USER MOD reduce.3.24.130724 H: found=0, std=0, add=868, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 869 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 692 HIS : no HD1:sc= -3.47! C(o=-4.3!,f=-4!) USER MOD Set 1.2: A 696 HIS : no HD1:sc= -0.795 X(o=-4.3,f=-4!) USER MOD Set 2.1: A 677 MET CE :methyl -171:sc= -1.81 (180deg=-1.94) USER MOD Set 2.2: A 686 CYS SG : rot 180:sc= -0.165 USER MOD Single : A 629 HIS : no HE2:sc= 0.00513 X(o=0.0051,f=-0.14) USER MOD Single : A 641 THR OG1 : rot 87:sc= 1.01 USER MOD Single : A 644 CYS SG : rot 180:sc= -1.71! USER MOD Single : A 646 MET CE :methyl 138:sc= -1.6 (180deg=-6.83!) USER MOD Single : A 648 THR OG1 : rot 89:sc= 0.292! USER MOD Single : A 653 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 661 SER OG : rot 180:sc= 0 USER MOD Single : A 662 THR OG1 : rot 180:sc= 0 USER MOD Single : A 666 GLN :FLIP amide:sc= 0 F(o=-1.3!,f=0) USER MOD Single : A 671 GLN : amide:sc= -1.79! C(o=-1.8!,f=-3.1!) USER MOD Single : A 684 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 685 SER OG : rot 180:sc= 0 USER MOD Single : A 691 GLN : amide:sc= -0.849 K(o=-0.85,f=-3.4!) USER MOD Single : A 718 THR OG1 : rot 180:sc= 0 USER MOD Single : A 720 GLN :FLIP amide:sc= 0 F(o=-1.1!,f=0) USER MOD Single : A 722 SER OG : rot -90:sc= -0.0296 USER MOD Single : A 726 SER OG : rot 180:sc= 0 USER MOD Single : A 727 LYS NZ :NH3+ 160:sc= -0.0278 (180deg=-0.754) USER MOD Single : A 732 GLN :FLIP amide:sc= 0 F(o=-1!,f=0) USER MOD Single : A 736 THR OG1 : rot 72:sc= 0.888 USER MOD Single : A 737 THR OG1 : rot 180:sc= 0 USER MOD Single : A 739 GLN :FLIP amide:sc= 0 F(o=-1.1!,f=0) USER MOD ----------------------------------------------------------------- ATOM 13 N GLY A 628 -5.564 6.833 10.283 1.00 0.00 N ATOM 14 CA GLY A 628 -5.919 5.742 9.381 1.00 0.00 C ATOM 15 C GLY A 628 -5.698 6.158 7.931 1.00 0.00 C ATOM 16 O GLY A 628 -6.599 6.049 7.099 1.00 0.00 O ATOM 0 HA2 GLY A 628 -5.317 4.862 9.609 1.00 0.00 H new ATOM 0 HA3 GLY A 628 -6.962 5.462 9.531 1.00 0.00 H new ATOM 20 N HIS A 629 -4.497 6.645 7.638 1.00 0.00 N ATOM 21 CA HIS A 629 -4.168 7.089 6.287 1.00 0.00 C ATOM 22 C HIS A 629 -3.648 5.925 5.447 1.00 0.00 C ATOM 23 O HIS A 629 -2.945 5.052 5.951 1.00 0.00 O ATOM 24 CB HIS A 629 -3.092 8.175 6.349 1.00 0.00 C ATOM 25 CG HIS A 629 -3.602 9.363 7.112 1.00 0.00 C ATOM 26 ND1 HIS A 629 -2.771 10.140 7.903 1.00 0.00 N ATOM 27 CD2 HIS A 629 -4.847 9.929 7.206 1.00 0.00 C ATOM 28 CE1 HIS A 629 -3.519 11.124 8.433 1.00 0.00 C ATOM 29 NE2 HIS A 629 -4.792 11.043 8.039 1.00 0.00 N ATOM 0 H HIS A 629 -3.739 6.742 8.313 1.00 0.00 H new ATOM 0 HA HIS A 629 -5.074 7.484 5.827 1.00 0.00 H new ATOM 0 HB2 HIS A 629 -2.195 7.783 6.829 1.00 0.00 H new ATOM 0 HB3 HIS A 629 -2.809 8.475 5.340 1.00 0.00 H new ATOM 0 HD1 HIS A 629 -1.773 9.992 8.056 1.00 0.00 H new ATOM 0 HD2 HIS A 629 -5.735 9.566 6.710 1.00 0.00 H new ATOM 0 HE1 HIS A 629 -3.137 11.886 9.096 1.00 0.00 H new ATOM 38 N ILE A 630 -3.988 5.923 4.162 1.00 0.00 N ATOM 39 CA ILE A 630 -3.532 4.864 3.267 1.00 0.00 C ATOM 40 C ILE A 630 -2.684 5.443 2.137 1.00 0.00 C ATOM 41 O ILE A 630 -3.060 6.433 1.507 1.00 0.00 O ATOM 42 CB ILE A 630 -4.727 4.105 2.689 1.00 0.00 C ATOM 43 CG1 ILE A 630 -5.521 3.476 3.835 1.00 0.00 C ATOM 44 CG2 ILE A 630 -4.230 3.007 1.745 1.00 0.00 C ATOM 45 CD1 ILE A 630 -6.735 2.738 3.275 1.00 0.00 C ATOM 0 H ILE A 630 -4.571 6.634 3.720 1.00 0.00 H new ATOM 0 HA ILE A 630 -2.918 4.171 3.842 1.00 0.00 H new ATOM 0 HB ILE A 630 -5.365 4.792 2.134 1.00 0.00 H new ATOM 0 HG12 ILE A 630 -4.888 2.785 4.392 1.00 0.00 H new ATOM 0 HG13 ILE A 630 -5.843 4.248 4.534 1.00 0.00 H new ATOM 0 HG21 ILE A 630 -5.083 2.467 1.334 1.00 0.00 H new ATOM 0 HG22 ILE A 630 -3.659 3.457 0.932 1.00 0.00 H new ATOM 0 HG23 ILE A 630 -3.593 2.314 2.296 1.00 0.00 H new ATOM 0 HD11 ILE A 630 -7.299 2.291 4.094 1.00 0.00 H new ATOM 0 HD12 ILE A 630 -7.372 3.441 2.737 1.00 0.00 H new ATOM 0 HD13 ILE A 630 -6.402 1.955 2.594 1.00 0.00 H new ATOM 57 N LEU A 631 -1.534 4.823 1.893 1.00 0.00 N ATOM 58 CA LEU A 631 -0.631 5.286 0.843 1.00 0.00 C ATOM 59 C LEU A 631 -0.499 4.245 -0.261 1.00 0.00 C ATOM 60 O LEU A 631 -0.326 3.059 0.015 1.00 0.00 O ATOM 61 CB LEU A 631 0.747 5.574 1.434 1.00 0.00 C ATOM 62 CG LEU A 631 1.687 6.051 0.328 1.00 0.00 C ATOM 63 CD1 LEU A 631 1.234 7.423 -0.173 1.00 0.00 C ATOM 64 CD2 LEU A 631 3.109 6.155 0.882 1.00 0.00 C ATOM 0 H LEU A 631 -1.206 4.004 2.404 1.00 0.00 H new ATOM 0 HA LEU A 631 -1.047 6.198 0.415 1.00 0.00 H new ATOM 0 HB2 LEU A 631 0.669 6.333 2.212 1.00 0.00 H new ATOM 0 HB3 LEU A 631 1.148 4.676 1.904 1.00 0.00 H new ATOM 0 HG LEU A 631 1.667 5.340 -0.498 1.00 0.00 H new ATOM 0 HD11 LEU A 631 1.905 7.762 -0.962 1.00 0.00 H new ATOM 0 HD12 LEU A 631 0.220 7.350 -0.566 1.00 0.00 H new ATOM 0 HD13 LEU A 631 1.253 8.136 0.651 1.00 0.00 H new ATOM 0 HD21 LEU A 631 3.782 6.495 0.095 1.00 0.00 H new ATOM 0 HD22 LEU A 631 3.127 6.867 1.707 1.00 0.00 H new ATOM 0 HD23 LEU A 631 3.433 5.177 1.239 1.00 0.00 H new ATOM 76 N LEU A 632 -0.578 4.689 -1.512 1.00 0.00 N ATOM 77 CA LEU A 632 -0.460 3.767 -2.633 1.00 0.00 C ATOM 78 C LEU A 632 0.438 4.334 -3.739 1.00 0.00 C ATOM 79 O LEU A 632 0.305 5.492 -4.135 1.00 0.00 O ATOM 80 CB LEU A 632 -1.858 3.434 -3.182 1.00 0.00 C ATOM 81 CG LEU A 632 -2.095 4.119 -4.533 1.00 0.00 C ATOM 82 CD1 LEU A 632 -1.266 3.421 -5.613 1.00 0.00 C ATOM 83 CD2 LEU A 632 -3.582 4.029 -4.894 1.00 0.00 C ATOM 0 H LEU A 632 -0.721 5.665 -1.771 1.00 0.00 H new ATOM 0 HA LEU A 632 0.010 2.852 -2.274 1.00 0.00 H new ATOM 0 HB2 LEU A 632 -1.961 2.355 -3.294 1.00 0.00 H new ATOM 0 HB3 LEU A 632 -2.618 3.754 -2.470 1.00 0.00 H new ATOM 0 HG LEU A 632 -1.797 5.165 -4.467 1.00 0.00 H new ATOM 0 HD11 LEU A 632 -1.435 3.908 -6.573 1.00 0.00 H new ATOM 0 HD12 LEU A 632 -0.208 3.482 -5.356 1.00 0.00 H new ATOM 0 HD13 LEU A 632 -1.563 2.374 -5.680 1.00 0.00 H new ATOM 0 HD21 LEU A 632 -3.753 4.515 -5.854 1.00 0.00 H new ATOM 0 HD22 LEU A 632 -3.878 2.982 -4.960 1.00 0.00 H new ATOM 0 HD23 LEU A 632 -4.174 4.526 -4.125 1.00 0.00 H new ATOM 95 N LEU A 633 1.341 3.494 -4.245 1.00 0.00 N ATOM 96 CA LEU A 633 2.242 3.895 -5.326 1.00 0.00 C ATOM 97 C LEU A 633 1.827 3.193 -6.608 1.00 0.00 C ATOM 98 O LEU A 633 1.751 1.964 -6.652 1.00 0.00 O ATOM 99 CB LEU A 633 3.687 3.518 -4.986 1.00 0.00 C ATOM 100 CG LEU A 633 4.612 3.880 -6.155 1.00 0.00 C ATOM 101 CD1 LEU A 633 4.820 5.393 -6.211 1.00 0.00 C ATOM 102 CD2 LEU A 633 5.965 3.188 -5.965 1.00 0.00 C ATOM 0 H LEU A 633 1.468 2.534 -3.925 1.00 0.00 H new ATOM 0 HA LEU A 633 2.182 4.976 -5.455 1.00 0.00 H new ATOM 0 HB2 LEU A 633 4.005 4.041 -4.084 1.00 0.00 H new ATOM 0 HB3 LEU A 633 3.753 2.450 -4.776 1.00 0.00 H new ATOM 0 HG LEU A 633 4.155 3.548 -7.087 1.00 0.00 H new ATOM 0 HD11 LEU A 633 5.478 5.639 -7.044 1.00 0.00 H new ATOM 0 HD12 LEU A 633 3.859 5.888 -6.350 1.00 0.00 H new ATOM 0 HD13 LEU A 633 5.272 5.733 -5.279 1.00 0.00 H new ATOM 0 HD21 LEU A 633 6.624 3.444 -6.795 1.00 0.00 H new ATOM 0 HD22 LEU A 633 6.415 3.519 -5.029 1.00 0.00 H new ATOM 0 HD23 LEU A 633 5.820 2.108 -5.936 1.00 0.00 H new ATOM 114 N GLU A 634 1.547 3.963 -7.650 1.00 0.00 N ATOM 115 CA GLU A 634 1.129 3.363 -8.908 1.00 0.00 C ATOM 116 C GLU A 634 1.340 4.314 -10.077 1.00 0.00 C ATOM 117 O GLU A 634 1.355 5.533 -9.907 1.00 0.00 O ATOM 118 CB GLU A 634 -0.348 2.974 -8.824 1.00 0.00 C ATOM 119 CG GLU A 634 -0.741 2.189 -10.074 1.00 0.00 C ATOM 120 CD GLU A 634 -2.223 1.836 -10.023 1.00 0.00 C ATOM 121 OE1 GLU A 634 -2.880 2.257 -9.085 1.00 0.00 O ATOM 122 OE2 GLU A 634 -2.681 1.150 -10.923 1.00 0.00 O ATOM 0 H GLU A 634 1.600 4.982 -7.652 1.00 0.00 H new ATOM 0 HA GLU A 634 1.740 2.477 -9.079 1.00 0.00 H new ATOM 0 HB2 GLU A 634 -0.526 2.372 -7.933 1.00 0.00 H new ATOM 0 HB3 GLU A 634 -0.966 3.868 -8.734 1.00 0.00 H new ATOM 0 HG2 GLU A 634 -0.530 2.779 -10.966 1.00 0.00 H new ATOM 0 HG3 GLU A 634 -0.144 1.280 -10.145 1.00 0.00 H new ATOM 129 N GLU A 635 1.485 3.740 -11.266 1.00 0.00 N ATOM 130 CA GLU A 635 1.676 4.530 -12.474 1.00 0.00 C ATOM 131 C GLU A 635 0.333 4.730 -13.169 1.00 0.00 C ATOM 132 O GLU A 635 -0.651 4.075 -12.827 1.00 0.00 O ATOM 133 CB GLU A 635 2.643 3.818 -13.423 1.00 0.00 C ATOM 134 CG GLU A 635 4.006 3.661 -12.744 1.00 0.00 C ATOM 135 CD GLU A 635 4.588 5.033 -12.426 1.00 0.00 C ATOM 136 OE1 GLU A 635 4.110 6.002 -12.991 1.00 0.00 O ATOM 137 OE2 GLU A 635 5.504 5.096 -11.622 1.00 0.00 O ATOM 0 H GLU A 635 1.474 2.731 -11.418 1.00 0.00 H new ATOM 0 HA GLU A 635 2.096 5.499 -12.202 1.00 0.00 H new ATOM 0 HB2 GLU A 635 2.247 2.840 -13.696 1.00 0.00 H new ATOM 0 HB3 GLU A 635 2.749 4.388 -14.346 1.00 0.00 H new ATOM 0 HG2 GLU A 635 3.901 3.080 -11.828 1.00 0.00 H new ATOM 0 HG3 GLU A 635 4.685 3.110 -13.395 1.00 0.00 H new ATOM 144 N GLU A 636 0.290 5.642 -14.130 1.00 0.00 N ATOM 145 CA GLU A 636 -0.954 5.913 -14.838 1.00 0.00 C ATOM 146 C GLU A 636 -1.998 6.444 -13.859 1.00 0.00 C ATOM 147 O GLU A 636 -2.450 5.724 -12.969 1.00 0.00 O ATOM 148 CB GLU A 636 -1.468 4.629 -15.499 1.00 0.00 C ATOM 149 CG GLU A 636 -2.690 4.949 -16.362 1.00 0.00 C ATOM 150 CD GLU A 636 -3.255 3.667 -16.965 1.00 0.00 C ATOM 151 OE1 GLU A 636 -2.724 2.610 -16.666 1.00 0.00 O ATOM 152 OE2 GLU A 636 -4.210 3.761 -17.719 1.00 0.00 O ATOM 0 H GLU A 636 1.088 6.199 -14.434 1.00 0.00 H new ATOM 0 HA GLU A 636 -0.771 6.661 -15.609 1.00 0.00 H new ATOM 0 HB2 GLU A 636 -0.684 4.185 -16.112 1.00 0.00 H new ATOM 0 HB3 GLU A 636 -1.731 3.896 -14.737 1.00 0.00 H new ATOM 0 HG2 GLU A 636 -3.452 5.443 -15.759 1.00 0.00 H new ATOM 0 HG3 GLU A 636 -2.413 5.642 -17.156 1.00 0.00 H new ATOM 159 N ASP A 637 -2.365 7.710 -14.017 1.00 0.00 N ATOM 160 CA ASP A 637 -3.343 8.328 -13.129 1.00 0.00 C ATOM 161 C ASP A 637 -4.716 7.672 -13.272 1.00 0.00 C ATOM 162 O ASP A 637 -5.519 7.701 -12.341 1.00 0.00 O ATOM 163 CB ASP A 637 -3.449 9.828 -13.420 1.00 0.00 C ATOM 164 CG ASP A 637 -4.000 10.055 -14.821 1.00 0.00 C ATOM 165 OD1 ASP A 637 -4.471 9.098 -15.414 1.00 0.00 O ATOM 166 OD2 ASP A 637 -3.940 11.182 -15.284 1.00 0.00 O ATOM 0 H ASP A 637 -2.004 8.325 -14.746 1.00 0.00 H new ATOM 0 HA ASP A 637 -3.002 8.183 -12.104 1.00 0.00 H new ATOM 0 HB2 ASP A 637 -4.098 10.303 -12.685 1.00 0.00 H new ATOM 0 HB3 ASP A 637 -2.468 10.294 -13.327 1.00 0.00 H new ATOM 171 N GLU A 638 -4.988 7.087 -14.437 1.00 0.00 N ATOM 172 CA GLU A 638 -6.281 6.440 -14.659 1.00 0.00 C ATOM 173 C GLU A 638 -6.453 5.259 -13.711 1.00 0.00 C ATOM 174 O GLU A 638 -7.533 5.044 -13.160 1.00 0.00 O ATOM 175 CB GLU A 638 -6.384 5.943 -16.104 1.00 0.00 C ATOM 176 CG GLU A 638 -6.353 7.136 -17.060 1.00 0.00 C ATOM 177 CD GLU A 638 -6.489 6.656 -18.503 1.00 0.00 C ATOM 178 OE1 GLU A 638 -6.504 5.453 -18.708 1.00 0.00 O ATOM 179 OE2 GLU A 638 -6.576 7.498 -19.381 1.00 0.00 O ATOM 0 H GLU A 638 -4.345 7.047 -15.228 1.00 0.00 H new ATOM 0 HA GLU A 638 -7.066 7.173 -14.470 1.00 0.00 H new ATOM 0 HB2 GLU A 638 -5.560 5.265 -16.326 1.00 0.00 H new ATOM 0 HB3 GLU A 638 -7.307 5.379 -16.240 1.00 0.00 H new ATOM 0 HG2 GLU A 638 -7.163 7.825 -16.820 1.00 0.00 H new ATOM 0 HG3 GLU A 638 -5.420 7.686 -16.938 1.00 0.00 H new ATOM 186 N ALA A 639 -5.380 4.503 -13.517 1.00 0.00 N ATOM 187 CA ALA A 639 -5.424 3.354 -12.623 1.00 0.00 C ATOM 188 C ALA A 639 -5.498 3.815 -11.174 1.00 0.00 C ATOM 189 O ALA A 639 -6.239 3.252 -10.368 1.00 0.00 O ATOM 190 CB ALA A 639 -4.180 2.486 -12.822 1.00 0.00 C ATOM 0 H ALA A 639 -4.476 4.663 -13.962 1.00 0.00 H new ATOM 0 HA ALA A 639 -6.313 2.768 -12.856 1.00 0.00 H new ATOM 0 HB1 ALA A 639 -4.222 1.630 -12.149 1.00 0.00 H new ATOM 0 HB2 ALA A 639 -4.142 2.135 -13.853 1.00 0.00 H new ATOM 0 HB3 ALA A 639 -3.288 3.074 -12.606 1.00 0.00 H new ATOM 196 N ALA A 640 -4.719 4.844 -10.852 1.00 0.00 N ATOM 197 CA ALA A 640 -4.695 5.378 -9.496 1.00 0.00 C ATOM 198 C ALA A 640 -6.025 6.038 -9.142 1.00 0.00 C ATOM 199 O ALA A 640 -6.511 5.906 -8.020 1.00 0.00 O ATOM 200 CB ALA A 640 -3.566 6.403 -9.362 1.00 0.00 C ATOM 0 H ALA A 640 -4.100 5.321 -11.508 1.00 0.00 H new ATOM 0 HA ALA A 640 -4.526 4.550 -8.808 1.00 0.00 H new ATOM 0 HB1 ALA A 640 -3.553 6.799 -8.347 1.00 0.00 H new ATOM 0 HB2 ALA A 640 -2.611 5.923 -9.577 1.00 0.00 H new ATOM 0 HB3 ALA A 640 -3.729 7.218 -10.067 1.00 0.00 H new ATOM 206 N THR A 641 -6.608 6.755 -10.099 1.00 0.00 N ATOM 207 CA THR A 641 -7.877 7.432 -9.853 1.00 0.00 C ATOM 208 C THR A 641 -8.975 6.424 -9.532 1.00 0.00 C ATOM 209 O THR A 641 -9.766 6.625 -8.612 1.00 0.00 O ATOM 210 CB THR A 641 -8.284 8.255 -11.079 1.00 0.00 C ATOM 211 OG1 THR A 641 -7.226 9.137 -11.429 1.00 0.00 O ATOM 212 CG2 THR A 641 -9.540 9.066 -10.758 1.00 0.00 C ATOM 0 H THR A 641 -6.229 6.881 -11.038 1.00 0.00 H new ATOM 0 HA THR A 641 -7.746 8.095 -8.998 1.00 0.00 H new ATOM 0 HB THR A 641 -8.490 7.585 -11.914 1.00 0.00 H new ATOM 0 HG1 THR A 641 -6.595 8.673 -12.018 1.00 0.00 H new ATOM 0 HG21 THR A 641 -9.828 9.651 -11.631 1.00 0.00 H new ATOM 0 HG22 THR A 641 -10.352 8.389 -10.490 1.00 0.00 H new ATOM 0 HG23 THR A 641 -9.337 9.737 -9.923 1.00 0.00 H new ATOM 220 N VAL A 642 -9.021 5.341 -10.301 1.00 0.00 N ATOM 221 CA VAL A 642 -10.030 4.312 -10.089 1.00 0.00 C ATOM 222 C VAL A 642 -9.950 3.759 -8.669 1.00 0.00 C ATOM 223 O VAL A 642 -10.957 3.691 -7.960 1.00 0.00 O ATOM 224 CB VAL A 642 -9.833 3.183 -11.100 1.00 0.00 C ATOM 225 CG1 VAL A 642 -10.805 2.042 -10.793 1.00 0.00 C ATOM 226 CG2 VAL A 642 -10.105 3.717 -12.507 1.00 0.00 C ATOM 0 H VAL A 642 -8.377 5.155 -11.070 1.00 0.00 H new ATOM 0 HA VAL A 642 -11.015 4.757 -10.228 1.00 0.00 H new ATOM 0 HB VAL A 642 -8.810 2.811 -11.037 1.00 0.00 H new ATOM 0 HG11 VAL A 642 -10.662 1.238 -11.515 1.00 0.00 H new ATOM 0 HG12 VAL A 642 -10.617 1.664 -9.788 1.00 0.00 H new ATOM 0 HG13 VAL A 642 -11.829 2.410 -10.857 1.00 0.00 H new ATOM 0 HG21 VAL A 642 -9.966 2.916 -13.233 1.00 0.00 H new ATOM 0 HG22 VAL A 642 -11.129 4.086 -12.565 1.00 0.00 H new ATOM 0 HG23 VAL A 642 -9.414 4.531 -12.727 1.00 0.00 H new ATOM 236 N VAL A 643 -8.747 3.373 -8.254 1.00 0.00 N ATOM 237 CA VAL A 643 -8.557 2.837 -6.911 1.00 0.00 C ATOM 238 C VAL A 643 -8.998 3.861 -5.871 1.00 0.00 C ATOM 239 O VAL A 643 -9.614 3.513 -4.864 1.00 0.00 O ATOM 240 CB VAL A 643 -7.087 2.462 -6.692 1.00 0.00 C ATOM 241 CG1 VAL A 643 -6.872 2.047 -5.234 1.00 0.00 C ATOM 242 CG2 VAL A 643 -6.721 1.291 -7.605 1.00 0.00 C ATOM 0 H VAL A 643 -7.900 3.420 -8.820 1.00 0.00 H new ATOM 0 HA VAL A 643 -9.166 1.940 -6.803 1.00 0.00 H new ATOM 0 HB VAL A 643 -6.458 3.322 -6.923 1.00 0.00 H new ATOM 0 HG11 VAL A 643 -5.826 1.781 -5.082 1.00 0.00 H new ATOM 0 HG12 VAL A 643 -7.135 2.876 -4.577 1.00 0.00 H new ATOM 0 HG13 VAL A 643 -7.502 1.188 -5.004 1.00 0.00 H new ATOM 0 HG21 VAL A 643 -5.676 1.022 -7.451 1.00 0.00 H new ATOM 0 HG22 VAL A 643 -7.354 0.435 -7.370 1.00 0.00 H new ATOM 0 HG23 VAL A 643 -6.872 1.580 -8.645 1.00 0.00 H new ATOM 252 N CYS A 644 -8.682 5.126 -6.129 1.00 0.00 N ATOM 253 CA CYS A 644 -9.053 6.200 -5.216 1.00 0.00 C ATOM 254 C CYS A 644 -10.564 6.251 -5.030 1.00 0.00 C ATOM 255 O CYS A 644 -11.055 6.477 -3.924 1.00 0.00 O ATOM 256 CB CYS A 644 -8.555 7.537 -5.766 1.00 0.00 C ATOM 257 SG CYS A 644 -7.082 8.053 -4.852 1.00 0.00 S ATOM 0 H CYS A 644 -8.173 5.431 -6.958 1.00 0.00 H new ATOM 0 HA CYS A 644 -8.591 6.008 -4.247 1.00 0.00 H new ATOM 0 HB2 CYS A 644 -8.323 7.442 -6.827 1.00 0.00 H new ATOM 0 HB3 CYS A 644 -9.335 8.293 -5.676 1.00 0.00 H new ATOM 0 HG CYS A 644 -6.657 9.189 -5.320 1.00 0.00 H new ATOM 263 N GLU A 645 -11.300 6.038 -6.115 1.00 0.00 N ATOM 264 CA GLU A 645 -12.755 6.065 -6.043 1.00 0.00 C ATOM 265 C GLU A 645 -13.273 4.950 -5.140 1.00 0.00 C ATOM 266 O GLU A 645 -14.254 5.132 -4.419 1.00 0.00 O ATOM 267 CB GLU A 645 -13.356 5.914 -7.441 1.00 0.00 C ATOM 268 CG GLU A 645 -13.032 7.158 -8.272 1.00 0.00 C ATOM 269 CD GLU A 645 -13.660 8.390 -7.628 1.00 0.00 C ATOM 270 OE1 GLU A 645 -14.562 8.219 -6.824 1.00 0.00 O ATOM 271 OE2 GLU A 645 -13.227 9.487 -7.943 1.00 0.00 O ATOM 0 H GLU A 645 -10.920 5.847 -7.042 1.00 0.00 H new ATOM 0 HA GLU A 645 -13.056 7.025 -5.623 1.00 0.00 H new ATOM 0 HB2 GLU A 645 -12.955 5.024 -7.927 1.00 0.00 H new ATOM 0 HB3 GLU A 645 -14.436 5.780 -7.372 1.00 0.00 H new ATOM 0 HG2 GLU A 645 -11.952 7.286 -8.346 1.00 0.00 H new ATOM 0 HG3 GLU A 645 -13.408 7.036 -9.288 1.00 0.00 H new ATOM 278 N MET A 646 -12.615 3.794 -5.186 1.00 0.00 N ATOM 279 CA MET A 646 -13.036 2.660 -4.364 1.00 0.00 C ATOM 280 C MET A 646 -12.784 2.931 -2.881 1.00 0.00 C ATOM 281 O MET A 646 -13.693 2.824 -2.056 1.00 0.00 O ATOM 282 CB MET A 646 -12.267 1.404 -4.773 1.00 0.00 C ATOM 283 CG MET A 646 -12.555 1.075 -6.238 1.00 0.00 C ATOM 284 SD MET A 646 -11.773 -0.502 -6.660 1.00 0.00 S ATOM 285 CE MET A 646 -12.033 -0.421 -8.448 1.00 0.00 C ATOM 0 H MET A 646 -11.800 3.618 -5.774 1.00 0.00 H new ATOM 0 HA MET A 646 -14.105 2.514 -4.521 1.00 0.00 H new ATOM 0 HB2 MET A 646 -11.198 1.558 -4.629 1.00 0.00 H new ATOM 0 HB3 MET A 646 -12.557 0.566 -4.139 1.00 0.00 H new ATOM 0 HG2 MET A 646 -13.631 1.017 -6.405 1.00 0.00 H new ATOM 0 HG3 MET A 646 -12.174 1.867 -6.883 1.00 0.00 H new ATOM 0 HE1 MET A 646 -11.134 -0.761 -8.962 1.00 0.00 H new ATOM 0 HE2 MET A 646 -12.872 -1.060 -8.723 1.00 0.00 H new ATOM 0 HE3 MET A 646 -12.250 0.607 -8.738 1.00 0.00 H new ATOM 295 N LEU A 647 -11.543 3.274 -2.547 1.00 0.00 N ATOM 296 CA LEU A 647 -11.187 3.544 -1.160 1.00 0.00 C ATOM 297 C LEU A 647 -11.876 4.803 -0.647 1.00 0.00 C ATOM 298 O LEU A 647 -12.377 4.830 0.478 1.00 0.00 O ATOM 299 CB LEU A 647 -9.674 3.705 -1.034 1.00 0.00 C ATOM 300 CG LEU A 647 -9.013 2.326 -0.989 1.00 0.00 C ATOM 301 CD1 LEU A 647 -9.325 1.561 -2.276 1.00 0.00 C ATOM 302 CD2 LEU A 647 -7.499 2.497 -0.853 1.00 0.00 C ATOM 0 H LEU A 647 -10.775 3.371 -3.211 1.00 0.00 H new ATOM 0 HA LEU A 647 -11.520 2.699 -0.557 1.00 0.00 H new ATOM 0 HB2 LEU A 647 -9.288 4.277 -1.877 1.00 0.00 H new ATOM 0 HB3 LEU A 647 -9.432 4.265 -0.131 1.00 0.00 H new ATOM 0 HG LEU A 647 -9.399 1.767 -0.136 1.00 0.00 H new ATOM 0 HD11 LEU A 647 -8.852 0.580 -2.240 1.00 0.00 H new ATOM 0 HD12 LEU A 647 -10.404 1.441 -2.375 1.00 0.00 H new ATOM 0 HD13 LEU A 647 -8.942 2.117 -3.132 1.00 0.00 H new ATOM 0 HD21 LEU A 647 -7.024 1.517 -0.820 1.00 0.00 H new ATOM 0 HD22 LEU A 647 -7.118 3.057 -1.707 1.00 0.00 H new ATOM 0 HD23 LEU A 647 -7.275 3.039 0.066 1.00 0.00 H new ATOM 314 N THR A 648 -11.902 5.847 -1.470 1.00 0.00 N ATOM 315 CA THR A 648 -12.538 7.094 -1.059 1.00 0.00 C ATOM 316 C THR A 648 -13.983 6.842 -0.637 1.00 0.00 C ATOM 317 O THR A 648 -14.448 7.382 0.367 1.00 0.00 O ATOM 318 CB THR A 648 -12.501 8.111 -2.201 1.00 0.00 C ATOM 319 OG1 THR A 648 -11.161 8.279 -2.638 1.00 0.00 O ATOM 320 CG2 THR A 648 -13.046 9.455 -1.710 1.00 0.00 C ATOM 0 H THR A 648 -11.499 5.856 -2.407 1.00 0.00 H new ATOM 0 HA THR A 648 -11.987 7.496 -0.208 1.00 0.00 H new ATOM 0 HB THR A 648 -13.114 7.751 -3.027 1.00 0.00 H new ATOM 0 HG1 THR A 648 -10.960 7.622 -3.337 1.00 0.00 H new ATOM 0 HG21 THR A 648 -13.019 10.178 -2.525 1.00 0.00 H new ATOM 0 HG22 THR A 648 -14.074 9.329 -1.371 1.00 0.00 H new ATOM 0 HG23 THR A 648 -12.433 9.816 -0.884 1.00 0.00 H new ATOM 328 N ALA A 649 -14.686 6.015 -1.405 1.00 0.00 N ATOM 329 CA ALA A 649 -16.076 5.695 -1.093 1.00 0.00 C ATOM 330 C ALA A 649 -16.160 4.807 0.145 1.00 0.00 C ATOM 331 O ALA A 649 -17.172 4.797 0.845 1.00 0.00 O ATOM 332 CB ALA A 649 -16.729 4.985 -2.280 1.00 0.00 C ATOM 0 H ALA A 649 -14.321 5.558 -2.240 1.00 0.00 H new ATOM 0 HA ALA A 649 -16.605 6.626 -0.892 1.00 0.00 H new ATOM 0 HB1 ALA A 649 -17.766 4.750 -2.038 1.00 0.00 H new ATOM 0 HB2 ALA A 649 -16.699 5.635 -3.154 1.00 0.00 H new ATOM 0 HB3 ALA A 649 -16.189 4.063 -2.495 1.00 0.00 H new ATOM 338 N ALA A 650 -15.094 4.057 0.405 1.00 0.00 N ATOM 339 CA ALA A 650 -15.067 3.162 1.556 1.00 0.00 C ATOM 340 C ALA A 650 -14.883 3.946 2.855 1.00 0.00 C ATOM 341 O ALA A 650 -14.935 3.376 3.945 1.00 0.00 O ATOM 342 CB ALA A 650 -13.930 2.153 1.400 1.00 0.00 C ATOM 0 H ALA A 650 -14.245 4.051 -0.160 1.00 0.00 H new ATOM 0 HA ALA A 650 -16.021 2.636 1.603 1.00 0.00 H new ATOM 0 HB1 ALA A 650 -13.914 1.487 2.262 1.00 0.00 H new ATOM 0 HB2 ALA A 650 -14.084 1.569 0.493 1.00 0.00 H new ATOM 0 HB3 ALA A 650 -12.980 2.683 1.333 1.00 0.00 H new ATOM 348 N GLY A 651 -14.677 5.254 2.738 1.00 0.00 N ATOM 349 CA GLY A 651 -14.500 6.094 3.917 1.00 0.00 C ATOM 350 C GLY A 651 -13.022 6.286 4.243 1.00 0.00 C ATOM 351 O GLY A 651 -12.664 7.102 5.091 1.00 0.00 O ATOM 0 H GLY A 651 -14.629 5.751 1.849 1.00 0.00 H new ATOM 0 HA2 GLY A 651 -14.967 7.065 3.748 1.00 0.00 H new ATOM 0 HA3 GLY A 651 -15.007 5.641 4.769 1.00 0.00 H new ATOM 355 N PHE A 652 -12.167 5.531 3.563 1.00 0.00 N ATOM 356 CA PHE A 652 -10.730 5.630 3.788 1.00 0.00 C ATOM 357 C PHE A 652 -10.089 6.520 2.731 1.00 0.00 C ATOM 358 O PHE A 652 -10.373 6.384 1.540 1.00 0.00 O ATOM 359 CB PHE A 652 -10.095 4.240 3.741 1.00 0.00 C ATOM 360 CG PHE A 652 -10.668 3.394 4.851 1.00 0.00 C ATOM 361 CD1 PHE A 652 -10.083 3.413 6.123 1.00 0.00 C ATOM 362 CD2 PHE A 652 -11.788 2.590 4.608 1.00 0.00 C ATOM 363 CE1 PHE A 652 -10.620 2.629 7.152 1.00 0.00 C ATOM 364 CE2 PHE A 652 -12.325 1.808 5.636 1.00 0.00 C ATOM 365 CZ PHE A 652 -11.741 1.826 6.908 1.00 0.00 C ATOM 0 H PHE A 652 -12.441 4.848 2.856 1.00 0.00 H new ATOM 0 HA PHE A 652 -10.563 6.069 4.771 1.00 0.00 H new ATOM 0 HB2 PHE A 652 -10.287 3.772 2.775 1.00 0.00 H new ATOM 0 HB3 PHE A 652 -9.013 4.318 3.848 1.00 0.00 H new ATOM 0 HD1 PHE A 652 -9.218 4.032 6.311 1.00 0.00 H new ATOM 0 HD2 PHE A 652 -12.238 2.574 3.626 1.00 0.00 H new ATOM 0 HE1 PHE A 652 -10.170 2.644 8.133 1.00 0.00 H new ATOM 0 HE2 PHE A 652 -13.191 1.190 5.448 1.00 0.00 H new ATOM 0 HZ PHE A 652 -12.155 1.221 7.701 1.00 0.00 H new ATOM 375 N LYS A 653 -9.223 7.429 3.168 1.00 0.00 N ATOM 376 CA LYS A 653 -8.552 8.330 2.238 1.00 0.00 C ATOM 377 C LYS A 653 -7.214 7.738 1.807 1.00 0.00 C ATOM 378 O LYS A 653 -6.394 7.355 2.641 1.00 0.00 O ATOM 379 CB LYS A 653 -8.327 9.695 2.893 1.00 0.00 C ATOM 380 CG LYS A 653 -7.909 10.712 1.828 1.00 0.00 C ATOM 381 CD LYS A 653 -7.621 12.058 2.494 1.00 0.00 C ATOM 382 CE LYS A 653 -7.524 13.149 1.426 1.00 0.00 C ATOM 383 NZ LYS A 653 -7.417 14.482 2.086 1.00 0.00 N ATOM 0 H LYS A 653 -8.972 7.561 4.148 1.00 0.00 H new ATOM 0 HA LYS A 653 -9.185 8.458 1.360 1.00 0.00 H new ATOM 0 HB2 LYS A 653 -9.239 10.027 3.389 1.00 0.00 H new ATOM 0 HB3 LYS A 653 -7.557 9.619 3.660 1.00 0.00 H new ATOM 0 HG2 LYS A 653 -7.023 10.359 1.300 1.00 0.00 H new ATOM 0 HG3 LYS A 653 -8.699 10.823 1.086 1.00 0.00 H new ATOM 0 HD2 LYS A 653 -8.411 12.300 3.205 1.00 0.00 H new ATOM 0 HD3 LYS A 653 -6.690 12.004 3.059 1.00 0.00 H new ATOM 0 HE2 LYS A 653 -6.655 12.975 0.791 1.00 0.00 H new ATOM 0 HE3 LYS A 653 -8.402 13.120 0.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 653 -7.351 15.224 1.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 653 -8.259 14.647 2.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 653 -6.567 14.506 2.684 1.00 0.00 H new ATOM 397 N VAL A 654 -7.008 7.660 0.500 1.00 0.00 N ATOM 398 CA VAL A 654 -5.773 7.106 -0.039 1.00 0.00 C ATOM 399 C VAL A 654 -5.092 8.128 -0.940 1.00 0.00 C ATOM 400 O VAL A 654 -5.752 8.836 -1.701 1.00 0.00 O ATOM 401 CB VAL A 654 -6.090 5.839 -0.836 1.00 0.00 C ATOM 402 CG1 VAL A 654 -6.948 6.209 -2.048 1.00 0.00 C ATOM 403 CG2 VAL A 654 -4.788 5.183 -1.307 1.00 0.00 C ATOM 0 H VAL A 654 -7.676 7.972 -0.205 1.00 0.00 H new ATOM 0 HA VAL A 654 -5.101 6.859 0.783 1.00 0.00 H new ATOM 0 HB VAL A 654 -6.633 5.137 -0.203 1.00 0.00 H new ATOM 0 HG11 VAL A 654 -7.177 5.310 -2.620 1.00 0.00 H new ATOM 0 HG12 VAL A 654 -7.876 6.670 -1.710 1.00 0.00 H new ATOM 0 HG13 VAL A 654 -6.403 6.911 -2.679 1.00 0.00 H new ATOM 0 HG21 VAL A 654 -5.019 4.281 -1.874 1.00 0.00 H new ATOM 0 HG22 VAL A 654 -4.238 5.879 -1.941 1.00 0.00 H new ATOM 0 HG23 VAL A 654 -4.179 4.921 -0.442 1.00 0.00 H new ATOM 413 N ILE A 655 -3.770 8.209 -0.847 1.00 0.00 N ATOM 414 CA ILE A 655 -3.024 9.159 -1.661 1.00 0.00 C ATOM 415 C ILE A 655 -2.259 8.439 -2.765 1.00 0.00 C ATOM 416 O ILE A 655 -1.560 7.457 -2.515 1.00 0.00 O ATOM 417 CB ILE A 655 -2.044 9.949 -0.791 1.00 0.00 C ATOM 418 CG1 ILE A 655 -2.807 10.646 0.337 1.00 0.00 C ATOM 419 CG2 ILE A 655 -1.338 10.999 -1.649 1.00 0.00 C ATOM 420 CD1 ILE A 655 -1.814 11.340 1.274 1.00 0.00 C ATOM 0 H ILE A 655 -3.199 7.637 -0.225 1.00 0.00 H new ATOM 0 HA ILE A 655 -3.736 9.847 -2.117 1.00 0.00 H new ATOM 0 HB ILE A 655 -1.307 9.268 -0.364 1.00 0.00 H new ATOM 0 HG12 ILE A 655 -3.503 11.376 -0.077 1.00 0.00 H new ATOM 0 HG13 ILE A 655 -3.400 9.919 0.892 1.00 0.00 H new ATOM 0 HG21 ILE A 655 -0.639 11.563 -1.032 1.00 0.00 H new ATOM 0 HG22 ILE A 655 -0.794 10.505 -2.454 1.00 0.00 H new ATOM 0 HG23 ILE A 655 -2.077 11.678 -2.074 1.00 0.00 H new ATOM 0 HD11 ILE A 655 -2.358 11.836 2.078 1.00 0.00 H new ATOM 0 HD12 ILE A 655 -1.136 10.600 1.698 1.00 0.00 H new ATOM 0 HD13 ILE A 655 -1.240 12.078 0.714 1.00 0.00 H new ATOM 432 N TRP A 656 -2.399 8.941 -3.988 1.00 0.00 N ATOM 433 CA TRP A 656 -1.719 8.347 -5.132 1.00 0.00 C ATOM 434 C TRP A 656 -0.401 9.064 -5.400 1.00 0.00 C ATOM 435 O TRP A 656 -0.382 10.256 -5.706 1.00 0.00 O ATOM 436 CB TRP A 656 -2.615 8.432 -6.368 1.00 0.00 C ATOM 437 CG TRP A 656 -1.778 8.349 -7.602 1.00 0.00 C ATOM 438 CD1 TRP A 656 -1.076 7.262 -7.998 1.00 0.00 C ATOM 439 CD2 TRP A 656 -1.544 9.376 -8.607 1.00 0.00 C ATOM 440 NE1 TRP A 656 -0.422 7.559 -9.180 1.00 0.00 N ATOM 441 CE2 TRP A 656 -0.680 8.851 -9.596 1.00 0.00 C ATOM 442 CE3 TRP A 656 -1.993 10.698 -8.752 1.00 0.00 C ATOM 443 CZ2 TRP A 656 -0.277 9.613 -10.693 1.00 0.00 C ATOM 444 CZ3 TRP A 656 -1.590 11.470 -9.853 1.00 0.00 C ATOM 445 CH2 TRP A 656 -0.734 10.928 -10.822 1.00 0.00 C ATOM 0 H TRP A 656 -2.974 9.753 -4.211 1.00 0.00 H new ATOM 0 HA TRP A 656 -1.509 7.301 -4.909 1.00 0.00 H new ATOM 0 HB2 TRP A 656 -3.345 7.622 -6.357 1.00 0.00 H new ATOM 0 HB3 TRP A 656 -3.176 9.367 -6.359 1.00 0.00 H new ATOM 0 HD1 TRP A 656 -1.033 6.317 -7.476 1.00 0.00 H new ATOM 0 HE1 TRP A 656 0.177 6.904 -9.683 1.00 0.00 H new ATOM 0 HE3 TRP A 656 -2.653 11.124 -8.011 1.00 0.00 H new ATOM 0 HZ2 TRP A 656 0.383 9.191 -11.437 1.00 0.00 H new ATOM 0 HZ3 TRP A 656 -1.941 12.486 -9.954 1.00 0.00 H new ATOM 0 HH2 TRP A 656 -0.428 11.526 -11.668 1.00 0.00 H new ATOM 456 N LEU A 657 0.699 8.332 -5.280 1.00 0.00 N ATOM 457 CA LEU A 657 2.018 8.907 -5.509 1.00 0.00 C ATOM 458 C LEU A 657 2.694 8.238 -6.702 1.00 0.00 C ATOM 459 O LEU A 657 2.451 7.064 -6.986 1.00 0.00 O ATOM 460 CB LEU A 657 2.885 8.731 -4.263 1.00 0.00 C ATOM 461 CG LEU A 657 4.171 9.542 -4.414 1.00 0.00 C ATOM 462 CD1 LEU A 657 3.838 11.035 -4.413 1.00 0.00 C ATOM 463 CD2 LEU A 657 5.098 9.228 -3.242 1.00 0.00 C ATOM 0 H LEU A 657 0.705 7.344 -5.027 1.00 0.00 H new ATOM 0 HA LEU A 657 1.900 9.969 -5.723 1.00 0.00 H new ATOM 0 HB2 LEU A 657 2.339 9.058 -3.378 1.00 0.00 H new ATOM 0 HB3 LEU A 657 3.123 7.677 -4.119 1.00 0.00 H new ATOM 0 HG LEU A 657 4.661 9.283 -5.353 1.00 0.00 H new ATOM 0 HD11 LEU A 657 4.756 11.613 -4.521 1.00 0.00 H new ATOM 0 HD12 LEU A 657 3.169 11.259 -5.244 1.00 0.00 H new ATOM 0 HD13 LEU A 657 3.352 11.299 -3.474 1.00 0.00 H new ATOM 0 HD21 LEU A 657 6.019 9.803 -3.342 1.00 0.00 H new ATOM 0 HD22 LEU A 657 4.605 9.493 -2.307 1.00 0.00 H new ATOM 0 HD23 LEU A 657 5.333 8.164 -3.239 1.00 0.00 H new ATOM 475 N VAL A 658 3.537 8.995 -7.399 1.00 0.00 N ATOM 476 CA VAL A 658 4.244 8.466 -8.560 1.00 0.00 C ATOM 477 C VAL A 658 5.737 8.321 -8.265 1.00 0.00 C ATOM 478 O VAL A 658 6.566 8.390 -9.173 1.00 0.00 O ATOM 479 CB VAL A 658 4.049 9.392 -9.760 1.00 0.00 C ATOM 480 CG1 VAL A 658 2.554 9.547 -10.047 1.00 0.00 C ATOM 481 CG2 VAL A 658 4.655 10.763 -9.448 1.00 0.00 C ATOM 0 H VAL A 658 3.746 9.969 -7.182 1.00 0.00 H new ATOM 0 HA VAL A 658 3.834 7.482 -8.789 1.00 0.00 H new ATOM 0 HB VAL A 658 4.543 8.966 -10.633 1.00 0.00 H new ATOM 0 HG11 VAL A 658 2.414 10.207 -10.903 1.00 0.00 H new ATOM 0 HG12 VAL A 658 2.123 8.571 -10.268 1.00 0.00 H new ATOM 0 HG13 VAL A 658 2.058 9.974 -9.175 1.00 0.00 H new ATOM 0 HG21 VAL A 658 4.517 11.425 -10.303 1.00 0.00 H new ATOM 0 HG22 VAL A 658 4.160 11.189 -8.575 1.00 0.00 H new ATOM 0 HG23 VAL A 658 5.720 10.652 -9.243 1.00 0.00 H new ATOM 491 N ASP A 659 6.074 8.125 -6.991 1.00 0.00 N ATOM 492 CA ASP A 659 7.474 7.978 -6.595 1.00 0.00 C ATOM 493 C ASP A 659 7.610 7.059 -5.385 1.00 0.00 C ATOM 494 O ASP A 659 6.632 6.771 -4.695 1.00 0.00 O ATOM 495 CB ASP A 659 8.069 9.345 -6.254 1.00 0.00 C ATOM 496 CG ASP A 659 8.442 10.086 -7.531 1.00 0.00 C ATOM 497 OD1 ASP A 659 8.647 9.427 -8.537 1.00 0.00 O ATOM 498 OD2 ASP A 659 8.525 11.302 -7.483 1.00 0.00 O ATOM 0 H ASP A 659 5.405 8.065 -6.223 1.00 0.00 H new ATOM 0 HA ASP A 659 8.013 7.537 -7.434 1.00 0.00 H new ATOM 0 HB2 ASP A 659 7.350 9.931 -5.681 1.00 0.00 H new ATOM 0 HB3 ASP A 659 8.951 9.220 -5.626 1.00 0.00 H new ATOM 503 N GLY A 660 8.835 6.603 -5.134 1.00 0.00 N ATOM 504 CA GLY A 660 9.096 5.715 -4.006 1.00 0.00 C ATOM 505 C GLY A 660 9.889 6.426 -2.914 1.00 0.00 C ATOM 506 O GLY A 660 9.404 6.599 -1.796 1.00 0.00 O ATOM 0 H GLY A 660 9.657 6.832 -5.693 1.00 0.00 H new ATOM 0 HA2 GLY A 660 8.152 5.355 -3.597 1.00 0.00 H new ATOM 0 HA3 GLY A 660 9.649 4.840 -4.349 1.00 0.00 H new ATOM 510 N SER A 661 11.112 6.831 -3.241 1.00 0.00 N ATOM 511 CA SER A 661 11.961 7.517 -2.273 1.00 0.00 C ATOM 512 C SER A 661 11.286 8.787 -1.768 1.00 0.00 C ATOM 513 O SER A 661 11.338 9.099 -0.575 1.00 0.00 O ATOM 514 CB SER A 661 13.299 7.874 -2.920 1.00 0.00 C ATOM 515 OG SER A 661 14.119 8.533 -1.964 1.00 0.00 O ATOM 0 H SER A 661 11.535 6.698 -4.160 1.00 0.00 H new ATOM 0 HA SER A 661 12.128 6.850 -1.428 1.00 0.00 H new ATOM 0 HB2 SER A 661 13.794 6.973 -3.282 1.00 0.00 H new ATOM 0 HB3 SER A 661 13.138 8.518 -3.785 1.00 0.00 H new ATOM 0 HG SER A 661 14.979 8.763 -2.374 1.00 0.00 H new ATOM 521 N THR A 662 10.643 9.513 -2.678 1.00 0.00 N ATOM 522 CA THR A 662 9.955 10.743 -2.304 1.00 0.00 C ATOM 523 C THR A 662 8.836 10.423 -1.324 1.00 0.00 C ATOM 524 O THR A 662 8.556 11.191 -0.399 1.00 0.00 O ATOM 525 CB THR A 662 9.374 11.422 -3.548 1.00 0.00 C ATOM 526 OG1 THR A 662 10.388 11.552 -4.532 1.00 0.00 O ATOM 527 CG2 THR A 662 8.846 12.810 -3.177 1.00 0.00 C ATOM 0 H THR A 662 10.584 9.274 -3.668 1.00 0.00 H new ATOM 0 HA THR A 662 10.668 11.420 -1.833 1.00 0.00 H new ATOM 0 HB THR A 662 8.557 10.817 -3.942 1.00 0.00 H new ATOM 0 HG1 THR A 662 10.017 11.985 -5.329 1.00 0.00 H new ATOM 0 HG21 THR A 662 8.433 13.291 -4.064 1.00 0.00 H new ATOM 0 HG22 THR A 662 8.067 12.713 -2.421 1.00 0.00 H new ATOM 0 HG23 THR A 662 9.661 13.416 -2.782 1.00 0.00 H new ATOM 535 N ALA A 663 8.207 9.272 -1.531 1.00 0.00 N ATOM 536 CA ALA A 663 7.123 8.843 -0.663 1.00 0.00 C ATOM 537 C ALA A 663 7.613 8.703 0.766 1.00 0.00 C ATOM 538 O ALA A 663 6.957 9.153 1.694 1.00 0.00 O ATOM 539 CB ALA A 663 6.582 7.490 -1.131 1.00 0.00 C ATOM 0 H ALA A 663 8.429 8.625 -2.287 1.00 0.00 H new ATOM 0 HA ALA A 663 6.334 9.594 -0.706 1.00 0.00 H new ATOM 0 HB1 ALA A 663 5.770 7.176 -0.475 1.00 0.00 H new ATOM 0 HB2 ALA A 663 6.210 7.580 -2.151 1.00 0.00 H new ATOM 0 HB3 ALA A 663 7.380 6.749 -1.100 1.00 0.00 H new ATOM 545 N LEU A 664 8.770 8.070 0.932 1.00 0.00 N ATOM 546 CA LEU A 664 9.338 7.861 2.258 1.00 0.00 C ATOM 547 C LEU A 664 9.549 9.189 2.981 1.00 0.00 C ATOM 548 O LEU A 664 9.254 9.309 4.176 1.00 0.00 O ATOM 549 CB LEU A 664 10.657 7.076 2.133 1.00 0.00 C ATOM 550 CG LEU A 664 11.847 7.912 2.613 1.00 0.00 C ATOM 551 CD1 LEU A 664 11.761 8.110 4.128 1.00 0.00 C ATOM 552 CD2 LEU A 664 13.150 7.182 2.268 1.00 0.00 C ATOM 0 H LEU A 664 9.331 7.694 0.167 1.00 0.00 H new ATOM 0 HA LEU A 664 8.638 7.278 2.857 1.00 0.00 H new ATOM 0 HB2 LEU A 664 10.594 6.159 2.718 1.00 0.00 H new ATOM 0 HB3 LEU A 664 10.811 6.782 1.095 1.00 0.00 H new ATOM 0 HG LEU A 664 11.829 8.885 2.121 1.00 0.00 H new ATOM 0 HD11 LEU A 664 12.609 8.705 4.466 1.00 0.00 H new ATOM 0 HD12 LEU A 664 10.834 8.627 4.375 1.00 0.00 H new ATOM 0 HD13 LEU A 664 11.779 7.139 4.623 1.00 0.00 H new ATOM 0 HD21 LEU A 664 14.000 7.774 2.608 1.00 0.00 H new ATOM 0 HD22 LEU A 664 13.164 6.210 2.761 1.00 0.00 H new ATOM 0 HD23 LEU A 664 13.214 7.042 1.189 1.00 0.00 H new ATOM 564 N ASP A 665 10.055 10.183 2.261 1.00 0.00 N ATOM 565 CA ASP A 665 10.299 11.484 2.868 1.00 0.00 C ATOM 566 C ASP A 665 9.010 12.036 3.462 1.00 0.00 C ATOM 567 O ASP A 665 9.018 12.628 4.539 1.00 0.00 O ATOM 568 CB ASP A 665 10.842 12.460 1.824 1.00 0.00 C ATOM 569 CG ASP A 665 11.401 13.701 2.513 1.00 0.00 C ATOM 570 OD1 ASP A 665 12.568 13.684 2.866 1.00 0.00 O ATOM 571 OD2 ASP A 665 10.653 14.652 2.675 1.00 0.00 O ATOM 0 H ASP A 665 10.301 10.116 1.273 1.00 0.00 H new ATOM 0 HA ASP A 665 11.036 11.364 3.662 1.00 0.00 H new ATOM 0 HB2 ASP A 665 11.622 11.978 1.235 1.00 0.00 H new ATOM 0 HB3 ASP A 665 10.049 12.744 1.132 1.00 0.00 H new ATOM 576 N GLN A 666 7.903 11.838 2.758 1.00 0.00 N ATOM 577 CA GLN A 666 6.619 12.322 3.243 1.00 0.00 C ATOM 578 C GLN A 666 5.871 11.231 4.011 1.00 0.00 C ATOM 579 O GLN A 666 5.037 11.526 4.867 1.00 0.00 O ATOM 580 CB GLN A 666 5.768 12.789 2.064 1.00 0.00 C ATOM 581 CG GLN A 666 6.465 13.954 1.366 1.00 0.00 C ATOM 582 CD GLN A 666 5.600 14.462 0.219 1.00 0.00 C ATOM 583 OE1 GLN A 666 4.449 13.893 -0.020 1.00 0.00 O flip ATOM 584 NE2 GLN A 666 5.981 15.404 -0.477 1.00 0.00 N flip ATOM 0 H GLN A 666 7.868 11.352 1.862 1.00 0.00 H new ATOM 0 HA GLN A 666 6.804 13.155 3.922 1.00 0.00 H new ATOM 0 HB2 GLN A 666 5.617 11.968 1.363 1.00 0.00 H new ATOM 0 HB3 GLN A 666 4.782 13.097 2.412 1.00 0.00 H new ATOM 0 HG2 GLN A 666 6.650 14.758 2.078 1.00 0.00 H new ATOM 0 HG3 GLN A 666 7.436 13.634 0.987 1.00 0.00 H new ATOM 0 HE21 GLN A 666 6.880 15.847 -0.288 1.00 0.00 H new ATOM 0 HE22 GLN A 666 5.397 15.742 -1.242 1.00 0.00 H new ATOM 593 N LEU A 667 6.166 9.972 3.695 1.00 0.00 N ATOM 594 CA LEU A 667 5.502 8.852 4.357 1.00 0.00 C ATOM 595 C LEU A 667 5.612 8.969 5.868 1.00 0.00 C ATOM 596 O LEU A 667 4.691 8.596 6.594 1.00 0.00 O ATOM 597 CB LEU A 667 6.091 7.511 3.905 1.00 0.00 C ATOM 598 CG LEU A 667 5.151 6.384 4.348 1.00 0.00 C ATOM 599 CD1 LEU A 667 5.376 5.147 3.476 1.00 0.00 C ATOM 600 CD2 LEU A 667 5.402 6.020 5.817 1.00 0.00 C ATOM 0 H LEU A 667 6.854 9.703 2.991 1.00 0.00 H new ATOM 0 HA LEU A 667 4.450 8.888 4.073 1.00 0.00 H new ATOM 0 HB2 LEU A 667 6.212 7.498 2.822 1.00 0.00 H new ATOM 0 HB3 LEU A 667 7.081 7.369 4.338 1.00 0.00 H new ATOM 0 HG LEU A 667 4.123 6.730 4.238 1.00 0.00 H new ATOM 0 HD11 LEU A 667 4.705 4.350 3.796 1.00 0.00 H new ATOM 0 HD12 LEU A 667 5.174 5.395 2.434 1.00 0.00 H new ATOM 0 HD13 LEU A 667 6.409 4.814 3.576 1.00 0.00 H new ATOM 0 HD21 LEU A 667 4.726 5.218 6.114 1.00 0.00 H new ATOM 0 HD22 LEU A 667 6.433 5.688 5.939 1.00 0.00 H new ATOM 0 HD23 LEU A 667 5.226 6.894 6.444 1.00 0.00 H new ATOM 612 N ASP A 668 6.738 9.484 6.345 1.00 0.00 N ATOM 613 CA ASP A 668 6.926 9.625 7.780 1.00 0.00 C ATOM 614 C ASP A 668 5.770 10.425 8.365 1.00 0.00 C ATOM 615 O ASP A 668 5.290 10.138 9.460 1.00 0.00 O ATOM 616 CB ASP A 668 8.241 10.351 8.072 1.00 0.00 C ATOM 617 CG ASP A 668 9.415 9.536 7.543 1.00 0.00 C ATOM 618 OD1 ASP A 668 9.193 8.405 7.144 1.00 0.00 O ATOM 619 OD2 ASP A 668 10.519 10.055 7.545 1.00 0.00 O ATOM 0 H ASP A 668 7.519 9.804 5.772 1.00 0.00 H new ATOM 0 HA ASP A 668 6.958 8.634 8.232 1.00 0.00 H new ATOM 0 HB2 ASP A 668 8.233 11.337 7.607 1.00 0.00 H new ATOM 0 HB3 ASP A 668 8.350 10.506 9.145 1.00 0.00 H new ATOM 624 N LEU A 669 5.322 11.425 7.614 1.00 0.00 N ATOM 625 CA LEU A 669 4.211 12.264 8.049 1.00 0.00 C ATOM 626 C LEU A 669 2.877 11.544 7.872 1.00 0.00 C ATOM 627 O LEU A 669 1.961 11.718 8.676 1.00 0.00 O ATOM 628 CB LEU A 669 4.184 13.566 7.244 1.00 0.00 C ATOM 629 CG LEU A 669 5.497 14.326 7.446 1.00 0.00 C ATOM 630 CD1 LEU A 669 5.434 15.671 6.715 1.00 0.00 C ATOM 631 CD2 LEU A 669 5.713 14.572 8.941 1.00 0.00 C ATOM 0 H LEU A 669 5.709 11.674 6.704 1.00 0.00 H new ATOM 0 HA LEU A 669 4.357 12.485 9.106 1.00 0.00 H new ATOM 0 HB2 LEU A 669 4.038 13.348 6.186 1.00 0.00 H new ATOM 0 HB3 LEU A 669 3.343 14.183 7.561 1.00 0.00 H new ATOM 0 HG LEU A 669 6.322 13.736 7.046 1.00 0.00 H new ATOM 0 HD11 LEU A 669 6.371 16.209 6.861 1.00 0.00 H new ATOM 0 HD12 LEU A 669 5.277 15.499 5.650 1.00 0.00 H new ATOM 0 HD13 LEU A 669 4.610 16.263 7.113 1.00 0.00 H new ATOM 0 HD21 LEU A 669 6.647 15.113 9.089 1.00 0.00 H new ATOM 0 HD22 LEU A 669 4.886 15.161 9.336 1.00 0.00 H new ATOM 0 HD23 LEU A 669 5.760 13.617 9.464 1.00 0.00 H new ATOM 643 N LEU A 670 2.763 10.751 6.806 1.00 0.00 N ATOM 644 CA LEU A 670 1.517 10.038 6.536 1.00 0.00 C ATOM 645 C LEU A 670 1.292 8.923 7.551 1.00 0.00 C ATOM 646 O LEU A 670 0.169 8.709 8.009 1.00 0.00 O ATOM 647 CB LEU A 670 1.545 9.415 5.138 1.00 0.00 C ATOM 648 CG LEU A 670 1.931 10.459 4.093 1.00 0.00 C ATOM 649 CD1 LEU A 670 1.576 9.925 2.705 1.00 0.00 C ATOM 650 CD2 LEU A 670 1.172 11.767 4.347 1.00 0.00 C ATOM 0 H LEU A 670 3.506 10.588 6.126 1.00 0.00 H new ATOM 0 HA LEU A 670 0.708 10.765 6.606 1.00 0.00 H new ATOM 0 HB2 LEU A 670 2.257 8.590 5.116 1.00 0.00 H new ATOM 0 HB3 LEU A 670 0.566 8.998 4.900 1.00 0.00 H new ATOM 0 HG LEU A 670 3.001 10.656 4.156 1.00 0.00 H new ATOM 0 HD11 LEU A 670 1.848 10.663 1.951 1.00 0.00 H new ATOM 0 HD12 LEU A 670 2.122 9.000 2.520 1.00 0.00 H new ATOM 0 HD13 LEU A 670 0.505 9.731 2.653 1.00 0.00 H new ATOM 0 HD21 LEU A 670 1.455 12.504 3.596 1.00 0.00 H new ATOM 0 HD22 LEU A 670 0.099 11.583 4.288 1.00 0.00 H new ATOM 0 HD23 LEU A 670 1.421 12.146 5.338 1.00 0.00 H new ATOM 662 N GLN A 671 2.359 8.202 7.889 1.00 0.00 N ATOM 663 CA GLN A 671 2.243 7.102 8.839 1.00 0.00 C ATOM 664 C GLN A 671 0.967 6.317 8.552 1.00 0.00 C ATOM 665 O GLN A 671 0.037 6.298 9.358 1.00 0.00 O ATOM 666 CB GLN A 671 2.218 7.643 10.270 1.00 0.00 C ATOM 667 CG GLN A 671 3.653 7.878 10.751 1.00 0.00 C ATOM 668 CD GLN A 671 3.699 9.085 11.682 1.00 0.00 C ATOM 669 OE1 GLN A 671 2.786 9.286 12.482 1.00 0.00 O ATOM 670 NE2 GLN A 671 4.711 9.906 11.623 1.00 0.00 N ATOM 0 H GLN A 671 3.299 8.357 7.525 1.00 0.00 H new ATOM 0 HA GLN A 671 3.104 6.442 8.733 1.00 0.00 H new ATOM 0 HB2 GLN A 671 1.653 8.574 10.308 1.00 0.00 H new ATOM 0 HB3 GLN A 671 1.713 6.936 10.929 1.00 0.00 H new ATOM 0 HG2 GLN A 671 4.021 6.993 11.271 1.00 0.00 H new ATOM 0 HG3 GLN A 671 4.310 8.042 9.897 1.00 0.00 H new ATOM 0 HE21 GLN A 671 5.467 9.737 10.959 1.00 0.00 H new ATOM 0 HE22 GLN A 671 4.747 10.717 12.241 1.00 0.00 H new ATOM 679 N PRO A 672 0.907 5.698 7.401 1.00 0.00 N ATOM 680 CA PRO A 672 -0.280 4.919 6.959 1.00 0.00 C ATOM 681 C PRO A 672 -0.372 3.537 7.598 1.00 0.00 C ATOM 682 O PRO A 672 0.624 2.983 8.062 1.00 0.00 O ATOM 683 CB PRO A 672 -0.099 4.806 5.445 1.00 0.00 C ATOM 684 CG PRO A 672 1.366 4.965 5.187 1.00 0.00 C ATOM 685 CD PRO A 672 1.980 5.675 6.397 1.00 0.00 C ATOM 0 HA PRO A 672 -1.206 5.412 7.255 1.00 0.00 H new ATOM 0 HB2 PRO A 672 -0.456 3.843 5.081 1.00 0.00 H new ATOM 0 HB3 PRO A 672 -0.671 5.575 4.926 1.00 0.00 H new ATOM 0 HG2 PRO A 672 1.835 3.993 5.036 1.00 0.00 H new ATOM 0 HG3 PRO A 672 1.533 5.544 4.279 1.00 0.00 H new ATOM 0 HD2 PRO A 672 2.856 5.142 6.766 1.00 0.00 H new ATOM 0 HD3 PRO A 672 2.305 6.684 6.141 1.00 0.00 H new ATOM 693 N ILE A 673 -1.584 2.989 7.609 1.00 0.00 N ATOM 694 CA ILE A 673 -1.821 1.671 8.183 1.00 0.00 C ATOM 695 C ILE A 673 -1.740 0.594 7.104 1.00 0.00 C ATOM 696 O ILE A 673 -1.511 -0.578 7.401 1.00 0.00 O ATOM 697 CB ILE A 673 -3.200 1.639 8.854 1.00 0.00 C ATOM 698 CG1 ILE A 673 -3.356 0.336 9.641 1.00 0.00 C ATOM 699 CG2 ILE A 673 -4.306 1.727 7.795 1.00 0.00 C ATOM 700 CD1 ILE A 673 -2.602 0.441 10.965 1.00 0.00 C ATOM 0 H ILE A 673 -2.416 3.438 7.227 1.00 0.00 H new ATOM 0 HA ILE A 673 -1.052 1.470 8.929 1.00 0.00 H new ATOM 0 HB ILE A 673 -3.284 2.490 9.530 1.00 0.00 H new ATOM 0 HG12 ILE A 673 -4.411 0.136 9.827 1.00 0.00 H new ATOM 0 HG13 ILE A 673 -2.971 -0.501 9.058 1.00 0.00 H new ATOM 0 HG21 ILE A 673 -5.280 1.703 8.283 1.00 0.00 H new ATOM 0 HG22 ILE A 673 -4.202 2.658 7.237 1.00 0.00 H new ATOM 0 HG23 ILE A 673 -4.223 0.883 7.111 1.00 0.00 H new ATOM 0 HD11 ILE A 673 -2.715 -0.489 11.523 1.00 0.00 H new ATOM 0 HD12 ILE A 673 -1.545 0.620 10.769 1.00 0.00 H new ATOM 0 HD13 ILE A 673 -3.007 1.267 11.550 1.00 0.00 H new ATOM 712 N VAL A 674 -1.918 1.004 5.851 1.00 0.00 N ATOM 713 CA VAL A 674 -1.851 0.066 4.735 1.00 0.00 C ATOM 714 C VAL A 674 -1.174 0.714 3.531 1.00 0.00 C ATOM 715 O VAL A 674 -1.429 1.876 3.213 1.00 0.00 O ATOM 716 CB VAL A 674 -3.255 -0.399 4.349 1.00 0.00 C ATOM 717 CG1 VAL A 674 -3.159 -1.408 3.204 1.00 0.00 C ATOM 718 CG2 VAL A 674 -3.916 -1.068 5.557 1.00 0.00 C ATOM 0 H VAL A 674 -2.108 1.970 5.585 1.00 0.00 H new ATOM 0 HA VAL A 674 -1.263 -0.796 5.048 1.00 0.00 H new ATOM 0 HB VAL A 674 -3.849 0.458 4.032 1.00 0.00 H new ATOM 0 HG11 VAL A 674 -4.159 -1.741 2.927 1.00 0.00 H new ATOM 0 HG12 VAL A 674 -2.682 -0.938 2.344 1.00 0.00 H new ATOM 0 HG13 VAL A 674 -2.567 -2.266 3.523 1.00 0.00 H new ATOM 0 HG21 VAL A 674 -4.918 -1.401 5.286 1.00 0.00 H new ATOM 0 HG22 VAL A 674 -3.320 -1.926 5.869 1.00 0.00 H new ATOM 0 HG23 VAL A 674 -3.981 -0.354 6.378 1.00 0.00 H new ATOM 728 N ILE A 675 -0.305 -0.042 2.869 1.00 0.00 N ATOM 729 CA ILE A 675 0.403 0.478 1.709 1.00 0.00 C ATOM 730 C ILE A 675 0.237 -0.450 0.506 1.00 0.00 C ATOM 731 O ILE A 675 0.632 -1.615 0.553 1.00 0.00 O ATOM 732 CB ILE A 675 1.887 0.623 2.049 1.00 0.00 C ATOM 733 CG1 ILE A 675 2.037 1.510 3.290 1.00 0.00 C ATOM 734 CG2 ILE A 675 2.625 1.261 0.872 1.00 0.00 C ATOM 735 CD1 ILE A 675 3.509 1.572 3.702 1.00 0.00 C ATOM 0 H ILE A 675 -0.077 -1.006 3.113 1.00 0.00 H new ATOM 0 HA ILE A 675 -0.016 1.450 1.449 1.00 0.00 H new ATOM 0 HB ILE A 675 2.312 -0.361 2.248 1.00 0.00 H new ATOM 0 HG12 ILE A 675 1.665 2.513 3.080 1.00 0.00 H new ATOM 0 HG13 ILE A 675 1.436 1.113 4.108 1.00 0.00 H new ATOM 0 HG21 ILE A 675 3.682 1.363 1.117 1.00 0.00 H new ATOM 0 HG22 ILE A 675 2.517 0.630 -0.010 1.00 0.00 H new ATOM 0 HG23 ILE A 675 2.203 2.245 0.669 1.00 0.00 H new ATOM 0 HD11 ILE A 675 3.614 2.203 4.585 1.00 0.00 H new ATOM 0 HD12 ILE A 675 3.866 0.568 3.930 1.00 0.00 H new ATOM 0 HD13 ILE A 675 4.098 1.990 2.885 1.00 0.00 H new ATOM 747 N LEU A 676 -0.334 0.076 -0.577 1.00 0.00 N ATOM 748 CA LEU A 676 -0.525 -0.716 -1.789 1.00 0.00 C ATOM 749 C LEU A 676 0.454 -0.262 -2.865 1.00 0.00 C ATOM 750 O LEU A 676 0.618 0.934 -3.098 1.00 0.00 O ATOM 751 CB LEU A 676 -1.957 -0.568 -2.312 1.00 0.00 C ATOM 752 CG LEU A 676 -2.752 0.347 -1.387 1.00 0.00 C ATOM 753 CD1 LEU A 676 -4.104 0.660 -2.028 1.00 0.00 C ATOM 754 CD2 LEU A 676 -2.979 -0.349 -0.043 1.00 0.00 C ATOM 0 H LEU A 676 -0.669 1.037 -0.639 1.00 0.00 H new ATOM 0 HA LEU A 676 -0.344 -1.763 -1.546 1.00 0.00 H new ATOM 0 HB2 LEU A 676 -1.945 -0.158 -3.322 1.00 0.00 H new ATOM 0 HB3 LEU A 676 -2.435 -1.546 -2.371 1.00 0.00 H new ATOM 0 HG LEU A 676 -2.196 1.271 -1.226 1.00 0.00 H new ATOM 0 HD11 LEU A 676 -4.676 1.314 -1.370 1.00 0.00 H new ATOM 0 HD12 LEU A 676 -3.946 1.156 -2.986 1.00 0.00 H new ATOM 0 HD13 LEU A 676 -4.655 -0.267 -2.186 1.00 0.00 H new ATOM 0 HD21 LEU A 676 -3.547 0.308 0.615 1.00 0.00 H new ATOM 0 HD22 LEU A 676 -3.535 -1.273 -0.201 1.00 0.00 H new ATOM 0 HD23 LEU A 676 -2.017 -0.578 0.415 1.00 0.00 H new ATOM 766 N MET A 677 1.099 -1.214 -3.521 1.00 0.00 N ATOM 767 CA MET A 677 2.053 -0.873 -4.571 1.00 0.00 C ATOM 768 C MET A 677 1.928 -1.816 -5.765 1.00 0.00 C ATOM 769 O MET A 677 1.821 -3.032 -5.604 1.00 0.00 O ATOM 770 CB MET A 677 3.479 -0.932 -4.018 1.00 0.00 C ATOM 771 CG MET A 677 3.635 0.100 -2.900 1.00 0.00 C ATOM 772 SD MET A 677 5.385 0.249 -2.462 1.00 0.00 S ATOM 773 CE MET A 677 5.630 -1.457 -1.911 1.00 0.00 C ATOM 0 H MET A 677 0.984 -2.213 -3.351 1.00 0.00 H new ATOM 0 HA MET A 677 1.830 0.139 -4.911 1.00 0.00 H new ATOM 0 HB2 MET A 677 3.692 -1.931 -3.638 1.00 0.00 H new ATOM 0 HB3 MET A 677 4.197 -0.734 -4.813 1.00 0.00 H new ATOM 0 HG2 MET A 677 3.246 1.065 -3.224 1.00 0.00 H new ATOM 0 HG3 MET A 677 3.055 -0.201 -2.028 1.00 0.00 H new ATOM 0 HE1 MET A 677 6.610 -1.551 -1.443 1.00 0.00 H new ATOM 0 HE2 MET A 677 4.856 -1.721 -1.190 1.00 0.00 H new ATOM 0 HE3 MET A 677 5.572 -2.128 -2.768 1.00 0.00 H new ATOM 783 N ALA A 678 1.957 -1.239 -6.964 1.00 0.00 N ATOM 784 CA ALA A 678 1.863 -2.022 -8.191 1.00 0.00 C ATOM 785 C ALA A 678 3.099 -2.902 -8.356 1.00 0.00 C ATOM 786 O ALA A 678 4.202 -2.505 -7.985 1.00 0.00 O ATOM 787 CB ALA A 678 1.729 -1.085 -9.391 1.00 0.00 C ATOM 0 H ALA A 678 2.045 -0.233 -7.111 1.00 0.00 H new ATOM 0 HA ALA A 678 0.983 -2.663 -8.133 1.00 0.00 H new ATOM 0 HB1 ALA A 678 1.659 -1.673 -10.306 1.00 0.00 H new ATOM 0 HB2 ALA A 678 0.830 -0.478 -9.280 1.00 0.00 H new ATOM 0 HB3 ALA A 678 2.602 -0.434 -9.444 1.00 0.00 H new ATOM 793 N TRP A 679 2.913 -4.098 -8.910 1.00 0.00 N ATOM 794 CA TRP A 679 4.034 -5.011 -9.103 1.00 0.00 C ATOM 795 C TRP A 679 4.339 -5.227 -10.586 1.00 0.00 C ATOM 796 O TRP A 679 5.496 -5.415 -10.961 1.00 0.00 O ATOM 797 CB TRP A 679 3.740 -6.356 -8.438 1.00 0.00 C ATOM 798 CG TRP A 679 5.020 -6.954 -7.952 1.00 0.00 C ATOM 799 CD1 TRP A 679 5.506 -8.157 -8.334 1.00 0.00 C ATOM 800 CD2 TRP A 679 5.987 -6.403 -7.006 1.00 0.00 C ATOM 801 NE1 TRP A 679 6.706 -8.381 -7.685 1.00 0.00 N ATOM 802 CE2 TRP A 679 7.044 -7.330 -6.856 1.00 0.00 C ATOM 803 CE3 TRP A 679 6.048 -5.201 -6.270 1.00 0.00 C ATOM 804 CZ2 TRP A 679 8.124 -7.079 -6.008 1.00 0.00 C ATOM 805 CZ3 TRP A 679 7.136 -4.945 -5.414 1.00 0.00 C ATOM 806 CH2 TRP A 679 8.170 -5.883 -5.284 1.00 0.00 C ATOM 0 H TRP A 679 2.011 -4.453 -9.228 1.00 0.00 H new ATOM 0 HA TRP A 679 4.910 -4.557 -8.640 1.00 0.00 H new ATOM 0 HB2 TRP A 679 3.049 -6.220 -7.606 1.00 0.00 H new ATOM 0 HB3 TRP A 679 3.257 -7.028 -9.147 1.00 0.00 H new ATOM 0 HD1 TRP A 679 5.034 -8.832 -9.032 1.00 0.00 H new ATOM 0 HE1 TRP A 679 7.273 -9.221 -7.804 1.00 0.00 H new ATOM 0 HE3 TRP A 679 5.256 -4.473 -6.364 1.00 0.00 H new ATOM 0 HZ2 TRP A 679 8.919 -7.804 -5.912 1.00 0.00 H new ATOM 0 HZ3 TRP A 679 7.174 -4.022 -4.855 1.00 0.00 H new ATOM 0 HH2 TRP A 679 9.002 -5.682 -4.625 1.00 0.00 H new ATOM 817 N PRO A 680 3.338 -5.214 -11.431 1.00 0.00 N ATOM 818 CA PRO A 680 3.536 -5.423 -12.895 1.00 0.00 C ATOM 819 C PRO A 680 4.530 -4.427 -13.506 1.00 0.00 C ATOM 820 O PRO A 680 5.380 -4.810 -14.310 1.00 0.00 O ATOM 821 CB PRO A 680 2.140 -5.260 -13.507 1.00 0.00 C ATOM 822 CG PRO A 680 1.168 -5.345 -12.371 1.00 0.00 C ATOM 823 CD PRO A 680 1.924 -5.002 -11.087 1.00 0.00 C ATOM 0 HA PRO A 680 3.969 -6.403 -13.096 1.00 0.00 H new ATOM 0 HB2 PRO A 680 2.051 -4.304 -14.023 1.00 0.00 H new ATOM 0 HB3 PRO A 680 1.945 -6.039 -14.244 1.00 0.00 H new ATOM 0 HG2 PRO A 680 0.340 -4.653 -12.524 1.00 0.00 H new ATOM 0 HG3 PRO A 680 0.740 -6.346 -12.307 1.00 0.00 H new ATOM 0 HD2 PRO A 680 1.739 -3.973 -10.779 1.00 0.00 H new ATOM 0 HD3 PRO A 680 1.615 -5.642 -10.260 1.00 0.00 H new ATOM 831 N PRO A 681 4.446 -3.169 -13.145 1.00 0.00 N ATOM 832 CA PRO A 681 5.362 -2.116 -13.671 1.00 0.00 C ATOM 833 C PRO A 681 6.675 -2.072 -12.895 1.00 0.00 C ATOM 834 O PRO A 681 6.777 -2.641 -11.808 1.00 0.00 O ATOM 835 CB PRO A 681 4.560 -0.835 -13.461 1.00 0.00 C ATOM 836 CG PRO A 681 3.744 -1.092 -12.238 1.00 0.00 C ATOM 837 CD PRO A 681 3.472 -2.600 -12.195 1.00 0.00 C ATOM 0 HA PRO A 681 5.652 -2.285 -14.708 1.00 0.00 H new ATOM 0 HB2 PRO A 681 5.216 0.025 -13.325 1.00 0.00 H new ATOM 0 HB3 PRO A 681 3.926 -0.620 -14.321 1.00 0.00 H new ATOM 0 HG2 PRO A 681 4.277 -0.770 -11.343 1.00 0.00 H new ATOM 0 HG3 PRO A 681 2.810 -0.532 -12.272 1.00 0.00 H new ATOM 0 HD2 PRO A 681 3.613 -3.002 -11.192 1.00 0.00 H new ATOM 0 HD3 PRO A 681 2.448 -2.829 -12.489 1.00 0.00 H new ATOM 845 N PRO A 682 7.672 -1.411 -13.421 1.00 0.00 N ATOM 846 CA PRO A 682 8.995 -1.296 -12.749 1.00 0.00 C ATOM 847 C PRO A 682 8.852 -0.852 -11.297 1.00 0.00 C ATOM 848 O PRO A 682 8.871 -1.674 -10.380 1.00 0.00 O ATOM 849 CB PRO A 682 9.754 -0.242 -13.570 1.00 0.00 C ATOM 850 CG PRO A 682 8.770 0.329 -14.542 1.00 0.00 C ATOM 851 CD PRO A 682 7.656 -0.702 -14.702 1.00 0.00 C ATOM 0 HA PRO A 682 9.515 -2.253 -12.713 1.00 0.00 H new ATOM 0 HB2 PRO A 682 10.157 0.537 -12.923 1.00 0.00 H new ATOM 0 HB3 PRO A 682 10.599 -0.691 -14.092 1.00 0.00 H new ATOM 0 HG2 PRO A 682 8.371 1.275 -14.177 1.00 0.00 H new ATOM 0 HG3 PRO A 682 9.248 0.533 -15.500 1.00 0.00 H new ATOM 0 HD2 PRO A 682 6.692 -0.228 -14.888 1.00 0.00 H new ATOM 0 HD3 PRO A 682 7.847 -1.375 -15.538 1.00 0.00 H new ATOM 859 N ASP A 683 8.708 0.451 -11.096 1.00 0.00 N ATOM 860 CA ASP A 683 8.563 0.990 -9.752 1.00 0.00 C ATOM 861 C ASP A 683 9.746 0.561 -8.891 1.00 0.00 C ATOM 862 O ASP A 683 9.578 0.151 -7.743 1.00 0.00 O ATOM 863 CB ASP A 683 7.262 0.489 -9.127 1.00 0.00 C ATOM 864 CG ASP A 683 6.068 0.991 -9.926 1.00 0.00 C ATOM 865 OD1 ASP A 683 6.255 1.879 -10.742 1.00 0.00 O ATOM 866 OD2 ASP A 683 4.982 0.483 -9.709 1.00 0.00 O ATOM 0 H ASP A 683 8.689 1.149 -11.840 1.00 0.00 H new ATOM 0 HA ASP A 683 8.536 2.078 -9.808 1.00 0.00 H new ATOM 0 HB2 ASP A 683 7.259 -0.601 -9.100 1.00 0.00 H new ATOM 0 HB3 ASP A 683 7.189 0.833 -8.095 1.00 0.00 H new ATOM 871 N GLN A 684 10.940 0.649 -9.467 1.00 0.00 N ATOM 872 CA GLN A 684 12.157 0.261 -8.763 1.00 0.00 C ATOM 873 C GLN A 684 12.305 1.062 -7.476 1.00 0.00 C ATOM 874 O GLN A 684 12.869 0.581 -6.493 1.00 0.00 O ATOM 875 CB GLN A 684 13.370 0.497 -9.664 1.00 0.00 C ATOM 876 CG GLN A 684 13.226 -0.352 -10.929 1.00 0.00 C ATOM 877 CD GLN A 684 14.423 -0.134 -11.847 1.00 0.00 C ATOM 878 OE1 GLN A 684 15.248 0.743 -11.596 1.00 0.00 O ATOM 879 NE2 GLN A 684 14.565 -0.884 -12.906 1.00 0.00 N ATOM 0 H GLN A 684 11.091 0.985 -10.418 1.00 0.00 H new ATOM 0 HA GLN A 684 12.094 -0.797 -8.509 1.00 0.00 H new ATOM 0 HB2 GLN A 684 13.444 1.552 -9.926 1.00 0.00 H new ATOM 0 HB3 GLN A 684 14.287 0.234 -9.137 1.00 0.00 H new ATOM 0 HG2 GLN A 684 13.150 -1.406 -10.662 1.00 0.00 H new ATOM 0 HG3 GLN A 684 12.306 -0.088 -11.450 1.00 0.00 H new ATOM 0 HE21 GLN A 684 13.879 -1.611 -13.112 1.00 0.00 H new ATOM 0 HE22 GLN A 684 15.362 -0.743 -13.527 1.00 0.00 H new ATOM 888 N SER A 685 11.789 2.287 -7.490 1.00 0.00 N ATOM 889 CA SER A 685 11.859 3.153 -6.320 1.00 0.00 C ATOM 890 C SER A 685 11.054 2.564 -5.165 1.00 0.00 C ATOM 891 O SER A 685 11.339 2.832 -3.998 1.00 0.00 O ATOM 892 CB SER A 685 11.313 4.538 -6.670 1.00 0.00 C ATOM 893 OG SER A 685 9.938 4.428 -7.014 1.00 0.00 O ATOM 0 H SER A 685 11.320 2.701 -8.296 1.00 0.00 H new ATOM 0 HA SER A 685 12.901 3.236 -6.013 1.00 0.00 H new ATOM 0 HB2 SER A 685 11.435 5.214 -5.824 1.00 0.00 H new ATOM 0 HB3 SER A 685 11.875 4.964 -7.502 1.00 0.00 H new ATOM 0 HG SER A 685 9.585 5.314 -7.237 1.00 0.00 H new ATOM 899 N CYS A 686 10.049 1.763 -5.499 1.00 0.00 N ATOM 900 CA CYS A 686 9.208 1.141 -4.481 1.00 0.00 C ATOM 901 C CYS A 686 10.044 0.261 -3.562 1.00 0.00 C ATOM 902 O CYS A 686 9.702 0.063 -2.395 1.00 0.00 O ATOM 903 CB CYS A 686 8.113 0.305 -5.151 1.00 0.00 C ATOM 904 SG CYS A 686 8.492 -1.462 -5.000 1.00 0.00 S ATOM 0 H CYS A 686 9.797 1.530 -6.459 1.00 0.00 H new ATOM 0 HA CYS A 686 8.746 1.926 -3.883 1.00 0.00 H new ATOM 0 HB2 CYS A 686 7.149 0.518 -4.689 1.00 0.00 H new ATOM 0 HB3 CYS A 686 8.030 0.578 -6.203 1.00 0.00 H new ATOM 0 HG CYS A 686 7.554 -2.157 -5.571 1.00 0.00 H new ATOM 910 N LEU A 687 11.138 -0.267 -4.095 1.00 0.00 N ATOM 911 CA LEU A 687 12.005 -1.126 -3.304 1.00 0.00 C ATOM 912 C LEU A 687 12.587 -0.343 -2.136 1.00 0.00 C ATOM 913 O LEU A 687 12.753 -0.880 -1.044 1.00 0.00 O ATOM 914 CB LEU A 687 13.141 -1.670 -4.174 1.00 0.00 C ATOM 915 CG LEU A 687 12.559 -2.405 -5.383 1.00 0.00 C ATOM 916 CD1 LEU A 687 13.698 -3.000 -6.213 1.00 0.00 C ATOM 917 CD2 LEU A 687 11.637 -3.531 -4.905 1.00 0.00 C ATOM 0 H LEU A 687 11.442 -0.118 -5.057 1.00 0.00 H new ATOM 0 HA LEU A 687 11.417 -1.960 -2.921 1.00 0.00 H new ATOM 0 HB2 LEU A 687 13.780 -0.852 -4.507 1.00 0.00 H new ATOM 0 HB3 LEU A 687 13.766 -2.347 -3.591 1.00 0.00 H new ATOM 0 HG LEU A 687 11.989 -1.704 -5.993 1.00 0.00 H new ATOM 0 HD11 LEU A 687 13.285 -3.524 -7.075 1.00 0.00 H new ATOM 0 HD12 LEU A 687 14.355 -2.200 -6.555 1.00 0.00 H new ATOM 0 HD13 LEU A 687 14.267 -3.700 -5.601 1.00 0.00 H new ATOM 0 HD21 LEU A 687 11.223 -4.053 -5.768 1.00 0.00 H new ATOM 0 HD22 LEU A 687 12.206 -4.232 -4.294 1.00 0.00 H new ATOM 0 HD23 LEU A 687 10.825 -3.110 -4.312 1.00 0.00 H new ATOM 929 N LEU A 688 12.887 0.933 -2.371 1.00 0.00 N ATOM 930 CA LEU A 688 13.443 1.779 -1.321 1.00 0.00 C ATOM 931 C LEU A 688 12.406 2.044 -0.234 1.00 0.00 C ATOM 932 O LEU A 688 12.737 2.082 0.950 1.00 0.00 O ATOM 933 CB LEU A 688 13.916 3.107 -1.912 1.00 0.00 C ATOM 934 CG LEU A 688 15.041 2.847 -2.912 1.00 0.00 C ATOM 935 CD1 LEU A 688 15.512 4.175 -3.503 1.00 0.00 C ATOM 936 CD2 LEU A 688 16.211 2.167 -2.198 1.00 0.00 C ATOM 0 H LEU A 688 12.756 1.398 -3.269 1.00 0.00 H new ATOM 0 HA LEU A 688 14.291 1.257 -0.877 1.00 0.00 H new ATOM 0 HB2 LEU A 688 13.087 3.614 -2.405 1.00 0.00 H new ATOM 0 HB3 LEU A 688 14.266 3.767 -1.118 1.00 0.00 H new ATOM 0 HG LEU A 688 14.676 2.201 -3.710 1.00 0.00 H new ATOM 0 HD11 LEU A 688 16.315 3.991 -4.217 1.00 0.00 H new ATOM 0 HD12 LEU A 688 14.680 4.663 -4.011 1.00 0.00 H new ATOM 0 HD13 LEU A 688 15.878 4.820 -2.704 1.00 0.00 H new ATOM 0 HD21 LEU A 688 17.014 1.981 -2.911 1.00 0.00 H new ATOM 0 HD22 LEU A 688 16.576 2.814 -1.401 1.00 0.00 H new ATOM 0 HD23 LEU A 688 15.877 1.220 -1.773 1.00 0.00 H new ATOM 948 N LEU A 689 11.151 2.221 -0.632 1.00 0.00 N ATOM 949 CA LEU A 689 10.098 2.472 0.341 1.00 0.00 C ATOM 950 C LEU A 689 10.063 1.342 1.358 1.00 0.00 C ATOM 951 O LEU A 689 9.998 1.578 2.564 1.00 0.00 O ATOM 952 CB LEU A 689 8.743 2.565 -0.362 1.00 0.00 C ATOM 953 CG LEU A 689 7.687 3.109 0.605 1.00 0.00 C ATOM 954 CD1 LEU A 689 6.575 3.782 -0.199 1.00 0.00 C ATOM 955 CD2 LEU A 689 7.093 1.960 1.428 1.00 0.00 C ATOM 0 H LEU A 689 10.843 2.196 -1.604 1.00 0.00 H new ATOM 0 HA LEU A 689 10.303 3.415 0.848 1.00 0.00 H new ATOM 0 HB2 LEU A 689 8.820 3.216 -1.233 1.00 0.00 H new ATOM 0 HB3 LEU A 689 8.444 1.581 -0.724 1.00 0.00 H new ATOM 0 HG LEU A 689 8.149 3.830 1.279 1.00 0.00 H new ATOM 0 HD11 LEU A 689 5.819 4.172 0.482 1.00 0.00 H new ATOM 0 HD12 LEU A 689 6.994 4.601 -0.784 1.00 0.00 H new ATOM 0 HD13 LEU A 689 6.119 3.054 -0.869 1.00 0.00 H new ATOM 0 HD21 LEU A 689 6.343 2.354 2.114 1.00 0.00 H new ATOM 0 HD22 LEU A 689 6.629 1.235 0.759 1.00 0.00 H new ATOM 0 HD23 LEU A 689 7.885 1.473 1.997 1.00 0.00 H new ATOM 967 N LEU A 690 10.114 0.110 0.862 1.00 0.00 N ATOM 968 CA LEU A 690 10.094 -1.049 1.743 1.00 0.00 C ATOM 969 C LEU A 690 11.316 -1.053 2.659 1.00 0.00 C ATOM 970 O LEU A 690 11.215 -1.404 3.834 1.00 0.00 O ATOM 971 CB LEU A 690 10.059 -2.345 0.926 1.00 0.00 C ATOM 972 CG LEU A 690 8.773 -2.411 0.091 1.00 0.00 C ATOM 973 CD1 LEU A 690 8.673 -3.783 -0.579 1.00 0.00 C ATOM 974 CD2 LEU A 690 7.558 -2.212 1.001 1.00 0.00 C ATOM 0 H LEU A 690 10.169 -0.109 -0.133 1.00 0.00 H new ATOM 0 HA LEU A 690 9.194 -0.990 2.355 1.00 0.00 H new ATOM 0 HB2 LEU A 690 10.929 -2.394 0.271 1.00 0.00 H new ATOM 0 HB3 LEU A 690 10.113 -3.205 1.593 1.00 0.00 H new ATOM 0 HG LEU A 690 8.796 -1.628 -0.667 1.00 0.00 H new ATOM 0 HD11 LEU A 690 7.760 -3.832 -1.173 1.00 0.00 H new ATOM 0 HD12 LEU A 690 9.536 -3.935 -1.227 1.00 0.00 H new ATOM 0 HD13 LEU A 690 8.651 -4.560 0.185 1.00 0.00 H new ATOM 0 HD21 LEU A 690 6.646 -2.259 0.406 1.00 0.00 H new ATOM 0 HD22 LEU A 690 7.538 -2.996 1.758 1.00 0.00 H new ATOM 0 HD23 LEU A 690 7.624 -1.239 1.488 1.00 0.00 H new ATOM 986 N GLN A 691 12.470 -0.663 2.121 1.00 0.00 N ATOM 987 CA GLN A 691 13.691 -0.632 2.921 1.00 0.00 C ATOM 988 C GLN A 691 13.541 0.344 4.081 1.00 0.00 C ATOM 989 O GLN A 691 13.967 0.063 5.201 1.00 0.00 O ATOM 990 CB GLN A 691 14.886 -0.218 2.057 1.00 0.00 C ATOM 991 CG GLN A 691 15.159 -1.294 1.005 1.00 0.00 C ATOM 992 CD GLN A 691 16.307 -0.861 0.098 1.00 0.00 C ATOM 993 OE1 GLN A 691 16.712 0.302 0.118 1.00 0.00 O ATOM 994 NE2 GLN A 691 16.857 -1.732 -0.703 1.00 0.00 N ATOM 0 H GLN A 691 12.585 -0.369 1.151 1.00 0.00 H new ATOM 0 HA GLN A 691 13.865 -1.633 3.315 1.00 0.00 H new ATOM 0 HB2 GLN A 691 14.682 0.736 1.571 1.00 0.00 H new ATOM 0 HB3 GLN A 691 15.767 -0.075 2.682 1.00 0.00 H new ATOM 0 HG2 GLN A 691 15.407 -2.237 1.493 1.00 0.00 H new ATOM 0 HG3 GLN A 691 14.262 -1.469 0.411 1.00 0.00 H new ATOM 0 HE21 GLN A 691 16.520 -2.695 -0.718 1.00 0.00 H new ATOM 0 HE22 GLN A 691 17.624 -1.450 -1.314 1.00 0.00 H new ATOM 1003 N HIS A 692 12.928 1.489 3.806 1.00 0.00 N ATOM 1004 CA HIS A 692 12.721 2.497 4.837 1.00 0.00 C ATOM 1005 C HIS A 692 11.882 1.939 5.984 1.00 0.00 C ATOM 1006 O HIS A 692 12.240 2.081 7.157 1.00 0.00 O ATOM 1007 CB HIS A 692 12.031 3.719 4.234 1.00 0.00 C ATOM 1008 CG HIS A 692 11.617 4.654 5.335 1.00 0.00 C ATOM 1009 ND1 HIS A 692 10.297 4.781 5.735 1.00 0.00 N ATOM 1010 CD2 HIS A 692 12.336 5.509 6.136 1.00 0.00 C ATOM 1011 CE1 HIS A 692 10.261 5.680 6.735 1.00 0.00 C ATOM 1012 NE2 HIS A 692 11.477 6.154 7.020 1.00 0.00 N ATOM 0 H HIS A 692 12.568 1.741 2.885 1.00 0.00 H new ATOM 0 HA HIS A 692 13.693 2.788 5.235 1.00 0.00 H new ATOM 0 HB2 HIS A 692 12.705 4.227 3.545 1.00 0.00 H new ATOM 0 HB3 HIS A 692 11.159 3.410 3.657 1.00 0.00 H new ATOM 0 HD2 HIS A 692 13.405 5.657 6.087 1.00 0.00 H new ATOM 0 HE1 HIS A 692 9.358 5.982 7.246 1.00 0.00 H new ATOM 0 HE2 HIS A 692 11.723 6.841 7.733 1.00 0.00 H new ATOM 1021 N LEU A 693 10.768 1.295 5.644 1.00 0.00 N ATOM 1022 CA LEU A 693 9.902 0.721 6.665 1.00 0.00 C ATOM 1023 C LEU A 693 10.708 -0.200 7.572 1.00 0.00 C ATOM 1024 O LEU A 693 10.544 -0.187 8.792 1.00 0.00 O ATOM 1025 CB LEU A 693 8.759 -0.072 6.017 1.00 0.00 C ATOM 1026 CG LEU A 693 7.932 0.843 5.109 1.00 0.00 C ATOM 1027 CD1 LEU A 693 6.774 0.047 4.503 1.00 0.00 C ATOM 1028 CD2 LEU A 693 7.360 2.006 5.925 1.00 0.00 C ATOM 0 H LEU A 693 10.449 1.160 4.685 1.00 0.00 H new ATOM 0 HA LEU A 693 9.479 1.534 7.255 1.00 0.00 H new ATOM 0 HB2 LEU A 693 9.164 -0.902 5.438 1.00 0.00 H new ATOM 0 HB3 LEU A 693 8.122 -0.503 6.789 1.00 0.00 H new ATOM 0 HG LEU A 693 8.572 1.232 4.317 1.00 0.00 H new ATOM 0 HD11 LEU A 693 6.185 0.697 3.857 1.00 0.00 H new ATOM 0 HD12 LEU A 693 7.170 -0.784 3.919 1.00 0.00 H new ATOM 0 HD13 LEU A 693 6.142 -0.340 5.302 1.00 0.00 H new ATOM 0 HD21 LEU A 693 6.773 2.653 5.274 1.00 0.00 H new ATOM 0 HD22 LEU A 693 6.723 1.615 6.718 1.00 0.00 H new ATOM 0 HD23 LEU A 693 8.177 2.578 6.365 1.00 0.00 H new ATOM 1040 N ARG A 694 11.586 -0.991 6.967 1.00 0.00 N ATOM 1041 CA ARG A 694 12.424 -1.913 7.725 1.00 0.00 C ATOM 1042 C ARG A 694 13.394 -1.143 8.618 1.00 0.00 C ATOM 1043 O ARG A 694 13.832 -1.641 9.655 1.00 0.00 O ATOM 1044 CB ARG A 694 13.212 -2.813 6.767 1.00 0.00 C ATOM 1045 CG ARG A 694 13.903 -3.923 7.563 1.00 0.00 C ATOM 1046 CD ARG A 694 14.795 -4.745 6.630 1.00 0.00 C ATOM 1047 NE ARG A 694 14.025 -5.224 5.487 1.00 0.00 N ATOM 1048 CZ ARG A 694 13.222 -6.280 5.587 1.00 0.00 C ATOM 1049 NH1 ARG A 694 13.116 -6.919 6.720 1.00 0.00 N ATOM 1050 NH2 ARG A 694 12.543 -6.680 4.547 1.00 0.00 N ATOM 0 H ARG A 694 11.736 -1.013 5.958 1.00 0.00 H new ATOM 0 HA ARG A 694 11.780 -2.529 8.353 1.00 0.00 H new ATOM 0 HB2 ARG A 694 12.542 -3.246 6.024 1.00 0.00 H new ATOM 0 HB3 ARG A 694 13.952 -2.225 6.224 1.00 0.00 H new ATOM 0 HG2 ARG A 694 14.500 -3.491 8.366 1.00 0.00 H new ATOM 0 HG3 ARG A 694 13.158 -4.567 8.031 1.00 0.00 H new ATOM 0 HD2 ARG A 694 15.631 -4.136 6.285 1.00 0.00 H new ATOM 0 HD3 ARG A 694 15.219 -5.590 7.172 1.00 0.00 H new ATOM 0 HE ARG A 694 14.104 -4.739 4.593 1.00 0.00 H new ATOM 0 HH11 ARG A 694 13.650 -6.609 7.532 1.00 0.00 H new ATOM 0 HH12 ARG A 694 12.499 -7.728 6.793 1.00 0.00 H new ATOM 0 HH21 ARG A 694 12.629 -6.183 3.660 1.00 0.00 H new ATOM 0 HH22 ARG A 694 11.927 -7.489 4.621 1.00 0.00 H new ATOM 1064 N GLU A 695 13.742 0.064 8.184 1.00 0.00 N ATOM 1065 CA GLU A 695 14.683 0.901 8.918 1.00 0.00 C ATOM 1066 C GLU A 695 14.118 1.346 10.268 1.00 0.00 C ATOM 1067 O GLU A 695 14.850 1.398 11.259 1.00 0.00 O ATOM 1068 CB GLU A 695 15.025 2.132 8.079 1.00 0.00 C ATOM 1069 CG GLU A 695 16.179 2.891 8.732 1.00 0.00 C ATOM 1070 CD GLU A 695 16.475 4.162 7.944 1.00 0.00 C ATOM 1071 OE1 GLU A 695 15.696 4.483 7.062 1.00 0.00 O ATOM 1072 OE2 GLU A 695 17.475 4.796 8.236 1.00 0.00 O ATOM 0 H GLU A 695 13.385 0.485 7.326 1.00 0.00 H new ATOM 0 HA GLU A 695 15.578 0.310 9.110 1.00 0.00 H new ATOM 0 HB2 GLU A 695 15.300 1.831 7.068 1.00 0.00 H new ATOM 0 HB3 GLU A 695 14.153 2.780 7.993 1.00 0.00 H new ATOM 0 HG2 GLU A 695 15.924 3.142 9.762 1.00 0.00 H new ATOM 0 HG3 GLU A 695 17.067 2.260 8.768 1.00 0.00 H new ATOM 1079 N HIS A 696 12.829 1.676 10.317 1.00 0.00 N ATOM 1080 CA HIS A 696 12.237 2.116 11.582 1.00 0.00 C ATOM 1081 C HIS A 696 10.823 1.570 11.783 1.00 0.00 C ATOM 1082 O HIS A 696 10.447 1.217 12.900 1.00 0.00 O ATOM 1083 CB HIS A 696 12.218 3.645 11.645 1.00 0.00 C ATOM 1084 CG HIS A 696 10.920 4.173 11.093 1.00 0.00 C ATOM 1085 ND1 HIS A 696 9.769 4.263 11.861 1.00 0.00 N ATOM 1086 CD2 HIS A 696 10.585 4.666 9.856 1.00 0.00 C ATOM 1087 CE1 HIS A 696 8.805 4.793 11.085 1.00 0.00 C ATOM 1088 NE2 HIS A 696 9.251 5.059 9.855 1.00 0.00 N ATOM 0 H HIS A 696 12.190 1.650 9.523 1.00 0.00 H new ATOM 0 HA HIS A 696 12.857 1.719 12.386 1.00 0.00 H new ATOM 0 HB2 HIS A 696 12.344 3.975 12.676 1.00 0.00 H new ATOM 0 HB3 HIS A 696 13.055 4.050 11.076 1.00 0.00 H new ATOM 0 HD2 HIS A 696 11.255 4.738 9.012 1.00 0.00 H new ATOM 0 HE1 HIS A 696 7.794 4.980 11.417 1.00 0.00 H new ATOM 0 HE2 HIS A 696 8.726 5.464 9.080 1.00 0.00 H new ATOM 1168 N PRO A 702 4.372 -3.235 12.637 1.00 0.00 N ATOM 1169 CA PRO A 702 4.437 -3.216 11.150 1.00 0.00 C ATOM 1170 C PRO A 702 3.051 -3.136 10.506 1.00 0.00 C ATOM 1171 O PRO A 702 2.170 -3.937 10.820 1.00 0.00 O ATOM 1172 CB PRO A 702 5.118 -4.540 10.796 1.00 0.00 C ATOM 1173 CG PRO A 702 5.908 -4.921 12.005 1.00 0.00 C ATOM 1174 CD PRO A 702 5.203 -4.302 13.211 1.00 0.00 C ATOM 0 HA PRO A 702 4.972 -2.340 10.782 1.00 0.00 H new ATOM 0 HB2 PRO A 702 4.382 -5.306 10.551 1.00 0.00 H new ATOM 0 HB3 PRO A 702 5.764 -4.428 9.925 1.00 0.00 H new ATOM 0 HG2 PRO A 702 5.963 -6.005 12.104 1.00 0.00 H new ATOM 0 HG3 PRO A 702 6.932 -4.556 11.928 1.00 0.00 H new ATOM 0 HD2 PRO A 702 4.597 -5.038 13.738 1.00 0.00 H new ATOM 0 HD3 PRO A 702 5.919 -3.905 13.930 1.00 0.00 H new ATOM 1182 N PRO A 703 2.845 -2.197 9.614 1.00 0.00 N ATOM 1183 CA PRO A 703 1.539 -2.025 8.913 1.00 0.00 C ATOM 1184 C PRO A 703 1.307 -3.107 7.862 1.00 0.00 C ATOM 1185 O PRO A 703 2.241 -3.794 7.447 1.00 0.00 O ATOM 1186 CB PRO A 703 1.650 -0.644 8.264 1.00 0.00 C ATOM 1187 CG PRO A 703 3.111 -0.408 8.079 1.00 0.00 C ATOM 1188 CD PRO A 703 3.832 -1.196 9.175 1.00 0.00 C ATOM 0 HA PRO A 703 0.694 -2.108 9.596 1.00 0.00 H new ATOM 0 HB2 PRO A 703 1.124 -0.615 7.310 1.00 0.00 H new ATOM 0 HB3 PRO A 703 1.205 0.124 8.897 1.00 0.00 H new ATOM 0 HG2 PRO A 703 3.433 -0.738 7.091 1.00 0.00 H new ATOM 0 HG3 PRO A 703 3.343 0.655 8.152 1.00 0.00 H new ATOM 0 HD2 PRO A 703 4.737 -1.670 8.794 1.00 0.00 H new ATOM 0 HD3 PRO A 703 4.134 -0.548 9.998 1.00 0.00 H new ATOM 1196 N LEU A 704 0.058 -3.250 7.433 1.00 0.00 N ATOM 1197 CA LEU A 704 -0.285 -4.248 6.426 1.00 0.00 C ATOM 1198 C LEU A 704 0.118 -3.752 5.035 1.00 0.00 C ATOM 1199 O LEU A 704 -0.030 -2.571 4.723 1.00 0.00 O ATOM 1200 CB LEU A 704 -1.793 -4.534 6.464 1.00 0.00 C ATOM 1201 CG LEU A 704 -2.221 -4.989 7.871 1.00 0.00 C ATOM 1202 CD1 LEU A 704 -1.200 -5.978 8.436 1.00 0.00 C ATOM 1203 CD2 LEU A 704 -2.325 -3.781 8.807 1.00 0.00 C ATOM 0 H LEU A 704 -0.729 -2.692 7.764 1.00 0.00 H new ATOM 0 HA LEU A 704 0.257 -5.169 6.643 1.00 0.00 H new ATOM 0 HB2 LEU A 704 -2.346 -3.638 6.181 1.00 0.00 H new ATOM 0 HB3 LEU A 704 -2.041 -5.305 5.735 1.00 0.00 H new ATOM 0 HG LEU A 704 -3.194 -5.474 7.797 1.00 0.00 H new ATOM 0 HD11 LEU A 704 -1.512 -6.294 9.432 1.00 0.00 H new ATOM 0 HD12 LEU A 704 -1.136 -6.848 7.783 1.00 0.00 H new ATOM 0 HD13 LEU A 704 -0.223 -5.498 8.497 1.00 0.00 H new ATOM 0 HD21 LEU A 704 -2.628 -4.115 9.799 1.00 0.00 H new ATOM 0 HD22 LEU A 704 -1.356 -3.286 8.871 1.00 0.00 H new ATOM 0 HD23 LEU A 704 -3.065 -3.082 8.418 1.00 0.00 H new ATOM 1215 N VAL A 705 0.640 -4.655 4.207 1.00 0.00 N ATOM 1216 CA VAL A 705 1.071 -4.284 2.859 1.00 0.00 C ATOM 1217 C VAL A 705 0.340 -5.105 1.803 1.00 0.00 C ATOM 1218 O VAL A 705 0.215 -6.325 1.925 1.00 0.00 O ATOM 1219 CB VAL A 705 2.577 -4.508 2.717 1.00 0.00 C ATOM 1220 CG1 VAL A 705 3.051 -3.980 1.361 1.00 0.00 C ATOM 1221 CG2 VAL A 705 3.311 -3.773 3.843 1.00 0.00 C ATOM 0 H VAL A 705 0.774 -5.639 4.441 1.00 0.00 H new ATOM 0 HA VAL A 705 0.835 -3.231 2.707 1.00 0.00 H new ATOM 0 HB VAL A 705 2.792 -5.575 2.781 1.00 0.00 H new ATOM 0 HG11 VAL A 705 4.125 -4.141 1.263 1.00 0.00 H new ATOM 0 HG12 VAL A 705 2.530 -4.509 0.563 1.00 0.00 H new ATOM 0 HG13 VAL A 705 2.836 -2.914 1.290 1.00 0.00 H new ATOM 0 HG21 VAL A 705 4.385 -3.932 3.742 1.00 0.00 H new ATOM 0 HG22 VAL A 705 3.095 -2.706 3.782 1.00 0.00 H new ATOM 0 HG23 VAL A 705 2.976 -4.157 4.807 1.00 0.00 H new ATOM 1231 N LEU A 706 -0.135 -4.430 0.761 1.00 0.00 N ATOM 1232 CA LEU A 706 -0.843 -5.113 -0.315 1.00 0.00 C ATOM 1233 C LEU A 706 -0.074 -5.009 -1.628 1.00 0.00 C ATOM 1234 O LEU A 706 0.352 -3.924 -2.023 1.00 0.00 O ATOM 1235 CB LEU A 706 -2.231 -4.498 -0.502 1.00 0.00 C ATOM 1236 CG LEU A 706 -2.989 -4.532 0.824 1.00 0.00 C ATOM 1237 CD1 LEU A 706 -4.425 -4.051 0.604 1.00 0.00 C ATOM 1238 CD2 LEU A 706 -3.008 -5.964 1.359 1.00 0.00 C ATOM 0 H LEU A 706 -0.044 -3.421 0.639 1.00 0.00 H new ATOM 0 HA LEU A 706 -0.935 -6.164 -0.041 1.00 0.00 H new ATOM 0 HB2 LEU A 706 -2.140 -3.471 -0.854 1.00 0.00 H new ATOM 0 HB3 LEU A 706 -2.784 -5.048 -1.263 1.00 0.00 H new ATOM 0 HG LEU A 706 -2.495 -3.879 1.544 1.00 0.00 H new ATOM 0 HD11 LEU A 706 -4.966 -4.075 1.550 1.00 0.00 H new ATOM 0 HD12 LEU A 706 -4.412 -3.031 0.219 1.00 0.00 H new ATOM 0 HD13 LEU A 706 -4.921 -4.703 -0.114 1.00 0.00 H new ATOM 0 HD21 LEU A 706 -3.548 -5.992 2.305 1.00 0.00 H new ATOM 0 HD22 LEU A 706 -3.504 -6.615 0.639 1.00 0.00 H new ATOM 0 HD23 LEU A 706 -1.985 -6.308 1.515 1.00 0.00 H new ATOM 1250 N PHE A 707 0.078 -6.138 -2.313 1.00 0.00 N ATOM 1251 CA PHE A 707 0.774 -6.148 -3.595 1.00 0.00 C ATOM 1252 C PHE A 707 -0.205 -6.454 -4.721 1.00 0.00 C ATOM 1253 O PHE A 707 -0.926 -7.451 -4.679 1.00 0.00 O ATOM 1254 CB PHE A 707 1.903 -7.182 -3.584 1.00 0.00 C ATOM 1255 CG PHE A 707 2.994 -6.712 -2.654 1.00 0.00 C ATOM 1256 CD1 PHE A 707 2.908 -6.975 -1.282 1.00 0.00 C ATOM 1257 CD2 PHE A 707 4.092 -6.010 -3.165 1.00 0.00 C ATOM 1258 CE1 PHE A 707 3.918 -6.533 -0.421 1.00 0.00 C ATOM 1259 CE2 PHE A 707 5.103 -5.569 -2.304 1.00 0.00 C ATOM 1260 CZ PHE A 707 5.016 -5.831 -0.932 1.00 0.00 C ATOM 0 H PHE A 707 -0.267 -7.048 -2.007 1.00 0.00 H new ATOM 0 HA PHE A 707 1.208 -5.162 -3.761 1.00 0.00 H new ATOM 0 HB2 PHE A 707 1.523 -8.150 -3.259 1.00 0.00 H new ATOM 0 HB3 PHE A 707 2.299 -7.317 -4.590 1.00 0.00 H new ATOM 0 HD1 PHE A 707 2.062 -7.519 -0.888 1.00 0.00 H new ATOM 0 HD2 PHE A 707 4.159 -5.809 -4.224 1.00 0.00 H new ATOM 0 HE1 PHE A 707 3.851 -6.733 0.638 1.00 0.00 H new ATOM 0 HE2 PHE A 707 5.950 -5.027 -2.698 1.00 0.00 H new ATOM 0 HZ PHE A 707 5.796 -5.491 -0.267 1.00 0.00 H new ATOM 1270 N LEU A 708 -0.231 -5.586 -5.722 1.00 0.00 N ATOM 1271 CA LEU A 708 -1.131 -5.765 -6.852 1.00 0.00 C ATOM 1272 C LEU A 708 -0.417 -6.486 -7.991 1.00 0.00 C ATOM 1273 O LEU A 708 0.791 -6.335 -8.169 1.00 0.00 O ATOM 1274 CB LEU A 708 -1.632 -4.401 -7.325 1.00 0.00 C ATOM 1275 CG LEU A 708 -2.174 -3.625 -6.122 1.00 0.00 C ATOM 1276 CD1 LEU A 708 -2.691 -2.260 -6.576 1.00 0.00 C ATOM 1277 CD2 LEU A 708 -3.314 -4.417 -5.478 1.00 0.00 C ATOM 0 H LEU A 708 0.358 -4.755 -5.775 1.00 0.00 H new ATOM 0 HA LEU A 708 -1.980 -6.373 -6.539 1.00 0.00 H new ATOM 0 HB2 LEU A 708 -0.822 -3.845 -7.798 1.00 0.00 H new ATOM 0 HB3 LEU A 708 -2.413 -4.526 -8.075 1.00 0.00 H new ATOM 0 HG LEU A 708 -1.374 -3.481 -5.396 1.00 0.00 H new ATOM 0 HD11 LEU A 708 -3.076 -1.712 -5.716 1.00 0.00 H new ATOM 0 HD12 LEU A 708 -1.877 -1.696 -7.031 1.00 0.00 H new ATOM 0 HD13 LEU A 708 -3.490 -2.397 -7.305 1.00 0.00 H new ATOM 0 HD21 LEU A 708 -3.701 -3.866 -4.621 1.00 0.00 H new ATOM 0 HD22 LEU A 708 -4.112 -4.563 -6.206 1.00 0.00 H new ATOM 0 HD23 LEU A 708 -2.942 -5.387 -5.148 1.00 0.00 H new ATOM 1289 N GLY A 709 -1.167 -7.271 -8.758 1.00 0.00 N ATOM 1290 CA GLY A 709 -0.584 -8.006 -9.875 1.00 0.00 C ATOM 1291 C GLY A 709 -0.102 -9.388 -9.443 1.00 0.00 C ATOM 1292 O GLY A 709 -0.848 -10.156 -8.833 1.00 0.00 O ATOM 0 H GLY A 709 -2.169 -7.414 -8.629 1.00 0.00 H new ATOM 0 HA2 GLY A 709 -1.323 -8.109 -10.670 1.00 0.00 H new ATOM 0 HA3 GLY A 709 0.251 -7.441 -10.288 1.00 0.00 H new ATOM 1296 N GLU A 710 1.147 -9.703 -9.775 1.00 0.00 N ATOM 1297 CA GLU A 710 1.718 -11.001 -9.430 1.00 0.00 C ATOM 1298 C GLU A 710 2.359 -10.960 -8.039 1.00 0.00 C ATOM 1299 O GLU A 710 2.625 -9.879 -7.512 1.00 0.00 O ATOM 1300 CB GLU A 710 2.774 -11.388 -10.469 1.00 0.00 C ATOM 1301 CG GLU A 710 2.098 -11.660 -11.814 1.00 0.00 C ATOM 1302 CD GLU A 710 2.947 -12.625 -12.633 1.00 0.00 C ATOM 1303 OE1 GLU A 710 4.120 -12.754 -12.325 1.00 0.00 O ATOM 1304 OE2 GLU A 710 2.414 -13.220 -13.554 1.00 0.00 O ATOM 0 H GLU A 710 1.779 -9.082 -10.279 1.00 0.00 H new ATOM 0 HA GLU A 710 0.918 -11.741 -9.422 1.00 0.00 H new ATOM 0 HB2 GLU A 710 3.506 -10.587 -10.574 1.00 0.00 H new ATOM 0 HB3 GLU A 710 3.317 -12.274 -10.138 1.00 0.00 H new ATOM 0 HG2 GLU A 710 1.105 -12.081 -11.654 1.00 0.00 H new ATOM 0 HG3 GLU A 710 1.964 -10.726 -12.360 1.00 0.00 H new ATOM 1311 N PRO A 711 2.618 -12.100 -7.431 1.00 0.00 N ATOM 1312 CA PRO A 711 3.245 -12.154 -6.076 1.00 0.00 C ATOM 1313 C PRO A 711 4.703 -11.677 -6.097 1.00 0.00 C ATOM 1314 O PRO A 711 5.455 -12.008 -7.015 1.00 0.00 O ATOM 1315 CB PRO A 711 3.168 -13.637 -5.674 1.00 0.00 C ATOM 1316 CG PRO A 711 2.298 -14.308 -6.689 1.00 0.00 C ATOM 1317 CD PRO A 711 2.349 -13.452 -7.948 1.00 0.00 C ATOM 0 HA PRO A 711 2.733 -11.497 -5.373 1.00 0.00 H new ATOM 0 HB2 PRO A 711 4.161 -14.086 -5.657 1.00 0.00 H new ATOM 0 HB3 PRO A 711 2.751 -13.746 -4.673 1.00 0.00 H new ATOM 0 HG2 PRO A 711 2.652 -15.318 -6.894 1.00 0.00 H new ATOM 0 HG3 PRO A 711 1.275 -14.397 -6.323 1.00 0.00 H new ATOM 0 HD2 PRO A 711 3.132 -13.785 -8.629 1.00 0.00 H new ATOM 0 HD3 PRO A 711 1.410 -13.492 -8.499 1.00 0.00 H new ATOM 1325 N PRO A 712 5.118 -10.916 -5.111 1.00 0.00 N ATOM 1326 CA PRO A 712 6.519 -10.403 -5.031 1.00 0.00 C ATOM 1327 C PRO A 712 7.557 -11.497 -5.276 1.00 0.00 C ATOM 1328 O PRO A 712 7.310 -12.673 -5.011 1.00 0.00 O ATOM 1329 CB PRO A 712 6.629 -9.869 -3.603 1.00 0.00 C ATOM 1330 CG PRO A 712 5.237 -9.525 -3.194 1.00 0.00 C ATOM 1331 CD PRO A 712 4.303 -10.453 -3.972 1.00 0.00 C ATOM 0 HA PRO A 712 6.716 -9.650 -5.794 1.00 0.00 H new ATOM 0 HB2 PRO A 712 7.059 -10.617 -2.937 1.00 0.00 H new ATOM 0 HB3 PRO A 712 7.277 -8.994 -3.561 1.00 0.00 H new ATOM 0 HG2 PRO A 712 5.106 -9.657 -2.120 1.00 0.00 H new ATOM 0 HG3 PRO A 712 5.016 -8.481 -3.416 1.00 0.00 H new ATOM 0 HD2 PRO A 712 3.968 -11.288 -3.357 1.00 0.00 H new ATOM 0 HD3 PRO A 712 3.410 -9.927 -4.309 1.00 0.00 H new ATOM 1339 N VAL A 713 8.719 -11.099 -5.789 1.00 0.00 N ATOM 1340 CA VAL A 713 9.788 -12.053 -6.072 1.00 0.00 C ATOM 1341 C VAL A 713 10.616 -12.341 -4.818 1.00 0.00 C ATOM 1342 O VAL A 713 10.900 -13.499 -4.513 1.00 0.00 O ATOM 1343 CB VAL A 713 10.695 -11.510 -7.179 1.00 0.00 C ATOM 1344 CG1 VAL A 713 11.302 -10.180 -6.734 1.00 0.00 C ATOM 1345 CG2 VAL A 713 11.818 -12.511 -7.464 1.00 0.00 C ATOM 0 H VAL A 713 8.943 -10.130 -6.016 1.00 0.00 H new ATOM 0 HA VAL A 713 9.331 -12.986 -6.402 1.00 0.00 H new ATOM 0 HB VAL A 713 10.107 -11.359 -8.084 1.00 0.00 H new ATOM 0 HG11 VAL A 713 11.948 -9.793 -7.522 1.00 0.00 H new ATOM 0 HG12 VAL A 713 10.504 -9.465 -6.535 1.00 0.00 H new ATOM 0 HG13 VAL A 713 11.887 -10.332 -5.827 1.00 0.00 H new ATOM 0 HG21 VAL A 713 12.462 -12.121 -8.253 1.00 0.00 H new ATOM 0 HG22 VAL A 713 12.406 -12.666 -6.559 1.00 0.00 H new ATOM 0 HG23 VAL A 713 11.387 -13.460 -7.783 1.00 0.00 H new ATOM 1355 N ASP A 714 11.004 -11.289 -4.092 1.00 0.00 N ATOM 1356 CA ASP A 714 11.798 -11.471 -2.876 1.00 0.00 C ATOM 1357 C ASP A 714 10.935 -12.055 -1.758 1.00 0.00 C ATOM 1358 O ASP A 714 9.735 -11.786 -1.684 1.00 0.00 O ATOM 1359 CB ASP A 714 12.405 -10.141 -2.418 1.00 0.00 C ATOM 1360 CG ASP A 714 13.871 -10.070 -2.833 1.00 0.00 C ATOM 1361 OD1 ASP A 714 14.667 -10.780 -2.241 1.00 0.00 O ATOM 1362 OD2 ASP A 714 14.176 -9.305 -3.733 1.00 0.00 O ATOM 0 H ASP A 714 10.786 -10.319 -4.320 1.00 0.00 H new ATOM 0 HA ASP A 714 12.607 -12.165 -3.103 1.00 0.00 H new ATOM 0 HB2 ASP A 714 11.853 -9.309 -2.856 1.00 0.00 H new ATOM 0 HB3 ASP A 714 12.319 -10.046 -1.336 1.00 0.00 H new ATOM 1367 N PRO A 715 11.521 -12.852 -0.900 1.00 0.00 N ATOM 1368 CA PRO A 715 10.794 -13.501 0.233 1.00 0.00 C ATOM 1369 C PRO A 715 10.441 -12.528 1.357 1.00 0.00 C ATOM 1370 O PRO A 715 9.499 -12.763 2.114 1.00 0.00 O ATOM 1371 CB PRO A 715 11.779 -14.559 0.730 1.00 0.00 C ATOM 1372 CG PRO A 715 13.128 -14.038 0.364 1.00 0.00 C ATOM 1373 CD PRO A 715 12.945 -13.224 -0.918 1.00 0.00 C ATOM 0 HA PRO A 715 9.834 -13.905 -0.090 1.00 0.00 H new ATOM 0 HB2 PRO A 715 11.691 -14.704 1.807 1.00 0.00 H new ATOM 0 HB3 PRO A 715 11.589 -15.525 0.262 1.00 0.00 H new ATOM 0 HG2 PRO A 715 13.534 -13.418 1.163 1.00 0.00 H new ATOM 0 HG3 PRO A 715 13.831 -14.856 0.207 1.00 0.00 H new ATOM 0 HD2 PRO A 715 13.588 -12.344 -0.928 1.00 0.00 H new ATOM 0 HD3 PRO A 715 13.194 -13.810 -1.803 1.00 0.00 H new ATOM 1381 N LEU A 716 11.201 -11.446 1.474 1.00 0.00 N ATOM 1382 CA LEU A 716 10.945 -10.470 2.525 1.00 0.00 C ATOM 1383 C LEU A 716 9.656 -9.704 2.254 1.00 0.00 C ATOM 1384 O LEU A 716 8.978 -9.270 3.185 1.00 0.00 O ATOM 1385 CB LEU A 716 12.114 -9.492 2.639 1.00 0.00 C ATOM 1386 CG LEU A 716 13.406 -10.268 2.907 1.00 0.00 C ATOM 1387 CD1 LEU A 716 14.566 -9.284 3.062 1.00 0.00 C ATOM 1388 CD2 LEU A 716 13.255 -11.083 4.194 1.00 0.00 C ATOM 0 H LEU A 716 11.988 -11.224 0.864 1.00 0.00 H new ATOM 0 HA LEU A 716 10.837 -11.009 3.466 1.00 0.00 H new ATOM 0 HB2 LEU A 716 12.209 -8.914 1.720 1.00 0.00 H new ATOM 0 HB3 LEU A 716 11.930 -8.782 3.445 1.00 0.00 H new ATOM 0 HG LEU A 716 13.606 -10.940 2.073 1.00 0.00 H new ATOM 0 HD11 LEU A 716 15.487 -9.835 3.253 1.00 0.00 H new ATOM 0 HD12 LEU A 716 14.674 -8.702 2.147 1.00 0.00 H new ATOM 0 HD13 LEU A 716 14.365 -8.613 3.897 1.00 0.00 H new ATOM 0 HD21 LEU A 716 14.175 -11.636 4.385 1.00 0.00 H new ATOM 0 HD22 LEU A 716 13.055 -10.411 5.029 1.00 0.00 H new ATOM 0 HD23 LEU A 716 12.427 -11.783 4.086 1.00 0.00 H new ATOM 1400 N LEU A 717 9.314 -9.543 0.979 1.00 0.00 N ATOM 1401 CA LEU A 717 8.094 -8.831 0.625 1.00 0.00 C ATOM 1402 C LEU A 717 6.887 -9.736 0.833 1.00 0.00 C ATOM 1403 O LEU A 717 5.861 -9.304 1.358 1.00 0.00 O ATOM 1404 CB LEU A 717 8.157 -8.367 -0.832 1.00 0.00 C ATOM 1405 CG LEU A 717 9.164 -7.222 -0.948 1.00 0.00 C ATOM 1406 CD1 LEU A 717 10.572 -7.761 -0.710 1.00 0.00 C ATOM 1407 CD2 LEU A 717 9.087 -6.610 -2.348 1.00 0.00 C ATOM 0 H LEU A 717 9.855 -9.890 0.187 1.00 0.00 H new ATOM 0 HA LEU A 717 7.997 -7.956 1.267 1.00 0.00 H new ATOM 0 HB2 LEU A 717 8.452 -9.194 -1.478 1.00 0.00 H new ATOM 0 HB3 LEU A 717 7.173 -8.038 -1.165 1.00 0.00 H new ATOM 0 HG LEU A 717 8.932 -6.459 -0.205 1.00 0.00 H new ATOM 0 HD11 LEU A 717 11.292 -6.947 -0.792 1.00 0.00 H new ATOM 0 HD12 LEU A 717 10.631 -8.198 0.287 1.00 0.00 H new ATOM 0 HD13 LEU A 717 10.800 -8.524 -1.455 1.00 0.00 H new ATOM 0 HD21 LEU A 717 9.805 -5.794 -2.428 1.00 0.00 H new ATOM 0 HD22 LEU A 717 9.319 -7.372 -3.092 1.00 0.00 H new ATOM 0 HD23 LEU A 717 8.082 -6.227 -2.523 1.00 0.00 H new ATOM 1419 N THR A 718 7.023 -11.001 0.445 1.00 0.00 N ATOM 1420 CA THR A 718 5.936 -11.952 0.627 1.00 0.00 C ATOM 1421 C THR A 718 5.667 -12.137 2.112 1.00 0.00 C ATOM 1422 O THR A 718 4.517 -12.173 2.548 1.00 0.00 O ATOM 1423 CB THR A 718 6.291 -13.302 0.003 1.00 0.00 C ATOM 1424 OG1 THR A 718 6.651 -13.110 -1.357 1.00 0.00 O ATOM 1425 CG2 THR A 718 5.082 -14.235 0.092 1.00 0.00 C ATOM 0 H THR A 718 7.862 -11.385 0.010 1.00 0.00 H new ATOM 0 HA THR A 718 5.045 -11.562 0.134 1.00 0.00 H new ATOM 0 HB THR A 718 7.129 -13.747 0.539 1.00 0.00 H new ATOM 0 HG1 THR A 718 6.881 -13.973 -1.760 1.00 0.00 H new ATOM 0 HG21 THR A 718 5.332 -15.198 -0.352 1.00 0.00 H new ATOM 0 HG22 THR A 718 4.809 -14.378 1.137 1.00 0.00 H new ATOM 0 HG23 THR A 718 4.242 -13.795 -0.446 1.00 0.00 H new ATOM 1433 N ALA A 719 6.743 -12.247 2.887 1.00 0.00 N ATOM 1434 CA ALA A 719 6.618 -12.415 4.325 1.00 0.00 C ATOM 1435 C ALA A 719 6.011 -11.161 4.945 1.00 0.00 C ATOM 1436 O ALA A 719 5.193 -11.242 5.860 1.00 0.00 O ATOM 1437 CB ALA A 719 7.992 -12.687 4.944 1.00 0.00 C ATOM 0 H ALA A 719 7.703 -12.223 2.543 1.00 0.00 H new ATOM 0 HA ALA A 719 5.964 -13.264 4.525 1.00 0.00 H new ATOM 0 HB1 ALA A 719 7.887 -12.811 6.022 1.00 0.00 H new ATOM 0 HB2 ALA A 719 8.412 -13.596 4.513 1.00 0.00 H new ATOM 0 HB3 ALA A 719 8.656 -11.848 4.738 1.00 0.00 H new ATOM 1443 N GLN A 720 6.419 -9.999 4.435 1.00 0.00 N ATOM 1444 CA GLN A 720 5.908 -8.731 4.943 1.00 0.00 C ATOM 1445 C GLN A 720 4.576 -8.377 4.288 1.00 0.00 C ATOM 1446 O GLN A 720 3.863 -7.489 4.753 1.00 0.00 O ATOM 1447 CB GLN A 720 6.924 -7.611 4.686 1.00 0.00 C ATOM 1448 CG GLN A 720 6.460 -6.331 5.386 1.00 0.00 C ATOM 1449 CD GLN A 720 7.435 -5.193 5.107 1.00 0.00 C ATOM 1450 OE1 GLN A 720 8.587 -5.455 4.556 1.00 0.00 O flip ATOM 1451 NE2 GLN A 720 7.142 -4.035 5.407 1.00 0.00 N flip ATOM 0 H GLN A 720 7.096 -9.912 3.677 1.00 0.00 H new ATOM 0 HA GLN A 720 5.749 -8.836 6.016 1.00 0.00 H new ATOM 0 HB2 GLN A 720 7.906 -7.905 5.056 1.00 0.00 H new ATOM 0 HB3 GLN A 720 7.026 -7.436 3.615 1.00 0.00 H new ATOM 0 HG2 GLN A 720 5.463 -6.059 5.038 1.00 0.00 H new ATOM 0 HG3 GLN A 720 6.387 -6.502 6.460 1.00 0.00 H new ATOM 0 HE21 GLN A 720 6.240 -3.832 5.838 1.00 0.00 H new ATOM 0 HE22 GLN A 720 7.801 -3.278 5.224 1.00 0.00 H new ATOM 1460 N ALA A 721 4.244 -9.071 3.205 1.00 0.00 N ATOM 1461 CA ALA A 721 2.994 -8.800 2.504 1.00 0.00 C ATOM 1462 C ALA A 721 1.800 -9.282 3.320 1.00 0.00 C ATOM 1463 O ALA A 721 1.754 -10.432 3.760 1.00 0.00 O ATOM 1464 CB ALA A 721 2.993 -9.495 1.141 1.00 0.00 C ATOM 0 H ALA A 721 4.812 -9.814 2.798 1.00 0.00 H new ATOM 0 HA ALA A 721 2.912 -7.722 2.363 1.00 0.00 H new ATOM 0 HB1 ALA A 721 2.055 -9.286 0.627 1.00 0.00 H new ATOM 0 HB2 ALA A 721 3.825 -9.124 0.543 1.00 0.00 H new ATOM 0 HB3 ALA A 721 3.098 -10.571 1.281 1.00 0.00 H new ATOM 1470 N SER A 722 0.831 -8.393 3.513 1.00 0.00 N ATOM 1471 CA SER A 722 -0.366 -8.732 4.272 1.00 0.00 C ATOM 1472 C SER A 722 -1.400 -9.393 3.369 1.00 0.00 C ATOM 1473 O SER A 722 -2.256 -10.147 3.833 1.00 0.00 O ATOM 1474 CB SER A 722 -0.960 -7.470 4.894 1.00 0.00 C ATOM 1475 OG SER A 722 -2.186 -7.795 5.534 1.00 0.00 O ATOM 0 H SER A 722 0.851 -7.438 3.156 1.00 0.00 H new ATOM 0 HA SER A 722 -0.091 -9.431 5.062 1.00 0.00 H new ATOM 0 HB2 SER A 722 -0.262 -7.043 5.614 1.00 0.00 H new ATOM 0 HB3 SER A 722 -1.127 -6.715 4.125 1.00 0.00 H new ATOM 0 HG SER A 722 -2.924 -7.696 4.897 1.00 0.00 H new ATOM 1481 N ALA A 723 -1.310 -9.104 2.077 1.00 0.00 N ATOM 1482 CA ALA A 723 -2.238 -9.674 1.108 1.00 0.00 C ATOM 1483 C ALA A 723 -1.781 -9.353 -0.309 1.00 0.00 C ATOM 1484 O ALA A 723 -1.003 -8.423 -0.525 1.00 0.00 O ATOM 1485 CB ALA A 723 -3.646 -9.119 1.336 1.00 0.00 C ATOM 0 H ALA A 723 -0.608 -8.482 1.677 1.00 0.00 H new ATOM 0 HA ALA A 723 -2.257 -10.756 1.239 1.00 0.00 H new ATOM 0 HB1 ALA A 723 -4.330 -9.552 0.606 1.00 0.00 H new ATOM 0 HB2 ALA A 723 -3.979 -9.374 2.342 1.00 0.00 H new ATOM 0 HB3 ALA A 723 -3.633 -8.035 1.222 1.00 0.00 H new ATOM 1491 N ILE A 724 -2.262 -10.133 -1.269 1.00 0.00 N ATOM 1492 CA ILE A 724 -1.884 -9.927 -2.660 1.00 0.00 C ATOM 1493 C ILE A 724 -3.100 -10.033 -3.572 1.00 0.00 C ATOM 1494 O ILE A 724 -3.822 -11.030 -3.548 1.00 0.00 O ATOM 1495 CB ILE A 724 -0.848 -10.974 -3.067 1.00 0.00 C ATOM 1496 CG1 ILE A 724 0.351 -10.899 -2.117 1.00 0.00 C ATOM 1497 CG2 ILE A 724 -0.388 -10.701 -4.500 1.00 0.00 C ATOM 1498 CD1 ILE A 724 1.310 -12.051 -2.414 1.00 0.00 C ATOM 0 H ILE A 724 -2.908 -10.906 -1.112 1.00 0.00 H new ATOM 0 HA ILE A 724 -1.461 -8.928 -2.761 1.00 0.00 H new ATOM 0 HB ILE A 724 -1.290 -11.969 -3.012 1.00 0.00 H new ATOM 0 HG12 ILE A 724 0.864 -9.945 -2.237 1.00 0.00 H new ATOM 0 HG13 ILE A 724 0.012 -10.951 -1.082 1.00 0.00 H new ATOM 0 HG21 ILE A 724 0.351 -11.446 -4.793 1.00 0.00 H new ATOM 0 HG22 ILE A 724 -1.244 -10.754 -5.173 1.00 0.00 H new ATOM 0 HG23 ILE A 724 0.057 -9.707 -4.556 1.00 0.00 H new ATOM 0 HD11 ILE A 724 2.163 -11.998 -1.738 1.00 0.00 H new ATOM 0 HD12 ILE A 724 0.793 -13.000 -2.272 1.00 0.00 H new ATOM 0 HD13 ILE A 724 1.658 -11.978 -3.444 1.00 0.00 H new ATOM 1510 N LEU A 725 -3.316 -9.001 -4.380 1.00 0.00 N ATOM 1511 CA LEU A 725 -4.444 -8.994 -5.303 1.00 0.00 C ATOM 1512 C LEU A 725 -3.948 -9.184 -6.731 1.00 0.00 C ATOM 1513 O LEU A 725 -3.073 -8.453 -7.192 1.00 0.00 O ATOM 1514 CB LEU A 725 -5.192 -7.664 -5.193 1.00 0.00 C ATOM 1515 CG LEU A 725 -5.539 -7.394 -3.727 1.00 0.00 C ATOM 1516 CD1 LEU A 725 -6.335 -6.093 -3.620 1.00 0.00 C ATOM 1517 CD2 LEU A 725 -6.381 -8.547 -3.179 1.00 0.00 C ATOM 0 H LEU A 725 -2.731 -8.166 -4.415 1.00 0.00 H new ATOM 0 HA LEU A 725 -5.118 -9.811 -5.047 1.00 0.00 H new ATOM 0 HB2 LEU A 725 -4.577 -6.855 -5.587 1.00 0.00 H new ATOM 0 HB3 LEU A 725 -6.101 -7.695 -5.793 1.00 0.00 H new ATOM 0 HG LEU A 725 -4.618 -7.307 -3.150 1.00 0.00 H new ATOM 0 HD11 LEU A 725 -6.581 -5.902 -2.576 1.00 0.00 H new ATOM 0 HD12 LEU A 725 -5.738 -5.268 -4.009 1.00 0.00 H new ATOM 0 HD13 LEU A 725 -7.254 -6.180 -4.200 1.00 0.00 H new ATOM 0 HD21 LEU A 725 -6.627 -8.353 -2.135 1.00 0.00 H new ATOM 0 HD22 LEU A 725 -7.300 -8.634 -3.759 1.00 0.00 H new ATOM 0 HD23 LEU A 725 -5.817 -9.477 -3.252 1.00 0.00 H new ATOM 1529 N SER A 726 -4.510 -10.164 -7.431 1.00 0.00 N ATOM 1530 CA SER A 726 -4.108 -10.425 -8.808 1.00 0.00 C ATOM 1531 C SER A 726 -4.574 -9.295 -9.720 1.00 0.00 C ATOM 1532 O SER A 726 -3.842 -8.336 -9.963 1.00 0.00 O ATOM 1533 CB SER A 726 -4.703 -11.751 -9.285 1.00 0.00 C ATOM 1534 OG SER A 726 -4.383 -11.947 -10.657 1.00 0.00 O ATOM 0 H SER A 726 -5.237 -10.784 -7.073 1.00 0.00 H new ATOM 0 HA SER A 726 -3.020 -10.485 -8.847 1.00 0.00 H new ATOM 0 HB2 SER A 726 -4.311 -12.574 -8.688 1.00 0.00 H new ATOM 0 HB3 SER A 726 -5.785 -11.746 -9.150 1.00 0.00 H new ATOM 0 HG SER A 726 -4.762 -12.797 -10.963 1.00 0.00 H new ATOM 1540 N LYS A 727 -5.794 -9.420 -10.222 1.00 0.00 N ATOM 1541 CA LYS A 727 -6.352 -8.406 -11.111 1.00 0.00 C ATOM 1542 C LYS A 727 -7.796 -8.051 -10.736 1.00 0.00 C ATOM 1543 O LYS A 727 -8.213 -6.904 -10.893 1.00 0.00 O ATOM 1544 CB LYS A 727 -6.310 -8.899 -12.558 1.00 0.00 C ATOM 1545 CG LYS A 727 -6.605 -7.729 -13.500 1.00 0.00 C ATOM 1546 CD LYS A 727 -7.312 -8.241 -14.757 1.00 0.00 C ATOM 1547 CE LYS A 727 -7.967 -7.069 -15.487 1.00 0.00 C ATOM 1548 NZ LYS A 727 -7.075 -5.877 -15.417 1.00 0.00 N ATOM 0 H LYS A 727 -6.414 -10.207 -10.032 1.00 0.00 H new ATOM 0 HA LYS A 727 -5.744 -7.508 -11.005 1.00 0.00 H new ATOM 0 HB2 LYS A 727 -5.331 -9.323 -12.782 1.00 0.00 H new ATOM 0 HB3 LYS A 727 -7.042 -9.693 -12.705 1.00 0.00 H new ATOM 0 HG2 LYS A 727 -7.230 -6.992 -12.995 1.00 0.00 H new ATOM 0 HG3 LYS A 727 -5.677 -7.227 -13.773 1.00 0.00 H new ATOM 0 HD2 LYS A 727 -6.597 -8.738 -15.413 1.00 0.00 H new ATOM 0 HD3 LYS A 727 -8.065 -8.982 -14.487 1.00 0.00 H new ATOM 0 HE2 LYS A 727 -8.155 -7.335 -16.527 1.00 0.00 H new ATOM 0 HE3 LYS A 727 -8.933 -6.840 -15.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 727 -7.333 -5.206 -16.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 727 -7.182 -5.417 -14.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 727 -6.087 -6.175 -15.544 1.00 0.00 H new ATOM 1562 N PRO A 728 -8.570 -9.000 -10.264 1.00 0.00 N ATOM 1563 CA PRO A 728 -9.996 -8.755 -9.888 1.00 0.00 C ATOM 1564 C PRO A 728 -10.147 -7.658 -8.836 1.00 0.00 C ATOM 1565 O PRO A 728 -9.268 -7.454 -7.999 1.00 0.00 O ATOM 1566 CB PRO A 728 -10.479 -10.103 -9.346 1.00 0.00 C ATOM 1567 CG PRO A 728 -9.524 -11.116 -9.882 1.00 0.00 C ATOM 1568 CD PRO A 728 -8.186 -10.400 -10.034 1.00 0.00 C ATOM 0 HA PRO A 728 -10.577 -8.404 -10.740 1.00 0.00 H new ATOM 0 HB2 PRO A 728 -10.485 -10.108 -8.256 1.00 0.00 H new ATOM 0 HB3 PRO A 728 -11.498 -10.314 -9.671 1.00 0.00 H new ATOM 0 HG2 PRO A 728 -9.436 -11.965 -9.204 1.00 0.00 H new ATOM 0 HG3 PRO A 728 -9.868 -11.507 -10.840 1.00 0.00 H new ATOM 0 HD2 PRO A 728 -7.570 -10.506 -9.141 1.00 0.00 H new ATOM 0 HD3 PRO A 728 -7.609 -10.800 -10.868 1.00 0.00 H new ATOM 1576 N LEU A 729 -11.274 -6.954 -8.892 1.00 0.00 N ATOM 1577 CA LEU A 729 -11.547 -5.877 -7.948 1.00 0.00 C ATOM 1578 C LEU A 729 -11.624 -6.413 -6.520 1.00 0.00 C ATOM 1579 O LEU A 729 -10.659 -6.329 -5.760 1.00 0.00 O ATOM 1580 CB LEU A 729 -12.872 -5.199 -8.318 1.00 0.00 C ATOM 1581 CG LEU A 729 -12.802 -4.690 -9.760 1.00 0.00 C ATOM 1582 CD1 LEU A 729 -14.135 -4.046 -10.147 1.00 0.00 C ATOM 1583 CD2 LEU A 729 -11.691 -3.646 -9.872 1.00 0.00 C ATOM 0 H LEU A 729 -12.011 -7.110 -9.580 1.00 0.00 H new ATOM 0 HA LEU A 729 -10.734 -5.153 -8.000 1.00 0.00 H new ATOM 0 HB2 LEU A 729 -13.696 -5.904 -8.210 1.00 0.00 H new ATOM 0 HB3 LEU A 729 -13.071 -4.370 -7.638 1.00 0.00 H new ATOM 0 HG LEU A 729 -12.596 -5.526 -10.428 1.00 0.00 H new ATOM 0 HD11 LEU A 729 -14.080 -3.685 -11.174 1.00 0.00 H new ATOM 0 HD12 LEU A 729 -14.933 -4.784 -10.064 1.00 0.00 H new ATOM 0 HD13 LEU A 729 -14.342 -3.210 -9.479 1.00 0.00 H new ATOM 0 HD21 LEU A 729 -11.637 -3.280 -10.897 1.00 0.00 H new ATOM 0 HD22 LEU A 729 -11.905 -2.814 -9.201 1.00 0.00 H new ATOM 0 HD23 LEU A 729 -10.738 -4.098 -9.598 1.00 0.00 H new ATOM 1595 N ASP A 730 -12.777 -6.970 -6.167 1.00 0.00 N ATOM 1596 CA ASP A 730 -12.980 -7.527 -4.833 1.00 0.00 C ATOM 1597 C ASP A 730 -12.657 -6.495 -3.750 1.00 0.00 C ATOM 1598 O ASP A 730 -11.802 -6.726 -2.896 1.00 0.00 O ATOM 1599 CB ASP A 730 -12.095 -8.763 -4.645 1.00 0.00 C ATOM 1600 CG ASP A 730 -12.599 -9.911 -5.515 1.00 0.00 C ATOM 1601 OD1 ASP A 730 -13.746 -9.857 -5.928 1.00 0.00 O ATOM 1602 OD2 ASP A 730 -11.832 -10.829 -5.754 1.00 0.00 O ATOM 0 H ASP A 730 -13.585 -7.048 -6.785 1.00 0.00 H new ATOM 0 HA ASP A 730 -14.029 -7.808 -4.739 1.00 0.00 H new ATOM 0 HB2 ASP A 730 -11.064 -8.524 -4.907 1.00 0.00 H new ATOM 0 HB3 ASP A 730 -12.096 -9.064 -3.597 1.00 0.00 H new ATOM 1607 N PRO A 731 -13.331 -5.376 -3.766 1.00 0.00 N ATOM 1608 CA PRO A 731 -13.122 -4.293 -2.760 1.00 0.00 C ATOM 1609 C PRO A 731 -13.489 -4.741 -1.346 1.00 0.00 C ATOM 1610 O PRO A 731 -13.116 -4.097 -0.363 1.00 0.00 O ATOM 1611 CB PRO A 731 -14.038 -3.157 -3.225 1.00 0.00 C ATOM 1612 CG PRO A 731 -15.029 -3.782 -4.152 1.00 0.00 C ATOM 1613 CD PRO A 731 -14.362 -5.021 -4.748 1.00 0.00 C ATOM 0 HA PRO A 731 -12.075 -3.996 -2.704 1.00 0.00 H new ATOM 0 HB2 PRO A 731 -14.538 -2.687 -2.378 1.00 0.00 H new ATOM 0 HB3 PRO A 731 -13.468 -2.378 -3.731 1.00 0.00 H new ATOM 0 HG2 PRO A 731 -15.939 -4.053 -3.618 1.00 0.00 H new ATOM 0 HG3 PRO A 731 -15.317 -3.083 -4.937 1.00 0.00 H new ATOM 0 HD2 PRO A 731 -15.077 -5.832 -4.887 1.00 0.00 H new ATOM 0 HD3 PRO A 731 -13.927 -4.809 -5.725 1.00 0.00 H new ATOM 1621 N GLN A 732 -14.220 -5.847 -1.247 1.00 0.00 N ATOM 1622 CA GLN A 732 -14.623 -6.358 0.056 1.00 0.00 C ATOM 1623 C GLN A 732 -13.419 -6.926 0.797 1.00 0.00 C ATOM 1624 O GLN A 732 -13.326 -6.818 2.020 1.00 0.00 O ATOM 1625 CB GLN A 732 -15.690 -7.444 -0.103 1.00 0.00 C ATOM 1626 CG GLN A 732 -16.971 -6.823 -0.660 1.00 0.00 C ATOM 1627 CD GLN A 732 -18.077 -7.874 -0.716 1.00 0.00 C ATOM 1628 OE1 GLN A 732 -17.816 -9.109 -0.376 1.00 0.00 O flip ATOM 1629 NE2 GLN A 732 -19.211 -7.562 -1.080 1.00 0.00 N flip ATOM 0 H GLN A 732 -14.541 -6.399 -2.042 1.00 0.00 H new ATOM 0 HA GLN A 732 -15.040 -5.533 0.634 1.00 0.00 H new ATOM 0 HB2 GLN A 732 -15.331 -8.226 -0.773 1.00 0.00 H new ATOM 0 HB3 GLN A 732 -15.890 -7.915 0.859 1.00 0.00 H new ATOM 0 HG2 GLN A 732 -17.283 -5.988 -0.033 1.00 0.00 H new ATOM 0 HG3 GLN A 732 -16.787 -6.422 -1.657 1.00 0.00 H new ATOM 0 HE21 GLN A 732 -19.414 -6.598 -1.345 1.00 0.00 H new ATOM 0 HE22 GLN A 732 -19.947 -8.267 -1.116 1.00 0.00 H new ATOM 1638 N LEU A 733 -12.493 -7.524 0.053 1.00 0.00 N ATOM 1639 CA LEU A 733 -11.299 -8.091 0.666 1.00 0.00 C ATOM 1640 C LEU A 733 -10.403 -6.980 1.201 1.00 0.00 C ATOM 1641 O LEU A 733 -9.891 -7.063 2.318 1.00 0.00 O ATOM 1642 CB LEU A 733 -10.526 -8.924 -0.355 1.00 0.00 C ATOM 1643 CG LEU A 733 -9.372 -9.637 0.348 1.00 0.00 C ATOM 1644 CD1 LEU A 733 -9.927 -10.756 1.230 1.00 0.00 C ATOM 1645 CD2 LEU A 733 -8.428 -10.232 -0.698 1.00 0.00 C ATOM 0 H LEU A 733 -12.545 -7.627 -0.960 1.00 0.00 H new ATOM 0 HA LEU A 733 -11.606 -8.732 1.492 1.00 0.00 H new ATOM 0 HB2 LEU A 733 -11.188 -9.652 -0.824 1.00 0.00 H new ATOM 0 HB3 LEU A 733 -10.143 -8.284 -1.150 1.00 0.00 H new ATOM 0 HG LEU A 733 -8.826 -8.924 0.966 1.00 0.00 H new ATOM 0 HD11 LEU A 733 -9.104 -11.265 1.732 1.00 0.00 H new ATOM 0 HD12 LEU A 733 -10.600 -10.332 1.975 1.00 0.00 H new ATOM 0 HD13 LEU A 733 -10.473 -11.469 0.612 1.00 0.00 H new ATOM 0 HD21 LEU A 733 -7.604 -10.741 -0.197 1.00 0.00 H new ATOM 0 HD22 LEU A 733 -8.973 -10.945 -1.316 1.00 0.00 H new ATOM 0 HD23 LEU A 733 -8.033 -9.434 -1.327 1.00 0.00 H new ATOM 1657 N LEU A 734 -10.232 -5.933 0.400 1.00 0.00 N ATOM 1658 CA LEU A 734 -9.411 -4.802 0.807 1.00 0.00 C ATOM 1659 C LEU A 734 -9.880 -4.287 2.160 1.00 0.00 C ATOM 1660 O LEU A 734 -9.075 -4.032 3.060 1.00 0.00 O ATOM 1661 CB LEU A 734 -9.508 -3.692 -0.244 1.00 0.00 C ATOM 1662 CG LEU A 734 -8.746 -2.456 0.236 1.00 0.00 C ATOM 1663 CD1 LEU A 734 -7.261 -2.788 0.377 1.00 0.00 C ATOM 1664 CD2 LEU A 734 -8.912 -1.329 -0.785 1.00 0.00 C ATOM 0 H LEU A 734 -10.648 -5.846 -0.527 1.00 0.00 H new ATOM 0 HA LEU A 734 -8.372 -5.120 0.892 1.00 0.00 H new ATOM 0 HB2 LEU A 734 -9.096 -4.039 -1.192 1.00 0.00 H new ATOM 0 HB3 LEU A 734 -10.553 -3.439 -0.424 1.00 0.00 H new ATOM 0 HG LEU A 734 -9.142 -2.142 1.202 1.00 0.00 H new ATOM 0 HD11 LEU A 734 -6.722 -1.905 0.719 1.00 0.00 H new ATOM 0 HD12 LEU A 734 -7.135 -3.593 1.101 1.00 0.00 H new ATOM 0 HD13 LEU A 734 -6.865 -3.103 -0.588 1.00 0.00 H new ATOM 0 HD21 LEU A 734 -8.370 -0.447 -0.445 1.00 0.00 H new ATOM 0 HD22 LEU A 734 -8.516 -1.650 -1.748 1.00 0.00 H new ATOM 0 HD23 LEU A 734 -9.969 -1.086 -0.890 1.00 0.00 H new ATOM 1676 N LEU A 735 -11.194 -4.156 2.304 1.00 0.00 N ATOM 1677 CA LEU A 735 -11.763 -3.692 3.559 1.00 0.00 C ATOM 1678 C LEU A 735 -11.441 -4.673 4.677 1.00 0.00 C ATOM 1679 O LEU A 735 -11.126 -4.273 5.798 1.00 0.00 O ATOM 1680 CB LEU A 735 -13.279 -3.546 3.427 1.00 0.00 C ATOM 1681 CG LEU A 735 -13.853 -3.015 4.742 1.00 0.00 C ATOM 1682 CD1 LEU A 735 -13.485 -1.539 4.901 1.00 0.00 C ATOM 1683 CD2 LEU A 735 -15.377 -3.167 4.735 1.00 0.00 C ATOM 0 H LEU A 735 -11.877 -4.362 1.575 1.00 0.00 H new ATOM 0 HA LEU A 735 -11.329 -2.722 3.799 1.00 0.00 H new ATOM 0 HB2 LEU A 735 -13.520 -2.865 2.611 1.00 0.00 H new ATOM 0 HB3 LEU A 735 -13.729 -4.509 3.183 1.00 0.00 H new ATOM 0 HG LEU A 735 -13.438 -3.583 5.574 1.00 0.00 H new ATOM 0 HD11 LEU A 735 -13.894 -1.161 5.838 1.00 0.00 H new ATOM 0 HD12 LEU A 735 -12.400 -1.433 4.910 1.00 0.00 H new ATOM 0 HD13 LEU A 735 -13.898 -0.969 4.069 1.00 0.00 H new ATOM 0 HD21 LEU A 735 -15.785 -2.788 5.672 1.00 0.00 H new ATOM 0 HD22 LEU A 735 -15.795 -2.601 3.903 1.00 0.00 H new ATOM 0 HD23 LEU A 735 -15.637 -4.220 4.625 1.00 0.00 H new ATOM 1695 N THR A 736 -11.516 -5.964 4.362 1.00 0.00 N ATOM 1696 CA THR A 736 -11.225 -6.992 5.350 1.00 0.00 C ATOM 1697 C THR A 736 -9.808 -6.818 5.878 1.00 0.00 C ATOM 1698 O THR A 736 -9.553 -6.989 7.070 1.00 0.00 O ATOM 1699 CB THR A 736 -11.383 -8.386 4.733 1.00 0.00 C ATOM 1700 OG1 THR A 736 -12.689 -8.517 4.185 1.00 0.00 O ATOM 1701 CG2 THR A 736 -11.172 -9.446 5.814 1.00 0.00 C ATOM 0 H THR A 736 -11.773 -6.317 3.440 1.00 0.00 H new ATOM 0 HA THR A 736 -11.930 -6.892 6.175 1.00 0.00 H new ATOM 0 HB THR A 736 -10.645 -8.521 3.943 1.00 0.00 H new ATOM 0 HG1 THR A 736 -12.757 -7.977 3.370 1.00 0.00 H new ATOM 0 HG21 THR A 736 -11.284 -10.438 5.377 1.00 0.00 H new ATOM 0 HG22 THR A 736 -10.171 -9.345 6.232 1.00 0.00 H new ATOM 0 HG23 THR A 736 -11.911 -9.312 6.604 1.00 0.00 H new ATOM 1709 N THR A 737 -8.888 -6.464 4.985 1.00 0.00 N ATOM 1710 CA THR A 737 -7.503 -6.256 5.382 1.00 0.00 C ATOM 1711 C THR A 737 -7.419 -5.138 6.412 1.00 0.00 C ATOM 1712 O THR A 737 -6.652 -5.220 7.373 1.00 0.00 O ATOM 1713 CB THR A 737 -6.649 -5.895 4.163 1.00 0.00 C ATOM 1714 OG1 THR A 737 -6.726 -6.943 3.205 1.00 0.00 O ATOM 1715 CG2 THR A 737 -5.194 -5.700 4.596 1.00 0.00 C ATOM 0 H THR A 737 -9.075 -6.317 3.993 1.00 0.00 H new ATOM 0 HA THR A 737 -7.125 -7.180 5.820 1.00 0.00 H new ATOM 0 HB THR A 737 -7.020 -4.971 3.720 1.00 0.00 H new ATOM 0 HG1 THR A 737 -6.181 -6.713 2.424 1.00 0.00 H new ATOM 0 HG21 THR A 737 -4.587 -5.443 3.728 1.00 0.00 H new ATOM 0 HG22 THR A 737 -5.137 -4.895 5.329 1.00 0.00 H new ATOM 0 HG23 THR A 737 -4.820 -6.622 5.040 1.00 0.00 H new ATOM 1723 N LEU A 738 -8.216 -4.092 6.205 1.00 0.00 N ATOM 1724 CA LEU A 738 -8.224 -2.960 7.126 1.00 0.00 C ATOM 1725 C LEU A 738 -8.705 -3.394 8.509 1.00 0.00 C ATOM 1726 O LEU A 738 -8.152 -2.984 9.528 1.00 0.00 O ATOM 1727 CB LEU A 738 -9.155 -1.860 6.601 1.00 0.00 C ATOM 1728 CG LEU A 738 -8.762 -1.471 5.174 1.00 0.00 C ATOM 1729 CD1 LEU A 738 -9.510 -0.199 4.772 1.00 0.00 C ATOM 1730 CD2 LEU A 738 -7.254 -1.223 5.101 1.00 0.00 C ATOM 0 H LEU A 738 -8.858 -4.005 5.417 1.00 0.00 H new ATOM 0 HA LEU A 738 -7.205 -2.579 7.201 1.00 0.00 H new ATOM 0 HB2 LEU A 738 -10.188 -2.208 6.619 1.00 0.00 H new ATOM 0 HB3 LEU A 738 -9.101 -0.987 7.251 1.00 0.00 H new ATOM 0 HG LEU A 738 -9.024 -2.281 4.493 1.00 0.00 H new ATOM 0 HD11 LEU A 738 -9.232 0.081 3.756 1.00 0.00 H new ATOM 0 HD12 LEU A 738 -10.584 -0.379 4.818 1.00 0.00 H new ATOM 0 HD13 LEU A 738 -9.248 0.609 5.455 1.00 0.00 H new ATOM 0 HD21 LEU A 738 -6.980 -0.946 4.083 1.00 0.00 H new ATOM 0 HD22 LEU A 738 -6.985 -0.415 5.782 1.00 0.00 H new ATOM 0 HD23 LEU A 738 -6.722 -2.130 5.386 1.00 0.00 H new ATOM 1742 N GLN A 739 -9.747 -4.219 8.531 1.00 0.00 N ATOM 1743 CA GLN A 739 -10.314 -4.701 9.788 1.00 0.00 C ATOM 1744 C GLN A 739 -9.328 -5.595 10.532 1.00 0.00 C ATOM 1745 O GLN A 739 -9.363 -5.682 11.759 1.00 0.00 O ATOM 1746 CB GLN A 739 -11.608 -5.466 9.507 1.00 0.00 C ATOM 1747 CG GLN A 739 -12.599 -4.524 8.821 1.00 0.00 C ATOM 1748 CD GLN A 739 -13.936 -5.225 8.604 1.00 0.00 C ATOM 1749 OE1 GLN A 739 -14.085 -6.461 8.991 1.00 0.00 O flip ATOM 1750 NE2 GLN A 739 -14.871 -4.626 8.073 1.00 0.00 N flip ATOM 0 H GLN A 739 -10.216 -4.568 7.695 1.00 0.00 H new ATOM 0 HA GLN A 739 -10.529 -3.840 10.421 1.00 0.00 H new ATOM 0 HB2 GLN A 739 -11.406 -6.329 8.872 1.00 0.00 H new ATOM 0 HB3 GLN A 739 -12.031 -5.847 10.437 1.00 0.00 H new ATOM 0 HG2 GLN A 739 -12.744 -3.632 9.430 1.00 0.00 H new ATOM 0 HG3 GLN A 739 -12.194 -4.194 7.864 1.00 0.00 H new ATOM 0 HE21 GLN A 739 -14.752 -3.659 7.771 1.00 0.00 H new ATOM 0 HE22 GLN A 739 -15.765 -5.097 7.935 1.00 0.00 H new ATOM 1759 N GLY A 740 -8.462 -6.265 9.780 1.00 0.00 N ATOM 1760 CA GLY A 740 -7.475 -7.164 10.373 1.00 0.00 C ATOM 1761 C GLY A 740 -7.202 -6.811 11.832 1.00 0.00 C ATOM 1762 O GLY A 740 -7.168 -7.690 12.691 1.00 0.00 O ATOM 0 H GLY A 740 -8.422 -6.204 8.763 1.00 0.00 H new ATOM 0 HA2 GLY A 740 -7.832 -8.192 10.307 1.00 0.00 H new ATOM 0 HA3 GLY A 740 -6.546 -7.112 9.805 1.00 0.00 H new ATOM 1766 N LEU A 741 -7.014 -5.526 12.113 1.00 0.00 N ATOM 1767 CA LEU A 741 -6.752 -5.096 13.482 1.00 0.00 C ATOM 1768 C LEU A 741 -8.066 -4.863 14.223 1.00 0.00 C ATOM 1769 O LEU A 741 -8.792 -5.810 14.525 1.00 0.00 O ATOM 1770 CB LEU A 741 -5.909 -3.817 13.487 1.00 0.00 C ATOM 1771 CG LEU A 741 -6.334 -2.907 12.335 1.00 0.00 C ATOM 1772 CD1 LEU A 741 -6.253 -1.448 12.786 1.00 0.00 C ATOM 1773 CD2 LEU A 741 -5.398 -3.120 11.143 1.00 0.00 C ATOM 0 H LEU A 741 -7.037 -4.775 11.424 1.00 0.00 H new ATOM 0 HA LEU A 741 -6.196 -5.882 13.992 1.00 0.00 H new ATOM 0 HB2 LEU A 741 -6.030 -3.296 14.437 1.00 0.00 H new ATOM 0 HB3 LEU A 741 -4.852 -4.068 13.393 1.00 0.00 H new ATOM 0 HG LEU A 741 -7.357 -3.145 12.042 1.00 0.00 H new ATOM 0 HD11 LEU A 741 -6.556 -0.796 11.966 1.00 0.00 H new ATOM 0 HD12 LEU A 741 -6.916 -1.293 13.637 1.00 0.00 H new ATOM 0 HD13 LEU A 741 -5.229 -1.213 13.077 1.00 0.00 H new ATOM 0 HD21 LEU A 741 -5.701 -2.471 10.322 1.00 0.00 H new ATOM 0 HD22 LEU A 741 -4.376 -2.881 11.436 1.00 0.00 H new ATOM 0 HD23 LEU A 741 -5.449 -4.160 10.821 1.00 0.00 H new