USER MOD reduce.3.24.130724 H: found=0, std=0, add=868, rem=0, adj=15 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 HE2:sc= -11.1! C(o=-14!,f=-25!) USER MOD Set 1.2: A 696 HIS : no HD1:sc= -2.55! C(o=-14!,f=-22!) USER MOD Single : A 629 HIS : no HD1:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 641 THR OG1 : rot 91:sc= 1.2 USER MOD Single : A 644 CYS SG : rot 78:sc= -0.498 USER MOD Single : A 646 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 648 THR OG1 : rot 70:sc= 0.362! USER MOD Single : A 653 LYS NZ :NH3+ 167:sc= -0.621 (180deg=-1.28) 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 : amide:sc= -2.11! K(o=-2.1!,f=-0.19) USER MOD Single : A 671 GLN : amide:sc= 1.17 K(o=1.2,f=-1.3) USER MOD Single : A 677 MET CE :methyl -131:sc= -0.162 (180deg=-2.43!) USER MOD Single : A 684 GLN : amide:sc= -0.0169 K(o=-0.017,f=-1.8!) USER MOD Single : A 685 SER OG : rot 180:sc= 0 USER MOD Single : A 686 CYS SG : rot -167:sc= 0.075 USER MOD Single : A 691 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 718 THR OG1 : rot 180:sc= -0.0889 USER MOD Single : A 720 GLN : amide:sc=-0.00648 K(o=-0.0065,f=-1.7!) USER MOD Single : A 722 SER OG : rot 80:sc= -1 USER MOD Single : A 726 SER OG : rot 180:sc= 0 USER MOD Single : A 727 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 732 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 736 THR OG1 : rot 72:sc= 0.157 USER MOD Single : A 737 THR OG1 : rot 180:sc= 0 USER MOD Single : A 739 GLN : amide:sc= -1.29! K(o=-1.3!,f=0) USER MOD ----------------------------------------------------------------- ATOM 13 N GLY A 628 -7.175 6.759 10.708 1.00 0.00 N ATOM 14 CA GLY A 628 -7.159 5.697 9.708 1.00 0.00 C ATOM 15 C GLY A 628 -6.791 6.259 8.339 1.00 0.00 C ATOM 16 O GLY A 628 -7.623 6.314 7.433 1.00 0.00 O ATOM 0 HA2 GLY A 628 -6.442 4.928 9.997 1.00 0.00 H new ATOM 0 HA3 GLY A 628 -8.137 5.219 9.661 1.00 0.00 H new ATOM 20 N HIS A 629 -5.541 6.684 8.201 1.00 0.00 N ATOM 21 CA HIS A 629 -5.069 7.250 6.944 1.00 0.00 C ATOM 22 C HIS A 629 -4.506 6.156 6.043 1.00 0.00 C ATOM 23 O HIS A 629 -3.772 5.279 6.500 1.00 0.00 O ATOM 24 CB HIS A 629 -3.990 8.295 7.230 1.00 0.00 C ATOM 25 CG HIS A 629 -4.582 9.400 8.061 1.00 0.00 C ATOM 26 ND1 HIS A 629 -4.592 9.361 9.447 1.00 0.00 N ATOM 27 CD2 HIS A 629 -5.189 10.581 7.715 1.00 0.00 C ATOM 28 CE1 HIS A 629 -5.188 10.487 9.880 1.00 0.00 C ATOM 29 NE2 HIS A 629 -5.574 11.264 8.865 1.00 0.00 N ATOM 0 H HIS A 629 -4.839 6.648 8.940 1.00 0.00 H new ATOM 0 HA HIS A 629 -5.907 7.722 6.432 1.00 0.00 H new ATOM 0 HB2 HIS A 629 -3.153 7.836 7.756 1.00 0.00 H new ATOM 0 HB3 HIS A 629 -3.598 8.696 6.295 1.00 0.00 H new ATOM 0 HD2 HIS A 629 -5.344 10.928 6.704 1.00 0.00 H new ATOM 0 HE1 HIS A 629 -5.336 10.732 10.921 1.00 0.00 H new ATOM 0 HE2 HIS A 629 -6.049 12.165 8.921 1.00 0.00 H new ATOM 38 N ILE A 630 -4.861 6.211 4.762 1.00 0.00 N ATOM 39 CA ILE A 630 -4.392 5.214 3.805 1.00 0.00 C ATOM 40 C ILE A 630 -3.432 5.843 2.799 1.00 0.00 C ATOM 41 O ILE A 630 -3.696 6.921 2.269 1.00 0.00 O ATOM 42 CB ILE A 630 -5.584 4.614 3.058 1.00 0.00 C ATOM 43 CG1 ILE A 630 -6.619 4.103 4.065 1.00 0.00 C ATOM 44 CG2 ILE A 630 -5.108 3.452 2.183 1.00 0.00 C ATOM 45 CD1 ILE A 630 -5.924 3.258 5.133 1.00 0.00 C ATOM 0 H ILE A 630 -5.467 6.929 4.365 1.00 0.00 H new ATOM 0 HA ILE A 630 -3.867 4.431 4.353 1.00 0.00 H new ATOM 0 HB ILE A 630 -6.038 5.380 2.430 1.00 0.00 H new ATOM 0 HG12 ILE A 630 -7.134 4.944 4.530 1.00 0.00 H new ATOM 0 HG13 ILE A 630 -7.376 3.509 3.553 1.00 0.00 H new ATOM 0 HG21 ILE A 630 -5.958 3.025 1.651 1.00 0.00 H new ATOM 0 HG22 ILE A 630 -4.375 3.815 1.463 1.00 0.00 H new ATOM 0 HG23 ILE A 630 -4.652 2.687 2.811 1.00 0.00 H new ATOM 0 HD11 ILE A 630 -6.663 2.896 5.848 1.00 0.00 H new ATOM 0 HD12 ILE A 630 -5.430 2.409 4.661 1.00 0.00 H new ATOM 0 HD13 ILE A 630 -5.183 3.866 5.653 1.00 0.00 H new ATOM 57 N LEU A 631 -2.319 5.163 2.537 1.00 0.00 N ATOM 58 CA LEU A 631 -1.334 5.673 1.586 1.00 0.00 C ATOM 59 C LEU A 631 -1.246 4.768 0.362 1.00 0.00 C ATOM 60 O LEU A 631 -1.223 3.544 0.488 1.00 0.00 O ATOM 61 CB LEU A 631 0.037 5.772 2.255 1.00 0.00 C ATOM 62 CG LEU A 631 1.055 6.320 1.254 1.00 0.00 C ATOM 63 CD1 LEU A 631 0.690 7.761 0.889 1.00 0.00 C ATOM 64 CD2 LEU A 631 2.450 6.288 1.884 1.00 0.00 C ATOM 0 H LEU A 631 -2.078 4.268 2.963 1.00 0.00 H new ATOM 0 HA LEU A 631 -1.651 6.665 1.263 1.00 0.00 H new ATOM 0 HB2 LEU A 631 -0.018 6.424 3.127 1.00 0.00 H new ATOM 0 HB3 LEU A 631 0.352 4.791 2.610 1.00 0.00 H new ATOM 0 HG LEU A 631 1.047 5.708 0.352 1.00 0.00 H new ATOM 0 HD11 LEU A 631 1.416 8.151 0.176 1.00 0.00 H new ATOM 0 HD12 LEU A 631 -0.304 7.783 0.443 1.00 0.00 H new ATOM 0 HD13 LEU A 631 0.698 8.377 1.788 1.00 0.00 H new ATOM 0 HD21 LEU A 631 3.179 6.678 1.174 1.00 0.00 H new ATOM 0 HD22 LEU A 631 2.457 6.902 2.785 1.00 0.00 H new ATOM 0 HD23 LEU A 631 2.709 5.261 2.143 1.00 0.00 H new ATOM 76 N LEU A 632 -1.202 5.371 -0.826 1.00 0.00 N ATOM 77 CA LEU A 632 -1.122 4.584 -2.052 1.00 0.00 C ATOM 78 C LEU A 632 -0.069 5.126 -3.012 1.00 0.00 C ATOM 79 O LEU A 632 -0.108 6.292 -3.403 1.00 0.00 O ATOM 80 CB LEU A 632 -2.476 4.569 -2.761 1.00 0.00 C ATOM 81 CG LEU A 632 -2.419 3.595 -3.940 1.00 0.00 C ATOM 82 CD1 LEU A 632 -3.838 3.293 -4.421 1.00 0.00 C ATOM 83 CD2 LEU A 632 -1.609 4.215 -5.085 1.00 0.00 C ATOM 0 H LEU A 632 -1.220 6.382 -0.963 1.00 0.00 H new ATOM 0 HA LEU A 632 -0.836 3.573 -1.763 1.00 0.00 H new ATOM 0 HB2 LEU A 632 -3.260 4.270 -2.065 1.00 0.00 H new ATOM 0 HB3 LEU A 632 -2.726 5.570 -3.113 1.00 0.00 H new ATOM 0 HG LEU A 632 -1.939 2.670 -3.621 1.00 0.00 H new ATOM 0 HD11 LEU A 632 -3.798 2.599 -5.261 1.00 0.00 H new ATOM 0 HD12 LEU A 632 -4.410 2.846 -3.608 1.00 0.00 H new ATOM 0 HD13 LEU A 632 -4.320 4.218 -4.738 1.00 0.00 H new ATOM 0 HD21 LEU A 632 -1.571 3.518 -5.922 1.00 0.00 H new ATOM 0 HD22 LEU A 632 -2.083 5.142 -5.406 1.00 0.00 H new ATOM 0 HD23 LEU A 632 -0.596 4.426 -4.742 1.00 0.00 H new ATOM 95 N LEU A 633 0.854 4.255 -3.411 1.00 0.00 N ATOM 96 CA LEU A 633 1.898 4.634 -4.354 1.00 0.00 C ATOM 97 C LEU A 633 1.789 3.781 -5.614 1.00 0.00 C ATOM 98 O LEU A 633 1.737 2.553 -5.538 1.00 0.00 O ATOM 99 CB LEU A 633 3.280 4.457 -3.724 1.00 0.00 C ATOM 100 CG LEU A 633 4.339 5.055 -4.650 1.00 0.00 C ATOM 101 CD1 LEU A 633 5.481 5.630 -3.812 1.00 0.00 C ATOM 102 CD2 LEU A 633 4.888 3.964 -5.573 1.00 0.00 C ATOM 0 H LEU A 633 0.899 3.286 -3.096 1.00 0.00 H new ATOM 0 HA LEU A 633 1.768 5.684 -4.616 1.00 0.00 H new ATOM 0 HB2 LEU A 633 3.314 4.946 -2.751 1.00 0.00 H new ATOM 0 HB3 LEU A 633 3.483 3.399 -3.556 1.00 0.00 H new ATOM 0 HG LEU A 633 3.890 5.847 -5.250 1.00 0.00 H new ATOM 0 HD11 LEU A 633 6.237 6.057 -4.471 1.00 0.00 H new ATOM 0 HD12 LEU A 633 5.093 6.407 -3.153 1.00 0.00 H new ATOM 0 HD13 LEU A 633 5.928 4.837 -3.213 1.00 0.00 H new ATOM 0 HD21 LEU A 633 5.643 4.392 -6.233 1.00 0.00 H new ATOM 0 HD22 LEU A 633 5.337 3.172 -4.973 1.00 0.00 H new ATOM 0 HD23 LEU A 633 4.076 3.551 -6.171 1.00 0.00 H new ATOM 114 N GLU A 634 1.743 4.433 -6.771 1.00 0.00 N ATOM 115 CA GLU A 634 1.628 3.707 -8.031 1.00 0.00 C ATOM 116 C GLU A 634 2.101 4.564 -9.202 1.00 0.00 C ATOM 117 O GLU A 634 2.367 5.755 -9.048 1.00 0.00 O ATOM 118 CB GLU A 634 0.173 3.267 -8.247 1.00 0.00 C ATOM 119 CG GLU A 634 -0.535 4.226 -9.209 1.00 0.00 C ATOM 120 CD GLU A 634 -0.356 5.664 -8.736 1.00 0.00 C ATOM 121 OE1 GLU A 634 -0.676 5.934 -7.591 1.00 0.00 O ATOM 122 OE2 GLU A 634 0.101 6.474 -9.527 1.00 0.00 O ATOM 0 H GLU A 634 1.783 5.448 -6.863 1.00 0.00 H new ATOM 0 HA GLU A 634 2.266 2.825 -7.981 1.00 0.00 H new ATOM 0 HB2 GLU A 634 0.148 2.254 -8.649 1.00 0.00 H new ATOM 0 HB3 GLU A 634 -0.353 3.245 -7.292 1.00 0.00 H new ATOM 0 HG2 GLU A 634 -0.129 4.112 -10.214 1.00 0.00 H new ATOM 0 HG3 GLU A 634 -1.596 3.982 -9.264 1.00 0.00 H new ATOM 129 N GLU A 635 2.203 3.943 -10.372 1.00 0.00 N ATOM 130 CA GLU A 635 2.644 4.649 -11.567 1.00 0.00 C ATOM 131 C GLU A 635 1.469 4.872 -12.513 1.00 0.00 C ATOM 132 O GLU A 635 0.425 4.234 -12.379 1.00 0.00 O ATOM 133 CB GLU A 635 3.731 3.843 -12.281 1.00 0.00 C ATOM 134 CG GLU A 635 4.917 3.630 -11.337 1.00 0.00 C ATOM 135 CD GLU A 635 5.503 4.974 -10.920 1.00 0.00 C ATOM 136 OE1 GLU A 635 5.209 5.958 -11.578 1.00 0.00 O ATOM 137 OE2 GLU A 635 6.238 5.000 -9.946 1.00 0.00 O ATOM 0 H GLU A 635 1.987 2.957 -10.517 1.00 0.00 H new ATOM 0 HA GLU A 635 3.050 5.616 -11.269 1.00 0.00 H new ATOM 0 HB2 GLU A 635 3.332 2.881 -12.603 1.00 0.00 H new ATOM 0 HB3 GLU A 635 4.057 4.369 -13.178 1.00 0.00 H new ATOM 0 HG2 GLU A 635 4.595 3.076 -10.455 1.00 0.00 H new ATOM 0 HG3 GLU A 635 5.681 3.029 -11.830 1.00 0.00 H new ATOM 144 N GLU A 636 1.644 5.787 -13.460 1.00 0.00 N ATOM 145 CA GLU A 636 0.590 6.097 -14.420 1.00 0.00 C ATOM 146 C GLU A 636 -0.593 6.753 -13.717 1.00 0.00 C ATOM 147 O GLU A 636 -1.209 6.160 -12.831 1.00 0.00 O ATOM 148 CB GLU A 636 0.126 4.822 -15.130 1.00 0.00 C ATOM 149 CG GLU A 636 -0.864 5.188 -16.239 1.00 0.00 C ATOM 150 CD GLU A 636 -1.417 3.920 -16.880 1.00 0.00 C ATOM 151 OE1 GLU A 636 -1.009 2.847 -16.468 1.00 0.00 O ATOM 152 OE2 GLU A 636 -2.243 4.041 -17.770 1.00 0.00 O ATOM 0 H GLU A 636 2.502 6.325 -13.584 1.00 0.00 H new ATOM 0 HA GLU A 636 0.992 6.790 -15.159 1.00 0.00 H new ATOM 0 HB2 GLU A 636 0.982 4.295 -15.551 1.00 0.00 H new ATOM 0 HB3 GLU A 636 -0.345 4.146 -14.416 1.00 0.00 H new ATOM 0 HG2 GLU A 636 -1.679 5.784 -15.829 1.00 0.00 H new ATOM 0 HG3 GLU A 636 -0.369 5.801 -16.992 1.00 0.00 H new ATOM 159 N ASP A 637 -0.898 7.982 -14.114 1.00 0.00 N ATOM 160 CA ASP A 637 -2.004 8.721 -13.515 1.00 0.00 C ATOM 161 C ASP A 637 -3.320 7.964 -13.668 1.00 0.00 C ATOM 162 O ASP A 637 -4.166 7.988 -12.774 1.00 0.00 O ATOM 163 CB ASP A 637 -2.132 10.092 -14.178 1.00 0.00 C ATOM 164 CG ASP A 637 -0.920 10.953 -13.840 1.00 0.00 C ATOM 165 OD1 ASP A 637 -0.102 10.506 -13.052 1.00 0.00 O ATOM 166 OD2 ASP A 637 -0.824 12.043 -14.377 1.00 0.00 O ATOM 0 H ASP A 637 -0.398 8.487 -14.845 1.00 0.00 H new ATOM 0 HA ASP A 637 -1.792 8.840 -12.452 1.00 0.00 H new ATOM 0 HB2 ASP A 637 -2.215 9.976 -15.259 1.00 0.00 H new ATOM 0 HB3 ASP A 637 -3.043 10.585 -13.839 1.00 0.00 H new ATOM 171 N GLU A 638 -3.496 7.307 -14.810 1.00 0.00 N ATOM 172 CA GLU A 638 -4.725 6.565 -15.065 1.00 0.00 C ATOM 173 C GLU A 638 -4.872 5.395 -14.094 1.00 0.00 C ATOM 174 O GLU A 638 -5.963 5.136 -13.586 1.00 0.00 O ATOM 175 CB GLU A 638 -4.727 6.038 -16.500 1.00 0.00 C ATOM 176 CG GLU A 638 -6.094 5.431 -16.813 1.00 0.00 C ATOM 177 CD GLU A 638 -6.078 4.794 -18.198 1.00 0.00 C ATOM 178 OE1 GLU A 638 -5.026 4.790 -18.816 1.00 0.00 O ATOM 179 OE2 GLU A 638 -7.119 4.318 -18.620 1.00 0.00 O ATOM 0 H GLU A 638 -2.812 7.273 -15.566 1.00 0.00 H new ATOM 0 HA GLU A 638 -5.566 7.244 -14.920 1.00 0.00 H new ATOM 0 HB2 GLU A 638 -4.507 6.847 -17.197 1.00 0.00 H new ATOM 0 HB3 GLU A 638 -3.946 5.288 -16.625 1.00 0.00 H new ATOM 0 HG2 GLU A 638 -6.349 4.683 -16.063 1.00 0.00 H new ATOM 0 HG3 GLU A 638 -6.863 6.203 -16.768 1.00 0.00 H new ATOM 186 N ALA A 639 -3.775 4.689 -13.837 1.00 0.00 N ATOM 187 CA ALA A 639 -3.814 3.551 -12.923 1.00 0.00 C ATOM 188 C ALA A 639 -4.133 4.016 -11.507 1.00 0.00 C ATOM 189 O ALA A 639 -4.877 3.359 -10.778 1.00 0.00 O ATOM 190 CB ALA A 639 -2.469 2.820 -12.932 1.00 0.00 C ATOM 0 H ALA A 639 -2.859 4.881 -14.242 1.00 0.00 H new ATOM 0 HA ALA A 639 -4.596 2.869 -13.257 1.00 0.00 H new ATOM 0 HB1 ALA A 639 -2.510 1.973 -12.247 1.00 0.00 H new ATOM 0 HB2 ALA A 639 -2.256 2.461 -13.939 1.00 0.00 H new ATOM 0 HB3 ALA A 639 -1.681 3.504 -12.617 1.00 0.00 H new ATOM 196 N ALA A 640 -3.566 5.154 -11.126 1.00 0.00 N ATOM 197 CA ALA A 640 -3.795 5.702 -9.795 1.00 0.00 C ATOM 198 C ALA A 640 -5.248 6.134 -9.632 1.00 0.00 C ATOM 199 O ALA A 640 -5.849 5.944 -8.574 1.00 0.00 O ATOM 200 CB ALA A 640 -2.877 6.904 -9.561 1.00 0.00 C ATOM 0 H ALA A 640 -2.948 5.712 -11.715 1.00 0.00 H new ATOM 0 HA ALA A 640 -3.575 4.925 -9.062 1.00 0.00 H new ATOM 0 HB1 ALA A 640 -3.054 7.308 -8.564 1.00 0.00 H new ATOM 0 HB2 ALA A 640 -1.837 6.589 -9.646 1.00 0.00 H new ATOM 0 HB3 ALA A 640 -3.086 7.672 -10.306 1.00 0.00 H new ATOM 206 N THR A 641 -5.806 6.721 -10.685 1.00 0.00 N ATOM 207 CA THR A 641 -7.188 7.183 -10.645 1.00 0.00 C ATOM 208 C THR A 641 -8.148 6.018 -10.421 1.00 0.00 C ATOM 209 O THR A 641 -9.047 6.096 -9.583 1.00 0.00 O ATOM 210 CB THR A 641 -7.534 7.885 -11.961 1.00 0.00 C ATOM 211 OG1 THR A 641 -6.608 8.939 -12.186 1.00 0.00 O ATOM 212 CG2 THR A 641 -8.951 8.455 -11.887 1.00 0.00 C ATOM 0 H THR A 641 -5.327 6.887 -11.570 1.00 0.00 H new ATOM 0 HA THR A 641 -7.292 7.881 -9.814 1.00 0.00 H new ATOM 0 HB THR A 641 -7.480 7.168 -12.780 1.00 0.00 H new ATOM 0 HG1 THR A 641 -5.850 8.602 -12.707 1.00 0.00 H new ATOM 0 HG21 THR A 641 -9.192 8.953 -12.826 1.00 0.00 H new ATOM 0 HG22 THR A 641 -9.660 7.646 -11.713 1.00 0.00 H new ATOM 0 HG23 THR A 641 -9.012 9.173 -11.069 1.00 0.00 H new ATOM 220 N VAL A 642 -7.955 4.940 -11.174 1.00 0.00 N ATOM 221 CA VAL A 642 -8.816 3.770 -11.046 1.00 0.00 C ATOM 222 C VAL A 642 -8.806 3.236 -9.615 1.00 0.00 C ATOM 223 O VAL A 642 -9.857 3.057 -8.995 1.00 0.00 O ATOM 224 CB VAL A 642 -8.339 2.673 -11.998 1.00 0.00 C ATOM 225 CG1 VAL A 642 -9.081 1.372 -11.696 1.00 0.00 C ATOM 226 CG2 VAL A 642 -8.622 3.090 -13.442 1.00 0.00 C ATOM 0 H VAL A 642 -7.217 4.852 -11.873 1.00 0.00 H new ATOM 0 HA VAL A 642 -9.834 4.067 -11.299 1.00 0.00 H new ATOM 0 HB VAL A 642 -7.268 2.522 -11.863 1.00 0.00 H new ATOM 0 HG11 VAL A 642 -8.739 0.592 -12.376 1.00 0.00 H new ATOM 0 HG12 VAL A 642 -8.882 1.070 -10.668 1.00 0.00 H new ATOM 0 HG13 VAL A 642 -10.152 1.525 -11.828 1.00 0.00 H new ATOM 0 HG21 VAL A 642 -8.282 2.307 -14.120 1.00 0.00 H new ATOM 0 HG22 VAL A 642 -9.693 3.243 -13.573 1.00 0.00 H new ATOM 0 HG23 VAL A 642 -8.093 4.017 -13.663 1.00 0.00 H new ATOM 236 N VAL A 643 -7.610 2.975 -9.100 1.00 0.00 N ATOM 237 CA VAL A 643 -7.472 2.453 -7.747 1.00 0.00 C ATOM 238 C VAL A 643 -8.054 3.425 -6.727 1.00 0.00 C ATOM 239 O VAL A 643 -8.749 3.017 -5.796 1.00 0.00 O ATOM 240 CB VAL A 643 -6.001 2.184 -7.436 1.00 0.00 C ATOM 241 CG1 VAL A 643 -5.878 1.607 -6.025 1.00 0.00 C ATOM 242 CG2 VAL A 643 -5.450 1.179 -8.451 1.00 0.00 C ATOM 0 H VAL A 643 -6.729 3.115 -9.595 1.00 0.00 H new ATOM 0 HA VAL A 643 -8.027 1.517 -7.683 1.00 0.00 H new ATOM 0 HB VAL A 643 -5.435 3.113 -7.497 1.00 0.00 H new ATOM 0 HG11 VAL A 643 -4.829 1.414 -5.801 1.00 0.00 H new ATOM 0 HG12 VAL A 643 -6.278 2.320 -5.304 1.00 0.00 H new ATOM 0 HG13 VAL A 643 -6.439 0.675 -5.963 1.00 0.00 H new ATOM 0 HG21 VAL A 643 -4.400 0.982 -8.235 1.00 0.00 H new ATOM 0 HG22 VAL A 643 -6.014 0.249 -8.385 1.00 0.00 H new ATOM 0 HG23 VAL A 643 -5.543 1.589 -9.457 1.00 0.00 H new ATOM 252 N CYS A 644 -7.775 4.712 -6.910 1.00 0.00 N ATOM 253 CA CYS A 644 -8.288 5.726 -5.995 1.00 0.00 C ATOM 254 C CYS A 644 -9.807 5.644 -5.932 1.00 0.00 C ATOM 255 O CYS A 644 -10.408 5.829 -4.873 1.00 0.00 O ATOM 256 CB CYS A 644 -7.865 7.121 -6.461 1.00 0.00 C ATOM 257 SG CYS A 644 -6.061 7.254 -6.407 1.00 0.00 S ATOM 0 H CYS A 644 -7.204 5.074 -7.673 1.00 0.00 H new ATOM 0 HA CYS A 644 -7.876 5.545 -5.002 1.00 0.00 H new ATOM 0 HB2 CYS A 644 -8.223 7.302 -7.474 1.00 0.00 H new ATOM 0 HB3 CYS A 644 -8.316 7.881 -5.823 1.00 0.00 H new ATOM 0 HG CYS A 644 -5.550 6.650 -7.439 1.00 0.00 H new ATOM 263 N GLU A 645 -10.419 5.352 -7.073 1.00 0.00 N ATOM 264 CA GLU A 645 -11.868 5.231 -7.140 1.00 0.00 C ATOM 265 C GLU A 645 -12.344 4.092 -6.251 1.00 0.00 C ATOM 266 O GLU A 645 -13.369 4.203 -5.579 1.00 0.00 O ATOM 267 CB GLU A 645 -12.302 4.959 -8.581 1.00 0.00 C ATOM 268 CG GLU A 645 -13.828 4.900 -8.652 1.00 0.00 C ATOM 269 CD GLU A 645 -14.267 4.498 -10.055 1.00 0.00 C ATOM 270 OE1 GLU A 645 -13.400 4.244 -10.874 1.00 0.00 O ATOM 271 OE2 GLU A 645 -15.463 4.448 -10.288 1.00 0.00 O ATOM 0 H GLU A 645 -9.937 5.196 -7.959 1.00 0.00 H new ATOM 0 HA GLU A 645 -12.310 6.166 -6.794 1.00 0.00 H new ATOM 0 HB2 GLU A 645 -11.927 5.743 -9.239 1.00 0.00 H new ATOM 0 HB3 GLU A 645 -11.875 4.019 -8.929 1.00 0.00 H new ATOM 0 HG2 GLU A 645 -14.207 4.183 -7.924 1.00 0.00 H new ATOM 0 HG3 GLU A 645 -14.251 5.871 -8.394 1.00 0.00 H new ATOM 278 N MET A 646 -11.597 2.992 -6.254 1.00 0.00 N ATOM 279 CA MET A 646 -11.965 1.839 -5.441 1.00 0.00 C ATOM 280 C MET A 646 -11.882 2.171 -3.953 1.00 0.00 C ATOM 281 O MET A 646 -12.829 1.930 -3.203 1.00 0.00 O ATOM 282 CB MET A 646 -11.044 0.661 -5.761 1.00 0.00 C ATOM 283 CG MET A 646 -11.276 0.216 -7.206 1.00 0.00 C ATOM 284 SD MET A 646 -13.011 -0.259 -7.421 1.00 0.00 S ATOM 285 CE MET A 646 -13.224 0.407 -9.090 1.00 0.00 C ATOM 0 H MET A 646 -10.745 2.875 -6.802 1.00 0.00 H new ATOM 0 HA MET A 646 -12.995 1.570 -5.676 1.00 0.00 H new ATOM 0 HB2 MET A 646 -10.003 0.950 -5.620 1.00 0.00 H new ATOM 0 HB3 MET A 646 -11.241 -0.165 -5.078 1.00 0.00 H new ATOM 0 HG2 MET A 646 -11.021 1.024 -7.892 1.00 0.00 H new ATOM 0 HG3 MET A 646 -10.625 -0.624 -7.448 1.00 0.00 H new ATOM 0 HE1 MET A 646 -14.243 0.221 -9.428 1.00 0.00 H new ATOM 0 HE2 MET A 646 -13.035 1.480 -9.080 1.00 0.00 H new ATOM 0 HE3 MET A 646 -12.522 -0.079 -9.768 1.00 0.00 H new ATOM 295 N LEU A 647 -10.755 2.738 -3.528 1.00 0.00 N ATOM 296 CA LEU A 647 -10.589 3.104 -2.124 1.00 0.00 C ATOM 297 C LEU A 647 -11.484 4.287 -1.773 1.00 0.00 C ATOM 298 O LEU A 647 -12.165 4.279 -0.747 1.00 0.00 O ATOM 299 CB LEU A 647 -9.128 3.452 -1.834 1.00 0.00 C ATOM 300 CG LEU A 647 -8.315 2.163 -1.713 1.00 0.00 C ATOM 301 CD1 LEU A 647 -8.308 1.434 -3.058 1.00 0.00 C ATOM 302 CD2 LEU A 647 -6.879 2.504 -1.309 1.00 0.00 C ATOM 0 H LEU A 647 -9.956 2.951 -4.124 1.00 0.00 H new ATOM 0 HA LEU A 647 -10.877 2.251 -1.510 1.00 0.00 H new ATOM 0 HB2 LEU A 647 -8.726 4.076 -2.632 1.00 0.00 H new ATOM 0 HB3 LEU A 647 -9.056 4.029 -0.912 1.00 0.00 H new ATOM 0 HG LEU A 647 -8.764 1.520 -0.956 1.00 0.00 H new ATOM 0 HD11 LEU A 647 -7.728 0.515 -2.971 1.00 0.00 H new ATOM 0 HD12 LEU A 647 -9.331 1.192 -3.346 1.00 0.00 H new ATOM 0 HD13 LEU A 647 -7.860 2.075 -3.817 1.00 0.00 H new ATOM 0 HD21 LEU A 647 -6.298 1.586 -1.222 1.00 0.00 H new ATOM 0 HD22 LEU A 647 -6.431 3.147 -2.066 1.00 0.00 H new ATOM 0 HD23 LEU A 647 -6.884 3.022 -0.350 1.00 0.00 H new ATOM 314 N THR A 648 -11.488 5.299 -2.637 1.00 0.00 N ATOM 315 CA THR A 648 -12.321 6.473 -2.407 1.00 0.00 C ATOM 316 C THR A 648 -13.778 6.055 -2.238 1.00 0.00 C ATOM 317 O THR A 648 -14.482 6.549 -1.357 1.00 0.00 O ATOM 318 CB THR A 648 -12.194 7.443 -3.583 1.00 0.00 C ATOM 319 OG1 THR A 648 -10.824 7.759 -3.790 1.00 0.00 O ATOM 320 CG2 THR A 648 -12.977 8.722 -3.281 1.00 0.00 C ATOM 0 H THR A 648 -10.931 5.330 -3.491 1.00 0.00 H new ATOM 0 HA THR A 648 -11.985 6.970 -1.497 1.00 0.00 H new ATOM 0 HB THR A 648 -12.598 6.978 -4.482 1.00 0.00 H new ATOM 0 HG1 THR A 648 -10.357 6.973 -4.142 1.00 0.00 H new ATOM 0 HG21 THR A 648 -12.885 9.412 -4.120 1.00 0.00 H new ATOM 0 HG22 THR A 648 -14.028 8.477 -3.126 1.00 0.00 H new ATOM 0 HG23 THR A 648 -12.577 9.190 -2.381 1.00 0.00 H new ATOM 328 N ALA A 649 -14.218 5.134 -3.090 1.00 0.00 N ATOM 329 CA ALA A 649 -15.589 4.638 -3.033 1.00 0.00 C ATOM 330 C ALA A 649 -15.808 3.811 -1.770 1.00 0.00 C ATOM 331 O ALA A 649 -16.931 3.691 -1.282 1.00 0.00 O ATOM 332 CB ALA A 649 -15.884 3.777 -4.263 1.00 0.00 C ATOM 0 H ALA A 649 -13.647 4.717 -3.826 1.00 0.00 H new ATOM 0 HA ALA A 649 -16.264 5.494 -3.016 1.00 0.00 H new ATOM 0 HB1 ALA A 649 -16.909 3.410 -4.213 1.00 0.00 H new ATOM 0 HB2 ALA A 649 -15.756 4.375 -5.165 1.00 0.00 H new ATOM 0 HB3 ALA A 649 -15.197 2.931 -4.288 1.00 0.00 H new ATOM 338 N ALA A 650 -14.728 3.231 -1.253 1.00 0.00 N ATOM 339 CA ALA A 650 -14.819 2.404 -0.054 1.00 0.00 C ATOM 340 C ALA A 650 -15.083 3.256 1.185 1.00 0.00 C ATOM 341 O ALA A 650 -15.408 2.731 2.250 1.00 0.00 O ATOM 342 CB ALA A 650 -13.520 1.616 0.133 1.00 0.00 C ATOM 0 H ALA A 650 -13.789 3.317 -1.641 1.00 0.00 H new ATOM 0 HA ALA A 650 -15.653 1.714 -0.181 1.00 0.00 H new ATOM 0 HB1 ALA A 650 -13.594 1.000 1.030 1.00 0.00 H new ATOM 0 HB2 ALA A 650 -13.355 0.976 -0.734 1.00 0.00 H new ATOM 0 HB3 ALA A 650 -12.685 2.309 0.237 1.00 0.00 H new ATOM 348 N GLY A 651 -14.956 4.570 1.038 1.00 0.00 N ATOM 349 CA GLY A 651 -15.198 5.480 2.154 1.00 0.00 C ATOM 350 C GLY A 651 -13.901 5.837 2.876 1.00 0.00 C ATOM 351 O GLY A 651 -13.900 6.651 3.799 1.00 0.00 O ATOM 0 H GLY A 651 -14.689 5.027 0.166 1.00 0.00 H new ATOM 0 HA2 GLY A 651 -15.673 6.389 1.787 1.00 0.00 H new ATOM 0 HA3 GLY A 651 -15.892 5.019 2.857 1.00 0.00 H new ATOM 355 N PHE A 652 -12.801 5.227 2.451 1.00 0.00 N ATOM 356 CA PHE A 652 -11.506 5.495 3.066 1.00 0.00 C ATOM 357 C PHE A 652 -10.755 6.568 2.290 1.00 0.00 C ATOM 358 O PHE A 652 -10.906 6.689 1.074 1.00 0.00 O ATOM 359 CB PHE A 652 -10.667 4.219 3.106 1.00 0.00 C ATOM 360 CG PHE A 652 -11.285 3.236 4.069 1.00 0.00 C ATOM 361 CD1 PHE A 652 -11.045 3.357 5.444 1.00 0.00 C ATOM 362 CD2 PHE A 652 -12.095 2.200 3.589 1.00 0.00 C ATOM 363 CE1 PHE A 652 -11.614 2.442 6.337 1.00 0.00 C ATOM 364 CE2 PHE A 652 -12.663 1.284 4.484 1.00 0.00 C ATOM 365 CZ PHE A 652 -12.422 1.406 5.857 1.00 0.00 C ATOM 0 H PHE A 652 -12.779 4.549 1.689 1.00 0.00 H new ATOM 0 HA PHE A 652 -11.680 5.848 4.083 1.00 0.00 H new ATOM 0 HB2 PHE A 652 -10.608 3.780 2.110 1.00 0.00 H new ATOM 0 HB3 PHE A 652 -9.647 4.452 3.413 1.00 0.00 H new ATOM 0 HD1 PHE A 652 -10.421 4.157 5.815 1.00 0.00 H new ATOM 0 HD2 PHE A 652 -12.282 2.107 2.529 1.00 0.00 H new ATOM 0 HE1 PHE A 652 -11.429 2.536 7.397 1.00 0.00 H new ATOM 0 HE2 PHE A 652 -13.287 0.484 4.114 1.00 0.00 H new ATOM 0 HZ PHE A 652 -12.860 0.700 6.547 1.00 0.00 H new ATOM 375 N LYS A 653 -9.939 7.341 2.997 1.00 0.00 N ATOM 376 CA LYS A 653 -9.165 8.395 2.356 1.00 0.00 C ATOM 377 C LYS A 653 -7.785 7.871 1.975 1.00 0.00 C ATOM 378 O LYS A 653 -7.073 7.300 2.804 1.00 0.00 O ATOM 379 CB LYS A 653 -9.023 9.590 3.299 1.00 0.00 C ATOM 380 CG LYS A 653 -10.405 10.187 3.568 1.00 0.00 C ATOM 381 CD LYS A 653 -10.264 11.437 4.438 1.00 0.00 C ATOM 382 CE LYS A 653 -11.652 11.973 4.790 1.00 0.00 C ATOM 383 NZ LYS A 653 -12.621 10.843 4.860 1.00 0.00 N ATOM 0 H LYS A 653 -9.797 7.259 4.004 1.00 0.00 H new ATOM 0 HA LYS A 653 -9.687 8.715 1.454 1.00 0.00 H new ATOM 0 HB2 LYS A 653 -8.561 9.277 4.235 1.00 0.00 H new ATOM 0 HB3 LYS A 653 -8.369 10.342 2.857 1.00 0.00 H new ATOM 0 HG2 LYS A 653 -10.892 10.440 2.626 1.00 0.00 H new ATOM 0 HG3 LYS A 653 -11.038 9.454 4.067 1.00 0.00 H new ATOM 0 HD2 LYS A 653 -9.713 11.199 5.348 1.00 0.00 H new ATOM 0 HD3 LYS A 653 -9.692 12.199 3.909 1.00 0.00 H new ATOM 0 HE2 LYS A 653 -11.619 12.497 5.745 1.00 0.00 H new ATOM 0 HE3 LYS A 653 -11.975 12.696 4.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 653 -13.501 11.168 5.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 653 -12.827 10.502 3.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 653 -12.212 10.069 5.421 1.00 0.00 H new ATOM 397 N VAL A 654 -7.420 8.058 0.713 1.00 0.00 N ATOM 398 CA VAL A 654 -6.132 7.588 0.223 1.00 0.00 C ATOM 399 C VAL A 654 -5.357 8.718 -0.444 1.00 0.00 C ATOM 400 O VAL A 654 -5.933 9.555 -1.139 1.00 0.00 O ATOM 401 CB VAL A 654 -6.349 6.456 -0.781 1.00 0.00 C ATOM 402 CG1 VAL A 654 -7.090 6.996 -2.005 1.00 0.00 C ATOM 403 CG2 VAL A 654 -4.997 5.888 -1.215 1.00 0.00 C ATOM 0 H VAL A 654 -7.994 8.529 0.014 1.00 0.00 H new ATOM 0 HA VAL A 654 -5.552 7.226 1.072 1.00 0.00 H new ATOM 0 HB VAL A 654 -6.940 5.668 -0.315 1.00 0.00 H new ATOM 0 HG11 VAL A 654 -7.245 6.189 -2.722 1.00 0.00 H new ATOM 0 HG12 VAL A 654 -8.055 7.399 -1.698 1.00 0.00 H new ATOM 0 HG13 VAL A 654 -6.499 7.785 -2.469 1.00 0.00 H new ATOM 0 HG21 VAL A 654 -5.154 5.081 -1.931 1.00 0.00 H new ATOM 0 HG22 VAL A 654 -4.404 6.675 -1.680 1.00 0.00 H new ATOM 0 HG23 VAL A 654 -4.468 5.502 -0.344 1.00 0.00 H new ATOM 413 N ILE A 655 -4.045 8.728 -0.235 1.00 0.00 N ATOM 414 CA ILE A 655 -3.196 9.752 -0.830 1.00 0.00 C ATOM 415 C ILE A 655 -2.446 9.164 -2.017 1.00 0.00 C ATOM 416 O ILE A 655 -1.902 8.063 -1.935 1.00 0.00 O ATOM 417 CB ILE A 655 -2.198 10.279 0.204 1.00 0.00 C ATOM 418 CG1 ILE A 655 -2.947 10.691 1.474 1.00 0.00 C ATOM 419 CG2 ILE A 655 -1.462 11.492 -0.369 1.00 0.00 C ATOM 420 CD1 ILE A 655 -4.189 11.501 1.097 1.00 0.00 C ATOM 0 H ILE A 655 -3.550 8.044 0.337 1.00 0.00 H new ATOM 0 HA ILE A 655 -3.820 10.579 -1.168 1.00 0.00 H new ATOM 0 HB ILE A 655 -1.478 9.497 0.444 1.00 0.00 H new ATOM 0 HG12 ILE A 655 -3.236 9.806 2.041 1.00 0.00 H new ATOM 0 HG13 ILE A 655 -2.296 11.283 2.117 1.00 0.00 H new ATOM 0 HG21 ILE A 655 -0.751 11.867 0.367 1.00 0.00 H new ATOM 0 HG22 ILE A 655 -0.928 11.200 -1.273 1.00 0.00 H new ATOM 0 HG23 ILE A 655 -2.182 12.274 -0.610 1.00 0.00 H new ATOM 0 HD11 ILE A 655 -4.721 11.794 2.002 1.00 0.00 H new ATOM 0 HD12 ILE A 655 -3.889 12.394 0.548 1.00 0.00 H new ATOM 0 HD13 ILE A 655 -4.843 10.894 0.472 1.00 0.00 H new ATOM 432 N TRP A 656 -2.436 9.892 -3.125 1.00 0.00 N ATOM 433 CA TRP A 656 -1.768 9.416 -4.328 1.00 0.00 C ATOM 434 C TRP A 656 -0.320 9.886 -4.386 1.00 0.00 C ATOM 435 O TRP A 656 -0.046 11.075 -4.543 1.00 0.00 O ATOM 436 CB TRP A 656 -2.515 9.916 -5.564 1.00 0.00 C ATOM 437 CG TRP A 656 -1.702 9.634 -6.783 1.00 0.00 C ATOM 438 CD1 TRP A 656 -0.955 8.523 -6.979 1.00 0.00 C ATOM 439 CD2 TRP A 656 -1.537 10.455 -7.974 1.00 0.00 C ATOM 440 NE1 TRP A 656 -0.343 8.610 -8.217 1.00 0.00 N ATOM 441 CE2 TRP A 656 -0.672 9.783 -8.869 1.00 0.00 C ATOM 442 CE3 TRP A 656 -2.051 11.706 -8.361 1.00 0.00 C ATOM 443 CZ2 TRP A 656 -0.327 10.332 -10.104 1.00 0.00 C ATOM 444 CZ3 TRP A 656 -1.707 12.262 -9.604 1.00 0.00 C ATOM 445 CH2 TRP A 656 -0.848 11.576 -10.474 1.00 0.00 C ATOM 0 H TRP A 656 -2.879 10.806 -3.216 1.00 0.00 H new ATOM 0 HA TRP A 656 -1.771 8.326 -4.305 1.00 0.00 H new ATOM 0 HB2 TRP A 656 -3.485 9.425 -5.639 1.00 0.00 H new ATOM 0 HB3 TRP A 656 -2.705 10.986 -5.480 1.00 0.00 H new ATOM 0 HD1 TRP A 656 -0.853 7.703 -6.284 1.00 0.00 H new ATOM 0 HE1 TRP A 656 0.275 7.896 -8.601 1.00 0.00 H new ATOM 0 HE3 TRP A 656 -2.714 12.242 -7.698 1.00 0.00 H new ATOM 0 HZ2 TRP A 656 0.337 9.801 -10.769 1.00 0.00 H new ATOM 0 HZ3 TRP A 656 -2.106 13.223 -9.891 1.00 0.00 H new ATOM 0 HH2 TRP A 656 -0.589 12.008 -11.429 1.00 0.00 H new ATOM 456 N LEU A 657 0.602 8.935 -4.277 1.00 0.00 N ATOM 457 CA LEU A 657 2.025 9.245 -4.336 1.00 0.00 C ATOM 458 C LEU A 657 2.629 8.668 -5.611 1.00 0.00 C ATOM 459 O LEU A 657 2.308 7.547 -6.009 1.00 0.00 O ATOM 460 CB LEU A 657 2.752 8.668 -3.117 1.00 0.00 C ATOM 461 CG LEU A 657 2.495 9.549 -1.891 1.00 0.00 C ATOM 462 CD1 LEU A 657 3.173 10.906 -2.087 1.00 0.00 C ATOM 463 CD2 LEU A 657 0.991 9.757 -1.706 1.00 0.00 C ATOM 0 H LEU A 657 0.390 7.946 -4.148 1.00 0.00 H new ATOM 0 HA LEU A 657 2.143 10.329 -4.336 1.00 0.00 H new ATOM 0 HB2 LEU A 657 2.407 7.652 -2.924 1.00 0.00 H new ATOM 0 HB3 LEU A 657 3.822 8.609 -3.315 1.00 0.00 H new ATOM 0 HG LEU A 657 2.902 9.059 -1.007 1.00 0.00 H new ATOM 0 HD11 LEU A 657 2.990 11.533 -1.215 1.00 0.00 H new ATOM 0 HD12 LEU A 657 4.246 10.762 -2.212 1.00 0.00 H new ATOM 0 HD13 LEU A 657 2.766 11.391 -2.974 1.00 0.00 H new ATOM 0 HD21 LEU A 657 0.815 10.384 -0.832 1.00 0.00 H new ATOM 0 HD22 LEU A 657 0.579 10.243 -2.591 1.00 0.00 H new ATOM 0 HD23 LEU A 657 0.505 8.792 -1.563 1.00 0.00 H new ATOM 475 N VAL A 658 3.498 9.442 -6.252 1.00 0.00 N ATOM 476 CA VAL A 658 4.133 8.996 -7.487 1.00 0.00 C ATOM 477 C VAL A 658 5.619 8.734 -7.272 1.00 0.00 C ATOM 478 O VAL A 658 6.360 8.494 -8.227 1.00 0.00 O ATOM 479 CB VAL A 658 3.948 10.052 -8.575 1.00 0.00 C ATOM 480 CG1 VAL A 658 2.455 10.232 -8.859 1.00 0.00 C ATOM 481 CG2 VAL A 658 4.540 11.383 -8.101 1.00 0.00 C ATOM 0 H VAL A 658 3.777 10.372 -5.941 1.00 0.00 H new ATOM 0 HA VAL A 658 3.661 8.064 -7.798 1.00 0.00 H new ATOM 0 HB VAL A 658 4.457 9.731 -9.484 1.00 0.00 H new ATOM 0 HG11 VAL A 658 2.321 10.985 -9.635 1.00 0.00 H new ATOM 0 HG12 VAL A 658 2.032 9.285 -9.195 1.00 0.00 H new ATOM 0 HG13 VAL A 658 1.948 10.554 -7.949 1.00 0.00 H new ATOM 0 HG21 VAL A 658 4.408 12.137 -8.877 1.00 0.00 H new ATOM 0 HG22 VAL A 658 4.031 11.705 -7.193 1.00 0.00 H new ATOM 0 HG23 VAL A 658 5.603 11.256 -7.896 1.00 0.00 H new ATOM 491 N ASP A 659 6.050 8.773 -6.017 1.00 0.00 N ATOM 492 CA ASP A 659 7.451 8.529 -5.696 1.00 0.00 C ATOM 493 C ASP A 659 7.582 7.920 -4.304 1.00 0.00 C ATOM 494 O ASP A 659 6.998 8.416 -3.341 1.00 0.00 O ATOM 495 CB ASP A 659 8.242 9.837 -5.764 1.00 0.00 C ATOM 496 CG ASP A 659 9.734 9.544 -5.676 1.00 0.00 C ATOM 497 OD1 ASP A 659 10.322 9.260 -6.706 1.00 0.00 O ATOM 498 OD2 ASP A 659 10.268 9.605 -4.581 1.00 0.00 O ATOM 0 H ASP A 659 5.456 8.969 -5.211 1.00 0.00 H new ATOM 0 HA ASP A 659 7.854 7.827 -6.426 1.00 0.00 H new ATOM 0 HB2 ASP A 659 8.019 10.359 -6.694 1.00 0.00 H new ATOM 0 HB3 ASP A 659 7.943 10.496 -4.949 1.00 0.00 H new ATOM 503 N GLY A 660 8.345 6.836 -4.209 1.00 0.00 N ATOM 504 CA GLY A 660 8.539 6.156 -2.933 1.00 0.00 C ATOM 505 C GLY A 660 9.253 7.043 -1.915 1.00 0.00 C ATOM 506 O GLY A 660 8.857 7.105 -0.751 1.00 0.00 O ATOM 0 H GLY A 660 8.837 6.411 -4.995 1.00 0.00 H new ATOM 0 HA2 GLY A 660 7.572 5.852 -2.533 1.00 0.00 H new ATOM 0 HA3 GLY A 660 9.119 5.247 -3.091 1.00 0.00 H new ATOM 510 N SER A 661 10.313 7.717 -2.352 1.00 0.00 N ATOM 511 CA SER A 661 11.075 8.581 -1.453 1.00 0.00 C ATOM 512 C SER A 661 10.201 9.700 -0.894 1.00 0.00 C ATOM 513 O SER A 661 10.233 9.990 0.305 1.00 0.00 O ATOM 514 CB SER A 661 12.262 9.190 -2.199 1.00 0.00 C ATOM 515 OG SER A 661 13.028 8.151 -2.793 1.00 0.00 O ATOM 0 H SER A 661 10.661 7.684 -3.310 1.00 0.00 H new ATOM 0 HA SER A 661 11.433 7.972 -0.623 1.00 0.00 H new ATOM 0 HB2 SER A 661 11.909 9.880 -2.965 1.00 0.00 H new ATOM 0 HB3 SER A 661 12.881 9.766 -1.511 1.00 0.00 H new ATOM 0 HG SER A 661 13.789 8.539 -3.273 1.00 0.00 H new ATOM 521 N THR A 662 9.415 10.322 -1.765 1.00 0.00 N ATOM 522 CA THR A 662 8.538 11.401 -1.336 1.00 0.00 C ATOM 523 C THR A 662 7.489 10.869 -0.371 1.00 0.00 C ATOM 524 O THR A 662 7.085 11.555 0.567 1.00 0.00 O ATOM 525 CB THR A 662 7.849 12.041 -2.541 1.00 0.00 C ATOM 526 OG1 THR A 662 8.832 12.524 -3.447 1.00 0.00 O ATOM 527 CG2 THR A 662 6.971 13.198 -2.063 1.00 0.00 C ATOM 0 H THR A 662 9.368 10.101 -2.760 1.00 0.00 H new ATOM 0 HA THR A 662 9.141 12.156 -0.832 1.00 0.00 H new ATOM 0 HB THR A 662 7.229 11.301 -3.047 1.00 0.00 H new ATOM 0 HG1 THR A 662 8.391 12.933 -4.221 1.00 0.00 H new ATOM 0 HG21 THR A 662 6.477 13.658 -2.919 1.00 0.00 H new ATOM 0 HG22 THR A 662 6.219 12.822 -1.369 1.00 0.00 H new ATOM 0 HG23 THR A 662 7.590 13.940 -1.559 1.00 0.00 H new ATOM 535 N ALA A 663 7.051 9.640 -0.613 1.00 0.00 N ATOM 536 CA ALA A 663 6.047 9.024 0.237 1.00 0.00 C ATOM 537 C ALA A 663 6.560 8.904 1.666 1.00 0.00 C ATOM 538 O ALA A 663 5.837 9.183 2.617 1.00 0.00 O ATOM 539 CB ALA A 663 5.690 7.636 -0.301 1.00 0.00 C ATOM 0 H ALA A 663 7.373 9.056 -1.385 1.00 0.00 H new ATOM 0 HA ALA A 663 5.157 9.653 0.235 1.00 0.00 H new ATOM 0 HB1 ALA A 663 4.937 7.180 0.341 1.00 0.00 H new ATOM 0 HB2 ALA A 663 5.296 7.728 -1.313 1.00 0.00 H new ATOM 0 HB3 ALA A 663 6.582 7.010 -0.314 1.00 0.00 H new ATOM 545 N LEU A 664 7.812 8.490 1.808 1.00 0.00 N ATOM 546 CA LEU A 664 8.406 8.340 3.133 1.00 0.00 C ATOM 547 C LEU A 664 8.408 9.663 3.894 1.00 0.00 C ATOM 548 O LEU A 664 8.035 9.714 5.068 1.00 0.00 O ATOM 549 CB LEU A 664 9.845 7.837 3.009 1.00 0.00 C ATOM 550 CG LEU A 664 9.857 6.475 2.318 1.00 0.00 C ATOM 551 CD1 LEU A 664 11.301 5.994 2.175 1.00 0.00 C ATOM 552 CD2 LEU A 664 9.065 5.470 3.162 1.00 0.00 C ATOM 0 H LEU A 664 8.431 8.254 1.033 1.00 0.00 H new ATOM 0 HA LEU A 664 7.803 7.619 3.685 1.00 0.00 H new ATOM 0 HB2 LEU A 664 10.442 8.550 2.440 1.00 0.00 H new ATOM 0 HB3 LEU A 664 10.299 7.758 3.997 1.00 0.00 H new ATOM 0 HG LEU A 664 9.401 6.560 1.331 1.00 0.00 H new ATOM 0 HD11 LEU A 664 11.314 5.022 1.682 1.00 0.00 H new ATOM 0 HD12 LEU A 664 11.866 6.711 1.579 1.00 0.00 H new ATOM 0 HD13 LEU A 664 11.755 5.906 3.162 1.00 0.00 H new ATOM 0 HD21 LEU A 664 9.072 4.497 2.671 1.00 0.00 H new ATOM 0 HD22 LEU A 664 9.522 5.382 4.148 1.00 0.00 H new ATOM 0 HD23 LEU A 664 8.037 5.815 3.269 1.00 0.00 H new ATOM 564 N ASP A 665 8.843 10.730 3.229 1.00 0.00 N ATOM 565 CA ASP A 665 8.902 12.036 3.879 1.00 0.00 C ATOM 566 C ASP A 665 7.506 12.524 4.251 1.00 0.00 C ATOM 567 O ASP A 665 7.316 13.136 5.302 1.00 0.00 O ATOM 568 CB ASP A 665 9.579 13.058 2.961 1.00 0.00 C ATOM 569 CG ASP A 665 8.561 13.664 2.001 1.00 0.00 C ATOM 570 OD1 ASP A 665 7.580 14.210 2.478 1.00 0.00 O ATOM 571 OD2 ASP A 665 8.782 13.582 0.805 1.00 0.00 O ATOM 0 H ASP A 665 9.155 10.718 2.258 1.00 0.00 H new ATOM 0 HA ASP A 665 9.488 11.930 4.792 1.00 0.00 H new ATOM 0 HB2 ASP A 665 10.039 13.845 3.559 1.00 0.00 H new ATOM 0 HB3 ASP A 665 10.379 12.577 2.398 1.00 0.00 H new ATOM 576 N GLN A 666 6.530 12.252 3.391 1.00 0.00 N ATOM 577 CA GLN A 666 5.162 12.677 3.661 1.00 0.00 C ATOM 578 C GLN A 666 4.464 11.675 4.571 1.00 0.00 C ATOM 579 O GLN A 666 3.771 12.054 5.516 1.00 0.00 O ATOM 580 CB GLN A 666 4.377 12.809 2.353 1.00 0.00 C ATOM 581 CG GLN A 666 5.016 13.887 1.477 1.00 0.00 C ATOM 582 CD GLN A 666 4.117 14.184 0.282 1.00 0.00 C ATOM 583 OE1 GLN A 666 4.447 15.027 -0.553 1.00 0.00 O ATOM 584 NE2 GLN A 666 2.990 13.540 0.153 1.00 0.00 N ATOM 0 H GLN A 666 6.657 11.747 2.514 1.00 0.00 H new ATOM 0 HA GLN A 666 5.199 13.647 4.157 1.00 0.00 H new ATOM 0 HB2 GLN A 666 4.368 11.855 1.825 1.00 0.00 H new ATOM 0 HB3 GLN A 666 3.339 13.066 2.565 1.00 0.00 H new ATOM 0 HG2 GLN A 666 5.174 14.795 2.059 1.00 0.00 H new ATOM 0 HG3 GLN A 666 5.995 13.555 1.133 1.00 0.00 H new ATOM 0 HE21 GLN A 666 2.719 12.842 0.846 1.00 0.00 H new ATOM 0 HE22 GLN A 666 2.380 13.734 -0.641 1.00 0.00 H new ATOM 593 N LEU A 667 4.655 10.395 4.275 1.00 0.00 N ATOM 594 CA LEU A 667 4.041 9.331 5.058 1.00 0.00 C ATOM 595 C LEU A 667 4.254 9.543 6.550 1.00 0.00 C ATOM 596 O LEU A 667 3.375 9.236 7.356 1.00 0.00 O ATOM 597 CB LEU A 667 4.607 7.972 4.658 1.00 0.00 C ATOM 598 CG LEU A 667 3.868 6.889 5.443 1.00 0.00 C ATOM 599 CD1 LEU A 667 3.930 5.562 4.681 1.00 0.00 C ATOM 600 CD2 LEU A 667 4.513 6.714 6.826 1.00 0.00 C ATOM 0 H LEU A 667 5.230 10.069 3.498 1.00 0.00 H new ATOM 0 HA LEU A 667 2.971 9.355 4.851 1.00 0.00 H new ATOM 0 HB2 LEU A 667 4.487 7.812 3.587 1.00 0.00 H new ATOM 0 HB3 LEU A 667 5.676 7.930 4.868 1.00 0.00 H new ATOM 0 HG LEU A 667 2.827 7.189 5.565 1.00 0.00 H new ATOM 0 HD11 LEU A 667 3.402 4.793 5.245 1.00 0.00 H new ATOM 0 HD12 LEU A 667 3.462 5.681 3.704 1.00 0.00 H new ATOM 0 HD13 LEU A 667 4.971 5.265 4.551 1.00 0.00 H new ATOM 0 HD21 LEU A 667 3.981 5.941 7.380 1.00 0.00 H new ATOM 0 HD22 LEU A 667 5.556 6.422 6.707 1.00 0.00 H new ATOM 0 HD23 LEU A 667 4.460 7.655 7.374 1.00 0.00 H new ATOM 612 N ASP A 668 5.420 10.057 6.923 1.00 0.00 N ATOM 613 CA ASP A 668 5.708 10.279 8.334 1.00 0.00 C ATOM 614 C ASP A 668 4.615 11.135 8.961 1.00 0.00 C ATOM 615 O ASP A 668 4.185 10.886 10.087 1.00 0.00 O ATOM 616 CB ASP A 668 7.059 10.978 8.488 1.00 0.00 C ATOM 617 CG ASP A 668 7.455 11.036 9.959 1.00 0.00 C ATOM 618 OD1 ASP A 668 6.718 10.504 10.774 1.00 0.00 O ATOM 619 OD2 ASP A 668 8.488 11.614 10.250 1.00 0.00 O ATOM 0 H ASP A 668 6.168 10.323 6.282 1.00 0.00 H new ATOM 0 HA ASP A 668 5.743 9.315 8.841 1.00 0.00 H new ATOM 0 HB2 ASP A 668 7.820 10.444 7.919 1.00 0.00 H new ATOM 0 HB3 ASP A 668 7.004 11.987 8.078 1.00 0.00 H new ATOM 624 N LEU A 669 4.157 12.131 8.216 1.00 0.00 N ATOM 625 CA LEU A 669 3.098 13.006 8.699 1.00 0.00 C ATOM 626 C LEU A 669 1.739 12.318 8.569 1.00 0.00 C ATOM 627 O LEU A 669 0.811 12.613 9.322 1.00 0.00 O ATOM 628 CB LEU A 669 3.099 14.314 7.900 1.00 0.00 C ATOM 629 CG LEU A 669 4.483 14.962 7.988 1.00 0.00 C ATOM 630 CD1 LEU A 669 4.518 16.219 7.117 1.00 0.00 C ATOM 631 CD2 LEU A 669 4.779 15.347 9.440 1.00 0.00 C ATOM 0 H LEU A 669 4.499 12.353 7.281 1.00 0.00 H new ATOM 0 HA LEU A 669 3.279 13.228 9.751 1.00 0.00 H new ATOM 0 HB2 LEU A 669 2.843 14.117 6.859 1.00 0.00 H new ATOM 0 HB3 LEU A 669 2.342 14.993 8.292 1.00 0.00 H new ATOM 0 HG LEU A 669 5.233 14.253 7.637 1.00 0.00 H new ATOM 0 HD11 LEU A 669 5.504 16.679 7.181 1.00 0.00 H new ATOM 0 HD12 LEU A 669 4.310 15.950 6.081 1.00 0.00 H new ATOM 0 HD13 LEU A 669 3.765 16.925 7.467 1.00 0.00 H new ATOM 0 HD21 LEU A 669 5.765 15.808 9.500 1.00 0.00 H new ATOM 0 HD22 LEU A 669 4.026 16.053 9.790 1.00 0.00 H new ATOM 0 HD23 LEU A 669 4.757 14.454 10.065 1.00 0.00 H new ATOM 643 N LEU A 670 1.626 11.407 7.601 1.00 0.00 N ATOM 644 CA LEU A 670 0.368 10.695 7.374 1.00 0.00 C ATOM 645 C LEU A 670 0.103 9.661 8.465 1.00 0.00 C ATOM 646 O LEU A 670 -1.039 9.469 8.882 1.00 0.00 O ATOM 647 CB LEU A 670 0.403 9.972 6.024 1.00 0.00 C ATOM 648 CG LEU A 670 0.799 10.948 4.917 1.00 0.00 C ATOM 649 CD1 LEU A 670 0.513 10.317 3.553 1.00 0.00 C ATOM 650 CD2 LEU A 670 0.000 12.245 5.061 1.00 0.00 C ATOM 0 H LEU A 670 2.382 11.147 6.968 1.00 0.00 H new ATOM 0 HA LEU A 670 -0.428 11.439 7.387 1.00 0.00 H new ATOM 0 HB2 LEU A 670 1.113 9.146 6.063 1.00 0.00 H new ATOM 0 HB3 LEU A 670 -0.575 9.541 5.808 1.00 0.00 H new ATOM 0 HG LEU A 670 1.863 11.172 4.997 1.00 0.00 H new ATOM 0 HD11 LEU A 670 0.796 11.013 2.764 1.00 0.00 H new ATOM 0 HD12 LEU A 670 1.089 9.398 3.449 1.00 0.00 H new ATOM 0 HD13 LEU A 670 -0.550 10.090 3.473 1.00 0.00 H new ATOM 0 HD21 LEU A 670 0.286 12.938 4.270 1.00 0.00 H new ATOM 0 HD22 LEU A 670 -1.065 12.026 4.985 1.00 0.00 H new ATOM 0 HD23 LEU A 670 0.210 12.696 6.031 1.00 0.00 H new ATOM 662 N GLN A 671 1.155 8.978 8.910 1.00 0.00 N ATOM 663 CA GLN A 671 0.994 7.951 9.932 1.00 0.00 C ATOM 664 C GLN A 671 -0.188 7.058 9.572 1.00 0.00 C ATOM 665 O GLN A 671 -1.194 7.020 10.281 1.00 0.00 O ATOM 666 CB GLN A 671 0.762 8.595 11.299 1.00 0.00 C ATOM 667 CG GLN A 671 1.987 9.423 11.685 1.00 0.00 C ATOM 668 CD GLN A 671 3.123 8.503 12.116 1.00 0.00 C ATOM 669 OE1 GLN A 671 2.887 7.487 12.770 1.00 0.00 O ATOM 670 NE2 GLN A 671 4.350 8.800 11.786 1.00 0.00 N ATOM 0 H GLN A 671 2.112 9.114 8.585 1.00 0.00 H new ATOM 0 HA GLN A 671 1.902 7.350 9.980 1.00 0.00 H new ATOM 0 HB2 GLN A 671 -0.124 9.229 11.269 1.00 0.00 H new ATOM 0 HB3 GLN A 671 0.578 7.826 12.049 1.00 0.00 H new ATOM 0 HG2 GLN A 671 2.304 10.034 10.840 1.00 0.00 H new ATOM 0 HG3 GLN A 671 1.734 10.106 12.496 1.00 0.00 H new ATOM 0 HE21 GLN A 671 4.543 9.642 11.244 1.00 0.00 H new ATOM 0 HE22 GLN A 671 5.116 8.190 12.070 1.00 0.00 H new ATOM 679 N PRO A 672 -0.084 6.362 8.474 1.00 0.00 N ATOM 680 CA PRO A 672 -1.157 5.463 7.975 1.00 0.00 C ATOM 681 C PRO A 672 -1.118 4.084 8.628 1.00 0.00 C ATOM 682 O PRO A 672 -0.061 3.617 9.052 1.00 0.00 O ATOM 683 CB PRO A 672 -0.858 5.368 6.479 1.00 0.00 C ATOM 684 CG PRO A 672 0.620 5.565 6.352 1.00 0.00 C ATOM 685 CD PRO A 672 1.085 6.354 7.582 1.00 0.00 C ATOM 0 HA PRO A 672 -2.153 5.844 8.202 1.00 0.00 H new ATOM 0 HB2 PRO A 672 -1.160 4.400 6.079 1.00 0.00 H new ATOM 0 HB3 PRO A 672 -1.404 6.128 5.921 1.00 0.00 H new ATOM 0 HG2 PRO A 672 1.132 4.604 6.296 1.00 0.00 H new ATOM 0 HG3 PRO A 672 0.858 6.106 5.436 1.00 0.00 H new ATOM 0 HD2 PRO A 672 1.944 5.880 8.057 1.00 0.00 H new ATOM 0 HD3 PRO A 672 1.387 7.366 7.314 1.00 0.00 H new ATOM 693 N ILE A 673 -2.277 3.435 8.695 1.00 0.00 N ATOM 694 CA ILE A 673 -2.364 2.105 9.288 1.00 0.00 C ATOM 695 C ILE A 673 -2.226 1.036 8.210 1.00 0.00 C ATOM 696 O ILE A 673 -1.931 -0.122 8.506 1.00 0.00 O ATOM 697 CB ILE A 673 -3.703 1.936 10.012 1.00 0.00 C ATOM 698 CG1 ILE A 673 -3.736 0.571 10.708 1.00 0.00 C ATOM 699 CG2 ILE A 673 -4.849 2.024 9.001 1.00 0.00 C ATOM 700 CD1 ILE A 673 -4.930 0.508 11.662 1.00 0.00 C ATOM 0 H ILE A 673 -3.162 3.805 8.349 1.00 0.00 H new ATOM 0 HA ILE A 673 -1.552 1.993 10.007 1.00 0.00 H new ATOM 0 HB ILE A 673 -3.817 2.726 10.754 1.00 0.00 H new ATOM 0 HG12 ILE A 673 -3.808 -0.225 9.966 1.00 0.00 H new ATOM 0 HG13 ILE A 673 -2.809 0.410 11.259 1.00 0.00 H new ATOM 0 HG21 ILE A 673 -5.801 1.903 9.518 1.00 0.00 H new ATOM 0 HG22 ILE A 673 -4.825 2.995 8.507 1.00 0.00 H new ATOM 0 HG23 ILE A 673 -4.739 1.236 8.256 1.00 0.00 H new ATOM 0 HD11 ILE A 673 -4.951 -0.464 12.155 1.00 0.00 H new ATOM 0 HD12 ILE A 673 -4.838 1.294 12.412 1.00 0.00 H new ATOM 0 HD13 ILE A 673 -5.853 0.649 11.100 1.00 0.00 H new ATOM 712 N VAL A 674 -2.443 1.430 6.958 1.00 0.00 N ATOM 713 CA VAL A 674 -2.337 0.494 5.844 1.00 0.00 C ATOM 714 C VAL A 674 -1.783 1.187 4.599 1.00 0.00 C ATOM 715 O VAL A 674 -2.164 2.318 4.277 1.00 0.00 O ATOM 716 CB VAL A 674 -3.710 -0.104 5.545 1.00 0.00 C ATOM 717 CG1 VAL A 674 -3.593 -1.102 4.395 1.00 0.00 C ATOM 718 CG2 VAL A 674 -4.228 -0.823 6.793 1.00 0.00 C ATOM 0 H VAL A 674 -2.691 2.383 6.691 1.00 0.00 H new ATOM 0 HA VAL A 674 -1.647 -0.302 6.123 1.00 0.00 H new ATOM 0 HB VAL A 674 -4.402 0.690 5.265 1.00 0.00 H new ATOM 0 HG11 VAL A 674 -4.573 -1.528 4.182 1.00 0.00 H new ATOM 0 HG12 VAL A 674 -3.219 -0.592 3.507 1.00 0.00 H new ATOM 0 HG13 VAL A 674 -2.903 -1.899 4.674 1.00 0.00 H new ATOM 0 HG21 VAL A 674 -5.208 -1.252 6.585 1.00 0.00 H new ATOM 0 HG22 VAL A 674 -3.535 -1.618 7.069 1.00 0.00 H new ATOM 0 HG23 VAL A 674 -4.310 -0.112 7.615 1.00 0.00 H new ATOM 728 N ILE A 675 -0.873 0.503 3.905 1.00 0.00 N ATOM 729 CA ILE A 675 -0.265 1.065 2.704 1.00 0.00 C ATOM 730 C ILE A 675 -0.416 0.115 1.518 1.00 0.00 C ATOM 731 O ILE A 675 0.041 -1.028 1.563 1.00 0.00 O ATOM 732 CB ILE A 675 1.220 1.318 2.958 1.00 0.00 C ATOM 733 CG1 ILE A 675 1.381 2.175 4.213 1.00 0.00 C ATOM 734 CG2 ILE A 675 1.826 2.052 1.761 1.00 0.00 C ATOM 735 CD1 ILE A 675 2.862 2.262 4.584 1.00 0.00 C ATOM 0 H ILE A 675 -0.545 -0.431 4.152 1.00 0.00 H new ATOM 0 HA ILE A 675 -0.772 2.000 2.467 1.00 0.00 H new ATOM 0 HB ILE A 675 1.732 0.366 3.097 1.00 0.00 H new ATOM 0 HG12 ILE A 675 0.979 3.173 4.039 1.00 0.00 H new ATOM 0 HG13 ILE A 675 0.813 1.743 5.037 1.00 0.00 H new ATOM 0 HG21 ILE A 675 2.885 2.232 1.943 1.00 0.00 H new ATOM 0 HG22 ILE A 675 1.710 1.443 0.864 1.00 0.00 H new ATOM 0 HG23 ILE A 675 1.315 3.005 1.621 1.00 0.00 H new ATOM 0 HD11 ILE A 675 2.978 2.873 5.479 1.00 0.00 H new ATOM 0 HD12 ILE A 675 3.248 1.261 4.776 1.00 0.00 H new ATOM 0 HD13 ILE A 675 3.417 2.714 3.762 1.00 0.00 H new ATOM 747 N LEU A 676 -1.037 0.601 0.450 1.00 0.00 N ATOM 748 CA LEU A 676 -1.219 -0.207 -0.751 1.00 0.00 C ATOM 749 C LEU A 676 -0.330 0.328 -1.868 1.00 0.00 C ATOM 750 O LEU A 676 -0.281 1.533 -2.099 1.00 0.00 O ATOM 751 CB LEU A 676 -2.680 -0.163 -1.200 1.00 0.00 C ATOM 752 CG LEU A 676 -3.588 -0.622 -0.055 1.00 0.00 C ATOM 753 CD1 LEU A 676 -3.871 0.546 0.894 1.00 0.00 C ATOM 754 CD2 LEU A 676 -4.907 -1.137 -0.633 1.00 0.00 C ATOM 0 H LEU A 676 -1.421 1.544 0.390 1.00 0.00 H new ATOM 0 HA LEU A 676 -0.946 -1.238 -0.527 1.00 0.00 H new ATOM 0 HB2 LEU A 676 -2.946 0.849 -1.504 1.00 0.00 H new ATOM 0 HB3 LEU A 676 -2.822 -0.805 -2.069 1.00 0.00 H new ATOM 0 HG LEU A 676 -3.090 -1.417 0.499 1.00 0.00 H new ATOM 0 HD11 LEU A 676 -4.517 0.208 1.704 1.00 0.00 H new ATOM 0 HD12 LEU A 676 -2.932 0.914 1.308 1.00 0.00 H new ATOM 0 HD13 LEU A 676 -4.365 1.348 0.346 1.00 0.00 H new ATOM 0 HD21 LEU A 676 -5.557 -1.465 0.179 1.00 0.00 H new ATOM 0 HD22 LEU A 676 -5.397 -0.338 -1.190 1.00 0.00 H new ATOM 0 HD23 LEU A 676 -4.709 -1.976 -1.301 1.00 0.00 H new ATOM 766 N MET A 677 0.378 -0.552 -2.564 1.00 0.00 N ATOM 767 CA MET A 677 1.243 -0.092 -3.643 1.00 0.00 C ATOM 768 C MET A 677 1.282 -1.079 -4.803 1.00 0.00 C ATOM 769 O MET A 677 1.453 -2.282 -4.610 1.00 0.00 O ATOM 770 CB MET A 677 2.660 0.138 -3.115 1.00 0.00 C ATOM 771 CG MET A 677 2.626 1.228 -2.040 1.00 0.00 C ATOM 772 SD MET A 677 4.314 1.713 -1.600 1.00 0.00 S ATOM 773 CE MET A 677 4.797 0.171 -0.785 1.00 0.00 C ATOM 0 H MET A 677 0.373 -1.560 -2.408 1.00 0.00 H new ATOM 0 HA MET A 677 0.830 0.845 -4.017 1.00 0.00 H new ATOM 0 HB2 MET A 677 3.061 -0.787 -2.700 1.00 0.00 H new ATOM 0 HB3 MET A 677 3.321 0.434 -3.930 1.00 0.00 H new ATOM 0 HG2 MET A 677 2.073 2.094 -2.405 1.00 0.00 H new ATOM 0 HG3 MET A 677 2.101 0.864 -1.157 1.00 0.00 H new ATOM 0 HE1 MET A 677 5.248 0.396 0.181 1.00 0.00 H new ATOM 0 HE2 MET A 677 3.916 -0.454 -0.638 1.00 0.00 H new ATOM 0 HE3 MET A 677 5.518 -0.359 -1.407 1.00 0.00 H new ATOM 783 N ALA A 678 1.147 -0.545 -6.012 1.00 0.00 N ATOM 784 CA ALA A 678 1.194 -1.364 -7.216 1.00 0.00 C ATOM 785 C ALA A 678 2.589 -1.953 -7.385 1.00 0.00 C ATOM 786 O ALA A 678 3.569 -1.390 -6.897 1.00 0.00 O ATOM 787 CB ALA A 678 0.835 -0.526 -8.443 1.00 0.00 C ATOM 0 H ALA A 678 1.004 0.450 -6.183 1.00 0.00 H new ATOM 0 HA ALA A 678 0.470 -2.173 -7.119 1.00 0.00 H new ATOM 0 HB1 ALA A 678 0.874 -1.151 -9.335 1.00 0.00 H new ATOM 0 HB2 ALA A 678 -0.171 -0.123 -8.327 1.00 0.00 H new ATOM 0 HB3 ALA A 678 1.545 0.295 -8.544 1.00 0.00 H new ATOM 793 N TRP A 679 2.677 -3.087 -8.070 1.00 0.00 N ATOM 794 CA TRP A 679 3.966 -3.735 -8.287 1.00 0.00 C ATOM 795 C TRP A 679 4.302 -3.788 -9.776 1.00 0.00 C ATOM 796 O TRP A 679 4.117 -4.816 -10.427 1.00 0.00 O ATOM 797 CB TRP A 679 3.920 -5.157 -7.725 1.00 0.00 C ATOM 798 CG TRP A 679 5.301 -5.618 -7.386 1.00 0.00 C ATOM 799 CD1 TRP A 679 6.220 -6.045 -8.282 1.00 0.00 C ATOM 800 CD2 TRP A 679 5.933 -5.713 -6.076 1.00 0.00 C ATOM 801 NE1 TRP A 679 7.373 -6.401 -7.604 1.00 0.00 N ATOM 802 CE2 TRP A 679 7.244 -6.214 -6.242 1.00 0.00 C ATOM 803 CE3 TRP A 679 5.498 -5.419 -4.772 1.00 0.00 C ATOM 804 CZ2 TRP A 679 8.094 -6.416 -5.154 1.00 0.00 C ATOM 805 CZ3 TRP A 679 6.350 -5.621 -3.674 1.00 0.00 C ATOM 806 CH2 TRP A 679 7.645 -6.120 -3.865 1.00 0.00 C ATOM 0 H TRP A 679 1.880 -3.573 -8.481 1.00 0.00 H new ATOM 0 HA TRP A 679 4.737 -3.157 -7.777 1.00 0.00 H new ATOM 0 HB2 TRP A 679 3.290 -5.185 -6.836 1.00 0.00 H new ATOM 0 HB3 TRP A 679 3.472 -5.831 -8.455 1.00 0.00 H new ATOM 0 HD1 TRP A 679 6.077 -6.099 -9.351 1.00 0.00 H new ATOM 0 HE1 TRP A 679 8.215 -6.758 -8.055 1.00 0.00 H new ATOM 0 HE3 TRP A 679 4.501 -5.035 -4.613 1.00 0.00 H new ATOM 0 HZ2 TRP A 679 9.092 -6.799 -5.308 1.00 0.00 H new ATOM 0 HZ3 TRP A 679 6.005 -5.390 -2.677 1.00 0.00 H new ATOM 0 HH2 TRP A 679 8.295 -6.276 -3.017 1.00 0.00 H new ATOM 817 N PRO A 680 4.793 -2.703 -10.321 1.00 0.00 N ATOM 818 CA PRO A 680 5.168 -2.606 -11.750 1.00 0.00 C ATOM 819 C PRO A 680 6.654 -2.892 -11.977 1.00 0.00 C ATOM 820 O PRO A 680 7.513 -2.131 -11.530 1.00 0.00 O ATOM 821 CB PRO A 680 4.852 -1.147 -12.064 1.00 0.00 C ATOM 822 CG PRO A 680 5.111 -0.406 -10.786 1.00 0.00 C ATOM 823 CD PRO A 680 5.044 -1.428 -9.640 1.00 0.00 C ATOM 0 HA PRO A 680 4.644 -3.328 -12.377 1.00 0.00 H new ATOM 0 HB2 PRO A 680 5.482 -0.772 -12.871 1.00 0.00 H new ATOM 0 HB3 PRO A 680 3.817 -1.028 -12.386 1.00 0.00 H new ATOM 0 HG2 PRO A 680 6.088 0.076 -10.813 1.00 0.00 H new ATOM 0 HG3 PRO A 680 4.371 0.381 -10.642 1.00 0.00 H new ATOM 0 HD2 PRO A 680 5.974 -1.454 -9.073 1.00 0.00 H new ATOM 0 HD3 PRO A 680 4.248 -1.187 -8.936 1.00 0.00 H new ATOM 831 N PRO A 681 6.972 -3.958 -12.667 1.00 0.00 N ATOM 832 CA PRO A 681 8.385 -4.325 -12.953 1.00 0.00 C ATOM 833 C PRO A 681 9.160 -3.183 -13.607 1.00 0.00 C ATOM 834 O PRO A 681 10.310 -2.926 -13.251 1.00 0.00 O ATOM 835 CB PRO A 681 8.301 -5.522 -13.898 1.00 0.00 C ATOM 836 CG PRO A 681 6.896 -6.032 -13.822 1.00 0.00 C ATOM 837 CD PRO A 681 6.022 -4.920 -13.238 1.00 0.00 C ATOM 0 HA PRO A 681 8.921 -4.552 -12.032 1.00 0.00 H new ATOM 0 HB2 PRO A 681 8.552 -5.229 -14.917 1.00 0.00 H new ATOM 0 HB3 PRO A 681 9.010 -6.296 -13.606 1.00 0.00 H new ATOM 0 HG2 PRO A 681 6.540 -6.317 -14.812 1.00 0.00 H new ATOM 0 HG3 PRO A 681 6.847 -6.924 -13.197 1.00 0.00 H new ATOM 0 HD2 PRO A 681 5.404 -4.457 -14.007 1.00 0.00 H new ATOM 0 HD3 PRO A 681 5.345 -5.307 -12.476 1.00 0.00 H new ATOM 845 N PRO A 682 8.561 -2.497 -14.551 1.00 0.00 N ATOM 846 CA PRO A 682 9.230 -1.365 -15.250 1.00 0.00 C ATOM 847 C PRO A 682 9.777 -0.357 -14.255 1.00 0.00 C ATOM 848 O PRO A 682 10.448 0.605 -14.626 1.00 0.00 O ATOM 849 CB PRO A 682 8.127 -0.740 -16.103 1.00 0.00 C ATOM 850 CG PRO A 682 7.089 -1.797 -16.262 1.00 0.00 C ATOM 851 CD PRO A 682 7.191 -2.714 -15.048 1.00 0.00 C ATOM 0 HA PRO A 682 10.082 -1.694 -15.845 1.00 0.00 H new ATOM 0 HB2 PRO A 682 7.713 0.145 -15.620 1.00 0.00 H new ATOM 0 HB3 PRO A 682 8.514 -0.423 -17.071 1.00 0.00 H new ATOM 0 HG2 PRO A 682 6.095 -1.354 -16.327 1.00 0.00 H new ATOM 0 HG3 PRO A 682 7.249 -2.358 -17.183 1.00 0.00 H new ATOM 0 HD2 PRO A 682 6.447 -2.460 -14.292 1.00 0.00 H new ATOM 0 HD3 PRO A 682 7.026 -3.756 -15.320 1.00 0.00 H new ATOM 859 N ASP A 683 9.478 -0.595 -12.985 1.00 0.00 N ATOM 860 CA ASP A 683 9.934 0.295 -11.918 1.00 0.00 C ATOM 861 C ASP A 683 10.129 -0.475 -10.613 1.00 0.00 C ATOM 862 O ASP A 683 9.337 -0.349 -9.678 1.00 0.00 O ATOM 863 CB ASP A 683 8.914 1.417 -11.702 1.00 0.00 C ATOM 864 CG ASP A 683 8.854 2.324 -12.929 1.00 0.00 C ATOM 865 OD1 ASP A 683 9.866 2.458 -13.596 1.00 0.00 O ATOM 866 OD2 ASP A 683 7.793 2.872 -13.183 1.00 0.00 O ATOM 0 H ASP A 683 8.925 -1.391 -12.667 1.00 0.00 H new ATOM 0 HA ASP A 683 10.891 0.723 -12.217 1.00 0.00 H new ATOM 0 HB2 ASP A 683 7.930 0.990 -11.509 1.00 0.00 H new ATOM 0 HB3 ASP A 683 9.187 2.001 -10.823 1.00 0.00 H new ATOM 871 N GLN A 684 11.199 -1.264 -10.561 1.00 0.00 N ATOM 872 CA GLN A 684 11.517 -2.050 -9.373 1.00 0.00 C ATOM 873 C GLN A 684 11.827 -1.137 -8.192 1.00 0.00 C ATOM 874 O GLN A 684 12.283 -1.595 -7.145 1.00 0.00 O ATOM 875 CB GLN A 684 12.726 -2.944 -9.649 1.00 0.00 C ATOM 876 CG GLN A 684 12.381 -3.957 -10.741 1.00 0.00 C ATOM 877 CD GLN A 684 13.631 -4.739 -11.131 1.00 0.00 C ATOM 878 OE1 GLN A 684 14.744 -4.341 -10.789 1.00 0.00 O ATOM 879 NE2 GLN A 684 13.515 -5.833 -11.834 1.00 0.00 N ATOM 0 H GLN A 684 11.861 -1.376 -11.329 1.00 0.00 H new ATOM 0 HA GLN A 684 10.652 -2.666 -9.128 1.00 0.00 H new ATOM 0 HB2 GLN A 684 13.576 -2.336 -9.959 1.00 0.00 H new ATOM 0 HB3 GLN A 684 13.021 -3.464 -8.738 1.00 0.00 H new ATOM 0 HG2 GLN A 684 11.609 -4.640 -10.386 1.00 0.00 H new ATOM 0 HG3 GLN A 684 11.975 -3.443 -11.612 1.00 0.00 H new ATOM 0 HE21 GLN A 684 12.592 -6.162 -12.117 1.00 0.00 H new ATOM 0 HE22 GLN A 684 14.347 -6.359 -12.100 1.00 0.00 H new ATOM 888 N SER A 685 11.590 0.157 -8.372 1.00 0.00 N ATOM 889 CA SER A 685 11.864 1.127 -7.318 1.00 0.00 C ATOM 890 C SER A 685 11.054 0.809 -6.065 1.00 0.00 C ATOM 891 O SER A 685 11.464 1.139 -4.952 1.00 0.00 O ATOM 892 CB SER A 685 11.528 2.538 -7.802 1.00 0.00 C ATOM 893 OG SER A 685 12.278 2.823 -8.975 1.00 0.00 O ATOM 0 H SER A 685 11.212 0.557 -9.231 1.00 0.00 H new ATOM 0 HA SER A 685 12.924 1.071 -7.072 1.00 0.00 H new ATOM 0 HB2 SER A 685 10.461 2.619 -8.010 1.00 0.00 H new ATOM 0 HB3 SER A 685 11.757 3.266 -7.024 1.00 0.00 H new ATOM 0 HG SER A 685 12.064 3.726 -9.289 1.00 0.00 H new ATOM 899 N CYS A 686 9.907 0.168 -6.247 1.00 0.00 N ATOM 900 CA CYS A 686 9.060 -0.184 -5.114 1.00 0.00 C ATOM 901 C CYS A 686 9.834 -1.038 -4.111 1.00 0.00 C ATOM 902 O CYS A 686 9.491 -1.088 -2.929 1.00 0.00 O ATOM 903 CB CYS A 686 7.827 -0.948 -5.598 1.00 0.00 C ATOM 904 SG CYS A 686 6.727 0.181 -6.488 1.00 0.00 S ATOM 0 H CYS A 686 9.544 -0.116 -7.157 1.00 0.00 H new ATOM 0 HA CYS A 686 8.743 0.736 -4.622 1.00 0.00 H new ATOM 0 HB2 CYS A 686 8.127 -1.769 -6.249 1.00 0.00 H new ATOM 0 HB3 CYS A 686 7.304 -1.389 -4.750 1.00 0.00 H new ATOM 0 HG CYS A 686 5.572 -0.389 -6.666 1.00 0.00 H new ATOM 910 N LEU A 687 10.883 -1.704 -4.587 1.00 0.00 N ATOM 911 CA LEU A 687 11.696 -2.548 -3.718 1.00 0.00 C ATOM 912 C LEU A 687 12.377 -1.706 -2.648 1.00 0.00 C ATOM 913 O LEU A 687 12.594 -2.165 -1.525 1.00 0.00 O ATOM 914 CB LEU A 687 12.769 -3.272 -4.536 1.00 0.00 C ATOM 915 CG LEU A 687 12.110 -4.123 -5.622 1.00 0.00 C ATOM 916 CD1 LEU A 687 13.192 -4.853 -6.421 1.00 0.00 C ATOM 917 CD2 LEU A 687 11.184 -5.150 -4.972 1.00 0.00 C ATOM 0 H LEU A 687 11.187 -1.676 -5.560 1.00 0.00 H new ATOM 0 HA LEU A 687 11.041 -3.279 -3.244 1.00 0.00 H new ATOM 0 HB2 LEU A 687 13.444 -2.546 -4.990 1.00 0.00 H new ATOM 0 HB3 LEU A 687 13.372 -3.903 -3.883 1.00 0.00 H new ATOM 0 HG LEU A 687 11.533 -3.480 -6.287 1.00 0.00 H new ATOM 0 HD11 LEU A 687 12.725 -5.460 -7.196 1.00 0.00 H new ATOM 0 HD12 LEU A 687 13.857 -4.124 -6.883 1.00 0.00 H new ATOM 0 HD13 LEU A 687 13.766 -5.495 -5.753 1.00 0.00 H new ATOM 0 HD21 LEU A 687 10.714 -5.757 -5.746 1.00 0.00 H new ATOM 0 HD22 LEU A 687 11.762 -5.793 -4.308 1.00 0.00 H new ATOM 0 HD23 LEU A 687 10.414 -4.634 -4.398 1.00 0.00 H new ATOM 929 N LEU A 688 12.718 -0.474 -3.004 1.00 0.00 N ATOM 930 CA LEU A 688 13.381 0.418 -2.065 1.00 0.00 C ATOM 931 C LEU A 688 12.416 0.841 -0.957 1.00 0.00 C ATOM 932 O LEU A 688 12.813 0.976 0.201 1.00 0.00 O ATOM 933 CB LEU A 688 13.926 1.643 -2.808 1.00 0.00 C ATOM 934 CG LEU A 688 12.862 2.745 -2.861 1.00 0.00 C ATOM 935 CD1 LEU A 688 12.885 3.570 -1.569 1.00 0.00 C ATOM 936 CD2 LEU A 688 13.149 3.663 -4.052 1.00 0.00 C ATOM 0 H LEU A 688 12.548 -0.074 -3.927 1.00 0.00 H new ATOM 0 HA LEU A 688 14.215 -0.110 -1.603 1.00 0.00 H new ATOM 0 HB2 LEU A 688 14.820 2.014 -2.306 1.00 0.00 H new ATOM 0 HB3 LEU A 688 14.221 1.363 -3.819 1.00 0.00 H new ATOM 0 HG LEU A 688 11.879 2.286 -2.970 1.00 0.00 H new ATOM 0 HD11 LEU A 688 12.124 4.349 -1.621 1.00 0.00 H new ATOM 0 HD12 LEU A 688 12.681 2.920 -0.718 1.00 0.00 H new ATOM 0 HD13 LEU A 688 13.866 4.029 -1.448 1.00 0.00 H new ATOM 0 HD21 LEU A 688 12.395 4.449 -4.095 1.00 0.00 H new ATOM 0 HD22 LEU A 688 14.135 4.112 -3.936 1.00 0.00 H new ATOM 0 HD23 LEU A 688 13.121 3.082 -4.974 1.00 0.00 H new ATOM 948 N LEU A 689 11.146 1.032 -1.311 1.00 0.00 N ATOM 949 CA LEU A 689 10.145 1.419 -0.323 1.00 0.00 C ATOM 950 C LEU A 689 10.027 0.329 0.737 1.00 0.00 C ATOM 951 O LEU A 689 9.970 0.612 1.933 1.00 0.00 O ATOM 952 CB LEU A 689 8.791 1.631 -1.007 1.00 0.00 C ATOM 953 CG LEU A 689 7.932 2.604 -0.188 1.00 0.00 C ATOM 954 CD1 LEU A 689 7.942 2.200 1.287 1.00 0.00 C ATOM 955 CD2 LEU A 689 8.493 4.022 -0.329 1.00 0.00 C ATOM 0 H LEU A 689 10.791 0.927 -2.261 1.00 0.00 H new ATOM 0 HA LEU A 689 10.450 2.351 0.152 1.00 0.00 H new ATOM 0 HB2 LEU A 689 8.941 2.024 -2.013 1.00 0.00 H new ATOM 0 HB3 LEU A 689 8.274 0.677 -1.111 1.00 0.00 H new ATOM 0 HG LEU A 689 6.908 2.574 -0.560 1.00 0.00 H new ATOM 0 HD11 LEU A 689 7.330 2.897 1.859 1.00 0.00 H new ATOM 0 HD12 LEU A 689 7.539 1.193 1.391 1.00 0.00 H new ATOM 0 HD13 LEU A 689 8.965 2.222 1.663 1.00 0.00 H new ATOM 0 HD21 LEU A 689 7.884 4.714 0.252 1.00 0.00 H new ATOM 0 HD22 LEU A 689 9.519 4.046 0.038 1.00 0.00 H new ATOM 0 HD23 LEU A 689 8.476 4.317 -1.378 1.00 0.00 H new ATOM 967 N LEU A 690 10.011 -0.923 0.289 1.00 0.00 N ATOM 968 CA LEU A 690 9.921 -2.048 1.211 1.00 0.00 C ATOM 969 C LEU A 690 11.119 -2.049 2.150 1.00 0.00 C ATOM 970 O LEU A 690 10.999 -2.384 3.328 1.00 0.00 O ATOM 971 CB LEU A 690 9.873 -3.368 0.438 1.00 0.00 C ATOM 972 CG LEU A 690 8.430 -3.685 0.039 1.00 0.00 C ATOM 973 CD1 LEU A 690 7.641 -4.118 1.275 1.00 0.00 C ATOM 974 CD2 LEU A 690 7.781 -2.440 -0.567 1.00 0.00 C ATOM 0 H LEU A 690 10.059 -1.182 -0.697 1.00 0.00 H new ATOM 0 HA LEU A 690 9.006 -1.946 1.794 1.00 0.00 H new ATOM 0 HB2 LEU A 690 10.499 -3.302 -0.452 1.00 0.00 H new ATOM 0 HB3 LEU A 690 10.275 -4.174 1.052 1.00 0.00 H new ATOM 0 HG LEU A 690 8.427 -4.491 -0.695 1.00 0.00 H new ATOM 0 HD11 LEU A 690 6.613 -4.344 0.990 1.00 0.00 H new ATOM 0 HD12 LEU A 690 8.101 -5.006 1.707 1.00 0.00 H new ATOM 0 HD13 LEU A 690 7.645 -3.313 2.010 1.00 0.00 H new ATOM 0 HD21 LEU A 690 6.753 -2.667 -0.851 1.00 0.00 H new ATOM 0 HD22 LEU A 690 7.785 -1.634 0.167 1.00 0.00 H new ATOM 0 HD23 LEU A 690 8.341 -2.131 -1.449 1.00 0.00 H new ATOM 986 N GLN A 691 12.277 -1.673 1.616 1.00 0.00 N ATOM 987 CA GLN A 691 13.496 -1.636 2.413 1.00 0.00 C ATOM 988 C GLN A 691 13.345 -0.674 3.587 1.00 0.00 C ATOM 989 O GLN A 691 13.741 -0.987 4.710 1.00 0.00 O ATOM 990 CB GLN A 691 14.670 -1.192 1.539 1.00 0.00 C ATOM 991 CG GLN A 691 15.973 -1.317 2.328 1.00 0.00 C ATOM 992 CD GLN A 691 17.151 -0.892 1.456 1.00 0.00 C ATOM 993 OE1 GLN A 691 17.025 -0.819 0.234 1.00 0.00 O ATOM 994 NE2 GLN A 691 18.292 -0.599 2.016 1.00 0.00 N ATOM 0 H GLN A 691 12.396 -1.392 0.643 1.00 0.00 H new ATOM 0 HA GLN A 691 13.684 -2.636 2.803 1.00 0.00 H new ATOM 0 HB2 GLN A 691 14.718 -1.805 0.639 1.00 0.00 H new ATOM 0 HB3 GLN A 691 14.526 -0.161 1.216 1.00 0.00 H new ATOM 0 HG2 GLN A 691 15.928 -0.695 3.222 1.00 0.00 H new ATOM 0 HG3 GLN A 691 16.109 -2.346 2.662 1.00 0.00 H new ATOM 0 HE21 GLN A 691 18.394 -0.660 3.029 1.00 0.00 H new ATOM 0 HE22 GLN A 691 19.083 -0.308 1.441 1.00 0.00 H new ATOM 1003 N HIS A 692 12.767 0.496 3.325 1.00 0.00 N ATOM 1004 CA HIS A 692 12.571 1.486 4.379 1.00 0.00 C ATOM 1005 C HIS A 692 11.714 0.910 5.500 1.00 0.00 C ATOM 1006 O HIS A 692 12.074 0.991 6.675 1.00 0.00 O ATOM 1007 CB HIS A 692 11.898 2.737 3.810 1.00 0.00 C ATOM 1008 CG HIS A 692 11.801 3.786 4.882 1.00 0.00 C ATOM 1009 ND1 HIS A 692 10.606 4.414 5.197 1.00 0.00 N ATOM 1010 CD2 HIS A 692 12.742 4.330 5.720 1.00 0.00 C ATOM 1011 CE1 HIS A 692 10.857 5.290 6.187 1.00 0.00 C ATOM 1012 NE2 HIS A 692 12.144 5.278 6.543 1.00 0.00 N ATOM 0 H HIS A 692 12.430 0.779 2.405 1.00 0.00 H new ATOM 0 HA HIS A 692 13.547 1.755 4.782 1.00 0.00 H new ATOM 0 HB2 HIS A 692 12.470 3.118 2.964 1.00 0.00 H new ATOM 0 HB3 HIS A 692 10.904 2.490 3.437 1.00 0.00 H new ATOM 0 HD1 HIS A 692 9.701 4.243 4.758 1.00 0.00 H new ATOM 0 HD2 HIS A 692 13.788 4.062 5.738 1.00 0.00 H new ATOM 0 HE1 HIS A 692 10.109 5.925 6.638 1.00 0.00 H new ATOM 1021 N LEU A 693 10.582 0.320 5.127 1.00 0.00 N ATOM 1022 CA LEU A 693 9.682 -0.272 6.108 1.00 0.00 C ATOM 1023 C LEU A 693 10.429 -1.287 6.966 1.00 0.00 C ATOM 1024 O LEU A 693 10.230 -1.360 8.180 1.00 0.00 O ATOM 1025 CB LEU A 693 8.519 -0.960 5.394 1.00 0.00 C ATOM 1026 CG LEU A 693 7.811 0.052 4.492 1.00 0.00 C ATOM 1027 CD1 LEU A 693 6.591 -0.603 3.844 1.00 0.00 C ATOM 1028 CD2 LEU A 693 7.359 1.250 5.328 1.00 0.00 C ATOM 0 H LEU A 693 10.269 0.240 4.160 1.00 0.00 H new ATOM 0 HA LEU A 693 9.296 0.518 6.752 1.00 0.00 H new ATOM 0 HB2 LEU A 693 8.885 -1.799 4.802 1.00 0.00 H new ATOM 0 HB3 LEU A 693 7.819 -1.367 6.123 1.00 0.00 H new ATOM 0 HG LEU A 693 8.499 0.386 3.715 1.00 0.00 H new ATOM 0 HD11 LEU A 693 6.088 0.120 3.202 1.00 0.00 H new ATOM 0 HD12 LEU A 693 6.911 -1.458 3.248 1.00 0.00 H new ATOM 0 HD13 LEU A 693 5.903 -0.939 4.620 1.00 0.00 H new ATOM 0 HD21 LEU A 693 6.854 1.972 4.686 1.00 0.00 H new ATOM 0 HD22 LEU A 693 6.673 0.913 6.105 1.00 0.00 H new ATOM 0 HD23 LEU A 693 8.227 1.720 5.790 1.00 0.00 H new ATOM 1040 N ARG A 694 11.298 -2.064 6.325 1.00 0.00 N ATOM 1041 CA ARG A 694 12.075 -3.068 7.036 1.00 0.00 C ATOM 1042 C ARG A 694 12.968 -2.398 8.071 1.00 0.00 C ATOM 1043 O ARG A 694 13.220 -2.951 9.142 1.00 0.00 O ATOM 1044 CB ARG A 694 12.931 -3.866 6.054 1.00 0.00 C ATOM 1045 CG ARG A 694 13.584 -5.040 6.787 1.00 0.00 C ATOM 1046 CD ARG A 694 14.465 -5.819 5.811 1.00 0.00 C ATOM 1047 NE ARG A 694 13.677 -6.257 4.665 1.00 0.00 N ATOM 1048 CZ ARG A 694 14.259 -6.578 3.514 1.00 0.00 C ATOM 1049 NH1 ARG A 694 15.559 -6.527 3.408 1.00 0.00 N ATOM 1050 NH2 ARG A 694 13.532 -6.942 2.494 1.00 0.00 N ATOM 0 H ARG A 694 11.479 -2.017 5.322 1.00 0.00 H new ATOM 0 HA ARG A 694 11.389 -3.748 7.541 1.00 0.00 H new ATOM 0 HB2 ARG A 694 12.315 -4.233 5.233 1.00 0.00 H new ATOM 0 HB3 ARG A 694 13.696 -3.225 5.617 1.00 0.00 H new ATOM 0 HG2 ARG A 694 14.182 -4.675 7.622 1.00 0.00 H new ATOM 0 HG3 ARG A 694 12.818 -5.694 7.205 1.00 0.00 H new ATOM 0 HD2 ARG A 694 15.292 -5.193 5.476 1.00 0.00 H new ATOM 0 HD3 ARG A 694 14.902 -6.682 6.313 1.00 0.00 H new ATOM 0 HE ARG A 694 12.662 -6.318 4.748 1.00 0.00 H new ATOM 0 HH11 ARG A 694 16.125 -6.241 4.207 1.00 0.00 H new ATOM 0 HH12 ARG A 694 16.009 -6.773 2.526 1.00 0.00 H new ATOM 0 HH21 ARG A 694 12.516 -6.980 2.579 1.00 0.00 H new ATOM 0 HH22 ARG A 694 13.979 -7.188 1.611 1.00 0.00 H new ATOM 1064 N GLU A 695 13.440 -1.200 7.742 1.00 0.00 N ATOM 1065 CA GLU A 695 14.302 -0.452 8.646 1.00 0.00 C ATOM 1066 C GLU A 695 13.527 -0.026 9.890 1.00 0.00 C ATOM 1067 O GLU A 695 14.083 0.050 10.985 1.00 0.00 O ATOM 1068 CB GLU A 695 14.840 0.793 7.936 1.00 0.00 C ATOM 1069 CG GLU A 695 15.894 1.471 8.814 1.00 0.00 C ATOM 1070 CD GLU A 695 16.297 2.809 8.206 1.00 0.00 C ATOM 1071 OE1 GLU A 695 15.681 3.204 7.230 1.00 0.00 O ATOM 1072 OE2 GLU A 695 17.210 3.424 8.732 1.00 0.00 O ATOM 0 H GLU A 695 13.240 -0.729 6.860 1.00 0.00 H new ATOM 0 HA GLU A 695 15.131 -1.093 8.945 1.00 0.00 H new ATOM 0 HB2 GLU A 695 15.276 0.516 6.976 1.00 0.00 H new ATOM 0 HB3 GLU A 695 14.025 1.486 7.728 1.00 0.00 H new ATOM 0 HG2 GLU A 695 15.499 1.623 9.819 1.00 0.00 H new ATOM 0 HG3 GLU A 695 16.769 0.827 8.909 1.00 0.00 H new ATOM 1079 N HIS A 696 12.240 0.262 9.709 1.00 0.00 N ATOM 1080 CA HIS A 696 11.397 0.695 10.820 1.00 0.00 C ATOM 1081 C HIS A 696 10.533 -0.447 11.349 1.00 0.00 C ATOM 1082 O HIS A 696 9.682 -0.238 12.214 1.00 0.00 O ATOM 1083 CB HIS A 696 10.499 1.847 10.370 1.00 0.00 C ATOM 1084 CG HIS A 696 11.351 3.029 10.002 1.00 0.00 C ATOM 1085 ND1 HIS A 696 12.133 3.694 10.933 1.00 0.00 N ATOM 1086 CD2 HIS A 696 11.550 3.682 8.811 1.00 0.00 C ATOM 1087 CE1 HIS A 696 12.760 4.697 10.294 1.00 0.00 C ATOM 1088 NE2 HIS A 696 12.441 4.734 8.997 1.00 0.00 N ATOM 0 H HIS A 696 11.761 0.204 8.810 1.00 0.00 H new ATOM 0 HA HIS A 696 12.052 1.026 11.626 1.00 0.00 H new ATOM 0 HB2 HIS A 696 9.895 1.540 9.516 1.00 0.00 H new ATOM 0 HB3 HIS A 696 9.808 2.117 11.168 1.00 0.00 H new ATOM 0 HD2 HIS A 696 11.085 3.419 7.872 1.00 0.00 H new ATOM 0 HE1 HIS A 696 13.439 5.389 10.771 1.00 0.00 H new ATOM 0 HE2 HIS A 696 12.778 5.392 8.294 1.00 0.00 H new ATOM 1168 N PRO A 702 3.592 -2.603 13.873 1.00 0.00 N ATOM 1169 CA PRO A 702 3.875 -3.021 12.472 1.00 0.00 C ATOM 1170 C PRO A 702 2.658 -2.810 11.564 1.00 0.00 C ATOM 1171 O PRO A 702 1.629 -3.465 11.735 1.00 0.00 O ATOM 1172 CB PRO A 702 4.211 -4.507 12.603 1.00 0.00 C ATOM 1173 CG PRO A 702 4.724 -4.678 13.996 1.00 0.00 C ATOM 1174 CD PRO A 702 4.061 -3.594 14.850 1.00 0.00 C ATOM 0 HA PRO A 702 4.677 -2.440 12.016 1.00 0.00 H new ATOM 0 HB2 PRO A 702 3.330 -5.125 12.430 1.00 0.00 H new ATOM 0 HB3 PRO A 702 4.960 -4.806 11.869 1.00 0.00 H new ATOM 0 HG2 PRO A 702 4.484 -5.671 14.377 1.00 0.00 H new ATOM 0 HG3 PRO A 702 5.809 -4.581 14.023 1.00 0.00 H new ATOM 0 HD2 PRO A 702 3.235 -3.998 15.436 1.00 0.00 H new ATOM 0 HD3 PRO A 702 4.767 -3.155 15.555 1.00 0.00 H new ATOM 1182 N PRO A 703 2.750 -1.904 10.621 1.00 0.00 N ATOM 1183 CA PRO A 703 1.627 -1.592 9.686 1.00 0.00 C ATOM 1184 C PRO A 703 1.467 -2.626 8.570 1.00 0.00 C ATOM 1185 O PRO A 703 2.447 -3.190 8.084 1.00 0.00 O ATOM 1186 CB PRO A 703 2.017 -0.231 9.112 1.00 0.00 C ATOM 1187 CG PRO A 703 3.508 -0.198 9.158 1.00 0.00 C ATOM 1188 CD PRO A 703 3.934 -1.074 10.338 1.00 0.00 C ATOM 0 HA PRO A 703 0.664 -1.599 10.198 1.00 0.00 H new ATOM 0 HB2 PRO A 703 1.652 -0.115 8.091 1.00 0.00 H new ATOM 0 HB3 PRO A 703 1.587 0.581 9.698 1.00 0.00 H new ATOM 0 HG2 PRO A 703 3.932 -0.572 8.226 1.00 0.00 H new ATOM 0 HG3 PRO A 703 3.868 0.823 9.285 1.00 0.00 H new ATOM 0 HD2 PRO A 703 4.799 -1.688 10.086 1.00 0.00 H new ATOM 0 HD3 PRO A 703 4.212 -0.470 11.202 1.00 0.00 H new ATOM 1196 N LEU A 704 0.219 -2.853 8.165 1.00 0.00 N ATOM 1197 CA LEU A 704 -0.076 -3.805 7.097 1.00 0.00 C ATOM 1198 C LEU A 704 0.143 -3.165 5.730 1.00 0.00 C ATOM 1199 O LEU A 704 -0.144 -1.984 5.535 1.00 0.00 O ATOM 1200 CB LEU A 704 -1.529 -4.272 7.196 1.00 0.00 C ATOM 1201 CG LEU A 704 -1.723 -5.114 8.458 1.00 0.00 C ATOM 1202 CD1 LEU A 704 -1.654 -4.214 9.694 1.00 0.00 C ATOM 1203 CD2 LEU A 704 -3.092 -5.800 8.401 1.00 0.00 C ATOM 0 H LEU A 704 -0.601 -2.392 8.559 1.00 0.00 H new ATOM 0 HA LEU A 704 0.596 -4.656 7.209 1.00 0.00 H new ATOM 0 HB2 LEU A 704 -2.196 -3.410 7.218 1.00 0.00 H new ATOM 0 HB3 LEU A 704 -1.793 -4.857 6.315 1.00 0.00 H new ATOM 0 HG LEU A 704 -0.937 -5.867 8.518 1.00 0.00 H new ATOM 0 HD11 LEU A 704 -1.793 -4.817 10.591 1.00 0.00 H new ATOM 0 HD12 LEU A 704 -0.681 -3.723 9.733 1.00 0.00 H new ATOM 0 HD13 LEU A 704 -2.439 -3.460 9.639 1.00 0.00 H new ATOM 0 HD21 LEU A 704 -3.235 -6.402 9.299 1.00 0.00 H new ATOM 0 HD22 LEU A 704 -3.875 -5.044 8.342 1.00 0.00 H new ATOM 0 HD23 LEU A 704 -3.141 -6.443 7.522 1.00 0.00 H new ATOM 1215 N VAL A 705 0.636 -3.953 4.781 1.00 0.00 N ATOM 1216 CA VAL A 705 0.868 -3.446 3.434 1.00 0.00 C ATOM 1217 C VAL A 705 0.317 -4.419 2.393 1.00 0.00 C ATOM 1218 O VAL A 705 0.476 -5.636 2.518 1.00 0.00 O ATOM 1219 CB VAL A 705 2.365 -3.232 3.202 1.00 0.00 C ATOM 1220 CG1 VAL A 705 3.085 -4.580 3.226 1.00 0.00 C ATOM 1221 CG2 VAL A 705 2.584 -2.568 1.841 1.00 0.00 C ATOM 0 H VAL A 705 0.880 -4.934 4.917 1.00 0.00 H new ATOM 0 HA VAL A 705 0.350 -2.492 3.331 1.00 0.00 H new ATOM 0 HB VAL A 705 2.762 -2.591 3.989 1.00 0.00 H new ATOM 0 HG11 VAL A 705 4.151 -4.426 3.061 1.00 0.00 H new ATOM 0 HG12 VAL A 705 2.933 -5.056 4.195 1.00 0.00 H new ATOM 0 HG13 VAL A 705 2.685 -5.220 2.440 1.00 0.00 H new ATOM 0 HG21 VAL A 705 3.651 -2.416 1.678 1.00 0.00 H new ATOM 0 HG22 VAL A 705 2.184 -3.209 1.055 1.00 0.00 H new ATOM 0 HG23 VAL A 705 2.073 -1.605 1.819 1.00 0.00 H new ATOM 1231 N LEU A 706 -0.330 -3.876 1.366 1.00 0.00 N ATOM 1232 CA LEU A 706 -0.895 -4.706 0.307 1.00 0.00 C ATOM 1233 C LEU A 706 -0.263 -4.352 -1.035 1.00 0.00 C ATOM 1234 O LEU A 706 -0.098 -3.176 -1.359 1.00 0.00 O ATOM 1235 CB LEU A 706 -2.408 -4.507 0.237 1.00 0.00 C ATOM 1236 CG LEU A 706 -3.019 -4.829 1.600 1.00 0.00 C ATOM 1237 CD1 LEU A 706 -2.682 -3.710 2.587 1.00 0.00 C ATOM 1238 CD2 LEU A 706 -4.539 -4.949 1.463 1.00 0.00 C ATOM 0 H LEU A 706 -0.475 -2.874 1.245 1.00 0.00 H new ATOM 0 HA LEU A 706 -0.683 -5.751 0.532 1.00 0.00 H new ATOM 0 HB2 LEU A 706 -2.639 -3.480 -0.045 1.00 0.00 H new ATOM 0 HB3 LEU A 706 -2.837 -5.153 -0.529 1.00 0.00 H new ATOM 0 HG LEU A 706 -2.612 -5.771 1.967 1.00 0.00 H new ATOM 0 HD11 LEU A 706 -3.118 -3.939 3.560 1.00 0.00 H new ATOM 0 HD12 LEU A 706 -1.600 -3.625 2.685 1.00 0.00 H new ATOM 0 HD13 LEU A 706 -3.088 -2.767 2.221 1.00 0.00 H new ATOM 0 HD21 LEU A 706 -4.975 -5.179 2.435 1.00 0.00 H new ATOM 0 HD22 LEU A 706 -4.947 -4.007 1.096 1.00 0.00 H new ATOM 0 HD23 LEU A 706 -4.779 -5.747 0.760 1.00 0.00 H new ATOM 1250 N PHE A 707 0.097 -5.370 -1.810 1.00 0.00 N ATOM 1251 CA PHE A 707 0.717 -5.134 -3.109 1.00 0.00 C ATOM 1252 C PHE A 707 -0.133 -5.687 -4.248 1.00 0.00 C ATOM 1253 O PHE A 707 -0.566 -6.838 -4.214 1.00 0.00 O ATOM 1254 CB PHE A 707 2.097 -5.787 -3.149 1.00 0.00 C ATOM 1255 CG PHE A 707 3.006 -5.094 -2.164 1.00 0.00 C ATOM 1256 CD1 PHE A 707 3.621 -3.887 -2.513 1.00 0.00 C ATOM 1257 CD2 PHE A 707 3.233 -5.657 -0.903 1.00 0.00 C ATOM 1258 CE1 PHE A 707 4.463 -3.242 -1.602 1.00 0.00 C ATOM 1259 CE2 PHE A 707 4.077 -5.011 0.010 1.00 0.00 C ATOM 1260 CZ PHE A 707 4.691 -3.803 -0.340 1.00 0.00 C ATOM 0 H PHE A 707 -0.027 -6.353 -1.566 1.00 0.00 H new ATOM 0 HA PHE A 707 0.806 -4.056 -3.242 1.00 0.00 H new ATOM 0 HB2 PHE A 707 2.018 -6.846 -2.905 1.00 0.00 H new ATOM 0 HB3 PHE A 707 2.514 -5.722 -4.154 1.00 0.00 H new ATOM 0 HD1 PHE A 707 3.445 -3.453 -3.486 1.00 0.00 H new ATOM 0 HD2 PHE A 707 2.758 -6.589 -0.634 1.00 0.00 H new ATOM 0 HE1 PHE A 707 4.938 -2.310 -1.872 1.00 0.00 H new ATOM 0 HE2 PHE A 707 4.254 -5.445 0.983 1.00 0.00 H new ATOM 0 HZ PHE A 707 5.341 -3.304 0.364 1.00 0.00 H new ATOM 1270 N LEU A 708 -0.347 -4.862 -5.268 1.00 0.00 N ATOM 1271 CA LEU A 708 -1.123 -5.280 -6.429 1.00 0.00 C ATOM 1272 C LEU A 708 -0.183 -5.670 -7.566 1.00 0.00 C ATOM 1273 O LEU A 708 0.857 -5.042 -7.759 1.00 0.00 O ATOM 1274 CB LEU A 708 -2.038 -4.143 -6.887 1.00 0.00 C ATOM 1275 CG LEU A 708 -2.901 -3.676 -5.713 1.00 0.00 C ATOM 1276 CD1 LEU A 708 -3.881 -2.607 -6.195 1.00 0.00 C ATOM 1277 CD2 LEU A 708 -3.683 -4.864 -5.148 1.00 0.00 C ATOM 0 H LEU A 708 0.004 -3.905 -5.314 1.00 0.00 H new ATOM 0 HA LEU A 708 -1.734 -6.140 -6.154 1.00 0.00 H new ATOM 0 HB2 LEU A 708 -1.442 -3.313 -7.266 1.00 0.00 H new ATOM 0 HB3 LEU A 708 -2.672 -4.481 -7.707 1.00 0.00 H new ATOM 0 HG LEU A 708 -2.260 -3.260 -4.936 1.00 0.00 H new ATOM 0 HD11 LEU A 708 -4.496 -2.274 -5.359 1.00 0.00 H new ATOM 0 HD12 LEU A 708 -3.326 -1.760 -6.597 1.00 0.00 H new ATOM 0 HD13 LEU A 708 -4.521 -3.024 -6.973 1.00 0.00 H new ATOM 0 HD21 LEU A 708 -4.297 -4.531 -4.312 1.00 0.00 H new ATOM 0 HD22 LEU A 708 -4.323 -5.281 -5.925 1.00 0.00 H new ATOM 0 HD23 LEU A 708 -2.986 -5.628 -4.804 1.00 0.00 H new ATOM 1289 N GLY A 709 -0.546 -6.704 -8.318 1.00 0.00 N ATOM 1290 CA GLY A 709 0.289 -7.147 -9.429 1.00 0.00 C ATOM 1291 C GLY A 709 0.925 -8.502 -9.135 1.00 0.00 C ATOM 1292 O GLY A 709 0.291 -9.384 -8.561 1.00 0.00 O ATOM 0 H GLY A 709 -1.400 -7.244 -8.182 1.00 0.00 H new ATOM 0 HA2 GLY A 709 -0.313 -7.214 -10.335 1.00 0.00 H new ATOM 0 HA3 GLY A 709 1.069 -6.409 -9.618 1.00 0.00 H new ATOM 1296 N GLU A 710 2.181 -8.660 -9.538 1.00 0.00 N ATOM 1297 CA GLU A 710 2.892 -9.916 -9.319 1.00 0.00 C ATOM 1298 C GLU A 710 3.560 -9.921 -7.944 1.00 0.00 C ATOM 1299 O GLU A 710 3.886 -8.864 -7.403 1.00 0.00 O ATOM 1300 CB GLU A 710 3.947 -10.101 -10.413 1.00 0.00 C ATOM 1301 CG GLU A 710 5.189 -9.285 -10.058 1.00 0.00 C ATOM 1302 CD GLU A 710 5.850 -8.750 -11.326 1.00 0.00 C ATOM 1303 OE1 GLU A 710 5.335 -9.017 -12.400 1.00 0.00 O ATOM 1304 OE2 GLU A 710 6.863 -8.081 -11.203 1.00 0.00 O ATOM 0 H GLU A 710 2.725 -7.941 -10.014 1.00 0.00 H new ATOM 0 HA GLU A 710 2.178 -10.739 -9.358 1.00 0.00 H new ATOM 0 HB2 GLU A 710 4.206 -11.155 -10.510 1.00 0.00 H new ATOM 0 HB3 GLU A 710 3.550 -9.780 -11.376 1.00 0.00 H new ATOM 0 HG2 GLU A 710 4.914 -8.456 -9.405 1.00 0.00 H new ATOM 0 HG3 GLU A 710 5.895 -9.905 -9.505 1.00 0.00 H new ATOM 1311 N PRO A 711 3.757 -11.083 -7.371 1.00 0.00 N ATOM 1312 CA PRO A 711 4.389 -11.218 -6.026 1.00 0.00 C ATOM 1313 C PRO A 711 5.900 -10.968 -6.061 1.00 0.00 C ATOM 1314 O PRO A 711 6.548 -11.177 -7.086 1.00 0.00 O ATOM 1315 CB PRO A 711 4.082 -12.662 -5.623 1.00 0.00 C ATOM 1316 CG PRO A 711 3.900 -13.404 -6.906 1.00 0.00 C ATOM 1317 CD PRO A 711 3.398 -12.395 -7.939 1.00 0.00 C ATOM 0 HA PRO A 711 4.003 -10.482 -5.321 1.00 0.00 H new ATOM 0 HB2 PRO A 711 4.896 -13.087 -5.036 1.00 0.00 H new ATOM 0 HB3 PRO A 711 3.184 -12.715 -5.008 1.00 0.00 H new ATOM 0 HG2 PRO A 711 4.840 -13.852 -7.229 1.00 0.00 H new ATOM 0 HG3 PRO A 711 3.185 -14.218 -6.783 1.00 0.00 H new ATOM 0 HD2 PRO A 711 3.870 -12.551 -8.909 1.00 0.00 H new ATOM 0 HD3 PRO A 711 2.322 -12.482 -8.090 1.00 0.00 H new ATOM 1325 N PRO A 712 6.463 -10.529 -4.961 1.00 0.00 N ATOM 1326 CA PRO A 712 7.926 -10.247 -4.859 1.00 0.00 C ATOM 1327 C PRO A 712 8.789 -11.385 -5.401 1.00 0.00 C ATOM 1328 O PRO A 712 8.325 -12.516 -5.554 1.00 0.00 O ATOM 1329 CB PRO A 712 8.167 -10.074 -3.359 1.00 0.00 C ATOM 1330 CG PRO A 712 6.849 -9.703 -2.767 1.00 0.00 C ATOM 1331 CD PRO A 712 5.762 -10.247 -3.695 1.00 0.00 C ATOM 0 HA PRO A 712 8.199 -9.374 -5.452 1.00 0.00 H new ATOM 0 HB2 PRO A 712 8.547 -10.995 -2.917 1.00 0.00 H new ATOM 0 HB3 PRO A 712 8.910 -9.299 -3.171 1.00 0.00 H new ATOM 0 HG2 PRO A 712 6.745 -10.123 -1.767 1.00 0.00 H new ATOM 0 HG3 PRO A 712 6.763 -8.621 -2.668 1.00 0.00 H new ATOM 0 HD2 PRO A 712 5.305 -11.148 -3.285 1.00 0.00 H new ATOM 0 HD3 PRO A 712 4.962 -9.520 -3.838 1.00 0.00 H new ATOM 1339 N VAL A 713 10.051 -11.070 -5.679 1.00 0.00 N ATOM 1340 CA VAL A 713 10.992 -12.060 -6.192 1.00 0.00 C ATOM 1341 C VAL A 713 11.607 -12.844 -5.038 1.00 0.00 C ATOM 1342 O VAL A 713 12.629 -13.512 -5.199 1.00 0.00 O ATOM 1343 CB VAL A 713 12.096 -11.368 -6.991 1.00 0.00 C ATOM 1344 CG1 VAL A 713 12.732 -12.367 -7.959 1.00 0.00 C ATOM 1345 CG2 VAL A 713 11.494 -10.205 -7.782 1.00 0.00 C ATOM 0 H VAL A 713 10.445 -10.137 -5.558 1.00 0.00 H new ATOM 0 HA VAL A 713 10.456 -12.748 -6.845 1.00 0.00 H new ATOM 0 HB VAL A 713 12.858 -10.992 -6.308 1.00 0.00 H new ATOM 0 HG11 VAL A 713 13.519 -11.872 -8.528 1.00 0.00 H new ATOM 0 HG12 VAL A 713 13.159 -13.198 -7.397 1.00 0.00 H new ATOM 0 HG13 VAL A 713 11.972 -12.745 -8.643 1.00 0.00 H new ATOM 0 HG21 VAL A 713 12.279 -9.709 -8.353 1.00 0.00 H new ATOM 0 HG22 VAL A 713 10.733 -10.584 -8.464 1.00 0.00 H new ATOM 0 HG23 VAL A 713 11.041 -9.492 -7.093 1.00 0.00 H new ATOM 1355 N ASP A 714 10.972 -12.752 -3.873 1.00 0.00 N ATOM 1356 CA ASP A 714 11.451 -13.448 -2.685 1.00 0.00 C ATOM 1357 C ASP A 714 10.332 -13.546 -1.651 1.00 0.00 C ATOM 1358 O ASP A 714 9.468 -12.673 -1.575 1.00 0.00 O ATOM 1359 CB ASP A 714 12.645 -12.702 -2.084 1.00 0.00 C ATOM 1360 CG ASP A 714 13.925 -13.503 -2.297 1.00 0.00 C ATOM 1361 OD1 ASP A 714 14.296 -13.698 -3.443 1.00 0.00 O ATOM 1362 OD2 ASP A 714 14.516 -13.910 -1.311 1.00 0.00 O ATOM 0 H ASP A 714 10.125 -12.202 -3.727 1.00 0.00 H new ATOM 0 HA ASP A 714 11.765 -14.452 -2.969 1.00 0.00 H new ATOM 0 HB2 ASP A 714 12.740 -11.720 -2.547 1.00 0.00 H new ATOM 0 HB3 ASP A 714 12.482 -12.538 -1.019 1.00 0.00 H new ATOM 1367 N PRO A 715 10.325 -14.597 -0.874 1.00 0.00 N ATOM 1368 CA PRO A 715 9.276 -14.828 0.164 1.00 0.00 C ATOM 1369 C PRO A 715 9.433 -13.920 1.382 1.00 0.00 C ATOM 1370 O PRO A 715 8.544 -13.855 2.231 1.00 0.00 O ATOM 1371 CB PRO A 715 9.477 -16.293 0.551 1.00 0.00 C ATOM 1372 CG PRO A 715 10.917 -16.572 0.282 1.00 0.00 C ATOM 1373 CD PRO A 715 11.320 -15.682 -0.896 1.00 0.00 C ATOM 0 HA PRO A 715 8.279 -14.605 -0.215 1.00 0.00 H new ATOM 0 HB2 PRO A 715 9.232 -16.461 1.600 1.00 0.00 H new ATOM 0 HB3 PRO A 715 8.832 -16.948 -0.035 1.00 0.00 H new ATOM 0 HG2 PRO A 715 11.525 -16.353 1.160 1.00 0.00 H new ATOM 0 HG3 PRO A 715 11.070 -17.624 0.043 1.00 0.00 H new ATOM 0 HD2 PRO A 715 12.333 -15.298 -0.779 1.00 0.00 H new ATOM 0 HD3 PRO A 715 11.294 -16.230 -1.838 1.00 0.00 H new ATOM 1381 N LEU A 716 10.563 -13.227 1.470 1.00 0.00 N ATOM 1382 CA LEU A 716 10.805 -12.340 2.602 1.00 0.00 C ATOM 1383 C LEU A 716 9.901 -11.117 2.524 1.00 0.00 C ATOM 1384 O LEU A 716 9.405 -10.637 3.542 1.00 0.00 O ATOM 1385 CB LEU A 716 12.271 -11.893 2.633 1.00 0.00 C ATOM 1386 CG LEU A 716 13.176 -13.069 3.023 1.00 0.00 C ATOM 1387 CD1 LEU A 716 13.138 -13.270 4.541 1.00 0.00 C ATOM 1388 CD2 LEU A 716 12.699 -14.348 2.328 1.00 0.00 C ATOM 0 H LEU A 716 11.316 -13.261 0.782 1.00 0.00 H new ATOM 0 HA LEU A 716 10.582 -12.891 3.516 1.00 0.00 H new ATOM 0 HB2 LEU A 716 12.562 -11.509 1.655 1.00 0.00 H new ATOM 0 HB3 LEU A 716 12.395 -11.077 3.345 1.00 0.00 H new ATOM 0 HG LEU A 716 14.197 -12.849 2.711 1.00 0.00 H new ATOM 0 HD11 LEU A 716 13.782 -14.106 4.814 1.00 0.00 H new ATOM 0 HD12 LEU A 716 13.489 -12.365 5.037 1.00 0.00 H new ATOM 0 HD13 LEU A 716 12.116 -13.482 4.854 1.00 0.00 H new ATOM 0 HD21 LEU A 716 13.346 -15.178 2.610 1.00 0.00 H new ATOM 0 HD22 LEU A 716 11.675 -14.567 2.632 1.00 0.00 H new ATOM 0 HD23 LEU A 716 12.735 -14.210 1.247 1.00 0.00 H new ATOM 1400 N LEU A 717 9.676 -10.623 1.312 1.00 0.00 N ATOM 1401 CA LEU A 717 8.815 -9.465 1.136 1.00 0.00 C ATOM 1402 C LEU A 717 7.360 -9.897 1.228 1.00 0.00 C ATOM 1403 O LEU A 717 6.530 -9.205 1.818 1.00 0.00 O ATOM 1404 CB LEU A 717 9.083 -8.814 -0.223 1.00 0.00 C ATOM 1405 CG LEU A 717 10.558 -8.418 -0.314 1.00 0.00 C ATOM 1406 CD1 LEU A 717 10.794 -7.612 -1.593 1.00 0.00 C ATOM 1407 CD2 LEU A 717 10.934 -7.569 0.903 1.00 0.00 C ATOM 0 H LEU A 717 10.072 -11.000 0.451 1.00 0.00 H new ATOM 0 HA LEU A 717 9.025 -8.738 1.920 1.00 0.00 H new ATOM 0 HB2 LEU A 717 8.831 -9.506 -1.026 1.00 0.00 H new ATOM 0 HB3 LEU A 717 8.451 -7.935 -0.349 1.00 0.00 H new ATOM 0 HG LEU A 717 11.174 -9.317 -0.334 1.00 0.00 H new ATOM 0 HD11 LEU A 717 11.845 -7.330 -1.657 1.00 0.00 H new ATOM 0 HD12 LEU A 717 10.527 -8.218 -2.459 1.00 0.00 H new ATOM 0 HD13 LEU A 717 10.178 -6.713 -1.575 1.00 0.00 H new ATOM 0 HD21 LEU A 717 11.985 -7.286 0.839 1.00 0.00 H new ATOM 0 HD22 LEU A 717 10.317 -6.670 0.924 1.00 0.00 H new ATOM 0 HD23 LEU A 717 10.768 -8.145 1.814 1.00 0.00 H new ATOM 1419 N THR A 718 7.063 -11.064 0.663 1.00 0.00 N ATOM 1420 CA THR A 718 5.711 -11.598 0.711 1.00 0.00 C ATOM 1421 C THR A 718 5.319 -11.883 2.153 1.00 0.00 C ATOM 1422 O THR A 718 4.189 -11.620 2.566 1.00 0.00 O ATOM 1423 CB THR A 718 5.617 -12.887 -0.107 1.00 0.00 C ATOM 1424 OG1 THR A 718 6.019 -12.631 -1.446 1.00 0.00 O ATOM 1425 CG2 THR A 718 4.175 -13.394 -0.089 1.00 0.00 C ATOM 0 H THR A 718 7.736 -11.652 0.171 1.00 0.00 H new ATOM 0 HA THR A 718 5.031 -10.859 0.287 1.00 0.00 H new ATOM 0 HB THR A 718 6.272 -13.643 0.326 1.00 0.00 H new ATOM 0 HG1 THR A 718 5.960 -13.458 -1.969 1.00 0.00 H new ATOM 0 HG21 THR A 718 4.105 -14.313 -0.671 1.00 0.00 H new ATOM 0 HG22 THR A 718 3.872 -13.592 0.939 1.00 0.00 H new ATOM 0 HG23 THR A 718 3.519 -12.639 -0.522 1.00 0.00 H new ATOM 1433 N ALA A 719 6.266 -12.422 2.919 1.00 0.00 N ATOM 1434 CA ALA A 719 6.011 -12.736 4.317 1.00 0.00 C ATOM 1435 C ALA A 719 5.752 -11.459 5.105 1.00 0.00 C ATOM 1436 O ALA A 719 4.901 -11.427 5.994 1.00 0.00 O ATOM 1437 CB ALA A 719 7.208 -13.479 4.913 1.00 0.00 C ATOM 0 H ALA A 719 7.207 -12.647 2.596 1.00 0.00 H new ATOM 0 HA ALA A 719 5.129 -13.373 4.377 1.00 0.00 H new ATOM 0 HB1 ALA A 719 7.009 -13.710 5.959 1.00 0.00 H new ATOM 0 HB2 ALA A 719 7.373 -14.405 4.362 1.00 0.00 H new ATOM 0 HB3 ALA A 719 8.097 -12.852 4.843 1.00 0.00 H new ATOM 1443 N GLN A 720 6.488 -10.404 4.765 1.00 0.00 N ATOM 1444 CA GLN A 720 6.328 -9.121 5.438 1.00 0.00 C ATOM 1445 C GLN A 720 5.070 -8.414 4.941 1.00 0.00 C ATOM 1446 O GLN A 720 4.491 -7.587 5.645 1.00 0.00 O ATOM 1447 CB GLN A 720 7.553 -8.239 5.187 1.00 0.00 C ATOM 1448 CG GLN A 720 8.777 -8.852 5.872 1.00 0.00 C ATOM 1449 CD GLN A 720 10.026 -8.049 5.522 1.00 0.00 C ATOM 1450 OE1 GLN A 720 10.016 -7.271 4.569 1.00 0.00 O ATOM 1451 NE2 GLN A 720 11.107 -8.191 6.240 1.00 0.00 N ATOM 0 H GLN A 720 7.197 -10.413 4.032 1.00 0.00 H new ATOM 0 HA GLN A 720 6.231 -9.300 6.509 1.00 0.00 H new ATOM 0 HB2 GLN A 720 7.732 -8.145 4.116 1.00 0.00 H new ATOM 0 HB3 GLN A 720 7.375 -7.234 5.570 1.00 0.00 H new ATOM 0 HG2 GLN A 720 8.632 -8.863 6.952 1.00 0.00 H new ATOM 0 HG3 GLN A 720 8.900 -9.888 5.556 1.00 0.00 H new ATOM 0 HE21 GLN A 720 11.114 -8.836 7.030 1.00 0.00 H new ATOM 0 HE22 GLN A 720 11.945 -7.656 6.011 1.00 0.00 H new ATOM 1460 N ALA A 721 4.656 -8.743 3.720 1.00 0.00 N ATOM 1461 CA ALA A 721 3.467 -8.132 3.134 1.00 0.00 C ATOM 1462 C ALA A 721 2.202 -8.643 3.819 1.00 0.00 C ATOM 1463 O ALA A 721 2.139 -9.796 4.245 1.00 0.00 O ATOM 1464 CB ALA A 721 3.398 -8.442 1.637 1.00 0.00 C ATOM 0 H ALA A 721 5.123 -9.424 3.121 1.00 0.00 H new ATOM 0 HA ALA A 721 3.534 -7.054 3.278 1.00 0.00 H new ATOM 0 HB1 ALA A 721 2.507 -7.981 1.211 1.00 0.00 H new ATOM 0 HB2 ALA A 721 4.284 -8.045 1.142 1.00 0.00 H new ATOM 0 HB3 ALA A 721 3.354 -9.521 1.491 1.00 0.00 H new ATOM 1470 N SER A 722 1.195 -7.778 3.920 1.00 0.00 N ATOM 1471 CA SER A 722 -0.063 -8.156 4.556 1.00 0.00 C ATOM 1472 C SER A 722 -0.989 -8.840 3.554 1.00 0.00 C ATOM 1473 O SER A 722 -1.833 -9.653 3.932 1.00 0.00 O ATOM 1474 CB SER A 722 -0.758 -6.920 5.127 1.00 0.00 C ATOM 1475 OG SER A 722 -1.868 -7.331 5.917 1.00 0.00 O ATOM 0 H SER A 722 1.225 -6.819 3.573 1.00 0.00 H new ATOM 0 HA SER A 722 0.161 -8.852 5.364 1.00 0.00 H new ATOM 0 HB2 SER A 722 -0.059 -6.342 5.732 1.00 0.00 H new ATOM 0 HB3 SER A 722 -1.092 -6.270 4.319 1.00 0.00 H new ATOM 0 HG SER A 722 -1.553 -7.618 6.800 1.00 0.00 H new ATOM 1481 N ALA A 723 -0.831 -8.507 2.278 1.00 0.00 N ATOM 1482 CA ALA A 723 -1.669 -9.104 1.244 1.00 0.00 C ATOM 1483 C ALA A 723 -1.148 -8.767 -0.150 1.00 0.00 C ATOM 1484 O ALA A 723 -0.474 -7.757 -0.346 1.00 0.00 O ATOM 1485 CB ALA A 723 -3.107 -8.602 1.386 1.00 0.00 C ATOM 0 H ALA A 723 -0.141 -7.837 1.938 1.00 0.00 H new ATOM 0 HA ALA A 723 -1.642 -10.186 1.370 1.00 0.00 H new ATOM 0 HB1 ALA A 723 -3.728 -9.052 0.611 1.00 0.00 H new ATOM 0 HB2 ALA A 723 -3.494 -8.879 2.367 1.00 0.00 H new ATOM 0 HB3 ALA A 723 -3.126 -7.517 1.282 1.00 0.00 H new ATOM 1491 N ILE A 724 -1.469 -9.625 -1.114 1.00 0.00 N ATOM 1492 CA ILE A 724 -1.036 -9.419 -2.490 1.00 0.00 C ATOM 1493 C ILE A 724 -2.067 -9.996 -3.455 1.00 0.00 C ATOM 1494 O ILE A 724 -2.357 -11.192 -3.421 1.00 0.00 O ATOM 1495 CB ILE A 724 0.312 -10.106 -2.723 1.00 0.00 C ATOM 1496 CG1 ILE A 724 1.310 -9.660 -1.652 1.00 0.00 C ATOM 1497 CG2 ILE A 724 0.848 -9.723 -4.104 1.00 0.00 C ATOM 1498 CD1 ILE A 724 2.658 -10.343 -1.895 1.00 0.00 C ATOM 0 H ILE A 724 -2.026 -10.467 -0.967 1.00 0.00 H new ATOM 0 HA ILE A 724 -0.934 -8.348 -2.666 1.00 0.00 H new ATOM 0 HB ILE A 724 0.179 -11.186 -2.668 1.00 0.00 H new ATOM 0 HG12 ILE A 724 1.429 -8.577 -1.679 1.00 0.00 H new ATOM 0 HG13 ILE A 724 0.934 -9.915 -0.661 1.00 0.00 H new ATOM 0 HG21 ILE A 724 1.808 -10.212 -4.270 1.00 0.00 H new ATOM 0 HG22 ILE A 724 0.141 -10.042 -4.870 1.00 0.00 H new ATOM 0 HG23 ILE A 724 0.978 -8.642 -4.157 1.00 0.00 H new ATOM 0 HD11 ILE A 724 3.369 -10.026 -1.132 1.00 0.00 H new ATOM 0 HD12 ILE A 724 2.532 -11.425 -1.846 1.00 0.00 H new ATOM 0 HD13 ILE A 724 3.034 -10.066 -2.880 1.00 0.00 H new ATOM 1510 N LEU A 725 -2.624 -9.145 -4.311 1.00 0.00 N ATOM 1511 CA LEU A 725 -3.625 -9.604 -5.269 1.00 0.00 C ATOM 1512 C LEU A 725 -3.025 -9.716 -6.667 1.00 0.00 C ATOM 1513 O LEU A 725 -2.633 -8.715 -7.266 1.00 0.00 O ATOM 1514 CB LEU A 725 -4.802 -8.629 -5.305 1.00 0.00 C ATOM 1515 CG LEU A 725 -5.342 -8.418 -3.890 1.00 0.00 C ATOM 1516 CD1 LEU A 725 -6.661 -7.647 -3.960 1.00 0.00 C ATOM 1517 CD2 LEU A 725 -5.575 -9.776 -3.223 1.00 0.00 C ATOM 0 H LEU A 725 -2.405 -8.150 -4.362 1.00 0.00 H new ATOM 0 HA LEU A 725 -3.971 -10.588 -4.952 1.00 0.00 H new ATOM 0 HB2 LEU A 725 -4.484 -7.676 -5.729 1.00 0.00 H new ATOM 0 HB3 LEU A 725 -5.589 -9.018 -5.950 1.00 0.00 H new ATOM 0 HG LEU A 725 -4.619 -7.849 -3.305 1.00 0.00 H new ATOM 0 HD11 LEU A 725 -7.048 -7.495 -2.952 1.00 0.00 H new ATOM 0 HD12 LEU A 725 -6.492 -6.680 -4.433 1.00 0.00 H new ATOM 0 HD13 LEU A 725 -7.384 -8.216 -4.545 1.00 0.00 H new ATOM 0 HD21 LEU A 725 -5.960 -9.625 -2.214 1.00 0.00 H new ATOM 0 HD22 LEU A 725 -6.297 -10.348 -3.805 1.00 0.00 H new ATOM 0 HD23 LEU A 725 -4.634 -10.323 -3.174 1.00 0.00 H new ATOM 1529 N SER A 726 -2.964 -10.939 -7.183 1.00 0.00 N ATOM 1530 CA SER A 726 -2.418 -11.168 -8.514 1.00 0.00 C ATOM 1531 C SER A 726 -3.354 -10.614 -9.582 1.00 0.00 C ATOM 1532 O SER A 726 -2.908 -10.093 -10.604 1.00 0.00 O ATOM 1533 CB SER A 726 -2.211 -12.664 -8.743 1.00 0.00 C ATOM 1534 OG SER A 726 -1.536 -13.218 -7.622 1.00 0.00 O ATOM 0 H SER A 726 -3.284 -11.781 -6.703 1.00 0.00 H new ATOM 0 HA SER A 726 -1.460 -10.653 -8.585 1.00 0.00 H new ATOM 0 HB2 SER A 726 -3.172 -13.159 -8.885 1.00 0.00 H new ATOM 0 HB3 SER A 726 -1.630 -12.828 -9.650 1.00 0.00 H new ATOM 0 HG SER A 726 -1.402 -14.179 -7.763 1.00 0.00 H new ATOM 1540 N LYS A 727 -4.653 -10.739 -9.335 1.00 0.00 N ATOM 1541 CA LYS A 727 -5.656 -10.259 -10.279 1.00 0.00 C ATOM 1542 C LYS A 727 -6.754 -9.491 -9.548 1.00 0.00 C ATOM 1543 O LYS A 727 -7.692 -10.089 -9.022 1.00 0.00 O ATOM 1544 CB LYS A 727 -6.275 -11.445 -11.021 1.00 0.00 C ATOM 1545 CG LYS A 727 -6.181 -12.699 -10.148 1.00 0.00 C ATOM 1546 CD LYS A 727 -7.407 -13.581 -10.387 1.00 0.00 C ATOM 1547 CE LYS A 727 -7.425 -14.715 -9.361 1.00 0.00 C ATOM 1548 NZ LYS A 727 -8.536 -15.656 -9.679 1.00 0.00 N ATOM 0 H LYS A 727 -5.036 -11.167 -8.492 1.00 0.00 H new ATOM 0 HA LYS A 727 -5.171 -9.591 -10.991 1.00 0.00 H new ATOM 0 HB2 LYS A 727 -7.317 -11.234 -11.261 1.00 0.00 H new ATOM 0 HB3 LYS A 727 -5.757 -11.607 -11.966 1.00 0.00 H new ATOM 0 HG2 LYS A 727 -5.271 -13.251 -10.383 1.00 0.00 H new ATOM 0 HG3 LYS A 727 -6.121 -12.419 -9.096 1.00 0.00 H new ATOM 0 HD2 LYS A 727 -8.317 -12.987 -10.305 1.00 0.00 H new ATOM 0 HD3 LYS A 727 -7.383 -13.990 -11.397 1.00 0.00 H new ATOM 0 HE2 LYS A 727 -6.472 -15.244 -9.371 1.00 0.00 H new ATOM 0 HE3 LYS A 727 -7.554 -14.310 -8.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 727 -8.548 -16.427 -8.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 727 -9.442 -15.147 -9.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 727 -8.394 -16.052 -10.630 1.00 0.00 H new ATOM 1562 N PRO A 728 -6.656 -8.188 -9.504 1.00 0.00 N ATOM 1563 CA PRO A 728 -7.667 -7.337 -8.817 1.00 0.00 C ATOM 1564 C PRO A 728 -9.091 -7.714 -9.214 1.00 0.00 C ATOM 1565 O PRO A 728 -9.392 -7.895 -10.394 1.00 0.00 O ATOM 1566 CB PRO A 728 -7.325 -5.919 -9.278 1.00 0.00 C ATOM 1567 CG PRO A 728 -5.877 -5.959 -9.641 1.00 0.00 C ATOM 1568 CD PRO A 728 -5.577 -7.387 -10.101 1.00 0.00 C ATOM 0 HA PRO A 728 -7.634 -7.452 -7.734 1.00 0.00 H new ATOM 0 HB2 PRO A 728 -7.936 -5.625 -10.131 1.00 0.00 H new ATOM 0 HB3 PRO A 728 -7.512 -5.193 -8.487 1.00 0.00 H new ATOM 0 HG2 PRO A 728 -5.657 -5.243 -10.433 1.00 0.00 H new ATOM 0 HG3 PRO A 728 -5.256 -5.690 -8.786 1.00 0.00 H new ATOM 0 HD2 PRO A 728 -5.577 -7.464 -11.188 1.00 0.00 H new ATOM 0 HD3 PRO A 728 -4.597 -7.719 -9.758 1.00 0.00 H new ATOM 1576 N LEU A 729 -9.959 -7.836 -8.217 1.00 0.00 N ATOM 1577 CA LEU A 729 -11.349 -8.200 -8.460 1.00 0.00 C ATOM 1578 C LEU A 729 -12.137 -8.181 -7.155 1.00 0.00 C ATOM 1579 O LEU A 729 -11.646 -8.631 -6.120 1.00 0.00 O ATOM 1580 CB LEU A 729 -11.421 -9.600 -9.077 1.00 0.00 C ATOM 1581 CG LEU A 729 -12.871 -9.922 -9.450 1.00 0.00 C ATOM 1582 CD1 LEU A 729 -13.247 -9.197 -10.745 1.00 0.00 C ATOM 1583 CD2 LEU A 729 -13.022 -11.432 -9.650 1.00 0.00 C ATOM 0 H LEU A 729 -9.726 -7.689 -7.235 1.00 0.00 H new ATOM 0 HA LEU A 729 -11.783 -7.475 -9.149 1.00 0.00 H new ATOM 0 HB2 LEU A 729 -10.787 -9.652 -9.962 1.00 0.00 H new ATOM 0 HB3 LEU A 729 -11.043 -10.340 -8.371 1.00 0.00 H new ATOM 0 HG LEU A 729 -13.530 -9.591 -8.648 1.00 0.00 H new ATOM 0 HD11 LEU A 729 -14.279 -9.430 -11.006 1.00 0.00 H new ATOM 0 HD12 LEU A 729 -13.142 -8.121 -10.603 1.00 0.00 H new ATOM 0 HD13 LEU A 729 -12.587 -9.523 -11.549 1.00 0.00 H new ATOM 0 HD21 LEU A 729 -14.054 -11.662 -9.916 1.00 0.00 H new ATOM 0 HD22 LEU A 729 -12.359 -11.761 -10.450 1.00 0.00 H new ATOM 0 HD23 LEU A 729 -12.761 -11.949 -8.727 1.00 0.00 H new ATOM 1595 N ASP A 730 -13.356 -7.657 -7.209 1.00 0.00 N ATOM 1596 CA ASP A 730 -14.198 -7.586 -6.020 1.00 0.00 C ATOM 1597 C ASP A 730 -13.550 -6.713 -4.951 1.00 0.00 C ATOM 1598 O ASP A 730 -13.014 -7.217 -3.964 1.00 0.00 O ATOM 1599 CB ASP A 730 -14.434 -8.989 -5.455 1.00 0.00 C ATOM 1600 CG ASP A 730 -15.179 -9.846 -6.472 1.00 0.00 C ATOM 1601 OD1 ASP A 730 -15.431 -9.356 -7.559 1.00 0.00 O ATOM 1602 OD2 ASP A 730 -15.488 -10.981 -6.147 1.00 0.00 O ATOM 0 H ASP A 730 -13.781 -7.278 -8.055 1.00 0.00 H new ATOM 0 HA ASP A 730 -15.152 -7.144 -6.307 1.00 0.00 H new ATOM 0 HB2 ASP A 730 -13.480 -9.454 -5.205 1.00 0.00 H new ATOM 0 HB3 ASP A 730 -15.009 -8.925 -4.531 1.00 0.00 H new ATOM 1607 N PRO A 731 -13.594 -5.422 -5.130 1.00 0.00 N ATOM 1608 CA PRO A 731 -13.004 -4.453 -4.161 1.00 0.00 C ATOM 1609 C PRO A 731 -13.506 -4.697 -2.739 1.00 0.00 C ATOM 1610 O PRO A 731 -13.004 -4.107 -1.780 1.00 0.00 O ATOM 1611 CB PRO A 731 -13.466 -3.086 -4.674 1.00 0.00 C ATOM 1612 CG PRO A 731 -13.793 -3.284 -6.117 1.00 0.00 C ATOM 1613 CD PRO A 731 -14.211 -4.746 -6.280 1.00 0.00 C ATOM 0 HA PRO A 731 -11.919 -4.541 -4.104 1.00 0.00 H new ATOM 0 HB2 PRO A 731 -14.336 -2.734 -4.120 1.00 0.00 H new ATOM 0 HB3 PRO A 731 -12.684 -2.337 -4.549 1.00 0.00 H new ATOM 0 HG2 PRO A 731 -14.597 -2.616 -6.426 1.00 0.00 H new ATOM 0 HG3 PRO A 731 -12.930 -3.057 -6.743 1.00 0.00 H new ATOM 0 HD2 PRO A 731 -15.296 -4.854 -6.272 1.00 0.00 H new ATOM 0 HD3 PRO A 731 -13.856 -5.160 -7.224 1.00 0.00 H new ATOM 1621 N GLN A 732 -14.502 -5.569 -2.611 1.00 0.00 N ATOM 1622 CA GLN A 732 -15.066 -5.878 -1.303 1.00 0.00 C ATOM 1623 C GLN A 732 -14.072 -6.670 -0.466 1.00 0.00 C ATOM 1624 O GLN A 732 -13.987 -6.487 0.748 1.00 0.00 O ATOM 1625 CB GLN A 732 -16.357 -6.684 -1.461 1.00 0.00 C ATOM 1626 CG GLN A 732 -17.415 -5.828 -2.159 1.00 0.00 C ATOM 1627 CD GLN A 732 -18.706 -6.622 -2.317 1.00 0.00 C ATOM 1628 OE1 GLN A 732 -18.711 -7.840 -2.136 1.00 0.00 O ATOM 1629 NE2 GLN A 732 -19.808 -6.003 -2.641 1.00 0.00 N ATOM 0 H GLN A 732 -14.931 -6.069 -3.389 1.00 0.00 H new ATOM 0 HA GLN A 732 -15.287 -4.939 -0.796 1.00 0.00 H new ATOM 0 HB2 GLN A 732 -16.165 -7.587 -2.041 1.00 0.00 H new ATOM 0 HB3 GLN A 732 -16.720 -7.003 -0.484 1.00 0.00 H new ATOM 0 HG2 GLN A 732 -17.603 -4.924 -1.580 1.00 0.00 H new ATOM 0 HG3 GLN A 732 -17.051 -5.511 -3.136 1.00 0.00 H new ATOM 0 HE21 GLN A 732 -19.801 -4.994 -2.790 1.00 0.00 H new ATOM 0 HE22 GLN A 732 -20.676 -6.528 -2.745 1.00 0.00 H new ATOM 1638 N LEU A 733 -13.311 -7.541 -1.118 1.00 0.00 N ATOM 1639 CA LEU A 733 -12.320 -8.337 -0.408 1.00 0.00 C ATOM 1640 C LEU A 733 -11.211 -7.434 0.114 1.00 0.00 C ATOM 1641 O LEU A 733 -10.727 -7.609 1.232 1.00 0.00 O ATOM 1642 CB LEU A 733 -11.727 -9.398 -1.335 1.00 0.00 C ATOM 1643 CG LEU A 733 -10.755 -10.275 -0.545 1.00 0.00 C ATOM 1644 CD1 LEU A 733 -11.539 -11.164 0.422 1.00 0.00 C ATOM 1645 CD2 LEU A 733 -9.958 -11.153 -1.512 1.00 0.00 C ATOM 0 H LEU A 733 -13.360 -7.712 -2.122 1.00 0.00 H new ATOM 0 HA LEU A 733 -12.807 -8.835 0.431 1.00 0.00 H new ATOM 0 HB2 LEU A 733 -12.522 -10.010 -1.761 1.00 0.00 H new ATOM 0 HB3 LEU A 733 -11.210 -8.921 -2.168 1.00 0.00 H new ATOM 0 HG LEU A 733 -10.071 -9.641 0.018 1.00 0.00 H new ATOM 0 HD11 LEU A 733 -10.846 -11.789 0.985 1.00 0.00 H new ATOM 0 HD12 LEU A 733 -12.107 -10.539 1.112 1.00 0.00 H new ATOM 0 HD13 LEU A 733 -12.224 -11.798 -0.141 1.00 0.00 H new ATOM 0 HD21 LEU A 733 -9.265 -11.778 -0.949 1.00 0.00 H new ATOM 0 HD22 LEU A 733 -10.642 -11.787 -2.076 1.00 0.00 H new ATOM 0 HD23 LEU A 733 -9.398 -10.520 -2.201 1.00 0.00 H new ATOM 1657 N LEU A 734 -10.824 -6.458 -0.701 1.00 0.00 N ATOM 1658 CA LEU A 734 -9.786 -5.519 -0.306 1.00 0.00 C ATOM 1659 C LEU A 734 -10.197 -4.828 0.987 1.00 0.00 C ATOM 1660 O LEU A 734 -9.384 -4.630 1.890 1.00 0.00 O ATOM 1661 CB LEU A 734 -9.580 -4.478 -1.410 1.00 0.00 C ATOM 1662 CG LEU A 734 -8.359 -3.614 -1.087 1.00 0.00 C ATOM 1663 CD1 LEU A 734 -7.086 -4.358 -1.495 1.00 0.00 C ATOM 1664 CD2 LEU A 734 -8.448 -2.298 -1.862 1.00 0.00 C ATOM 0 H LEU A 734 -11.211 -6.299 -1.631 1.00 0.00 H new ATOM 0 HA LEU A 734 -8.851 -6.056 -0.148 1.00 0.00 H new ATOM 0 HB2 LEU A 734 -9.441 -4.975 -2.370 1.00 0.00 H new ATOM 0 HB3 LEU A 734 -10.467 -3.851 -1.501 1.00 0.00 H new ATOM 0 HG LEU A 734 -8.333 -3.407 -0.017 1.00 0.00 H new ATOM 0 HD11 LEU A 734 -6.216 -3.743 -1.265 1.00 0.00 H new ATOM 0 HD12 LEU A 734 -7.022 -5.297 -0.946 1.00 0.00 H new ATOM 0 HD13 LEU A 734 -7.112 -4.564 -2.565 1.00 0.00 H new ATOM 0 HD21 LEU A 734 -7.579 -1.681 -1.633 1.00 0.00 H new ATOM 0 HD22 LEU A 734 -8.473 -2.507 -2.932 1.00 0.00 H new ATOM 0 HD23 LEU A 734 -9.355 -1.767 -1.574 1.00 0.00 H new ATOM 1676 N LEU A 735 -11.478 -4.476 1.066 1.00 0.00 N ATOM 1677 CA LEU A 735 -12.011 -3.815 2.251 1.00 0.00 C ATOM 1678 C LEU A 735 -11.904 -4.724 3.471 1.00 0.00 C ATOM 1679 O LEU A 735 -11.610 -4.264 4.574 1.00 0.00 O ATOM 1680 CB LEU A 735 -13.478 -3.444 2.024 1.00 0.00 C ATOM 1681 CG LEU A 735 -13.981 -2.608 3.202 1.00 0.00 C ATOM 1682 CD1 LEU A 735 -14.763 -1.406 2.675 1.00 0.00 C ATOM 1683 CD2 LEU A 735 -14.895 -3.465 4.080 1.00 0.00 C ATOM 0 H LEU A 735 -12.162 -4.637 0.327 1.00 0.00 H new ATOM 0 HA LEU A 735 -11.426 -2.913 2.431 1.00 0.00 H new ATOM 0 HB2 LEU A 735 -13.583 -2.883 1.095 1.00 0.00 H new ATOM 0 HB3 LEU A 735 -14.081 -4.346 1.921 1.00 0.00 H new ATOM 0 HG LEU A 735 -13.132 -2.260 3.791 1.00 0.00 H new ATOM 0 HD11 LEU A 735 -15.122 -0.809 3.514 1.00 0.00 H new ATOM 0 HD12 LEU A 735 -14.113 -0.796 2.048 1.00 0.00 H new ATOM 0 HD13 LEU A 735 -15.612 -1.754 2.087 1.00 0.00 H new ATOM 0 HD21 LEU A 735 -15.254 -2.871 4.920 1.00 0.00 H new ATOM 0 HD22 LEU A 735 -15.744 -3.812 3.491 1.00 0.00 H new ATOM 0 HD23 LEU A 735 -14.338 -4.324 4.455 1.00 0.00 H new ATOM 1695 N THR A 736 -12.155 -6.014 3.266 1.00 0.00 N ATOM 1696 CA THR A 736 -12.093 -6.978 4.360 1.00 0.00 C ATOM 1697 C THR A 736 -10.705 -6.996 4.994 1.00 0.00 C ATOM 1698 O THR A 736 -10.573 -6.958 6.217 1.00 0.00 O ATOM 1699 CB THR A 736 -12.439 -8.376 3.840 1.00 0.00 C ATOM 1700 OG1 THR A 736 -13.722 -8.348 3.229 1.00 0.00 O ATOM 1701 CG2 THR A 736 -12.444 -9.370 5.001 1.00 0.00 C ATOM 0 H THR A 736 -12.401 -6.413 2.360 1.00 0.00 H new ATOM 0 HA THR A 736 -12.816 -6.680 5.120 1.00 0.00 H new ATOM 0 HB THR A 736 -11.694 -8.685 3.107 1.00 0.00 H new ATOM 0 HG1 THR A 736 -13.668 -7.867 2.377 1.00 0.00 H new ATOM 0 HG21 THR A 736 -12.691 -10.364 4.628 1.00 0.00 H new ATOM 0 HG22 THR A 736 -11.458 -9.391 5.466 1.00 0.00 H new ATOM 0 HG23 THR A 736 -13.187 -9.065 5.738 1.00 0.00 H new ATOM 1709 N THR A 737 -9.673 -7.048 4.158 1.00 0.00 N ATOM 1710 CA THR A 737 -8.301 -7.065 4.657 1.00 0.00 C ATOM 1711 C THR A 737 -7.984 -5.770 5.399 1.00 0.00 C ATOM 1712 O THR A 737 -7.350 -5.787 6.454 1.00 0.00 O ATOM 1713 CB THR A 737 -7.322 -7.246 3.495 1.00 0.00 C ATOM 1714 OG1 THR A 737 -7.633 -8.446 2.801 1.00 0.00 O ATOM 1715 CG2 THR A 737 -5.893 -7.320 4.035 1.00 0.00 C ATOM 0 H THR A 737 -9.758 -7.079 3.142 1.00 0.00 H new ATOM 0 HA THR A 737 -8.197 -7.901 5.349 1.00 0.00 H new ATOM 0 HB THR A 737 -7.405 -6.400 2.813 1.00 0.00 H new ATOM 0 HG1 THR A 737 -7.009 -8.564 2.055 1.00 0.00 H new ATOM 0 HG21 THR A 737 -5.197 -7.449 3.206 1.00 0.00 H new ATOM 0 HG22 THR A 737 -5.657 -6.398 4.567 1.00 0.00 H new ATOM 0 HG23 THR A 737 -5.805 -8.165 4.717 1.00 0.00 H new ATOM 1723 N LEU A 738 -8.436 -4.652 4.844 1.00 0.00 N ATOM 1724 CA LEU A 738 -8.202 -3.354 5.465 1.00 0.00 C ATOM 1725 C LEU A 738 -8.894 -3.292 6.825 1.00 0.00 C ATOM 1726 O LEU A 738 -8.363 -2.731 7.784 1.00 0.00 O ATOM 1727 CB LEU A 738 -8.733 -2.243 4.554 1.00 0.00 C ATOM 1728 CG LEU A 738 -8.324 -0.878 5.113 1.00 0.00 C ATOM 1729 CD1 LEU A 738 -8.110 0.106 3.961 1.00 0.00 C ATOM 1730 CD2 LEU A 738 -9.433 -0.352 6.026 1.00 0.00 C ATOM 0 H LEU A 738 -8.963 -4.617 3.971 1.00 0.00 H new ATOM 0 HA LEU A 738 -7.131 -3.215 5.610 1.00 0.00 H new ATOM 0 HB2 LEU A 738 -8.338 -2.367 3.545 1.00 0.00 H new ATOM 0 HB3 LEU A 738 -9.819 -2.307 4.482 1.00 0.00 H new ATOM 0 HG LEU A 738 -7.398 -0.981 5.679 1.00 0.00 H new ATOM 0 HD11 LEU A 738 -7.819 1.077 4.361 1.00 0.00 H new ATOM 0 HD12 LEU A 738 -7.323 -0.267 3.305 1.00 0.00 H new ATOM 0 HD13 LEU A 738 -9.035 0.210 3.394 1.00 0.00 H new ATOM 0 HD21 LEU A 738 -9.145 0.620 6.426 1.00 0.00 H new ATOM 0 HD22 LEU A 738 -10.356 -0.250 5.456 1.00 0.00 H new ATOM 0 HD23 LEU A 738 -9.589 -1.050 6.848 1.00 0.00 H new ATOM 1742 N GLN A 739 -10.080 -3.887 6.894 1.00 0.00 N ATOM 1743 CA GLN A 739 -10.852 -3.919 8.132 1.00 0.00 C ATOM 1744 C GLN A 739 -10.126 -4.727 9.202 1.00 0.00 C ATOM 1745 O GLN A 739 -10.274 -4.470 10.397 1.00 0.00 O ATOM 1746 CB GLN A 739 -12.221 -4.548 7.870 1.00 0.00 C ATOM 1747 CG GLN A 739 -13.087 -4.432 9.125 1.00 0.00 C ATOM 1748 CD GLN A 739 -14.372 -5.233 8.944 1.00 0.00 C ATOM 1749 OE1 GLN A 739 -15.180 -5.331 9.867 1.00 0.00 O ATOM 1750 NE2 GLN A 739 -14.607 -5.819 7.801 1.00 0.00 N ATOM 0 H GLN A 739 -10.529 -4.354 6.106 1.00 0.00 H new ATOM 0 HA GLN A 739 -10.974 -2.895 8.486 1.00 0.00 H new ATOM 0 HB2 GLN A 739 -12.708 -4.048 7.032 1.00 0.00 H new ATOM 0 HB3 GLN A 739 -12.104 -5.595 7.592 1.00 0.00 H new ATOM 0 HG2 GLN A 739 -12.538 -4.800 9.992 1.00 0.00 H new ATOM 0 HG3 GLN A 739 -13.324 -3.386 9.318 1.00 0.00 H new ATOM 0 HE21 GLN A 739 -13.935 -5.736 7.038 1.00 0.00 H new ATOM 0 HE22 GLN A 739 -15.462 -6.360 7.671 1.00 0.00 H new ATOM 1759 N GLY A 740 -9.360 -5.721 8.763 1.00 0.00 N ATOM 1760 CA GLY A 740 -8.630 -6.587 9.683 1.00 0.00 C ATOM 1761 C GLY A 740 -7.959 -5.799 10.806 1.00 0.00 C ATOM 1762 O GLY A 740 -7.384 -6.389 11.721 1.00 0.00 O ATOM 0 H GLY A 740 -9.229 -5.947 7.777 1.00 0.00 H new ATOM 0 HA2 GLY A 740 -9.315 -7.317 10.113 1.00 0.00 H new ATOM 0 HA3 GLY A 740 -7.874 -7.146 9.131 1.00 0.00 H new ATOM 1766 N LEU A 741 -8.032 -4.473 10.745 1.00 0.00 N ATOM 1767 CA LEU A 741 -7.419 -3.652 11.784 1.00 0.00 C ATOM 1768 C LEU A 741 -8.069 -2.271 11.852 1.00 0.00 C ATOM 1769 O LEU A 741 -8.289 -1.739 12.938 1.00 0.00 O ATOM 1770 CB LEU A 741 -5.919 -3.506 11.516 1.00 0.00 C ATOM 1771 CG LEU A 741 -5.231 -2.944 12.762 1.00 0.00 C ATOM 1772 CD1 LEU A 741 -5.248 -3.994 13.876 1.00 0.00 C ATOM 1773 CD2 LEU A 741 -3.780 -2.587 12.428 1.00 0.00 C ATOM 0 H LEU A 741 -8.500 -3.952 10.003 1.00 0.00 H new ATOM 0 HA LEU A 741 -7.572 -4.149 12.742 1.00 0.00 H new ATOM 0 HB2 LEU A 741 -5.489 -4.473 11.255 1.00 0.00 H new ATOM 0 HB3 LEU A 741 -5.753 -2.844 10.666 1.00 0.00 H new ATOM 0 HG LEU A 741 -5.761 -2.051 13.094 1.00 0.00 H new ATOM 0 HD11 LEU A 741 -4.758 -3.592 14.763 1.00 0.00 H new ATOM 0 HD12 LEU A 741 -6.279 -4.252 14.117 1.00 0.00 H new ATOM 0 HD13 LEU A 741 -4.719 -4.887 13.542 1.00 0.00 H new ATOM 0 HD21 LEU A 741 -3.290 -2.187 13.316 1.00 0.00 H new ATOM 0 HD22 LEU A 741 -3.253 -3.481 12.095 1.00 0.00 H new ATOM 0 HD23 LEU A 741 -3.763 -1.839 11.636 1.00 0.00 H new