -5.824 -4.637 1.00 0.00 C ATOM 630 O ILE A 758 8.519 -4.634 -4.755 1.00 0.00 O ATOM 631 CB ILE A 758 5.986 -6.471 -5.564 1.00 0.00 C ATOM 632 CG1 ILE A 758 5.764 -5.163 -6.311 1.00 0.00 C ATOM 633 CG2 ILE A 758 4.649 -7.077 -5.218 1.00 0.00 C ATOM 634 CD1 ILE A 758 6.741 -4.947 -7.444 1.00 0.00 C ATOM 0 H ILE A 758 5.808 -4.476 -3.879 1.00 0.00 H new ATOM 0 HA ILE A 758 6.892 -7.201 -3.746 1.00 0.00 H new ATOM 0 HB ILE A 758 6.544 -7.150 -6.209 1.00 0.00 H new ATOM 0 HG12 ILE A 758 4.749 -5.147 -6.708 1.00 0.00 H new ATOM 0 HG13 ILE A 758 5.844 -4.334 -5.608 1.00 0.00 H new ATOM 0 HG21 ILE A 758 4.069 -7.224 -6.129 1.00 0.00 H new ATOM 0 HG22 ILE A 758 4.801 -8.038 -4.726 1.00 0.00 H new ATOM 0 HG23 ILE A 758 4.109 -6.408 -4.548 1.00 0.00 H new ATOM 0 HD11 ILE A 758 6.526 -3.997 -7.933 1.00 0.00 H new ATOM 0 HD12 ILE A 758 7.757 -4.931 -7.050 1.00 0.00 H new ATOM 0 HD13 ILE A 758 6.645 -5.757 -8.167 1.00 0.00 H new ATOM 646 N GLU A 759 9.114 -6.797 -4.794 1.00 0.00 N ATOM 647 CA GLU A 759 10.495 -6.524 -5.124 1.00 0.00 C ATOM 648 C GLU A 759 10.647 -6.340 -6.615 1.00 0.00 C ATOM 649 O GLU A 759 10.213 -7.188 -7.399 1.00 0.00 O ATOM 650 CB GLU A 759 11.392 -7.671 -4.686 1.00 0.00 C ATOM 651 CG GLU A 759 11.087 -8.194 -3.304 1.00 0.00 C ATOM 652 CD GLU A 759 12.271 -8.917 -2.697 1.00 0.00 C ATOM 653 OE1 GLU A 759 12.836 -9.809 -3.371 1.00 0.00 O ATOM 654 OE2 GLU A 759 12.630 -8.620 -1.542 1.00 0.00 O ATOM 0 H GLU A 759 8.892 -7.788 -4.697 1.00 0.00 H new ATOM 0 HA GLU A 759 10.788 -5.613 -4.602 1.00 0.00 H new ATOM 0 HB2 GLU A 759 11.296 -8.487 -5.402 1.00 0.00 H new ATOM 0 HB3 GLU A 759 12.430 -7.340 -4.717 1.00 0.00 H new ATOM 0 HG2 GLU A 759 10.799 -7.365 -2.658 1.00 0.00 H new ATOM 0 HG3 GLU A 759 10.235 -8.872 -3.353 1.00 0.00 H new ATOM 661 N THR A 760 11.263 -5.248 -7.011 1.00 0.00 N ATOM 662 CA THR A 760 11.542 -5.027 -8.414 1.00 0.00 C ATOM 663 C THR A 760 12.959 -5.478 -8.742 1.00 0.00 C ATOM 664 O THR A 760 13.383 -5.459 -9.896 1.00 0.00 O ATOM 665 CB THR A 760 11.281 -3.556 -8.831 1.00 0.00 C ATOM 666 OG1 THR A 760 12.186 -3.123 -9.860 1.00 0.00 O ATOM 667 CG2 THR A 760 11.355 -2.618 -7.639 1.00 0.00 C ATOM 0 H THR A 760 11.578 -4.504 -6.388 1.00 0.00 H new ATOM 0 HA THR A 760 10.852 -5.632 -9.002 1.00 0.00 H new ATOM 0 HB THR A 760 10.269 -3.521 -9.235 1.00 0.00 H new ATOM 0 HG1 THR A 760 12.558 -3.905 -10.318 1.00 0.00 H new ATOM 0 HG21 THR A 760 11.167 -1.596 -7.968 1.00 0.00 H new ATOM 0 HG22 THR A 760 10.605 -2.906 -6.902 1.00 0.00 H new ATOM 0 HG23 THR A 760 12.346 -2.678 -7.190 1.00 0.00 H new ATOM 675 N PHE A 761 13.681 -5.917 -7.718 1.00 0.00 N ATOM 676 CA PHE A 761 15.021 -6.434 -7.917 1.00 0.00 C ATOM 677 C PHE A 761 15.029 -7.962 -7.911 1.00 0.00 C ATOM 678 O PHE A 761 15.877 -8.577 -8.556 1.00 0.00 O ATOM 679 CB PHE A 761 15.992 -5.881 -6.866 1.00 0.00 C ATOM 680 CG PHE A 761 15.671 -6.269 -5.452 1.00 0.00 C ATOM 681 CD1 PHE A 761 14.684 -5.607 -4.745 1.00 0.00 C ATOM 682 CD2 PHE A 761 16.369 -7.288 -4.825 1.00 0.00 C ATOM 683 CE1 PHE A 761 14.398 -5.953 -3.441 1.00 0.00 C ATOM 684 CE2 PHE A 761 16.086 -7.639 -3.523 1.00 0.00 C ATOM 685 CZ PHE A 761 15.099 -6.970 -2.830 1.00 0.00 C ATOM 0 H PHE A 761 13.360 -5.924 -6.750 1.00 0.00 H new ATOM 0 HA PHE A 761 15.360 -6.098 -8.897 1.00 0.00 H new ATOM 0 HB2 PHE A 761 16.998 -6.225 -7.104 1.00 0.00 H new ATOM 0 HB3 PHE A 761 16.002 -4.793 -6.937 1.00 0.00 H new ATOM 0 HD1 PHE A 761 14.131 -4.810 -5.219 1.00 0.00 H new ATOM 0 HD2 PHE A 761 17.144 -7.814 -5.363 1.00 0.00 H new ATOM 0 HE1 PHE A 761 13.625 -5.427 -2.899 1.00 0.00 H new ATOM 0 HE2 PHE A 761 16.636 -8.437 -3.046 1.00 0.00 H new ATOM 0 HZ PHE A 761 14.876 -7.243 -1.809 1.00 0.00 H new ATOM 695 N SER A 762 14.095 -8.589 -7.193 1.00 0.00 N ATOM 696 CA SER A 762 14.039 -10.037 -7.168 1.00 0.00 C ATOM 697 C SER A 762 12.614 -10.552 -7.333 1.00 0.00 C ATOM 698 O SER A 762 12.070 -10.522 -8.438 1.00 0.00 O ATOM 699 CB SER A 762 14.664 -10.582 -5.886 1.00 0.00 C ATOM 700 OG SER A 762 16.042 -10.263 -5.819 1.00 0.00 O ATOM 0 H SER A 762 13.383 -8.120 -6.633 1.00 0.00 H new ATOM 0 HA SER A 762 14.618 -10.399 -8.017 1.00 0.00 H new ATOM 0 HB2 SER A 762 14.148 -10.166 -5.020 1.00 0.00 H new ATOM 0 HB3 SER A 762 14.535 -11.664 -5.845 1.00 0.00 H new ATOM 0 HG SER A 762 16.150 -9.344 -5.497 1.00 0.00 H new ATOM 706 N SER A 763 11.994 -10.985 -6.238 1.00 0.00 N ATOM 707 CA SER A 763 10.687 -11.621 -6.324 1.00 0.00 C ATOM 708 C SER A 763 10.077 -11.893 -4.949 1.00 0.00 C ATOM 709 O SER A 763 9.004 -12.487 -4.852 1.00 0.00 O ATOM 710 CB SER A 763 10.814 -12.938 -7.093 1.00 0.00 C ATOM 711 OG SER A 763 11.827 -13.758 -6.529 1.00 0.00 O ATOM 0 H SER A 763 12.371 -10.908 -5.294 1.00 0.00 H new ATOM 0 HA SER A 763 10.022 -10.933 -6.846 1.00 0.00 H new ATOM 0 HB2 SER A 763 9.861 -13.467 -7.076 1.00 0.00 H new ATOM 0 HB3 SER A 763 11.046 -12.733 -8.138 1.00 0.00 H new ATOM 0 HG SER A 763 11.890 -14.595 -7.035 1.00 0.00 H new ATOM 717 N LYS A 764 10.730 -11.452 -3.884 1.00 0.00 N ATOM 718 CA LYS A 764 10.255 -11.781 -2.539 1.00 0.00 C ATOM 719 C LYS A 764 9.216 -10.772 -2.057 1.00 0.00 C ATOM 720 O LYS A 764 9.385 -10.106 -1.034 1.00 0.00 O ATOM 721 CB LYS A 764 11.420 -11.895 -1.555 1.00 0.00 C ATOM 722 CG LYS A 764 12.333 -13.073 -1.856 1.00 0.00 C ATOM 723 CD LYS A 764 13.477 -13.186 -0.858 1.00 0.00 C ATOM 724 CE LYS A 764 14.671 -12.324 -1.246 1.00 0.00 C ATOM 725 NZ LYS A 764 14.372 -10.868 -1.209 1.00 0.00 N ATOM 0 H LYS A 764 11.572 -10.878 -3.917 1.00 0.00 H new ATOM 0 HA LYS A 764 9.768 -12.755 -2.588 1.00 0.00 H new ATOM 0 HB2 LYS A 764 12.003 -10.974 -1.581 1.00 0.00 H new ATOM 0 HB3 LYS A 764 11.027 -11.995 -0.543 1.00 0.00 H new ATOM 0 HG2 LYS A 764 11.750 -13.994 -1.843 1.00 0.00 H new ATOM 0 HG3 LYS A 764 12.740 -12.967 -2.862 1.00 0.00 H new ATOM 0 HD2 LYS A 764 13.124 -12.890 0.130 1.00 0.00 H new ATOM 0 HD3 LYS A 764 13.792 -14.227 -0.786 1.00 0.00 H new ATOM 0 HE2 LYS A 764 15.500 -12.536 -0.571 1.00 0.00 H new ATOM 0 HE3 LYS A 764 14.999 -12.597 -2.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 764 15.234 -10.343 -0.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 764 14.038 -10.558 -2.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 764 13.635 -10.683 -0.499 1.00 0.00 H new ATOM 739 N ARG A 765 8.147 -10.680 -2.837 1.00 0.00 N ATOM 740 CA ARG A 765 6.991 -9.848 -2.557 1.00 0.00 C ATOM 741 C ARG A 765 6.448 -10.041 -1.136 1.00 0.00 C ATOM 742 O ARG A 765 6.515 -11.134 -0.568 1.00 0.00 O ATOM 743 CB ARG A 765 5.912 -10.176 -3.595 1.00 0.00 C ATOM 744 CG ARG A 765 4.508 -9.807 -3.167 1.00 0.00 C ATOM 745 CD ARG A 765 3.507 -9.965 -4.302 1.00 0.00 C ATOM 746 NE ARG A 765 3.288 -11.367 -4.657 1.00 0.00 N ATOM 747 CZ ARG A 765 2.124 -11.852 -5.095 1.00 0.00 C ATOM 748 NH1 ARG A 765 1.087 -11.042 -5.281 1.00 0.00 N ATOM 749 NH2 ARG A 765 1.998 -13.146 -5.358 1.00 0.00 N ATOM 0 H ARG A 765 8.061 -11.201 -3.710 1.00 0.00 H new ATOM 0 HA ARG A 765 7.291 -8.802 -2.622 1.00 0.00 H new ATOM 0 HB2 ARG A 765 6.146 -9.655 -4.523 1.00 0.00 H new ATOM 0 HB3 ARG A 765 5.945 -11.244 -3.812 1.00 0.00 H new ATOM 0 HG2 ARG A 765 4.208 -10.435 -2.328 1.00 0.00 H new ATOM 0 HG3 ARG A 765 4.496 -8.776 -2.813 1.00 0.00 H new ATOM 0 HD2 ARG A 765 2.558 -9.513 -4.012 1.00 0.00 H new ATOM 0 HD3 ARG A 765 3.864 -9.422 -5.177 1.00 0.00 H new ATOM 0 HE ARG A 765 4.072 -12.013 -4.564 1.00 0.00 H new ATOM 0 HH11 ARG A 765 1.178 -10.044 -5.089 1.00 0.00 H new ATOM 0 HH12 ARG A 765 0.200 -11.418 -5.616 1.00 0.00 H new ATOM 0 HH21 ARG A 765 2.792 -13.773 -5.226 1.00 0.00 H new ATOM 0 HH22 ARG A 765 1.107 -13.514 -5.693 1.00 0.00 H new ATOM 763 N LYS A 766 5.919 -8.955 -0.587 1.00 0.00 N ATOM 764 CA LYS A 766 5.302 -8.943 0.722 1.00 0.00 C ATOM 765 C LYS A 766 3.848 -8.518 0.572 1.00 0.00 C ATOM 766 O LYS A 766 3.517 -7.734 -0.307 1.00 0.00 O ATOM 767 CB LYS A 766 6.056 -7.968 1.636 1.00 0.00 C ATOM 768 CG LYS A 766 5.701 -8.092 3.111 1.00 0.00 C ATOM 769 CD LYS A 766 4.515 -7.223 3.489 1.00 0.00 C ATOM 770 CE LYS A 766 4.169 -7.370 4.958 1.00 0.00 C ATOM 771 NZ LYS A 766 3.691 -8.738 5.286 1.00 0.00 N ATOM 0 H LYS A 766 5.909 -8.046 -1.050 1.00 0.00 H new ATOM 0 HA LYS A 766 5.343 -9.936 1.169 1.00 0.00 H new ATOM 0 HB2 LYS A 766 7.127 -8.131 1.517 1.00 0.00 H new ATOM 0 HB3 LYS A 766 5.850 -6.949 1.309 1.00 0.00 H new ATOM 0 HG2 LYS A 766 5.475 -9.133 3.343 1.00 0.00 H new ATOM 0 HG3 LYS A 766 6.563 -7.811 3.716 1.00 0.00 H new ATOM 0 HD2 LYS A 766 4.742 -6.180 3.269 1.00 0.00 H new ATOM 0 HD3 LYS A 766 3.653 -7.497 2.881 1.00 0.00 H new ATOM 0 HE2 LYS A 766 5.047 -7.139 5.562 1.00 0.00 H new ATOM 0 HE3 LYS A 766 3.400 -6.645 5.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 766 3.370 -8.766 6.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 766 2.901 -8.989 4.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 766 4.467 -9.418 5.155 1.00 0.00 H new ATOM 785 N THR A 767 2.983 -9.052 1.402 1.00 0.00 N ATOM 786 CA THR A 767 1.577 -8.680 1.375 1.00 0.00 C ATOM 787 C THR A 767 1.133 -8.167 2.743 1.00 0.00 C ATOM 788 O THR A 767 1.412 -8.791 3.768 1.00 0.00 O ATOM 789 CB THR A 767 0.696 -9.874 0.969 1.00 0.00 C ATOM 790 OG1 THR A 767 1.084 -10.344 -0.327 1.00 0.00 O ATOM 791 CG2 THR A 767 -0.778 -9.491 0.950 1.00 0.00 C ATOM 0 H THR A 767 3.223 -9.748 2.108 1.00 0.00 H new ATOM 0 HA THR A 767 1.460 -7.888 0.635 1.00 0.00 H new ATOM 0 HB THR A 767 0.836 -10.664 1.707 1.00 0.00 H new ATOM 0 HG1 THR A 767 0.522 -11.105 -0.581 1.00 0.00 H new ATOM 0 HG21 THR A 767 -1.375 -10.356 0.659 1.00 0.00 H new ATOM 0 HG22 THR A 767 -1.080 -9.158 1.943 1.00 0.00 H new ATOM 0 HG23 THR A 767 -0.935 -8.684 0.234 1.00 0.00 H new ATOM 799 N PHE A 768 0.462 -7.027 2.761 1.00 0.00 N ATOM 800 CA PHE A 768 -0.034 -6.457 3.993 1.00 0.00 C ATOM 801 C PHE A 768 -1.517 -6.155 3.838 1.00 0.00 C ATOM 802 O PHE A 768 -1.950 -5.618 2.817 1.00 0.00 O ATOM 803 CB PHE A 768 0.733 -5.182 4.333 1.00 0.00 C ATOM 804 CG PHE A 768 0.740 -4.835 5.794 1.00 0.00 C ATOM 805 CD1 PHE A 768 -0.442 -4.586 6.456 1.00 0.00 C ATOM 806 CD2 PHE A 768 1.930 -4.745 6.497 1.00 0.00 C ATOM 807 CE1 PHE A 768 -0.449 -4.253 7.795 1.00 0.00 C ATOM 808 CE2 PHE A 768 1.934 -4.414 7.837 1.00 0.00 C ATOM 809 CZ PHE A 768 0.742 -4.168 8.488 1.00 0.00 C ATOM 0 H PHE A 768 0.250 -6.478 1.928 1.00 0.00 H new ATOM 0 HA PHE A 768 0.110 -7.168 4.807 1.00 0.00 H new ATOM 0 HB2 PHE A 768 1.763 -5.290 3.992 1.00 0.00 H new ATOM 0 HB3 PHE A 768 0.299 -4.351 3.777 1.00 0.00 H new ATOM 0 HD1 PHE A 768 -1.377 -4.652 5.919 1.00 0.00 H new ATOM 0 HD2 PHE A 768 2.865 -4.936 5.991 1.00 0.00 H new ATOM 0 HE1 PHE A 768 -1.384 -4.059 8.300 1.00 0.00 H new ATOM 0 HE2 PHE A 768 2.868 -4.348 8.375 1.00 0.00 H new ATOM 0 HZ PHE A 768 0.741 -3.910 9.537 1.00 0.00 H new ATOM 819 N GLU A 769 -2.282 -6.516 4.846 1.00 0.00 N ATOM 820 CA GLU A 769 -3.720 -6.349 4.822 1.00 0.00 C ATOM 821 C GLU A 769 -4.199 -5.627 6.077 1.00 0.00 C ATOM 822 O GLU A 769 -3.847 -6.002 7.198 1.00 0.00 O ATOM 823 CB GLU A 769 -4.372 -7.723 4.708 1.00 0.00 C ATOM 824 CG GLU A 769 -5.894 -7.704 4.702 1.00 0.00 C ATOM 825 CD GLU A 769 -6.483 -9.099 4.661 1.00 0.00 C ATOM 826 OE1 GLU A 769 -6.530 -9.703 3.570 1.00 0.00 O ATOM 827 OE2 GLU A 769 -6.896 -9.608 5.723 1.00 0.00 O ATOM 0 H GLU A 769 -1.925 -6.934 5.705 1.00 0.00 H new ATOM 0 HA GLU A 769 -4.002 -5.740 3.964 1.00 0.00 H new ATOM 0 HB2 GLU A 769 -4.024 -8.201 3.792 1.00 0.00 H new ATOM 0 HB3 GLU A 769 -4.033 -8.342 5.539 1.00 0.00 H new ATOM 0 HG2 GLU A 769 -6.253 -7.186 5.591 1.00 0.00 H new ATOM 0 HG3 GLU A 769 -6.245 -7.138 3.840 1.00 0.00 H new ATOM 834 N ILE A 770 -4.979 -4.578 5.878 1.00 0.00 N ATOM 835 CA ILE A 770 -5.564 -3.825 6.970 1.00 0.00 C ATOM 836 C ILE A 770 -7.074 -3.807 6.811 1.00 0.00 C ATOM 837 O ILE A 770 -7.600 -3.249 5.853 1.00 0.00 O ATOM 838 CB ILE A 770 -5.021 -2.382 7.009 1.00 0.00 C ATOM 839 CG1 ILE A 770 -3.525 -2.395 7.311 1.00 0.00 C ATOM 840 CG2 ILE A 770 -5.755 -1.554 8.050 1.00 0.00 C ATOM 841 CD1 ILE A 770 -2.724 -1.518 6.387 1.00 0.00 C ATOM 0 H ILE A 770 -5.224 -4.225 4.953 1.00 0.00 H new ATOM 0 HA ILE A 770 -5.295 -4.308 7.909 1.00 0.00 H new ATOM 0 HB ILE A 770 -5.186 -1.927 6.032 1.00 0.00 H new ATOM 0 HG12 ILE A 770 -3.366 -2.069 8.339 1.00 0.00 H new ATOM 0 HG13 ILE A 770 -3.156 -3.418 7.240 1.00 0.00 H new ATOM 0 HG21 ILE A 770 -5.354 -0.541 8.058 1.00 0.00 H new ATOM 0 HG22 ILE A 770 -6.817 -1.522 7.807 1.00 0.00 H new ATOM 0 HG23 ILE A 770 -5.622 -2.005 9.033 1.00 0.00 H new ATOM 0 HD11 ILE A 770 -1.669 -1.573 6.656 1.00 0.00 H new ATOM 0 HD12 ILE A 770 -2.854 -1.857 5.359 1.00 0.00 H new ATOM 0 HD13 ILE A 770 -3.068 -0.487 6.475 1.00 0.00 H new ATOM 853 N LYS A 771 -7.768 -4.452 7.725 1.00 0.00 N ATOM 854 CA LYS A 771 -9.201 -4.579 7.633 1.00 0.00 C ATOM 855 C LYS A 771 -9.904 -3.364 8.203 1.00 0.00 C ATOM 856 O LYS A 771 -9.354 -2.641 9.041 1.00 0.00 O ATOM 857 CB LYS A 771 -9.647 -5.832 8.364 1.00 0.00 C ATOM 858 CG LYS A 771 -8.561 -6.886 8.407 1.00 0.00 C ATOM 859 CD LYS A 771 -9.089 -8.252 8.781 1.00 0.00 C ATOM 860 CE LYS A 771 -9.770 -8.936 7.604 1.00 0.00 C ATOM 861 NZ LYS A 771 -11.142 -8.422 7.351 1.00 0.00 N ATOM 0 H LYS A 771 -7.356 -4.898 8.545 1.00 0.00 H new ATOM 0 HA LYS A 771 -9.471 -4.653 6.580 1.00 0.00 H new ATOM 0 HB2 LYS A 771 -9.939 -5.572 9.381 1.00 0.00 H new ATOM 0 HB3 LYS A 771 -10.530 -6.242 7.873 1.00 0.00 H new ATOM 0 HG2 LYS A 771 -8.076 -6.943 7.432 1.00 0.00 H new ATOM 0 HG3 LYS A 771 -7.798 -6.587 9.125 1.00 0.00 H new ATOM 0 HD2 LYS A 771 -8.268 -8.874 9.138 1.00 0.00 H new ATOM 0 HD3 LYS A 771 -9.797 -8.155 9.604 1.00 0.00 H new ATOM 0 HE2 LYS A 771 -9.164 -8.796 6.709 1.00 0.00 H new ATOM 0 HE3 LYS A 771 -9.818 -10.009 7.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 771 -11.762 -9.209 7.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 771 -11.512 -7.980 8.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 771 -11.113 -7.717 6.587 1.00 0.00 H new ATOM 875 N GLU A 772 -11.120 -3.164 7.724 1.00 0.00 N ATOM 876 CA GLU A 772 -12.005 -2.099 8.180 1.00 0.00 C ATOM 877 C GLU A 772 -11.346 -0.728 8.106 1.00 0.00 C ATOM 878 O GLU A 772 -11.455 0.057 9.049 1.00 0.00 O ATOM 879 CB GLU A 772 -12.476 -2.349 9.617 1.00 0.00 C ATOM 880 CG GLU A 772 -12.715 -3.810 9.938 1.00 0.00 C ATOM 881 CD GLU A 772 -13.504 -4.015 11.213 1.00 0.00 C ATOM 882 OE1 GLU A 772 -12.907 -3.947 12.308 1.00 0.00 O ATOM 883 OE2 GLU A 772 -14.728 -4.264 11.127 1.00 0.00 O ATOM 0 H GLU A 772 -11.530 -3.746 6.994 1.00 0.00 H new ATOM 0 HA GLU A 772 -12.862 -2.107 7.506 1.00 0.00 H new ATOM 0 HB2 GLU A 772 -11.732 -1.952 10.307 1.00 0.00 H new ATOM 0 HB3 GLU A 772 -13.398 -1.794 9.789 1.00 0.00 H new ATOM 0 HG2 GLU A 772 -13.248 -4.276 9.109 1.00 0.00 H new ATOM 0 HG3 GLU A 772 -11.755 -4.319 10.026 1.00 0.00 H new ATOM 890 N ILE A 773 -10.661 -0.421 7.010 1.00 0.00 N ATOM 891 CA ILE A 773 -10.162 0.924 6.843 1.00 0.00 C ATOM 892 C ILE A 773 -11.354 1.808 6.517 1.00 0.00 C ATOM 893 O ILE A 773 -12.017 1.635 5.504 1.00 0.00 O ATOM 894 CB ILE A 773 -9.005 1.051 5.788 1.00 0.00 C ATOM 895 CG1 ILE A 773 -9.484 1.432 4.381 1.00 0.00 C ATOM 896 CG2 ILE A 773 -8.206 -0.241 5.710 1.00 0.00 C ATOM 897 CD1 ILE A 773 -9.660 2.931 4.172 1.00 0.00 C ATOM 0 H ILE A 773 -10.447 -1.067 6.250 1.00 0.00 H new ATOM 0 HA ILE A 773 -9.689 1.247 7.770 1.00 0.00 H new ATOM 0 HB ILE A 773 -8.378 1.868 6.144 1.00 0.00 H new ATOM 0 HG12 ILE A 773 -8.769 1.055 3.650 1.00 0.00 H new ATOM 0 HG13 ILE A 773 -10.433 0.934 4.184 1.00 0.00 H new ATOM 0 HG21 ILE A 773 -7.410 -0.132 4.974 1.00 0.00 H new ATOM 0 HG22 ILE A 773 -7.771 -0.459 6.685 1.00 0.00 H new ATOM 0 HG23 ILE A 773 -8.864 -1.058 5.415 1.00 0.00 H new ATOM 0 HD11 ILE A 773 -10.000 3.119 3.154 1.00 0.00 H new ATOM 0 HD12 ILE A 773 -10.398 3.313 4.877 1.00 0.00 H new ATOM 0 HD13 ILE A 773 -8.708 3.435 4.335 1.00 0.00 H new ATOM 909 N LYS A 774 -11.677 2.679 7.444 1.00 0.00 N ATOM 910 CA LYS A 774 -12.808 3.581 7.311 1.00 0.00 C ATOM 911 C LYS A 774 -12.272 4.987 7.069 1.00 0.00 C ATOM 912 O LYS A 774 -12.922 5.985 7.374 1.00 0.00 O ATOM 913 CB LYS A 774 -13.617 3.527 8.609 1.00 0.00 C ATOM 914 CG LYS A 774 -13.957 2.105 9.046 1.00 0.00 C ATOM 915 CD LYS A 774 -14.328 2.037 10.519 1.00 0.00 C ATOM 916 CE LYS A 774 -14.600 0.604 10.959 1.00 0.00 C ATOM 917 NZ LYS A 774 -14.831 0.509 12.425 1.00 0.00 N ATOM 0 H LYS A 774 -11.163 2.786 8.318 1.00 0.00 H new ATOM 0 HA LYS A 774 -13.450 3.297 6.477 1.00 0.00 H new ATOM 0 HB2 LYS A 774 -13.053 4.019 9.402 1.00 0.00 H new ATOM 0 HB3 LYS A 774 -14.541 4.091 8.478 1.00 0.00 H new ATOM 0 HG2 LYS A 774 -14.785 1.729 8.445 1.00 0.00 H new ATOM 0 HG3 LYS A 774 -13.104 1.453 8.856 1.00 0.00 H new ATOM 0 HD2 LYS A 774 -13.520 2.456 11.119 1.00 0.00 H new ATOM 0 HD3 LYS A 774 -15.211 2.649 10.702 1.00 0.00 H new ATOM 0 HE2 LYS A 774 -15.472 0.220 10.428 1.00 0.00 H new ATOM 0 HE3 LYS A 774 -13.755 -0.027 10.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 774 -15.012 -0.482 12.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 774 -13.990 0.851 12.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 774 -15.653 1.091 12.685 1.00 0.00 H new ATOM 931 N THR A 775 -11.073 5.042 6.500 1.00 0.00 N ATOM 932 CA THR A 775 -10.286 6.265 6.474 1.00 0.00 C ATOM 933 C THR A 775 -10.443 7.063 5.180 1.00 0.00 C ATOM 934 O THR A 775 -11.092 8.111 5.168 1.00 0.00 O ATOM 935 CB THR A 775 -8.804 5.920 6.644 1.00 0.00 C ATOM 936 OG1 THR A 775 -8.676 4.731 7.431 1.00 0.00 O ATOM 937 CG2 THR A 775 -8.057 7.060 7.318 1.00 0.00 C ATOM 0 H THR A 775 -10.624 4.246 6.048 1.00 0.00 H new ATOM 0 HA THR A 775 -10.655 6.884 7.291 1.00 0.00 H new ATOM 0 HB THR A 775 -8.371 5.758 5.657 1.00 0.00 H new ATOM 0 HG1 THR A 775 -7.727 4.510 7.538 1.00 0.00 H new ATOM 0 HG21 THR A 775 -7.006 6.792 7.428 1.00 0.00 H new ATOM 0 HG22 THR A 775 -8.140 7.960 6.709 1.00 0.00 H new ATOM 0 HG23 THR A 775 -8.489 7.247 8.301 1.00 0.00 H new ATOM 945 N ASN A 776 -9.810 6.561 4.112 1.00 0.00 N ATOM 946 CA ASN A 776 -9.751 7.220 2.794 1.00 0.00 C ATOM 947 C ASN A 776 -8.635 8.254 2.747 1.00 0.00 C ATOM 948 O ASN A 776 -8.496 8.993 1.777 1.00 0.00 O ATOM 949 CB ASN A 776 -11.085 7.846 2.383 1.00 0.00 C ATOM 950 CG ASN A 776 -12.196 6.825 2.236 1.00 0.00 C ATOM 951 OD1 ASN A 776 -13.377 7.165 2.313 1.00 0.00 O ATOM 952 ND2 ASN A 776 -11.834 5.565 2.057 1.00 0.00 N ATOM 0 H ASN A 776 -9.315 5.670 4.137 1.00 0.00 H new ATOM 0 HA ASN A 776 -9.533 6.436 2.068 1.00 0.00 H new ATOM 0 HB2 ASN A 776 -11.377 8.588 3.126 1.00 0.00 H new ATOM 0 HB3 ASN A 776 -10.957 8.374 1.438 1.00 0.00 H new ATOM 0 HD21 ASN A 776 -12.544 4.837 1.978 1.00 0.00 H new ATOM 0 HD22 ASN A 776 -10.845 5.322 1.998 1.00 0.00 H new ATOM 959 N GLU A 777 -7.836 8.262 3.799 1.00 0.00 N ATOM 960 CA GLU A 777 -6.637 9.087 3.904 1.00 0.00 C ATOM 961 C GLU A 777 -5.735 8.485 4.965 1.00 0.00 C ATOM 962 O GLU A 777 -5.758 8.901 6.124 1.00 0.00 O ATOM 963 CB GLU A 777 -6.984 10.525 4.284 1.00 0.00 C ATOM 964 CG GLU A 777 -7.318 11.413 3.101 1.00 0.00 C ATOM 965 CD GLU A 777 -7.419 12.875 3.478 1.00 0.00 C ATOM 966 OE1 GLU A 777 -6.468 13.635 3.189 1.00 0.00 O ATOM 967 OE2 GLU A 777 -8.443 13.274 4.071 1.00 0.00 O ATOM 0 H GLU A 777 -8.002 7.685 4.623 1.00 0.00 H new ATOM 0 HA GLU A 777 -6.135 9.110 2.937 1.00 0.00 H new ATOM 0 HB2 GLU A 777 -7.833 10.514 4.968 1.00 0.00 H new ATOM 0 HB3 GLU A 777 -6.144 10.960 4.825 1.00 0.00 H new ATOM 0 HG2 GLU A 777 -6.553 11.292 2.334 1.00 0.00 H new ATOM 0 HG3 GLU A 777 -8.262 11.089 2.664 1.00 0.00 H new ATOM 974 N TYR A 778 -4.952 7.497 4.576 1.00 0.00 N ATOM 975 CA TYR A 778 -4.220 6.693 5.550 1.00 0.00 C ATOM 976 C TYR A 778 -2.755 6.596 5.179 1.00 0.00 C ATOM 977 O TYR A 778 -2.412 6.279 4.045 1.00 0.00 O ATOM 978 CB TYR A 778 -4.847 5.299 5.665 1.00 0.00 C ATOM 979 CG TYR A 778 -4.095 4.327 6.549 1.00 0.00 C ATOM 980 CD1 TYR A 778 -4.261 4.339 7.926 1.00 0.00 C ATOM 981 CD2 TYR A 778 -3.235 3.381 6.002 1.00 0.00 C ATOM 982 CE1 TYR A 778 -3.591 3.438 8.734 1.00 0.00 C ATOM 983 CE2 TYR A 778 -2.559 2.481 6.803 1.00 0.00 C ATOM 984 CZ TYR A 778 -2.741 2.513 8.168 1.00 0.00 C ATOM 985 OH TYR A 778 -2.075 1.612 8.970 1.00 0.00 O ATOM 0 H TYR A 778 -4.804 7.229 3.603 1.00 0.00 H new ATOM 0 HA TYR A 778 -4.286 7.183 6.521 1.00 0.00 H new ATOM 0 HB2 TYR A 778 -5.862 5.405 6.049 1.00 0.00 H new ATOM 0 HB3 TYR A 778 -4.927 4.870 4.666 1.00 0.00 H new ATOM 0 HD1 TYR A 778 -4.924 5.064 8.375 1.00 0.00 H new ATOM 0 HD2 TYR A 778 -3.093 3.349 4.932 1.00 0.00 H new ATOM 0 HE1 TYR A 778 -3.734 3.460 9.804 1.00 0.00 H new ATOM 0 HE2 TYR A 778 -1.891 1.756 6.361 1.00 0.00 H new ATOM 0 HH TYR A 778 -1.517 1.029 8.414 1.00 0.00 H new ATOM 995 N VAL A 779 -1.890 6.886 6.131 1.00 0.00 N ATOM 996 CA VAL A 779 -0.471 6.797 5.894 1.00 0.00 C ATOM 997 C VAL A 779 0.029 5.401 6.221 1.00 0.00 C ATOM 998 O VAL A 779 0.030 4.979 7.379 1.00 0.00 O ATOM 999 CB VAL A 779 0.319 7.846 6.697 1.00 0.00 C ATOM 1000 CG1 VAL A 779 1.765 7.902 6.227 1.00 0.00 C ATOM 1001 CG2 VAL A 779 -0.333 9.208 6.578 1.00 0.00 C ATOM 0 H VAL A 779 -2.148 7.184 7.072 1.00 0.00 H new ATOM 0 HA VAL A 779 -0.305 7.004 4.837 1.00 0.00 H new ATOM 0 HB VAL A 779 0.311 7.552 7.747 1.00 0.00 H new ATOM 0 HG11 VAL A 779 2.307 8.649 6.806 1.00 0.00 H new ATOM 0 HG12 VAL A 779 2.231 6.926 6.366 1.00 0.00 H new ATOM 0 HG13 VAL A 779 1.794 8.170 5.171 1.00 0.00 H new ATOM 0 HG21 VAL A 779 0.239 9.937 7.152 1.00 0.00 H new ATOM 0 HG22 VAL A 779 -0.357 9.509 5.531 1.00 0.00 H new ATOM 0 HG23 VAL A 779 -1.351 9.159 6.965 1.00 0.00 H new ATOM 1011 N ILE A 780 0.422 4.683 5.184 1.00 0.00 N ATOM 1012 CA ILE A 780 0.932 3.333 5.330 1.00 0.00 C ATOM 1013 C ILE A 780 2.379 3.364 5.790 1.00 0.00 C ATOM 1014 O ILE A 780 3.140 4.259 5.426 1.00 0.00 O ATOM 1015 CB ILE A 780 0.844 2.552 4.001 1.00 0.00 C ATOM 1016 CG1 ILE A 780 -0.602 2.388 3.559 1.00 0.00 C ATOM 1017 CG2 ILE A 780 1.506 1.184 4.117 1.00 0.00 C ATOM 1018 CD1 ILE A 780 -0.721 1.661 2.243 1.00 0.00 C ATOM 0 H ILE A 780 0.397 5.018 4.221 1.00 0.00 H new ATOM 0 HA ILE A 780 0.316 2.829 6.075 1.00 0.00 H new ATOM 0 HB ILE A 780 1.378 3.133 3.249 1.00 0.00 H new ATOM 0 HG12 ILE A 780 -1.153 1.842 4.324 1.00 0.00 H new ATOM 0 HG13 ILE A 780 -1.066 3.370 3.472 1.00 0.00 H new ATOM 0 HG21 ILE A 780 1.427 0.660 3.165 1.00 0.00 H new ATOM 0 HG22 ILE A 780 2.557 1.309 4.376 1.00 0.00 H new ATOM 0 HG23 ILE A 780 1.008 0.603 4.893 1.00 0.00 H new ATOM 0 HD11 ILE A 780 -1.773 1.570 1.972 1.00 0.00 H new ATOM 0 HD12 ILE A 780 -0.194 2.220 1.470 1.00 0.00 H new ATOM 0 HD13 ILE A 780 -0.282 0.667 2.335 1.00 0.00 H new ATOM 1030 N LYS A 781 2.746 2.398 6.605 1.00 0.00 N ATOM 1031 CA LYS A 781 4.121 2.229 7.027 1.00 0.00 C ATOM 1032 C LYS A 781 4.518 0.785 6.820 1.00 0.00 C ATOM 1033 O LYS A 781 4.040 -0.103 7.527 1.00 0.00 O ATOM 1034 CB LYS A 781 4.332 2.615 8.499 1.00 0.00 C ATOM 1035 CG LYS A 781 4.248 4.111 8.791 1.00 0.00 C ATOM 1036 CD LYS A 781 2.814 4.621 8.840 1.00 0.00 C ATOM 1037 CE LYS A 781 2.002 3.919 9.920 1.00 0.00 C ATOM 1038 NZ LYS A 781 0.630 4.477 10.031 1.00 0.00 N ATOM 0 H LYS A 781 2.102 1.709 6.993 1.00 0.00 H new ATOM 0 HA LYS A 781 4.743 2.894 6.427 1.00 0.00 H new ATOM 0 HB2 LYS A 781 3.587 2.099 9.105 1.00 0.00 H new ATOM 0 HB3 LYS A 781 5.309 2.252 8.818 1.00 0.00 H new ATOM 0 HG2 LYS A 781 4.736 4.319 9.743 1.00 0.00 H new ATOM 0 HG3 LYS A 781 4.798 4.658 8.025 1.00 0.00 H new ATOM 0 HD2 LYS A 781 2.816 5.695 9.027 1.00 0.00 H new ATOM 0 HD3 LYS A 781 2.340 4.467 7.871 1.00 0.00 H new ATOM 0 HE2 LYS A 781 1.944 2.854 9.696 1.00 0.00 H new ATOM 0 HE3 LYS A 781 2.512 4.016 10.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 781 0.034 3.826 10.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 781 0.668 5.400 10.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 781 0.226 4.597 9.080 1.00 0.00 H new ATOM 1052 N THR A 782 5.368 0.540 5.840 1.00 0.00 N ATOM 1053 CA THR A 782 5.771 -0.816 5.550 1.00 0.00 C ATOM 1054 C THR A 782 6.794 -1.266 6.581 1.00 0.00 C ATOM 1055 O THR A 782 7.663 -0.477 6.975 1.00 0.00 O ATOM 1056 CB THR A 782 6.373 -0.959 4.149 1.00 0.00 C ATOM 1057 OG1 THR A 782 7.644 -0.312 4.082 1.00 0.00 O ATOM 1058 CG2 THR A 782 5.435 -0.373 3.131 1.00 0.00 C ATOM 0 H THR A 782 5.785 1.253 5.242 1.00 0.00 H new ATOM 0 HA THR A 782 4.878 -1.440 5.591 1.00 0.00 H new ATOM 0 HB THR A 782 6.516 -2.018 3.933 1.00 0.00 H new ATOM 0 HG1 THR A 782 7.520 0.659 4.129 1.00 0.00 H new ATOM 0 HG21 THR A 782 5.867 -0.477 2.136 1.00 0.00 H new ATOM 0 HG22 THR A 782 4.481 -0.900 3.169 1.00 0.00 H new ATOM 0 HG23 THR A 782 5.275 0.683 3.349 1.00 0.00 H new ATOM 1066 N PRO A 783 6.713 -2.533 7.010 1.00 0.00 N ATOM 1067 CA PRO A 783 7.605 -3.086 8.032 1.00 0.00 C ATOM 1068 C PRO A 783 9.065 -2.925 7.636 1.00 0.00 C ATOM 1069 O PRO A 783 9.396 -2.934 6.447 1.00 0.00 O ATOM 1070 CB PRO A 783 7.227 -4.567 8.088 1.00 0.00 C ATOM 1071 CG PRO A 783 5.862 -4.648 7.494 1.00 0.00 C ATOM 1072 CD PRO A 783 5.766 -3.531 6.501 1.00 0.00 C ATOM 0 HA PRO A 783 7.497 -2.581 8.992 1.00 0.00 H new ATOM 0 HB2 PRO A 783 7.937 -5.175 7.527 1.00 0.00 H new ATOM 0 HB3 PRO A 783 7.232 -4.936 9.114 1.00 0.00 H new ATOM 0 HG2 PRO A 783 5.706 -5.612 7.010 1.00 0.00 H new ATOM 0 HG3 PRO A 783 5.097 -4.550 8.264 1.00 0.00 H new ATOM 0 HD2 PRO A 783 6.034 -3.863 5.498 1.00 0.00 H new ATOM 0 HD3 PRO A 783 4.754 -3.131 6.445 1.00 0.00 H new ATOM 1080 N VAL A 784 9.928 -2.795 8.632 1.00 0.00 N ATOM 1081 CA VAL A 784 11.326 -2.476 8.399 1.00 0.00 C ATOM 1082 C VAL A 784 12.001 -3.568 7.577 1.00 0.00 C ATOM 1083 O VAL A 784 11.843 -4.762 7.841 1.00 0.00 O ATOM 1084 CB VAL A 784 12.087 -2.256 9.727 1.00 0.00 C ATOM 1085 CG1 VAL A 784 12.117 -3.526 10.556 1.00 0.00 C ATOM 1086 CG2 VAL A 784 13.491 -1.742 9.463 1.00 0.00 C ATOM 0 H VAL A 784 9.681 -2.907 9.615 1.00 0.00 H new ATOM 0 HA VAL A 784 11.358 -1.544 7.835 1.00 0.00 H new ATOM 0 HB VAL A 784 11.553 -1.499 10.301 1.00 0.00 H new ATOM 0 HG11 VAL A 784 12.658 -3.342 11.484 1.00 0.00 H new ATOM 0 HG12 VAL A 784 11.097 -3.835 10.786 1.00 0.00 H new ATOM 0 HG13 VAL A 784 12.617 -4.315 9.995 1.00 0.00 H new ATOM 0 HG21 VAL A 784 14.009 -1.594 10.411 1.00 0.00 H new ATOM 0 HG22 VAL A 784 14.037 -2.468 8.861 1.00 0.00 H new ATOM 0 HG23 VAL A 784 13.437 -0.794 8.928 1.00 0.00 H new ATOM 1096 N PHE A 785 12.737 -3.148 6.563 1.00 0.00 N ATOM 1097 CA PHE A 785 13.331 -4.078 5.619 1.00 0.00 C ATOM 1098 C PHE A 785 14.713 -4.513 6.052 1.00 0.00 C ATOM 1099 O PHE A 785 15.083 -5.665 5.871 1.00 0.00 O ATOM 1100 CB PHE A 785 13.366 -3.471 4.218 1.00 0.00 C ATOM 1101 CG PHE A 785 11.998 -3.336 3.618 1.00 0.00 C ATOM 1102 CD1 PHE A 785 11.239 -2.204 3.842 1.00 0.00 C ATOM 1103 CD2 PHE A 785 11.465 -4.353 2.845 1.00 0.00 C ATOM 1104 CE1 PHE A 785 9.973 -2.085 3.303 1.00 0.00 C ATOM 1105 CE2 PHE A 785 10.202 -4.240 2.301 1.00 0.00 C ATOM 1106 CZ PHE A 785 9.455 -3.104 2.533 1.00 0.00 C ATOM 0 H PHE A 785 12.938 -2.166 6.372 1.00 0.00 H new ATOM 0 HA PHE A 785 12.704 -4.969 5.596 1.00 0.00 H new ATOM 0 HB2 PHE A 785 13.839 -2.490 4.262 1.00 0.00 H new ATOM 0 HB3 PHE A 785 13.984 -4.094 3.571 1.00 0.00 H new ATOM 0 HD1 PHE A 785 11.640 -1.403 4.445 1.00 0.00 H new ATOM 0 HD2 PHE A 785 12.045 -5.246 2.665 1.00 0.00 H new ATOM 0 HE1 PHE A 785 9.390 -1.194 3.485 1.00 0.00 H new ATOM 0 HE2 PHE A 785 9.800 -5.039 1.695 1.00 0.00 H new ATOM 0 HZ PHE A 785 8.465 -3.013 2.112 1.00 0.00 H new ATOM 1116 N THR A 786 15.465 -3.574 6.627 1.00 0.00 N ATOM 1117 CA THR A 786 16.843 -3.807 7.090 1.00 0.00 C ATOM 1118 C THR A 786 17.747 -4.284 5.957 1.00 0.00 C ATOM 1119 O THR A 786 18.923 -4.573 6.167 1.00 0.00 O ATOM 1120 CB THR A 786 16.916 -4.807 8.272 1.00 0.00 C ATOM 1121 OG1 THR A 786 16.619 -6.143 7.845 1.00 0.00 O ATOM 1122 CG2 THR A 786 15.941 -4.403 9.360 1.00 0.00 C ATOM 0 H THR A 786 15.137 -2.622 6.788 1.00 0.00 H new ATOM 0 HA THR A 786 17.201 -2.841 7.446 1.00 0.00 H new ATOM 0 HB THR A 786 17.934 -4.784 8.661 1.00 0.00 H new ATOM 0 HG1 THR A 786 16.286 -6.125 6.924 1.00 0.00 H new ATOM 0 HG21 THR A 786 16.002 -5.113 10.185 1.00 0.00 H new ATOM 0 HG22 THR A 786 16.191 -3.405 9.721 1.00 0.00 H new ATOM 0 HG23 THR A 786 14.928 -4.400 8.958 1.00 0.00 H new ATOM 1130 N THR A 787 17.194 -4.345 4.759 1.00 0.00 N ATOM 1131 CA THR A 787 17.937 -4.798 3.603 1.00 0.00 C ATOM 1132 C THR A 787 17.708 -3.878 2.419 1.00 0.00 C ATOM 1133 O THR A 787 16.575 -3.690 1.979 1.00 0.00 O ATOM 1134 CB THR A 787 17.548 -6.226 3.221 1.00 0.00 C ATOM 1135 OG1 THR A 787 17.703 -7.092 4.352 1.00 0.00 O ATOM 1136 CG2 THR A 787 18.398 -6.733 2.067 1.00 0.00 C ATOM 0 H THR A 787 16.227 -4.084 4.564 1.00 0.00 H new ATOM 0 HA THR A 787 18.994 -4.781 3.869 1.00 0.00 H new ATOM 0 HB THR A 787 16.505 -6.222 2.904 1.00 0.00 H new ATOM 0 HG1 THR A 787 17.451 -8.005 4.102 1.00 0.00 H new ATOM 0 HG21 THR A 787 18.100 -7.751 1.816 1.00 0.00 H new ATOM 0 HG22 THR A 787 18.255 -6.089 1.200 1.00 0.00 H new ATOM 0 HG23 THR A 787 19.449 -6.723 2.357 1.00 0.00 H new ATOM 1144 N GLY A 788 18.788 -3.269 1.952 1.00 0.00 N ATOM 1145 CA GLY A 788 18.732 -2.460 0.753 1.00 0.00 C ATOM 1146 C GLY A 788 18.160 -3.200 -0.442 1.00 0.00 C ATOM 1147 O GLY A 788 18.794 -4.097 -0.994 1.00 0.00 O ATOM 0 H GLY A 788 19.709 -3.322 2.387 1.00 0.00 H new ATOM 0 HA2 GLY A 788 18.126 -1.575 0.948 1.00 0.00 H new ATOM 0 HA3 GLY A 788 19.736 -2.112 0.510 1.00 0.00 H new ATOM 1151 N GLY A 789 16.957 -2.816 -0.817 1.00 0.00 N ATOM 1152 CA GLY A 789 16.314 -3.335 -2.003 1.00 0.00 C ATOM 1153 C GLY A 789 15.283 -2.352 -2.519 1.00 0.00 C ATOM 1154 O GLY A 789 14.927 -1.406 -1.814 1.00 0.00 O ATOM 0 H GLY A 789 16.398 -2.133 -0.305 1.00 0.00 H new ATOM 0 HA2 GLY A 789 17.060 -3.527 -2.774 1.00 0.00 H new ATOM 0 HA3 GLY A 789 15.836 -4.288 -1.777 1.00 0.00 H new ATOM 1158 N ASP A 790 14.796 -2.556 -3.731 1.00 0.00 N ATOM 1159 CA ASP A 790 13.796 -1.672 -4.295 1.00 0.00 C ATOM 1160 C ASP A 790 12.463 -2.383 -4.369 1.00 0.00 C ATOM 1161 O ASP A 790 12.363 -3.511 -4.860 1.00 0.00 O ATOM 1162 CB ASP A 790 14.215 -1.141 -5.673 1.00 0.00 C ATOM 1163 CG ASP A 790 15.019 -2.135 -6.487 1.00 0.00 C ATOM 1164 OD1 ASP A 790 16.262 -2.141 -6.353 1.00 0.00 O ATOM 1165 OD2 ASP A 790 14.424 -2.893 -7.277 1.00 0.00 O ATOM 0 H ASP A 790 15.077 -3.324 -4.340 1.00 0.00 H new ATOM 0 HA ASP A 790 13.700 -0.807 -3.639 1.00 0.00 H new ATOM 0 HB2 ASP A 790 13.322 -0.863 -6.233 1.00 0.00 H new ATOM 0 HB3 ASP A 790 14.803 -0.233 -5.540 1.00 0.00 H new ATOM 1170 N TYR A 791 11.444 -1.726 -3.852 1.00 0.00 N ATOM 1171 CA TYR A 791 10.127 -2.317 -3.751 1.00 0.00 C ATOM 1172 C TYR A 791 9.086 -1.375 -4.318 1.00 0.00 C ATOM 1173 O TYR A 791 9.302 -0.170 -4.387 1.00 0.00 O ATOM 1174 CB TYR A 791 9.791 -2.619 -2.289 1.00 0.00 C ATOM 1175 CG TYR A 791 10.853 -3.416 -1.565 1.00 0.00 C ATOM 1176 CD1 TYR A 791 11.852 -2.777 -0.842 1.00 0.00 C ATOM 1177 CD2 TYR A 791 10.856 -4.803 -1.607 1.00 0.00 C ATOM 1178 CE1 TYR A 791 12.827 -3.499 -0.183 1.00 0.00 C ATOM 1179 CE2 TYR A 791 11.828 -5.532 -0.949 1.00 0.00 C ATOM 1180 CZ TYR A 791 12.809 -4.876 -0.239 1.00 0.00 C ATOM 1181 OH TYR A 791 13.778 -5.601 0.418 1.00 0.00 O ATOM 0 H TYR A 791 11.506 -0.773 -3.492 1.00 0.00 H new ATOM 0 HA TYR A 791 10.124 -3.246 -4.321 1.00 0.00 H new ATOM 0 HB2 TYR A 791 9.635 -1.678 -1.761 1.00 0.00 H new ATOM 0 HB3 TYR A 791 8.850 -3.167 -2.249 1.00 0.00 H new ATOM 0 HD1 TYR A 791 11.866 -1.698 -0.795 1.00 0.00 H new ATOM 0 HD2 TYR A 791 10.087 -5.320 -2.162 1.00 0.00 H new ATOM 0 HE1 TYR A 791 13.599 -2.988 0.373 1.00 0.00 H new ATOM 0 HE2 TYR A 791 11.819 -6.611 -0.991 1.00 0.00 H new ATOM 0 HH TYR A 791 13.621 -6.558 0.279 1.00 0.00 H new ATOM 1191 N ILE A 792 7.967 -1.924 -4.738 1.00 0.00 N ATOM 1192 CA ILE A 792 6.854 -1.120 -5.184 1.00 0.00 C ATOM 1193 C ILE A 792 5.596 -1.557 -4.459 1.00 0.00 C ATOM 1194 O ILE A 792 5.190 -2.716 -4.540 1.00 0.00 O ATOM 1195 CB ILE A 792 6.670 -1.226 -6.709 1.00 0.00 C ATOM 1196 CG1 ILE A 792 7.857 -0.572 -7.417 1.00 0.00 C ATOM 1197 CG2 ILE A 792 5.371 -0.561 -7.133 1.00 0.00 C ATOM 1198 CD1 ILE A 792 8.221 -1.225 -8.726 1.00 0.00 C ATOM 0 H ILE A 792 7.805 -2.930 -4.779 1.00 0.00 H new ATOM 0 HA ILE A 792 7.058 -0.075 -4.951 1.00 0.00 H new ATOM 0 HB ILE A 792 6.624 -2.278 -6.989 1.00 0.00 H new ATOM 0 HG12 ILE A 792 7.627 0.478 -7.597 1.00 0.00 H new ATOM 0 HG13 ILE A 792 8.723 -0.599 -6.755 1.00 0.00 H new ATOM 0 HG21 ILE A 792 5.255 -0.644 -8.214 1.00 0.00 H new ATOM 0 HG22 ILE A 792 4.533 -1.053 -6.639 1.00 0.00 H new ATOM 0 HG23 ILE A 792 5.392 0.492 -6.850 1.00 0.00 H new ATOM 0 HD11 ILE A 792 9.071 -0.705 -9.168 1.00 0.00 H new ATOM 0 HD12 ILE A 792 8.484 -2.268 -8.551 1.00 0.00 H new ATOM 0 HD13 ILE A 792 7.371 -1.174 -9.407 1.00 0.00 H new ATOM 1210 N LEU A 793 5.010 -0.637 -3.717 1.00 0.00 N ATOM 1211 CA LEU A 793 3.798 -0.923 -2.990 1.00 0.00 C ATOM 1212 C LEU A 793 2.614 -0.732 -3.921 1.00 0.00 C ATOM 1213 O LEU A 793 2.269 0.394 -4.284 1.00 0.00 O ATOM 1214 CB LEU A 793 3.675 -0.023 -1.753 1.00 0.00 C ATOM 1215 CG LEU A 793 2.482 -0.331 -0.836 1.00 0.00 C ATOM 1216 CD1 LEU A 793 2.807 -0.002 0.613 1.00 0.00 C ATOM 1217 CD2 LEU A 793 1.260 0.457 -1.262 1.00 0.00 C ATOM 0 H LEU A 793 5.358 0.315 -3.605 1.00 0.00 H new ATOM 0 HA LEU A 793 3.820 -1.954 -2.637 1.00 0.00 H new ATOM 0 HB2 LEU A 793 4.592 -0.107 -1.170 1.00 0.00 H new ATOM 0 HB3 LEU A 793 3.601 1.013 -2.083 1.00 0.00 H new ATOM 0 HG LEU A 793 2.273 -1.397 -0.921 1.00 0.00 H new ATOM 0 HD11 LEU A 793 1.945 -0.230 1.240 1.00 0.00 H new ATOM 0 HD12 LEU A 793 3.660 -0.597 0.939 1.00 0.00 H new ATOM 0 HD13 LEU A 793 3.049 1.057 0.700 1.00 0.00 H new ATOM 0 HD21 LEU A 793 0.427 0.223 -0.599 1.00 0.00 H new ATOM 0 HD22 LEU A 793 1.478 1.524 -1.209 1.00 0.00 H new ATOM 0 HD23 LEU A 793 0.994 0.192 -2.285 1.00 0.00 H new ATOM 1229 N SER A 794 2.022 -1.837 -4.317 1.00 0.00 N ATOM 1230 CA SER A 794 0.892 -1.826 -5.220 1.00 0.00 C ATOM 1231 C SER A 794 -0.327 -2.387 -4.501 1.00 0.00 C ATOM 1232 O SER A 794 -0.210 -2.908 -3.396 1.00 0.00 O ATOM 1233 CB SER A 794 1.222 -2.659 -6.454 1.00 0.00 C ATOM 1234 OG SER A 794 2.538 -2.387 -6.902 1.00 0.00 O ATOM 0 H SER A 794 2.311 -2.770 -4.022 1.00 0.00 H new ATOM 0 HA SER A 794 0.674 -0.806 -5.538 1.00 0.00 H new ATOM 0 HB2 SER A 794 1.123 -3.719 -6.221 1.00 0.00 H new ATOM 0 HB3 SER A 794 0.509 -2.440 -7.249 1.00 0.00 H new ATOM 0 HG SER A 794 2.733 -2.931 -7.693 1.00 0.00 H new ATOM 1240 N LEU A 795 -1.489 -2.280 -5.114 1.00 0.00 N ATOM 1241 CA LEU A 795 -2.722 -2.696 -4.471 1.00 0.00 C ATOM 1242 C LEU A 795 -3.122 -4.095 -4.914 1.00 0.00 C ATOM 1243 O LEU A 795 -3.182 -4.381 -6.112 1.00 0.00 O ATOM 1244 CB LEU A 795 -3.826 -1.710 -4.817 1.00 0.00 C ATOM 1245 CG LEU A 795 -3.440 -0.241 -4.691 1.00 0.00 C ATOM 1246 CD1 LEU A 795 -4.615 0.629 -5.070 1.00 0.00 C ATOM 1247 CD2 LEU A 795 -2.949 0.078 -3.286 1.00 0.00 C ATOM 0 H LEU A 795 -1.607 -1.909 -6.057 1.00 0.00 H new ATOM 0 HA LEU A 795 -2.565 -2.713 -3.392 1.00 0.00 H new ATOM 0 HB2 LEU A 795 -4.153 -1.898 -5.840 1.00 0.00 H new ATOM 0 HB3 LEU A 795 -4.681 -1.902 -4.169 1.00 0.00 H new ATOM 0 HG LEU A 795 -2.617 -0.034 -5.375 1.00 0.00 H new ATOM 0 HD11 LEU A 795 -4.335 1.678 -4.979 1.00 0.00 H new ATOM 0 HD12 LEU A 795 -4.906 0.419 -6.099 1.00 0.00 H new ATOM 0 HD13 LEU A 795 -5.453 0.418 -4.406 1.00 0.00 H new ATOM 0 HD21 LEU A 795 -2.681 1.133 -3.225 1.00 0.00 H new ATOM 0 HD22 LEU A 795 -3.739 -0.137 -2.567 1.00 0.00 H new ATOM 0 HD23 LEU A 795 -2.075 -0.532 -3.059 1.00 0.00 H new ATOM 1259 N VAL A 796 -3.408 -4.958 -3.945 1.00 0.00 N ATOM 1260 CA VAL A 796 -3.789 -6.333 -4.238 1.00 0.00 C ATOM 1261 C VAL A 796 -5.293 -6.448 -4.428 1.00 0.00 C ATOM 1262 O VAL A 796 -5.768 -6.869 -5.483 1.00 0.00 O ATOM 1263 CB VAL A 796 -3.345 -7.297 -3.112 1.00 0.00 C ATOM 1264 CG1 VAL A 796 -3.912 -8.695 -3.329 1.00 0.00 C ATOM 1265 CG2 VAL A 796 -1.837 -7.348 -3.054 1.00 0.00 C ATOM 0 H VAL A 796 -3.383 -4.729 -2.951 1.00 0.00 H new ATOM 0 HA VAL A 796 -3.283 -6.615 -5.161 1.00 0.00 H new ATOM 0 HB VAL A 796 -3.732 -6.923 -2.164 1.00 0.00 H new ATOM 0 HG11 VAL A 796 -3.583 -9.350 -2.522 1.00 0.00 H new ATOM 0 HG12 VAL A 796 -5.001 -8.649 -3.338 1.00 0.00 H new ATOM 0 HG13 VAL A 796 -3.558 -9.087 -4.282 1.00 0.00 H new ATOM 0 HG21 VAL A 796 -1.526 -8.027 -2.260 1.00 0.00 H new ATOM 0 HG22 VAL A 796 -1.448 -7.703 -4.008 1.00 0.00 H new ATOM 0 HG23 VAL A 796 -1.447 -6.351 -2.851 1.00 0.00 H new ATOM 1275 N SER A 797 -6.034 -6.014 -3.418 1.00 0.00 N ATOM 1276 CA SER A 797 -7.480 -6.180 -3.379 1.00 0.00 C ATOM 1277 C SER A 797 -8.061 -5.439 -2.180 1.00 0.00 C ATOM 1278 O SER A 797 -7.331 -5.049 -1.273 1.00 0.00 O ATOM 1279 CB SER A 797 -7.849 -7.668 -3.290 1.00 0.00 C ATOM 1280 OG SER A 797 -7.660 -8.331 -4.531 1.00 0.00 O ATOM 0 H SER A 797 -5.650 -5.537 -2.603 1.00 0.00 H new ATOM 0 HA SER A 797 -7.897 -5.766 -4.297 1.00 0.00 H new ATOM 0 HB2 SER A 797 -7.240 -8.149 -2.524 1.00 0.00 H new ATOM 0 HB3 SER A 797 -8.889 -7.767 -2.979 1.00 0.00 H new ATOM 0 HG SER A 797 -7.262 -7.710 -5.176 1.00 0.00 H new ATOM 1286 N ILE A 798 -9.364 -5.230 -2.196 1.00 0.00 N ATOM 1287 CA ILE A 798 -10.058 -4.601 -1.084 1.00 0.00 C ATOM 1288 C ILE A 798 -11.337 -5.374 -0.812 1.00 0.00 C ATOM 1289 O ILE A 798 -11.730 -6.203 -1.619 1.00 0.00 O ATOM 1290 CB ILE A 798 -10.386 -3.123 -1.378 1.00 0.00 C ATOM 1291 CG1 ILE A 798 -10.670 -2.368 -0.079 1.00 0.00 C ATOM 1292 CG2 ILE A 798 -11.588 -3.038 -2.305 1.00 0.00 C ATOM 1293 CD1 ILE A 798 -10.508 -0.872 -0.199 1.00 0.00 C ATOM 0 H ILE A 798 -9.970 -5.489 -2.975 1.00 0.00 H new ATOM 0 HA ILE A 798 -9.408 -4.620 -0.209 1.00 0.00 H new ATOM 0 HB ILE A 798 -9.525 -2.662 -1.863 1.00 0.00 H new ATOM 0 HG12 ILE A 798 -11.687 -2.590 0.245 1.00 0.00 H new ATOM 0 HG13 ILE A 798 -10.001 -2.736 0.699 1.00 0.00 H new ATOM 0 HG21 ILE A 798 -11.816 -1.992 -2.510 1.00 0.00 H new ATOM 0 HG22 ILE A 798 -11.363 -3.550 -3.240 1.00 0.00 H new ATOM 0 HG23 ILE A 798 -12.448 -3.511 -1.830 1.00 0.00 H new ATOM 0 HD11 ILE A 798 -10.726 -0.404 0.761 1.00 0.00 H new ATOM 0 HD12 ILE A 798 -9.484 -0.639 -0.492 1.00 0.00 H new ATOM 0 HD13 ILE A 798 -11.197 -0.491 -0.953 1.00 0.00 H new ATOM 1305 N LYS A 799 -11.978 -5.119 0.307 1.00 0.00 N ATOM 1306 CA LYS A 799 -13.159 -5.875 0.676 1.00 0.00 C ATOM 1307 C LYS A 799 -14.249 -4.968 1.197 1.00 0.00 C ATOM 1308 O LYS A 799 -14.054 -4.256 2.184 1.00 0.00 O ATOM 1309 CB LYS A 799 -12.775 -6.870 1.743 1.00 0.00 C ATOM 1310 CG LYS A 799 -13.831 -7.869 2.141 1.00 0.00 C ATOM 1311 CD LYS A 799 -13.246 -8.816 3.165 1.00 0.00 C ATOM 1312 CE LYS A 799 -14.253 -9.834 3.622 1.00 0.00 C ATOM 1313 NZ LYS A 799 -13.630 -10.913 4.428 1.00 0.00 N ATOM 0 H LYS A 799 -11.705 -4.399 0.975 1.00 0.00 H new ATOM 0 HA LYS A 799 -13.543 -6.386 -0.206 1.00 0.00 H new ATOM 0 HB2 LYS A 799 -11.899 -7.419 1.398 1.00 0.00 H new ATOM 0 HB3 LYS A 799 -12.475 -6.317 2.633 1.00 0.00 H new ATOM 0 HG2 LYS A 799 -14.699 -7.356 2.554 1.00 0.00 H new ATOM 0 HG3 LYS A 799 -14.174 -8.423 1.267 1.00 0.00 H new ATOM 0 HD2 LYS A 799 -12.382 -9.325 2.738 1.00 0.00 H new ATOM 0 HD3 LYS A 799 -12.888 -8.248 4.023 1.00 0.00 H new ATOM 0 HE2 LYS A 799 -15.024 -9.340 4.213 1.00 0.00 H new ATOM 0 HE3 LYS A 799 -14.747 -10.270 2.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 799 -14.360 -11.593 4.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 799 -12.912 -11.402 3.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 799 -13.181 -10.501 5.271 1.00 0.00 H new ATOM 1327 N ASP A 800 -15.384 -5.000 0.525 1.00 0.00 N ATOM 1328 CA ASP A 800 -16.565 -4.278 0.975 1.00 0.00 C ATOM 1329 C ASP A 800 -17.008 -4.829 2.305 1.00 0.00 C ATOM 1330 O ASP A 800 -16.742 -5.989 2.617 1.00 0.00 O ATOM 1331 CB ASP A 800 -17.730 -4.410 -0.009 1.00 0.00 C ATOM 1332 CG ASP A 800 -17.486 -3.745 -1.349 1.00 0.00 C ATOM 1333 OD1 ASP A 800 -17.920 -2.587 -1.522 1.00 0.00 O ATOM 1334 OD2 ASP A 800 -16.903 -4.385 -2.240 1.00 0.00 O ATOM 0 H ASP A 800 -15.516 -5.522 -0.341 1.00 0.00 H new ATOM 0 HA ASP A 800 -16.294 -3.225 1.052 1.00 0.00 H new ATOM 0 HB2 ASP A 800 -17.936 -5.468 -0.172 1.00 0.00 H new ATOM 0 HB3 ASP A 800 -18.623 -3.978 0.442 1.00 0.00 H new ATOM 1339 N SER A 801 -17.728 -4.002 3.054 1.00 0.00 N ATOM 1340 CA SER A 801 -18.152 -4.322 4.410 1.00 0.00 C ATOM 1341 C SER A 801 -19.125 -5.509 4.449 1.00 0.00 C ATOM 1342 O SER A 801 -19.514 -5.968 5.523 1.00 0.00 O ATOM 1343 CB SER A 801 -18.798 -3.084 5.023 1.00 0.00 C ATOM 1344 OG SER A 801 -18.031 -1.924 4.728 1.00 0.00 O ATOM 0 H SER A 801 -18.036 -3.084 2.734 1.00 0.00 H new ATOM 0 HA SER A 801 -17.275 -4.618 4.986 1.00 0.00 H new ATOM 0 HB2 SER A 801 -19.810 -2.966 4.637 1.00 0.00 H new ATOM 0 HB3 SER A 801 -18.881 -3.207 6.103 1.00 0.00 H new ATOM 0 HG SER A 801 -17.080 -2.117 4.865 1.00 0.00 H new ATOM 1350 N THR A 802 -19.515 -5.988 3.271 1.00 0.00 N ATOM 1351 CA THR A 802 -20.358 -7.170 3.149 1.00 0.00 C ATOM 1352 C THR A 802 -19.510 -8.362 2.685 1.00 0.00 C ATOM 1353 O THR A 802 -20.026 -9.413 2.292 1.00 0.00 O ATOM 1354 CB THR A 802 -21.526 -6.915 2.161 1.00 0.00 C ATOM 1355 OG1 THR A 802 -22.397 -8.052 2.092 1.00 0.00 O ATOM 1356 CG2 THR A 802 -21.002 -6.588 0.769 1.00 0.00 C ATOM 0 H THR A 802 -19.256 -5.568 2.378 1.00 0.00 H new ATOM 0 HA THR A 802 -20.789 -7.397 4.124 1.00 0.00 H new ATOM 0 HB THR A 802 -22.090 -6.060 2.535 1.00 0.00 H new ATOM 0 HG1 THR A 802 -21.862 -8.870 2.024 1.00 0.00 H new ATOM 0 HG21 THR A 802 -21.841 -6.414 0.096 1.00 0.00 H new ATOM 0 HG22 THR A 802 -20.382 -5.693 0.815 1.00 0.00 H new ATOM 0 HG23 THR A 802 -20.407 -7.423 0.399 1.00 0.00 H new ATOM 1364 N GLY A 803 -18.197 -8.176 2.743 1.00 0.00 N ATOM 1365 CA GLY A 803 -17.263 -9.200 2.330 1.00 0.00 C ATOM 1366 C GLY A 803 -17.179 -9.346 0.827 1.00 0.00 C ATOM 1367 O GLY A 803 -17.220 -10.458 0.305 1.00 0.00 O ATOM 0 H GLY A 803 -17.759 -7.317 3.075 1.00 0.00 H new ATOM 0 HA2 GLY A 803 -16.274 -8.963 2.723 1.00 0.00 H new ATOM 0 HA3 GLY A 803 -17.560 -10.153 2.767 1.00 0.00 H new ATOM 1371 N CYS A 804 -17.061 -8.229 0.129 1.00 0.00 N ATOM 1372 CA CYS A 804 -16.911 -8.271 -1.325 1.00 0.00 C ATOM 1373 C CYS A 804 -15.499 -7.854 -1.710 1.00 0.00 C ATOM 1374 O CYS A 804 -15.145 -6.685 -1.625 1.00 0.00 O ATOM 1375 CB CYS A 804 -17.944 -7.372 -2.014 1.00 0.00 C ATOM 1376 SG CYS A 804 -17.845 -7.366 -3.819 1.00 0.00 S ATOM 0 H CYS A 804 -17.065 -7.293 0.533 1.00 0.00 H new ATOM 0 HA CYS A 804 -17.085 -9.293 -1.661 1.00 0.00 H new ATOM 0 HB2 CYS A 804 -18.942 -7.694 -1.718 1.00 0.00 H new ATOM 0 HB3 CYS A 804 -17.818 -6.352 -1.652 1.00 0.00 H new ATOM 0 HG CYS A 804 -18.760 -6.578 -4.301 1.00 0.00 H new ATOM 1382 N VAL A 805 -14.686 -8.816 -2.113 1.00 0.00 N ATOM 1383 CA VAL A 805 -13.291 -8.540 -2.409 1.00 0.00 C ATOM 1384 C VAL A 805 -13.127 -8.080 -3.855 1.00 0.00 C ATOM 1385 O VAL A 805 -13.200 -8.873 -4.798 1.00 0.00 O ATOM 1386 CB VAL A 805 -12.393 -9.765 -2.145 1.00 0.00 C ATOM 1387 CG1 VAL A 805 -10.948 -9.336 -1.983 1.00 0.00 C ATOM 1388 CG2 VAL A 805 -12.865 -10.534 -0.919 1.00 0.00 C ATOM 0 H VAL A 805 -14.965 -9.788 -2.242 1.00 0.00 H new ATOM 0 HA VAL A 805 -12.975 -7.740 -1.739 1.00 0.00 H new ATOM 0 HB VAL A 805 -12.463 -10.430 -3.006 1.00 0.00 H new ATOM 0 HG11 VAL A 805 -10.327 -10.212 -1.797 1.00 0.00 H new ATOM 0 HG12 VAL A 805 -10.612 -8.839 -2.893 1.00 0.00 H new ATOM 0 HG13 VAL A 805 -10.865 -8.648 -1.142 1.00 0.00 H new ATOM 0 HG21 VAL A 805 -12.214 -11.393 -0.755 1.00 0.00 H new ATOM 0 HG22 VAL A 805 -12.832 -9.882 -0.046 1.00 0.00 H new ATOM 0 HG23 VAL A 805 -13.887 -10.878 -1.077 1.00 0.00 H new ATOM 1398 N VAL A 806 -12.909 -6.785 -4.007 1.00 0.00 N ATOM 1399 CA VAL A 806 -12.757 -6.154 -5.305 1.00 0.00 C ATOM 1400 C VAL A 806 -11.297 -6.143 -5.741 1.00 0.00 C ATOM 1401 O VAL A 806 -10.393 -5.893 -4.936 1.00 0.00 O ATOM 1402 CB VAL A 806 -13.311 -4.710 -5.272 1.00 0.00 C ATOM 1403 CG1 VAL A 806 -12.874 -3.908 -6.491 1.00 0.00 C ATOM 1404 CG2 VAL A 806 -14.823 -4.747 -5.192 1.00 0.00 C ATOM 0 H VAL A 806 -12.832 -6.136 -3.224 1.00 0.00 H new ATOM 0 HA VAL A 806 -13.327 -6.736 -6.029 1.00 0.00 H new ATOM 0 HB VAL A 806 -12.906 -4.215 -4.390 1.00 0.00 H new ATOM 0 HG11 VAL A 806 -13.284 -2.900 -6.429 1.00 0.00 H new ATOM 0 HG12 VAL A 806 -11.786 -3.856 -6.521 1.00 0.00 H new ATOM 0 HG13 VAL A 806 -13.239 -4.394 -7.396 1.00 0.00 H new ATOM 0 HG21 VAL A 806 -15.211 -3.729 -5.169 1.00 0.00 H new ATOM 0 HG22 VAL A 806 -15.221 -5.267 -6.063 1.00 0.00 H new ATOM 0 HG23 VAL A 806 -15.127 -5.272 -4.286 1.00 0.00 H new ATOM 1414 N GLY A 807 -11.085 -6.426 -7.018 1.00 0.00 N ATOM 1415 CA GLY A 807 -9.748 -6.426 -7.578 1.00 0.00 C ATOM 1416 C GLY A 807 -9.228 -5.021 -7.781 1.00 0.00 C ATOM 1417 O GLY A 807 -9.745 -4.274 -8.613 1.00 0.00 O ATOM 0 H GLY A 807 -11.823 -6.658 -7.683 1.00 0.00 H new ATOM 0 HA2 GLY A 807 -9.076 -6.971 -6.915 1.00 0.00 H new ATOM 0 HA3 GLY A 807 -9.753 -6.954 -8.532 1.00 0.00 H new ATOM 1421 N LEU A 808 -8.206 -4.662 -7.023 1.00 0.00 N ATOM 1422 CA LEU A 808 -7.690 -3.305 -7.027 1.00 0.00 C ATOM 1423 C LEU A 808 -6.777 -3.031 -8.205 1.00 0.00 C ATOM 1424 O LEU A 808 -5.884 -3.818 -8.518 1.00 0.00 O ATOM 1425 CB LEU A 808 -6.949 -3.027 -5.726 1.00 0.00 C ATOM 1426 CG LEU A 808 -7.832 -2.962 -4.490 1.00 0.00 C ATOM 1427 CD1 LEU A 808 -7.034 -2.480 -3.295 1.00 0.00 C ATOM 1428 CD2 LEU A 808 -9.028 -2.076 -4.750 1.00 0.00 C ATOM 0 H LEU A 808 -7.715 -5.297 -6.393 1.00 0.00 H new ATOM 0 HA LEU A 808 -8.547 -2.638 -7.120 1.00 0.00 H new ATOM 0 HB2 LEU A 808 -6.199 -3.804 -5.579 1.00 0.00 H new ATOM 0 HB3 LEU A 808 -6.415 -2.082 -5.824 1.00 0.00 H new ATOM 0 HG LEU A 808 -8.199 -3.963 -4.262 1.00 0.00 H new ATOM 0 HD11 LEU A 808 -7.680 -2.439 -2.418 1.00 0.00 H new ATOM 0 HD12 LEU A 808 -6.210 -3.168 -3.106 1.00 0.00 H new ATOM 0 HD13 LEU A 808 -6.637 -1.486 -3.500 1.00 0.00 H new ATOM 0 HD21 LEU A 808 -9.653 -2.037 -3.858 1.00 0.00 H new ATOM 0 HD22 LEU A 808 -8.689 -1.071 -4.999 1.00 0.00 H new ATOM 0 HD23 LEU A 808 -9.606 -2.480 -5.581 1.00 0.00 H new ATOM 1440 N SER A 809 -7.029 -1.915 -8.866 1.00 0.00 N ATOM 1441 CA SER A 809 -6.142 -1.411 -9.895 1.00 0.00 C ATOM 1442 C SER A 809 -6.114 0.115 -9.842 1.00 0.00 C ATOM 1443 O SER A 809 -6.869 0.795 -10.543 1.00 0.00 O ATOM 1444 CB SER A 809 -6.608 -1.893 -11.271 1.00 0.00 C ATOM 1445 OG SER A 809 -6.733 -3.308 -11.293 1.00 0.00 O ATOM 0 H SER A 809 -7.852 -1.335 -8.704 1.00 0.00 H new ATOM 0 HA SER A 809 -5.134 -1.789 -9.722 1.00 0.00 H new ATOM 0 HB2 SER A 809 -7.566 -1.435 -11.517 1.00 0.00 H new ATOM 0 HB3 SER A 809 -5.897 -1.574 -12.033 1.00 0.00 H new ATOM 0 HG SER A 809 -7.033 -3.596 -12.180 1.00 0.00 H new ATOM 1451 N GLN A 810 -5.249 0.639 -8.987 1.00 0.00 N ATOM 1452 CA GLN A 810 -5.056 2.077 -8.849 1.00 0.00 C ATOM 1453 C GLN A 810 -3.581 2.364 -8.504 1.00 0.00 C ATOM 1454 O GLN A 810 -2.822 1.416 -8.304 1.00 0.00 O ATOM 1455 CB GLN A 810 -6.033 2.646 -7.806 1.00 0.00 C ATOM 1456 CG GLN A 810 -7.004 3.665 -8.399 1.00 0.00 C ATOM 1457 CD GLN A 810 -7.886 4.335 -7.365 1.00 0.00 C ATOM 1458 OE1 GLN A 810 -7.502 5.330 -6.754 1.00 0.00 O ATOM 1459 NE2 GLN A 810 -9.092 3.825 -7.197 1.00 0.00 N ATOM 0 H GLN A 810 -4.660 0.081 -8.369 1.00 0.00 H new ATOM 0 HA GLN A 810 -5.277 2.579 -9.791 1.00 0.00 H new ATOM 0 HB2 GLN A 810 -6.599 1.828 -7.361 1.00 0.00 H new ATOM 0 HB3 GLN A 810 -5.466 3.116 -7.002 1.00 0.00 H new ATOM 0 HG2 GLN A 810 -6.436 4.429 -8.930 1.00 0.00 H new ATOM 0 HG3 GLN A 810 -7.635 3.167 -9.135 1.00 0.00 H new ATOM 0 HE21 GLN A 810 -9.374 2.998 -7.723 1.00 0.00 H new ATOM 0 HE22 GLN A 810 -9.742 4.258 -6.541 1.00 0.00 H new ATOM 1468 N PRO A 811 -3.152 3.652 -8.453 1.00 0.00 N ATOM 1469 CA PRO A 811 -1.736 4.041 -8.270 1.00 0.00 C ATOM 1470 C PRO A 811 -0.950 3.267 -7.199 1.00 0.00 C ATOM 1471 O PRO A 811 -1.501 2.750 -6.224 1.00 0.00 O ATOM 1472 CB PRO A 811 -1.843 5.505 -7.860 1.00 0.00 C ATOM 1473 CG PRO A 811 -3.046 6.002 -8.572 1.00 0.00 C ATOM 1474 CD PRO A 811 -4.006 4.847 -8.622 1.00 0.00 C ATOM 0 HA PRO A 811 -1.177 3.831 -9.182 1.00 0.00 H new ATOM 0 HB2 PRO A 811 -1.950 5.608 -6.780 1.00 0.00 H new ATOM 0 HB3 PRO A 811 -0.952 6.064 -8.147 1.00 0.00 H new ATOM 0 HG2 PRO A 811 -3.485 6.852 -8.049 1.00 0.00 H new ATOM 0 HG3 PRO A 811 -2.792 6.342 -9.576 1.00 0.00 H new ATOM 0 HD2 PRO A 811 -4.753 4.917 -7.831 1.00 0.00 H new ATOM 0 HD3 PRO A 811 -4.545 4.819 -9.569 1.00 0.00 H new ATOM 1482 N ASP A 812 0.362 3.239 -7.412 1.00 0.00 N ATOM 1483 CA ASP A 812 1.323 2.547 -6.552 1.00 0.00 C ATOM 1484 C ASP A 812 2.482 3.481 -6.225 1.00 0.00 C ATOM 1485 O ASP A 812 2.620 4.546 -6.832 1.00 0.00 O ATOM 1486 CB ASP A 812 1.871 1.297 -7.241 1.00 0.00 C ATOM 1487 CG ASP A 812 2.382 1.574 -8.642 1.00 0.00 C ATOM 1488 OD1 ASP A 812 1.576 1.527 -9.594 1.00 0.00 O ATOM 1489 OD2 ASP A 812 3.592 1.839 -8.803 1.00 0.00 O ATOM 0 H ASP A 812 0.799 3.707 -8.206 1.00 0.00 H new ATOM 0 HA ASP A 812 0.810 2.249 -5.638 1.00 0.00 H new ATOM 0 HB2 ASP A 812 2.680 0.881 -6.640 1.00 0.00 H new ATOM 0 HB3 ASP A 812 1.088 0.541 -7.288 1.00 0.00 H new ATOM 1494 N ALA A 813 3.302 3.092 -5.264 1.00 0.00 N ATOM 1495 CA ALA A 813 4.463 3.894 -4.880 1.00 0.00 C ATOM 1496 C ALA A 813 5.722 3.048 -4.896 1.00 0.00 C ATOM 1497 O ALA A 813 5.679 1.854 -4.617 1.00 0.00 O ATOM 1498 CB ALA A 813 4.282 4.518 -3.510 1.00 0.00 C ATOM 0 H ALA A 813 3.190 2.228 -4.733 1.00 0.00 H new ATOM 0 HA ALA A 813 4.559 4.698 -5.610 1.00 0.00 H new ATOM 0 HB1 ALA A 813 5.165 5.106 -3.259 1.00 0.00 H new ATOM 0 HB2 ALA A 813 3.405 5.165 -3.518 1.00 0.00 H new ATOM 0 HB3 ALA A 813 4.146 3.732 -2.767 1.00 0.00 H new ATOM 1504 N LYS A 814 6.840 3.670 -5.204 1.00 0.00 N ATOM 1505 CA LYS A 814 8.092 2.959 -5.331 1.00 0.00 C ATOM 1506 C LYS A 814 9.034 3.317 -4.186 1.00 0.00 C ATOM 1507 O LYS A 814 9.500 4.445 -4.078 1.00 0.00 O ATOM 1508 CB LYS A 814 8.721 3.283 -6.684 1.00 0.00 C ATOM 1509 CG LYS A 814 9.860 2.363 -7.059 1.00 0.00 C ATOM 1510 CD LYS A 814 10.191 2.469 -8.540 1.00 0.00 C ATOM 1511 CE LYS A 814 11.425 1.658 -8.897 1.00 0.00 C ATOM 1512 NZ LYS A 814 12.665 2.272 -8.355 1.00 0.00 N ATOM 0 H LYS A 814 6.906 4.674 -5.372 1.00 0.00 H new ATOM 0 HA LYS A 814 7.905 1.886 -5.277 1.00 0.00 H new ATOM 0 HB2 LYS A 814 7.952 3.228 -7.455 1.00 0.00 H new ATOM 0 HB3 LYS A 814 9.085 4.310 -6.669 1.00 0.00 H new ATOM 0 HG2 LYS A 814 10.741 2.613 -6.468 1.00 0.00 H new ATOM 0 HG3 LYS A 814 9.594 1.334 -6.816 1.00 0.00 H new ATOM 0 HD2 LYS A 814 9.343 2.120 -9.129 1.00 0.00 H new ATOM 0 HD3 LYS A 814 10.353 3.514 -8.803 1.00 0.00 H new ATOM 0 HE2 LYS A 814 11.320 0.646 -8.507 1.00 0.00 H new ATOM 0 HE3 LYS A 814 11.504 1.575 -9.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 814 13.356 2.394 -9.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 814 12.441 3.199 -7.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 814 13.067 1.653 -7.622 1.00 0.00 H new ATOM 1526 N ILE A 815 9.298 2.343 -3.336 1.00 0.00 N ATOM 1527 CA ILE A 815 10.147 2.527 -2.171 1.00 0.00 C ATOM 1528 C ILE A 815 11.560 2.031 -2.475 1.00 0.00 C ATOM 1529 O ILE A 815 11.743 0.901 -2.930 1.00 0.00 O ATOM 1530 CB ILE A 815 9.592 1.762 -0.947 1.00 0.00 C ATOM 1531 CG1 ILE A 815 8.185 2.256 -0.579 1.00 0.00 C ATOM 1532 CG2 ILE A 815 10.527 1.901 0.242 1.00 0.00 C ATOM 1533 CD1 ILE A 815 7.061 1.528 -1.291 1.00 0.00 C ATOM 0 H ILE A 815 8.929 1.397 -3.433 1.00 0.00 H new ATOM 0 HA ILE A 815 10.168 3.591 -1.936 1.00 0.00 H new ATOM 0 HB ILE A 815 9.524 0.708 -1.215 1.00 0.00 H new ATOM 0 HG12 ILE A 815 8.046 2.151 0.497 1.00 0.00 H new ATOM 0 HG13 ILE A 815 8.115 3.320 -0.807 1.00 0.00 H new ATOM 0 HG21 ILE A 815 10.118 1.355 1.092 1.00 0.00 H new ATOM 0 HG22 ILE A 815 11.505 1.493 -0.014 1.00 0.00 H new ATOM 0 HG23 ILE A 815 10.630 2.954 0.502 1.00 0.00 H new ATOM 0 HD11 ILE A 815 6.103 1.939 -0.973 1.00 0.00 H new ATOM 0 HD12 ILE A 815 7.171 1.654 -2.368 1.00 0.00 H new ATOM 0 HD13 ILE A 815 7.101 0.467 -1.044 1.00 0.00 H new ATOM 1545 N GLN A 816 12.552 2.873 -2.231 1.00 0.00 N ATOM 1546 CA GLN A 816 13.931 2.521 -2.504 1.00 0.00 C ATOM 1547 C GLN A 816 14.734 2.435 -1.213 1.00 0.00 C ATOM 1548 O GLN A 816 14.990 3.444 -0.566 1.00 0.00 O ATOM 1549 CB GLN A 816 14.557 3.548 -3.445 1.00 0.00 C ATOM 1550 CG GLN A 816 15.974 3.199 -3.864 1.00 0.00 C ATOM 1551 CD GLN A 816 17.027 4.062 -3.192 1.00 0.00 C ATOM 1552 OE1 GLN A 816 17.492 3.638 -2.027 1.00 0.00 O flip ATOM 1553 NE2 GLN A 816 17.414 5.107 -3.715 1.00 0.00 N flip ATOM 0 H GLN A 816 12.424 3.808 -1.843 1.00 0.00 H new ATOM 0 HA GLN A 816 13.947 1.542 -2.983 1.00 0.00 H new ATOM 0 HB2 GLN A 816 13.935 3.640 -4.336 1.00 0.00 H new ATOM 0 HB3 GLN A 816 14.560 4.522 -2.957 1.00 0.00 H new ATOM 0 HG2 GLN A 816 16.168 2.152 -3.629 1.00 0.00 H new ATOM 0 HG3 GLN A 816 16.063 3.305 -4.945 1.00 0.00 H new ATOM 0 HE21 GLN A 816 17.031 5.400 -4.614 1.00 0.00 H new ATOM 0 HE22 GLN A 816 18.118 5.680 -3.249 1.00 0.00 H new ATOM 1562 N VAL A 817 15.125 1.230 -0.849 1.00 0.00 N ATOM 1563 CA VAL A 817 15.981 1.009 0.307 1.00 0.00 C ATOM 1564 C VAL A 817 17.386 0.671 -0.179 1.00 0.00 C ATOM 1565 O VAL A 817 17.543 -0.195 -1.024 1.00 0.00 O ATOM 1566 CB VAL A 817 15.449 -0.161 1.172 1.00 0.00 C ATOM 1567 CG1 VAL A 817 16.318 -0.382 2.403 1.00 0.00 C ATOM 1568 CG2 VAL A 817 14.006 0.086 1.580 1.00 0.00 C ATOM 0 H VAL A 817 14.861 0.377 -1.342 1.00 0.00 H new ATOM 0 HA VAL A 817 15.992 1.913 0.915 1.00 0.00 H new ATOM 0 HB VAL A 817 15.491 -1.065 0.565 1.00 0.00 H new ATOM 0 HG11 VAL A 817 15.917 -1.210 2.988 1.00 0.00 H new ATOM 0 HG12 VAL A 817 17.336 -0.617 2.092 1.00 0.00 H new ATOM 0 HG13 VAL A 817 16.324 0.522 3.011 1.00 0.00 H new ATOM 0 HG21 VAL A 817 13.652 -0.747 2.187 1.00 0.00 H new ATOM 0 HG22 VAL A 817 13.944 1.008 2.158 1.00 0.00 H new ATOM 0 HG23 VAL A 817 13.386 0.175 0.688 1.00 0.00 H new ATOM 1578 N ARG A 818 18.405 1.369 0.306 1.00 0.00 N ATOM 1579 CA ARG A 818 19.783 1.052 -0.079 1.00 0.00 C ATOM 1580 C ARG A 818 20.755 1.352 1.050 1.00 0.00 C ATOM 1581 O ARG A 818 20.572 2.307 1.805 1.00 0.00 O ATOM 1582 CB ARG A 818 20.203 1.815 -1.349 1.00 0.00 C ATOM 1583 CG ARG A 818 19.589 1.272 -2.632 1.00 0.00 C ATOM 1584 CD ARG A 818 20.135 -0.105 -2.965 1.00 0.00 C ATOM 1585 NE ARG A 818 19.305 -0.810 -3.942 1.00 0.00 N ATOM 1586 CZ ARG A 818 19.430 -2.108 -4.220 1.00 0.00 C ATOM 1587 NH1 ARG A 818 20.414 -2.813 -3.679 1.00 0.00 N ATOM 1588 NH2 ARG A 818 18.582 -2.700 -5.050 1.00 0.00 N ATOM 0 H ARG A 818 18.311 2.148 0.958 1.00 0.00 H new ATOM 0 HA ARG A 818 19.816 -0.017 -0.292 1.00 0.00 H new ATOM 0 HB2 ARG A 818 19.923 2.863 -1.240 1.00 0.00 H new ATOM 0 HB3 ARG A 818 21.289 1.783 -1.437 1.00 0.00 H new ATOM 0 HG2 ARG A 818 18.505 1.220 -2.525 1.00 0.00 H new ATOM 0 HG3 ARG A 818 19.796 1.956 -3.455 1.00 0.00 H new ATOM 0 HD2 ARG A 818 21.148 -0.007 -3.355 1.00 0.00 H new ATOM 0 HD3 ARG A 818 20.201 -0.698 -2.053 1.00 0.00 H new ATOM 0 HE ARG A 818 18.590 -0.278 -4.439 1.00 0.00 H new ATOM 0 HH11 ARG A 818 21.077 -2.362 -3.049 1.00 0.00 H new ATOM 0 HH12 ARG A 818 20.508 -3.806 -3.893 1.00 0.00 H new ATOM 0 HH21 ARG A 818 17.829 -2.162 -5.479 1.00 0.00 H new ATOM 0 HH22 ARG A 818 18.682 -3.693 -5.259 1.00 0.00 H new ATOM 1602 N ARG A 819 21.786 0.521 1.168 1.00 0.00 N ATOM 1603 CA ARG A 819 22.818 0.732 2.174 1.00 0.00 C ATOM 1604 C ARG A 819 23.958 1.557 1.599 1.00 0.00 C ATOM 1605 O ARG A 819 24.260 1.470 0.407 1.00 0.00 O ATOM 1606 CB ARG A 819 23.360 -0.586 2.727 1.00 0.00 C ATOM 1607 CG ARG A 819 23.654 -1.635 1.677 1.00 0.00 C ATOM 1608 CD ARG A 819 22.614 -2.733 1.735 1.00 0.00 C ATOM 1609 NE ARG A 819 22.780 -3.590 2.911 1.00 0.00 N ATOM 1610 CZ ARG A 819 22.424 -4.877 2.965 1.00 0.00 C ATOM 1611 NH1 ARG A 819 21.966 -5.491 1.879 1.00 0.00 N ATOM 1612 NH2 ARG A 819 22.558 -5.555 4.099 1.00 0.00 N ATOM 0 H ARG A 819 21.928 -0.301 0.581 1.00 0.00 H new ATOM 0 HA ARG A 819 22.356 1.274 2.999 1.00 0.00 H new ATOM 0 HB2 ARG A 819 24.274 -0.383 3.285 1.00 0.00 H new ATOM 0 HB3 ARG A 819 22.638 -0.992 3.436 1.00 0.00 H new ATOM 0 HG2 ARG A 819 23.658 -1.179 0.687 1.00 0.00 H new ATOM 0 HG3 ARG A 819 24.647 -2.055 1.839 1.00 0.00 H new ATOM 0 HD2 ARG A 819 21.619 -2.288 1.749 1.00 0.00 H new ATOM 0 HD3 ARG A 819 22.679 -3.341 0.832 1.00 0.00 H new ATOM 0 HE ARG A 819 23.196 -3.176 3.746 1.00 0.00 H new ATOM 0 HH11 ARG A 819 21.885 -4.980 1.000 1.00 0.00 H new ATOM 0 HH12 ARG A 819 21.695 -6.473 1.924 1.00 0.00 H new ATOM 0 HH21 ARG A 819 22.932 -5.093 4.928 1.00 0.00 H new ATOM 0 HH22 ARG A 819 22.286 -6.537 4.141 1.00 0.00 H new ATOM 1626 N ASP A 820 24.577 2.364 2.441 1.00 0.00 N ATOM 1627 CA ASP A 820 25.696 3.190 2.031 1.00 0.00 C ATOM 1628 C ASP A 820 26.886 2.943 2.944 1.00 0.00 C ATOM 1629 O ASP A 820 27.995 2.703 2.471 1.00 99.99 O ATOM 1630 CB ASP A 820 25.315 4.677 2.017 1.00 0.00 C ATOM 1631 CG ASP A 820 24.886 5.204 3.371 1.00 0.00 C ATOM 1632 OD1 ASP A 820 25.683 5.910 4.026 1.00 0.00 O ATOM 1633 OD2 ASP A 820 23.740 4.930 3.782 1.00 0.00 O ATOM 0 H ASP A 820 24.320 2.465 3.423 1.00 0.00 H new ATOM 0 HA ASP A 820 25.972 2.915 1.013 1.00 0.00 H new ATOM 0 HB2 ASP A 820 26.166 5.259 1.663 1.00 0.00 H new ATOM 0 HB3 ASP A 820 24.505 4.830 1.303 1.00 0.00 H new TER 1638 ASP A 820