USER MOD reduce.3.24.130724 H: found=0, std=0, add=612, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 613 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 Single : A 688 SER OG : rot 130:sc= -0.127 USER MOD Single : A 699 LYS NZ :NH3+ 173:sc= 0.133 (180deg=-0.00788) USER MOD Single : A 704 TYR OH : rot 131:sc= -1.06 USER MOD Single : A 709 SER OG : rot 180:sc= -0.0809 USER MOD Single : A 711 ASN : amide:sc= -0.135 K(o=-0.13,f=-1) USER MOD Single : A 714 SER OG : rot -18:sc= 0.128 USER MOD Single : A 715 ASN : amide:sc= -0.748 X(o=-0.75,f=-0.33) USER MOD Single : A 718 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 721 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 723 ASN : amide:sc= -2.24 X(o=-2.2,f=-2.7!) USER MOD Single : A 728 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 735 MET CE :methyl -169:sc= -3.42! (180deg=-3.59!) USER MOD Single : A 736 LYS NZ :NH3+ 143:sc= -6.32! (180deg=-7.64!) USER MOD Single : A 738 LYS NZ :NH3+ -169:sc= -0.337 (180deg=-0.688) USER MOD Single : A 741 SER OG : rot 104:sc= -0.562 USER MOD Single : A 742 SER OG : rot 180:sc= 0 USER MOD Single : A 745 THR OG1 : rot 180:sc= 0 USER MOD Single : A 747 SER OG : rot 20:sc= 1.38 USER MOD Single : A 748 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 749 THR OG1 : rot -35:sc= 1.1 USER MOD Single : A 751 THR OG1 : rot 180:sc= 0 USER MOD Single : A 752 LYS NZ :NH3+ -164:sc= -0.0859 (180deg=-0.343) USER MOD Single : A 756 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 759 ASN : amide:sc= -0.545 K(o=-0.54,f=-3.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 685 -8.082 5.959 -6.629 1.00 0.00 N ATOM 2 CA GLY A 685 -7.853 4.800 -7.532 1.00 0.00 C ATOM 3 C GLY A 685 -6.872 5.115 -8.642 1.00 0.00 C ATOM 4 O GLY A 685 -6.366 6.235 -8.727 1.00 0.00 O ATOM 0 HA2 GLY A 685 -7.479 3.958 -6.949 1.00 0.00 H new ATOM 0 HA3 GLY A 685 -8.803 4.490 -7.968 1.00 0.00 H new ATOM 8 N VAL A 686 -6.597 4.119 -9.488 1.00 0.00 N ATOM 9 CA VAL A 686 -5.672 4.278 -10.607 1.00 0.00 C ATOM 10 C VAL A 686 -4.224 4.450 -10.137 1.00 0.00 C ATOM 11 O VAL A 686 -3.281 4.222 -10.897 1.00 0.00 O ATOM 12 CB VAL A 686 -6.092 5.469 -11.490 1.00 0.00 C ATOM 13 CG1 VAL A 686 -4.991 5.857 -12.465 1.00 0.00 C ATOM 14 CG2 VAL A 686 -7.377 5.138 -12.231 1.00 0.00 C ATOM 0 H VAL A 686 -7.007 3.188 -9.416 1.00 0.00 H new ATOM 0 HA VAL A 686 -5.718 3.362 -11.197 1.00 0.00 H new ATOM 0 HB VAL A 686 -6.268 6.327 -10.842 1.00 0.00 H new ATOM 0 HG11 VAL A 686 -5.322 6.700 -13.071 1.00 0.00 H new ATOM 0 HG12 VAL A 686 -4.096 6.139 -11.910 1.00 0.00 H new ATOM 0 HG13 VAL A 686 -4.764 5.011 -13.114 1.00 0.00 H new ATOM 0 HG21 VAL A 686 -7.667 5.985 -12.853 1.00 0.00 H new ATOM 0 HG22 VAL A 686 -7.219 4.263 -12.861 1.00 0.00 H new ATOM 0 HG23 VAL A 686 -8.168 4.929 -11.511 1.00 0.00 H new ATOM 24 N GLU A 687 -4.055 4.834 -8.879 1.00 0.00 N ATOM 25 CA GLU A 687 -2.726 5.036 -8.310 1.00 0.00 C ATOM 26 C GLU A 687 -1.894 3.759 -8.377 1.00 0.00 C ATOM 27 O GLU A 687 -0.675 3.799 -8.252 1.00 0.00 O ATOM 28 CB GLU A 687 -2.833 5.513 -6.863 1.00 0.00 C ATOM 29 CG GLU A 687 -3.936 4.824 -6.083 1.00 0.00 C ATOM 30 CD GLU A 687 -3.821 5.038 -4.588 1.00 0.00 C ATOM 31 OE1 GLU A 687 -3.039 4.309 -3.942 1.00 0.00 O ATOM 32 OE2 GLU A 687 -4.512 5.935 -4.062 1.00 0.00 O ATOM 0 H GLU A 687 -4.822 5.013 -8.231 1.00 0.00 H new ATOM 0 HA GLU A 687 -2.224 5.801 -8.903 1.00 0.00 H new ATOM 0 HB2 GLU A 687 -1.881 5.342 -6.360 1.00 0.00 H new ATOM 0 HB3 GLU A 687 -3.009 6.589 -6.855 1.00 0.00 H new ATOM 0 HG2 GLU A 687 -4.902 5.195 -6.425 1.00 0.00 H new ATOM 0 HG3 GLU A 687 -3.911 3.755 -6.295 1.00 0.00 H new ATOM 39 N SER A 688 -2.556 2.625 -8.572 1.00 0.00 N ATOM 40 CA SER A 688 -1.859 1.348 -8.656 1.00 0.00 C ATOM 41 C SER A 688 -1.069 1.247 -9.957 1.00 0.00 C ATOM 42 O SER A 688 0.068 0.771 -9.970 1.00 0.00 O ATOM 43 CB SER A 688 -2.849 0.190 -8.560 1.00 0.00 C ATOM 44 OG SER A 688 -3.816 0.254 -9.593 1.00 0.00 O ATOM 0 H SER A 688 -3.569 2.563 -8.674 1.00 0.00 H new ATOM 0 HA SER A 688 -1.163 1.289 -7.819 1.00 0.00 H new ATOM 0 HB2 SER A 688 -2.312 -0.757 -8.620 1.00 0.00 H new ATOM 0 HB3 SER A 688 -3.347 0.214 -7.591 1.00 0.00 H new ATOM 0 HG SER A 688 -3.876 -0.616 -10.040 1.00 0.00 H new ATOM 50 N ALA A 689 -1.682 1.699 -11.050 1.00 0.00 N ATOM 51 CA ALA A 689 -1.043 1.663 -12.361 1.00 0.00 C ATOM 52 C ALA A 689 0.261 2.452 -12.358 1.00 0.00 C ATOM 53 O ALA A 689 1.322 1.914 -12.672 1.00 0.00 O ATOM 54 CB ALA A 689 -1.989 2.206 -13.422 1.00 0.00 C ATOM 0 H ALA A 689 -2.622 2.095 -11.052 1.00 0.00 H new ATOM 0 HA ALA A 689 -0.807 0.625 -12.596 1.00 0.00 H new ATOM 0 HB1 ALA A 689 -1.500 2.174 -14.396 1.00 0.00 H new ATOM 0 HB2 ALA A 689 -2.893 1.598 -13.449 1.00 0.00 H new ATOM 0 HB3 ALA A 689 -2.252 3.236 -13.182 1.00 0.00 H new ATOM 60 N VAL A 690 0.170 3.732 -12.005 1.00 0.00 N ATOM 61 CA VAL A 690 1.342 4.599 -11.958 1.00 0.00 C ATOM 62 C VAL A 690 2.413 4.021 -11.045 1.00 0.00 C ATOM 63 O VAL A 690 3.590 3.969 -11.400 1.00 0.00 O ATOM 64 CB VAL A 690 0.980 6.008 -11.452 1.00 0.00 C ATOM 65 CG1 VAL A 690 0.145 6.749 -12.483 1.00 0.00 C ATOM 66 CG2 VAL A 690 0.246 5.926 -10.123 1.00 0.00 C ATOM 0 H VAL A 690 -0.704 4.191 -11.747 1.00 0.00 H new ATOM 0 HA VAL A 690 1.722 4.667 -12.977 1.00 0.00 H new ATOM 0 HB VAL A 690 1.904 6.566 -11.298 1.00 0.00 H new ATOM 0 HG11 VAL A 690 -0.100 7.742 -12.107 1.00 0.00 H new ATOM 0 HG12 VAL A 690 0.710 6.842 -13.410 1.00 0.00 H new ATOM 0 HG13 VAL A 690 -0.775 6.195 -12.672 1.00 0.00 H new ATOM 0 HG21 VAL A 690 -0.001 6.931 -9.781 1.00 0.00 H new ATOM 0 HG22 VAL A 690 -0.670 5.349 -10.248 1.00 0.00 H new ATOM 0 HG23 VAL A 690 0.883 5.439 -9.385 1.00 0.00 H new ATOM 76 N LEU A 691 1.986 3.598 -9.864 1.00 0.00 N ATOM 77 CA LEU A 691 2.883 3.024 -8.873 1.00 0.00 C ATOM 78 C LEU A 691 3.590 1.778 -9.408 1.00 0.00 C ATOM 79 O LEU A 691 4.553 1.888 -10.167 1.00 0.00 O ATOM 80 CB LEU A 691 2.106 2.705 -7.600 1.00 0.00 C ATOM 81 CG LEU A 691 2.162 3.770 -6.499 1.00 0.00 C ATOM 82 CD1 LEU A 691 1.685 5.121 -7.013 1.00 0.00 C ATOM 83 CD2 LEU A 691 1.325 3.332 -5.308 1.00 0.00 C ATOM 0 H LEU A 691 1.011 3.643 -9.567 1.00 0.00 H new ATOM 0 HA LEU A 691 3.656 3.757 -8.644 1.00 0.00 H new ATOM 0 HB2 LEU A 691 1.062 2.539 -7.866 1.00 0.00 H new ATOM 0 HB3 LEU A 691 2.484 1.767 -7.192 1.00 0.00 H new ATOM 0 HG LEU A 691 3.200 3.880 -6.185 1.00 0.00 H new ATOM 0 HD11 LEU A 691 1.737 5.855 -6.209 1.00 0.00 H new ATOM 0 HD12 LEU A 691 2.321 5.441 -7.838 1.00 0.00 H new ATOM 0 HD13 LEU A 691 0.655 5.035 -7.360 1.00 0.00 H new ATOM 0 HD21 LEU A 691 1.371 4.095 -4.531 1.00 0.00 H new ATOM 0 HD22 LEU A 691 0.290 3.195 -5.621 1.00 0.00 H new ATOM 0 HD23 LEU A 691 1.713 2.392 -4.917 1.00 0.00 H new ATOM 95 N ARG A 692 3.107 0.597 -9.021 1.00 0.00 N ATOM 96 CA ARG A 692 3.712 -0.659 -9.460 1.00 0.00 C ATOM 97 C ARG A 692 2.985 -1.869 -8.882 1.00 0.00 C ATOM 98 O ARG A 692 3.403 -2.432 -7.869 1.00 0.00 O ATOM 99 CB ARG A 692 5.178 -0.715 -9.071 1.00 0.00 C ATOM 100 CG ARG A 692 6.018 -1.423 -10.113 1.00 0.00 C ATOM 101 CD ARG A 692 6.080 -0.643 -11.417 1.00 0.00 C ATOM 102 NE ARG A 692 6.921 -1.309 -12.409 1.00 0.00 N ATOM 103 CZ ARG A 692 7.277 -0.755 -13.564 1.00 0.00 C ATOM 104 NH1 ARG A 692 6.867 0.468 -13.872 1.00 0.00 N ATOM 105 NH2 ARG A 692 8.044 -1.426 -14.413 1.00 0.00 N ATOM 0 H ARG A 692 2.301 0.485 -8.406 1.00 0.00 H new ATOM 0 HA ARG A 692 3.625 -0.693 -10.546 1.00 0.00 H new ATOM 0 HB2 ARG A 692 5.554 0.298 -8.930 1.00 0.00 H new ATOM 0 HB3 ARG A 692 5.279 -1.228 -8.115 1.00 0.00 H new ATOM 0 HG2 ARG A 692 7.028 -1.568 -9.728 1.00 0.00 H new ATOM 0 HG3 ARG A 692 5.604 -2.413 -10.302 1.00 0.00 H new ATOM 0 HD2 ARG A 692 5.073 -0.522 -11.816 1.00 0.00 H new ATOM 0 HD3 ARG A 692 6.468 0.357 -11.224 1.00 0.00 H new ATOM 0 HE ARG A 692 7.253 -2.251 -12.204 1.00 0.00 H new ATOM 0 HH11 ARG A 692 6.277 0.987 -13.222 1.00 0.00 H new ATOM 0 HH12 ARG A 692 7.142 0.890 -14.759 1.00 0.00 H new ATOM 0 HH21 ARG A 692 8.361 -2.367 -14.180 1.00 0.00 H new ATOM 0 HH22 ARG A 692 8.317 -1.001 -15.299 1.00 0.00 H new ATOM 119 N GLY A 693 1.894 -2.262 -9.530 1.00 0.00 N ATOM 120 CA GLY A 693 1.132 -3.413 -9.080 1.00 0.00 C ATOM 121 C GLY A 693 0.644 -3.295 -7.647 1.00 0.00 C ATOM 122 O GLY A 693 0.577 -4.293 -6.931 1.00 0.00 O ATOM 0 H GLY A 693 1.522 -1.803 -10.361 1.00 0.00 H new ATOM 0 HA2 GLY A 693 0.273 -3.550 -9.737 1.00 0.00 H new ATOM 0 HA3 GLY A 693 1.750 -4.306 -9.172 1.00 0.00 H new ATOM 126 N PHE A 694 0.307 -2.080 -7.220 1.00 0.00 N ATOM 127 CA PHE A 694 -0.189 -1.864 -5.864 1.00 0.00 C ATOM 128 C PHE A 694 -1.710 -1.983 -5.821 1.00 0.00 C ATOM 129 O PHE A 694 -2.359 -2.156 -6.850 1.00 0.00 O ATOM 130 CB PHE A 694 0.231 -0.489 -5.341 1.00 0.00 C ATOM 131 CG PHE A 694 1.686 -0.387 -4.988 1.00 0.00 C ATOM 132 CD1 PHE A 694 2.621 -0.069 -5.953 1.00 0.00 C ATOM 133 CD2 PHE A 694 2.118 -0.596 -3.689 1.00 0.00 C ATOM 134 CE1 PHE A 694 3.959 0.041 -5.636 1.00 0.00 C ATOM 135 CE2 PHE A 694 3.457 -0.491 -3.367 1.00 0.00 C ATOM 136 CZ PHE A 694 4.376 -0.172 -4.341 1.00 0.00 C ATOM 0 H PHE A 694 0.368 -1.236 -7.789 1.00 0.00 H new ATOM 0 HA PHE A 694 0.248 -2.632 -5.226 1.00 0.00 H new ATOM 0 HB2 PHE A 694 -0.002 0.262 -6.096 1.00 0.00 H new ATOM 0 HB3 PHE A 694 -0.364 -0.250 -4.459 1.00 0.00 H new ATOM 0 HD1 PHE A 694 2.300 0.096 -6.971 1.00 0.00 H new ATOM 0 HD2 PHE A 694 1.401 -0.844 -2.920 1.00 0.00 H new ATOM 0 HE1 PHE A 694 4.678 0.294 -6.402 1.00 0.00 H new ATOM 0 HE2 PHE A 694 3.783 -0.659 -2.351 1.00 0.00 H new ATOM 0 HZ PHE A 694 5.423 -0.089 -4.090 1.00 0.00 H new ATOM 146 N LEU A 695 -2.267 -1.904 -4.617 1.00 0.00 N ATOM 147 CA LEU A 695 -3.712 -1.985 -4.432 1.00 0.00 C ATOM 148 C LEU A 695 -4.246 -0.669 -3.897 1.00 0.00 C ATOM 149 O LEU A 695 -3.491 0.142 -3.366 1.00 0.00 O ATOM 150 CB LEU A 695 -4.074 -3.110 -3.466 1.00 0.00 C ATOM 151 CG LEU A 695 -4.509 -4.422 -4.118 1.00 0.00 C ATOM 152 CD1 LEU A 695 -4.839 -5.456 -3.055 1.00 0.00 C ATOM 153 CD2 LEU A 695 -5.704 -4.197 -5.031 1.00 0.00 C ATOM 0 H LEU A 695 -1.739 -1.784 -3.753 1.00 0.00 H new ATOM 0 HA LEU A 695 -4.165 -2.194 -5.401 1.00 0.00 H new ATOM 0 HB2 LEU A 695 -3.213 -3.309 -2.829 1.00 0.00 H new ATOM 0 HB3 LEU A 695 -4.878 -2.763 -2.817 1.00 0.00 H new ATOM 0 HG LEU A 695 -3.683 -4.797 -4.723 1.00 0.00 H new ATOM 0 HD11 LEU A 695 -5.147 -6.385 -3.534 1.00 0.00 H new ATOM 0 HD12 LEU A 695 -3.958 -5.640 -2.440 1.00 0.00 H new ATOM 0 HD13 LEU A 695 -5.649 -5.086 -2.427 1.00 0.00 H new ATOM 0 HD21 LEU A 695 -5.998 -5.143 -5.485 1.00 0.00 H new ATOM 0 HD22 LEU A 695 -6.536 -3.799 -4.450 1.00 0.00 H new ATOM 0 HD23 LEU A 695 -5.436 -3.487 -5.813 1.00 0.00 H new ATOM 165 N ILE A 696 -5.550 -0.467 -4.017 1.00 0.00 N ATOM 166 CA ILE A 696 -6.160 0.767 -3.550 1.00 0.00 C ATOM 167 C ILE A 696 -6.607 0.662 -2.098 1.00 0.00 C ATOM 168 O ILE A 696 -7.648 0.075 -1.800 1.00 0.00 O ATOM 169 CB ILE A 696 -7.374 1.148 -4.420 1.00 0.00 C ATOM 170 CG1 ILE A 696 -6.978 1.205 -5.896 1.00 0.00 C ATOM 171 CG2 ILE A 696 -7.958 2.476 -3.969 1.00 0.00 C ATOM 172 CD1 ILE A 696 -5.838 2.157 -6.182 1.00 0.00 C ATOM 0 H ILE A 696 -6.200 -1.136 -4.430 1.00 0.00 H new ATOM 0 HA ILE A 696 -5.397 1.541 -3.628 1.00 0.00 H new ATOM 0 HB ILE A 696 -8.139 0.381 -4.300 1.00 0.00 H new ATOM 0 HG12 ILE A 696 -6.697 0.205 -6.227 1.00 0.00 H new ATOM 0 HG13 ILE A 696 -7.845 1.503 -6.485 1.00 0.00 H new ATOM 0 HG21 ILE A 696 -8.814 2.728 -4.595 1.00 0.00 H new ATOM 0 HG22 ILE A 696 -8.278 2.398 -2.930 1.00 0.00 H new ATOM 0 HG23 ILE A 696 -7.201 3.255 -4.058 1.00 0.00 H new ATOM 0 HD11 ILE A 696 -5.612 2.145 -7.248 1.00 0.00 H new ATOM 0 HD12 ILE A 696 -6.123 3.166 -5.883 1.00 0.00 H new ATOM 0 HD13 ILE A 696 -4.956 1.848 -5.621 1.00 0.00 H new ATOM 184 N LEU A 697 -5.827 1.257 -1.200 1.00 0.00 N ATOM 185 CA LEU A 697 -6.150 1.246 0.218 1.00 0.00 C ATOM 186 C LEU A 697 -6.986 2.474 0.553 1.00 0.00 C ATOM 187 O LEU A 697 -8.201 2.472 0.361 1.00 0.00 O ATOM 188 CB LEU A 697 -4.868 1.197 1.062 1.00 0.00 C ATOM 189 CG LEU A 697 -5.011 0.625 2.477 1.00 0.00 C ATOM 190 CD1 LEU A 697 -5.796 1.575 3.362 1.00 0.00 C ATOM 191 CD2 LEU A 697 -5.671 -0.746 2.442 1.00 0.00 C ATOM 0 H LEU A 697 -4.966 1.753 -1.432 1.00 0.00 H new ATOM 0 HA LEU A 697 -6.730 0.353 0.452 1.00 0.00 H new ATOM 0 HB2 LEU A 697 -4.127 0.604 0.526 1.00 0.00 H new ATOM 0 HB3 LEU A 697 -4.470 2.209 1.140 1.00 0.00 H new ATOM 0 HG LEU A 697 -4.013 0.510 2.899 1.00 0.00 H new ATOM 0 HD11 LEU A 697 -5.886 1.150 4.362 1.00 0.00 H new ATOM 0 HD12 LEU A 697 -5.277 2.532 3.420 1.00 0.00 H new ATOM 0 HD13 LEU A 697 -6.790 1.727 2.941 1.00 0.00 H new ATOM 0 HD21 LEU A 697 -5.762 -1.132 3.457 1.00 0.00 H new ATOM 0 HD22 LEU A 697 -6.662 -0.662 1.996 1.00 0.00 H new ATOM 0 HD23 LEU A 697 -5.062 -1.428 1.848 1.00 0.00 H new ATOM 203 N GLY A 698 -6.340 3.526 1.039 1.00 0.00 N ATOM 204 CA GLY A 698 -7.075 4.739 1.355 1.00 0.00 C ATOM 205 C GLY A 698 -6.284 5.749 2.163 1.00 0.00 C ATOM 206 O GLY A 698 -5.081 5.604 2.351 1.00 0.00 O ATOM 0 H GLY A 698 -5.337 3.564 1.218 1.00 0.00 H new ATOM 0 HA2 GLY A 698 -7.399 5.207 0.426 1.00 0.00 H new ATOM 0 HA3 GLY A 698 -7.975 4.472 1.908 1.00 0.00 H new ATOM 210 N LYS A 699 -6.981 6.782 2.634 1.00 0.00 N ATOM 211 CA LYS A 699 -6.367 7.842 3.432 1.00 0.00 C ATOM 212 C LYS A 699 -6.640 7.621 4.914 1.00 0.00 C ATOM 213 O LYS A 699 -7.410 8.351 5.541 1.00 0.00 O ATOM 214 CB LYS A 699 -6.892 9.211 2.991 1.00 0.00 C ATOM 215 CG LYS A 699 -8.381 9.216 2.675 1.00 0.00 C ATOM 216 CD LYS A 699 -8.845 10.570 2.161 1.00 0.00 C ATOM 217 CE LYS A 699 -8.183 10.926 0.838 1.00 0.00 C ATOM 218 NZ LYS A 699 -8.472 9.914 -0.214 1.00 0.00 N ATOM 0 H LYS A 699 -7.981 6.908 2.475 1.00 0.00 H new ATOM 0 HA LYS A 699 -5.289 7.815 3.273 1.00 0.00 H new ATOM 0 HB2 LYS A 699 -6.693 9.939 3.778 1.00 0.00 H new ATOM 0 HB3 LYS A 699 -6.340 9.536 2.109 1.00 0.00 H new ATOM 0 HG2 LYS A 699 -8.597 8.451 1.929 1.00 0.00 H new ATOM 0 HG3 LYS A 699 -8.944 8.955 3.571 1.00 0.00 H new ATOM 0 HD2 LYS A 699 -9.928 10.560 2.035 1.00 0.00 H new ATOM 0 HD3 LYS A 699 -8.617 11.338 2.900 1.00 0.00 H new ATOM 0 HE2 LYS A 699 -8.533 11.904 0.508 1.00 0.00 H new ATOM 0 HE3 LYS A 699 -7.105 11.005 0.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 699 -8.105 10.249 -1.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 699 -8.013 9.014 0.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 699 -9.500 9.771 -0.285 1.00 0.00 H new ATOM 232 N GLU A 700 -6.003 6.596 5.456 1.00 0.00 N ATOM 233 CA GLU A 700 -6.154 6.229 6.855 1.00 0.00 C ATOM 234 C GLU A 700 -4.925 5.474 7.320 1.00 0.00 C ATOM 235 O GLU A 700 -3.892 5.513 6.668 1.00 0.00 O ATOM 236 CB GLU A 700 -7.398 5.371 7.063 1.00 0.00 C ATOM 237 CG GLU A 700 -7.433 4.134 6.180 1.00 0.00 C ATOM 238 CD GLU A 700 -8.599 3.222 6.503 1.00 0.00 C ATOM 239 OE1 GLU A 700 -8.448 2.357 7.391 1.00 0.00 O ATOM 240 OE2 GLU A 700 -9.664 3.373 5.868 1.00 0.00 O ATOM 0 H GLU A 700 -5.365 5.993 4.937 1.00 0.00 H new ATOM 0 HA GLU A 700 -6.266 7.141 7.441 1.00 0.00 H new ATOM 0 HB2 GLU A 700 -7.448 5.064 8.108 1.00 0.00 H new ATOM 0 HB3 GLU A 700 -8.284 5.975 6.865 1.00 0.00 H new ATOM 0 HG2 GLU A 700 -7.493 4.439 5.135 1.00 0.00 H new ATOM 0 HG3 GLU A 700 -6.501 3.582 6.297 1.00 0.00 H new ATOM 247 N ASP A 701 -5.011 4.846 8.480 1.00 0.00 N ATOM 248 CA ASP A 701 -3.891 4.065 8.985 1.00 0.00 C ATOM 249 C ASP A 701 -2.624 4.916 9.009 1.00 0.00 C ATOM 250 O ASP A 701 -1.562 4.494 8.553 1.00 0.00 O ATOM 251 CB ASP A 701 -3.704 2.827 8.099 1.00 0.00 C ATOM 252 CG ASP A 701 -2.823 1.771 8.737 1.00 0.00 C ATOM 253 OD1 ASP A 701 -1.822 2.141 9.382 1.00 0.00 O ATOM 254 OD2 ASP A 701 -3.139 0.572 8.595 1.00 0.00 O ATOM 0 H ASP A 701 -5.833 4.859 9.084 1.00 0.00 H new ATOM 0 HA ASP A 701 -4.096 3.743 10.006 1.00 0.00 H new ATOM 0 HB2 ASP A 701 -4.680 2.394 7.878 1.00 0.00 H new ATOM 0 HB3 ASP A 701 -3.267 3.130 7.147 1.00 0.00 H new ATOM 259 N ARG A 702 -2.755 6.124 9.545 1.00 0.00 N ATOM 260 CA ARG A 702 -1.636 7.051 9.633 1.00 0.00 C ATOM 261 C ARG A 702 -0.595 6.558 10.633 1.00 0.00 C ATOM 262 O ARG A 702 0.491 7.126 10.740 1.00 0.00 O ATOM 263 CB ARG A 702 -2.130 8.445 10.032 1.00 0.00 C ATOM 264 CG ARG A 702 -3.049 9.089 9.000 1.00 0.00 C ATOM 265 CD ARG A 702 -4.477 8.571 9.109 1.00 0.00 C ATOM 266 NE ARG A 702 -5.063 8.853 10.417 1.00 0.00 N ATOM 267 CZ ARG A 702 -6.350 8.676 10.704 1.00 0.00 C ATOM 268 NH1 ARG A 702 -7.183 8.217 9.778 1.00 0.00 N ATOM 269 NH2 ARG A 702 -6.805 8.956 11.916 1.00 0.00 N ATOM 0 H ARG A 702 -3.630 6.484 9.926 1.00 0.00 H new ATOM 0 HA ARG A 702 -1.167 7.108 8.651 1.00 0.00 H new ATOM 0 HB2 ARG A 702 -2.659 8.375 10.983 1.00 0.00 H new ATOM 0 HB3 ARG A 702 -1.269 9.093 10.193 1.00 0.00 H new ATOM 0 HG2 ARG A 702 -3.044 10.171 9.134 1.00 0.00 H new ATOM 0 HG3 ARG A 702 -2.666 8.890 7.999 1.00 0.00 H new ATOM 0 HD2 ARG A 702 -5.089 9.028 8.331 1.00 0.00 H new ATOM 0 HD3 ARG A 702 -4.487 7.496 8.931 1.00 0.00 H new ATOM 0 HE ARG A 702 -4.450 9.206 11.152 1.00 0.00 H new ATOM 0 HH11 ARG A 702 -6.837 7.999 8.844 1.00 0.00 H new ATOM 0 HH12 ARG A 702 -8.169 8.082 10.001 1.00 0.00 H new ATOM 0 HH21 ARG A 702 -6.168 9.308 12.631 1.00 0.00 H new ATOM 0 HH22 ARG A 702 -7.792 8.820 12.134 1.00 0.00 H new ATOM 283 N ARG A 703 -0.935 5.497 11.362 1.00 0.00 N ATOM 284 CA ARG A 703 -0.022 4.928 12.348 1.00 0.00 C ATOM 285 C ARG A 703 1.270 4.459 11.682 1.00 0.00 C ATOM 286 O ARG A 703 2.280 4.246 12.353 1.00 0.00 O ATOM 287 CB ARG A 703 -0.686 3.763 13.089 1.00 0.00 C ATOM 288 CG ARG A 703 -1.150 2.643 12.173 1.00 0.00 C ATOM 289 CD ARG A 703 -1.754 1.489 12.957 1.00 0.00 C ATOM 290 NE ARG A 703 -2.244 0.430 12.078 1.00 0.00 N ATOM 291 CZ ARG A 703 -2.740 -0.725 12.513 1.00 0.00 C ATOM 292 NH1 ARG A 703 -2.810 -0.973 13.814 1.00 0.00 N ATOM 293 NH2 ARG A 703 -3.165 -1.632 11.645 1.00 0.00 N ATOM 0 H ARG A 703 -1.832 5.017 11.288 1.00 0.00 H new ATOM 0 HA ARG A 703 0.223 5.707 13.070 1.00 0.00 H new ATOM 0 HB2 ARG A 703 0.018 3.358 13.816 1.00 0.00 H new ATOM 0 HB3 ARG A 703 -1.541 4.140 13.649 1.00 0.00 H new ATOM 0 HG2 ARG A 703 -1.887 3.030 11.469 1.00 0.00 H new ATOM 0 HG3 ARG A 703 -0.307 2.281 11.585 1.00 0.00 H new ATOM 0 HD2 ARG A 703 -1.005 1.080 13.636 1.00 0.00 H new ATOM 0 HD3 ARG A 703 -2.574 1.858 13.573 1.00 0.00 H new ATOM 0 HE ARG A 703 -2.203 0.586 11.071 1.00 0.00 H new ATOM 0 HH11 ARG A 703 -2.483 -0.277 14.484 1.00 0.00 H new ATOM 0 HH12 ARG A 703 -3.191 -1.860 14.144 1.00 0.00 H new ATOM 0 HH21 ARG A 703 -3.112 -1.444 10.644 1.00 0.00 H new ATOM 0 HH22 ARG A 703 -3.545 -2.518 11.978 1.00 0.00 H new ATOM 307 N TYR A 704 1.232 4.301 10.360 1.00 0.00 N ATOM 308 CA TYR A 704 2.409 3.871 9.612 1.00 0.00 C ATOM 309 C TYR A 704 3.448 4.984 9.576 1.00 0.00 C ATOM 310 O TYR A 704 4.649 4.733 9.675 1.00 0.00 O ATOM 311 CB TYR A 704 2.029 3.484 8.178 1.00 0.00 C ATOM 312 CG TYR A 704 1.472 2.084 8.036 1.00 0.00 C ATOM 313 CD1 TYR A 704 2.154 0.991 8.553 1.00 0.00 C ATOM 314 CD2 TYR A 704 0.274 1.854 7.366 1.00 0.00 C ATOM 315 CE1 TYR A 704 1.660 -0.290 8.413 1.00 0.00 C ATOM 316 CE2 TYR A 704 -0.223 0.577 7.219 1.00 0.00 C ATOM 317 CZ TYR A 704 0.472 -0.493 7.745 1.00 0.00 C ATOM 318 OH TYR A 704 -0.020 -1.769 7.601 1.00 0.00 O ATOM 0 H TYR A 704 0.403 4.464 9.788 1.00 0.00 H new ATOM 0 HA TYR A 704 2.828 3.000 10.115 1.00 0.00 H new ATOM 0 HB2 TYR A 704 1.291 4.195 7.806 1.00 0.00 H new ATOM 0 HB3 TYR A 704 2.910 3.578 7.544 1.00 0.00 H new ATOM 0 HD1 TYR A 704 3.087 1.146 9.074 1.00 0.00 H new ATOM 0 HD2 TYR A 704 -0.274 2.689 6.955 1.00 0.00 H new ATOM 0 HE1 TYR A 704 2.202 -1.129 8.825 1.00 0.00 H new ATOM 0 HE2 TYR A 704 -1.153 0.414 6.694 1.00 0.00 H new ATOM 0 HH TYR A 704 -0.963 -1.788 7.866 1.00 0.00 H new ATOM 328 N GLY A 705 2.964 6.217 9.439 1.00 0.00 N ATOM 329 CA GLY A 705 3.837 7.376 9.390 1.00 0.00 C ATOM 330 C GLY A 705 5.053 7.184 8.499 1.00 0.00 C ATOM 331 O GLY A 705 6.177 7.443 8.931 1.00 0.00 O ATOM 0 H GLY A 705 1.970 6.434 9.360 1.00 0.00 H new ATOM 0 HA2 GLY A 705 3.268 8.235 9.034 1.00 0.00 H new ATOM 0 HA3 GLY A 705 4.171 7.612 10.400 1.00 0.00 H new ATOM 335 N PRO A 706 4.868 6.729 7.243 1.00 0.00 N ATOM 336 CA PRO A 706 5.967 6.529 6.315 1.00 0.00 C ATOM 337 C PRO A 706 6.234 7.769 5.477 1.00 0.00 C ATOM 338 O PRO A 706 7.224 8.469 5.691 1.00 0.00 O ATOM 339 CB PRO A 706 5.467 5.376 5.448 1.00 0.00 C ATOM 340 CG PRO A 706 3.972 5.481 5.463 1.00 0.00 C ATOM 341 CD PRO A 706 3.583 6.369 6.625 1.00 0.00 C ATOM 0 HA PRO A 706 6.913 6.323 6.815 1.00 0.00 H new ATOM 0 HB2 PRO A 706 5.855 5.452 4.432 1.00 0.00 H new ATOM 0 HB3 PRO A 706 5.797 4.416 5.844 1.00 0.00 H new ATOM 0 HG2 PRO A 706 3.609 5.899 4.524 1.00 0.00 H new ATOM 0 HG3 PRO A 706 3.521 4.494 5.568 1.00 0.00 H new ATOM 0 HD2 PRO A 706 3.041 7.252 6.288 1.00 0.00 H new ATOM 0 HD3 PRO A 706 2.935 5.846 7.328 1.00 0.00 H new ATOM 349 N ALA A 707 5.346 8.037 4.525 1.00 0.00 N ATOM 350 CA ALA A 707 5.474 9.204 3.665 1.00 0.00 C ATOM 351 C ALA A 707 6.801 9.207 2.916 1.00 0.00 C ATOM 352 O ALA A 707 7.825 9.649 3.437 1.00 0.00 O ATOM 353 CB ALA A 707 5.328 10.465 4.497 1.00 0.00 C ATOM 0 H ALA A 707 4.528 7.459 4.331 1.00 0.00 H new ATOM 0 HA ALA A 707 4.681 9.168 2.918 1.00 0.00 H new ATOM 0 HB1 ALA A 707 5.424 11.339 3.853 1.00 0.00 H new ATOM 0 HB2 ALA A 707 4.349 10.473 4.976 1.00 0.00 H new ATOM 0 HB3 ALA A 707 6.106 10.490 5.260 1.00 0.00 H new ATOM 359 N LEU A 708 6.772 8.705 1.688 1.00 0.00 N ATOM 360 CA LEU A 708 7.961 8.651 0.849 1.00 0.00 C ATOM 361 C LEU A 708 7.580 8.694 -0.625 1.00 0.00 C ATOM 362 O LEU A 708 6.439 9.001 -0.972 1.00 0.00 O ATOM 363 CB LEU A 708 8.783 7.392 1.152 1.00 0.00 C ATOM 364 CG LEU A 708 7.973 6.122 1.429 1.00 0.00 C ATOM 365 CD1 LEU A 708 6.982 5.853 0.309 1.00 0.00 C ATOM 366 CD2 LEU A 708 8.902 4.933 1.606 1.00 0.00 C ATOM 0 H LEU A 708 5.932 8.327 1.249 1.00 0.00 H new ATOM 0 HA LEU A 708 8.574 9.524 1.073 1.00 0.00 H new ATOM 0 HB2 LEU A 708 9.446 7.201 0.308 1.00 0.00 H new ATOM 0 HB3 LEU A 708 9.416 7.593 2.016 1.00 0.00 H new ATOM 0 HG LEU A 708 7.411 6.272 2.351 1.00 0.00 H new ATOM 0 HD11 LEU A 708 6.420 4.946 0.531 1.00 0.00 H new ATOM 0 HD12 LEU A 708 6.294 6.694 0.222 1.00 0.00 H new ATOM 0 HD13 LEU A 708 7.520 5.726 -0.630 1.00 0.00 H new ATOM 0 HD21 LEU A 708 8.313 4.037 1.802 1.00 0.00 H new ATOM 0 HD22 LEU A 708 9.488 4.790 0.698 1.00 0.00 H new ATOM 0 HD23 LEU A 708 9.573 5.117 2.445 1.00 0.00 H new ATOM 378 N SER A 709 8.538 8.385 -1.490 1.00 0.00 N ATOM 379 CA SER A 709 8.294 8.392 -2.925 1.00 0.00 C ATOM 380 C SER A 709 8.009 6.985 -3.440 1.00 0.00 C ATOM 381 O SER A 709 8.352 5.993 -2.795 1.00 0.00 O ATOM 382 CB SER A 709 9.490 8.989 -3.660 1.00 0.00 C ATOM 383 OG SER A 709 9.301 8.949 -5.063 1.00 0.00 O ATOM 0 H SER A 709 9.488 8.127 -1.223 1.00 0.00 H new ATOM 0 HA SER A 709 7.415 9.008 -3.116 1.00 0.00 H new ATOM 0 HB2 SER A 709 9.639 10.020 -3.340 1.00 0.00 H new ATOM 0 HB3 SER A 709 10.394 8.439 -3.396 1.00 0.00 H new ATOM 0 HG SER A 709 10.081 9.339 -5.509 1.00 0.00 H new ATOM 389 N ILE A 710 7.377 6.911 -4.606 1.00 0.00 N ATOM 390 CA ILE A 710 7.037 5.632 -5.219 1.00 0.00 C ATOM 391 C ILE A 710 8.284 4.820 -5.530 1.00 0.00 C ATOM 392 O ILE A 710 8.296 3.598 -5.375 1.00 0.00 O ATOM 393 CB ILE A 710 6.234 5.833 -6.520 1.00 0.00 C ATOM 394 CG1 ILE A 710 4.768 6.127 -6.209 1.00 0.00 C ATOM 395 CG2 ILE A 710 6.346 4.608 -7.417 1.00 0.00 C ATOM 396 CD1 ILE A 710 4.557 7.304 -5.281 1.00 0.00 C ATOM 0 H ILE A 710 7.089 7.726 -5.148 1.00 0.00 H new ATOM 0 HA ILE A 710 6.426 5.089 -4.498 1.00 0.00 H new ATOM 0 HB ILE A 710 6.655 6.689 -7.048 1.00 0.00 H new ATOM 0 HG12 ILE A 710 4.240 6.316 -7.144 1.00 0.00 H new ATOM 0 HG13 ILE A 710 4.318 5.241 -5.762 1.00 0.00 H new ATOM 0 HG21 ILE A 710 5.772 4.771 -8.329 1.00 0.00 H new ATOM 0 HG22 ILE A 710 7.392 4.438 -7.672 1.00 0.00 H new ATOM 0 HG23 ILE A 710 5.954 3.736 -6.893 1.00 0.00 H new ATOM 0 HD11 ILE A 710 3.490 7.446 -5.111 1.00 0.00 H new ATOM 0 HD12 ILE A 710 5.054 7.111 -4.330 1.00 0.00 H new ATOM 0 HD13 ILE A 710 4.975 8.203 -5.733 1.00 0.00 H new ATOM 408 N ASN A 711 9.326 5.500 -5.983 1.00 0.00 N ATOM 409 CA ASN A 711 10.574 4.838 -6.320 1.00 0.00 C ATOM 410 C ASN A 711 11.073 4.006 -5.142 1.00 0.00 C ATOM 411 O ASN A 711 11.880 3.090 -5.304 1.00 0.00 O ATOM 412 CB ASN A 711 11.626 5.871 -6.727 1.00 0.00 C ATOM 413 CG ASN A 711 12.972 5.245 -7.037 1.00 0.00 C ATOM 414 OD1 ASN A 711 13.049 4.113 -7.515 1.00 0.00 O ATOM 415 ND2 ASN A 711 14.043 5.981 -6.761 1.00 0.00 N ATOM 0 H ASN A 711 9.331 6.510 -6.125 1.00 0.00 H new ATOM 0 HA ASN A 711 10.397 4.169 -7.162 1.00 0.00 H new ATOM 0 HB2 ASN A 711 11.274 6.417 -7.602 1.00 0.00 H new ATOM 0 HB3 ASN A 711 11.745 6.598 -5.924 1.00 0.00 H new ATOM 0 HD21 ASN A 711 14.976 5.613 -6.945 1.00 0.00 H new ATOM 0 HD22 ASN A 711 13.932 6.915 -6.365 1.00 0.00 H new ATOM 422 N GLU A 712 10.578 4.342 -3.957 1.00 0.00 N ATOM 423 CA GLU A 712 10.951 3.645 -2.729 1.00 0.00 C ATOM 424 C GLU A 712 9.885 2.623 -2.366 1.00 0.00 C ATOM 425 O GLU A 712 10.145 1.651 -1.658 1.00 0.00 O ATOM 426 CB GLU A 712 11.115 4.649 -1.588 1.00 0.00 C ATOM 427 CG GLU A 712 11.539 6.026 -2.061 1.00 0.00 C ATOM 428 CD GLU A 712 12.932 6.034 -2.661 1.00 0.00 C ATOM 429 OE1 GLU A 712 13.908 5.886 -1.896 1.00 0.00 O ATOM 430 OE2 GLU A 712 13.045 6.187 -3.894 1.00 0.00 O ATOM 0 H GLU A 712 9.910 5.101 -3.819 1.00 0.00 H new ATOM 0 HA GLU A 712 11.898 3.130 -2.890 1.00 0.00 H new ATOM 0 HB2 GLU A 712 10.172 4.732 -1.047 1.00 0.00 H new ATOM 0 HB3 GLU A 712 11.855 4.270 -0.883 1.00 0.00 H new ATOM 0 HG2 GLU A 712 10.826 6.387 -2.802 1.00 0.00 H new ATOM 0 HG3 GLU A 712 11.505 6.721 -1.222 1.00 0.00 H new ATOM 437 N LEU A 713 8.677 2.878 -2.849 1.00 0.00 N ATOM 438 CA LEU A 713 7.528 2.010 -2.610 1.00 0.00 C ATOM 439 C LEU A 713 7.817 0.558 -2.992 1.00 0.00 C ATOM 440 O LEU A 713 7.272 -0.368 -2.392 1.00 0.00 O ATOM 441 CB LEU A 713 6.335 2.527 -3.416 1.00 0.00 C ATOM 442 CG LEU A 713 5.046 2.769 -2.630 1.00 0.00 C ATOM 443 CD1 LEU A 713 5.323 3.536 -1.351 1.00 0.00 C ATOM 444 CD2 LEU A 713 4.062 3.542 -3.483 1.00 0.00 C ATOM 0 H LEU A 713 8.464 3.696 -3.420 1.00 0.00 H new ATOM 0 HA LEU A 713 7.305 2.029 -1.543 1.00 0.00 H new ATOM 0 HB2 LEU A 713 6.625 3.462 -3.896 1.00 0.00 H new ATOM 0 HB3 LEU A 713 6.123 1.812 -4.211 1.00 0.00 H new ATOM 0 HG LEU A 713 4.622 1.800 -2.366 1.00 0.00 H new ATOM 0 HD11 LEU A 713 4.389 3.694 -0.812 1.00 0.00 H new ATOM 0 HD12 LEU A 713 6.010 2.966 -0.726 1.00 0.00 H new ATOM 0 HD13 LEU A 713 5.769 4.500 -1.594 1.00 0.00 H new ATOM 0 HD21 LEU A 713 3.145 3.712 -2.918 1.00 0.00 H new ATOM 0 HD22 LEU A 713 4.498 4.501 -3.763 1.00 0.00 H new ATOM 0 HD23 LEU A 713 3.833 2.971 -4.383 1.00 0.00 H new ATOM 456 N SER A 714 8.667 0.363 -3.991 1.00 0.00 N ATOM 457 CA SER A 714 9.008 -0.981 -4.449 1.00 0.00 C ATOM 458 C SER A 714 9.814 -1.740 -3.396 1.00 0.00 C ATOM 459 O SER A 714 9.925 -2.965 -3.450 1.00 0.00 O ATOM 460 CB SER A 714 9.790 -0.908 -5.761 1.00 0.00 C ATOM 461 OG SER A 714 10.185 -2.198 -6.194 1.00 0.00 O ATOM 0 H SER A 714 9.133 1.114 -4.500 1.00 0.00 H new ATOM 0 HA SER A 714 8.078 -1.525 -4.616 1.00 0.00 H new ATOM 0 HB2 SER A 714 9.176 -0.436 -6.528 1.00 0.00 H new ATOM 0 HB3 SER A 714 10.671 -0.280 -5.628 1.00 0.00 H new ATOM 0 HG SER A 714 10.136 -2.825 -5.442 1.00 0.00 H new ATOM 467 N ASN A 715 10.369 -1.005 -2.438 1.00 0.00 N ATOM 468 CA ASN A 715 11.162 -1.608 -1.370 1.00 0.00 C ATOM 469 C ASN A 715 10.263 -2.105 -0.243 1.00 0.00 C ATOM 470 O ASN A 715 10.742 -2.612 0.772 1.00 0.00 O ATOM 471 CB ASN A 715 12.163 -0.591 -0.818 1.00 0.00 C ATOM 472 CG ASN A 715 12.892 0.165 -1.913 1.00 0.00 C ATOM 473 OD1 ASN A 715 13.275 1.321 -1.733 1.00 0.00 O ATOM 474 ND2 ASN A 715 13.087 -0.483 -3.057 1.00 0.00 N ATOM 0 H ASN A 715 10.285 0.010 -2.378 1.00 0.00 H new ATOM 0 HA ASN A 715 11.703 -2.458 -1.787 1.00 0.00 H new ATOM 0 HB2 ASN A 715 11.638 0.119 -0.179 1.00 0.00 H new ATOM 0 HB3 ASN A 715 12.891 -1.107 -0.191 1.00 0.00 H new ATOM 0 HD21 ASN A 715 13.571 -0.022 -3.828 1.00 0.00 H new ATOM 0 HD22 ASN A 715 12.753 -1.441 -3.164 1.00 0.00 H new ATOM 481 N LEU A 716 8.956 -1.956 -0.431 1.00 0.00 N ATOM 482 CA LEU A 716 7.978 -2.378 0.567 1.00 0.00 C ATOM 483 C LEU A 716 7.805 -3.891 0.581 1.00 0.00 C ATOM 484 O LEU A 716 8.147 -4.580 -0.380 1.00 0.00 O ATOM 485 CB LEU A 716 6.632 -1.709 0.295 1.00 0.00 C ATOM 486 CG LEU A 716 6.593 -0.207 0.575 1.00 0.00 C ATOM 487 CD1 LEU A 716 5.357 0.418 -0.041 1.00 0.00 C ATOM 488 CD2 LEU A 716 6.630 0.054 2.073 1.00 0.00 C ATOM 0 H LEU A 716 8.547 -1.544 -1.270 1.00 0.00 H new ATOM 0 HA LEU A 716 8.350 -2.072 1.545 1.00 0.00 H new ATOM 0 HB2 LEU A 716 6.363 -1.877 -0.748 1.00 0.00 H new ATOM 0 HB3 LEU A 716 5.870 -2.197 0.903 1.00 0.00 H new ATOM 0 HG LEU A 716 7.472 0.251 0.121 1.00 0.00 H new ATOM 0 HD11 LEU A 716 5.347 1.488 0.169 1.00 0.00 H new ATOM 0 HD12 LEU A 716 5.368 0.260 -1.119 1.00 0.00 H new ATOM 0 HD13 LEU A 716 4.466 -0.044 0.384 1.00 0.00 H new ATOM 0 HD21 LEU A 716 6.602 1.128 2.256 1.00 0.00 H new ATOM 0 HD22 LEU A 716 5.769 -0.418 2.546 1.00 0.00 H new ATOM 0 HD23 LEU A 716 7.546 -0.361 2.492 1.00 0.00 H new ATOM 500 N ALA A 717 7.270 -4.399 1.687 1.00 0.00 N ATOM 501 CA ALA A 717 7.030 -5.826 1.842 1.00 0.00 C ATOM 502 C ALA A 717 5.574 -6.151 1.536 1.00 0.00 C ATOM 503 O ALA A 717 4.677 -5.373 1.859 1.00 0.00 O ATOM 504 CB ALA A 717 7.390 -6.270 3.250 1.00 0.00 C ATOM 0 H ALA A 717 6.994 -3.838 2.493 1.00 0.00 H new ATOM 0 HA ALA A 717 7.661 -6.367 1.137 1.00 0.00 H new ATOM 0 HB1 ALA A 717 7.206 -7.339 3.353 1.00 0.00 H new ATOM 0 HB2 ALA A 717 8.444 -6.064 3.438 1.00 0.00 H new ATOM 0 HB3 ALA A 717 6.779 -5.726 3.970 1.00 0.00 H new ATOM 510 N LYS A 718 5.339 -7.301 0.918 1.00 0.00 N ATOM 511 CA LYS A 718 3.985 -7.703 0.567 1.00 0.00 C ATOM 512 C LYS A 718 3.103 -7.846 1.799 1.00 0.00 C ATOM 513 O LYS A 718 3.587 -8.097 2.902 1.00 0.00 O ATOM 514 CB LYS A 718 3.995 -9.004 -0.226 1.00 0.00 C ATOM 515 CG LYS A 718 3.703 -8.794 -1.698 1.00 0.00 C ATOM 516 CD LYS A 718 4.876 -8.140 -2.413 1.00 0.00 C ATOM 517 CE LYS A 718 4.450 -7.519 -3.734 1.00 0.00 C ATOM 518 NZ LYS A 718 5.574 -6.803 -4.398 1.00 0.00 N ATOM 0 H LYS A 718 6.064 -7.967 0.651 1.00 0.00 H new ATOM 0 HA LYS A 718 3.565 -6.914 -0.056 1.00 0.00 H new ATOM 0 HB2 LYS A 718 4.968 -9.483 -0.118 1.00 0.00 H new ATOM 0 HB3 LYS A 718 3.255 -9.686 0.193 1.00 0.00 H new ATOM 0 HG2 LYS A 718 3.480 -9.753 -2.166 1.00 0.00 H new ATOM 0 HG3 LYS A 718 2.815 -8.171 -1.808 1.00 0.00 H new ATOM 0 HD2 LYS A 718 5.311 -7.372 -1.773 1.00 0.00 H new ATOM 0 HD3 LYS A 718 5.653 -8.883 -2.593 1.00 0.00 H new ATOM 0 HE2 LYS A 718 4.074 -8.298 -4.397 1.00 0.00 H new ATOM 0 HE3 LYS A 718 3.629 -6.824 -3.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 718 5.243 -6.394 -5.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 718 5.917 -6.043 -3.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 718 6.348 -7.471 -4.587 1.00 0.00 H new ATOM 532 N GLY A 719 1.799 -7.678 1.594 1.00 0.00 N ATOM 533 CA GLY A 719 0.855 -7.779 2.687 1.00 0.00 C ATOM 534 C GLY A 719 0.880 -6.550 3.574 1.00 0.00 C ATOM 535 O GLY A 719 0.090 -6.432 4.511 1.00 0.00 O ATOM 0 H GLY A 719 1.381 -7.473 0.686 1.00 0.00 H new ATOM 0 HA2 GLY A 719 -0.149 -7.917 2.287 1.00 0.00 H new ATOM 0 HA3 GLY A 719 1.084 -8.662 3.284 1.00 0.00 H new ATOM 539 N GLU A 720 1.793 -5.632 3.271 1.00 0.00 N ATOM 540 CA GLU A 720 1.937 -4.399 4.041 1.00 0.00 C ATOM 541 C GLU A 720 1.425 -3.196 3.262 1.00 0.00 C ATOM 542 O GLU A 720 1.092 -3.296 2.080 1.00 0.00 O ATOM 543 CB GLU A 720 3.398 -4.171 4.420 1.00 0.00 C ATOM 544 CG GLU A 720 3.966 -5.237 5.340 1.00 0.00 C ATOM 545 CD GLU A 720 3.312 -5.236 6.708 1.00 0.00 C ATOM 546 OE1 GLU A 720 2.250 -5.876 6.861 1.00 0.00 O ATOM 547 OE2 GLU A 720 3.862 -4.593 7.627 1.00 0.00 O ATOM 0 H GLU A 720 2.448 -5.719 2.494 1.00 0.00 H new ATOM 0 HA GLU A 720 1.339 -4.509 4.946 1.00 0.00 H new ATOM 0 HB2 GLU A 720 3.998 -4.132 3.511 1.00 0.00 H new ATOM 0 HB3 GLU A 720 3.490 -3.199 4.905 1.00 0.00 H new ATOM 0 HG2 GLU A 720 3.835 -6.216 4.880 1.00 0.00 H new ATOM 0 HG3 GLU A 720 5.038 -5.079 5.454 1.00 0.00 H new ATOM 554 N LYS A 721 1.353 -2.057 3.944 1.00 0.00 N ATOM 555 CA LYS A 721 0.886 -0.824 3.325 1.00 0.00 C ATOM 556 C LYS A 721 1.899 0.301 3.491 1.00 0.00 C ATOM 557 O LYS A 721 2.918 0.139 4.161 1.00 0.00 O ATOM 558 CB LYS A 721 -0.445 -0.398 3.931 1.00 0.00 C ATOM 559 CG LYS A 721 -1.648 -1.100 3.332 1.00 0.00 C ATOM 560 CD LYS A 721 -2.668 -1.440 4.401 1.00 0.00 C ATOM 561 CE LYS A 721 -2.161 -2.551 5.307 1.00 0.00 C ATOM 562 NZ LYS A 721 -3.175 -2.952 6.322 1.00 0.00 N ATOM 0 H LYS A 721 1.613 -1.964 4.926 1.00 0.00 H new ATOM 0 HA LYS A 721 0.758 -1.020 2.260 1.00 0.00 H new ATOM 0 HB2 LYS A 721 -0.422 -0.590 5.004 1.00 0.00 H new ATOM 0 HB3 LYS A 721 -0.564 0.678 3.802 1.00 0.00 H new ATOM 0 HG2 LYS A 721 -2.107 -0.462 2.577 1.00 0.00 H new ATOM 0 HG3 LYS A 721 -1.327 -2.011 2.827 1.00 0.00 H new ATOM 0 HD2 LYS A 721 -2.886 -0.553 4.995 1.00 0.00 H new ATOM 0 HD3 LYS A 721 -3.603 -1.747 3.932 1.00 0.00 H new ATOM 0 HE2 LYS A 721 -1.892 -3.417 4.702 1.00 0.00 H new ATOM 0 HE3 LYS A 721 -1.254 -2.221 5.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 721 -2.788 -3.711 6.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 721 -3.414 -2.133 6.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 721 -4.032 -3.292 5.841 1.00 0.00 H new ATOM 576 N ALA A 722 1.606 1.445 2.873 1.00 0.00 N ATOM 577 CA ALA A 722 2.493 2.608 2.961 1.00 0.00 C ATOM 578 C ALA A 722 1.820 3.861 2.415 1.00 0.00 C ATOM 579 O ALA A 722 1.366 3.879 1.274 1.00 0.00 O ATOM 580 CB ALA A 722 3.790 2.341 2.211 1.00 0.00 C ATOM 0 H ALA A 722 0.768 1.592 2.310 1.00 0.00 H new ATOM 0 HA ALA A 722 2.718 2.778 4.014 1.00 0.00 H new ATOM 0 HB1 ALA A 722 4.439 3.213 2.285 1.00 0.00 H new ATOM 0 HB2 ALA A 722 4.292 1.477 2.648 1.00 0.00 H new ATOM 0 HB3 ALA A 722 3.569 2.141 1.163 1.00 0.00 H new ATOM 586 N ASN A 723 1.812 4.919 3.223 1.00 0.00 N ATOM 587 CA ASN A 723 1.181 6.181 2.842 1.00 0.00 C ATOM 588 C ASN A 723 1.994 6.945 1.808 1.00 0.00 C ATOM 589 O ASN A 723 3.150 7.303 2.040 1.00 0.00 O ATOM 590 CB ASN A 723 0.960 7.053 4.079 1.00 0.00 C ATOM 591 CG ASN A 723 -0.035 6.442 5.047 1.00 0.00 C ATOM 592 OD1 ASN A 723 -1.228 6.738 4.997 1.00 0.00 O ATOM 593 ND2 ASN A 723 0.453 5.582 5.935 1.00 0.00 N ATOM 0 H ASN A 723 2.237 4.927 4.150 1.00 0.00 H new ATOM 0 HA ASN A 723 0.221 5.937 2.387 1.00 0.00 H new ATOM 0 HB2 ASN A 723 1.912 7.205 4.588 1.00 0.00 H new ATOM 0 HB3 ASN A 723 0.604 8.036 3.769 1.00 0.00 H new ATOM 0 HD21 ASN A 723 -0.169 5.139 6.611 1.00 0.00 H new ATOM 0 HD22 ASN A 723 1.450 5.365 5.941 1.00 0.00 H new ATOM 600 N VAL A 724 1.366 7.187 0.661 1.00 0.00 N ATOM 601 CA VAL A 724 1.992 7.926 -0.423 1.00 0.00 C ATOM 602 C VAL A 724 0.984 8.832 -1.116 1.00 0.00 C ATOM 603 O VAL A 724 -0.202 8.514 -1.195 1.00 0.00 O ATOM 604 CB VAL A 724 2.638 6.999 -1.466 1.00 0.00 C ATOM 605 CG1 VAL A 724 3.948 6.450 -0.937 1.00 0.00 C ATOM 606 CG2 VAL A 724 1.697 5.870 -1.848 1.00 0.00 C ATOM 0 H VAL A 724 0.415 6.877 0.461 1.00 0.00 H new ATOM 0 HA VAL A 724 2.778 8.529 0.030 1.00 0.00 H new ATOM 0 HB VAL A 724 2.841 7.581 -2.365 1.00 0.00 H new ATOM 0 HG11 VAL A 724 4.396 5.795 -1.684 1.00 0.00 H new ATOM 0 HG12 VAL A 724 4.628 7.275 -0.723 1.00 0.00 H new ATOM 0 HG13 VAL A 724 3.763 5.885 -0.023 1.00 0.00 H new ATOM 0 HG21 VAL A 724 2.178 5.229 -2.587 1.00 0.00 H new ATOM 0 HG22 VAL A 724 1.454 5.283 -0.962 1.00 0.00 H new ATOM 0 HG23 VAL A 724 0.782 6.286 -2.270 1.00 0.00 H new ATOM 616 N LEU A 725 1.462 9.964 -1.617 1.00 0.00 N ATOM 617 CA LEU A 725 0.598 10.917 -2.301 1.00 0.00 C ATOM 618 C LEU A 725 0.319 10.466 -3.728 1.00 0.00 C ATOM 619 O LEU A 725 1.188 9.900 -4.392 1.00 0.00 O ATOM 620 CB LEU A 725 1.231 12.310 -2.321 1.00 0.00 C ATOM 621 CG LEU A 725 2.548 12.445 -1.556 1.00 0.00 C ATOM 622 CD1 LEU A 725 3.294 13.692 -2.003 1.00 0.00 C ATOM 623 CD2 LEU A 725 2.288 12.484 -0.056 1.00 0.00 C ATOM 0 H LEU A 725 2.441 10.244 -1.563 1.00 0.00 H new ATOM 0 HA LEU A 725 -0.342 10.963 -1.752 1.00 0.00 H new ATOM 0 HB2 LEU A 725 1.402 12.597 -3.358 1.00 0.00 H new ATOM 0 HB3 LEU A 725 0.516 13.021 -1.907 1.00 0.00 H new ATOM 0 HG LEU A 725 3.169 11.576 -1.775 1.00 0.00 H new ATOM 0 HD11 LEU A 725 4.229 13.774 -1.449 1.00 0.00 H new ATOM 0 HD12 LEU A 725 3.508 13.625 -3.070 1.00 0.00 H new ATOM 0 HD13 LEU A 725 2.680 14.572 -1.811 1.00 0.00 H new ATOM 0 HD21 LEU A 725 3.235 12.580 0.475 1.00 0.00 H new ATOM 0 HD22 LEU A 725 1.651 13.336 0.181 1.00 0.00 H new ATOM 0 HD23 LEU A 725 1.792 11.563 0.251 1.00 0.00 H new ATOM 635 N ILE A 726 -0.898 10.718 -4.195 1.00 0.00 N ATOM 636 CA ILE A 726 -1.287 10.340 -5.549 1.00 0.00 C ATOM 637 C ILE A 726 -1.299 11.550 -6.473 1.00 0.00 C ATOM 638 O ILE A 726 -1.508 11.420 -7.680 1.00 0.00 O ATOM 639 CB ILE A 726 -2.671 9.671 -5.575 1.00 0.00 C ATOM 640 CG1 ILE A 726 -3.716 10.559 -4.894 1.00 0.00 C ATOM 641 CG2 ILE A 726 -2.605 8.306 -4.907 1.00 0.00 C ATOM 642 CD1 ILE A 726 -5.120 9.990 -4.948 1.00 0.00 C ATOM 0 H ILE A 726 -1.631 11.181 -3.658 1.00 0.00 H new ATOM 0 HA ILE A 726 -0.545 9.624 -5.901 1.00 0.00 H new ATOM 0 HB ILE A 726 -2.972 9.535 -6.614 1.00 0.00 H new ATOM 0 HG12 ILE A 726 -3.432 10.707 -3.852 1.00 0.00 H new ATOM 0 HG13 ILE A 726 -3.712 11.541 -5.368 1.00 0.00 H new ATOM 0 HG21 ILE A 726 -3.591 7.841 -4.931 1.00 0.00 H new ATOM 0 HG22 ILE A 726 -1.893 7.675 -5.439 1.00 0.00 H new ATOM 0 HG23 ILE A 726 -2.284 8.423 -3.872 1.00 0.00 H new ATOM 0 HD11 ILE A 726 -5.808 10.671 -4.447 1.00 0.00 H new ATOM 0 HD12 ILE A 726 -5.423 9.868 -5.988 1.00 0.00 H new ATOM 0 HD13 ILE A 726 -5.140 9.021 -4.448 1.00 0.00 H new ATOM 654 N GLY A 727 -1.075 12.723 -5.896 1.00 0.00 N ATOM 655 CA GLY A 727 -1.060 13.948 -6.676 1.00 0.00 C ATOM 656 C GLY A 727 -0.210 15.032 -6.039 1.00 0.00 C ATOM 657 O GLY A 727 0.967 15.179 -6.367 1.00 0.00 O ATOM 0 H GLY A 727 -0.903 12.850 -4.899 1.00 0.00 H new ATOM 0 HA2 GLY A 727 -0.681 13.734 -7.675 1.00 0.00 H new ATOM 0 HA3 GLY A 727 -2.080 14.313 -6.793 1.00 0.00 H new ATOM 661 N GLN A 728 -0.810 15.791 -5.127 1.00 0.00 N ATOM 662 CA GLN A 728 -0.108 16.870 -4.441 1.00 0.00 C ATOM 663 C GLN A 728 -0.917 17.364 -3.245 1.00 0.00 C ATOM 664 O GLN A 728 -0.792 18.518 -2.833 1.00 0.00 O ATOM 665 CB GLN A 728 0.155 18.029 -5.406 1.00 0.00 C ATOM 666 CG GLN A 728 -1.110 18.607 -6.017 1.00 0.00 C ATOM 667 CD GLN A 728 -0.824 19.703 -7.024 1.00 0.00 C ATOM 668 OE1 GLN A 728 -0.674 19.442 -8.219 1.00 0.00 O ATOM 669 NE2 GLN A 728 -0.744 20.939 -6.547 1.00 0.00 N ATOM 0 H GLN A 728 -1.784 15.678 -4.845 1.00 0.00 H new ATOM 0 HA GLN A 728 0.845 16.483 -4.081 1.00 0.00 H new ATOM 0 HB2 GLN A 728 0.687 18.819 -4.876 1.00 0.00 H new ATOM 0 HB3 GLN A 728 0.811 17.684 -6.206 1.00 0.00 H new ATOM 0 HG2 GLN A 728 -1.671 17.809 -6.504 1.00 0.00 H new ATOM 0 HG3 GLN A 728 -1.743 19.004 -5.224 1.00 0.00 H new ATOM 0 HE21 GLN A 728 -0.875 21.110 -5.550 1.00 0.00 H new ATOM 0 HE22 GLN A 728 -0.552 21.717 -7.177 1.00 0.00 H new ATOM 678 N GLY A 729 -1.739 16.480 -2.685 1.00 0.00 N ATOM 679 CA GLY A 729 -2.557 16.850 -1.544 1.00 0.00 C ATOM 680 C GLY A 729 -3.423 15.708 -1.050 1.00 0.00 C ATOM 681 O GLY A 729 -4.273 15.897 -0.180 1.00 0.00 O ATOM 0 H GLY A 729 -1.853 15.517 -3.000 1.00 0.00 H new ATOM 0 HA2 GLY A 729 -1.911 17.188 -0.733 1.00 0.00 H new ATOM 0 HA3 GLY A 729 -3.194 17.692 -1.816 1.00 0.00 H new ATOM 685 N ASP A 730 -3.208 14.518 -1.604 1.00 0.00 N ATOM 686 CA ASP A 730 -3.973 13.342 -1.212 1.00 0.00 C ATOM 687 C ASP A 730 -3.054 12.277 -0.630 1.00 0.00 C ATOM 688 O ASP A 730 -2.319 11.611 -1.361 1.00 0.00 O ATOM 689 CB ASP A 730 -4.731 12.774 -2.414 1.00 0.00 C ATOM 690 CG ASP A 730 -5.579 11.574 -2.045 1.00 0.00 C ATOM 691 OD1 ASP A 730 -5.022 10.460 -1.957 1.00 0.00 O ATOM 692 OD2 ASP A 730 -6.799 11.749 -1.844 1.00 0.00 O ATOM 0 H ASP A 730 -2.509 14.344 -2.326 1.00 0.00 H new ATOM 0 HA ASP A 730 -4.692 13.641 -0.449 1.00 0.00 H new ATOM 0 HB2 ASP A 730 -5.368 13.550 -2.838 1.00 0.00 H new ATOM 0 HB3 ASP A 730 -4.019 12.488 -3.188 1.00 0.00 H new ATOM 697 N VAL A 731 -3.102 12.116 0.689 1.00 0.00 N ATOM 698 CA VAL A 731 -2.266 11.138 1.369 1.00 0.00 C ATOM 699 C VAL A 731 -3.014 9.828 1.582 1.00 0.00 C ATOM 700 O VAL A 731 -3.916 9.742 2.416 1.00 0.00 O ATOM 701 CB VAL A 731 -1.787 11.669 2.733 1.00 0.00 C ATOM 702 CG1 VAL A 731 -0.840 10.680 3.391 1.00 0.00 C ATOM 703 CG2 VAL A 731 -1.124 13.029 2.570 1.00 0.00 C ATOM 0 H VAL A 731 -3.712 12.652 1.307 1.00 0.00 H new ATOM 0 HA VAL A 731 -1.402 10.958 0.730 1.00 0.00 H new ATOM 0 HB VAL A 731 -2.655 11.787 3.382 1.00 0.00 H new ATOM 0 HG11 VAL A 731 -0.513 11.074 4.353 1.00 0.00 H new ATOM 0 HG12 VAL A 731 -1.354 9.731 3.543 1.00 0.00 H new ATOM 0 HG13 VAL A 731 0.027 10.525 2.749 1.00 0.00 H new ATOM 0 HG21 VAL A 731 -0.791 13.390 3.543 1.00 0.00 H new ATOM 0 HG22 VAL A 731 -0.266 12.938 1.904 1.00 0.00 H new ATOM 0 HG23 VAL A 731 -1.839 13.734 2.146 1.00 0.00 H new ATOM 713 N VAL A 732 -2.630 8.812 0.818 1.00 0.00 N ATOM 714 CA VAL A 732 -3.256 7.500 0.914 1.00 0.00 C ATOM 715 C VAL A 732 -2.210 6.395 0.828 1.00 0.00 C ATOM 716 O VAL A 732 -1.281 6.470 0.027 1.00 0.00 O ATOM 717 CB VAL A 732 -4.294 7.290 -0.205 1.00 0.00 C ATOM 718 CG1 VAL A 732 -5.482 8.218 -0.017 1.00 0.00 C ATOM 719 CG2 VAL A 732 -3.660 7.502 -1.571 1.00 0.00 C ATOM 0 H VAL A 732 -1.886 8.873 0.123 1.00 0.00 H new ATOM 0 HA VAL A 732 -3.759 7.455 1.880 1.00 0.00 H new ATOM 0 HB VAL A 732 -4.652 6.262 -0.149 1.00 0.00 H new ATOM 0 HG11 VAL A 732 -6.203 8.053 -0.818 1.00 0.00 H new ATOM 0 HG12 VAL A 732 -5.954 8.014 0.944 1.00 0.00 H new ATOM 0 HG13 VAL A 732 -5.142 9.253 -0.042 1.00 0.00 H new ATOM 0 HG21 VAL A 732 -4.409 7.349 -2.348 1.00 0.00 H new ATOM 0 HG22 VAL A 732 -3.270 8.518 -1.638 1.00 0.00 H new ATOM 0 HG23 VAL A 732 -2.845 6.791 -1.708 1.00 0.00 H new ATOM 729 N LEU A 733 -2.378 5.363 1.642 1.00 0.00 N ATOM 730 CA LEU A 733 -1.447 4.243 1.655 1.00 0.00 C ATOM 731 C LEU A 733 -1.840 3.215 0.614 1.00 0.00 C ATOM 732 O LEU A 733 -2.988 3.174 0.175 1.00 0.00 O ATOM 733 CB LEU A 733 -1.353 3.580 3.038 1.00 0.00 C ATOM 734 CG LEU A 733 -2.684 3.252 3.712 1.00 0.00 C ATOM 735 CD1 LEU A 733 -2.502 2.170 4.763 1.00 0.00 C ATOM 736 CD2 LEU A 733 -3.270 4.495 4.344 1.00 0.00 C ATOM 0 H LEU A 733 -3.151 5.278 2.303 1.00 0.00 H new ATOM 0 HA LEU A 733 -0.462 4.644 1.415 1.00 0.00 H new ATOM 0 HB2 LEU A 733 -0.781 2.658 2.939 1.00 0.00 H new ATOM 0 HB3 LEU A 733 -0.786 4.238 3.697 1.00 0.00 H new ATOM 0 HG LEU A 733 -3.371 2.883 2.951 1.00 0.00 H new ATOM 0 HD11 LEU A 733 -3.462 1.952 5.231 1.00 0.00 H new ATOM 0 HD12 LEU A 733 -2.114 1.267 4.292 1.00 0.00 H new ATOM 0 HD13 LEU A 733 -1.799 2.514 5.522 1.00 0.00 H new ATOM 0 HD21 LEU A 733 -4.218 4.248 4.821 1.00 0.00 H new ATOM 0 HD22 LEU A 733 -2.578 4.884 5.091 1.00 0.00 H new ATOM 0 HD23 LEU A 733 -3.436 5.250 3.576 1.00 0.00 H new ATOM 748 N VAL A 734 -0.876 2.406 0.193 1.00 0.00 N ATOM 749 CA VAL A 734 -1.135 1.388 -0.803 1.00 0.00 C ATOM 750 C VAL A 734 -1.001 0.005 -0.216 1.00 0.00 C ATOM 751 O VAL A 734 -0.475 -0.161 0.881 1.00 0.00 O ATOM 752 CB VAL A 734 -0.197 1.507 -2.007 1.00 0.00 C ATOM 753 CG1 VAL A 734 -0.995 1.953 -3.208 1.00 0.00 C ATOM 754 CG2 VAL A 734 0.950 2.466 -1.719 1.00 0.00 C ATOM 0 H VAL A 734 0.087 2.439 0.527 1.00 0.00 H new ATOM 0 HA VAL A 734 -2.159 1.546 -1.141 1.00 0.00 H new ATOM 0 HB VAL A 734 0.249 0.534 -2.214 1.00 0.00 H new ATOM 0 HG11 VAL A 734 -0.335 2.041 -4.071 1.00 0.00 H new ATOM 0 HG12 VAL A 734 -1.774 1.221 -3.420 1.00 0.00 H new ATOM 0 HG13 VAL A 734 -1.453 2.920 -3.002 1.00 0.00 H new ATOM 0 HG21 VAL A 734 1.599 2.530 -2.592 1.00 0.00 H new ATOM 0 HG22 VAL A 734 0.550 3.454 -1.491 1.00 0.00 H new ATOM 0 HG23 VAL A 734 1.523 2.102 -0.867 1.00 0.00 H new ATOM 764 N MET A 735 -1.467 -0.978 -0.971 1.00 0.00 N ATOM 765 CA MET A 735 -1.421 -2.366 -0.544 1.00 0.00 C ATOM 766 C MET A 735 -0.697 -3.221 -1.574 1.00 0.00 C ATOM 767 O MET A 735 -1.075 -3.258 -2.744 1.00 0.00 O ATOM 768 CB MET A 735 -2.843 -2.875 -0.346 1.00 0.00 C ATOM 769 CG MET A 735 -3.144 -3.310 1.078 1.00 0.00 C ATOM 770 SD MET A 735 -3.255 -5.100 1.254 1.00 0.00 S ATOM 771 CE MET A 735 -1.548 -5.566 0.987 1.00 0.00 C ATOM 0 H MET A 735 -1.885 -0.837 -1.891 1.00 0.00 H new ATOM 0 HA MET A 735 -0.874 -2.432 0.396 1.00 0.00 H new ATOM 0 HB2 MET A 735 -3.543 -2.090 -0.632 1.00 0.00 H new ATOM 0 HB3 MET A 735 -3.015 -3.716 -1.017 1.00 0.00 H new ATOM 0 HG2 MET A 735 -2.365 -2.932 1.741 1.00 0.00 H new ATOM 0 HG3 MET A 735 -4.083 -2.859 1.400 1.00 0.00 H new ATOM 0 HE1 MET A 735 -1.480 -6.647 0.869 1.00 0.00 H new ATOM 0 HE2 MET A 735 -1.174 -5.079 0.086 1.00 0.00 H new ATOM 0 HE3 MET A 735 -0.948 -5.256 1.843 1.00 0.00 H new ATOM 781 N LYS A 736 0.345 -3.910 -1.135 1.00 0.00 N ATOM 782 CA LYS A 736 1.126 -4.754 -2.029 1.00 0.00 C ATOM 783 C LYS A 736 0.417 -6.085 -2.285 1.00 0.00 C ATOM 784 O LYS A 736 -0.635 -6.357 -1.712 1.00 0.00 O ATOM 785 CB LYS A 736 2.517 -4.993 -1.441 1.00 0.00 C ATOM 786 CG LYS A 736 2.897 -3.987 -0.368 1.00 0.00 C ATOM 787 CD LYS A 736 3.177 -2.625 -0.965 1.00 0.00 C ATOM 788 CE LYS A 736 2.630 -1.514 -0.088 1.00 0.00 C ATOM 789 NZ LYS A 736 3.209 -1.557 1.282 1.00 0.00 N ATOM 0 H LYS A 736 0.670 -3.902 -0.168 1.00 0.00 H new ATOM 0 HA LYS A 736 1.229 -4.240 -2.985 1.00 0.00 H new ATOM 0 HB2 LYS A 736 2.558 -5.997 -1.019 1.00 0.00 H new ATOM 0 HB3 LYS A 736 3.254 -4.954 -2.243 1.00 0.00 H new ATOM 0 HG2 LYS A 736 2.091 -3.908 0.361 1.00 0.00 H new ATOM 0 HG3 LYS A 736 3.778 -4.339 0.168 1.00 0.00 H new ATOM 0 HD2 LYS A 736 4.252 -2.495 -1.091 1.00 0.00 H new ATOM 0 HD3 LYS A 736 2.729 -2.562 -1.957 1.00 0.00 H new ATOM 0 HE2 LYS A 736 2.849 -0.549 -0.545 1.00 0.00 H new ATOM 0 HE3 LYS A 736 1.545 -1.599 -0.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 736 3.357 -0.587 1.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 736 2.555 -2.055 1.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 736 4.119 -2.059 1.259 1.00 0.00 H new ATOM 803 N ARG A 737 0.997 -6.906 -3.158 1.00 0.00 N ATOM 804 CA ARG A 737 0.415 -8.205 -3.492 1.00 0.00 C ATOM 805 C ARG A 737 0.157 -9.034 -2.245 1.00 0.00 C ATOM 806 O ARG A 737 0.856 -8.909 -1.241 1.00 0.00 O ATOM 807 CB ARG A 737 1.333 -8.982 -4.439 1.00 0.00 C ATOM 808 CG ARG A 737 1.436 -8.369 -5.826 1.00 0.00 C ATOM 809 CD ARG A 737 2.220 -9.263 -6.775 1.00 0.00 C ATOM 810 NE ARG A 737 3.603 -9.442 -6.344 1.00 0.00 N ATOM 811 CZ ARG A 737 4.260 -10.596 -6.423 1.00 0.00 C ATOM 812 NH1 ARG A 737 3.658 -11.675 -6.909 1.00 0.00 N ATOM 813 NH2 ARG A 737 5.519 -10.674 -6.015 1.00 0.00 N ATOM 0 H ARG A 737 1.868 -6.696 -3.646 1.00 0.00 H new ATOM 0 HA ARG A 737 -0.537 -8.016 -3.987 1.00 0.00 H new ATOM 0 HB2 ARG A 737 2.329 -9.038 -4.001 1.00 0.00 H new ATOM 0 HB3 ARG A 737 0.966 -10.005 -4.529 1.00 0.00 H new ATOM 0 HG2 ARG A 737 0.436 -8.201 -6.226 1.00 0.00 H new ATOM 0 HG3 ARG A 737 1.920 -7.395 -5.759 1.00 0.00 H new ATOM 0 HD2 ARG A 737 1.733 -10.236 -6.842 1.00 0.00 H new ATOM 0 HD3 ARG A 737 2.206 -8.830 -7.775 1.00 0.00 H new ATOM 0 HE ARG A 737 4.094 -8.635 -5.960 1.00 0.00 H new ATOM 0 HH11 ARG A 737 2.689 -11.621 -7.223 1.00 0.00 H new ATOM 0 HH12 ARG A 737 4.164 -12.558 -6.968 1.00 0.00 H new ATOM 0 HH21 ARG A 737 5.986 -9.848 -5.640 1.00 0.00 H new ATOM 0 HH22 ARG A 737 6.021 -11.560 -6.076 1.00 0.00 H new ATOM 827 N LYS A 738 -0.868 -9.870 -2.311 1.00 0.00 N ATOM 828 CA LYS A 738 -1.201 -10.742 -1.200 1.00 0.00 C ATOM 829 C LYS A 738 -0.506 -12.077 -1.397 1.00 0.00 C ATOM 830 O LYS A 738 -0.335 -12.853 -0.455 1.00 0.00 O ATOM 831 CB LYS A 738 -2.716 -10.946 -1.099 1.00 0.00 C ATOM 832 CG LYS A 738 -3.259 -12.030 -2.019 1.00 0.00 C ATOM 833 CD LYS A 738 -3.210 -11.601 -3.473 1.00 0.00 C ATOM 834 CE LYS A 738 -4.275 -10.563 -3.790 1.00 0.00 C ATOM 835 NZ LYS A 738 -4.236 -10.150 -5.219 1.00 0.00 N ATOM 0 H LYS A 738 -1.481 -9.961 -3.121 1.00 0.00 H new ATOM 0 HA LYS A 738 -0.864 -10.281 -0.272 1.00 0.00 H new ATOM 0 HB2 LYS A 738 -2.970 -11.197 -0.069 1.00 0.00 H new ATOM 0 HB3 LYS A 738 -3.215 -10.005 -1.330 1.00 0.00 H new ATOM 0 HG2 LYS A 738 -2.679 -12.944 -1.888 1.00 0.00 H new ATOM 0 HG3 LYS A 738 -4.287 -12.263 -1.742 1.00 0.00 H new ATOM 0 HD2 LYS A 738 -2.225 -11.192 -3.699 1.00 0.00 H new ATOM 0 HD3 LYS A 738 -3.348 -12.472 -4.114 1.00 0.00 H new ATOM 0 HE2 LYS A 738 -5.259 -10.969 -3.556 1.00 0.00 H new ATOM 0 HE3 LYS A 738 -4.131 -9.689 -3.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 738 -4.842 -9.316 -5.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 738 -3.259 -9.915 -5.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 738 -4.580 -10.930 -5.815 1.00 0.00 H new ATOM 849 N ARG A 739 -0.103 -12.330 -2.639 1.00 0.00 N ATOM 850 CA ARG A 739 0.570 -13.570 -2.987 1.00 0.00 C ATOM 851 C ARG A 739 1.135 -13.515 -4.405 1.00 0.00 C ATOM 852 O ARG A 739 2.337 -13.328 -4.597 1.00 0.00 O ATOM 853 CB ARG A 739 -0.402 -14.741 -2.861 1.00 0.00 C ATOM 854 CG ARG A 739 0.271 -16.102 -2.926 1.00 0.00 C ATOM 855 CD ARG A 739 -0.729 -17.228 -2.721 1.00 0.00 C ATOM 856 NE ARG A 739 -1.822 -17.167 -3.687 1.00 0.00 N ATOM 857 CZ ARG A 739 -2.440 -18.241 -4.168 1.00 0.00 C ATOM 858 NH1 ARG A 739 -2.070 -19.455 -3.780 1.00 0.00 N ATOM 859 NH2 ARG A 739 -3.427 -18.101 -5.041 1.00 0.00 N ATOM 0 H ARG A 739 -0.233 -11.688 -3.421 1.00 0.00 H new ATOM 0 HA ARG A 739 1.401 -13.710 -2.296 1.00 0.00 H new ATOM 0 HB2 ARG A 739 -0.939 -14.656 -1.917 1.00 0.00 H new ATOM 0 HB3 ARG A 739 -1.144 -14.674 -3.657 1.00 0.00 H new ATOM 0 HG2 ARG A 739 0.761 -16.221 -3.892 1.00 0.00 H new ATOM 0 HG3 ARG A 739 1.049 -16.161 -2.164 1.00 0.00 H new ATOM 0 HD2 ARG A 739 -0.219 -18.187 -2.810 1.00 0.00 H new ATOM 0 HD3 ARG A 739 -1.134 -17.175 -1.710 1.00 0.00 H new ATOM 0 HE ARG A 739 -2.128 -16.249 -4.011 1.00 0.00 H new ATOM 0 HH11 ARG A 739 -1.309 -19.566 -3.110 1.00 0.00 H new ATOM 0 HH12 ARG A 739 -2.547 -20.277 -4.151 1.00 0.00 H new ATOM 0 HH21 ARG A 739 -3.712 -17.170 -5.343 1.00 0.00 H new ATOM 0 HH22 ARG A 739 -3.902 -18.925 -5.411 1.00 0.00 H new ATOM 873 N ASP A 740 0.261 -13.680 -5.395 1.00 0.00 N ATOM 874 CA ASP A 740 0.677 -13.655 -6.794 1.00 0.00 C ATOM 875 C ASP A 740 -0.197 -12.710 -7.613 1.00 0.00 C ATOM 876 O ASP A 740 -1.425 -12.785 -7.566 1.00 0.00 O ATOM 877 CB ASP A 740 0.616 -15.064 -7.389 1.00 0.00 C ATOM 878 CG ASP A 740 1.024 -15.092 -8.849 1.00 0.00 C ATOM 879 OD1 ASP A 740 2.241 -15.053 -9.128 1.00 0.00 O ATOM 880 OD2 ASP A 740 0.126 -15.156 -9.715 1.00 0.00 O ATOM 0 H ASP A 740 -0.738 -13.832 -5.254 1.00 0.00 H new ATOM 0 HA ASP A 740 1.704 -13.291 -6.832 1.00 0.00 H new ATOM 0 HB2 ASP A 740 1.269 -15.725 -6.819 1.00 0.00 H new ATOM 0 HB3 ASP A 740 -0.397 -15.454 -7.290 1.00 0.00 H new ATOM 885 N SER A 741 0.449 -11.823 -8.365 1.00 0.00 N ATOM 886 CA SER A 741 -0.258 -10.857 -9.199 1.00 0.00 C ATOM 887 C SER A 741 0.716 -10.090 -10.085 1.00 0.00 C ATOM 888 O SER A 741 1.916 -10.048 -9.813 1.00 0.00 O ATOM 889 CB SER A 741 -1.053 -9.880 -8.331 1.00 0.00 C ATOM 890 OG SER A 741 -1.837 -9.015 -9.132 1.00 0.00 O ATOM 0 H SER A 741 1.465 -11.754 -8.413 1.00 0.00 H new ATOM 0 HA SER A 741 -0.950 -11.407 -9.838 1.00 0.00 H new ATOM 0 HB2 SER A 741 -1.698 -10.435 -7.649 1.00 0.00 H new ATOM 0 HB3 SER A 741 -0.369 -9.294 -7.717 1.00 0.00 H new ATOM 0 HG SER A 741 -2.774 -9.299 -9.100 1.00 0.00 H new ATOM 896 N SER A 742 0.192 -9.486 -11.145 1.00 0.00 N ATOM 897 CA SER A 742 1.016 -8.722 -12.073 1.00 0.00 C ATOM 898 C SER A 742 0.824 -7.224 -11.865 1.00 0.00 C ATOM 899 O SER A 742 1.792 -6.466 -11.816 1.00 0.00 O ATOM 900 CB SER A 742 0.676 -9.098 -13.517 1.00 0.00 C ATOM 901 OG SER A 742 0.845 -10.487 -13.737 1.00 0.00 O ATOM 0 H SER A 742 -0.800 -9.511 -11.383 1.00 0.00 H new ATOM 0 HA SER A 742 2.061 -8.965 -11.878 1.00 0.00 H new ATOM 0 HB2 SER A 742 -0.353 -8.815 -13.737 1.00 0.00 H new ATOM 0 HB3 SER A 742 1.314 -8.538 -14.201 1.00 0.00 H new ATOM 0 HG SER A 742 0.620 -10.701 -14.666 1.00 0.00 H new ATOM 907 N ILE A 743 -0.433 -6.801 -11.746 1.00 0.00 N ATOM 908 CA ILE A 743 -0.749 -5.395 -11.547 1.00 0.00 C ATOM 909 C ILE A 743 -1.664 -5.202 -10.348 1.00 0.00 C ATOM 910 O ILE A 743 -1.974 -4.076 -9.957 1.00 0.00 O ATOM 911 CB ILE A 743 -1.396 -4.799 -12.810 1.00 0.00 C ATOM 912 CG1 ILE A 743 -2.880 -5.170 -12.895 1.00 0.00 C ATOM 913 CG2 ILE A 743 -0.658 -5.298 -14.042 1.00 0.00 C ATOM 914 CD1 ILE A 743 -3.594 -4.557 -14.080 1.00 0.00 C ATOM 0 H ILE A 743 -1.247 -7.415 -11.784 1.00 0.00 H new ATOM 0 HA ILE A 743 0.186 -4.870 -11.351 1.00 0.00 H new ATOM 0 HB ILE A 743 -1.325 -3.713 -12.759 1.00 0.00 H new ATOM 0 HG12 ILE A 743 -2.972 -6.255 -12.948 1.00 0.00 H new ATOM 0 HG13 ILE A 743 -3.378 -4.853 -11.979 1.00 0.00 H new ATOM 0 HG21 ILE A 743 -1.116 -4.876 -14.936 1.00 0.00 H new ATOM 0 HG22 ILE A 743 0.386 -4.991 -13.990 1.00 0.00 H new ATOM 0 HG23 ILE A 743 -0.714 -6.386 -14.084 1.00 0.00 H new ATOM 0 HD11 ILE A 743 -4.640 -4.864 -14.074 1.00 0.00 H new ATOM 0 HD12 ILE A 743 -3.535 -3.470 -14.018 1.00 0.00 H new ATOM 0 HD13 ILE A 743 -3.122 -4.894 -15.003 1.00 0.00 H new ATOM 926 N LEU A 744 -2.094 -6.318 -9.778 1.00 0.00 N ATOM 927 CA LEU A 744 -2.963 -6.312 -8.608 1.00 0.00 C ATOM 928 C LEU A 744 -4.296 -5.621 -8.885 1.00 0.00 C ATOM 929 O LEU A 744 -5.046 -5.315 -7.958 1.00 0.00 O ATOM 930 CB LEU A 744 -2.266 -5.639 -7.423 1.00 0.00 C ATOM 931 CG LEU A 744 -1.988 -6.551 -6.227 1.00 0.00 C ATOM 932 CD1 LEU A 744 -1.349 -5.763 -5.094 1.00 0.00 C ATOM 933 CD2 LEU A 744 -3.270 -7.224 -5.753 1.00 0.00 C ATOM 0 H LEU A 744 -1.852 -7.251 -10.111 1.00 0.00 H new ATOM 0 HA LEU A 744 -3.172 -7.353 -8.362 1.00 0.00 H new ATOM 0 HB2 LEU A 744 -1.320 -5.221 -7.768 1.00 0.00 H new ATOM 0 HB3 LEU A 744 -2.880 -4.804 -7.087 1.00 0.00 H new ATOM 0 HG LEU A 744 -1.292 -7.328 -6.544 1.00 0.00 H new ATOM 0 HD11 LEU A 744 -1.158 -6.427 -4.251 1.00 0.00 H new ATOM 0 HD12 LEU A 744 -0.408 -5.331 -5.436 1.00 0.00 H new ATOM 0 HD13 LEU A 744 -2.022 -4.965 -4.781 1.00 0.00 H new ATOM 0 HD21 LEU A 744 -3.050 -7.868 -4.902 1.00 0.00 H new ATOM 0 HD22 LEU A 744 -3.992 -6.463 -5.455 1.00 0.00 H new ATOM 0 HD23 LEU A 744 -3.687 -7.823 -6.563 1.00 0.00 H new ATOM 945 N THR A 745 -4.590 -5.388 -10.161 1.00 0.00 N ATOM 946 CA THR A 745 -5.837 -4.734 -10.558 1.00 0.00 C ATOM 947 C THR A 745 -5.918 -3.312 -10.006 1.00 0.00 C ATOM 948 O THR A 745 -5.244 -2.973 -9.033 1.00 0.00 O ATOM 949 CB THR A 745 -7.065 -5.536 -10.080 1.00 0.00 C ATOM 950 OG1 THR A 745 -6.876 -6.929 -10.351 1.00 0.00 O ATOM 951 CG2 THR A 745 -8.333 -5.056 -10.768 1.00 0.00 C ATOM 0 H THR A 745 -3.982 -5.642 -10.940 1.00 0.00 H new ATOM 0 HA THR A 745 -5.841 -4.692 -11.647 1.00 0.00 H new ATOM 0 HB THR A 745 -7.171 -5.381 -9.006 1.00 0.00 H new ATOM 0 HG1 THR A 745 -7.659 -7.431 -10.043 1.00 0.00 H new ATOM 0 HG21 THR A 745 -9.183 -5.639 -10.412 1.00 0.00 H new ATOM 0 HG22 THR A 745 -8.494 -4.002 -10.540 1.00 0.00 H new ATOM 0 HG23 THR A 745 -8.232 -5.182 -11.846 1.00 0.00 H new ATOM 959 N ASP A 746 -6.742 -2.480 -10.637 1.00 0.00 N ATOM 960 CA ASP A 746 -6.909 -1.097 -10.204 1.00 0.00 C ATOM 961 C ASP A 746 -8.117 -0.954 -9.278 1.00 0.00 C ATOM 962 O ASP A 746 -7.960 -0.710 -8.083 1.00 0.00 O ATOM 963 CB ASP A 746 -7.051 -0.170 -11.415 1.00 0.00 C ATOM 964 CG ASP A 746 -8.058 -0.681 -12.428 1.00 0.00 C ATOM 965 OD1 ASP A 746 -7.725 -1.626 -13.173 1.00 0.00 O ATOM 966 OD2 ASP A 746 -9.180 -0.133 -12.478 1.00 0.00 O ATOM 0 H ASP A 746 -7.303 -2.739 -11.448 1.00 0.00 H new ATOM 0 HA ASP A 746 -6.019 -0.808 -9.646 1.00 0.00 H new ATOM 0 HB2 ASP A 746 -7.354 0.821 -11.076 1.00 0.00 H new ATOM 0 HB3 ASP A 746 -6.080 -0.059 -11.898 1.00 0.00 H new ATOM 971 N SER A 747 -9.314 -1.113 -9.841 1.00 0.00 N ATOM 972 CA SER A 747 -10.557 -1.004 -9.078 1.00 0.00 C ATOM 973 C SER A 747 -10.573 0.241 -8.194 1.00 0.00 C ATOM 974 O SER A 747 -10.103 0.216 -7.057 1.00 0.00 O ATOM 975 CB SER A 747 -10.776 -2.257 -8.225 1.00 0.00 C ATOM 976 OG SER A 747 -9.723 -2.433 -7.291 1.00 0.00 O ATOM 0 H SER A 747 -9.450 -1.319 -10.831 1.00 0.00 H new ATOM 0 HA SER A 747 -11.372 -0.914 -9.796 1.00 0.00 H new ATOM 0 HB2 SER A 747 -11.726 -2.178 -7.696 1.00 0.00 H new ATOM 0 HB3 SER A 747 -10.843 -3.133 -8.871 1.00 0.00 H new ATOM 0 HG SER A 747 -9.251 -1.583 -7.167 1.00 0.00 H new ATOM 982 N GLN A 748 -11.122 1.327 -8.726 1.00 0.00 N ATOM 983 CA GLN A 748 -11.203 2.581 -7.986 1.00 0.00 C ATOM 984 C GLN A 748 -12.533 2.691 -7.246 1.00 0.00 C ATOM 985 O GLN A 748 -12.907 3.766 -6.779 1.00 0.00 O ATOM 986 CB GLN A 748 -11.033 3.769 -8.935 1.00 0.00 C ATOM 987 CG GLN A 748 -12.036 3.788 -10.077 1.00 0.00 C ATOM 988 CD GLN A 748 -11.844 4.974 -11.003 1.00 0.00 C ATOM 989 OE1 GLN A 748 -10.731 5.472 -11.174 1.00 0.00 O ATOM 990 NE2 GLN A 748 -12.934 5.434 -11.607 1.00 0.00 N ATOM 0 H GLN A 748 -11.517 1.365 -9.666 1.00 0.00 H new ATOM 0 HA GLN A 748 -10.398 2.594 -7.252 1.00 0.00 H new ATOM 0 HB2 GLN A 748 -11.127 4.694 -8.366 1.00 0.00 H new ATOM 0 HB3 GLN A 748 -10.025 3.750 -9.349 1.00 0.00 H new ATOM 0 HG2 GLN A 748 -11.945 2.866 -10.651 1.00 0.00 H new ATOM 0 HG3 GLN A 748 -13.046 3.811 -9.668 1.00 0.00 H new ATOM 0 HE21 GLN A 748 -13.837 4.991 -11.437 1.00 0.00 H new ATOM 0 HE22 GLN A 748 -12.868 6.230 -12.241 1.00 0.00 H new ATOM 999 N THR A 749 -13.240 1.569 -7.138 1.00 0.00 N ATOM 1000 CA THR A 749 -14.528 1.545 -6.456 1.00 0.00 C ATOM 1001 C THR A 749 -14.361 1.355 -4.950 1.00 0.00 C ATOM 1002 O THR A 749 -15.330 1.091 -4.237 1.00 0.00 O ATOM 1003 CB THR A 749 -15.440 0.431 -7.011 1.00 0.00 C ATOM 1004 OG1 THR A 749 -16.724 0.483 -6.376 1.00 0.00 O ATOM 1005 CG2 THR A 749 -14.819 -0.942 -6.795 1.00 0.00 C ATOM 0 H THR A 749 -12.943 0.668 -7.513 1.00 0.00 H new ATOM 0 HA THR A 749 -14.996 2.512 -6.641 1.00 0.00 H new ATOM 0 HB THR A 749 -15.557 0.594 -8.082 1.00 0.00 H new ATOM 0 HG1 THR A 749 -16.616 0.759 -5.442 1.00 0.00 H new ATOM 0 HG21 THR A 749 -15.483 -1.709 -7.195 1.00 0.00 H new ATOM 0 HG22 THR A 749 -13.858 -0.991 -7.306 1.00 0.00 H new ATOM 0 HG23 THR A 749 -14.672 -1.111 -5.728 1.00 0.00 H new ATOM 1013 N ALA A 750 -13.130 1.499 -4.470 1.00 0.00 N ATOM 1014 CA ALA A 750 -12.845 1.347 -3.047 1.00 0.00 C ATOM 1015 C ALA A 750 -11.661 2.213 -2.627 1.00 0.00 C ATOM 1016 O ALA A 750 -10.517 1.764 -2.647 1.00 0.00 O ATOM 1017 CB ALA A 750 -12.578 -0.113 -2.714 1.00 0.00 C ATOM 0 H ALA A 750 -12.316 1.720 -5.043 1.00 0.00 H new ATOM 0 HA ALA A 750 -13.721 1.681 -2.490 1.00 0.00 H new ATOM 0 HB1 ALA A 750 -12.367 -0.211 -1.649 1.00 0.00 H new ATOM 0 HB2 ALA A 750 -13.454 -0.710 -2.966 1.00 0.00 H new ATOM 0 HB3 ALA A 750 -11.721 -0.466 -3.288 1.00 0.00 H new ATOM 1023 N THR A 751 -11.947 3.455 -2.247 1.00 0.00 N ATOM 1024 CA THR A 751 -10.904 4.381 -1.821 1.00 0.00 C ATOM 1025 C THR A 751 -10.717 4.338 -0.309 1.00 0.00 C ATOM 1026 O THR A 751 -9.662 4.707 0.202 1.00 0.00 O ATOM 1027 CB THR A 751 -11.220 5.828 -2.256 1.00 0.00 C ATOM 1028 OG1 THR A 751 -11.484 5.867 -3.663 1.00 0.00 O ATOM 1029 CG2 THR A 751 -10.063 6.767 -1.929 1.00 0.00 C ATOM 0 H THR A 751 -12.890 3.842 -2.226 1.00 0.00 H new ATOM 0 HA THR A 751 -9.981 4.063 -2.305 1.00 0.00 H new ATOM 0 HB THR A 751 -12.100 6.161 -1.706 1.00 0.00 H new ATOM 0 HG1 THR A 751 -11.686 6.787 -3.933 1.00 0.00 H new ATOM 0 HG21 THR A 751 -10.315 7.779 -2.247 1.00 0.00 H new ATOM 0 HG22 THR A 751 -9.881 6.759 -0.854 1.00 0.00 H new ATOM 0 HG23 THR A 751 -9.166 6.435 -2.452 1.00 0.00 H new ATOM 1037 N LYS A 752 -11.745 3.894 0.407 1.00 0.00 N ATOM 1038 CA LYS A 752 -11.667 3.793 1.862 1.00 0.00 C ATOM 1039 C LYS A 752 -10.578 2.803 2.249 1.00 0.00 C ATOM 1040 O LYS A 752 -9.660 3.125 3.004 1.00 0.00 O ATOM 1041 CB LYS A 752 -13.012 3.348 2.440 1.00 0.00 C ATOM 1042 CG LYS A 752 -14.170 4.256 2.057 1.00 0.00 C ATOM 1043 CD LYS A 752 -15.489 3.751 2.623 1.00 0.00 C ATOM 1044 CE LYS A 752 -15.895 2.423 1.999 1.00 0.00 C ATOM 1045 NZ LYS A 752 -16.063 2.531 0.524 1.00 0.00 N ATOM 0 H LYS A 752 -12.636 3.600 0.008 1.00 0.00 H new ATOM 0 HA LYS A 752 -11.423 4.773 2.271 1.00 0.00 H new ATOM 0 HB2 LYS A 752 -13.227 2.335 2.099 1.00 0.00 H new ATOM 0 HB3 LYS A 752 -12.936 3.309 3.527 1.00 0.00 H new ATOM 0 HG2 LYS A 752 -13.979 5.265 2.423 1.00 0.00 H new ATOM 0 HG3 LYS A 752 -14.240 4.319 0.971 1.00 0.00 H new ATOM 0 HD2 LYS A 752 -15.401 3.634 3.703 1.00 0.00 H new ATOM 0 HD3 LYS A 752 -16.269 4.491 2.445 1.00 0.00 H new ATOM 0 HE2 LYS A 752 -15.140 1.670 2.224 1.00 0.00 H new ATOM 0 HE3 LYS A 752 -16.828 2.082 2.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 752 -16.591 1.706 0.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 752 -16.588 3.400 0.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 752 -15.128 2.562 0.069 1.00 0.00 H new ATOM 1059 N ARG A 753 -10.695 1.593 1.716 1.00 0.00 N ATOM 1060 CA ARG A 753 -9.727 0.532 1.961 1.00 0.00 C ATOM 1061 C ARG A 753 -9.820 -0.515 0.858 1.00 0.00 C ATOM 1062 O ARG A 753 -10.810 -0.573 0.129 1.00 0.00 O ATOM 1063 CB ARG A 753 -9.949 -0.116 3.327 1.00 0.00 C ATOM 1064 CG ARG A 753 -8.979 0.368 4.394 1.00 0.00 C ATOM 1065 CD ARG A 753 -8.993 -0.551 5.606 1.00 0.00 C ATOM 1066 NE ARG A 753 -7.970 -0.192 6.584 1.00 0.00 N ATOM 1067 CZ ARG A 753 -7.767 -0.860 7.715 1.00 0.00 C ATOM 1068 NH1 ARG A 753 -8.514 -1.916 8.009 1.00 0.00 N ATOM 1069 NH2 ARG A 753 -6.815 -0.475 8.554 1.00 0.00 N ATOM 0 H ARG A 753 -11.463 1.320 1.102 1.00 0.00 H new ATOM 0 HA ARG A 753 -8.729 0.971 1.959 1.00 0.00 H new ATOM 0 HB2 ARG A 753 -10.968 0.087 3.655 1.00 0.00 H new ATOM 0 HB3 ARG A 753 -9.856 -1.197 3.227 1.00 0.00 H new ATOM 0 HG2 ARG A 753 -7.972 0.413 3.980 1.00 0.00 H new ATOM 0 HG3 ARG A 753 -9.244 1.380 4.699 1.00 0.00 H new ATOM 0 HD2 ARG A 753 -9.974 -0.511 6.078 1.00 0.00 H new ATOM 0 HD3 ARG A 753 -8.837 -1.580 5.281 1.00 0.00 H new ATOM 0 HE ARG A 753 -7.379 0.616 6.389 1.00 0.00 H new ATOM 0 HH11 ARG A 753 -9.247 -2.217 7.366 1.00 0.00 H new ATOM 0 HH12 ARG A 753 -8.356 -2.427 8.878 1.00 0.00 H new ATOM 0 HH21 ARG A 753 -6.237 0.335 8.332 1.00 0.00 H new ATOM 0 HH22 ARG A 753 -6.661 -0.989 9.421 1.00 0.00 H new ATOM 1083 N ILE A 754 -8.788 -1.340 0.739 1.00 0.00 N ATOM 1084 CA ILE A 754 -8.756 -2.374 -0.287 1.00 0.00 C ATOM 1085 C ILE A 754 -9.918 -3.352 -0.141 1.00 0.00 C ATOM 1086 O ILE A 754 -10.667 -3.301 0.835 1.00 0.00 O ATOM 1087 CB ILE A 754 -7.421 -3.142 -0.266 1.00 0.00 C ATOM 1088 CG1 ILE A 754 -7.107 -3.666 1.140 1.00 0.00 C ATOM 1089 CG2 ILE A 754 -6.299 -2.244 -0.758 1.00 0.00 C ATOM 1090 CD1 ILE A 754 -7.850 -4.933 1.507 1.00 0.00 C ATOM 0 H ILE A 754 -7.964 -1.314 1.339 1.00 0.00 H new ATOM 0 HA ILE A 754 -8.854 -1.867 -1.247 1.00 0.00 H new ATOM 0 HB ILE A 754 -7.509 -4.001 -0.931 1.00 0.00 H new ATOM 0 HG12 ILE A 754 -6.035 -3.851 1.216 1.00 0.00 H new ATOM 0 HG13 ILE A 754 -7.350 -2.891 1.868 1.00 0.00 H new ATOM 0 HG21 ILE A 754 -5.358 -2.794 -0.740 1.00 0.00 H new ATOM 0 HG22 ILE A 754 -6.512 -1.921 -1.777 1.00 0.00 H new ATOM 0 HG23 ILE A 754 -6.221 -1.371 -0.110 1.00 0.00 H new ATOM 0 HD11 ILE A 754 -7.573 -5.238 2.516 1.00 0.00 H new ATOM 0 HD12 ILE A 754 -8.924 -4.750 1.465 1.00 0.00 H new ATOM 0 HD13 ILE A 754 -7.589 -5.724 0.804 1.00 0.00 H new ATOM 1102 N ARG A 755 -10.058 -4.243 -1.118 1.00 0.00 N ATOM 1103 CA ARG A 755 -11.133 -5.230 -1.107 1.00 0.00 C ATOM 1104 C ARG A 755 -10.592 -6.644 -0.912 1.00 0.00 C ATOM 1105 O ARG A 755 -11.357 -7.585 -0.695 1.00 0.00 O ATOM 1106 CB ARG A 755 -11.938 -5.147 -2.408 1.00 0.00 C ATOM 1107 CG ARG A 755 -11.091 -4.874 -3.645 1.00 0.00 C ATOM 1108 CD ARG A 755 -10.243 -6.076 -4.030 1.00 0.00 C ATOM 1109 NE ARG A 755 -11.062 -7.227 -4.402 1.00 0.00 N ATOM 1110 CZ ARG A 755 -10.581 -8.311 -5.006 1.00 0.00 C ATOM 1111 NH1 ARG A 755 -9.290 -8.389 -5.302 1.00 0.00 N ATOM 1112 NH2 ARG A 755 -11.390 -9.316 -5.311 1.00 0.00 N ATOM 0 H ARG A 755 -9.440 -4.302 -1.928 1.00 0.00 H new ATOM 0 HA ARG A 755 -11.787 -5.004 -0.265 1.00 0.00 H new ATOM 0 HB2 ARG A 755 -12.478 -6.083 -2.549 1.00 0.00 H new ATOM 0 HB3 ARG A 755 -12.685 -4.360 -2.311 1.00 0.00 H new ATOM 0 HG2 ARG A 755 -11.741 -4.607 -4.478 1.00 0.00 H new ATOM 0 HG3 ARG A 755 -10.443 -4.017 -3.459 1.00 0.00 H new ATOM 0 HD2 ARG A 755 -9.593 -5.809 -4.863 1.00 0.00 H new ATOM 0 HD3 ARG A 755 -9.596 -6.346 -3.195 1.00 0.00 H new ATOM 0 HE ARG A 755 -12.059 -7.198 -4.187 1.00 0.00 H new ATOM 0 HH11 ARG A 755 -8.665 -7.618 -5.067 1.00 0.00 H new ATOM 0 HH12 ARG A 755 -8.922 -9.220 -5.765 1.00 0.00 H new ATOM 0 HH21 ARG A 755 -12.383 -9.259 -5.083 1.00 0.00 H new ATOM 0 HH22 ARG A 755 -11.020 -10.146 -5.774 1.00 0.00 H new ATOM 1126 N MET A 756 -9.273 -6.790 -0.988 1.00 0.00 N ATOM 1127 CA MET A 756 -8.637 -8.094 -0.823 1.00 0.00 C ATOM 1128 C MET A 756 -7.432 -7.996 0.106 1.00 0.00 C ATOM 1129 O MET A 756 -6.382 -7.477 -0.276 1.00 0.00 O ATOM 1130 CB MET A 756 -8.211 -8.650 -2.183 1.00 0.00 C ATOM 1131 CG MET A 756 -7.531 -10.007 -2.104 1.00 0.00 C ATOM 1132 SD MET A 756 -8.561 -11.261 -1.320 1.00 0.00 S ATOM 1133 CE MET A 756 -7.474 -12.682 -1.390 1.00 0.00 C ATOM 0 H MET A 756 -8.624 -6.023 -1.163 1.00 0.00 H new ATOM 0 HA MET A 756 -9.361 -8.773 -0.374 1.00 0.00 H new ATOM 0 HB2 MET A 756 -9.089 -8.731 -2.824 1.00 0.00 H new ATOM 0 HB3 MET A 756 -7.533 -7.941 -2.659 1.00 0.00 H new ATOM 0 HG2 MET A 756 -7.269 -10.336 -3.110 1.00 0.00 H new ATOM 0 HG3 MET A 756 -6.599 -9.909 -1.547 1.00 0.00 H new ATOM 0 HE1 MET A 756 -7.971 -13.542 -0.941 1.00 0.00 H new ATOM 0 HE2 MET A 756 -7.232 -12.904 -2.429 1.00 0.00 H new ATOM 0 HE3 MET A 756 -6.557 -12.466 -0.842 1.00 0.00 H new ATOM 1143 N ALA A 757 -7.590 -8.497 1.327 1.00 0.00 N ATOM 1144 CA ALA A 757 -6.518 -8.465 2.314 1.00 0.00 C ATOM 1145 C ALA A 757 -5.952 -9.861 2.552 1.00 0.00 C ATOM 1146 O ALA A 757 -6.522 -10.857 2.106 1.00 0.00 O ATOM 1147 CB ALA A 757 -7.018 -7.867 3.620 1.00 0.00 C ATOM 0 H ALA A 757 -8.452 -8.931 1.657 1.00 0.00 H new ATOM 0 HA ALA A 757 -5.717 -7.836 1.924 1.00 0.00 H new ATOM 0 HB1 ALA A 757 -6.206 -7.850 4.347 1.00 0.00 H new ATOM 0 HB2 ALA A 757 -7.369 -6.850 3.444 1.00 0.00 H new ATOM 0 HB3 ALA A 757 -7.838 -8.472 4.007 1.00 0.00 H new ATOM 1153 N ILE A 758 -4.830 -9.924 3.260 1.00 0.00 N ATOM 1154 CA ILE A 758 -4.184 -11.196 3.559 1.00 0.00 C ATOM 1155 C ILE A 758 -4.996 -12.004 4.565 1.00 0.00 C ATOM 1156 O ILE A 758 -6.013 -11.536 5.078 1.00 0.00 O ATOM 1157 CB ILE A 758 -2.762 -10.984 4.114 1.00 0.00 C ATOM 1158 CG1 ILE A 758 -2.804 -10.098 5.363 1.00 0.00 C ATOM 1159 CG2 ILE A 758 -1.868 -10.371 3.045 1.00 0.00 C ATOM 1160 CD1 ILE A 758 -1.459 -9.933 6.040 1.00 0.00 C ATOM 0 H ILE A 758 -4.349 -9.108 3.638 1.00 0.00 H new ATOM 0 HA ILE A 758 -4.123 -11.749 2.621 1.00 0.00 H new ATOM 0 HB ILE A 758 -2.346 -11.951 4.397 1.00 0.00 H new ATOM 0 HG12 ILE A 758 -3.185 -9.115 5.087 1.00 0.00 H new ATOM 0 HG13 ILE A 758 -3.510 -10.524 6.076 1.00 0.00 H new ATOM 0 HG21 ILE A 758 -0.866 -10.226 3.448 1.00 0.00 H new ATOM 0 HG22 ILE A 758 -1.820 -11.038 2.185 1.00 0.00 H new ATOM 0 HG23 ILE A 758 -2.278 -9.409 2.736 1.00 0.00 H new ATOM 0 HD11 ILE A 758 -1.568 -9.293 6.916 1.00 0.00 H new ATOM 0 HD12 ILE A 758 -1.085 -10.909 6.348 1.00 0.00 H new ATOM 0 HD13 ILE A 758 -0.755 -9.478 5.344 1.00 0.00 H new ATOM 1172 N ASN A 759 -4.538 -13.221 4.842 1.00 0.00 N ATOM 1173 CA ASN A 759 -5.219 -14.100 5.786 1.00 0.00 C ATOM 1174 C ASN A 759 -4.418 -14.228 7.078 1.00 0.00 C ATOM 1175 O ASN A 759 -3.531 -15.106 7.139 1.00 0.00 O ATOM 1176 CB ASN A 759 -5.433 -15.480 5.162 1.00 0.00 C ATOM 1177 CG ASN A 759 -6.346 -16.364 5.990 1.00 0.00 C ATOM 1178 OD1 ASN A 759 -6.438 -16.218 7.210 1.00 0.00 O ATOM 1179 ND2 ASN A 759 -7.027 -17.293 5.329 1.00 0.00 N ATOM 1180 OXT ASN A 759 -4.684 -13.449 8.017 1.00 0.00 O ATOM 0 H ASN A 759 -3.697 -13.621 4.426 1.00 0.00 H new ATOM 0 HA ASN A 759 -6.189 -13.663 6.023 1.00 0.00 H new ATOM 0 HB2 ASN A 759 -5.856 -15.361 4.165 1.00 0.00 H new ATOM 0 HB3 ASN A 759 -4.468 -15.973 5.042 1.00 0.00 H new ATOM 0 HD21 ASN A 759 -7.655 -17.919 5.832 1.00 0.00 H new ATOM 0 HD22 ASN A 759 -6.922 -17.380 4.318 1.00 0.00 H new TER 1187 ASN A 759