USER MOD reduce.3.24.130724 H: found=0, std=0, add=609, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 610 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 738 LYS NZ :NH3+ 173:sc= -0.0011 (180deg=-0.048) USER MOD Set 1.2: A 756 MET CE :methyl -147:sc= -0.413 (180deg=-1.02) USER MOD Set 2.1: A 704 TYR OH : rot 130:sc= -0.555 USER MOD Set 2.2: A 721 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 688 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 745 THR OG1 : rot 180:sc= 0 USER MOD Single : A 699 LYS NZ :NH3+ 165:sc= -0.0823 (180deg=-0.354) USER MOD Single : A 709 SER OG : rot 180:sc= -0.0627 USER MOD Single : A 711 ASN : amide:sc= -1.23! K(o=-1.2!,f=-0.04) USER MOD Single : A 714 SER OG : rot -13:sc= 0.248 USER MOD Single : A 715 ASN : amide:sc= -0.976 K(o=-0.98,f=0) USER MOD Single : A 718 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 723 ASN : amide:sc= -2.12 K(o=-2.1,f=-3.1!) USER MOD Single : A 728 GLN : amide:sc= -1.06 K(o=-1.1,f=-0.0023) USER MOD Single : A 735 MET CE :methyl -171:sc= -4.34! (180deg=-4.47!) USER MOD Single : A 736 LYS NZ :NH3+ -106:sc= -6.71! (180deg=-7.3!) USER MOD Single : A 741 SER OG : rot 100:sc= -0.942 USER MOD Single : A 742 SER OG : rot 180:sc= 0 USER MOD Single : A 747 SER OG : rot -71:sc= -0.94! USER MOD Single : A 748 GLN : amide:sc= -1.09 K(o=-1.1,f=0) USER MOD Single : A 749 THR OG1 : rot -39:sc= 0.518 USER MOD Single : A 751 THR OG1 : rot 62:sc= 0.278 USER MOD Single : A 752 LYS NZ :NH3+ -167:sc= -0.0542 (180deg=-0.285) USER MOD Single : A 759 ASN : amide:sc= -0.0411 X(o=-0.041,f=0) USER MOD ----------------------------------------------------------------- ATOM 8 N VAL A 686 -5.555 4.062 -11.064 1.00 0.00 N ATOM 9 CA VAL A 686 -4.982 5.399 -10.970 1.00 0.00 C ATOM 10 C VAL A 686 -3.708 5.394 -10.133 1.00 0.00 C ATOM 11 O VAL A 686 -2.601 5.340 -10.667 1.00 0.00 O ATOM 12 CB VAL A 686 -5.998 6.389 -10.374 1.00 0.00 C ATOM 13 CG1 VAL A 686 -5.367 7.758 -10.159 1.00 0.00 C ATOM 14 CG2 VAL A 686 -7.222 6.496 -11.271 1.00 0.00 C ATOM 0 HA VAL A 686 -4.730 5.720 -11.981 1.00 0.00 H new ATOM 0 HB VAL A 686 -6.312 6.010 -9.402 1.00 0.00 H new ATOM 0 HG11 VAL A 686 -6.107 8.438 -9.737 1.00 0.00 H new ATOM 0 HG12 VAL A 686 -4.525 7.667 -9.473 1.00 0.00 H new ATOM 0 HG13 VAL A 686 -5.016 8.151 -11.113 1.00 0.00 H new ATOM 0 HG21 VAL A 686 -7.931 7.200 -10.836 1.00 0.00 H new ATOM 0 HG22 VAL A 686 -6.920 6.848 -12.258 1.00 0.00 H new ATOM 0 HG23 VAL A 686 -7.692 5.517 -11.363 1.00 0.00 H new ATOM 24 N GLU A 687 -3.877 5.455 -8.821 1.00 0.00 N ATOM 25 CA GLU A 687 -2.751 5.446 -7.896 1.00 0.00 C ATOM 26 C GLU A 687 -1.894 4.198 -8.099 1.00 0.00 C ATOM 27 O GLU A 687 -0.666 4.269 -8.083 1.00 0.00 O ATOM 28 CB GLU A 687 -3.249 5.507 -6.451 1.00 0.00 C ATOM 29 CG GLU A 687 -4.290 4.452 -6.118 1.00 0.00 C ATOM 30 CD GLU A 687 -4.728 4.504 -4.667 1.00 0.00 C ATOM 31 OE1 GLU A 687 -5.583 5.352 -4.337 1.00 0.00 O ATOM 32 OE2 GLU A 687 -4.218 3.695 -3.864 1.00 0.00 O ATOM 0 H GLU A 687 -4.790 5.512 -8.369 1.00 0.00 H new ATOM 0 HA GLU A 687 -2.139 6.325 -8.098 1.00 0.00 H new ATOM 0 HB2 GLU A 687 -2.399 5.391 -5.778 1.00 0.00 H new ATOM 0 HB3 GLU A 687 -3.672 6.494 -6.263 1.00 0.00 H new ATOM 0 HG2 GLU A 687 -5.159 4.588 -6.761 1.00 0.00 H new ATOM 0 HG3 GLU A 687 -3.884 3.464 -6.336 1.00 0.00 H new ATOM 39 N SER A 688 -2.553 3.060 -8.292 1.00 0.00 N ATOM 40 CA SER A 688 -1.853 1.797 -8.503 1.00 0.00 C ATOM 41 C SER A 688 -1.367 1.682 -9.943 1.00 0.00 C ATOM 42 O SER A 688 -0.405 0.971 -10.224 1.00 0.00 O ATOM 43 CB SER A 688 -2.761 0.613 -8.163 1.00 0.00 C ATOM 44 OG SER A 688 -3.934 0.624 -8.956 1.00 0.00 O ATOM 0 H SER A 688 -3.570 2.986 -8.307 1.00 0.00 H new ATOM 0 HA SER A 688 -0.988 1.778 -7.840 1.00 0.00 H new ATOM 0 HB2 SER A 688 -2.221 -0.320 -8.321 1.00 0.00 H new ATOM 0 HB3 SER A 688 -3.032 0.650 -7.108 1.00 0.00 H new ATOM 0 HG SER A 688 -4.496 -0.144 -8.720 1.00 0.00 H new ATOM 50 N ALA A 689 -2.049 2.373 -10.853 1.00 0.00 N ATOM 51 CA ALA A 689 -1.683 2.351 -12.265 1.00 0.00 C ATOM 52 C ALA A 689 -0.218 2.733 -12.459 1.00 0.00 C ATOM 53 O ALA A 689 0.562 1.966 -13.021 1.00 0.00 O ATOM 54 CB ALA A 689 -2.584 3.282 -13.061 1.00 0.00 C ATOM 0 H ALA A 689 -2.858 2.955 -10.637 1.00 0.00 H new ATOM 0 HA ALA A 689 -1.818 1.334 -12.633 1.00 0.00 H new ATOM 0 HB1 ALA A 689 -2.298 3.254 -14.112 1.00 0.00 H new ATOM 0 HB2 ALA A 689 -3.621 2.961 -12.958 1.00 0.00 H new ATOM 0 HB3 ALA A 689 -2.480 4.299 -12.684 1.00 0.00 H new ATOM 60 N VAL A 690 0.148 3.923 -11.988 1.00 0.00 N ATOM 61 CA VAL A 690 1.522 4.403 -12.102 1.00 0.00 C ATOM 62 C VAL A 690 2.480 3.496 -11.340 1.00 0.00 C ATOM 63 O VAL A 690 3.517 3.083 -11.859 1.00 0.00 O ATOM 64 CB VAL A 690 1.664 5.837 -11.556 1.00 0.00 C ATOM 65 CG1 VAL A 690 0.928 6.829 -12.441 1.00 0.00 C ATOM 66 CG2 VAL A 690 1.160 5.918 -10.122 1.00 0.00 C ATOM 0 H VAL A 690 -0.488 4.572 -11.524 1.00 0.00 H new ATOM 0 HA VAL A 690 1.772 4.396 -13.163 1.00 0.00 H new ATOM 0 HB VAL A 690 2.722 6.099 -11.562 1.00 0.00 H new ATOM 0 HG11 VAL A 690 1.043 7.834 -12.035 1.00 0.00 H new ATOM 0 HG12 VAL A 690 1.343 6.795 -13.448 1.00 0.00 H new ATOM 0 HG13 VAL A 690 -0.130 6.570 -12.475 1.00 0.00 H new ATOM 0 HG21 VAL A 690 1.269 6.939 -9.755 1.00 0.00 H new ATOM 0 HG22 VAL A 690 0.109 5.631 -10.089 1.00 0.00 H new ATOM 0 HG23 VAL A 690 1.741 5.243 -9.494 1.00 0.00 H new ATOM 76 N LEU A 691 2.115 3.200 -10.100 1.00 0.00 N ATOM 77 CA LEU A 691 2.913 2.351 -9.229 1.00 0.00 C ATOM 78 C LEU A 691 3.217 1.008 -9.886 1.00 0.00 C ATOM 79 O LEU A 691 4.309 0.462 -9.730 1.00 0.00 O ATOM 80 CB LEU A 691 2.169 2.134 -7.912 1.00 0.00 C ATOM 81 CG LEU A 691 2.529 3.101 -6.778 1.00 0.00 C ATOM 82 CD1 LEU A 691 2.366 4.546 -7.221 1.00 0.00 C ATOM 83 CD2 LEU A 691 1.667 2.825 -5.556 1.00 0.00 C ATOM 0 H LEU A 691 1.256 3.543 -9.670 1.00 0.00 H new ATOM 0 HA LEU A 691 3.863 2.850 -9.039 1.00 0.00 H new ATOM 0 HB2 LEU A 691 1.099 2.210 -8.104 1.00 0.00 H new ATOM 0 HB3 LEU A 691 2.360 1.116 -7.571 1.00 0.00 H new ATOM 0 HG LEU A 691 3.575 2.942 -6.516 1.00 0.00 H new ATOM 0 HD11 LEU A 691 2.628 5.211 -6.398 1.00 0.00 H new ATOM 0 HD12 LEU A 691 3.022 4.743 -8.069 1.00 0.00 H new ATOM 0 HD13 LEU A 691 1.331 4.722 -7.514 1.00 0.00 H new ATOM 0 HD21 LEU A 691 1.933 3.519 -4.759 1.00 0.00 H new ATOM 0 HD22 LEU A 691 0.616 2.956 -5.815 1.00 0.00 H new ATOM 0 HD23 LEU A 691 1.833 1.802 -5.217 1.00 0.00 H new ATOM 95 N ARG A 692 2.241 0.484 -10.620 1.00 0.00 N ATOM 96 CA ARG A 692 2.388 -0.795 -11.306 1.00 0.00 C ATOM 97 C ARG A 692 2.796 -1.909 -10.344 1.00 0.00 C ATOM 98 O ARG A 692 3.975 -2.245 -10.239 1.00 0.00 O ATOM 99 CB ARG A 692 3.415 -0.682 -12.432 1.00 0.00 C ATOM 100 CG ARG A 692 2.994 0.263 -13.541 1.00 0.00 C ATOM 101 CD ARG A 692 3.957 0.207 -14.710 1.00 0.00 C ATOM 102 NE ARG A 692 3.932 -1.092 -15.376 1.00 0.00 N ATOM 103 CZ ARG A 692 4.658 -1.388 -16.450 1.00 0.00 C ATOM 104 NH1 ARG A 692 5.473 -0.482 -16.975 1.00 0.00 N ATOM 105 NH2 ARG A 692 4.572 -2.591 -16.999 1.00 0.00 N ATOM 0 H ARG A 692 1.333 0.929 -10.756 1.00 0.00 H new ATOM 0 HA ARG A 692 1.416 -1.052 -11.727 1.00 0.00 H new ATOM 0 HB2 ARG A 692 4.363 -0.342 -12.016 1.00 0.00 H new ATOM 0 HB3 ARG A 692 3.589 -1.671 -12.855 1.00 0.00 H new ATOM 0 HG2 ARG A 692 1.991 0.004 -13.881 1.00 0.00 H new ATOM 0 HG3 ARG A 692 2.947 1.281 -13.155 1.00 0.00 H new ATOM 0 HD2 ARG A 692 3.703 0.987 -15.427 1.00 0.00 H new ATOM 0 HD3 ARG A 692 4.967 0.415 -14.358 1.00 0.00 H new ATOM 0 HE ARG A 692 3.322 -1.815 -14.995 1.00 0.00 H new ATOM 0 HH11 ARG A 692 5.544 0.445 -16.555 1.00 0.00 H new ATOM 0 HH12 ARG A 692 6.029 -0.712 -17.799 1.00 0.00 H new ATOM 0 HH21 ARG A 692 3.948 -3.291 -16.598 1.00 0.00 H new ATOM 0 HH22 ARG A 692 5.129 -2.817 -17.823 1.00 0.00 H new ATOM 119 N GLY A 693 1.819 -2.474 -9.636 1.00 0.00 N ATOM 120 CA GLY A 693 2.115 -3.556 -8.711 1.00 0.00 C ATOM 121 C GLY A 693 1.573 -3.327 -7.310 1.00 0.00 C ATOM 122 O GLY A 693 2.013 -3.980 -6.364 1.00 0.00 O ATOM 0 H GLY A 693 0.836 -2.205 -9.686 1.00 0.00 H new ATOM 0 HA2 GLY A 693 1.699 -4.483 -9.105 1.00 0.00 H new ATOM 0 HA3 GLY A 693 3.195 -3.690 -8.656 1.00 0.00 H new ATOM 126 N PHE A 694 0.626 -2.404 -7.167 1.00 0.00 N ATOM 127 CA PHE A 694 0.038 -2.120 -5.861 1.00 0.00 C ATOM 128 C PHE A 694 -1.486 -2.169 -5.913 1.00 0.00 C ATOM 129 O PHE A 694 -2.087 -2.140 -6.986 1.00 0.00 O ATOM 130 CB PHE A 694 0.482 -0.748 -5.356 1.00 0.00 C ATOM 131 CG PHE A 694 1.942 -0.662 -5.022 1.00 0.00 C ATOM 132 CD1 PHE A 694 2.886 -0.535 -6.023 1.00 0.00 C ATOM 133 CD2 PHE A 694 2.370 -0.681 -3.706 1.00 0.00 C ATOM 134 CE1 PHE A 694 4.226 -0.433 -5.723 1.00 0.00 C ATOM 135 CE2 PHE A 694 3.710 -0.584 -3.400 1.00 0.00 C ATOM 136 CZ PHE A 694 4.638 -0.457 -4.407 1.00 0.00 C ATOM 0 H PHE A 694 0.252 -1.844 -7.933 1.00 0.00 H new ATOM 0 HA PHE A 694 0.389 -2.891 -5.175 1.00 0.00 H new ATOM 0 HB2 PHE A 694 0.249 -0.001 -6.114 1.00 0.00 H new ATOM 0 HB3 PHE A 694 -0.098 -0.494 -4.469 1.00 0.00 H new ATOM 0 HD1 PHE A 694 2.568 -0.515 -7.055 1.00 0.00 H new ATOM 0 HD2 PHE A 694 1.646 -0.773 -2.910 1.00 0.00 H new ATOM 0 HE1 PHE A 694 4.952 -0.334 -6.516 1.00 0.00 H new ATOM 0 HE2 PHE A 694 4.032 -0.608 -2.369 1.00 0.00 H new ATOM 0 HZ PHE A 694 5.688 -0.376 -4.168 1.00 0.00 H new ATOM 146 N LEU A 695 -2.097 -2.240 -4.735 1.00 0.00 N ATOM 147 CA LEU A 695 -3.552 -2.281 -4.607 1.00 0.00 C ATOM 148 C LEU A 695 -4.064 -0.950 -4.078 1.00 0.00 C ATOM 149 O LEU A 695 -3.298 -0.163 -3.530 1.00 0.00 O ATOM 150 CB LEU A 695 -3.967 -3.391 -3.645 1.00 0.00 C ATOM 151 CG LEU A 695 -4.456 -4.687 -4.293 1.00 0.00 C ATOM 152 CD1 LEU A 695 -4.689 -5.747 -3.228 1.00 0.00 C ATOM 153 CD2 LEU A 695 -5.734 -4.441 -5.080 1.00 0.00 C ATOM 0 H LEU A 695 -1.601 -2.271 -3.844 1.00 0.00 H new ATOM 0 HA LEU A 695 -3.980 -2.475 -5.591 1.00 0.00 H new ATOM 0 HB2 LEU A 695 -3.118 -3.626 -3.004 1.00 0.00 H new ATOM 0 HB3 LEU A 695 -4.758 -3.009 -2.999 1.00 0.00 H new ATOM 0 HG LEU A 695 -3.690 -5.042 -4.983 1.00 0.00 H new ATOM 0 HD11 LEU A 695 -5.037 -6.666 -3.699 1.00 0.00 H new ATOM 0 HD12 LEU A 695 -3.757 -5.942 -2.698 1.00 0.00 H new ATOM 0 HD13 LEU A 695 -5.441 -5.394 -2.522 1.00 0.00 H new ATOM 0 HD21 LEU A 695 -6.067 -5.374 -5.534 1.00 0.00 H new ATOM 0 HD22 LEU A 695 -6.508 -4.067 -4.410 1.00 0.00 H new ATOM 0 HD23 LEU A 695 -5.544 -3.705 -5.861 1.00 0.00 H new ATOM 165 N ILE A 696 -5.359 -0.698 -4.225 1.00 0.00 N ATOM 166 CA ILE A 696 -5.926 0.552 -3.740 1.00 0.00 C ATOM 167 C ILE A 696 -6.401 0.420 -2.301 1.00 0.00 C ATOM 168 O ILE A 696 -7.448 -0.170 -2.032 1.00 0.00 O ATOM 169 CB ILE A 696 -7.098 1.045 -4.618 1.00 0.00 C ATOM 170 CG1 ILE A 696 -6.576 1.493 -5.988 1.00 0.00 C ATOM 171 CG2 ILE A 696 -7.846 2.182 -3.924 1.00 0.00 C ATOM 172 CD1 ILE A 696 -7.599 2.245 -6.814 1.00 0.00 C ATOM 0 H ILE A 696 -6.025 -1.330 -4.668 1.00 0.00 H new ATOM 0 HA ILE A 696 -5.125 1.289 -3.793 1.00 0.00 H new ATOM 0 HB ILE A 696 -7.797 0.222 -4.766 1.00 0.00 H new ATOM 0 HG12 ILE A 696 -5.701 2.127 -5.844 1.00 0.00 H new ATOM 0 HG13 ILE A 696 -6.246 0.616 -6.545 1.00 0.00 H new ATOM 0 HG21 ILE A 696 -8.668 2.516 -4.557 1.00 0.00 H new ATOM 0 HG22 ILE A 696 -8.242 1.829 -2.972 1.00 0.00 H new ATOM 0 HG23 ILE A 696 -7.163 3.013 -3.748 1.00 0.00 H new ATOM 0 HD11 ILE A 696 -7.157 2.529 -7.769 1.00 0.00 H new ATOM 0 HD12 ILE A 696 -8.465 1.607 -6.990 1.00 0.00 H new ATOM 0 HD13 ILE A 696 -7.912 3.141 -6.278 1.00 0.00 H new ATOM 184 N LEU A 697 -5.622 0.977 -1.380 1.00 0.00 N ATOM 185 CA LEU A 697 -5.978 0.950 0.028 1.00 0.00 C ATOM 186 C LEU A 697 -6.896 2.128 0.315 1.00 0.00 C ATOM 187 O LEU A 697 -8.105 2.042 0.114 1.00 0.00 O ATOM 188 CB LEU A 697 -4.719 0.996 0.906 1.00 0.00 C ATOM 189 CG LEU A 697 -4.867 0.451 2.332 1.00 0.00 C ATOM 190 CD1 LEU A 697 -5.748 1.359 3.168 1.00 0.00 C ATOM 191 CD2 LEU A 697 -5.423 -0.963 2.318 1.00 0.00 C ATOM 0 H LEU A 697 -4.742 1.451 -1.586 1.00 0.00 H new ATOM 0 HA LEU A 697 -6.498 0.022 0.264 1.00 0.00 H new ATOM 0 HB2 LEU A 697 -3.931 0.434 0.405 1.00 0.00 H new ATOM 0 HB3 LEU A 697 -4.382 2.031 0.968 1.00 0.00 H new ATOM 0 HG LEU A 697 -3.876 0.424 2.784 1.00 0.00 H new ATOM 0 HD11 LEU A 697 -5.838 0.952 4.175 1.00 0.00 H new ATOM 0 HD12 LEU A 697 -5.303 2.353 3.217 1.00 0.00 H new ATOM 0 HD13 LEU A 697 -6.737 1.426 2.714 1.00 0.00 H new ATOM 0 HD21 LEU A 697 -5.518 -1.327 3.341 1.00 0.00 H new ATOM 0 HD22 LEU A 697 -6.402 -0.964 1.840 1.00 0.00 H new ATOM 0 HD23 LEU A 697 -4.748 -1.614 1.763 1.00 0.00 H new ATOM 203 N GLY A 698 -6.319 3.234 0.762 1.00 0.00 N ATOM 204 CA GLY A 698 -7.123 4.412 1.029 1.00 0.00 C ATOM 205 C GLY A 698 -6.378 5.495 1.784 1.00 0.00 C ATOM 206 O GLY A 698 -5.170 5.405 1.986 1.00 0.00 O ATOM 0 H GLY A 698 -5.321 3.338 0.943 1.00 0.00 H new ATOM 0 HA2 GLY A 698 -7.481 4.820 0.084 1.00 0.00 H new ATOM 0 HA3 GLY A 698 -8.002 4.119 1.603 1.00 0.00 H new ATOM 210 N LYS A 699 -7.112 6.528 2.187 1.00 0.00 N ATOM 211 CA LYS A 699 -6.542 7.645 2.936 1.00 0.00 C ATOM 212 C LYS A 699 -6.844 7.489 4.420 1.00 0.00 C ATOM 213 O LYS A 699 -7.623 8.246 5.001 1.00 0.00 O ATOM 214 CB LYS A 699 -7.090 8.976 2.419 1.00 0.00 C ATOM 215 CG LYS A 699 -8.561 8.920 2.038 1.00 0.00 C ATOM 216 CD LYS A 699 -9.058 10.256 1.510 1.00 0.00 C ATOM 217 CE LYS A 699 -8.383 10.627 0.198 1.00 0.00 C ATOM 218 NZ LYS A 699 -8.614 9.600 -0.854 1.00 0.00 N ATOM 0 H LYS A 699 -8.112 6.615 2.006 1.00 0.00 H new ATOM 0 HA LYS A 699 -5.461 7.641 2.795 1.00 0.00 H new ATOM 0 HB2 LYS A 699 -6.950 9.739 3.184 1.00 0.00 H new ATOM 0 HB3 LYS A 699 -6.509 9.286 1.550 1.00 0.00 H new ATOM 0 HG2 LYS A 699 -8.711 8.151 1.280 1.00 0.00 H new ATOM 0 HG3 LYS A 699 -9.151 8.630 2.908 1.00 0.00 H new ATOM 0 HD2 LYS A 699 -10.137 10.211 1.364 1.00 0.00 H new ATOM 0 HD3 LYS A 699 -8.868 11.034 2.250 1.00 0.00 H new ATOM 0 HE2 LYS A 699 -8.761 11.590 -0.145 1.00 0.00 H new ATOM 0 HE3 LYS A 699 -7.312 10.745 0.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 699 -8.366 9.994 -1.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 699 -8.022 8.767 -0.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 699 -9.616 9.321 -0.852 1.00 0.00 H new ATOM 232 N GLU A 700 -6.215 6.490 5.016 1.00 0.00 N ATOM 233 CA GLU A 700 -6.393 6.178 6.425 1.00 0.00 C ATOM 234 C GLU A 700 -5.160 5.470 6.945 1.00 0.00 C ATOM 235 O GLU A 700 -4.114 5.508 6.315 1.00 0.00 O ATOM 236 CB GLU A 700 -7.621 5.295 6.636 1.00 0.00 C ATOM 237 CG GLU A 700 -7.591 4.018 5.814 1.00 0.00 C ATOM 238 CD GLU A 700 -8.732 3.080 6.151 1.00 0.00 C ATOM 239 OE1 GLU A 700 -9.815 3.217 5.544 1.00 0.00 O ATOM 240 OE2 GLU A 700 -8.544 2.206 7.023 1.00 0.00 O ATOM 0 H GLU A 700 -5.564 5.870 4.535 1.00 0.00 H new ATOM 0 HA GLU A 700 -6.542 7.110 6.971 1.00 0.00 H new ATOM 0 HB2 GLU A 700 -7.697 5.037 7.692 1.00 0.00 H new ATOM 0 HB3 GLU A 700 -8.516 5.862 6.381 1.00 0.00 H new ATOM 0 HG2 GLU A 700 -7.635 4.271 4.755 1.00 0.00 H new ATOM 0 HG3 GLU A 700 -6.643 3.506 5.980 1.00 0.00 H new ATOM 247 N ASP A 701 -5.259 4.887 8.127 1.00 0.00 N ATOM 248 CA ASP A 701 -4.132 4.153 8.686 1.00 0.00 C ATOM 249 C ASP A 701 -2.893 5.042 8.719 1.00 0.00 C ATOM 250 O ASP A 701 -1.807 4.641 8.297 1.00 0.00 O ATOM 251 CB ASP A 701 -3.881 2.897 7.841 1.00 0.00 C ATOM 252 CG ASP A 701 -3.001 1.883 8.545 1.00 0.00 C ATOM 253 OD1 ASP A 701 -2.079 2.299 9.276 1.00 0.00 O ATOM 254 OD2 ASP A 701 -3.238 0.670 8.370 1.00 0.00 O ATOM 0 H ASP A 701 -6.094 4.905 8.713 1.00 0.00 H new ATOM 0 HA ASP A 701 -4.358 3.852 9.709 1.00 0.00 H new ATOM 0 HB2 ASP A 701 -4.836 2.433 7.594 1.00 0.00 H new ATOM 0 HB3 ASP A 701 -3.414 3.185 6.899 1.00 0.00 H new ATOM 259 N ARG A 702 -3.073 6.259 9.220 1.00 0.00 N ATOM 260 CA ARG A 702 -1.989 7.225 9.310 1.00 0.00 C ATOM 261 C ARG A 702 -0.968 6.807 10.362 1.00 0.00 C ATOM 262 O ARG A 702 0.092 7.422 10.488 1.00 0.00 O ATOM 263 CB ARG A 702 -2.538 8.617 9.637 1.00 0.00 C ATOM 264 CG ARG A 702 -3.438 9.193 8.552 1.00 0.00 C ATOM 265 CD ARG A 702 -4.847 8.622 8.624 1.00 0.00 C ATOM 266 NE ARG A 702 -5.499 8.932 9.894 1.00 0.00 N ATOM 267 CZ ARG A 702 -6.689 8.456 10.248 1.00 0.00 C ATOM 268 NH1 ARG A 702 -7.354 7.651 9.431 1.00 0.00 N ATOM 269 NH2 ARG A 702 -7.214 8.785 11.421 1.00 0.00 N ATOM 0 H ARG A 702 -3.968 6.600 9.572 1.00 0.00 H new ATOM 0 HA ARG A 702 -1.490 7.259 8.342 1.00 0.00 H new ATOM 0 HB2 ARG A 702 -3.097 8.567 10.571 1.00 0.00 H new ATOM 0 HB3 ARG A 702 -1.703 9.297 9.802 1.00 0.00 H new ATOM 0 HG2 ARG A 702 -3.480 10.278 8.652 1.00 0.00 H new ATOM 0 HG3 ARG A 702 -3.009 8.980 7.573 1.00 0.00 H new ATOM 0 HD2 ARG A 702 -5.443 9.022 7.804 1.00 0.00 H new ATOM 0 HD3 ARG A 702 -4.807 7.541 8.491 1.00 0.00 H new ATOM 0 HE ARG A 702 -5.014 9.548 10.546 1.00 0.00 H new ATOM 0 HH11 ARG A 702 -6.953 7.396 8.529 1.00 0.00 H new ATOM 0 HH12 ARG A 702 -8.267 7.287 9.705 1.00 0.00 H new ATOM 0 HH21 ARG A 702 -6.705 9.404 12.052 1.00 0.00 H new ATOM 0 HH22 ARG A 702 -8.127 8.419 11.692 1.00 0.00 H new ATOM 283 N ARG A 703 -1.292 5.760 11.117 1.00 0.00 N ATOM 284 CA ARG A 703 -0.394 5.267 12.155 1.00 0.00 C ATOM 285 C ARG A 703 0.929 4.805 11.551 1.00 0.00 C ATOM 286 O ARG A 703 1.926 4.664 12.258 1.00 0.00 O ATOM 287 CB ARG A 703 -1.047 4.126 12.938 1.00 0.00 C ATOM 288 CG ARG A 703 -1.353 2.900 12.096 1.00 0.00 C ATOM 289 CD ARG A 703 -1.850 1.749 12.955 1.00 0.00 C ATOM 290 NE ARG A 703 -0.861 1.348 13.952 1.00 0.00 N ATOM 291 CZ ARG A 703 -1.148 0.618 15.025 1.00 0.00 C ATOM 292 NH1 ARG A 703 -2.389 0.201 15.236 1.00 0.00 N ATOM 293 NH2 ARG A 703 -0.191 0.303 15.886 1.00 0.00 N ATOM 0 H ARG A 703 -2.165 5.240 11.029 1.00 0.00 H new ATOM 0 HA ARG A 703 -0.191 6.088 12.843 1.00 0.00 H new ATOM 0 HB2 ARG A 703 -0.389 3.837 13.757 1.00 0.00 H new ATOM 0 HB3 ARG A 703 -1.973 4.488 13.385 1.00 0.00 H new ATOM 0 HG2 ARG A 703 -2.105 3.149 11.348 1.00 0.00 H new ATOM 0 HG3 ARG A 703 -0.456 2.593 11.557 1.00 0.00 H new ATOM 0 HD2 ARG A 703 -2.773 2.042 13.456 1.00 0.00 H new ATOM 0 HD3 ARG A 703 -2.090 0.898 12.318 1.00 0.00 H new ATOM 0 HE ARG A 703 0.105 1.645 13.817 1.00 0.00 H new ATOM 0 HH11 ARG A 703 -3.127 0.440 14.574 1.00 0.00 H new ATOM 0 HH12 ARG A 703 -2.606 -0.359 16.061 1.00 0.00 H new ATOM 0 HH21 ARG A 703 0.765 0.621 15.725 1.00 0.00 H new ATOM 0 HH22 ARG A 703 -0.410 -0.257 16.710 1.00 0.00 H new ATOM 307 N TYR A 704 0.931 4.571 10.240 1.00 0.00 N ATOM 308 CA TYR A 704 2.142 4.145 9.548 1.00 0.00 C ATOM 309 C TYR A 704 3.136 5.298 9.486 1.00 0.00 C ATOM 310 O TYR A 704 4.345 5.103 9.624 1.00 0.00 O ATOM 311 CB TYR A 704 1.815 3.673 8.126 1.00 0.00 C ATOM 312 CG TYR A 704 1.276 2.260 8.037 1.00 0.00 C ATOM 313 CD1 TYR A 704 1.929 1.207 8.667 1.00 0.00 C ATOM 314 CD2 TYR A 704 0.125 1.973 7.306 1.00 0.00 C ATOM 315 CE1 TYR A 704 1.456 -0.087 8.570 1.00 0.00 C ATOM 316 CE2 TYR A 704 -0.353 0.684 7.208 1.00 0.00 C ATOM 317 CZ TYR A 704 0.315 -0.344 7.841 1.00 0.00 C ATOM 318 OH TYR A 704 -0.158 -1.631 7.746 1.00 0.00 O ATOM 0 H TYR A 704 0.112 4.669 9.640 1.00 0.00 H new ATOM 0 HA TYR A 704 2.580 3.314 10.101 1.00 0.00 H new ATOM 0 HB2 TYR A 704 1.084 4.354 7.691 1.00 0.00 H new ATOM 0 HB3 TYR A 704 2.717 3.742 7.518 1.00 0.00 H new ATOM 0 HD1 TYR A 704 2.822 1.404 9.242 1.00 0.00 H new ATOM 0 HD2 TYR A 704 -0.401 2.774 6.808 1.00 0.00 H new ATOM 0 HE1 TYR A 704 1.978 -0.894 9.063 1.00 0.00 H new ATOM 0 HE2 TYR A 704 -1.247 0.479 6.638 1.00 0.00 H new ATOM 0 HH TYR A 704 -1.113 -1.646 7.966 1.00 0.00 H new ATOM 328 N GLY A 705 2.604 6.499 9.282 1.00 0.00 N ATOM 329 CA GLY A 705 3.423 7.697 9.205 1.00 0.00 C ATOM 330 C GLY A 705 4.655 7.548 8.326 1.00 0.00 C ATOM 331 O GLY A 705 5.758 7.887 8.757 1.00 0.00 O ATOM 0 H GLY A 705 1.604 6.665 9.167 1.00 0.00 H new ATOM 0 HA2 GLY A 705 2.814 8.517 8.824 1.00 0.00 H new ATOM 0 HA3 GLY A 705 3.738 7.975 10.211 1.00 0.00 H new ATOM 335 N PRO A 706 4.511 7.041 7.085 1.00 0.00 N ATOM 336 CA PRO A 706 5.628 6.881 6.170 1.00 0.00 C ATOM 337 C PRO A 706 5.804 8.091 5.263 1.00 0.00 C ATOM 338 O PRO A 706 6.820 8.785 5.330 1.00 0.00 O ATOM 339 CB PRO A 706 5.227 5.649 5.367 1.00 0.00 C ATOM 340 CG PRO A 706 3.728 5.634 5.375 1.00 0.00 C ATOM 341 CD PRO A 706 3.261 6.564 6.476 1.00 0.00 C ATOM 0 HA PRO A 706 6.584 6.780 6.684 1.00 0.00 H new ATOM 0 HB2 PRO A 706 5.613 5.702 4.349 1.00 0.00 H new ATOM 0 HB3 PRO A 706 5.631 4.741 5.815 1.00 0.00 H new ATOM 0 HG2 PRO A 706 3.338 5.958 4.410 1.00 0.00 H new ATOM 0 HG3 PRO A 706 3.357 4.623 5.546 1.00 0.00 H new ATOM 0 HD2 PRO A 706 2.669 7.389 6.079 1.00 0.00 H new ATOM 0 HD3 PRO A 706 2.636 6.043 7.201 1.00 0.00 H new ATOM 349 N ALA A 707 4.809 8.341 4.415 1.00 0.00 N ATOM 350 CA ALA A 707 4.848 9.477 3.505 1.00 0.00 C ATOM 351 C ALA A 707 6.102 9.445 2.637 1.00 0.00 C ATOM 352 O ALA A 707 6.638 10.488 2.263 1.00 0.00 O ATOM 353 CB ALA A 707 4.780 10.766 4.302 1.00 0.00 C ATOM 0 H ALA A 707 3.967 7.770 4.341 1.00 0.00 H new ATOM 0 HA ALA A 707 3.987 9.421 2.838 1.00 0.00 H new ATOM 0 HB1 ALA A 707 4.809 11.617 3.621 1.00 0.00 H new ATOM 0 HB2 ALA A 707 3.853 10.791 4.875 1.00 0.00 H new ATOM 0 HB3 ALA A 707 5.629 10.818 4.984 1.00 0.00 H new ATOM 359 N LEU A 708 6.553 8.239 2.315 1.00 0.00 N ATOM 360 CA LEU A 708 7.746 8.058 1.494 1.00 0.00 C ATOM 361 C LEU A 708 7.441 8.300 0.021 1.00 0.00 C ATOM 362 O LEU A 708 6.386 8.835 -0.324 1.00 0.00 O ATOM 363 CB LEU A 708 8.337 6.661 1.691 1.00 0.00 C ATOM 364 CG LEU A 708 7.338 5.569 2.065 1.00 0.00 C ATOM 365 CD1 LEU A 708 6.195 5.525 1.068 1.00 0.00 C ATOM 366 CD2 LEU A 708 8.032 4.219 2.144 1.00 0.00 C ATOM 0 H LEU A 708 6.110 7.369 2.610 1.00 0.00 H new ATOM 0 HA LEU A 708 8.483 8.794 1.816 1.00 0.00 H new ATOM 0 HB2 LEU A 708 8.842 6.367 0.771 1.00 0.00 H new ATOM 0 HB3 LEU A 708 9.098 6.714 2.470 1.00 0.00 H new ATOM 0 HG LEU A 708 6.925 5.802 3.046 1.00 0.00 H new ATOM 0 HD11 LEU A 708 5.494 4.740 1.352 1.00 0.00 H new ATOM 0 HD12 LEU A 708 5.681 6.486 1.062 1.00 0.00 H new ATOM 0 HD13 LEU A 708 6.588 5.317 0.073 1.00 0.00 H new ATOM 0 HD21 LEU A 708 7.306 3.452 2.412 1.00 0.00 H new ATOM 0 HD22 LEU A 708 8.473 3.979 1.176 1.00 0.00 H new ATOM 0 HD23 LEU A 708 8.816 4.256 2.901 1.00 0.00 H new ATOM 378 N SER A 709 8.367 7.901 -0.849 1.00 0.00 N ATOM 379 CA SER A 709 8.199 8.104 -2.280 1.00 0.00 C ATOM 380 C SER A 709 7.817 6.812 -2.994 1.00 0.00 C ATOM 381 O SER A 709 7.963 5.717 -2.453 1.00 0.00 O ATOM 382 CB SER A 709 9.490 8.660 -2.867 1.00 0.00 C ATOM 383 OG SER A 709 9.325 9.014 -4.229 1.00 0.00 O ATOM 0 H SER A 709 9.237 7.437 -0.586 1.00 0.00 H new ATOM 0 HA SER A 709 7.385 8.814 -2.428 1.00 0.00 H new ATOM 0 HB2 SER A 709 9.804 9.534 -2.297 1.00 0.00 H new ATOM 0 HB3 SER A 709 10.283 7.918 -2.775 1.00 0.00 H new ATOM 0 HG SER A 709 10.169 9.369 -4.579 1.00 0.00 H new ATOM 389 N ILE A 710 7.318 6.958 -4.216 1.00 0.00 N ATOM 390 CA ILE A 710 6.916 5.816 -5.027 1.00 0.00 C ATOM 391 C ILE A 710 8.129 5.031 -5.495 1.00 0.00 C ATOM 392 O ILE A 710 8.141 3.800 -5.469 1.00 0.00 O ATOM 393 CB ILE A 710 6.111 6.266 -6.262 1.00 0.00 C ATOM 394 CG1 ILE A 710 4.675 6.622 -5.874 1.00 0.00 C ATOM 395 CG2 ILE A 710 6.123 5.181 -7.328 1.00 0.00 C ATOM 396 CD1 ILE A 710 4.575 7.712 -4.829 1.00 0.00 C ATOM 0 H ILE A 710 7.182 7.862 -4.669 1.00 0.00 H new ATOM 0 HA ILE A 710 6.289 5.182 -4.400 1.00 0.00 H new ATOM 0 HB ILE A 710 6.583 7.159 -6.671 1.00 0.00 H new ATOM 0 HG12 ILE A 710 4.135 6.938 -6.767 1.00 0.00 H new ATOM 0 HG13 ILE A 710 4.177 5.727 -5.500 1.00 0.00 H new ATOM 0 HG21 ILE A 710 5.550 5.515 -8.193 1.00 0.00 H new ATOM 0 HG22 ILE A 710 7.151 4.978 -7.629 1.00 0.00 H new ATOM 0 HG23 ILE A 710 5.677 4.271 -6.926 1.00 0.00 H new ATOM 0 HD11 ILE A 710 3.526 7.908 -4.607 1.00 0.00 H new ATOM 0 HD12 ILE A 710 5.085 7.393 -3.920 1.00 0.00 H new ATOM 0 HD13 ILE A 710 5.042 8.622 -5.206 1.00 0.00 H new ATOM 408 N ASN A 711 9.139 5.755 -5.950 1.00 0.00 N ATOM 409 CA ASN A 711 10.362 5.139 -6.434 1.00 0.00 C ATOM 410 C ASN A 711 10.929 4.187 -5.391 1.00 0.00 C ATOM 411 O ASN A 711 11.682 3.269 -5.712 1.00 0.00 O ATOM 412 CB ASN A 711 11.391 6.221 -6.753 1.00 0.00 C ATOM 413 CG ASN A 711 12.598 5.678 -7.495 1.00 0.00 C ATOM 414 OD1 ASN A 711 13.720 6.149 -7.306 1.00 0.00 O ATOM 415 ND2 ASN A 711 12.374 4.687 -8.351 1.00 0.00 N ATOM 0 H ASN A 711 9.135 6.774 -5.994 1.00 0.00 H new ATOM 0 HA ASN A 711 10.134 4.573 -7.337 1.00 0.00 H new ATOM 0 HB2 ASN A 711 10.920 6.999 -7.353 1.00 0.00 H new ATOM 0 HB3 ASN A 711 11.720 6.689 -5.825 1.00 0.00 H new ATOM 0 HD21 ASN A 711 13.148 4.287 -8.882 1.00 0.00 H new ATOM 0 HD22 ASN A 711 11.428 4.326 -8.477 1.00 0.00 H new ATOM 422 N GLU A 712 10.556 4.422 -4.139 1.00 0.00 N ATOM 423 CA GLU A 712 11.034 3.605 -3.031 1.00 0.00 C ATOM 424 C GLU A 712 9.994 2.564 -2.619 1.00 0.00 C ATOM 425 O GLU A 712 10.302 1.620 -1.893 1.00 0.00 O ATOM 426 CB GLU A 712 11.417 4.503 -1.847 1.00 0.00 C ATOM 427 CG GLU A 712 10.321 4.700 -0.819 1.00 0.00 C ATOM 428 CD GLU A 712 10.869 5.205 0.502 1.00 0.00 C ATOM 429 OE1 GLU A 712 11.172 6.412 0.597 1.00 0.00 O ATOM 430 OE2 GLU A 712 10.997 4.392 1.441 1.00 0.00 O ATOM 0 H GLU A 712 9.923 5.173 -3.865 1.00 0.00 H new ATOM 0 HA GLU A 712 11.921 3.062 -3.359 1.00 0.00 H new ATOM 0 HB2 GLU A 712 12.288 4.075 -1.351 1.00 0.00 H new ATOM 0 HB3 GLU A 712 11.716 5.479 -2.231 1.00 0.00 H new ATOM 0 HG2 GLU A 712 9.587 5.409 -1.202 1.00 0.00 H new ATOM 0 HG3 GLU A 712 9.800 3.756 -0.659 1.00 0.00 H new ATOM 437 N LEU A 713 8.760 2.759 -3.073 1.00 0.00 N ATOM 438 CA LEU A 713 7.661 1.849 -2.766 1.00 0.00 C ATOM 439 C LEU A 713 7.985 0.406 -3.149 1.00 0.00 C ATOM 440 O LEU A 713 7.428 -0.533 -2.579 1.00 0.00 O ATOM 441 CB LEU A 713 6.403 2.312 -3.505 1.00 0.00 C ATOM 442 CG LEU A 713 5.218 2.706 -2.623 1.00 0.00 C ATOM 443 CD1 LEU A 713 5.677 3.526 -1.434 1.00 0.00 C ATOM 444 CD2 LEU A 713 4.209 3.496 -3.430 1.00 0.00 C ATOM 0 H LEU A 713 8.494 3.548 -3.662 1.00 0.00 H new ATOM 0 HA LEU A 713 7.497 1.870 -1.689 1.00 0.00 H new ATOM 0 HB2 LEU A 713 6.666 3.166 -4.130 1.00 0.00 H new ATOM 0 HB3 LEU A 713 6.083 1.513 -4.174 1.00 0.00 H new ATOM 0 HG LEU A 713 4.751 1.793 -2.254 1.00 0.00 H new ATOM 0 HD11 LEU A 713 4.815 3.794 -0.822 1.00 0.00 H new ATOM 0 HD12 LEU A 713 6.378 2.942 -0.838 1.00 0.00 H new ATOM 0 HD13 LEU A 713 6.168 4.433 -1.786 1.00 0.00 H new ATOM 0 HD21 LEU A 713 3.369 3.772 -2.793 1.00 0.00 H new ATOM 0 HD22 LEU A 713 4.681 4.398 -3.819 1.00 0.00 H new ATOM 0 HD23 LEU A 713 3.850 2.887 -4.260 1.00 0.00 H new ATOM 456 N SER A 714 8.882 0.232 -4.111 1.00 0.00 N ATOM 457 CA SER A 714 9.263 -1.100 -4.569 1.00 0.00 C ATOM 458 C SER A 714 10.056 -1.854 -3.505 1.00 0.00 C ATOM 459 O SER A 714 10.227 -3.070 -3.591 1.00 0.00 O ATOM 460 CB SER A 714 10.082 -1.001 -5.855 1.00 0.00 C ATOM 461 OG SER A 714 10.564 -2.273 -6.251 1.00 0.00 O ATOM 0 H SER A 714 9.360 0.995 -4.590 1.00 0.00 H new ATOM 0 HA SER A 714 8.347 -1.658 -4.764 1.00 0.00 H new ATOM 0 HB2 SER A 714 9.468 -0.578 -6.650 1.00 0.00 H new ATOM 0 HB3 SER A 714 10.921 -0.321 -5.704 1.00 0.00 H new ATOM 0 HG SER A 714 10.447 -2.910 -5.516 1.00 0.00 H new ATOM 467 N ASN A 715 10.536 -1.129 -2.500 1.00 0.00 N ATOM 468 CA ASN A 715 11.315 -1.732 -1.424 1.00 0.00 C ATOM 469 C ASN A 715 10.422 -2.133 -0.252 1.00 0.00 C ATOM 470 O ASN A 715 10.910 -2.543 0.800 1.00 0.00 O ATOM 471 CB ASN A 715 12.397 -0.760 -0.946 1.00 0.00 C ATOM 472 CG ASN A 715 13.331 -0.333 -2.065 1.00 0.00 C ATOM 473 OD1 ASN A 715 13.854 0.781 -2.059 1.00 0.00 O ATOM 474 ND2 ASN A 715 13.546 -1.219 -3.030 1.00 0.00 N ATOM 0 H ASN A 715 10.399 -0.122 -2.408 1.00 0.00 H new ATOM 0 HA ASN A 715 11.787 -2.633 -1.816 1.00 0.00 H new ATOM 0 HB2 ASN A 715 11.924 0.122 -0.516 1.00 0.00 H new ATOM 0 HB3 ASN A 715 12.978 -1.230 -0.152 1.00 0.00 H new ATOM 0 HD21 ASN A 715 14.166 -0.987 -3.806 1.00 0.00 H new ATOM 0 HD22 ASN A 715 13.091 -2.131 -2.995 1.00 0.00 H new ATOM 481 N LEU A 716 9.113 -2.014 -0.444 1.00 0.00 N ATOM 482 CA LEU A 716 8.150 -2.365 0.595 1.00 0.00 C ATOM 483 C LEU A 716 7.927 -3.867 0.662 1.00 0.00 C ATOM 484 O LEU A 716 8.042 -4.572 -0.342 1.00 0.00 O ATOM 485 CB LEU A 716 6.816 -1.666 0.341 1.00 0.00 C ATOM 486 CG LEU A 716 6.818 -0.161 0.598 1.00 0.00 C ATOM 487 CD1 LEU A 716 5.580 0.486 0.002 1.00 0.00 C ATOM 488 CD2 LEU A 716 6.892 0.118 2.091 1.00 0.00 C ATOM 0 H LEU A 716 8.693 -1.677 -1.310 1.00 0.00 H new ATOM 0 HA LEU A 716 8.562 -2.034 1.548 1.00 0.00 H new ATOM 0 HB2 LEU A 716 6.521 -1.843 -0.693 1.00 0.00 H new ATOM 0 HB3 LEU A 716 6.056 -2.126 0.972 1.00 0.00 H new ATOM 0 HG LEU A 716 7.696 0.269 0.116 1.00 0.00 H new ATOM 0 HD11 LEU A 716 5.601 1.558 0.196 1.00 0.00 H new ATOM 0 HD12 LEU A 716 5.561 0.312 -1.074 1.00 0.00 H new ATOM 0 HD13 LEU A 716 4.689 0.052 0.455 1.00 0.00 H new ATOM 0 HD21 LEU A 716 6.893 1.195 2.260 1.00 0.00 H new ATOM 0 HD22 LEU A 716 6.030 -0.327 2.587 1.00 0.00 H new ATOM 0 HD23 LEU A 716 7.807 -0.314 2.497 1.00 0.00 H new ATOM 500 N ALA A 717 7.608 -4.349 1.855 1.00 0.00 N ATOM 501 CA ALA A 717 7.347 -5.763 2.066 1.00 0.00 C ATOM 502 C ALA A 717 5.916 -6.094 1.674 1.00 0.00 C ATOM 503 O ALA A 717 4.993 -5.337 1.969 1.00 0.00 O ATOM 504 CB ALA A 717 7.599 -6.128 3.518 1.00 0.00 C ATOM 0 H ALA A 717 7.524 -3.777 2.695 1.00 0.00 H new ATOM 0 HA ALA A 717 8.022 -6.346 1.439 1.00 0.00 H new ATOM 0 HB1 ALA A 717 7.401 -7.190 3.666 1.00 0.00 H new ATOM 0 HB2 ALA A 717 8.637 -5.914 3.772 1.00 0.00 H new ATOM 0 HB3 ALA A 717 6.940 -5.543 4.160 1.00 0.00 H new ATOM 510 N LYS A 718 5.729 -7.224 1.006 1.00 0.00 N ATOM 511 CA LYS A 718 4.401 -7.629 0.576 1.00 0.00 C ATOM 512 C LYS A 718 3.465 -7.803 1.764 1.00 0.00 C ATOM 513 O LYS A 718 3.905 -8.066 2.883 1.00 0.00 O ATOM 514 CB LYS A 718 4.465 -8.915 -0.238 1.00 0.00 C ATOM 515 CG LYS A 718 4.136 -8.703 -1.703 1.00 0.00 C ATOM 516 CD LYS A 718 5.212 -7.895 -2.413 1.00 0.00 C ATOM 517 CE LYS A 718 4.740 -7.409 -3.775 1.00 0.00 C ATOM 518 NZ LYS A 718 5.802 -6.654 -4.494 1.00 0.00 N ATOM 0 H LYS A 718 6.475 -7.871 0.752 1.00 0.00 H new ATOM 0 HA LYS A 718 4.003 -6.835 -0.056 1.00 0.00 H new ATOM 0 HB2 LYS A 718 5.464 -9.343 -0.153 1.00 0.00 H new ATOM 0 HB3 LYS A 718 3.770 -9.641 0.184 1.00 0.00 H new ATOM 0 HG2 LYS A 718 4.024 -9.670 -2.194 1.00 0.00 H new ATOM 0 HG3 LYS A 718 3.179 -8.189 -1.790 1.00 0.00 H new ATOM 0 HD2 LYS A 718 5.491 -7.040 -1.798 1.00 0.00 H new ATOM 0 HD3 LYS A 718 6.106 -8.506 -2.534 1.00 0.00 H new ATOM 0 HE2 LYS A 718 4.430 -8.263 -4.378 1.00 0.00 H new ATOM 0 HE3 LYS A 718 3.864 -6.773 -3.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 718 5.440 -6.340 -5.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 718 6.080 -5.825 -3.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 718 6.629 -7.269 -4.637 1.00 0.00 H new ATOM 532 N GLY A 719 2.170 -7.654 1.507 1.00 0.00 N ATOM 533 CA GLY A 719 1.186 -7.784 2.562 1.00 0.00 C ATOM 534 C GLY A 719 1.155 -6.563 3.462 1.00 0.00 C ATOM 535 O GLY A 719 0.341 -6.476 4.381 1.00 0.00 O ATOM 0 H GLY A 719 1.785 -7.445 0.586 1.00 0.00 H new ATOM 0 HA2 GLY A 719 0.200 -7.936 2.122 1.00 0.00 H new ATOM 0 HA3 GLY A 719 1.408 -8.669 3.158 1.00 0.00 H new ATOM 539 N GLU A 720 2.048 -5.617 3.185 1.00 0.00 N ATOM 540 CA GLU A 720 2.142 -4.385 3.964 1.00 0.00 C ATOM 541 C GLU A 720 1.602 -3.197 3.182 1.00 0.00 C ATOM 542 O GLU A 720 1.291 -3.306 1.994 1.00 0.00 O ATOM 543 CB GLU A 720 3.591 -4.110 4.356 1.00 0.00 C ATOM 544 CG GLU A 720 4.197 -5.177 5.249 1.00 0.00 C ATOM 545 CD GLU A 720 3.492 -5.289 6.587 1.00 0.00 C ATOM 546 OE1 GLU A 720 2.481 -6.019 6.666 1.00 0.00 O ATOM 547 OE2 GLU A 720 3.949 -4.647 7.555 1.00 0.00 O ATOM 0 H GLU A 720 2.721 -5.681 2.422 1.00 0.00 H new ATOM 0 HA GLU A 720 1.539 -4.519 4.862 1.00 0.00 H new ATOM 0 HB2 GLU A 720 4.192 -4.023 3.451 1.00 0.00 H new ATOM 0 HB3 GLU A 720 3.643 -3.149 4.867 1.00 0.00 H new ATOM 0 HG2 GLU A 720 4.155 -6.139 4.739 1.00 0.00 H new ATOM 0 HG3 GLU A 720 5.250 -4.951 5.416 1.00 0.00 H new ATOM 554 N LYS A 721 1.481 -2.066 3.863 1.00 0.00 N ATOM 555 CA LYS A 721 0.986 -0.847 3.238 1.00 0.00 C ATOM 556 C LYS A 721 1.962 0.304 3.419 1.00 0.00 C ATOM 557 O LYS A 721 2.978 0.171 4.103 1.00 0.00 O ATOM 558 CB LYS A 721 -0.362 -0.452 3.824 1.00 0.00 C ATOM 559 CG LYS A 721 -1.538 -1.196 3.222 1.00 0.00 C ATOM 560 CD LYS A 721 -2.556 -1.550 4.287 1.00 0.00 C ATOM 561 CE LYS A 721 -2.008 -2.606 5.236 1.00 0.00 C ATOM 562 NZ LYS A 721 -2.999 -2.993 6.276 1.00 0.00 N ATOM 0 H LYS A 721 1.719 -1.967 4.850 1.00 0.00 H new ATOM 0 HA LYS A 721 0.876 -1.052 2.173 1.00 0.00 H new ATOM 0 HB2 LYS A 721 -0.345 -0.629 4.899 1.00 0.00 H new ATOM 0 HB3 LYS A 721 -0.510 0.618 3.680 1.00 0.00 H new ATOM 0 HG2 LYS A 721 -2.008 -0.581 2.454 1.00 0.00 H new ATOM 0 HG3 LYS A 721 -1.187 -2.104 2.733 1.00 0.00 H new ATOM 0 HD2 LYS A 721 -2.826 -0.656 4.849 1.00 0.00 H new ATOM 0 HD3 LYS A 721 -3.468 -1.917 3.816 1.00 0.00 H new ATOM 0 HE2 LYS A 721 -1.718 -3.489 4.666 1.00 0.00 H new ATOM 0 HE3 LYS A 721 -1.107 -2.227 5.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 721 -2.584 -3.714 6.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 721 -3.258 -2.157 6.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 721 -3.849 -3.379 5.819 1.00 0.00 H new ATOM 576 N ALA A 722 1.644 1.438 2.801 1.00 0.00 N ATOM 577 CA ALA A 722 2.489 2.626 2.910 1.00 0.00 C ATOM 578 C ALA A 722 1.796 3.847 2.327 1.00 0.00 C ATOM 579 O ALA A 722 1.387 3.843 1.168 1.00 0.00 O ATOM 580 CB ALA A 722 3.823 2.398 2.216 1.00 0.00 C ATOM 0 H ALA A 722 0.813 1.561 2.223 1.00 0.00 H new ATOM 0 HA ALA A 722 2.671 2.811 3.969 1.00 0.00 H new ATOM 0 HB1 ALA A 722 4.438 3.293 2.308 1.00 0.00 H new ATOM 0 HB2 ALA A 722 4.336 1.556 2.681 1.00 0.00 H new ATOM 0 HB3 ALA A 722 3.652 2.182 1.161 1.00 0.00 H new ATOM 586 N ASN A 723 1.715 4.908 3.127 1.00 0.00 N ATOM 587 CA ASN A 723 1.055 6.140 2.714 1.00 0.00 C ATOM 588 C ASN A 723 1.880 6.931 1.714 1.00 0.00 C ATOM 589 O ASN A 723 2.964 7.422 2.023 1.00 0.00 O ATOM 590 CB ASN A 723 0.750 7.012 3.932 1.00 0.00 C ATOM 591 CG ASN A 723 -0.287 6.391 4.847 1.00 0.00 C ATOM 592 OD1 ASN A 723 -1.478 6.680 4.740 1.00 0.00 O ATOM 593 ND2 ASN A 723 0.162 5.530 5.752 1.00 0.00 N ATOM 0 H ASN A 723 2.102 4.937 4.070 1.00 0.00 H new ATOM 0 HA ASN A 723 0.126 5.853 2.222 1.00 0.00 H new ATOM 0 HB2 ASN A 723 1.669 7.181 4.493 1.00 0.00 H new ATOM 0 HB3 ASN A 723 0.397 7.987 3.597 1.00 0.00 H new ATOM 0 HD21 ASN A 723 -0.490 5.079 6.394 1.00 0.00 H new ATOM 0 HD22 ASN A 723 1.159 5.320 5.805 1.00 0.00 H new ATOM 600 N VAL A 724 1.342 7.042 0.505 1.00 0.00 N ATOM 601 CA VAL A 724 1.985 7.793 -0.555 1.00 0.00 C ATOM 602 C VAL A 724 0.991 8.733 -1.221 1.00 0.00 C ATOM 603 O VAL A 724 -0.140 8.347 -1.518 1.00 0.00 O ATOM 604 CB VAL A 724 2.625 6.882 -1.616 1.00 0.00 C ATOM 605 CG1 VAL A 724 3.909 6.286 -1.080 1.00 0.00 C ATOM 606 CG2 VAL A 724 1.670 5.781 -2.046 1.00 0.00 C ATOM 0 H VAL A 724 0.455 6.616 0.238 1.00 0.00 H new ATOM 0 HA VAL A 724 2.784 8.371 -0.090 1.00 0.00 H new ATOM 0 HB VAL A 724 2.851 7.488 -2.493 1.00 0.00 H new ATOM 0 HG11 VAL A 724 4.355 5.642 -1.838 1.00 0.00 H new ATOM 0 HG12 VAL A 724 4.605 7.087 -0.828 1.00 0.00 H new ATOM 0 HG13 VAL A 724 3.693 5.699 -0.187 1.00 0.00 H new ATOM 0 HG21 VAL A 724 2.152 5.154 -2.796 1.00 0.00 H new ATOM 0 HG22 VAL A 724 1.403 5.173 -1.182 1.00 0.00 H new ATOM 0 HG23 VAL A 724 0.769 6.225 -2.469 1.00 0.00 H new ATOM 616 N LEU A 725 1.412 9.973 -1.439 1.00 0.00 N ATOM 617 CA LEU A 725 0.545 10.962 -2.065 1.00 0.00 C ATOM 618 C LEU A 725 0.438 10.726 -3.566 1.00 0.00 C ATOM 619 O LEU A 725 1.386 10.271 -4.205 1.00 0.00 O ATOM 620 CB LEU A 725 1.014 12.402 -1.779 1.00 0.00 C ATOM 621 CG LEU A 725 2.529 12.634 -1.669 1.00 0.00 C ATOM 622 CD1 LEU A 725 3.043 12.200 -0.305 1.00 0.00 C ATOM 623 CD2 LEU A 725 3.282 11.917 -2.779 1.00 0.00 C ATOM 0 H LEU A 725 2.341 10.315 -1.194 1.00 0.00 H new ATOM 0 HA LEU A 725 -0.444 10.842 -1.623 1.00 0.00 H new ATOM 0 HB2 LEU A 725 0.629 13.047 -2.569 1.00 0.00 H new ATOM 0 HB3 LEU A 725 0.553 12.730 -0.847 1.00 0.00 H new ATOM 0 HG LEU A 725 2.709 13.703 -1.781 1.00 0.00 H new ATOM 0 HD11 LEU A 725 4.118 12.373 -0.249 1.00 0.00 H new ATOM 0 HD12 LEU A 725 2.542 12.776 0.473 1.00 0.00 H new ATOM 0 HD13 LEU A 725 2.838 11.139 -0.160 1.00 0.00 H new ATOM 0 HD21 LEU A 725 4.351 12.102 -2.672 1.00 0.00 H new ATOM 0 HD22 LEU A 725 3.091 10.846 -2.715 1.00 0.00 H new ATOM 0 HD23 LEU A 725 2.945 12.289 -3.747 1.00 0.00 H new ATOM 635 N ILE A 726 -0.731 11.023 -4.119 1.00 0.00 N ATOM 636 CA ILE A 726 -0.962 10.838 -5.546 1.00 0.00 C ATOM 637 C ILE A 726 -1.252 12.164 -6.238 1.00 0.00 C ATOM 638 O ILE A 726 -1.275 12.244 -7.466 1.00 0.00 O ATOM 639 CB ILE A 726 -2.128 9.866 -5.799 1.00 0.00 C ATOM 640 CG1 ILE A 726 -3.387 10.339 -5.063 1.00 0.00 C ATOM 641 CG2 ILE A 726 -1.739 8.461 -5.361 1.00 0.00 C ATOM 642 CD1 ILE A 726 -4.593 9.450 -5.283 1.00 0.00 C ATOM 0 H ILE A 726 -1.531 11.391 -3.604 1.00 0.00 H new ATOM 0 HA ILE A 726 -0.048 10.415 -5.963 1.00 0.00 H new ATOM 0 HB ILE A 726 -2.348 9.846 -6.866 1.00 0.00 H new ATOM 0 HG12 ILE A 726 -3.175 10.390 -3.995 1.00 0.00 H new ATOM 0 HG13 ILE A 726 -3.629 11.351 -5.389 1.00 0.00 H new ATOM 0 HG21 ILE A 726 -2.570 7.780 -5.544 1.00 0.00 H new ATOM 0 HG22 ILE A 726 -0.868 8.131 -5.928 1.00 0.00 H new ATOM 0 HG23 ILE A 726 -1.500 8.465 -4.298 1.00 0.00 H new ATOM 0 HD11 ILE A 726 -5.444 9.848 -4.731 1.00 0.00 H new ATOM 0 HD12 ILE A 726 -4.832 9.418 -6.346 1.00 0.00 H new ATOM 0 HD13 ILE A 726 -4.372 8.443 -4.931 1.00 0.00 H new ATOM 654 N GLY A 727 -1.472 13.201 -5.439 1.00 0.00 N ATOM 655 CA GLY A 727 -1.753 14.515 -5.986 1.00 0.00 C ATOM 656 C GLY A 727 -1.069 15.620 -5.206 1.00 0.00 C ATOM 657 O GLY A 727 -1.558 16.751 -5.164 1.00 0.00 O ATOM 0 H GLY A 727 -1.461 13.155 -4.420 1.00 0.00 H new ATOM 0 HA2 GLY A 727 -1.427 14.551 -7.025 1.00 0.00 H new ATOM 0 HA3 GLY A 727 -2.830 14.684 -5.984 1.00 0.00 H new ATOM 661 N GLN A 728 0.066 15.293 -4.591 1.00 0.00 N ATOM 662 CA GLN A 728 0.817 16.265 -3.802 1.00 0.00 C ATOM 663 C GLN A 728 -0.088 16.928 -2.770 1.00 0.00 C ATOM 664 O GLN A 728 0.018 18.127 -2.509 1.00 0.00 O ATOM 665 CB GLN A 728 1.439 17.325 -4.713 1.00 0.00 C ATOM 666 CG GLN A 728 2.430 16.757 -5.716 1.00 0.00 C ATOM 667 CD GLN A 728 3.024 17.822 -6.621 1.00 0.00 C ATOM 668 OE1 GLN A 728 4.168 17.710 -7.061 1.00 0.00 O ATOM 669 NE2 GLN A 728 2.245 18.859 -6.908 1.00 0.00 N ATOM 0 H GLN A 728 0.485 14.363 -4.624 1.00 0.00 H new ATOM 0 HA GLN A 728 1.616 15.739 -3.279 1.00 0.00 H new ATOM 0 HB2 GLN A 728 0.644 17.841 -5.252 1.00 0.00 H new ATOM 0 HB3 GLN A 728 1.943 18.070 -4.098 1.00 0.00 H new ATOM 0 HG2 GLN A 728 3.234 16.252 -5.180 1.00 0.00 H new ATOM 0 HG3 GLN A 728 1.932 16.004 -6.327 1.00 0.00 H new ATOM 0 HE21 GLN A 728 1.303 18.911 -6.521 1.00 0.00 H new ATOM 0 HE22 GLN A 728 2.589 19.603 -7.515 1.00 0.00 H new ATOM 678 N GLY A 729 -0.973 16.131 -2.179 1.00 0.00 N ATOM 679 CA GLY A 729 -1.898 16.652 -1.189 1.00 0.00 C ATOM 680 C GLY A 729 -2.817 15.581 -0.639 1.00 0.00 C ATOM 681 O GLY A 729 -3.361 15.722 0.457 1.00 0.00 O ATOM 0 H GLY A 729 -1.066 15.133 -2.368 1.00 0.00 H new ATOM 0 HA2 GLY A 729 -1.335 17.100 -0.370 1.00 0.00 H new ATOM 0 HA3 GLY A 729 -2.496 17.446 -1.637 1.00 0.00 H new ATOM 685 N ASP A 730 -2.991 14.505 -1.401 1.00 0.00 N ATOM 686 CA ASP A 730 -3.842 13.402 -0.985 1.00 0.00 C ATOM 687 C ASP A 730 -2.982 12.255 -0.478 1.00 0.00 C ATOM 688 O ASP A 730 -2.265 11.622 -1.251 1.00 0.00 O ATOM 689 CB ASP A 730 -4.715 12.928 -2.149 1.00 0.00 C ATOM 690 CG ASP A 730 -5.557 14.046 -2.731 1.00 0.00 C ATOM 691 OD1 ASP A 730 -6.608 14.367 -2.139 1.00 0.00 O ATOM 692 OD2 ASP A 730 -5.164 14.601 -3.779 1.00 0.00 O ATOM 0 H ASP A 730 -2.551 14.376 -2.312 1.00 0.00 H new ATOM 0 HA ASP A 730 -4.495 13.746 -0.183 1.00 0.00 H new ATOM 0 HB2 ASP A 730 -4.079 12.511 -2.930 1.00 0.00 H new ATOM 0 HB3 ASP A 730 -5.368 12.125 -1.807 1.00 0.00 H new ATOM 697 N VAL A 731 -3.067 11.986 0.820 1.00 0.00 N ATOM 698 CA VAL A 731 -2.274 10.930 1.429 1.00 0.00 C ATOM 699 C VAL A 731 -3.045 9.617 1.497 1.00 0.00 C ATOM 700 O VAL A 731 -3.977 9.467 2.288 1.00 0.00 O ATOM 701 CB VAL A 731 -1.827 11.326 2.849 1.00 0.00 C ATOM 702 CG1 VAL A 731 -0.947 10.246 3.456 1.00 0.00 C ATOM 703 CG2 VAL A 731 -1.102 12.663 2.826 1.00 0.00 C ATOM 0 H VAL A 731 -3.677 12.485 1.468 1.00 0.00 H new ATOM 0 HA VAL A 731 -1.397 10.790 0.798 1.00 0.00 H new ATOM 0 HB VAL A 731 -2.715 11.429 3.473 1.00 0.00 H new ATOM 0 HG11 VAL A 731 -0.642 10.546 4.459 1.00 0.00 H new ATOM 0 HG12 VAL A 731 -1.504 9.311 3.510 1.00 0.00 H new ATOM 0 HG13 VAL A 731 -0.062 10.106 2.835 1.00 0.00 H new ATOM 0 HG21 VAL A 731 -0.793 12.927 3.838 1.00 0.00 H new ATOM 0 HG22 VAL A 731 -0.223 12.589 2.186 1.00 0.00 H new ATOM 0 HG23 VAL A 731 -1.770 13.432 2.438 1.00 0.00 H new ATOM 713 N VAL A 732 -2.644 8.671 0.656 1.00 0.00 N ATOM 714 CA VAL A 732 -3.276 7.361 0.609 1.00 0.00 C ATOM 715 C VAL A 732 -2.220 6.261 0.568 1.00 0.00 C ATOM 716 O VAL A 732 -1.268 6.335 -0.206 1.00 0.00 O ATOM 717 CB VAL A 732 -4.199 7.220 -0.620 1.00 0.00 C ATOM 718 CG1 VAL A 732 -5.369 8.186 -0.527 1.00 0.00 C ATOM 719 CG2 VAL A 732 -3.417 7.448 -1.905 1.00 0.00 C ATOM 0 H VAL A 732 -1.878 8.790 -0.007 1.00 0.00 H new ATOM 0 HA VAL A 732 -3.879 7.261 1.511 1.00 0.00 H new ATOM 0 HB VAL A 732 -4.595 6.205 -0.635 1.00 0.00 H new ATOM 0 HG11 VAL A 732 -6.007 8.070 -1.403 1.00 0.00 H new ATOM 0 HG12 VAL A 732 -5.946 7.973 0.373 1.00 0.00 H new ATOM 0 HG13 VAL A 732 -4.994 9.209 -0.484 1.00 0.00 H new ATOM 0 HG21 VAL A 732 -4.085 7.344 -2.760 1.00 0.00 H new ATOM 0 HG22 VAL A 732 -2.989 8.451 -1.898 1.00 0.00 H new ATOM 0 HG23 VAL A 732 -2.616 6.712 -1.979 1.00 0.00 H new ATOM 729 N LEU A 733 -2.398 5.240 1.395 1.00 0.00 N ATOM 730 CA LEU A 733 -1.454 4.130 1.449 1.00 0.00 C ATOM 731 C LEU A 733 -1.801 3.080 0.412 1.00 0.00 C ATOM 732 O LEU A 733 -2.935 3.015 -0.059 1.00 0.00 O ATOM 733 CB LEU A 733 -1.398 3.489 2.847 1.00 0.00 C ATOM 734 CG LEU A 733 -2.744 3.126 3.471 1.00 0.00 C ATOM 735 CD1 LEU A 733 -2.568 2.057 4.535 1.00 0.00 C ATOM 736 CD2 LEU A 733 -3.395 4.350 4.073 1.00 0.00 C ATOM 0 H LEU A 733 -3.186 5.156 2.037 1.00 0.00 H new ATOM 0 HA LEU A 733 -0.468 4.539 1.229 1.00 0.00 H new ATOM 0 HB2 LEU A 733 -0.792 2.585 2.786 1.00 0.00 H new ATOM 0 HB3 LEU A 733 -0.881 4.174 3.519 1.00 0.00 H new ATOM 0 HG LEU A 733 -3.389 2.735 2.684 1.00 0.00 H new ATOM 0 HD11 LEU A 733 -3.538 1.812 4.968 1.00 0.00 H new ATOM 0 HD12 LEU A 733 -2.135 1.164 4.085 1.00 0.00 H new ATOM 0 HD13 LEU A 733 -1.905 2.427 5.317 1.00 0.00 H new ATOM 0 HD21 LEU A 733 -4.353 4.073 4.513 1.00 0.00 H new ATOM 0 HD22 LEU A 733 -2.747 4.764 4.845 1.00 0.00 H new ATOM 0 HD23 LEU A 733 -3.555 5.097 3.295 1.00 0.00 H new ATOM 748 N VAL A 734 -0.812 2.280 0.030 1.00 0.00 N ATOM 749 CA VAL A 734 -1.032 1.241 -0.955 1.00 0.00 C ATOM 750 C VAL A 734 -0.860 -0.129 -0.347 1.00 0.00 C ATOM 751 O VAL A 734 -0.321 -0.265 0.749 1.00 0.00 O ATOM 752 CB VAL A 734 -0.099 1.373 -2.166 1.00 0.00 C ATOM 753 CG1 VAL A 734 -0.915 1.772 -3.373 1.00 0.00 C ATOM 754 CG2 VAL A 734 1.012 2.377 -1.899 1.00 0.00 C ATOM 0 H VAL A 734 0.142 2.334 0.388 1.00 0.00 H new ATOM 0 HA VAL A 734 -2.059 1.364 -1.300 1.00 0.00 H new ATOM 0 HB VAL A 734 0.380 0.412 -2.356 1.00 0.00 H new ATOM 0 HG11 VAL A 734 -0.260 1.868 -4.239 1.00 0.00 H new ATOM 0 HG12 VAL A 734 -1.669 1.010 -3.571 1.00 0.00 H new ATOM 0 HG13 VAL A 734 -1.406 2.726 -3.181 1.00 0.00 H new ATOM 0 HG21 VAL A 734 1.656 2.448 -2.775 1.00 0.00 H new ATOM 0 HG22 VAL A 734 0.577 3.354 -1.688 1.00 0.00 H new ATOM 0 HG23 VAL A 734 1.600 2.049 -1.042 1.00 0.00 H new ATOM 764 N MET A 735 -1.309 -1.137 -1.083 1.00 0.00 N ATOM 765 CA MET A 735 -1.240 -2.517 -0.634 1.00 0.00 C ATOM 766 C MET A 735 -0.504 -3.389 -1.642 1.00 0.00 C ATOM 767 O MET A 735 -0.952 -3.571 -2.770 1.00 0.00 O ATOM 768 CB MET A 735 -2.655 -3.042 -0.440 1.00 0.00 C ATOM 769 CG MET A 735 -2.942 -3.502 0.976 1.00 0.00 C ATOM 770 SD MET A 735 -3.008 -5.298 1.126 1.00 0.00 S ATOM 771 CE MET A 735 -1.305 -5.722 0.782 1.00 0.00 C ATOM 0 H MET A 735 -1.730 -1.020 -2.005 1.00 0.00 H new ATOM 0 HA MET A 735 -0.690 -2.553 0.306 1.00 0.00 H new ATOM 0 HB2 MET A 735 -3.364 -2.260 -0.710 1.00 0.00 H new ATOM 0 HB3 MET A 735 -2.822 -3.874 -1.124 1.00 0.00 H new ATOM 0 HG2 MET A 735 -2.172 -3.114 1.643 1.00 0.00 H new ATOM 0 HG3 MET A 735 -3.891 -3.079 1.305 1.00 0.00 H new ATOM 0 HE1 MET A 735 -1.213 -6.803 0.678 1.00 0.00 H new ATOM 0 HE2 MET A 735 -0.990 -5.240 -0.144 1.00 0.00 H new ATOM 0 HE3 MET A 735 -0.672 -5.381 1.602 1.00 0.00 H new ATOM 781 N LYS A 736 0.623 -3.940 -1.220 1.00 0.00 N ATOM 782 CA LYS A 736 1.424 -4.791 -2.093 1.00 0.00 C ATOM 783 C LYS A 736 0.738 -6.136 -2.324 1.00 0.00 C ATOM 784 O LYS A 736 -0.401 -6.342 -1.911 1.00 0.00 O ATOM 785 CB LYS A 736 2.815 -5.003 -1.496 1.00 0.00 C ATOM 786 CG LYS A 736 3.150 -4.027 -0.381 1.00 0.00 C ATOM 787 CD LYS A 736 3.497 -2.663 -0.937 1.00 0.00 C ATOM 788 CE LYS A 736 2.938 -1.552 -0.069 1.00 0.00 C ATOM 789 NZ LYS A 736 3.479 -1.607 1.316 1.00 0.00 N ATOM 0 H LYS A 736 1.005 -3.815 -0.282 1.00 0.00 H new ATOM 0 HA LYS A 736 1.525 -4.290 -3.056 1.00 0.00 H new ATOM 0 HB2 LYS A 736 2.886 -6.020 -1.111 1.00 0.00 H new ATOM 0 HB3 LYS A 736 3.559 -4.909 -2.287 1.00 0.00 H new ATOM 0 HG2 LYS A 736 2.302 -3.941 0.298 1.00 0.00 H new ATOM 0 HG3 LYS A 736 3.988 -4.410 0.202 1.00 0.00 H new ATOM 0 HD2 LYS A 736 4.580 -2.562 -1.007 1.00 0.00 H new ATOM 0 HD3 LYS A 736 3.102 -2.570 -1.949 1.00 0.00 H new ATOM 0 HE2 LYS A 736 3.178 -0.587 -0.515 1.00 0.00 H new ATOM 0 HE3 LYS A 736 1.851 -1.627 -0.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 736 2.745 -1.962 1.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 736 4.301 -2.244 1.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 736 3.770 -0.654 1.613 1.00 0.00 H new ATOM 803 N ARG A 737 1.432 -7.048 -2.999 1.00 0.00 N ATOM 804 CA ARG A 737 0.881 -8.372 -3.274 1.00 0.00 C ATOM 805 C ARG A 737 0.669 -9.157 -1.992 1.00 0.00 C ATOM 806 O ARG A 737 1.267 -8.866 -0.958 1.00 0.00 O ATOM 807 CB ARG A 737 1.811 -9.166 -4.197 1.00 0.00 C ATOM 808 CG ARG A 737 2.035 -8.515 -5.550 1.00 0.00 C ATOM 809 CD ARG A 737 2.942 -9.364 -6.426 1.00 0.00 C ATOM 810 NE ARG A 737 3.181 -8.750 -7.729 1.00 0.00 N ATOM 811 CZ ARG A 737 4.229 -9.036 -8.495 1.00 0.00 C ATOM 812 NH1 ARG A 737 5.134 -9.916 -8.085 1.00 0.00 N ATOM 813 NH2 ARG A 737 4.376 -8.441 -9.671 1.00 0.00 N ATOM 0 H ARG A 737 2.372 -6.896 -3.364 1.00 0.00 H new ATOM 0 HA ARG A 737 -0.081 -8.225 -3.764 1.00 0.00 H new ATOM 0 HB2 ARG A 737 2.774 -9.295 -3.703 1.00 0.00 H new ATOM 0 HB3 ARG A 737 1.394 -10.162 -4.348 1.00 0.00 H new ATOM 0 HG2 ARG A 737 1.077 -8.368 -6.049 1.00 0.00 H new ATOM 0 HG3 ARG A 737 2.477 -7.528 -5.413 1.00 0.00 H new ATOM 0 HD2 ARG A 737 3.894 -9.518 -5.919 1.00 0.00 H new ATOM 0 HD3 ARG A 737 2.493 -10.347 -6.566 1.00 0.00 H new ATOM 0 HE ARG A 737 2.507 -8.064 -8.070 1.00 0.00 H new ATOM 0 HH11 ARG A 737 5.026 -10.375 -7.180 1.00 0.00 H new ATOM 0 HH12 ARG A 737 5.937 -10.134 -8.675 1.00 0.00 H new ATOM 0 HH21 ARG A 737 3.684 -7.762 -9.989 1.00 0.00 H new ATOM 0 HH22 ARG A 737 5.181 -8.662 -10.257 1.00 0.00 H new ATOM 827 N LYS A 738 -0.206 -10.146 -2.072 1.00 0.00 N ATOM 828 CA LYS A 738 -0.488 -11.013 -0.944 1.00 0.00 C ATOM 829 C LYS A 738 0.071 -12.393 -1.240 1.00 0.00 C ATOM 830 O LYS A 738 0.161 -13.250 -0.360 1.00 0.00 O ATOM 831 CB LYS A 738 -1.993 -11.090 -0.686 1.00 0.00 C ATOM 832 CG LYS A 738 -2.796 -11.481 -1.913 1.00 0.00 C ATOM 833 CD LYS A 738 -4.285 -11.488 -1.621 1.00 0.00 C ATOM 834 CE LYS A 738 -5.095 -11.699 -2.888 1.00 0.00 C ATOM 835 NZ LYS A 738 -4.811 -13.018 -3.516 1.00 0.00 N ATOM 0 H LYS A 738 -0.736 -10.368 -2.915 1.00 0.00 H new ATOM 0 HA LYS A 738 -0.018 -10.610 -0.047 1.00 0.00 H new ATOM 0 HB2 LYS A 738 -2.181 -11.813 0.108 1.00 0.00 H new ATOM 0 HB3 LYS A 738 -2.342 -10.122 -0.326 1.00 0.00 H new ATOM 0 HG2 LYS A 738 -2.586 -10.784 -2.724 1.00 0.00 H new ATOM 0 HG3 LYS A 738 -2.486 -12.469 -2.253 1.00 0.00 H new ATOM 0 HD2 LYS A 738 -4.514 -12.277 -0.905 1.00 0.00 H new ATOM 0 HD3 LYS A 738 -4.571 -10.544 -1.157 1.00 0.00 H new ATOM 0 HE2 LYS A 738 -6.158 -11.629 -2.655 1.00 0.00 H new ATOM 0 HE3 LYS A 738 -4.871 -10.903 -3.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 738 -5.467 -13.174 -4.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 738 -3.833 -13.031 -3.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 738 -4.935 -13.772 -2.811 1.00 0.00 H new ATOM 849 N ARG A 739 0.452 -12.587 -2.504 1.00 0.00 N ATOM 850 CA ARG A 739 1.017 -13.847 -2.959 1.00 0.00 C ATOM 851 C ARG A 739 1.445 -13.762 -4.422 1.00 0.00 C ATOM 852 O ARG A 739 2.637 -13.712 -4.724 1.00 0.00 O ATOM 853 CB ARG A 739 0.003 -14.980 -2.776 1.00 0.00 C ATOM 854 CG ARG A 739 0.499 -16.335 -3.261 1.00 0.00 C ATOM 855 CD ARG A 739 1.740 -16.783 -2.507 1.00 0.00 C ATOM 856 NE ARG A 739 1.516 -16.836 -1.065 1.00 0.00 N ATOM 857 CZ ARG A 739 2.387 -17.349 -0.201 1.00 0.00 C ATOM 858 NH1 ARG A 739 3.535 -17.853 -0.633 1.00 0.00 N ATOM 859 NH2 ARG A 739 2.111 -17.357 1.096 1.00 0.00 N ATOM 0 H ARG A 739 0.376 -11.877 -3.232 1.00 0.00 H new ATOM 0 HA ARG A 739 1.901 -14.056 -2.356 1.00 0.00 H new ATOM 0 HB2 ARG A 739 -0.256 -15.056 -1.720 1.00 0.00 H new ATOM 0 HB3 ARG A 739 -0.912 -14.726 -3.311 1.00 0.00 H new ATOM 0 HG2 ARG A 739 -0.290 -17.077 -3.137 1.00 0.00 H new ATOM 0 HG3 ARG A 739 0.721 -16.281 -4.327 1.00 0.00 H new ATOM 0 HD2 ARG A 739 2.044 -17.767 -2.863 1.00 0.00 H new ATOM 0 HD3 ARG A 739 2.561 -16.099 -2.721 1.00 0.00 H new ATOM 0 HE ARG A 739 0.642 -16.458 -0.700 1.00 0.00 H new ATOM 0 HH11 ARG A 739 3.751 -17.848 -1.630 1.00 0.00 H new ATOM 0 HH12 ARG A 739 4.202 -18.246 0.031 1.00 0.00 H new ATOM 0 HH21 ARG A 739 1.230 -16.969 1.432 1.00 0.00 H new ATOM 0 HH22 ARG A 739 2.780 -17.751 1.757 1.00 0.00 H new ATOM 873 N ASP A 740 0.468 -13.746 -5.325 1.00 0.00 N ATOM 874 CA ASP A 740 0.755 -13.674 -6.754 1.00 0.00 C ATOM 875 C ASP A 740 -0.059 -12.573 -7.429 1.00 0.00 C ATOM 876 O ASP A 740 -1.270 -12.471 -7.234 1.00 0.00 O ATOM 877 CB ASP A 740 0.466 -15.020 -7.421 1.00 0.00 C ATOM 878 CG ASP A 740 -0.990 -15.426 -7.299 1.00 0.00 C ATOM 879 OD1 ASP A 740 -1.404 -15.824 -6.190 1.00 0.00 O ATOM 880 OD2 ASP A 740 -1.716 -15.344 -8.311 1.00 0.00 O ATOM 0 H ASP A 740 -0.525 -13.782 -5.094 1.00 0.00 H new ATOM 0 HA ASP A 740 1.812 -13.435 -6.870 1.00 0.00 H new ATOM 0 HB2 ASP A 740 0.738 -14.966 -8.475 1.00 0.00 H new ATOM 0 HB3 ASP A 740 1.093 -15.788 -6.969 1.00 0.00 H new ATOM 885 N SER A 741 0.622 -11.756 -8.227 1.00 0.00 N ATOM 886 CA SER A 741 -0.020 -10.659 -8.946 1.00 0.00 C ATOM 887 C SER A 741 0.966 -10.008 -9.907 1.00 0.00 C ATOM 888 O SER A 741 2.100 -10.469 -10.049 1.00 0.00 O ATOM 889 CB SER A 741 -0.559 -9.617 -7.963 1.00 0.00 C ATOM 890 OG SER A 741 -1.355 -8.651 -8.628 1.00 0.00 O ATOM 0 H SER A 741 1.625 -11.834 -8.393 1.00 0.00 H new ATOM 0 HA SER A 741 -0.855 -11.064 -9.518 1.00 0.00 H new ATOM 0 HB2 SER A 741 -1.150 -10.111 -7.192 1.00 0.00 H new ATOM 0 HB3 SER A 741 0.272 -9.123 -7.460 1.00 0.00 H new ATOM 0 HG SER A 741 -2.303 -8.867 -8.505 1.00 0.00 H new ATOM 896 N SER A 742 0.535 -8.940 -10.567 1.00 0.00 N ATOM 897 CA SER A 742 1.392 -8.240 -11.515 1.00 0.00 C ATOM 898 C SER A 742 1.088 -6.746 -11.538 1.00 0.00 C ATOM 899 O SER A 742 1.982 -5.928 -11.754 1.00 0.00 O ATOM 900 CB SER A 742 1.221 -8.827 -12.917 1.00 0.00 C ATOM 901 OG SER A 742 2.041 -8.153 -13.856 1.00 0.00 O ATOM 0 H SER A 742 -0.398 -8.541 -10.464 1.00 0.00 H new ATOM 0 HA SER A 742 2.425 -8.373 -11.192 1.00 0.00 H new ATOM 0 HB2 SER A 742 1.474 -9.887 -12.904 1.00 0.00 H new ATOM 0 HB3 SER A 742 0.177 -8.752 -13.221 1.00 0.00 H new ATOM 0 HG SER A 742 1.914 -8.548 -14.744 1.00 0.00 H new ATOM 907 N ILE A 743 -0.175 -6.392 -11.314 1.00 0.00 N ATOM 908 CA ILE A 743 -0.582 -4.995 -11.323 1.00 0.00 C ATOM 909 C ILE A 743 -1.394 -4.636 -10.094 1.00 0.00 C ATOM 910 O ILE A 743 -1.372 -3.494 -9.634 1.00 0.00 O ATOM 911 CB ILE A 743 -1.393 -4.670 -12.590 1.00 0.00 C ATOM 912 CG1 ILE A 743 -2.748 -5.381 -12.562 1.00 0.00 C ATOM 913 CG2 ILE A 743 -0.606 -5.080 -13.823 1.00 0.00 C ATOM 914 CD1 ILE A 743 -3.681 -4.952 -13.675 1.00 0.00 C ATOM 0 H ILE A 743 -0.929 -7.052 -11.125 1.00 0.00 H new ATOM 0 HA ILE A 743 0.330 -4.398 -11.315 1.00 0.00 H new ATOM 0 HB ILE A 743 -1.574 -3.596 -12.624 1.00 0.00 H new ATOM 0 HG12 ILE A 743 -2.586 -6.457 -12.630 1.00 0.00 H new ATOM 0 HG13 ILE A 743 -3.229 -5.191 -11.603 1.00 0.00 H new ATOM 0 HG21 ILE A 743 -1.184 -4.848 -14.717 1.00 0.00 H new ATOM 0 HG22 ILE A 743 0.338 -4.536 -13.850 1.00 0.00 H new ATOM 0 HG23 ILE A 743 -0.406 -6.151 -13.788 1.00 0.00 H new ATOM 0 HD11 ILE A 743 -4.621 -5.497 -13.592 1.00 0.00 H new ATOM 0 HD12 ILE A 743 -3.874 -3.882 -13.596 1.00 0.00 H new ATOM 0 HD13 ILE A 743 -3.221 -5.168 -14.639 1.00 0.00 H new ATOM 926 N LEU A 744 -2.103 -5.616 -9.568 1.00 0.00 N ATOM 927 CA LEU A 744 -2.926 -5.413 -8.390 1.00 0.00 C ATOM 928 C LEU A 744 -3.902 -4.254 -8.588 1.00 0.00 C ATOM 929 O LEU A 744 -4.235 -3.540 -7.641 1.00 0.00 O ATOM 930 CB LEU A 744 -2.049 -5.155 -7.160 1.00 0.00 C ATOM 931 CG LEU A 744 -1.416 -6.395 -6.531 1.00 0.00 C ATOM 932 CD1 LEU A 744 -0.473 -5.992 -5.410 1.00 0.00 C ATOM 933 CD2 LEU A 744 -2.489 -7.341 -6.009 1.00 0.00 C ATOM 0 H LEU A 744 -2.126 -6.566 -9.940 1.00 0.00 H new ATOM 0 HA LEU A 744 -3.505 -6.323 -8.230 1.00 0.00 H new ATOM 0 HB2 LEU A 744 -1.253 -4.465 -7.441 1.00 0.00 H new ATOM 0 HB3 LEU A 744 -2.653 -4.654 -6.404 1.00 0.00 H new ATOM 0 HG LEU A 744 -0.845 -6.918 -7.298 1.00 0.00 H new ATOM 0 HD11 LEU A 744 -0.028 -6.885 -4.970 1.00 0.00 H new ATOM 0 HD12 LEU A 744 0.315 -5.353 -5.809 1.00 0.00 H new ATOM 0 HD13 LEU A 744 -1.028 -5.448 -4.645 1.00 0.00 H new ATOM 0 HD21 LEU A 744 -2.017 -8.217 -5.565 1.00 0.00 H new ATOM 0 HD22 LEU A 744 -3.088 -6.831 -5.255 1.00 0.00 H new ATOM 0 HD23 LEU A 744 -3.131 -7.653 -6.833 1.00 0.00 H new ATOM 945 N THR A 745 -4.369 -4.081 -9.820 1.00 0.00 N ATOM 946 CA THR A 745 -5.300 -3.006 -10.143 1.00 0.00 C ATOM 947 C THR A 745 -6.735 -3.520 -10.220 1.00 0.00 C ATOM 948 O THR A 745 -6.977 -4.653 -10.635 1.00 0.00 O ATOM 949 CB THR A 745 -4.931 -2.336 -11.482 1.00 0.00 C ATOM 950 OG1 THR A 745 -3.593 -1.829 -11.422 1.00 0.00 O ATOM 951 CG2 THR A 745 -5.890 -1.202 -11.809 1.00 0.00 C ATOM 0 H THR A 745 -4.118 -4.672 -10.612 1.00 0.00 H new ATOM 0 HA THR A 745 -5.228 -2.271 -9.341 1.00 0.00 H new ATOM 0 HB THR A 745 -5.004 -3.088 -12.268 1.00 0.00 H new ATOM 0 HG1 THR A 745 -3.365 -1.406 -12.276 1.00 0.00 H new ATOM 0 HG21 THR A 745 -5.606 -0.748 -12.758 1.00 0.00 H new ATOM 0 HG22 THR A 745 -6.905 -1.593 -11.883 1.00 0.00 H new ATOM 0 HG23 THR A 745 -5.848 -0.451 -11.020 1.00 0.00 H new ATOM 959 N ASP A 746 -7.682 -2.676 -9.818 1.00 0.00 N ATOM 960 CA ASP A 746 -9.094 -3.041 -9.842 1.00 0.00 C ATOM 961 C ASP A 746 -9.960 -1.844 -10.225 1.00 0.00 C ATOM 962 O ASP A 746 -10.344 -1.692 -11.385 1.00 0.00 O ATOM 963 CB ASP A 746 -9.523 -3.586 -8.479 1.00 0.00 C ATOM 964 CG ASP A 746 -10.991 -3.964 -8.440 1.00 0.00 C ATOM 965 OD1 ASP A 746 -11.347 -5.016 -9.011 1.00 0.00 O ATOM 966 OD2 ASP A 746 -11.782 -3.210 -7.838 1.00 0.00 O ATOM 0 H ASP A 746 -7.496 -1.735 -9.472 1.00 0.00 H new ATOM 0 HA ASP A 746 -9.232 -3.818 -10.594 1.00 0.00 H new ATOM 0 HB2 ASP A 746 -8.920 -4.460 -8.235 1.00 0.00 H new ATOM 0 HB3 ASP A 746 -9.324 -2.837 -7.713 1.00 0.00 H new ATOM 971 N SER A 747 -10.261 -0.997 -9.246 1.00 0.00 N ATOM 972 CA SER A 747 -11.077 0.188 -9.483 1.00 0.00 C ATOM 973 C SER A 747 -10.995 1.150 -8.304 1.00 0.00 C ATOM 974 O SER A 747 -10.550 0.780 -7.217 1.00 0.00 O ATOM 975 CB SER A 747 -12.532 -0.209 -9.743 1.00 0.00 C ATOM 976 OG SER A 747 -13.024 -1.045 -8.712 1.00 0.00 O ATOM 0 H SER A 747 -9.952 -1.109 -8.281 1.00 0.00 H new ATOM 0 HA SER A 747 -10.688 0.696 -10.366 1.00 0.00 H new ATOM 0 HB2 SER A 747 -13.149 0.686 -9.815 1.00 0.00 H new ATOM 0 HB3 SER A 747 -12.606 -0.725 -10.700 1.00 0.00 H new ATOM 0 HG SER A 747 -12.607 -1.929 -8.780 1.00 0.00 H new ATOM 982 N GLN A 748 -11.427 2.389 -8.525 1.00 0.00 N ATOM 983 CA GLN A 748 -11.392 3.411 -7.485 1.00 0.00 C ATOM 984 C GLN A 748 -12.622 3.332 -6.585 1.00 0.00 C ATOM 985 O GLN A 748 -12.854 4.216 -5.761 1.00 0.00 O ATOM 986 CB GLN A 748 -11.299 4.802 -8.114 1.00 0.00 C ATOM 987 CG GLN A 748 -12.476 5.142 -9.016 1.00 0.00 C ATOM 988 CD GLN A 748 -12.350 6.514 -9.652 1.00 0.00 C ATOM 989 OE1 GLN A 748 -13.351 7.179 -9.921 1.00 0.00 O ATOM 990 NE2 GLN A 748 -11.117 6.943 -9.903 1.00 0.00 N ATOM 0 H GLN A 748 -11.806 2.709 -9.416 1.00 0.00 H new ATOM 0 HA GLN A 748 -10.509 3.231 -6.871 1.00 0.00 H new ATOM 0 HB2 GLN A 748 -11.233 5.547 -7.321 1.00 0.00 H new ATOM 0 HB3 GLN A 748 -10.377 4.869 -8.692 1.00 0.00 H new ATOM 0 HG2 GLN A 748 -12.557 4.389 -9.800 1.00 0.00 H new ATOM 0 HG3 GLN A 748 -13.398 5.098 -8.436 1.00 0.00 H new ATOM 0 HE21 GLN A 748 -10.315 6.359 -9.664 1.00 0.00 H new ATOM 0 HE22 GLN A 748 -10.973 7.856 -10.335 1.00 0.00 H new ATOM 999 N THR A 749 -13.406 2.271 -6.745 1.00 0.00 N ATOM 1000 CA THR A 749 -14.606 2.088 -5.936 1.00 0.00 C ATOM 1001 C THR A 749 -14.247 1.591 -4.540 1.00 0.00 C ATOM 1002 O THR A 749 -15.124 1.302 -3.725 1.00 0.00 O ATOM 1003 CB THR A 749 -15.587 1.097 -6.590 1.00 0.00 C ATOM 1004 OG1 THR A 749 -16.850 1.141 -5.914 1.00 0.00 O ATOM 1005 CG2 THR A 749 -15.040 -0.324 -6.547 1.00 0.00 C ATOM 0 H THR A 749 -13.234 1.529 -7.423 1.00 0.00 H new ATOM 0 HA THR A 749 -15.092 3.061 -5.863 1.00 0.00 H new ATOM 0 HB THR A 749 -15.716 1.389 -7.632 1.00 0.00 H new ATOM 0 HG1 THR A 749 -16.702 1.225 -4.949 1.00 0.00 H new ATOM 0 HG21 THR A 749 -15.753 -1.003 -7.015 1.00 0.00 H new ATOM 0 HG22 THR A 749 -14.093 -0.366 -7.084 1.00 0.00 H new ATOM 0 HG23 THR A 749 -14.883 -0.622 -5.510 1.00 0.00 H new ATOM 1013 N ALA A 750 -12.949 1.496 -4.275 1.00 0.00 N ATOM 1014 CA ALA A 750 -12.460 1.032 -2.984 1.00 0.00 C ATOM 1015 C ALA A 750 -11.306 1.903 -2.497 1.00 0.00 C ATOM 1016 O ALA A 750 -10.250 1.396 -2.116 1.00 0.00 O ATOM 1017 CB ALA A 750 -12.021 -0.420 -3.088 1.00 0.00 C ATOM 0 H ALA A 750 -12.214 1.736 -4.941 1.00 0.00 H new ATOM 0 HA ALA A 750 -13.270 1.107 -2.258 1.00 0.00 H new ATOM 0 HB1 ALA A 750 -11.656 -0.760 -2.119 1.00 0.00 H new ATOM 0 HB2 ALA A 750 -12.867 -1.035 -3.394 1.00 0.00 H new ATOM 0 HB3 ALA A 750 -11.224 -0.507 -3.826 1.00 0.00 H new ATOM 1023 N THR A 751 -11.516 3.217 -2.504 1.00 0.00 N ATOM 1024 CA THR A 751 -10.489 4.158 -2.072 1.00 0.00 C ATOM 1025 C THR A 751 -10.435 4.257 -0.557 1.00 0.00 C ATOM 1026 O THR A 751 -9.773 5.133 0.000 1.00 0.00 O ATOM 1027 CB THR A 751 -10.713 5.560 -2.676 1.00 0.00 C ATOM 1028 OG1 THR A 751 -11.088 5.443 -4.054 1.00 0.00 O ATOM 1029 CG2 THR A 751 -9.457 6.414 -2.564 1.00 0.00 C ATOM 0 H THR A 751 -12.388 3.653 -2.804 1.00 0.00 H new ATOM 0 HA THR A 751 -9.536 3.773 -2.435 1.00 0.00 H new ATOM 0 HB THR A 751 -11.512 6.045 -2.115 1.00 0.00 H new ATOM 0 HG1 THR A 751 -11.935 4.956 -4.122 1.00 0.00 H new ATOM 0 HG21 THR A 751 -9.645 7.396 -2.998 1.00 0.00 H new ATOM 0 HG22 THR A 751 -9.186 6.527 -1.514 1.00 0.00 H new ATOM 0 HG23 THR A 751 -8.640 5.931 -3.100 1.00 0.00 H new ATOM 1037 N LYS A 752 -11.138 3.357 0.107 1.00 0.00 N ATOM 1038 CA LYS A 752 -11.140 3.321 1.556 1.00 0.00 C ATOM 1039 C LYS A 752 -10.148 2.268 2.024 1.00 0.00 C ATOM 1040 O LYS A 752 -9.280 2.533 2.854 1.00 0.00 O ATOM 1041 CB LYS A 752 -12.535 3.009 2.086 1.00 0.00 C ATOM 1042 CG LYS A 752 -12.617 3.096 3.591 1.00 0.00 C ATOM 1043 CD LYS A 752 -14.017 2.789 4.096 1.00 0.00 C ATOM 1044 CE LYS A 752 -14.096 2.882 5.610 1.00 0.00 C ATOM 1045 NZ LYS A 752 -13.169 1.925 6.274 1.00 0.00 N ATOM 0 H LYS A 752 -11.715 2.641 -0.336 1.00 0.00 H new ATOM 0 HA LYS A 752 -10.848 4.298 1.941 1.00 0.00 H new ATOM 0 HB2 LYS A 752 -13.251 3.704 1.646 1.00 0.00 H new ATOM 0 HB3 LYS A 752 -12.825 2.008 1.767 1.00 0.00 H new ATOM 0 HG2 LYS A 752 -11.908 2.397 4.035 1.00 0.00 H new ATOM 0 HG3 LYS A 752 -12.324 4.095 3.914 1.00 0.00 H new ATOM 0 HD2 LYS A 752 -14.727 3.486 3.650 1.00 0.00 H new ATOM 0 HD3 LYS A 752 -14.309 1.789 3.776 1.00 0.00 H new ATOM 0 HE2 LYS A 752 -13.856 3.898 5.924 1.00 0.00 H new ATOM 0 HE3 LYS A 752 -15.117 2.682 5.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 752 -13.404 1.859 7.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 752 -13.264 0.987 5.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 752 -12.190 2.260 6.168 1.00 0.00 H new ATOM 1059 N ARG A 753 -10.290 1.076 1.456 1.00 0.00 N ATOM 1060 CA ARG A 753 -9.417 -0.052 1.749 1.00 0.00 C ATOM 1061 C ARG A 753 -9.588 -1.112 0.668 1.00 0.00 C ATOM 1062 O ARG A 753 -10.690 -1.313 0.158 1.00 0.00 O ATOM 1063 CB ARG A 753 -9.705 -0.643 3.130 1.00 0.00 C ATOM 1064 CG ARG A 753 -8.910 0.013 4.250 1.00 0.00 C ATOM 1065 CD ARG A 753 -8.979 -0.804 5.529 1.00 0.00 C ATOM 1066 NE ARG A 753 -10.341 -0.892 6.048 1.00 0.00 N ATOM 1067 CZ ARG A 753 -10.876 -2.007 6.538 1.00 0.00 C ATOM 1068 NH1 ARG A 753 -10.165 -3.127 6.580 1.00 0.00 N ATOM 1069 NH2 ARG A 753 -12.124 -2.004 6.986 1.00 0.00 N ATOM 0 H ARG A 753 -11.019 0.865 0.775 1.00 0.00 H new ATOM 0 HA ARG A 753 -8.386 0.300 1.758 1.00 0.00 H new ATOM 0 HB2 ARG A 753 -10.769 -0.543 3.344 1.00 0.00 H new ATOM 0 HB3 ARG A 753 -9.482 -1.710 3.114 1.00 0.00 H new ATOM 0 HG2 ARG A 753 -7.870 0.125 3.943 1.00 0.00 H new ATOM 0 HG3 ARG A 753 -9.297 1.015 4.435 1.00 0.00 H new ATOM 0 HD2 ARG A 753 -8.598 -1.807 5.339 1.00 0.00 H new ATOM 0 HD3 ARG A 753 -8.332 -0.354 6.282 1.00 0.00 H new ATOM 0 HE ARG A 753 -10.916 -0.049 6.034 1.00 0.00 H new ATOM 0 HH11 ARG A 753 -9.205 -3.135 6.236 1.00 0.00 H new ATOM 0 HH12 ARG A 753 -10.579 -3.980 6.956 1.00 0.00 H new ATOM 0 HH21 ARG A 753 -12.675 -1.146 6.955 1.00 0.00 H new ATOM 0 HH22 ARG A 753 -12.533 -2.860 7.361 1.00 0.00 H new ATOM 1083 N ILE A 754 -8.493 -1.778 0.317 1.00 0.00 N ATOM 1084 CA ILE A 754 -8.515 -2.802 -0.724 1.00 0.00 C ATOM 1085 C ILE A 754 -9.701 -3.749 -0.576 1.00 0.00 C ATOM 1086 O ILE A 754 -10.148 -4.044 0.533 1.00 0.00 O ATOM 1087 CB ILE A 754 -7.205 -3.616 -0.745 1.00 0.00 C ATOM 1088 CG1 ILE A 754 -7.132 -4.596 0.437 1.00 0.00 C ATOM 1089 CG2 ILE A 754 -6.014 -2.673 -0.744 1.00 0.00 C ATOM 1090 CD1 ILE A 754 -7.220 -3.944 1.801 1.00 0.00 C ATOM 0 H ILE A 754 -7.577 -1.627 0.739 1.00 0.00 H new ATOM 0 HA ILE A 754 -8.618 -2.270 -1.670 1.00 0.00 H new ATOM 0 HB ILE A 754 -7.184 -4.211 -1.658 1.00 0.00 H new ATOM 0 HG12 ILE A 754 -7.941 -5.321 0.342 1.00 0.00 H new ATOM 0 HG13 ILE A 754 -6.197 -5.152 0.374 1.00 0.00 H new ATOM 0 HG21 ILE A 754 -5.091 -3.253 -0.759 1.00 0.00 H new ATOM 0 HG22 ILE A 754 -6.055 -2.034 -1.626 1.00 0.00 H new ATOM 0 HG23 ILE A 754 -6.040 -2.055 0.154 1.00 0.00 H new ATOM 0 HD11 ILE A 754 -7.160 -4.709 2.575 1.00 0.00 H new ATOM 0 HD12 ILE A 754 -6.396 -3.241 1.922 1.00 0.00 H new ATOM 0 HD13 ILE A 754 -8.167 -3.412 1.889 1.00 0.00 H new ATOM 1102 N ARG A 755 -10.201 -4.218 -1.713 1.00 0.00 N ATOM 1103 CA ARG A 755 -11.340 -5.126 -1.744 1.00 0.00 C ATOM 1104 C ARG A 755 -10.907 -6.569 -1.509 1.00 0.00 C ATOM 1105 O ARG A 755 -11.714 -7.494 -1.613 1.00 0.00 O ATOM 1106 CB ARG A 755 -12.071 -5.009 -3.087 1.00 0.00 C ATOM 1107 CG ARG A 755 -11.152 -4.748 -4.276 1.00 0.00 C ATOM 1108 CD ARG A 755 -10.199 -5.907 -4.526 1.00 0.00 C ATOM 1109 NE ARG A 755 -9.392 -5.708 -5.728 1.00 0.00 N ATOM 1110 CZ ARG A 755 -8.388 -6.507 -6.080 1.00 0.00 C ATOM 1111 NH1 ARG A 755 -8.093 -7.569 -5.344 1.00 0.00 N ATOM 1112 NH2 ARG A 755 -7.682 -6.249 -7.173 1.00 0.00 N ATOM 0 H ARG A 755 -9.831 -3.981 -2.634 1.00 0.00 H new ATOM 0 HA ARG A 755 -12.017 -4.842 -0.939 1.00 0.00 H new ATOM 0 HB2 ARG A 755 -12.628 -5.929 -3.267 1.00 0.00 H new ATOM 0 HB3 ARG A 755 -12.801 -4.202 -3.022 1.00 0.00 H new ATOM 0 HG2 ARG A 755 -11.754 -4.575 -5.168 1.00 0.00 H new ATOM 0 HG3 ARG A 755 -10.578 -3.839 -4.098 1.00 0.00 H new ATOM 0 HD2 ARG A 755 -9.542 -6.027 -3.665 1.00 0.00 H new ATOM 0 HD3 ARG A 755 -10.770 -6.830 -4.622 1.00 0.00 H new ATOM 0 HE ARG A 755 -9.610 -4.914 -6.330 1.00 0.00 H new ATOM 0 HH11 ARG A 755 -8.636 -7.775 -4.506 1.00 0.00 H new ATOM 0 HH12 ARG A 755 -7.323 -8.180 -5.616 1.00 0.00 H new ATOM 0 HH21 ARG A 755 -7.908 -5.436 -7.746 1.00 0.00 H new ATOM 0 HH22 ARG A 755 -6.913 -6.863 -7.440 1.00 0.00 H new ATOM 1126 N MET A 756 -9.631 -6.759 -1.188 1.00 0.00 N ATOM 1127 CA MET A 756 -9.100 -8.094 -0.945 1.00 0.00 C ATOM 1128 C MET A 756 -7.957 -8.053 0.065 1.00 0.00 C ATOM 1129 O MET A 756 -6.877 -7.540 -0.226 1.00 0.00 O ATOM 1130 CB MET A 756 -8.622 -8.714 -2.258 1.00 0.00 C ATOM 1131 CG MET A 756 -8.471 -10.225 -2.198 1.00 0.00 C ATOM 1132 SD MET A 756 -8.316 -10.971 -3.833 1.00 0.00 S ATOM 1133 CE MET A 756 -8.434 -12.711 -3.425 1.00 0.00 C ATOM 0 H MET A 756 -8.948 -6.008 -1.091 1.00 0.00 H new ATOM 0 HA MET A 756 -9.898 -8.709 -0.529 1.00 0.00 H new ATOM 0 HB2 MET A 756 -9.328 -8.459 -3.049 1.00 0.00 H new ATOM 0 HB3 MET A 756 -7.664 -8.272 -2.531 1.00 0.00 H new ATOM 0 HG2 MET A 756 -7.592 -10.475 -1.603 1.00 0.00 H new ATOM 0 HG3 MET A 756 -9.334 -10.653 -1.688 1.00 0.00 H new ATOM 0 HE1 MET A 756 -7.816 -13.289 -4.112 1.00 0.00 H new ATOM 0 HE2 MET A 756 -8.087 -12.870 -2.404 1.00 0.00 H new ATOM 0 HE3 MET A 756 -9.471 -13.035 -3.510 1.00 0.00 H new ATOM 1143 N ALA A 757 -8.201 -8.603 1.250 1.00 0.00 N ATOM 1144 CA ALA A 757 -7.195 -8.625 2.305 1.00 0.00 C ATOM 1145 C ALA A 757 -5.987 -9.466 1.903 1.00 0.00 C ATOM 1146 O ALA A 757 -5.928 -9.999 0.794 1.00 0.00 O ATOM 1147 CB ALA A 757 -7.798 -9.150 3.598 1.00 0.00 C ATOM 0 H ALA A 757 -9.087 -9.040 1.504 1.00 0.00 H new ATOM 0 HA ALA A 757 -6.853 -7.602 2.463 1.00 0.00 H new ATOM 0 HB1 ALA A 757 -7.036 -9.161 4.377 1.00 0.00 H new ATOM 0 HB2 ALA A 757 -8.621 -8.504 3.904 1.00 0.00 H new ATOM 0 HB3 ALA A 757 -8.171 -10.162 3.441 1.00 0.00 H new ATOM 1153 N ILE A 758 -5.026 -9.581 2.814 1.00 0.00 N ATOM 1154 CA ILE A 758 -3.815 -10.352 2.562 1.00 0.00 C ATOM 1155 C ILE A 758 -4.065 -11.844 2.761 1.00 0.00 C ATOM 1156 O ILE A 758 -4.157 -12.603 1.795 1.00 0.00 O ATOM 1157 CB ILE A 758 -2.656 -9.902 3.479 1.00 0.00 C ATOM 1158 CG1 ILE A 758 -2.295 -8.438 3.215 1.00 0.00 C ATOM 1159 CG2 ILE A 758 -1.437 -10.792 3.278 1.00 0.00 C ATOM 1160 CD1 ILE A 758 -3.255 -7.447 3.841 1.00 0.00 C ATOM 0 H ILE A 758 -5.064 -9.148 3.737 1.00 0.00 H new ATOM 0 HA ILE A 758 -3.532 -10.170 1.525 1.00 0.00 H new ATOM 0 HB ILE A 758 -2.986 -9.995 4.514 1.00 0.00 H new ATOM 0 HG12 ILE A 758 -1.292 -8.247 3.596 1.00 0.00 H new ATOM 0 HG13 ILE A 758 -2.265 -8.270 2.138 1.00 0.00 H new ATOM 0 HG21 ILE A 758 -0.632 -10.459 3.933 1.00 0.00 H new ATOM 0 HG22 ILE A 758 -1.696 -11.823 3.517 1.00 0.00 H new ATOM 0 HG23 ILE A 758 -1.110 -10.732 2.240 1.00 0.00 H new ATOM 0 HD11 ILE A 758 -2.932 -6.432 3.610 1.00 0.00 H new ATOM 0 HD12 ILE A 758 -4.256 -7.609 3.442 1.00 0.00 H new ATOM 0 HD13 ILE A 758 -3.268 -7.586 4.922 1.00 0.00 H new ATOM 1172 N ASN A 759 -4.174 -12.257 4.019 1.00 0.00 N ATOM 1173 CA ASN A 759 -4.417 -13.658 4.347 1.00 0.00 C ATOM 1174 C ASN A 759 -5.736 -13.817 5.097 1.00 0.00 C ATOM 1175 O ASN A 759 -5.730 -13.679 6.338 1.00 0.00 O ATOM 1176 CB ASN A 759 -3.267 -14.216 5.187 1.00 0.00 C ATOM 1177 CG ASN A 759 -3.450 -15.685 5.516 1.00 0.00 C ATOM 1178 OD1 ASN A 759 -2.999 -16.560 4.776 1.00 0.00 O ATOM 1179 ND2 ASN A 759 -4.120 -15.963 6.630 1.00 0.00 N ATOM 1180 OXT ASN A 759 -6.762 -14.077 4.436 1.00 0.00 O ATOM 0 H ASN A 759 -4.098 -11.642 4.829 1.00 0.00 H new ATOM 0 HA ASN A 759 -4.479 -14.219 3.415 1.00 0.00 H new ATOM 0 HB2 ASN A 759 -2.329 -14.081 4.648 1.00 0.00 H new ATOM 0 HB3 ASN A 759 -3.188 -13.646 6.113 1.00 0.00 H new ATOM 0 HD21 ASN A 759 -4.278 -16.933 6.901 1.00 0.00 H new ATOM 0 HD22 ASN A 759 -4.476 -15.206 7.213 1.00 0.00 H new