USER MOD reduce.3.24.130724 H: found=0, std=0, add=708, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 709 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 711 THR OG1 : rot -160:sc= -2.46! USER MOD Set 1.2: A 714 HIS : no HE2:sc= -4! C(o=-6.5!,f=-8.7!) USER MOD Set 2.1: A 688 ASN : amide:sc= -13.6! C(o=-14!,f=-14!) USER MOD Set 2.2: A 692 SER OG : rot 170:sc= 0.0168 USER MOD Single : A 647 SER OG : rot 180:sc= -0.179 USER MOD Single : A 648 SER OG : rot 180:sc= 0 USER MOD Single : A 650 CYS SG : rot 18:sc= 0.0584 USER MOD Single : A 656 GLN : amide:sc= -1.02 K(o=-1,f=-0.27) USER MOD Single : A 657 MET CE :methyl -169:sc= -9.51! (180deg=-10.6!) USER MOD Single : A 664 SER OG : rot -13:sc= -0.354 USER MOD Single : A 666 TYR OH : rot 180:sc= 0 USER MOD Single : A 667 LYS NZ :NH3+ -120:sc= -0.0139 (180deg=-0.0511) USER MOD Single : A 668 SER OG : rot -170:sc= -0.213 USER MOD Single : A 672 THR OG1 : rot 180:sc= 0 USER MOD Single : A 673 SER OG : rot 180:sc= 0 USER MOD Single : A 674 GLN : amide:sc= -0.151 X(o=-0.15,f=-0.0092) USER MOD Single : A 676 LYS NZ :NH3+ -177:sc= -0.763 (180deg=-0.947) USER MOD Single : A 679 SER OG : rot 180:sc= 0 USER MOD Single : A 682 SER OG : rot 180:sc= 0 USER MOD Single : A 686 LYS NZ :NH3+ 156:sc= -0.0613 (180deg=-0.717) USER MOD Single : A 687 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 689 ASN : amide:sc= -3.83! C(o=-3.8!,f=-11!) USER MOD Single : A 696 SER OG : rot 180:sc= 0.00482 USER MOD Single : A 702 GLN : amide:sc= -7.48! C(o=-7.5!,f=-14!) USER MOD Single : A 715 SER OG : rot 180:sc= 0 USER MOD Single : A 717 ASN : amide:sc= -2.42! C(o=-2.4!,f=-3.8!) USER MOD Single : A 720 TYR OH : rot 180:sc= 0 USER MOD Single : A 722 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 726 SER OG : rot 180:sc= 0 USER MOD Single : A 727 HIS : no HE2:sc= -19.5! C(o=-20!,f=-28!) USER MOD Single : A 733 GLN : amide:sc= -2.18 K(o=-2.2,f=-3.3) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 646 -22.773 5.684 -11.812 1.00 0.00 N ATOM 2 CA GLY A 646 -23.068 6.654 -10.720 1.00 0.00 C ATOM 3 C GLY A 646 -23.400 5.890 -9.440 1.00 0.00 C ATOM 4 O GLY A 646 -22.886 6.181 -8.378 1.00 0.00 O ATOM 0 HA2 GLY A 646 -22.210 7.306 -10.556 1.00 0.00 H new ATOM 0 HA3 GLY A 646 -23.904 7.293 -11.002 1.00 0.00 H new ATOM 10 N SER A 647 -24.254 4.909 -9.535 1.00 0.00 N ATOM 11 CA SER A 647 -24.622 4.126 -8.324 1.00 0.00 C ATOM 12 C SER A 647 -23.374 3.464 -7.736 1.00 0.00 C ATOM 13 O SER A 647 -23.174 3.451 -6.536 1.00 0.00 O ATOM 14 CB SER A 647 -25.610 3.077 -8.836 1.00 0.00 C ATOM 15 OG SER A 647 -24.941 2.200 -9.734 1.00 0.00 O ATOM 0 H SER A 647 -24.712 4.616 -10.398 1.00 0.00 H new ATOM 0 HA SER A 647 -25.053 4.739 -7.533 1.00 0.00 H new ATOM 0 HB2 SER A 647 -26.025 2.513 -8.001 1.00 0.00 H new ATOM 0 HB3 SER A 647 -26.446 3.563 -9.339 1.00 0.00 H new ATOM 0 HG SER A 647 -25.571 1.525 -10.063 1.00 0.00 H new ATOM 21 N SER A 648 -22.522 2.934 -8.567 1.00 0.00 N ATOM 22 CA SER A 648 -21.279 2.296 -8.050 1.00 0.00 C ATOM 23 C SER A 648 -20.083 3.238 -8.250 1.00 0.00 C ATOM 24 O SER A 648 -19.840 3.727 -9.337 1.00 0.00 O ATOM 25 CB SER A 648 -21.118 1.016 -8.872 1.00 0.00 C ATOM 26 OG SER A 648 -19.905 0.371 -8.508 1.00 0.00 O ATOM 0 H SER A 648 -22.632 2.915 -9.581 1.00 0.00 H new ATOM 0 HA SER A 648 -21.331 2.080 -6.983 1.00 0.00 H new ATOM 0 HB2 SER A 648 -21.963 0.350 -8.698 1.00 0.00 H new ATOM 0 HB3 SER A 648 -21.112 1.252 -9.936 1.00 0.00 H new ATOM 0 HG SER A 648 -19.801 -0.450 -9.032 1.00 0.00 H new ATOM 32 N ASP A 649 -19.334 3.490 -7.208 1.00 0.00 N ATOM 33 CA ASP A 649 -18.146 4.392 -7.327 1.00 0.00 C ATOM 34 C ASP A 649 -16.901 3.687 -6.789 1.00 0.00 C ATOM 35 O ASP A 649 -16.989 2.786 -5.980 1.00 0.00 O ATOM 36 CB ASP A 649 -18.478 5.625 -6.480 1.00 0.00 C ATOM 37 CG ASP A 649 -19.582 6.439 -7.158 1.00 0.00 C ATOM 38 OD1 ASP A 649 -19.784 6.255 -8.347 1.00 0.00 O ATOM 39 OD2 ASP A 649 -20.207 7.233 -6.475 1.00 0.00 O ATOM 0 H ASP A 649 -19.493 3.109 -6.275 1.00 0.00 H new ATOM 0 HA ASP A 649 -17.940 4.665 -8.362 1.00 0.00 H new ATOM 0 HB2 ASP A 649 -18.799 5.318 -5.485 1.00 0.00 H new ATOM 0 HB3 ASP A 649 -17.587 6.240 -6.352 1.00 0.00 H new ATOM 44 N CYS A 650 -15.742 4.083 -7.235 1.00 0.00 N ATOM 45 CA CYS A 650 -14.499 3.420 -6.748 1.00 0.00 C ATOM 46 C CYS A 650 -13.379 4.431 -6.524 1.00 0.00 C ATOM 47 O CYS A 650 -13.401 5.538 -7.026 1.00 0.00 O ATOM 48 CB CYS A 650 -14.098 2.453 -7.859 1.00 0.00 C ATOM 49 SG CYS A 650 -13.806 3.385 -9.384 1.00 0.00 S ATOM 0 H CYS A 650 -15.601 4.833 -7.912 1.00 0.00 H new ATOM 0 HA CYS A 650 -14.670 2.922 -5.794 1.00 0.00 H new ATOM 0 HB2 CYS A 650 -13.199 1.907 -7.575 1.00 0.00 H new ATOM 0 HB3 CYS A 650 -14.884 1.714 -8.015 1.00 0.00 H new ATOM 0 HG CYS A 650 -13.632 4.641 -9.098 1.00 0.00 H new ATOM 55 N ARG A 651 -12.394 4.038 -5.772 1.00 0.00 N ATOM 56 CA ARG A 651 -11.241 4.932 -5.498 1.00 0.00 C ATOM 57 C ARG A 651 -9.963 4.198 -5.902 1.00 0.00 C ATOM 58 O ARG A 651 -9.934 2.983 -5.953 1.00 0.00 O ATOM 59 CB ARG A 651 -11.276 5.169 -3.999 1.00 0.00 C ATOM 60 CG ARG A 651 -12.687 5.566 -3.566 1.00 0.00 C ATOM 61 CD ARG A 651 -12.620 6.185 -2.170 1.00 0.00 C ATOM 62 NE ARG A 651 -13.986 6.025 -1.601 1.00 0.00 N ATOM 63 CZ ARG A 651 -14.243 5.037 -0.786 1.00 0.00 C ATOM 64 NH1 ARG A 651 -13.518 3.950 -0.823 1.00 0.00 N ATOM 65 NH2 ARG A 651 -15.213 5.142 0.079 1.00 0.00 N ATOM 0 H ARG A 651 -12.339 3.121 -5.329 1.00 0.00 H new ATOM 0 HA ARG A 651 -11.278 5.874 -6.045 1.00 0.00 H new ATOM 0 HB2 ARG A 651 -10.965 4.267 -3.472 1.00 0.00 H new ATOM 0 HB3 ARG A 651 -10.570 5.954 -3.730 1.00 0.00 H new ATOM 0 HG2 ARG A 651 -13.113 6.277 -4.274 1.00 0.00 H new ATOM 0 HG3 ARG A 651 -13.339 4.693 -3.560 1.00 0.00 H new ATOM 0 HD2 ARG A 651 -11.876 5.682 -1.553 1.00 0.00 H new ATOM 0 HD3 ARG A 651 -12.336 7.236 -2.219 1.00 0.00 H new ATOM 0 HE ARG A 651 -14.722 6.687 -1.848 1.00 0.00 H new ATOM 0 HH11 ARG A 651 -12.750 3.872 -1.489 1.00 0.00 H new ATOM 0 HH12 ARG A 651 -13.721 3.180 -0.186 1.00 0.00 H new ATOM 0 HH21 ARG A 651 -15.771 5.995 0.119 1.00 0.00 H new ATOM 0 HH22 ARG A 651 -15.414 4.371 0.716 1.00 0.00 H new ATOM 79 N ILE A 652 -8.916 4.902 -6.218 1.00 0.00 N ATOM 80 CA ILE A 652 -7.678 4.196 -6.649 1.00 0.00 C ATOM 81 C ILE A 652 -6.518 4.436 -5.670 1.00 0.00 C ATOM 82 O ILE A 652 -6.317 5.524 -5.166 1.00 0.00 O ATOM 83 CB ILE A 652 -7.409 4.765 -8.040 1.00 0.00 C ATOM 84 CG1 ILE A 652 -7.123 6.268 -7.950 1.00 0.00 C ATOM 85 CG2 ILE A 652 -8.664 4.544 -8.893 1.00 0.00 C ATOM 86 CD1 ILE A 652 -6.358 6.715 -9.197 1.00 0.00 C ATOM 0 H ILE A 652 -8.861 5.920 -6.198 1.00 0.00 H new ATOM 0 HA ILE A 652 -7.786 3.111 -6.666 1.00 0.00 H new ATOM 0 HB ILE A 652 -6.545 4.269 -8.482 1.00 0.00 H new ATOM 0 HG12 ILE A 652 -8.057 6.823 -7.865 1.00 0.00 H new ATOM 0 HG13 ILE A 652 -6.540 6.486 -7.055 1.00 0.00 H new ATOM 0 HG21 ILE A 652 -8.498 4.942 -9.894 1.00 0.00 H new ATOM 0 HG22 ILE A 652 -8.877 3.477 -8.958 1.00 0.00 H new ATOM 0 HG23 ILE A 652 -9.510 5.056 -8.434 1.00 0.00 H new ATOM 0 HD11 ILE A 652 -6.154 7.784 -9.135 1.00 0.00 H new ATOM 0 HD12 ILE A 652 -5.417 6.169 -9.262 1.00 0.00 H new ATOM 0 HD13 ILE A 652 -6.958 6.511 -10.084 1.00 0.00 H new ATOM 98 N ILE A 653 -5.770 3.394 -5.393 1.00 0.00 N ATOM 99 CA ILE A 653 -4.624 3.491 -4.428 1.00 0.00 C ATOM 100 C ILE A 653 -3.291 3.224 -5.145 1.00 0.00 C ATOM 101 O ILE A 653 -3.164 2.314 -5.940 1.00 0.00 O ATOM 102 CB ILE A 653 -4.923 2.430 -3.318 1.00 0.00 C ATOM 103 CG1 ILE A 653 -3.640 1.667 -2.899 1.00 0.00 C ATOM 104 CG2 ILE A 653 -5.987 1.433 -3.795 1.00 0.00 C ATOM 105 CD1 ILE A 653 -4.007 0.355 -2.191 1.00 0.00 C ATOM 0 H ILE A 653 -5.905 2.468 -5.799 1.00 0.00 H new ATOM 0 HA ILE A 653 -4.529 4.486 -3.994 1.00 0.00 H new ATOM 0 HB ILE A 653 -5.300 2.968 -2.448 1.00 0.00 H new ATOM 0 HG12 ILE A 653 -3.031 1.456 -3.778 1.00 0.00 H new ATOM 0 HG13 ILE A 653 -3.038 2.290 -2.237 1.00 0.00 H new ATOM 0 HG21 ILE A 653 -6.181 0.703 -3.009 1.00 0.00 H new ATOM 0 HG22 ILE A 653 -6.908 1.968 -4.029 1.00 0.00 H new ATOM 0 HG23 ILE A 653 -5.630 0.919 -4.687 1.00 0.00 H new ATOM 0 HD11 ILE A 653 -3.096 -0.170 -1.903 1.00 0.00 H new ATOM 0 HD12 ILE A 653 -4.597 0.574 -1.301 1.00 0.00 H new ATOM 0 HD13 ILE A 653 -4.589 -0.272 -2.866 1.00 0.00 H new ATOM 117 N ARG A 654 -2.297 4.013 -4.848 1.00 0.00 N ATOM 118 CA ARG A 654 -0.957 3.834 -5.470 1.00 0.00 C ATOM 119 C ARG A 654 0.107 3.910 -4.380 1.00 0.00 C ATOM 120 O ARG A 654 0.172 4.855 -3.628 1.00 0.00 O ATOM 121 CB ARG A 654 -0.832 4.993 -6.453 1.00 0.00 C ATOM 122 CG ARG A 654 0.579 5.052 -7.036 1.00 0.00 C ATOM 123 CD ARG A 654 0.670 6.227 -8.020 1.00 0.00 C ATOM 124 NE ARG A 654 -0.632 6.225 -8.749 1.00 0.00 N ATOM 125 CZ ARG A 654 -0.825 5.401 -9.739 1.00 0.00 C ATOM 126 NH1 ARG A 654 0.105 5.242 -10.640 1.00 0.00 N ATOM 127 NH2 ARG A 654 -1.949 4.742 -9.828 1.00 0.00 N ATOM 0 H ARG A 654 -2.359 4.788 -4.188 1.00 0.00 H new ATOM 0 HA ARG A 654 -0.832 2.875 -5.973 1.00 0.00 H new ATOM 0 HB2 ARG A 654 -1.559 4.876 -7.257 1.00 0.00 H new ATOM 0 HB3 ARG A 654 -1.063 5.931 -5.949 1.00 0.00 H new ATOM 0 HG2 ARG A 654 1.311 5.174 -6.237 1.00 0.00 H new ATOM 0 HG3 ARG A 654 0.815 4.117 -7.545 1.00 0.00 H new ATOM 0 HD2 ARG A 654 0.827 7.169 -7.495 1.00 0.00 H new ATOM 0 HD3 ARG A 654 1.507 6.102 -8.707 1.00 0.00 H new ATOM 0 HE ARG A 654 -1.372 6.870 -8.472 1.00 0.00 H new ATOM 0 HH11 ARG A 654 0.979 5.762 -10.568 1.00 0.00 H new ATOM 0 HH12 ARG A 654 -0.042 4.598 -11.417 1.00 0.00 H new ATOM 0 HH21 ARG A 654 -2.674 4.873 -9.123 1.00 0.00 H new ATOM 0 HH22 ARG A 654 -2.102 4.096 -10.603 1.00 0.00 H new ATOM 141 N VAL A 655 0.932 2.921 -4.273 1.00 0.00 N ATOM 142 CA VAL A 655 1.963 2.949 -3.208 1.00 0.00 C ATOM 143 C VAL A 655 3.351 2.815 -3.825 1.00 0.00 C ATOM 144 O VAL A 655 3.497 2.441 -4.967 1.00 0.00 O ATOM 145 CB VAL A 655 1.641 1.734 -2.339 1.00 0.00 C ATOM 146 CG1 VAL A 655 2.575 1.695 -1.135 1.00 0.00 C ATOM 147 CG2 VAL A 655 0.185 1.807 -1.867 1.00 0.00 C ATOM 0 H VAL A 655 0.941 2.096 -4.872 1.00 0.00 H new ATOM 0 HA VAL A 655 1.959 3.878 -2.637 1.00 0.00 H new ATOM 0 HB VAL A 655 1.782 0.827 -2.927 1.00 0.00 H new ATOM 0 HG11 VAL A 655 2.340 0.826 -0.520 1.00 0.00 H new ATOM 0 HG12 VAL A 655 3.608 1.628 -1.478 1.00 0.00 H new ATOM 0 HG13 VAL A 655 2.446 2.603 -0.545 1.00 0.00 H new ATOM 0 HG21 VAL A 655 -0.041 0.939 -1.248 1.00 0.00 H new ATOM 0 HG22 VAL A 655 0.036 2.717 -1.285 1.00 0.00 H new ATOM 0 HG23 VAL A 655 -0.478 1.818 -2.732 1.00 0.00 H new ATOM 157 N GLN A 656 4.372 3.119 -3.081 1.00 0.00 N ATOM 158 CA GLN A 656 5.746 2.994 -3.640 1.00 0.00 C ATOM 159 C GLN A 656 6.686 2.356 -2.616 1.00 0.00 C ATOM 160 O GLN A 656 7.198 3.017 -1.735 1.00 0.00 O ATOM 161 CB GLN A 656 6.192 4.422 -3.958 1.00 0.00 C ATOM 162 CG GLN A 656 5.377 4.963 -5.136 1.00 0.00 C ATOM 163 CD GLN A 656 4.789 6.326 -4.767 1.00 0.00 C ATOM 164 OE1 GLN A 656 4.713 7.213 -5.595 1.00 0.00 O ATOM 165 NE2 GLN A 656 4.358 6.526 -3.550 1.00 0.00 N ATOM 0 H GLN A 656 4.319 3.447 -2.117 1.00 0.00 H new ATOM 0 HA GLN A 656 5.764 2.359 -4.526 1.00 0.00 H new ATOM 0 HB2 GLN A 656 6.055 5.060 -3.085 1.00 0.00 H new ATOM 0 HB3 GLN A 656 7.255 4.437 -4.200 1.00 0.00 H new ATOM 0 HG2 GLN A 656 6.010 5.055 -6.018 1.00 0.00 H new ATOM 0 HG3 GLN A 656 4.577 4.267 -5.389 1.00 0.00 H new ATOM 0 HE21 GLN A 656 4.423 5.780 -2.857 1.00 0.00 H new ATOM 0 HE22 GLN A 656 3.957 7.428 -3.293 1.00 0.00 H new ATOM 174 N MET A 657 6.945 1.084 -2.743 1.00 0.00 N ATOM 175 CA MET A 657 7.889 0.427 -1.794 1.00 0.00 C ATOM 176 C MET A 657 9.304 0.613 -2.336 1.00 0.00 C ATOM 177 O MET A 657 9.600 0.245 -3.455 1.00 0.00 O ATOM 178 CB MET A 657 7.502 -1.048 -1.794 1.00 0.00 C ATOM 179 CG MET A 657 6.238 -1.259 -0.976 1.00 0.00 C ATOM 180 SD MET A 657 5.328 -2.678 -1.639 1.00 0.00 S ATOM 181 CE MET A 657 6.707 -3.854 -1.692 1.00 0.00 C ATOM 0 H MET A 657 6.547 0.474 -3.457 1.00 0.00 H new ATOM 0 HA MET A 657 7.848 0.839 -0.786 1.00 0.00 H new ATOM 0 HB2 MET A 657 7.343 -1.390 -2.817 1.00 0.00 H new ATOM 0 HB3 MET A 657 8.315 -1.645 -1.381 1.00 0.00 H new ATOM 0 HG2 MET A 657 6.492 -1.431 0.070 1.00 0.00 H new ATOM 0 HG3 MET A 657 5.615 -0.365 -1.010 1.00 0.00 H new ATOM 0 HE1 MET A 657 6.409 -4.739 -2.254 1.00 0.00 H new ATOM 0 HE2 MET A 657 7.564 -3.388 -2.178 1.00 0.00 H new ATOM 0 HE3 MET A 657 6.978 -4.143 -0.677 1.00 0.00 H new ATOM 191 N GLU A 658 10.169 1.214 -1.577 1.00 0.00 N ATOM 192 CA GLU A 658 11.547 1.466 -2.083 1.00 0.00 C ATOM 193 C GLU A 658 12.551 0.478 -1.490 1.00 0.00 C ATOM 194 O GLU A 658 13.730 0.759 -1.400 1.00 0.00 O ATOM 195 CB GLU A 658 11.846 2.887 -1.616 1.00 0.00 C ATOM 196 CG GLU A 658 13.085 3.415 -2.335 1.00 0.00 C ATOM 197 CD GLU A 658 13.101 4.943 -2.260 1.00 0.00 C ATOM 198 OE1 GLU A 658 12.752 5.469 -1.216 1.00 0.00 O ATOM 199 OE2 GLU A 658 13.461 5.560 -3.246 1.00 0.00 O ATOM 0 H GLU A 658 9.985 1.543 -0.629 1.00 0.00 H new ATOM 0 HA GLU A 658 11.623 1.345 -3.164 1.00 0.00 H new ATOM 0 HB2 GLU A 658 10.993 3.534 -1.819 1.00 0.00 H new ATOM 0 HB3 GLU A 658 12.006 2.900 -0.538 1.00 0.00 H new ATOM 0 HG2 GLU A 658 13.986 3.008 -1.877 1.00 0.00 H new ATOM 0 HG3 GLU A 658 13.081 3.091 -3.376 1.00 0.00 H new ATOM 206 N LEU A 659 12.101 -0.663 -1.059 1.00 0.00 N ATOM 207 CA LEU A 659 13.052 -1.633 -0.445 1.00 0.00 C ATOM 208 C LEU A 659 12.648 -3.073 -0.753 1.00 0.00 C ATOM 209 O LEU A 659 11.550 -3.345 -1.194 1.00 0.00 O ATOM 210 CB LEU A 659 12.971 -1.381 1.054 1.00 0.00 C ATOM 211 CG LEU A 659 14.052 -2.210 1.753 1.00 0.00 C ATOM 212 CD1 LEU A 659 15.413 -1.874 1.138 1.00 0.00 C ATOM 213 CD2 LEU A 659 14.087 -1.867 3.244 1.00 0.00 C ATOM 0 H LEU A 659 11.128 -0.967 -1.103 1.00 0.00 H new ATOM 0 HA LEU A 659 14.060 -1.499 -0.837 1.00 0.00 H new ATOM 0 HB2 LEU A 659 13.112 -0.321 1.267 1.00 0.00 H new ATOM 0 HB3 LEU A 659 11.985 -1.653 1.430 1.00 0.00 H new ATOM 0 HG LEU A 659 13.830 -3.270 1.628 1.00 0.00 H new ATOM 0 HD11 LEU A 659 16.189 -2.460 1.630 1.00 0.00 H new ATOM 0 HD12 LEU A 659 15.400 -2.110 0.074 1.00 0.00 H new ATOM 0 HD13 LEU A 659 15.620 -0.812 1.272 1.00 0.00 H new ATOM 0 HD21 LEU A 659 14.858 -2.460 3.736 1.00 0.00 H new ATOM 0 HD22 LEU A 659 14.310 -0.807 3.368 1.00 0.00 H new ATOM 0 HD23 LEU A 659 13.118 -2.089 3.691 1.00 0.00 H new ATOM 225 N GLY A 660 13.539 -3.994 -0.532 1.00 0.00 N ATOM 226 CA GLY A 660 13.245 -5.416 -0.809 1.00 0.00 C ATOM 227 C GLY A 660 14.527 -6.049 -1.320 1.00 0.00 C ATOM 228 O GLY A 660 15.475 -5.357 -1.633 1.00 0.00 O ATOM 0 H GLY A 660 14.473 -3.814 -0.165 1.00 0.00 H new ATOM 0 HA2 GLY A 660 12.900 -5.920 0.094 1.00 0.00 H new ATOM 0 HA3 GLY A 660 12.450 -5.507 -1.549 1.00 0.00 H new ATOM 232 N GLU A 661 14.588 -7.342 -1.432 1.00 0.00 N ATOM 233 CA GLU A 661 15.847 -7.925 -1.948 1.00 0.00 C ATOM 234 C GLU A 661 16.118 -7.277 -3.301 1.00 0.00 C ATOM 235 O GLU A 661 17.247 -7.105 -3.710 1.00 0.00 O ATOM 236 CB GLU A 661 15.615 -9.433 -2.076 1.00 0.00 C ATOM 237 CG GLU A 661 14.462 -9.716 -3.039 1.00 0.00 C ATOM 238 CD GLU A 661 14.933 -10.696 -4.116 1.00 0.00 C ATOM 239 OE1 GLU A 661 16.102 -10.649 -4.461 1.00 0.00 O ATOM 240 OE2 GLU A 661 14.117 -11.475 -4.577 1.00 0.00 O ATOM 0 H GLU A 661 13.846 -8.001 -1.197 1.00 0.00 H new ATOM 0 HA GLU A 661 16.706 -7.752 -1.299 1.00 0.00 H new ATOM 0 HB2 GLU A 661 16.523 -9.918 -2.434 1.00 0.00 H new ATOM 0 HB3 GLU A 661 15.392 -9.857 -1.097 1.00 0.00 H new ATOM 0 HG2 GLU A 661 13.614 -10.134 -2.497 1.00 0.00 H new ATOM 0 HG3 GLU A 661 14.121 -8.789 -3.499 1.00 0.00 H new ATOM 247 N ASP A 662 15.075 -6.870 -3.974 1.00 0.00 N ATOM 248 CA ASP A 662 15.243 -6.177 -5.277 1.00 0.00 C ATOM 249 C ASP A 662 14.751 -4.730 -5.130 1.00 0.00 C ATOM 250 O ASP A 662 15.102 -3.857 -5.900 1.00 0.00 O ATOM 251 CB ASP A 662 14.388 -6.968 -6.266 1.00 0.00 C ATOM 252 CG ASP A 662 15.019 -8.341 -6.506 1.00 0.00 C ATOM 253 OD1 ASP A 662 16.234 -8.432 -6.450 1.00 0.00 O ATOM 254 OD2 ASP A 662 14.275 -9.281 -6.737 1.00 0.00 O ATOM 0 H ASP A 662 14.108 -6.990 -3.672 1.00 0.00 H new ATOM 0 HA ASP A 662 16.278 -6.133 -5.616 1.00 0.00 H new ATOM 0 HB2 ASP A 662 13.377 -7.084 -5.876 1.00 0.00 H new ATOM 0 HB3 ASP A 662 14.306 -6.425 -7.207 1.00 0.00 H new ATOM 259 N GLY A 663 13.952 -4.476 -4.121 1.00 0.00 N ATOM 260 CA GLY A 663 13.433 -3.101 -3.873 1.00 0.00 C ATOM 261 C GLY A 663 12.676 -2.572 -5.091 1.00 0.00 C ATOM 262 O GLY A 663 13.179 -2.551 -6.197 1.00 0.00 O ATOM 0 H GLY A 663 13.635 -5.177 -3.451 1.00 0.00 H new ATOM 0 HA2 GLY A 663 12.773 -3.109 -3.006 1.00 0.00 H new ATOM 0 HA3 GLY A 663 14.261 -2.433 -3.637 1.00 0.00 H new ATOM 266 N SER A 664 11.472 -2.116 -4.877 1.00 0.00 N ATOM 267 CA SER A 664 10.667 -1.549 -5.994 1.00 0.00 C ATOM 268 C SER A 664 10.622 -0.036 -5.837 1.00 0.00 C ATOM 269 O SER A 664 11.304 0.526 -5.005 1.00 0.00 O ATOM 270 CB SER A 664 9.267 -2.137 -5.848 1.00 0.00 C ATOM 271 OG SER A 664 8.685 -1.682 -4.633 1.00 0.00 O ATOM 0 H SER A 664 11.009 -2.112 -3.968 1.00 0.00 H new ATOM 0 HA SER A 664 11.086 -1.784 -6.972 1.00 0.00 H new ATOM 0 HB2 SER A 664 8.647 -1.841 -6.694 1.00 0.00 H new ATOM 0 HB3 SER A 664 9.316 -3.226 -5.855 1.00 0.00 H new ATOM 0 HG SER A 664 9.377 -1.274 -4.072 1.00 0.00 H new ATOM 277 N VAL A 665 9.845 0.636 -6.628 1.00 0.00 N ATOM 278 CA VAL A 665 9.793 2.114 -6.501 1.00 0.00 C ATOM 279 C VAL A 665 8.380 2.636 -6.760 1.00 0.00 C ATOM 280 O VAL A 665 8.153 3.828 -6.822 1.00 0.00 O ATOM 281 CB VAL A 665 10.753 2.608 -7.576 1.00 0.00 C ATOM 282 CG1 VAL A 665 12.169 2.161 -7.220 1.00 0.00 C ATOM 283 CG2 VAL A 665 10.360 1.994 -8.920 1.00 0.00 C ATOM 0 H VAL A 665 9.248 0.233 -7.351 1.00 0.00 H new ATOM 0 HA VAL A 665 10.063 2.457 -5.502 1.00 0.00 H new ATOM 0 HB VAL A 665 10.710 3.695 -7.640 1.00 0.00 H new ATOM 0 HG11 VAL A 665 12.864 2.510 -7.984 1.00 0.00 H new ATOM 0 HG12 VAL A 665 12.451 2.580 -6.254 1.00 0.00 H new ATOM 0 HG13 VAL A 665 12.205 1.073 -7.167 1.00 0.00 H new ATOM 0 HG21 VAL A 665 11.044 2.344 -9.694 1.00 0.00 H new ATOM 0 HG22 VAL A 665 10.413 0.907 -8.853 1.00 0.00 H new ATOM 0 HG23 VAL A 665 9.343 2.292 -9.173 1.00 0.00 H new ATOM 293 N TYR A 666 7.429 1.763 -6.927 1.00 0.00 N ATOM 294 CA TYR A 666 6.047 2.236 -7.196 1.00 0.00 C ATOM 295 C TYR A 666 5.037 1.116 -6.918 1.00 0.00 C ATOM 296 O TYR A 666 5.399 0.006 -6.588 1.00 0.00 O ATOM 297 CB TYR A 666 6.049 2.571 -8.685 1.00 0.00 C ATOM 298 CG TYR A 666 6.015 1.287 -9.479 1.00 0.00 C ATOM 299 CD1 TYR A 666 7.195 0.586 -9.759 1.00 0.00 C ATOM 300 CD2 TYR A 666 4.786 0.793 -9.923 1.00 0.00 C ATOM 301 CE1 TYR A 666 7.138 -0.608 -10.489 1.00 0.00 C ATOM 302 CE2 TYR A 666 4.728 -0.396 -10.649 1.00 0.00 C ATOM 303 CZ TYR A 666 5.902 -1.097 -10.935 1.00 0.00 C ATOM 304 OH TYR A 666 5.840 -2.273 -11.655 1.00 0.00 O ATOM 0 H TYR A 666 7.548 0.751 -6.889 1.00 0.00 H new ATOM 0 HA TYR A 666 5.768 3.083 -6.570 1.00 0.00 H new ATOM 0 HB2 TYR A 666 5.186 3.190 -8.933 1.00 0.00 H new ATOM 0 HB3 TYR A 666 6.938 3.148 -8.940 1.00 0.00 H new ATOM 0 HD1 TYR A 666 8.145 0.965 -9.413 1.00 0.00 H new ATOM 0 HD2 TYR A 666 3.878 1.334 -9.703 1.00 0.00 H new ATOM 0 HE1 TYR A 666 8.045 -1.151 -10.708 1.00 0.00 H new ATOM 0 HE2 TYR A 666 3.776 -0.775 -10.990 1.00 0.00 H new ATOM 0 HH TYR A 666 4.907 -2.467 -11.884 1.00 0.00 H new ATOM 314 N LYS A 667 3.777 1.396 -7.090 1.00 0.00 N ATOM 315 CA LYS A 667 2.737 0.348 -6.886 1.00 0.00 C ATOM 316 C LYS A 667 1.366 0.935 -7.228 1.00 0.00 C ATOM 317 O LYS A 667 0.995 1.983 -6.738 1.00 0.00 O ATOM 318 CB LYS A 667 2.815 -0.043 -5.409 1.00 0.00 C ATOM 319 CG LYS A 667 2.085 -1.371 -5.202 1.00 0.00 C ATOM 320 CD LYS A 667 0.580 -1.133 -5.291 1.00 0.00 C ATOM 321 CE LYS A 667 -0.157 -2.237 -4.533 1.00 0.00 C ATOM 322 NZ LYS A 667 -0.090 -3.429 -5.424 1.00 0.00 N ATOM 0 H LYS A 667 3.419 2.311 -7.365 1.00 0.00 H new ATOM 0 HA LYS A 667 2.892 -0.524 -7.521 1.00 0.00 H new ATOM 0 HB2 LYS A 667 3.856 -0.134 -5.099 1.00 0.00 H new ATOM 0 HB3 LYS A 667 2.365 0.734 -4.790 1.00 0.00 H new ATOM 0 HG2 LYS A 667 2.397 -2.093 -5.957 1.00 0.00 H new ATOM 0 HG3 LYS A 667 2.342 -1.794 -4.231 1.00 0.00 H new ATOM 0 HD2 LYS A 667 0.330 -0.159 -4.870 1.00 0.00 H new ATOM 0 HD3 LYS A 667 0.264 -1.120 -6.334 1.00 0.00 H new ATOM 0 HE2 LYS A 667 0.314 -2.437 -3.571 1.00 0.00 H new ATOM 0 HE3 LYS A 667 -1.190 -1.954 -4.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 667 -1.054 -3.734 -5.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 667 0.427 -3.185 -6.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 667 0.403 -4.202 -4.933 1.00 0.00 H new ATOM 336 N SER A 668 0.615 0.285 -8.072 1.00 0.00 N ATOM 337 CA SER A 668 -0.718 0.834 -8.439 1.00 0.00 C ATOM 338 C SER A 668 -1.784 -0.268 -8.443 1.00 0.00 C ATOM 339 O SER A 668 -1.643 -1.294 -9.080 1.00 0.00 O ATOM 340 CB SER A 668 -0.515 1.419 -9.838 1.00 0.00 C ATOM 341 OG SER A 668 -1.697 2.091 -10.264 1.00 0.00 O ATOM 0 H SER A 668 0.865 -0.596 -8.520 1.00 0.00 H new ATOM 0 HA SER A 668 -1.071 1.581 -7.729 1.00 0.00 H new ATOM 0 HB2 SER A 668 0.325 2.113 -9.832 1.00 0.00 H new ATOM 0 HB3 SER A 668 -0.266 0.624 -10.541 1.00 0.00 H new ATOM 0 HG SER A 668 -1.617 2.324 -11.213 1.00 0.00 H new ATOM 347 N ILE A 669 -2.854 -0.043 -7.733 1.00 0.00 N ATOM 348 CA ILE A 669 -3.964 -1.035 -7.667 1.00 0.00 C ATOM 349 C ILE A 669 -5.295 -0.274 -7.677 1.00 0.00 C ATOM 350 O ILE A 669 -5.345 0.900 -7.365 1.00 0.00 O ATOM 351 CB ILE A 669 -3.737 -1.794 -6.348 1.00 0.00 C ATOM 352 CG1 ILE A 669 -4.688 -3.004 -6.249 1.00 0.00 C ATOM 353 CG2 ILE A 669 -3.946 -0.857 -5.159 1.00 0.00 C ATOM 354 CD1 ILE A 669 -6.121 -2.551 -5.939 1.00 0.00 C ATOM 0 H ILE A 669 -3.009 0.803 -7.185 1.00 0.00 H new ATOM 0 HA ILE A 669 -3.989 -1.731 -8.506 1.00 0.00 H new ATOM 0 HB ILE A 669 -2.711 -2.161 -6.331 1.00 0.00 H new ATOM 0 HG12 ILE A 669 -4.673 -3.561 -7.186 1.00 0.00 H new ATOM 0 HG13 ILE A 669 -4.340 -3.682 -5.470 1.00 0.00 H new ATOM 0 HG21 ILE A 669 -3.783 -1.405 -4.231 1.00 0.00 H new ATOM 0 HG22 ILE A 669 -3.240 -0.029 -5.220 1.00 0.00 H new ATOM 0 HG23 ILE A 669 -4.964 -0.468 -5.177 1.00 0.00 H new ATOM 0 HD11 ILE A 669 -6.772 -3.423 -5.874 1.00 0.00 H new ATOM 0 HD12 ILE A 669 -6.136 -2.016 -4.990 1.00 0.00 H new ATOM 0 HD13 ILE A 669 -6.474 -1.892 -6.733 1.00 0.00 H new ATOM 366 N LEU A 670 -6.365 -0.910 -8.056 1.00 0.00 N ATOM 367 CA LEU A 670 -7.675 -0.196 -8.099 1.00 0.00 C ATOM 368 C LEU A 670 -8.471 -0.479 -6.824 1.00 0.00 C ATOM 369 O LEU A 670 -8.495 -1.590 -6.335 1.00 0.00 O ATOM 370 CB LEU A 670 -8.398 -0.770 -9.323 1.00 0.00 C ATOM 371 CG LEU A 670 -9.726 -0.038 -9.542 1.00 0.00 C ATOM 372 CD1 LEU A 670 -10.737 -0.450 -8.465 1.00 0.00 C ATOM 373 CD2 LEU A 670 -9.484 1.473 -9.476 1.00 0.00 C ATOM 0 H LEU A 670 -6.393 -1.890 -8.338 1.00 0.00 H new ATOM 0 HA LEU A 670 -7.556 0.885 -8.166 1.00 0.00 H new ATOM 0 HB2 LEU A 670 -7.768 -0.669 -10.207 1.00 0.00 H new ATOM 0 HB3 LEU A 670 -8.580 -1.835 -9.181 1.00 0.00 H new ATOM 0 HG LEU A 670 -10.128 -0.302 -10.520 1.00 0.00 H new ATOM 0 HD11 LEU A 670 -11.678 0.076 -8.629 1.00 0.00 H new ATOM 0 HD12 LEU A 670 -10.908 -1.525 -8.519 1.00 0.00 H new ATOM 0 HD13 LEU A 670 -10.345 -0.194 -7.481 1.00 0.00 H new ATOM 0 HD21 LEU A 670 -10.426 1.999 -9.631 1.00 0.00 H new ATOM 0 HD22 LEU A 670 -9.079 1.734 -8.498 1.00 0.00 H new ATOM 0 HD23 LEU A 670 -8.775 1.762 -10.251 1.00 0.00 H new ATOM 385 N VAL A 671 -9.135 0.509 -6.285 1.00 0.00 N ATOM 386 CA VAL A 671 -9.933 0.268 -5.052 1.00 0.00 C ATOM 387 C VAL A 671 -11.415 0.568 -5.298 1.00 0.00 C ATOM 388 O VAL A 671 -11.778 1.354 -6.149 1.00 0.00 O ATOM 389 CB VAL A 671 -9.353 1.226 -3.990 1.00 0.00 C ATOM 390 CG1 VAL A 671 -10.480 1.974 -3.261 1.00 0.00 C ATOM 391 CG2 VAL A 671 -8.553 0.418 -2.965 1.00 0.00 C ATOM 0 H VAL A 671 -9.158 1.464 -6.643 1.00 0.00 H new ATOM 0 HA VAL A 671 -9.874 -0.772 -4.732 1.00 0.00 H new ATOM 0 HB VAL A 671 -8.710 1.951 -4.489 1.00 0.00 H new ATOM 0 HG11 VAL A 671 -10.050 2.644 -2.517 1.00 0.00 H new ATOM 0 HG12 VAL A 671 -11.057 2.554 -3.981 1.00 0.00 H new ATOM 0 HG13 VAL A 671 -11.134 1.255 -2.767 1.00 0.00 H new ATOM 0 HG21 VAL A 671 -8.141 1.091 -2.213 1.00 0.00 H new ATOM 0 HG22 VAL A 671 -9.208 -0.308 -2.483 1.00 0.00 H new ATOM 0 HG23 VAL A 671 -7.740 -0.105 -3.468 1.00 0.00 H new ATOM 401 N THR A 672 -12.256 -0.026 -4.506 1.00 0.00 N ATOM 402 CA THR A 672 -13.718 0.226 -4.599 1.00 0.00 C ATOM 403 C THR A 672 -14.103 1.100 -3.409 1.00 0.00 C ATOM 404 O THR A 672 -13.318 1.295 -2.501 1.00 0.00 O ATOM 405 CB THR A 672 -14.370 -1.152 -4.519 1.00 0.00 C ATOM 406 OG1 THR A 672 -13.948 -1.934 -5.628 1.00 0.00 O ATOM 407 CG2 THR A 672 -15.895 -1.014 -4.532 1.00 0.00 C ATOM 0 H THR A 672 -11.986 -0.691 -3.781 1.00 0.00 H new ATOM 0 HA THR A 672 -14.028 0.735 -5.511 1.00 0.00 H new ATOM 0 HB THR A 672 -14.070 -1.640 -3.591 1.00 0.00 H new ATOM 0 HG1 THR A 672 -14.363 -2.821 -5.580 1.00 0.00 H new ATOM 0 HG21 THR A 672 -16.350 -2.003 -4.475 1.00 0.00 H new ATOM 0 HG22 THR A 672 -16.214 -0.418 -3.677 1.00 0.00 H new ATOM 0 HG23 THR A 672 -16.208 -0.523 -5.454 1.00 0.00 H new ATOM 415 N SER A 673 -15.268 1.663 -3.409 1.00 0.00 N ATOM 416 CA SER A 673 -15.648 2.554 -2.278 1.00 0.00 C ATOM 417 C SER A 673 -15.563 1.838 -0.918 1.00 0.00 C ATOM 418 O SER A 673 -15.282 2.454 0.091 1.00 0.00 O ATOM 419 CB SER A 673 -17.088 2.961 -2.572 1.00 0.00 C ATOM 420 OG SER A 673 -17.477 3.990 -1.672 1.00 0.00 O ATOM 0 H SER A 673 -15.975 1.550 -4.136 1.00 0.00 H new ATOM 0 HA SER A 673 -14.971 3.405 -2.205 1.00 0.00 H new ATOM 0 HB2 SER A 673 -17.177 3.309 -3.601 1.00 0.00 H new ATOM 0 HB3 SER A 673 -17.750 2.101 -2.468 1.00 0.00 H new ATOM 0 HG SER A 673 -18.402 4.256 -1.859 1.00 0.00 H new ATOM 426 N GLN A 674 -15.848 0.566 -0.864 1.00 0.00 N ATOM 427 CA GLN A 674 -15.830 -0.140 0.452 1.00 0.00 C ATOM 428 C GLN A 674 -14.793 -1.277 0.501 1.00 0.00 C ATOM 429 O GLN A 674 -14.855 -2.137 1.359 1.00 0.00 O ATOM 430 CB GLN A 674 -17.244 -0.699 0.530 1.00 0.00 C ATOM 431 CG GLN A 674 -18.225 0.469 0.458 1.00 0.00 C ATOM 432 CD GLN A 674 -19.342 0.158 -0.542 1.00 0.00 C ATOM 433 OE1 GLN A 674 -20.510 0.256 -0.216 1.00 0.00 O ATOM 434 NE2 GLN A 674 -19.029 -0.209 -1.758 1.00 0.00 N ATOM 0 H GLN A 674 -16.091 -0.013 -1.667 1.00 0.00 H new ATOM 0 HA GLN A 674 -15.553 0.515 1.278 1.00 0.00 H new ATOM 0 HB2 GLN A 674 -17.423 -1.396 -0.289 1.00 0.00 H new ATOM 0 HB3 GLN A 674 -17.382 -1.255 1.458 1.00 0.00 H new ATOM 0 HG2 GLN A 674 -18.651 0.657 1.444 1.00 0.00 H new ATOM 0 HG3 GLN A 674 -17.701 1.376 0.159 1.00 0.00 H new ATOM 0 HE21 GLN A 674 -18.049 -0.291 -2.030 1.00 0.00 H new ATOM 0 HE22 GLN A 674 -19.765 -0.413 -2.434 1.00 0.00 H new ATOM 443 N ASP A 675 -13.874 -1.318 -0.422 1.00 0.00 N ATOM 444 CA ASP A 675 -12.879 -2.443 -0.429 1.00 0.00 C ATOM 445 C ASP A 675 -11.527 -2.056 0.189 1.00 0.00 C ATOM 446 O ASP A 675 -10.935 -1.056 -0.163 1.00 0.00 O ATOM 447 CB ASP A 675 -12.679 -2.776 -1.904 1.00 0.00 C ATOM 448 CG ASP A 675 -11.821 -4.037 -2.010 1.00 0.00 C ATOM 449 OD1 ASP A 675 -11.378 -4.514 -0.978 1.00 0.00 O ATOM 450 OD2 ASP A 675 -11.623 -4.506 -3.118 1.00 0.00 O ATOM 0 H ASP A 675 -13.763 -0.632 -1.168 1.00 0.00 H new ATOM 0 HA ASP A 675 -13.250 -3.276 0.167 1.00 0.00 H new ATOM 0 HB2 ASP A 675 -13.642 -2.932 -2.390 1.00 0.00 H new ATOM 0 HB3 ASP A 675 -12.194 -1.945 -2.417 1.00 0.00 H new ATOM 455 N LYS A 676 -11.026 -2.862 1.094 1.00 0.00 N ATOM 456 CA LYS A 676 -9.705 -2.574 1.724 1.00 0.00 C ATOM 457 C LYS A 676 -8.592 -3.336 0.984 1.00 0.00 C ATOM 458 O LYS A 676 -8.329 -4.484 1.282 1.00 0.00 O ATOM 459 CB LYS A 676 -9.824 -3.143 3.132 1.00 0.00 C ATOM 460 CG LYS A 676 -11.160 -2.738 3.745 1.00 0.00 C ATOM 461 CD LYS A 676 -11.303 -1.218 3.736 1.00 0.00 C ATOM 462 CE LYS A 676 -12.670 -0.849 4.311 1.00 0.00 C ATOM 463 NZ LYS A 676 -13.553 -0.703 3.123 1.00 0.00 N ATOM 0 H LYS A 676 -11.482 -3.713 1.424 1.00 0.00 H new ATOM 0 HA LYS A 676 -9.464 -1.511 1.703 1.00 0.00 H new ATOM 0 HB2 LYS A 676 -9.742 -4.230 3.102 1.00 0.00 H new ATOM 0 HB3 LYS A 676 -9.005 -2.778 3.751 1.00 0.00 H new ATOM 0 HG2 LYS A 676 -11.978 -3.191 3.185 1.00 0.00 H new ATOM 0 HG3 LYS A 676 -11.228 -3.111 4.767 1.00 0.00 H new ATOM 0 HD2 LYS A 676 -10.509 -0.761 4.327 1.00 0.00 H new ATOM 0 HD3 LYS A 676 -11.205 -0.836 2.720 1.00 0.00 H new ATOM 0 HE2 LYS A 676 -13.038 -1.623 4.985 1.00 0.00 H new ATOM 0 HE3 LYS A 676 -12.622 0.077 4.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 676 -14.500 -0.400 3.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 676 -13.153 0.009 2.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 676 -13.625 -1.616 2.629 1.00 0.00 H new ATOM 477 N ALA A 677 -7.920 -2.725 0.045 1.00 0.00 N ATOM 478 CA ALA A 677 -6.823 -3.452 -0.663 1.00 0.00 C ATOM 479 C ALA A 677 -5.402 -2.972 -0.279 1.00 0.00 C ATOM 480 O ALA A 677 -4.468 -3.300 -0.983 1.00 0.00 O ATOM 481 CB ALA A 677 -7.073 -3.192 -2.142 1.00 0.00 C ATOM 0 H ALA A 677 -8.079 -1.765 -0.261 1.00 0.00 H new ATOM 0 HA ALA A 677 -6.844 -4.507 -0.391 1.00 0.00 H new ATOM 0 HB1 ALA A 677 -6.308 -3.694 -2.734 1.00 0.00 H new ATOM 0 HB2 ALA A 677 -8.055 -3.576 -2.418 1.00 0.00 H new ATOM 0 HB3 ALA A 677 -7.036 -2.120 -2.334 1.00 0.00 H new ATOM 487 N PRO A 678 -5.232 -2.239 0.808 1.00 0.00 N ATOM 488 CA PRO A 678 -3.869 -1.811 1.177 1.00 0.00 C ATOM 489 C PRO A 678 -3.029 -3.059 1.443 1.00 0.00 C ATOM 490 O PRO A 678 -1.823 -3.059 1.293 1.00 0.00 O ATOM 491 CB PRO A 678 -4.099 -0.978 2.442 1.00 0.00 C ATOM 492 CG PRO A 678 -5.601 -0.966 2.753 1.00 0.00 C ATOM 493 CD PRO A 678 -6.325 -1.816 1.713 1.00 0.00 C ATOM 0 HA PRO A 678 -3.337 -1.239 0.416 1.00 0.00 H new ATOM 0 HB2 PRO A 678 -3.543 -1.400 3.279 1.00 0.00 H new ATOM 0 HB3 PRO A 678 -3.734 0.039 2.297 1.00 0.00 H new ATOM 0 HG2 PRO A 678 -5.782 -1.358 3.754 1.00 0.00 H new ATOM 0 HG3 PRO A 678 -5.982 0.055 2.737 1.00 0.00 H new ATOM 0 HD2 PRO A 678 -6.826 -2.671 2.168 1.00 0.00 H new ATOM 0 HD3 PRO A 678 -7.088 -1.244 1.185 1.00 0.00 H new ATOM 501 N SER A 679 -3.673 -4.135 1.813 1.00 0.00 N ATOM 502 CA SER A 679 -2.935 -5.403 2.067 1.00 0.00 C ATOM 503 C SER A 679 -2.685 -6.133 0.745 1.00 0.00 C ATOM 504 O SER A 679 -1.979 -7.120 0.696 1.00 0.00 O ATOM 505 CB SER A 679 -3.852 -6.222 2.974 1.00 0.00 C ATOM 506 OG SER A 679 -3.998 -5.554 4.220 1.00 0.00 O ATOM 0 H SER A 679 -4.682 -4.188 1.950 1.00 0.00 H new ATOM 0 HA SER A 679 -1.961 -5.235 2.527 1.00 0.00 H new ATOM 0 HB2 SER A 679 -4.826 -6.354 2.502 1.00 0.00 H new ATOM 0 HB3 SER A 679 -3.435 -7.217 3.128 1.00 0.00 H new ATOM 0 HG SER A 679 -4.587 -6.076 4.804 1.00 0.00 H new ATOM 512 N VAL A 680 -3.259 -5.653 -0.330 1.00 0.00 N ATOM 513 CA VAL A 680 -3.045 -6.322 -1.646 1.00 0.00 C ATOM 514 C VAL A 680 -1.558 -6.314 -1.979 1.00 0.00 C ATOM 515 O VAL A 680 -1.076 -7.116 -2.754 1.00 0.00 O ATOM 516 CB VAL A 680 -3.828 -5.500 -2.674 1.00 0.00 C ATOM 517 CG1 VAL A 680 -3.076 -4.203 -2.995 1.00 0.00 C ATOM 518 CG2 VAL A 680 -3.980 -6.325 -3.952 1.00 0.00 C ATOM 0 H VAL A 680 -3.863 -4.831 -0.352 1.00 0.00 H new ATOM 0 HA VAL A 680 -3.381 -7.359 -1.638 1.00 0.00 H new ATOM 0 HB VAL A 680 -4.808 -5.250 -2.268 1.00 0.00 H new ATOM 0 HG11 VAL A 680 -3.641 -3.626 -3.727 1.00 0.00 H new ATOM 0 HG12 VAL A 680 -2.957 -3.616 -2.084 1.00 0.00 H new ATOM 0 HG13 VAL A 680 -2.094 -4.443 -3.403 1.00 0.00 H new ATOM 0 HG21 VAL A 680 -4.536 -5.750 -4.692 1.00 0.00 H new ATOM 0 HG22 VAL A 680 -2.994 -6.568 -4.348 1.00 0.00 H new ATOM 0 HG23 VAL A 680 -4.518 -7.246 -3.729 1.00 0.00 H new ATOM 528 N ILE A 681 -0.832 -5.406 -1.394 1.00 0.00 N ATOM 529 CA ILE A 681 0.630 -5.338 -1.671 1.00 0.00 C ATOM 530 C ILE A 681 1.263 -6.700 -1.368 1.00 0.00 C ATOM 531 O ILE A 681 2.088 -7.197 -2.111 1.00 0.00 O ATOM 532 CB ILE A 681 1.185 -4.288 -0.701 1.00 0.00 C ATOM 533 CG1 ILE A 681 0.555 -2.900 -0.986 1.00 0.00 C ATOM 534 CG2 ILE A 681 2.711 -4.246 -0.844 1.00 0.00 C ATOM 535 CD1 ILE A 681 1.616 -1.876 -1.425 1.00 0.00 C ATOM 0 H ILE A 681 -1.185 -4.709 -0.738 1.00 0.00 H new ATOM 0 HA ILE A 681 0.841 -5.083 -2.709 1.00 0.00 H new ATOM 0 HB ILE A 681 0.929 -4.556 0.324 1.00 0.00 H new ATOM 0 HG12 ILE A 681 -0.202 -2.996 -1.764 1.00 0.00 H new ATOM 0 HG13 ILE A 681 0.048 -2.539 -0.091 1.00 0.00 H new ATOM 0 HG21 ILE A 681 3.120 -3.503 -0.160 1.00 0.00 H new ATOM 0 HG22 ILE A 681 3.126 -5.226 -0.606 1.00 0.00 H new ATOM 0 HG23 ILE A 681 2.973 -3.980 -1.868 1.00 0.00 H new ATOM 0 HD11 ILE A 681 1.138 -0.915 -1.616 1.00 0.00 H new ATOM 0 HD12 ILE A 681 2.359 -1.761 -0.636 1.00 0.00 H new ATOM 0 HD13 ILE A 681 2.104 -2.225 -2.335 1.00 0.00 H new ATOM 547 N SER A 682 0.876 -7.303 -0.277 1.00 0.00 N ATOM 548 CA SER A 682 1.443 -8.631 0.099 1.00 0.00 C ATOM 549 C SER A 682 1.174 -9.647 -1.010 1.00 0.00 C ATOM 550 O SER A 682 2.023 -10.449 -1.347 1.00 0.00 O ATOM 551 CB SER A 682 0.694 -9.019 1.373 1.00 0.00 C ATOM 552 OG SER A 682 1.227 -10.233 1.888 1.00 0.00 O ATOM 0 H SER A 682 0.186 -6.930 0.375 1.00 0.00 H new ATOM 0 HA SER A 682 2.522 -8.601 0.248 1.00 0.00 H new ATOM 0 HB2 SER A 682 0.784 -8.226 2.116 1.00 0.00 H new ATOM 0 HB3 SER A 682 -0.369 -9.138 1.161 1.00 0.00 H new ATOM 0 HG SER A 682 0.747 -10.480 2.706 1.00 0.00 H new ATOM 558 N ARG A 683 0.008 -9.617 -1.592 1.00 0.00 N ATOM 559 CA ARG A 683 -0.281 -10.578 -2.693 1.00 0.00 C ATOM 560 C ARG A 683 0.594 -10.239 -3.897 1.00 0.00 C ATOM 561 O ARG A 683 1.201 -11.097 -4.510 1.00 0.00 O ATOM 562 CB ARG A 683 -1.757 -10.375 -3.021 1.00 0.00 C ATOM 563 CG ARG A 683 -2.609 -10.962 -1.897 1.00 0.00 C ATOM 564 CD ARG A 683 -2.739 -12.474 -2.103 1.00 0.00 C ATOM 565 NE ARG A 683 -2.046 -13.094 -0.938 1.00 0.00 N ATOM 566 CZ ARG A 683 -2.741 -13.698 -0.012 1.00 0.00 C ATOM 567 NH1 ARG A 683 -3.219 -14.893 -0.228 1.00 0.00 N ATOM 568 NH2 ARG A 683 -2.948 -13.111 1.135 1.00 0.00 N ATOM 0 H ARG A 683 -0.750 -8.976 -1.357 1.00 0.00 H new ATOM 0 HA ARG A 683 -0.074 -11.613 -2.419 1.00 0.00 H new ATOM 0 HB2 ARG A 683 -1.972 -9.313 -3.140 1.00 0.00 H new ATOM 0 HB3 ARG A 683 -2.001 -10.857 -3.968 1.00 0.00 H new ATOM 0 HG2 ARG A 683 -2.152 -10.752 -0.930 1.00 0.00 H new ATOM 0 HG3 ARG A 683 -3.595 -10.497 -1.891 1.00 0.00 H new ATOM 0 HD2 ARG A 683 -3.785 -12.776 -2.144 1.00 0.00 H new ATOM 0 HD3 ARG A 683 -2.281 -12.783 -3.043 1.00 0.00 H new ATOM 0 HE ARG A 683 -1.030 -13.047 -0.864 1.00 0.00 H new ATOM 0 HH11 ARG A 683 -3.050 -15.356 -1.121 1.00 0.00 H new ATOM 0 HH12 ARG A 683 -3.762 -15.364 0.496 1.00 0.00 H new ATOM 0 HH21 ARG A 683 -2.567 -12.181 1.308 1.00 0.00 H new ATOM 0 HH22 ARG A 683 -3.491 -13.582 1.859 1.00 0.00 H new ATOM 582 N VAL A 684 0.693 -8.981 -4.211 1.00 0.00 N ATOM 583 CA VAL A 684 1.552 -8.565 -5.337 1.00 0.00 C ATOM 584 C VAL A 684 2.998 -8.826 -4.937 1.00 0.00 C ATOM 585 O VAL A 684 3.853 -9.063 -5.766 1.00 0.00 O ATOM 586 CB VAL A 684 1.261 -7.068 -5.512 1.00 0.00 C ATOM 587 CG1 VAL A 684 2.485 -6.351 -6.078 1.00 0.00 C ATOM 588 CG2 VAL A 684 0.097 -6.895 -6.488 1.00 0.00 C ATOM 0 H VAL A 684 0.211 -8.222 -3.730 1.00 0.00 H new ATOM 0 HA VAL A 684 1.370 -9.099 -6.270 1.00 0.00 H new ATOM 0 HB VAL A 684 1.012 -6.642 -4.540 1.00 0.00 H new ATOM 0 HG11 VAL A 684 2.263 -5.290 -6.196 1.00 0.00 H new ATOM 0 HG12 VAL A 684 3.326 -6.472 -5.395 1.00 0.00 H new ATOM 0 HG13 VAL A 684 2.741 -6.778 -7.047 1.00 0.00 H new ATOM 0 HG21 VAL A 684 -0.115 -5.834 -6.617 1.00 0.00 H new ATOM 0 HG22 VAL A 684 0.362 -7.332 -7.451 1.00 0.00 H new ATOM 0 HG23 VAL A 684 -0.787 -7.396 -6.093 1.00 0.00 H new ATOM 598 N LEU A 685 3.270 -8.794 -3.657 1.00 0.00 N ATOM 599 CA LEU A 685 4.655 -9.044 -3.188 1.00 0.00 C ATOM 600 C LEU A 685 5.142 -10.408 -3.669 1.00 0.00 C ATOM 601 O LEU A 685 6.144 -10.505 -4.328 1.00 0.00 O ATOM 602 CB LEU A 685 4.576 -9.030 -1.664 1.00 0.00 C ATOM 603 CG LEU A 685 5.640 -8.087 -1.084 1.00 0.00 C ATOM 604 CD1 LEU A 685 6.941 -8.189 -1.881 1.00 0.00 C ATOM 605 CD2 LEU A 685 5.127 -6.647 -1.136 1.00 0.00 C ATOM 0 H LEU A 685 2.589 -8.605 -2.921 1.00 0.00 H new ATOM 0 HA LEU A 685 5.350 -8.297 -3.571 1.00 0.00 H new ATOM 0 HB2 LEU A 685 3.584 -8.708 -1.347 1.00 0.00 H new ATOM 0 HB3 LEU A 685 4.723 -10.038 -1.276 1.00 0.00 H new ATOM 0 HG LEU A 685 5.836 -8.375 -0.051 1.00 0.00 H new ATOM 0 HD11 LEU A 685 7.683 -7.513 -1.455 1.00 0.00 H new ATOM 0 HD12 LEU A 685 7.315 -9.212 -1.838 1.00 0.00 H new ATOM 0 HD13 LEU A 685 6.754 -7.914 -2.919 1.00 0.00 H new ATOM 0 HD21 LEU A 685 5.882 -5.977 -0.724 1.00 0.00 H new ATOM 0 HD22 LEU A 685 4.922 -6.371 -2.170 1.00 0.00 H new ATOM 0 HD23 LEU A 685 4.211 -6.566 -0.550 1.00 0.00 H new ATOM 617 N LYS A 686 4.443 -11.466 -3.367 1.00 0.00 N ATOM 618 CA LYS A 686 4.914 -12.801 -3.840 1.00 0.00 C ATOM 619 C LYS A 686 4.911 -12.853 -5.369 1.00 0.00 C ATOM 620 O LYS A 686 5.850 -13.322 -5.980 1.00 0.00 O ATOM 621 CB LYS A 686 3.934 -13.815 -3.245 1.00 0.00 C ATOM 622 CG LYS A 686 4.215 -13.972 -1.749 1.00 0.00 C ATOM 623 CD LYS A 686 5.179 -15.141 -1.521 1.00 0.00 C ATOM 624 CE LYS A 686 5.473 -15.276 -0.024 1.00 0.00 C ATOM 625 NZ LYS A 686 4.198 -15.746 0.587 1.00 0.00 N ATOM 0 H LYS A 686 3.580 -11.468 -2.823 1.00 0.00 H new ATOM 0 HA LYS A 686 5.936 -13.012 -3.526 1.00 0.00 H new ATOM 0 HB2 LYS A 686 2.908 -13.481 -3.401 1.00 0.00 H new ATOM 0 HB3 LYS A 686 4.037 -14.776 -3.749 1.00 0.00 H new ATOM 0 HG2 LYS A 686 4.644 -13.052 -1.352 1.00 0.00 H new ATOM 0 HG3 LYS A 686 3.283 -14.147 -1.211 1.00 0.00 H new ATOM 0 HD2 LYS A 686 4.744 -16.065 -1.902 1.00 0.00 H new ATOM 0 HD3 LYS A 686 6.105 -14.975 -2.071 1.00 0.00 H new ATOM 0 HE2 LYS A 686 6.280 -15.986 0.156 1.00 0.00 H new ATOM 0 HE3 LYS A 686 5.786 -14.323 0.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 686 4.402 -16.238 1.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 686 3.581 -14.930 0.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 686 3.720 -16.398 -0.067 1.00 0.00 H new ATOM 639 N LYS A 687 3.876 -12.357 -5.996 1.00 0.00 N ATOM 640 CA LYS A 687 3.839 -12.369 -7.486 1.00 0.00 C ATOM 641 C LYS A 687 4.912 -11.432 -8.036 1.00 0.00 C ATOM 642 O LYS A 687 5.390 -11.608 -9.141 1.00 0.00 O ATOM 643 CB LYS A 687 2.437 -11.879 -7.881 1.00 0.00 C ATOM 644 CG LYS A 687 2.279 -11.967 -9.405 1.00 0.00 C ATOM 645 CD LYS A 687 1.108 -11.094 -9.873 1.00 0.00 C ATOM 646 CE LYS A 687 1.068 -11.091 -11.405 1.00 0.00 C ATOM 647 NZ LYS A 687 -0.178 -10.359 -11.765 1.00 0.00 N ATOM 0 H LYS A 687 3.060 -11.947 -5.543 1.00 0.00 H new ATOM 0 HA LYS A 687 4.034 -13.362 -7.890 1.00 0.00 H new ATOM 0 HB2 LYS A 687 1.676 -12.485 -7.389 1.00 0.00 H new ATOM 0 HB3 LYS A 687 2.291 -10.852 -7.548 1.00 0.00 H new ATOM 0 HG2 LYS A 687 3.199 -11.643 -9.892 1.00 0.00 H new ATOM 0 HG3 LYS A 687 2.109 -13.002 -9.700 1.00 0.00 H new ATOM 0 HD2 LYS A 687 0.169 -11.477 -9.473 1.00 0.00 H new ATOM 0 HD3 LYS A 687 1.223 -10.077 -9.498 1.00 0.00 H new ATOM 0 HE2 LYS A 687 1.947 -10.598 -11.820 1.00 0.00 H new ATOM 0 HE3 LYS A 687 1.055 -12.107 -11.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 687 -0.270 -10.319 -12.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 687 -1.000 -10.854 -11.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 687 -0.135 -9.393 -11.383 1.00 0.00 H new ATOM 661 N ASN A 688 5.285 -10.425 -7.288 1.00 0.00 N ATOM 662 CA ASN A 688 6.316 -9.486 -7.806 1.00 0.00 C ATOM 663 C ASN A 688 7.540 -9.421 -6.868 1.00 0.00 C ATOM 664 O ASN A 688 8.319 -8.493 -6.924 1.00 0.00 O ATOM 665 CB ASN A 688 5.585 -8.135 -7.922 1.00 0.00 C ATOM 666 CG ASN A 688 5.820 -7.259 -6.694 1.00 0.00 C ATOM 667 OD1 ASN A 688 5.931 -6.056 -6.811 1.00 0.00 O ATOM 668 ND2 ASN A 688 5.895 -7.797 -5.517 1.00 0.00 N ATOM 0 H ASN A 688 4.925 -10.217 -6.356 1.00 0.00 H new ATOM 0 HA ASN A 688 6.725 -9.800 -8.767 1.00 0.00 H new ATOM 0 HB2 ASN A 688 5.928 -7.611 -8.814 1.00 0.00 H new ATOM 0 HB3 ASN A 688 4.516 -8.309 -8.046 1.00 0.00 H new ATOM 0 HD21 ASN A 688 6.046 -7.210 -4.697 1.00 0.00 H new ATOM 0 HD22 ASN A 688 5.803 -8.807 -5.411 1.00 0.00 H new ATOM 675 N ASN A 689 7.746 -10.411 -6.033 1.00 0.00 N ATOM 676 CA ASN A 689 8.952 -10.379 -5.142 1.00 0.00 C ATOM 677 C ASN A 689 10.159 -10.911 -5.902 1.00 0.00 C ATOM 678 O ASN A 689 11.239 -11.049 -5.363 1.00 0.00 O ATOM 679 CB ASN A 689 8.661 -11.295 -3.952 1.00 0.00 C ATOM 680 CG ASN A 689 8.401 -12.714 -4.462 1.00 0.00 C ATOM 681 OD1 ASN A 689 8.496 -12.971 -5.647 1.00 0.00 O ATOM 682 ND2 ASN A 689 8.076 -13.652 -3.616 1.00 0.00 N ATOM 0 H ASN A 689 7.144 -11.227 -5.929 1.00 0.00 H new ATOM 0 HA ASN A 689 9.163 -9.362 -4.811 1.00 0.00 H new ATOM 0 HB2 ASN A 689 9.504 -11.293 -3.261 1.00 0.00 H new ATOM 0 HB3 ASN A 689 7.795 -10.930 -3.400 1.00 0.00 H new ATOM 0 HD21 ASN A 689 7.902 -14.600 -3.948 1.00 0.00 H new ATOM 0 HD22 ASN A 689 7.996 -13.437 -2.622 1.00 0.00 H new ATOM 689 N ARG A 690 9.989 -11.186 -7.160 1.00 0.00 N ATOM 690 CA ARG A 690 11.135 -11.680 -7.967 1.00 0.00 C ATOM 691 C ARG A 690 11.752 -10.513 -8.732 1.00 0.00 C ATOM 692 O ARG A 690 12.951 -10.440 -8.918 1.00 0.00 O ATOM 693 CB ARG A 690 10.534 -12.705 -8.926 1.00 0.00 C ATOM 694 CG ARG A 690 11.645 -13.356 -9.748 1.00 0.00 C ATOM 695 CD ARG A 690 11.167 -14.714 -10.274 1.00 0.00 C ATOM 696 NE ARG A 690 11.195 -15.622 -9.090 1.00 0.00 N ATOM 697 CZ ARG A 690 10.119 -16.272 -8.732 1.00 0.00 C ATOM 698 NH1 ARG A 690 9.311 -16.752 -9.637 1.00 0.00 N ATOM 699 NH2 ARG A 690 9.855 -16.454 -7.466 1.00 0.00 N ATOM 0 H ARG A 690 9.108 -11.091 -7.665 1.00 0.00 H new ATOM 0 HA ARG A 690 11.924 -12.122 -7.358 1.00 0.00 H new ATOM 0 HB2 ARG A 690 9.990 -13.465 -8.366 1.00 0.00 H new ATOM 0 HB3 ARG A 690 9.815 -12.221 -9.587 1.00 0.00 H new ATOM 0 HG2 ARG A 690 11.922 -12.709 -10.581 1.00 0.00 H new ATOM 0 HG3 ARG A 690 12.537 -13.486 -9.135 1.00 0.00 H new ATOM 0 HD2 ARG A 690 10.163 -14.643 -10.693 1.00 0.00 H new ATOM 0 HD3 ARG A 690 11.818 -15.081 -11.067 1.00 0.00 H new ATOM 0 HE ARG A 690 12.058 -15.736 -8.558 1.00 0.00 H new ATOM 0 HH11 ARG A 690 9.518 -16.620 -10.627 1.00 0.00 H new ATOM 0 HH12 ARG A 690 8.472 -17.259 -9.354 1.00 0.00 H new ATOM 0 HH21 ARG A 690 10.489 -16.089 -6.755 1.00 0.00 H new ATOM 0 HH22 ARG A 690 9.015 -16.961 -7.188 1.00 0.00 H new ATOM 713 N ASP A 691 10.939 -9.597 -9.171 1.00 0.00 N ATOM 714 CA ASP A 691 11.467 -8.425 -9.918 1.00 0.00 C ATOM 715 C ASP A 691 11.272 -7.144 -9.097 1.00 0.00 C ATOM 716 O ASP A 691 12.063 -6.224 -9.167 1.00 0.00 O ATOM 717 CB ASP A 691 10.645 -8.387 -11.205 1.00 0.00 C ATOM 718 CG ASP A 691 11.070 -9.548 -12.108 1.00 0.00 C ATOM 719 OD1 ASP A 691 12.210 -9.970 -11.999 1.00 0.00 O ATOM 720 OD2 ASP A 691 10.250 -9.994 -12.893 1.00 0.00 O ATOM 0 H ASP A 691 9.927 -9.609 -9.044 1.00 0.00 H new ATOM 0 HA ASP A 691 12.535 -8.500 -10.122 1.00 0.00 H new ATOM 0 HB2 ASP A 691 9.582 -8.460 -10.974 1.00 0.00 H new ATOM 0 HB3 ASP A 691 10.795 -7.437 -11.719 1.00 0.00 H new ATOM 725 N SER A 692 10.209 -7.073 -8.334 1.00 0.00 N ATOM 726 CA SER A 692 9.946 -5.845 -7.523 1.00 0.00 C ATOM 727 C SER A 692 10.448 -6.021 -6.087 1.00 0.00 C ATOM 728 O SER A 692 11.423 -6.690 -5.835 1.00 0.00 O ATOM 729 CB SER A 692 8.432 -5.670 -7.522 1.00 0.00 C ATOM 730 OG SER A 692 7.957 -5.658 -8.862 1.00 0.00 O ATOM 0 H SER A 692 9.513 -7.812 -8.238 1.00 0.00 H new ATOM 0 HA SER A 692 10.462 -4.980 -7.940 1.00 0.00 H new ATOM 0 HB2 SER A 692 7.962 -6.480 -6.965 1.00 0.00 H new ATOM 0 HB3 SER A 692 8.163 -4.740 -7.021 1.00 0.00 H new ATOM 0 HG SER A 692 6.979 -5.713 -8.863 1.00 0.00 H new ATOM 736 N ALA A 693 9.777 -5.417 -5.145 1.00 0.00 N ATOM 737 CA ALA A 693 10.203 -5.524 -3.721 1.00 0.00 C ATOM 738 C ALA A 693 9.772 -6.858 -3.102 1.00 0.00 C ATOM 739 O ALA A 693 8.922 -7.560 -3.615 1.00 0.00 O ATOM 740 CB ALA A 693 9.508 -4.355 -3.020 1.00 0.00 C ATOM 0 H ALA A 693 8.945 -4.849 -5.303 1.00 0.00 H new ATOM 0 HA ALA A 693 11.288 -5.487 -3.622 1.00 0.00 H new ATOM 0 HB1 ALA A 693 9.768 -4.359 -1.962 1.00 0.00 H new ATOM 0 HB2 ALA A 693 9.832 -3.416 -3.470 1.00 0.00 H new ATOM 0 HB3 ALA A 693 8.428 -4.456 -3.128 1.00 0.00 H new ATOM 746 N VAL A 694 10.371 -7.200 -1.997 1.00 0.00 N ATOM 747 CA VAL A 694 10.041 -8.473 -1.300 1.00 0.00 C ATOM 748 C VAL A 694 9.827 -8.181 0.189 1.00 0.00 C ATOM 749 O VAL A 694 10.329 -7.206 0.710 1.00 0.00 O ATOM 750 CB VAL A 694 11.271 -9.357 -1.534 1.00 0.00 C ATOM 751 CG1 VAL A 694 11.138 -10.663 -0.746 1.00 0.00 C ATOM 752 CG2 VAL A 694 11.367 -9.687 -3.025 1.00 0.00 C ATOM 0 H VAL A 694 11.090 -6.640 -1.539 1.00 0.00 H new ATOM 0 HA VAL A 694 9.132 -8.955 -1.660 1.00 0.00 H new ATOM 0 HB VAL A 694 12.163 -8.826 -1.202 1.00 0.00 H new ATOM 0 HG11 VAL A 694 12.017 -11.284 -0.919 1.00 0.00 H new ATOM 0 HG12 VAL A 694 11.056 -10.439 0.318 1.00 0.00 H new ATOM 0 HG13 VAL A 694 10.246 -11.197 -1.075 1.00 0.00 H new ATOM 0 HG21 VAL A 694 12.239 -10.316 -3.203 1.00 0.00 H new ATOM 0 HG22 VAL A 694 10.468 -10.217 -3.339 1.00 0.00 H new ATOM 0 HG23 VAL A 694 11.463 -8.764 -3.597 1.00 0.00 H new ATOM 762 N ALA A 695 9.070 -8.995 0.873 1.00 0.00 N ATOM 763 CA ALA A 695 8.816 -8.733 2.322 1.00 0.00 C ATOM 764 C ALA A 695 8.177 -7.345 2.502 1.00 0.00 C ATOM 765 O ALA A 695 8.821 -6.328 2.340 1.00 0.00 O ATOM 766 CB ALA A 695 10.192 -8.802 2.993 1.00 0.00 C ATOM 0 H ALA A 695 8.617 -9.827 0.495 1.00 0.00 H new ATOM 0 HA ALA A 695 8.126 -9.454 2.761 1.00 0.00 H new ATOM 0 HB1 ALA A 695 10.085 -8.619 4.062 1.00 0.00 H new ATOM 0 HB2 ALA A 695 10.624 -9.790 2.836 1.00 0.00 H new ATOM 0 HB3 ALA A 695 10.847 -8.046 2.559 1.00 0.00 H new ATOM 772 N SER A 696 6.906 -7.306 2.820 1.00 0.00 N ATOM 773 CA SER A 696 6.201 -5.996 2.997 1.00 0.00 C ATOM 774 C SER A 696 6.284 -5.498 4.441 1.00 0.00 C ATOM 775 O SER A 696 5.491 -4.675 4.854 1.00 0.00 O ATOM 776 CB SER A 696 4.743 -6.266 2.634 1.00 0.00 C ATOM 777 OG SER A 696 4.226 -7.282 3.483 1.00 0.00 O ATOM 0 H SER A 696 6.323 -8.130 2.966 1.00 0.00 H new ATOM 0 HA SER A 696 6.657 -5.227 2.374 1.00 0.00 H new ATOM 0 HB2 SER A 696 4.155 -5.354 2.740 1.00 0.00 H new ATOM 0 HB3 SER A 696 4.667 -6.575 1.591 1.00 0.00 H new ATOM 0 HG SER A 696 3.289 -7.456 3.253 1.00 0.00 H new ATOM 783 N GLU A 697 7.222 -5.968 5.219 1.00 0.00 N ATOM 784 CA GLU A 697 7.301 -5.471 6.624 1.00 0.00 C ATOM 785 C GLU A 697 7.758 -4.027 6.596 1.00 0.00 C ATOM 786 O GLU A 697 8.878 -3.705 6.939 1.00 0.00 O ATOM 787 CB GLU A 697 8.345 -6.328 7.324 1.00 0.00 C ATOM 788 CG GLU A 697 7.801 -7.737 7.511 1.00 0.00 C ATOM 789 CD GLU A 697 8.658 -8.470 8.545 1.00 0.00 C ATOM 790 OE1 GLU A 697 9.831 -8.669 8.277 1.00 0.00 O ATOM 791 OE2 GLU A 697 8.129 -8.811 9.589 1.00 0.00 O ATOM 0 H GLU A 697 7.923 -6.659 4.951 1.00 0.00 H new ATOM 0 HA GLU A 697 6.341 -5.529 7.137 1.00 0.00 H new ATOM 0 HB2 GLU A 697 9.262 -6.356 6.736 1.00 0.00 H new ATOM 0 HB3 GLU A 697 8.599 -5.893 8.291 1.00 0.00 H new ATOM 0 HG2 GLU A 697 6.763 -7.699 7.842 1.00 0.00 H new ATOM 0 HG3 GLU A 697 7.814 -8.274 6.563 1.00 0.00 H new ATOM 798 N PHE A 698 6.904 -3.159 6.159 1.00 0.00 N ATOM 799 CA PHE A 698 7.287 -1.736 6.064 1.00 0.00 C ATOM 800 C PHE A 698 6.238 -0.801 6.690 1.00 0.00 C ATOM 801 O PHE A 698 5.171 -1.211 7.106 1.00 0.00 O ATOM 802 CB PHE A 698 7.437 -1.478 4.555 1.00 0.00 C ATOM 803 CG PHE A 698 6.302 -2.088 3.761 1.00 0.00 C ATOM 804 CD1 PHE A 698 5.002 -2.121 4.264 1.00 0.00 C ATOM 805 CD2 PHE A 698 6.568 -2.605 2.484 1.00 0.00 C ATOM 806 CE1 PHE A 698 3.969 -2.655 3.500 1.00 0.00 C ATOM 807 CE2 PHE A 698 5.535 -3.149 1.722 1.00 0.00 C ATOM 808 CZ PHE A 698 4.232 -3.169 2.229 1.00 0.00 C ATOM 0 H PHE A 698 5.952 -3.375 5.862 1.00 0.00 H new ATOM 0 HA PHE A 698 8.203 -1.532 6.618 1.00 0.00 H new ATOM 0 HB2 PHE A 698 7.471 -0.404 4.372 1.00 0.00 H new ATOM 0 HB3 PHE A 698 8.385 -1.891 4.209 1.00 0.00 H new ATOM 0 HD1 PHE A 698 4.796 -1.731 5.250 1.00 0.00 H new ATOM 0 HD2 PHE A 698 7.574 -2.582 2.091 1.00 0.00 H new ATOM 0 HE1 PHE A 698 2.962 -2.672 3.891 1.00 0.00 H new ATOM 0 HE2 PHE A 698 5.741 -3.554 0.742 1.00 0.00 H new ATOM 0 HZ PHE A 698 3.429 -3.582 1.637 1.00 0.00 H new ATOM 818 N GLU A 699 6.554 0.461 6.749 1.00 0.00 N ATOM 819 CA GLU A 699 5.623 1.473 7.306 1.00 0.00 C ATOM 820 C GLU A 699 4.972 2.202 6.129 1.00 0.00 C ATOM 821 O GLU A 699 5.648 2.698 5.250 1.00 0.00 O ATOM 822 CB GLU A 699 6.532 2.408 8.111 1.00 0.00 C ATOM 823 CG GLU A 699 5.717 3.525 8.763 1.00 0.00 C ATOM 824 CD GLU A 699 6.678 4.535 9.396 1.00 0.00 C ATOM 825 OE1 GLU A 699 7.873 4.290 9.352 1.00 0.00 O ATOM 826 OE2 GLU A 699 6.205 5.535 9.910 1.00 0.00 O ATOM 0 H GLU A 699 7.444 0.841 6.425 1.00 0.00 H new ATOM 0 HA GLU A 699 4.825 1.067 7.928 1.00 0.00 H new ATOM 0 HB2 GLU A 699 7.058 1.840 8.878 1.00 0.00 H new ATOM 0 HB3 GLU A 699 7.290 2.839 7.457 1.00 0.00 H new ATOM 0 HG2 GLU A 699 5.089 4.017 8.020 1.00 0.00 H new ATOM 0 HG3 GLU A 699 5.051 3.113 9.521 1.00 0.00 H new ATOM 833 N LEU A 700 3.674 2.244 6.074 1.00 0.00 N ATOM 834 CA LEU A 700 3.015 2.912 4.922 1.00 0.00 C ATOM 835 C LEU A 700 2.436 4.265 5.355 1.00 0.00 C ATOM 836 O LEU A 700 1.739 4.376 6.342 1.00 0.00 O ATOM 837 CB LEU A 700 1.938 1.913 4.473 1.00 0.00 C ATOM 838 CG LEU A 700 2.628 0.626 3.994 1.00 0.00 C ATOM 839 CD1 LEU A 700 3.142 -0.164 5.192 1.00 0.00 C ATOM 840 CD2 LEU A 700 1.649 -0.242 3.201 1.00 0.00 C ATOM 0 H LEU A 700 3.044 1.848 6.771 1.00 0.00 H new ATOM 0 HA LEU A 700 3.695 3.145 4.103 1.00 0.00 H new ATOM 0 HB2 LEU A 700 1.259 1.693 5.297 1.00 0.00 H new ATOM 0 HB3 LEU A 700 1.337 2.341 3.670 1.00 0.00 H new ATOM 0 HG LEU A 700 3.463 0.902 3.350 1.00 0.00 H new ATOM 0 HD11 LEU A 700 3.630 -1.075 4.845 1.00 0.00 H new ATOM 0 HD12 LEU A 700 3.858 0.442 5.747 1.00 0.00 H new ATOM 0 HD13 LEU A 700 2.306 -0.425 5.841 1.00 0.00 H new ATOM 0 HD21 LEU A 700 2.154 -1.149 2.869 1.00 0.00 H new ATOM 0 HD22 LEU A 700 0.803 -0.508 3.835 1.00 0.00 H new ATOM 0 HD23 LEU A 700 1.292 0.312 2.333 1.00 0.00 H new ATOM 852 N VAL A 701 2.743 5.301 4.620 1.00 0.00 N ATOM 853 CA VAL A 701 2.240 6.658 4.980 1.00 0.00 C ATOM 854 C VAL A 701 1.370 7.182 3.845 1.00 0.00 C ATOM 855 O VAL A 701 1.787 7.237 2.708 1.00 0.00 O ATOM 856 CB VAL A 701 3.501 7.513 5.154 1.00 0.00 C ATOM 857 CG1 VAL A 701 3.121 8.960 5.485 1.00 0.00 C ATOM 858 CG2 VAL A 701 4.345 6.939 6.294 1.00 0.00 C ATOM 0 H VAL A 701 3.323 5.265 3.782 1.00 0.00 H new ATOM 0 HA VAL A 701 1.631 6.667 5.884 1.00 0.00 H new ATOM 0 HB VAL A 701 4.070 7.500 4.224 1.00 0.00 H new ATOM 0 HG11 VAL A 701 4.026 9.555 5.606 1.00 0.00 H new ATOM 0 HG12 VAL A 701 2.520 9.373 4.674 1.00 0.00 H new ATOM 0 HG13 VAL A 701 2.546 8.982 6.411 1.00 0.00 H new ATOM 0 HG21 VAL A 701 5.243 7.543 6.422 1.00 0.00 H new ATOM 0 HG22 VAL A 701 3.765 6.950 7.217 1.00 0.00 H new ATOM 0 HG23 VAL A 701 4.629 5.914 6.056 1.00 0.00 H new ATOM 868 N GLN A 702 0.157 7.534 4.137 1.00 0.00 N ATOM 869 CA GLN A 702 -0.755 8.016 3.069 1.00 0.00 C ATOM 870 C GLN A 702 -0.611 9.520 2.835 1.00 0.00 C ATOM 871 O GLN A 702 -0.142 10.251 3.683 1.00 0.00 O ATOM 872 CB GLN A 702 -2.153 7.669 3.572 1.00 0.00 C ATOM 873 CG GLN A 702 -3.177 7.895 2.460 1.00 0.00 C ATOM 874 CD GLN A 702 -4.309 6.882 2.603 1.00 0.00 C ATOM 875 OE1 GLN A 702 -4.234 5.982 3.415 1.00 0.00 O ATOM 876 NE2 GLN A 702 -5.362 6.990 1.843 1.00 0.00 N ATOM 0 H GLN A 702 -0.246 7.509 5.074 1.00 0.00 H new ATOM 0 HA GLN A 702 -0.532 7.553 2.108 1.00 0.00 H new ATOM 0 HB2 GLN A 702 -2.183 6.630 3.900 1.00 0.00 H new ATOM 0 HB3 GLN A 702 -2.401 8.284 4.437 1.00 0.00 H new ATOM 0 HG2 GLN A 702 -3.572 8.909 2.515 1.00 0.00 H new ATOM 0 HG3 GLN A 702 -2.701 7.790 1.485 1.00 0.00 H new ATOM 0 HE21 GLN A 702 -5.424 7.746 1.161 1.00 0.00 H new ATOM 0 HE22 GLN A 702 -6.125 6.318 1.930 1.00 0.00 H new ATOM 885 N LEU A 703 -1.004 9.947 1.659 1.00 0.00 N ATOM 886 CA LEU A 703 -0.936 11.392 1.244 1.00 0.00 C ATOM 887 C LEU A 703 0.464 11.767 0.809 1.00 0.00 C ATOM 888 O LEU A 703 1.446 11.421 1.433 1.00 0.00 O ATOM 889 CB LEU A 703 -1.383 12.261 2.428 1.00 0.00 C ATOM 890 CG LEU A 703 -2.900 12.466 2.388 1.00 0.00 C ATOM 891 CD1 LEU A 703 -3.344 12.918 0.992 1.00 0.00 C ATOM 892 CD2 LEU A 703 -3.589 11.152 2.741 1.00 0.00 C ATOM 0 H LEU A 703 -1.384 9.331 0.940 1.00 0.00 H new ATOM 0 HA LEU A 703 -1.596 11.556 0.392 1.00 0.00 H new ATOM 0 HB2 LEU A 703 -1.097 11.786 3.366 1.00 0.00 H new ATOM 0 HB3 LEU A 703 -0.877 13.226 2.392 1.00 0.00 H new ATOM 0 HG LEU A 703 -3.175 13.238 3.107 1.00 0.00 H new ATOM 0 HD11 LEU A 703 -4.425 13.059 0.982 1.00 0.00 H new ATOM 0 HD12 LEU A 703 -2.853 13.858 0.741 1.00 0.00 H new ATOM 0 HD13 LEU A 703 -3.070 12.159 0.259 1.00 0.00 H new ATOM 0 HD21 LEU A 703 -4.670 11.289 2.715 1.00 0.00 H new ATOM 0 HD22 LEU A 703 -3.303 10.386 2.020 1.00 0.00 H new ATOM 0 HD23 LEU A 703 -3.287 10.840 3.741 1.00 0.00 H new ATOM 904 N LEU A 704 0.555 12.480 -0.272 1.00 0.00 N ATOM 905 CA LEU A 704 1.884 12.888 -0.768 1.00 0.00 C ATOM 906 C LEU A 704 2.525 13.883 0.226 1.00 0.00 C ATOM 907 O LEU A 704 3.680 13.730 0.567 1.00 0.00 O ATOM 908 CB LEU A 704 1.613 13.508 -2.149 1.00 0.00 C ATOM 909 CG LEU A 704 1.345 12.397 -3.183 1.00 0.00 C ATOM 910 CD1 LEU A 704 0.340 11.377 -2.633 1.00 0.00 C ATOM 911 CD2 LEU A 704 0.763 13.019 -4.455 1.00 0.00 C ATOM 0 H LEU A 704 -0.237 12.797 -0.832 1.00 0.00 H new ATOM 0 HA LEU A 704 2.592 12.064 -0.855 1.00 0.00 H new ATOM 0 HB2 LEU A 704 0.756 14.179 -2.094 1.00 0.00 H new ATOM 0 HB3 LEU A 704 2.468 14.108 -2.461 1.00 0.00 H new ATOM 0 HG LEU A 704 2.286 11.892 -3.400 1.00 0.00 H new ATOM 0 HD11 LEU A 704 0.164 10.601 -3.378 1.00 0.00 H new ATOM 0 HD12 LEU A 704 0.740 10.925 -1.726 1.00 0.00 H new ATOM 0 HD13 LEU A 704 -0.600 11.879 -2.404 1.00 0.00 H new ATOM 0 HD21 LEU A 704 0.572 12.236 -5.189 1.00 0.00 H new ATOM 0 HD22 LEU A 704 -0.171 13.528 -4.217 1.00 0.00 H new ATOM 0 HD23 LEU A 704 1.473 13.737 -4.867 1.00 0.00 H new ATOM 923 N PRO A 705 1.755 14.847 0.707 1.00 0.00 N ATOM 924 CA PRO A 705 2.284 15.808 1.710 1.00 0.00 C ATOM 925 C PRO A 705 2.518 15.094 3.039 1.00 0.00 C ATOM 926 O PRO A 705 3.347 15.481 3.839 1.00 0.00 O ATOM 927 CB PRO A 705 1.138 16.809 1.862 1.00 0.00 C ATOM 928 CG PRO A 705 -0.012 16.390 0.934 1.00 0.00 C ATOM 929 CD PRO A 705 0.346 15.046 0.284 1.00 0.00 C ATOM 0 HA PRO A 705 3.229 16.264 1.417 1.00 0.00 H new ATOM 0 HB2 PRO A 705 0.797 16.837 2.897 1.00 0.00 H new ATOM 0 HB3 PRO A 705 1.479 17.814 1.611 1.00 0.00 H new ATOM 0 HG2 PRO A 705 -0.940 16.302 1.499 1.00 0.00 H new ATOM 0 HG3 PRO A 705 -0.176 17.149 0.168 1.00 0.00 H new ATOM 0 HD2 PRO A 705 -0.300 14.241 0.635 1.00 0.00 H new ATOM 0 HD3 PRO A 705 0.250 15.082 -0.801 1.00 0.00 H new ATOM 937 N GLY A 706 1.757 14.066 3.282 1.00 0.00 N ATOM 938 CA GLY A 706 1.878 13.323 4.561 1.00 0.00 C ATOM 939 C GLY A 706 0.767 13.791 5.494 1.00 0.00 C ATOM 940 O GLY A 706 0.813 14.874 6.040 1.00 0.00 O ATOM 0 H GLY A 706 1.049 13.706 2.641 1.00 0.00 H new ATOM 0 HA2 GLY A 706 1.800 12.250 4.386 1.00 0.00 H new ATOM 0 HA3 GLY A 706 2.854 13.502 5.013 1.00 0.00 H new ATOM 944 N ASP A 707 -0.236 12.987 5.676 1.00 0.00 N ATOM 945 CA ASP A 707 -1.355 13.382 6.572 1.00 0.00 C ATOM 946 C ASP A 707 -1.643 12.253 7.555 1.00 0.00 C ATOM 947 O ASP A 707 -1.563 12.421 8.757 1.00 0.00 O ATOM 948 CB ASP A 707 -2.541 13.612 5.633 1.00 0.00 C ATOM 949 CG ASP A 707 -2.409 14.992 4.987 1.00 0.00 C ATOM 950 OD1 ASP A 707 -1.487 15.704 5.347 1.00 0.00 O ATOM 951 OD2 ASP A 707 -3.236 15.316 4.151 1.00 0.00 O ATOM 0 H ASP A 707 -0.331 12.069 5.242 1.00 0.00 H new ATOM 0 HA ASP A 707 -1.136 14.270 7.165 1.00 0.00 H new ATOM 0 HB2 ASP A 707 -2.568 12.839 4.865 1.00 0.00 H new ATOM 0 HB3 ASP A 707 -3.477 13.544 6.187 1.00 0.00 H new ATOM 956 N ARG A 708 -1.948 11.097 7.047 1.00 0.00 N ATOM 957 CA ARG A 708 -2.217 9.935 7.934 1.00 0.00 C ATOM 958 C ARG A 708 -1.375 8.751 7.465 1.00 0.00 C ATOM 959 O ARG A 708 -0.932 8.708 6.334 1.00 0.00 O ATOM 960 CB ARG A 708 -3.712 9.662 7.790 1.00 0.00 C ATOM 961 CG ARG A 708 -4.470 10.830 8.416 1.00 0.00 C ATOM 962 CD ARG A 708 -5.957 10.502 8.510 1.00 0.00 C ATOM 963 NE ARG A 708 -6.573 11.742 9.051 1.00 0.00 N ATOM 964 CZ ARG A 708 -7.862 11.812 9.207 1.00 0.00 C ATOM 965 NH1 ARG A 708 -8.618 12.195 8.214 1.00 0.00 N ATOM 966 NH2 ARG A 708 -8.392 11.494 10.355 1.00 0.00 N ATOM 0 H ARG A 708 -2.023 10.904 6.048 1.00 0.00 H new ATOM 0 HA ARG A 708 -1.959 10.115 8.978 1.00 0.00 H new ATOM 0 HB2 ARG A 708 -3.980 9.554 6.739 1.00 0.00 H new ATOM 0 HB3 ARG A 708 -3.978 8.727 8.284 1.00 0.00 H new ATOM 0 HG2 ARG A 708 -4.073 11.040 9.409 1.00 0.00 H new ATOM 0 HG3 ARG A 708 -4.325 11.730 7.818 1.00 0.00 H new ATOM 0 HD2 ARG A 708 -6.370 10.245 7.535 1.00 0.00 H new ATOM 0 HD3 ARG A 708 -6.136 9.650 9.166 1.00 0.00 H new ATOM 0 HE ARG A 708 -5.985 12.537 9.300 1.00 0.00 H new ATOM 0 HH11 ARG A 708 -8.197 12.439 7.317 1.00 0.00 H new ATOM 0 HH12 ARG A 708 -9.629 12.250 8.335 1.00 0.00 H new ATOM 0 HH21 ARG A 708 -7.796 11.192 11.126 1.00 0.00 H new ATOM 0 HH22 ARG A 708 -9.403 11.547 10.482 1.00 0.00 H new ATOM 980 N GLU A 709 -1.124 7.799 8.317 1.00 0.00 N ATOM 981 CA GLU A 709 -0.282 6.649 7.886 1.00 0.00 C ATOM 982 C GLU A 709 -1.142 5.400 7.628 1.00 0.00 C ATOM 983 O GLU A 709 -2.161 5.194 8.257 1.00 0.00 O ATOM 984 CB GLU A 709 0.682 6.417 9.054 1.00 0.00 C ATOM 985 CG GLU A 709 -0.112 6.038 10.305 1.00 0.00 C ATOM 986 CD GLU A 709 -0.257 7.260 11.215 1.00 0.00 C ATOM 987 OE1 GLU A 709 0.680 8.040 11.281 1.00 0.00 O ATOM 988 OE2 GLU A 709 -1.301 7.393 11.833 1.00 0.00 O ATOM 0 H GLU A 709 -1.459 7.765 9.280 1.00 0.00 H new ATOM 0 HA GLU A 709 0.242 6.851 6.952 1.00 0.00 H new ATOM 0 HB2 GLU A 709 1.388 5.625 8.805 1.00 0.00 H new ATOM 0 HB3 GLU A 709 1.267 7.318 9.241 1.00 0.00 H new ATOM 0 HG2 GLU A 709 -1.096 5.664 10.023 1.00 0.00 H new ATOM 0 HG3 GLU A 709 0.394 5.233 10.839 1.00 0.00 H new ATOM 995 N LEU A 710 -0.729 4.562 6.706 1.00 0.00 N ATOM 996 CA LEU A 710 -1.510 3.319 6.400 1.00 0.00 C ATOM 997 C LEU A 710 -0.658 2.087 6.707 1.00 0.00 C ATOM 998 O LEU A 710 -0.607 1.143 5.945 1.00 0.00 O ATOM 999 CB LEU A 710 -1.820 3.395 4.900 1.00 0.00 C ATOM 1000 CG LEU A 710 -2.685 2.200 4.470 1.00 0.00 C ATOM 1001 CD1 LEU A 710 -3.985 2.179 5.267 1.00 0.00 C ATOM 1002 CD2 LEU A 710 -3.021 2.334 2.987 1.00 0.00 C ATOM 0 H LEU A 710 0.118 4.685 6.151 1.00 0.00 H new ATOM 0 HA LEU A 710 -2.420 3.243 6.995 1.00 0.00 H new ATOM 0 HB2 LEU A 710 -2.339 4.327 4.676 1.00 0.00 H new ATOM 0 HB3 LEU A 710 -0.891 3.403 4.330 1.00 0.00 H new ATOM 0 HG LEU A 710 -2.133 1.278 4.653 1.00 0.00 H new ATOM 0 HD11 LEU A 710 -4.590 1.328 4.954 1.00 0.00 H new ATOM 0 HD12 LEU A 710 -3.759 2.092 6.330 1.00 0.00 H new ATOM 0 HD13 LEU A 710 -4.537 3.102 5.088 1.00 0.00 H new ATOM 0 HD21 LEU A 710 -3.635 1.489 2.675 1.00 0.00 H new ATOM 0 HD22 LEU A 710 -3.569 3.261 2.820 1.00 0.00 H new ATOM 0 HD23 LEU A 710 -2.100 2.347 2.405 1.00 0.00 H new ATOM 1014 N THR A 711 0.019 2.090 7.818 1.00 0.00 N ATOM 1015 CA THR A 711 0.872 0.924 8.164 1.00 0.00 C ATOM 1016 C THR A 711 0.007 -0.257 8.618 1.00 0.00 C ATOM 1017 O THR A 711 -1.207 -0.190 8.608 1.00 0.00 O ATOM 1018 CB THR A 711 1.805 1.418 9.270 1.00 0.00 C ATOM 1019 OG1 THR A 711 1.053 1.680 10.444 1.00 0.00 O ATOM 1020 CG2 THR A 711 2.492 2.703 8.808 1.00 0.00 C ATOM 0 H THR A 711 0.019 2.848 8.500 1.00 0.00 H new ATOM 0 HA THR A 711 1.445 0.558 7.312 1.00 0.00 H new ATOM 0 HB THR A 711 2.554 0.656 9.485 1.00 0.00 H new ATOM 0 HG1 THR A 711 1.561 2.278 11.031 1.00 0.00 H new ATOM 0 HG21 THR A 711 3.159 3.061 9.592 1.00 0.00 H new ATOM 0 HG22 THR A 711 3.068 2.503 7.905 1.00 0.00 H new ATOM 0 HG23 THR A 711 1.739 3.463 8.597 1.00 0.00 H new ATOM 1028 N ILE A 712 0.617 -1.362 8.952 1.00 0.00 N ATOM 1029 CA ILE A 712 -0.182 -2.563 9.331 1.00 0.00 C ATOM 1030 C ILE A 712 -0.965 -2.428 10.670 1.00 0.00 C ATOM 1031 O ILE A 712 -2.037 -2.991 10.766 1.00 0.00 O ATOM 1032 CB ILE A 712 0.800 -3.752 9.320 1.00 0.00 C ATOM 1033 CG1 ILE A 712 1.797 -3.696 10.494 1.00 0.00 C ATOM 1034 CG2 ILE A 712 1.569 -3.760 7.993 1.00 0.00 C ATOM 1035 CD1 ILE A 712 2.992 -2.775 10.180 1.00 0.00 C ATOM 0 H ILE A 712 1.629 -1.485 8.979 1.00 0.00 H new ATOM 0 HA ILE A 712 -0.987 -2.708 8.611 1.00 0.00 H new ATOM 0 HB ILE A 712 0.217 -4.666 9.430 1.00 0.00 H new ATOM 0 HG12 ILE A 712 1.287 -3.339 11.389 1.00 0.00 H new ATOM 0 HG13 ILE A 712 2.159 -4.701 10.713 1.00 0.00 H new ATOM 0 HG21 ILE A 712 2.265 -4.599 7.981 1.00 0.00 H new ATOM 0 HG22 ILE A 712 0.866 -3.859 7.166 1.00 0.00 H new ATOM 0 HG23 ILE A 712 2.123 -2.827 7.888 1.00 0.00 H new ATOM 0 HD11 ILE A 712 3.674 -2.761 11.031 1.00 0.00 H new ATOM 0 HD12 ILE A 712 3.517 -3.147 9.300 1.00 0.00 H new ATOM 0 HD13 ILE A 712 2.632 -1.765 9.987 1.00 0.00 H new ATOM 1047 N PRO A 713 -0.487 -1.683 11.659 1.00 0.00 N ATOM 1048 CA PRO A 713 -1.278 -1.538 12.918 1.00 0.00 C ATOM 1049 C PRO A 713 -2.734 -1.101 12.646 1.00 0.00 C ATOM 1050 O PRO A 713 -3.580 -1.176 13.517 1.00 0.00 O ATOM 1051 CB PRO A 713 -0.498 -0.465 13.688 1.00 0.00 C ATOM 1052 CG PRO A 713 0.742 -0.071 12.864 1.00 0.00 C ATOM 1053 CD PRO A 713 0.818 -0.971 11.621 1.00 0.00 C ATOM 0 HA PRO A 713 -1.379 -2.475 13.465 1.00 0.00 H new ATOM 0 HB2 PRO A 713 -1.128 0.407 13.864 1.00 0.00 H new ATOM 0 HB3 PRO A 713 -0.198 -0.844 14.665 1.00 0.00 H new ATOM 0 HG2 PRO A 713 0.681 0.976 12.568 1.00 0.00 H new ATOM 0 HG3 PRO A 713 1.645 -0.181 13.465 1.00 0.00 H new ATOM 0 HD2 PRO A 713 0.937 -0.390 10.706 1.00 0.00 H new ATOM 0 HD3 PRO A 713 1.659 -1.662 11.671 1.00 0.00 H new ATOM 1061 N HIS A 714 -3.040 -0.658 11.453 1.00 0.00 N ATOM 1062 CA HIS A 714 -4.443 -0.233 11.146 1.00 0.00 C ATOM 1063 C HIS A 714 -5.377 -1.452 11.056 1.00 0.00 C ATOM 1064 O HIS A 714 -4.939 -2.587 11.017 1.00 0.00 O ATOM 1065 CB HIS A 714 -4.351 0.490 9.798 1.00 0.00 C ATOM 1066 CG HIS A 714 -3.650 1.811 9.980 1.00 0.00 C ATOM 1067 ND1 HIS A 714 -4.346 3.008 10.074 1.00 0.00 N ATOM 1068 CD2 HIS A 714 -2.321 2.144 10.087 1.00 0.00 C ATOM 1069 CE1 HIS A 714 -3.443 3.993 10.228 1.00 0.00 C ATOM 1070 NE2 HIS A 714 -2.194 3.521 10.243 1.00 0.00 N ATOM 0 H HIS A 714 -2.382 -0.572 10.679 1.00 0.00 H new ATOM 0 HA HIS A 714 -4.857 0.408 11.924 1.00 0.00 H new ATOM 0 HB2 HIS A 714 -3.808 -0.125 9.080 1.00 0.00 H new ATOM 0 HB3 HIS A 714 -5.349 0.650 9.391 1.00 0.00 H new ATOM 0 HD1 HIS A 714 -5.359 3.120 10.034 1.00 0.00 H new ATOM 0 HD2 HIS A 714 -1.500 1.443 10.055 1.00 0.00 H new ATOM 0 HE1 HIS A 714 -3.697 5.038 10.327 1.00 0.00 H new ATOM 1078 N SER A 715 -6.667 -1.219 11.045 1.00 0.00 N ATOM 1079 CA SER A 715 -7.642 -2.350 10.984 1.00 0.00 C ATOM 1080 C SER A 715 -7.892 -2.787 9.542 1.00 0.00 C ATOM 1081 O SER A 715 -7.443 -2.167 8.599 1.00 0.00 O ATOM 1082 CB SER A 715 -8.928 -1.806 11.607 1.00 0.00 C ATOM 1083 OG SER A 715 -8.664 -1.394 12.941 1.00 0.00 O ATOM 0 H SER A 715 -7.087 -0.290 11.076 1.00 0.00 H new ATOM 0 HA SER A 715 -7.268 -3.228 11.511 1.00 0.00 H new ATOM 0 HB2 SER A 715 -9.302 -0.966 11.022 1.00 0.00 H new ATOM 0 HB3 SER A 715 -9.703 -2.572 11.597 1.00 0.00 H new ATOM 0 HG SER A 715 -9.486 -1.043 13.344 1.00 0.00 H new ATOM 1089 N ALA A 716 -8.607 -3.861 9.373 1.00 0.00 N ATOM 1090 CA ALA A 716 -8.892 -4.364 8.005 1.00 0.00 C ATOM 1091 C ALA A 716 -9.632 -3.299 7.194 1.00 0.00 C ATOM 1092 O ALA A 716 -9.319 -3.052 6.046 1.00 0.00 O ATOM 1093 CB ALA A 716 -9.776 -5.589 8.227 1.00 0.00 C ATOM 0 H ALA A 716 -9.009 -4.415 10.129 1.00 0.00 H new ATOM 0 HA ALA A 716 -7.987 -4.606 7.448 1.00 0.00 H new ATOM 0 HB1 ALA A 716 -10.037 -6.028 7.264 1.00 0.00 H new ATOM 0 HB2 ALA A 716 -9.237 -6.323 8.826 1.00 0.00 H new ATOM 0 HB3 ALA A 716 -10.685 -5.292 8.749 1.00 0.00 H new ATOM 1099 N ASN A 717 -10.602 -2.658 7.779 1.00 0.00 N ATOM 1100 CA ASN A 717 -11.341 -1.606 7.029 1.00 0.00 C ATOM 1101 C ASN A 717 -10.574 -0.293 7.115 1.00 0.00 C ATOM 1102 O ASN A 717 -10.894 0.586 7.886 1.00 0.00 O ATOM 1103 CB ASN A 717 -12.695 -1.505 7.721 1.00 0.00 C ATOM 1104 CG ASN A 717 -12.503 -1.039 9.162 1.00 0.00 C ATOM 1105 OD1 ASN A 717 -12.211 -1.831 10.036 1.00 0.00 O ATOM 1106 ND2 ASN A 717 -12.648 0.224 9.446 1.00 0.00 N ATOM 0 H ASN A 717 -10.914 -2.815 8.737 1.00 0.00 H new ATOM 0 HA ASN A 717 -11.457 -1.837 5.970 1.00 0.00 H new ATOM 0 HB2 ASN A 717 -13.337 -0.806 7.185 1.00 0.00 H new ATOM 0 HB3 ASN A 717 -13.195 -2.473 7.705 1.00 0.00 H new ATOM 0 HD21 ASN A 717 -12.516 0.550 10.404 1.00 0.00 H new ATOM 0 HD22 ASN A 717 -12.893 0.887 8.711 1.00 0.00 H new ATOM 1113 N VAL A 718 -9.528 -0.172 6.355 1.00 0.00 N ATOM 1114 CA VAL A 718 -8.714 1.066 6.434 1.00 0.00 C ATOM 1115 C VAL A 718 -9.093 2.052 5.326 1.00 0.00 C ATOM 1116 O VAL A 718 -9.242 3.234 5.571 1.00 0.00 O ATOM 1117 CB VAL A 718 -7.276 0.559 6.302 1.00 0.00 C ATOM 1118 CG1 VAL A 718 -6.879 0.447 4.832 1.00 0.00 C ATOM 1119 CG2 VAL A 718 -6.325 1.512 7.029 1.00 0.00 C ATOM 0 H VAL A 718 -9.203 -0.871 5.687 1.00 0.00 H new ATOM 0 HA VAL A 718 -8.867 1.624 7.358 1.00 0.00 H new ATOM 0 HB VAL A 718 -7.211 -0.431 6.753 1.00 0.00 H new ATOM 0 HG11 VAL A 718 -5.853 0.085 4.759 1.00 0.00 H new ATOM 0 HG12 VAL A 718 -7.547 -0.251 4.327 1.00 0.00 H new ATOM 0 HG13 VAL A 718 -6.953 1.427 4.360 1.00 0.00 H new ATOM 0 HG21 VAL A 718 -5.302 1.148 6.933 1.00 0.00 H new ATOM 0 HG22 VAL A 718 -6.399 2.506 6.589 1.00 0.00 H new ATOM 0 HG23 VAL A 718 -6.595 1.561 8.084 1.00 0.00 H new ATOM 1129 N PHE A 719 -9.264 1.599 4.112 1.00 0.00 N ATOM 1130 CA PHE A 719 -9.640 2.566 3.046 1.00 0.00 C ATOM 1131 C PHE A 719 -10.971 3.211 3.340 1.00 0.00 C ATOM 1132 O PHE A 719 -11.116 4.401 3.175 1.00 0.00 O ATOM 1133 CB PHE A 719 -9.667 1.816 1.721 1.00 0.00 C ATOM 1134 CG PHE A 719 -8.268 1.770 1.162 1.00 0.00 C ATOM 1135 CD1 PHE A 719 -7.345 2.786 1.469 1.00 0.00 C ATOM 1136 CD2 PHE A 719 -7.888 0.712 0.347 1.00 0.00 C ATOM 1137 CE1 PHE A 719 -6.057 2.732 0.966 1.00 0.00 C ATOM 1138 CE2 PHE A 719 -6.591 0.659 -0.163 1.00 0.00 C ATOM 1139 CZ PHE A 719 -5.674 1.673 0.151 1.00 0.00 C ATOM 0 H PHE A 719 -9.162 0.627 3.819 1.00 0.00 H new ATOM 0 HA PHE A 719 -8.909 3.373 2.999 1.00 0.00 H new ATOM 0 HB2 PHE A 719 -10.049 0.806 1.867 1.00 0.00 H new ATOM 0 HB3 PHE A 719 -10.338 2.312 1.020 1.00 0.00 H new ATOM 0 HD1 PHE A 719 -7.643 3.611 2.099 1.00 0.00 H new ATOM 0 HD2 PHE A 719 -8.595 -0.068 0.108 1.00 0.00 H new ATOM 0 HE1 PHE A 719 -5.350 3.512 1.206 1.00 0.00 H new ATOM 0 HE2 PHE A 719 -6.293 -0.162 -0.799 1.00 0.00 H new ATOM 0 HZ PHE A 719 -4.669 1.631 -0.241 1.00 0.00 H new ATOM 1149 N TYR A 720 -11.929 2.491 3.838 1.00 0.00 N ATOM 1150 CA TYR A 720 -13.202 3.175 4.173 1.00 0.00 C ATOM 1151 C TYR A 720 -12.841 4.436 4.961 1.00 0.00 C ATOM 1152 O TYR A 720 -13.546 5.425 4.948 1.00 0.00 O ATOM 1153 CB TYR A 720 -14.013 2.195 5.016 1.00 0.00 C ATOM 1154 CG TYR A 720 -15.293 2.869 5.432 1.00 0.00 C ATOM 1155 CD1 TYR A 720 -16.157 3.353 4.451 1.00 0.00 C ATOM 1156 CD2 TYR A 720 -15.614 3.016 6.789 1.00 0.00 C ATOM 1157 CE1 TYR A 720 -17.346 3.987 4.815 1.00 0.00 C ATOM 1158 CE2 TYR A 720 -16.807 3.651 7.156 1.00 0.00 C ATOM 1159 CZ TYR A 720 -17.673 4.137 6.167 1.00 0.00 C ATOM 1160 OH TYR A 720 -18.848 4.765 6.525 1.00 0.00 O ATOM 0 H TYR A 720 -11.892 1.489 4.024 1.00 0.00 H new ATOM 0 HA TYR A 720 -13.786 3.465 3.299 1.00 0.00 H new ATOM 0 HB2 TYR A 720 -14.229 1.292 4.445 1.00 0.00 H new ATOM 0 HB3 TYR A 720 -13.444 1.889 5.894 1.00 0.00 H new ATOM 0 HD1 TYR A 720 -15.906 3.237 3.407 1.00 0.00 H new ATOM 0 HD2 TYR A 720 -14.944 2.641 7.548 1.00 0.00 H new ATOM 0 HE1 TYR A 720 -18.013 4.362 4.053 1.00 0.00 H new ATOM 0 HE2 TYR A 720 -17.059 3.766 8.200 1.00 0.00 H new ATOM 0 HH TYR A 720 -18.924 4.785 7.502 1.00 0.00 H new ATOM 1170 N ALA A 721 -11.705 4.403 5.613 1.00 0.00 N ATOM 1171 CA ALA A 721 -11.233 5.590 6.377 1.00 0.00 C ATOM 1172 C ALA A 721 -10.056 6.295 5.655 1.00 0.00 C ATOM 1173 O ALA A 721 -9.847 7.480 5.828 1.00 0.00 O ATOM 1174 CB ALA A 721 -10.756 5.021 7.711 1.00 0.00 C ATOM 0 H ALA A 721 -11.082 3.596 5.646 1.00 0.00 H new ATOM 0 HA ALA A 721 -12.020 6.336 6.487 1.00 0.00 H new ATOM 0 HB1 ALA A 721 -10.389 5.831 8.341 1.00 0.00 H new ATOM 0 HB2 ALA A 721 -11.585 4.520 8.210 1.00 0.00 H new ATOM 0 HB3 ALA A 721 -9.953 4.305 7.535 1.00 0.00 H new ATOM 1180 N MET A 722 -9.262 5.578 4.880 1.00 0.00 N ATOM 1181 CA MET A 722 -8.080 6.226 4.202 1.00 0.00 C ATOM 1182 C MET A 722 -8.355 6.588 2.741 1.00 0.00 C ATOM 1183 O MET A 722 -7.669 7.398 2.156 1.00 0.00 O ATOM 1184 CB MET A 722 -6.965 5.162 4.223 1.00 0.00 C ATOM 1185 CG MET A 722 -6.257 5.159 5.582 1.00 0.00 C ATOM 1186 SD MET A 722 -7.449 4.828 6.910 1.00 0.00 S ATOM 1187 CE MET A 722 -6.796 6.022 8.104 1.00 0.00 C ATOM 0 H MET A 722 -9.379 4.583 4.689 1.00 0.00 H new ATOM 0 HA MET A 722 -7.829 7.153 4.718 1.00 0.00 H new ATOM 0 HB2 MET A 722 -7.389 4.178 4.024 1.00 0.00 H new ATOM 0 HB3 MET A 722 -6.245 5.365 3.431 1.00 0.00 H new ATOM 0 HG2 MET A 722 -5.473 4.402 5.590 1.00 0.00 H new ATOM 0 HG3 MET A 722 -5.773 6.121 5.750 1.00 0.00 H new ATOM 0 HE1 MET A 722 -7.392 5.987 9.016 1.00 0.00 H new ATOM 0 HE2 MET A 722 -5.761 5.774 8.337 1.00 0.00 H new ATOM 0 HE3 MET A 722 -6.842 7.024 7.678 1.00 0.00 H new ATOM 1197 N ASP A 723 -9.295 5.948 2.127 1.00 0.00 N ATOM 1198 CA ASP A 723 -9.531 6.200 0.678 1.00 0.00 C ATOM 1199 C ASP A 723 -10.393 7.434 0.388 1.00 0.00 C ATOM 1200 O ASP A 723 -10.859 7.609 -0.720 1.00 0.00 O ATOM 1201 CB ASP A 723 -10.216 4.931 0.205 1.00 0.00 C ATOM 1202 CG ASP A 723 -11.601 4.800 0.838 1.00 0.00 C ATOM 1203 OD1 ASP A 723 -12.199 5.819 1.139 1.00 0.00 O ATOM 1204 OD2 ASP A 723 -12.039 3.679 1.022 1.00 0.00 O ATOM 0 H ASP A 723 -9.913 5.261 2.558 1.00 0.00 H new ATOM 0 HA ASP A 723 -8.596 6.419 0.162 1.00 0.00 H new ATOM 0 HB2 ASP A 723 -10.306 4.943 -0.881 1.00 0.00 H new ATOM 0 HB3 ASP A 723 -9.608 4.064 0.465 1.00 0.00 H new ATOM 1209 N GLY A 724 -10.602 8.297 1.339 1.00 0.00 N ATOM 1210 CA GLY A 724 -11.427 9.506 1.044 1.00 0.00 C ATOM 1211 C GLY A 724 -10.841 10.187 -0.194 1.00 0.00 C ATOM 1212 O GLY A 724 -11.518 10.431 -1.172 1.00 0.00 O ATOM 0 H GLY A 724 -10.246 8.224 2.292 1.00 0.00 H new ATOM 0 HA2 GLY A 724 -12.466 9.225 0.869 1.00 0.00 H new ATOM 0 HA3 GLY A 724 -11.420 10.189 1.894 1.00 0.00 H new ATOM 1216 N ALA A 725 -9.576 10.486 -0.144 1.00 0.00 N ATOM 1217 CA ALA A 725 -8.893 11.139 -1.298 1.00 0.00 C ATOM 1218 C ALA A 725 -8.201 10.051 -2.118 1.00 0.00 C ATOM 1219 O ALA A 725 -8.352 8.882 -1.825 1.00 0.00 O ATOM 1220 CB ALA A 725 -7.855 12.059 -0.647 1.00 0.00 C ATOM 0 H ALA A 725 -8.974 10.304 0.659 1.00 0.00 H new ATOM 0 HA ALA A 725 -9.564 11.687 -1.959 1.00 0.00 H new ATOM 0 HB1 ALA A 725 -7.299 12.586 -1.422 1.00 0.00 H new ATOM 0 HB2 ALA A 725 -8.360 12.783 -0.008 1.00 0.00 H new ATOM 0 HB3 ALA A 725 -7.166 11.464 -0.047 1.00 0.00 H new ATOM 1226 N SER A 726 -7.407 10.380 -3.102 1.00 0.00 N ATOM 1227 CA SER A 726 -6.720 9.280 -3.824 1.00 0.00 C ATOM 1228 C SER A 726 -5.796 8.618 -2.810 1.00 0.00 C ATOM 1229 O SER A 726 -5.256 9.277 -1.945 1.00 0.00 O ATOM 1230 CB SER A 726 -5.938 9.934 -4.958 1.00 0.00 C ATOM 1231 OG SER A 726 -4.939 10.786 -4.416 1.00 0.00 O ATOM 0 H SER A 726 -7.211 11.327 -3.426 1.00 0.00 H new ATOM 0 HA SER A 726 -7.391 8.529 -4.241 1.00 0.00 H new ATOM 0 HB2 SER A 726 -5.478 9.170 -5.585 1.00 0.00 H new ATOM 0 HB3 SER A 726 -6.612 10.506 -5.596 1.00 0.00 H new ATOM 0 HG SER A 726 -4.436 11.205 -5.145 1.00 0.00 H new ATOM 1237 N HIS A 727 -5.636 7.333 -2.853 1.00 0.00 N ATOM 1238 CA HIS A 727 -4.776 6.698 -1.814 1.00 0.00 C ATOM 1239 C HIS A 727 -3.363 6.500 -2.326 1.00 0.00 C ATOM 1240 O HIS A 727 -3.039 5.501 -2.931 1.00 0.00 O ATOM 1241 CB HIS A 727 -5.404 5.343 -1.461 1.00 0.00 C ATOM 1242 CG HIS A 727 -6.827 5.275 -1.933 1.00 0.00 C ATOM 1243 ND1 HIS A 727 -7.679 6.357 -1.836 1.00 0.00 N ATOM 1244 CD2 HIS A 727 -7.560 4.265 -2.498 1.00 0.00 C ATOM 1245 CE1 HIS A 727 -8.864 5.978 -2.324 1.00 0.00 C ATOM 1246 NE2 HIS A 727 -8.852 4.710 -2.745 1.00 0.00 N ATOM 0 H HIS A 727 -6.049 6.703 -3.541 1.00 0.00 H new ATOM 0 HA HIS A 727 -4.717 7.340 -0.935 1.00 0.00 H new ATOM 0 HB2 HIS A 727 -4.826 4.539 -1.918 1.00 0.00 H new ATOM 0 HB3 HIS A 727 -5.366 5.190 -0.382 1.00 0.00 H new ATOM 0 HD1 HIS A 727 -7.447 7.277 -1.461 1.00 0.00 H new ATOM 0 HD2 HIS A 727 -7.190 3.274 -2.718 1.00 0.00 H new ATOM 0 HE1 HIS A 727 -9.730 6.621 -2.372 1.00 0.00 H new ATOM 1254 N ASP A 728 -2.512 7.434 -2.044 1.00 0.00 N ATOM 1255 CA ASP A 728 -1.096 7.303 -2.467 1.00 0.00 C ATOM 1256 C ASP A 728 -0.207 7.268 -1.229 1.00 0.00 C ATOM 1257 O ASP A 728 -0.083 8.247 -0.520 1.00 0.00 O ATOM 1258 CB ASP A 728 -0.800 8.540 -3.308 1.00 0.00 C ATOM 1259 CG ASP A 728 -1.477 8.413 -4.670 1.00 0.00 C ATOM 1260 OD1 ASP A 728 -2.231 7.471 -4.850 1.00 0.00 O ATOM 1261 OD2 ASP A 728 -1.221 9.254 -5.516 1.00 0.00 O ATOM 0 H ASP A 728 -2.735 8.290 -1.535 1.00 0.00 H new ATOM 0 HA ASP A 728 -0.912 6.391 -3.035 1.00 0.00 H new ATOM 0 HB2 ASP A 728 -1.157 9.433 -2.796 1.00 0.00 H new ATOM 0 HB3 ASP A 728 0.276 8.655 -3.436 1.00 0.00 H new ATOM 1266 N PHE A 729 0.416 6.160 -0.957 1.00 0.00 N ATOM 1267 CA PHE A 729 1.285 6.091 0.238 1.00 0.00 C ATOM 1268 C PHE A 729 2.665 5.610 -0.168 1.00 0.00 C ATOM 1269 O PHE A 729 2.872 5.087 -1.245 1.00 0.00 O ATOM 1270 CB PHE A 729 0.673 5.066 1.213 1.00 0.00 C ATOM 1271 CG PHE A 729 -0.720 4.654 0.798 1.00 0.00 C ATOM 1272 CD1 PHE A 729 -1.727 5.612 0.661 1.00 0.00 C ATOM 1273 CD2 PHE A 729 -1.001 3.303 0.562 1.00 0.00 C ATOM 1274 CE1 PHE A 729 -3.016 5.222 0.283 1.00 0.00 C ATOM 1275 CE2 PHE A 729 -2.288 2.912 0.186 1.00 0.00 C ATOM 1276 CZ PHE A 729 -3.297 3.871 0.045 1.00 0.00 C ATOM 0 H PHE A 729 0.360 5.304 -1.509 1.00 0.00 H new ATOM 0 HA PHE A 729 1.363 7.074 0.703 1.00 0.00 H new ATOM 0 HB2 PHE A 729 1.313 4.185 1.262 1.00 0.00 H new ATOM 0 HB3 PHE A 729 0.642 5.493 2.215 1.00 0.00 H new ATOM 0 HD1 PHE A 729 -1.511 6.654 0.847 1.00 0.00 H new ATOM 0 HD2 PHE A 729 -0.222 2.563 0.671 1.00 0.00 H new ATOM 0 HE1 PHE A 729 -3.794 5.963 0.175 1.00 0.00 H new ATOM 0 HE2 PHE A 729 -2.504 1.870 0.004 1.00 0.00 H new ATOM 0 HZ PHE A 729 -4.292 3.569 -0.247 1.00 0.00 H new ATOM 1286 N LEU A 730 3.605 5.779 0.696 1.00 0.00 N ATOM 1287 CA LEU A 730 4.987 5.327 0.394 1.00 0.00 C ATOM 1288 C LEU A 730 5.400 4.277 1.439 1.00 0.00 C ATOM 1289 O LEU A 730 5.032 4.380 2.592 1.00 0.00 O ATOM 1290 CB LEU A 730 5.812 6.601 0.510 1.00 0.00 C ATOM 1291 CG LEU A 730 7.243 6.335 0.083 1.00 0.00 C ATOM 1292 CD1 LEU A 730 7.303 6.156 -1.433 1.00 0.00 C ATOM 1293 CD2 LEU A 730 8.100 7.528 0.499 1.00 0.00 C ATOM 0 H LEU A 730 3.482 6.214 1.610 1.00 0.00 H new ATOM 0 HA LEU A 730 5.109 4.860 -0.583 1.00 0.00 H new ATOM 0 HB2 LEU A 730 5.378 7.383 -0.113 1.00 0.00 H new ATOM 0 HB3 LEU A 730 5.792 6.964 1.538 1.00 0.00 H new ATOM 0 HG LEU A 730 7.614 5.426 0.557 1.00 0.00 H new ATOM 0 HD11 LEU A 730 8.332 5.965 -1.736 1.00 0.00 H new ATOM 0 HD12 LEU A 730 6.676 5.313 -1.725 1.00 0.00 H new ATOM 0 HD13 LEU A 730 6.943 7.062 -1.921 1.00 0.00 H new ATOM 0 HD21 LEU A 730 9.134 7.355 0.200 1.00 0.00 H new ATOM 0 HD22 LEU A 730 7.728 8.430 0.014 1.00 0.00 H new ATOM 0 HD23 LEU A 730 8.051 7.652 1.581 1.00 0.00 H new ATOM 1305 N LEU A 731 6.111 3.241 1.059 1.00 0.00 N ATOM 1306 CA LEU A 731 6.458 2.195 2.077 1.00 0.00 C ATOM 1307 C LEU A 731 7.938 2.136 2.436 1.00 0.00 C ATOM 1308 O LEU A 731 8.810 2.122 1.592 1.00 0.00 O ATOM 1309 CB LEU A 731 6.040 0.855 1.464 1.00 0.00 C ATOM 1310 CG LEU A 731 4.720 0.981 0.702 1.00 0.00 C ATOM 1311 CD1 LEU A 731 4.064 -0.397 0.631 1.00 0.00 C ATOM 1312 CD2 LEU A 731 3.774 1.946 1.411 1.00 0.00 C ATOM 0 H LEU A 731 6.459 3.075 0.115 1.00 0.00 H new ATOM 0 HA LEU A 731 5.943 2.434 3.007 1.00 0.00 H new ATOM 0 HB2 LEU A 731 6.820 0.502 0.789 1.00 0.00 H new ATOM 0 HB3 LEU A 731 5.938 0.108 2.251 1.00 0.00 H new ATOM 0 HG LEU A 731 4.923 1.365 -0.298 1.00 0.00 H new ATOM 0 HD11 LEU A 731 3.121 -0.323 0.090 1.00 0.00 H new ATOM 0 HD12 LEU A 731 4.727 -1.089 0.112 1.00 0.00 H new ATOM 0 HD13 LEU A 731 3.876 -0.763 1.640 1.00 0.00 H new ATOM 0 HD21 LEU A 731 2.842 2.019 0.851 1.00 0.00 H new ATOM 0 HD22 LEU A 731 3.565 1.579 2.416 1.00 0.00 H new ATOM 0 HD23 LEU A 731 4.238 2.930 1.474 1.00 0.00 H new ATOM 1324 N ARG A 732 8.198 2.022 3.711 1.00 0.00 N ATOM 1325 CA ARG A 732 9.593 1.870 4.204 1.00 0.00 C ATOM 1326 C ARG A 732 9.700 0.527 4.933 1.00 0.00 C ATOM 1327 O ARG A 732 9.089 0.320 5.962 1.00 0.00 O ATOM 1328 CB ARG A 732 9.833 3.013 5.191 1.00 0.00 C ATOM 1329 CG ARG A 732 9.919 4.356 4.464 1.00 0.00 C ATOM 1330 CD ARG A 732 10.155 5.450 5.508 1.00 0.00 C ATOM 1331 NE ARG A 732 10.471 6.685 4.739 1.00 0.00 N ATOM 1332 CZ ARG A 732 11.707 6.945 4.405 1.00 0.00 C ATOM 1333 NH1 ARG A 732 12.654 6.880 5.301 1.00 0.00 N ATOM 1334 NH2 ARG A 732 12.000 7.275 3.178 1.00 0.00 N ATOM 0 H ARG A 732 7.488 2.028 4.443 1.00 0.00 H new ATOM 0 HA ARG A 732 10.322 1.898 3.394 1.00 0.00 H new ATOM 0 HB2 ARG A 732 9.025 3.042 5.922 1.00 0.00 H new ATOM 0 HB3 ARG A 732 10.756 2.834 5.743 1.00 0.00 H new ATOM 0 HG2 ARG A 732 10.731 4.343 3.736 1.00 0.00 H new ATOM 0 HG3 ARG A 732 8.999 4.549 3.912 1.00 0.00 H new ATOM 0 HD2 ARG A 732 9.272 5.593 6.131 1.00 0.00 H new ATOM 0 HD3 ARG A 732 10.976 5.184 6.174 1.00 0.00 H new ATOM 0 HE ARG A 732 9.724 7.327 4.473 1.00 0.00 H new ATOM 0 HH11 ARG A 732 12.429 6.626 6.263 1.00 0.00 H new ATOM 0 HH12 ARG A 732 13.619 7.083 5.039 1.00 0.00 H new ATOM 0 HH21 ARG A 732 11.263 7.331 2.475 1.00 0.00 H new ATOM 0 HH22 ARG A 732 12.966 7.477 2.921 1.00 0.00 H new ATOM 1348 N GLN A 733 10.450 -0.391 4.400 1.00 0.00 N ATOM 1349 CA GLN A 733 10.574 -1.732 5.057 1.00 0.00 C ATOM 1350 C GLN A 733 11.397 -1.668 6.340 1.00 0.00 C ATOM 1351 O GLN A 733 12.586 -1.414 6.329 1.00 0.00 O ATOM 1352 CB GLN A 733 11.267 -2.619 4.019 1.00 0.00 C ATOM 1353 CG GLN A 733 10.404 -3.852 3.738 1.00 0.00 C ATOM 1354 CD GLN A 733 11.069 -4.717 2.660 1.00 0.00 C ATOM 1355 OE1 GLN A 733 11.068 -4.362 1.497 1.00 0.00 O ATOM 1356 NE2 GLN A 733 11.637 -5.845 2.998 1.00 0.00 N ATOM 0 H GLN A 733 10.985 -0.278 3.539 1.00 0.00 H new ATOM 0 HA GLN A 733 9.598 -2.116 5.353 1.00 0.00 H new ATOM 0 HB2 GLN A 733 11.430 -2.059 3.098 1.00 0.00 H new ATOM 0 HB3 GLN A 733 12.248 -2.925 4.384 1.00 0.00 H new ATOM 0 HG2 GLN A 733 10.273 -4.431 4.652 1.00 0.00 H new ATOM 0 HG3 GLN A 733 9.411 -3.545 3.410 1.00 0.00 H new ATOM 0 HE21 GLN A 733 11.638 -6.143 3.973 1.00 0.00 H new ATOM 0 HE22 GLN A 733 12.079 -6.427 2.286 1.00 0.00 H new ATOM 1365 N ARG A 734 10.758 -1.943 7.447 1.00 0.00 N ATOM 1366 CA ARG A 734 11.477 -1.964 8.750 1.00 0.00 C ATOM 1367 C ARG A 734 12.424 -3.153 8.727 1.00 0.00 C ATOM 1368 O ARG A 734 13.527 -3.110 9.235 1.00 0.00 O ATOM 1369 CB ARG A 734 10.384 -2.171 9.805 1.00 0.00 C ATOM 1370 CG ARG A 734 10.985 -2.135 11.214 1.00 0.00 C ATOM 1371 CD ARG A 734 11.317 -0.692 11.593 1.00 0.00 C ATOM 1372 NE ARG A 734 11.891 -0.769 12.966 1.00 0.00 N ATOM 1373 CZ ARG A 734 12.413 0.296 13.508 1.00 0.00 C ATOM 1374 NH1 ARG A 734 12.830 1.274 12.751 1.00 0.00 N ATOM 1375 NH2 ARG A 734 12.521 0.383 14.805 1.00 0.00 N ATOM 0 H ARG A 734 9.762 -2.155 7.502 1.00 0.00 H new ATOM 0 HA ARG A 734 12.051 -1.060 8.953 1.00 0.00 H new ATOM 0 HB2 ARG A 734 9.624 -1.395 9.707 1.00 0.00 H new ATOM 0 HB3 ARG A 734 9.887 -3.127 9.640 1.00 0.00 H new ATOM 0 HG2 ARG A 734 10.281 -2.557 11.931 1.00 0.00 H new ATOM 0 HG3 ARG A 734 11.885 -2.748 11.252 1.00 0.00 H new ATOM 0 HD2 ARG A 734 12.029 -0.255 10.893 1.00 0.00 H new ATOM 0 HD3 ARG A 734 10.426 -0.065 11.574 1.00 0.00 H new ATOM 0 HE ARG A 734 11.876 -1.650 13.479 1.00 0.00 H new ATOM 0 HH11 ARG A 734 12.747 1.205 11.737 1.00 0.00 H new ATOM 0 HH12 ARG A 734 13.238 2.108 13.174 1.00 0.00 H new ATOM 0 HH21 ARG A 734 12.197 -0.382 15.396 1.00 0.00 H new ATOM 0 HH22 ARG A 734 12.929 1.216 15.228 1.00 0.00 H new ATOM 1389 N ARG A 735 11.981 -4.222 8.124 1.00 0.00 N ATOM 1390 CA ARG A 735 12.829 -5.444 8.045 1.00 0.00 C ATOM 1391 C ARG A 735 12.706 -6.095 6.665 1.00 0.00 C ATOM 1392 O ARG A 735 11.665 -6.670 6.390 1.00 0.00 O ATOM 1393 CB ARG A 735 12.284 -6.374 9.130 1.00 0.00 C ATOM 1394 CG ARG A 735 13.147 -7.635 9.191 1.00 0.00 C ATOM 1395 CD ARG A 735 12.491 -8.657 10.118 1.00 0.00 C ATOM 1396 NE ARG A 735 12.534 -8.022 11.462 1.00 0.00 N ATOM 1397 CZ ARG A 735 11.528 -7.302 11.870 1.00 0.00 C ATOM 1398 NH1 ARG A 735 10.333 -7.826 11.919 1.00 0.00 N ATOM 1399 NH2 ARG A 735 11.715 -6.060 12.223 1.00 0.00 N ATOM 1400 OXT ARG A 735 13.657 -6.010 5.908 1.00 0.00 O ATOM 0 H ARG A 735 11.065 -4.301 7.681 1.00 0.00 H new ATOM 0 HA ARG A 735 13.886 -5.220 8.191 1.00 0.00 H new ATOM 0 HB2 ARG A 735 12.289 -5.868 10.096 1.00 0.00 H new ATOM 0 HB3 ARG A 735 11.249 -6.637 8.914 1.00 0.00 H new ATOM 0 HG2 ARG A 735 13.265 -8.057 8.193 1.00 0.00 H new ATOM 0 HG3 ARG A 735 14.145 -7.388 9.553 1.00 0.00 H new ATOM 0 HD2 ARG A 735 11.467 -8.870 9.812 1.00 0.00 H new ATOM 0 HD3 ARG A 735 13.030 -9.604 10.109 1.00 0.00 H new ATOM 0 HE ARG A 735 13.349 -8.150 12.062 1.00 0.00 H new ATOM 0 HH11 ARG A 735 10.190 -8.796 11.638 1.00 0.00 H new ATOM 0 HH12 ARG A 735 9.543 -7.265 12.238 1.00 0.00 H new ATOM 0 HH21 ARG A 735 12.649 -5.653 12.180 1.00 0.00 H new ATOM 0 HH22 ARG A 735 10.927 -5.496 12.542 1.00 0.00 H new TER 1414 ARG A 735