USER MOD reduce.3.24.130724 H: found=0, std=0, add=566, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 560 hydrogens (11 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 759 HIS : no HD1:sc= -0.2 K(o=0.28,f=-7!) USER MOD Set 1.2: A 769 HIS : no HE2:sc= 0.478 K(o=0.28,f=-7.5!) USER MOD Set 2.1: A 737 MET CE :methyl -138:sc= -0.621 (180deg=-1.41) USER MOD Set 2.2: A 765 HIS : no HE2:sc= 1 K(o=0.38,f=-4.1!) USER MOD Single : A 722 SER OG : rot 180:sc= 0 USER MOD Single : A 723 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 728 HIS : no HD1:sc= -0.0205 X(o=-0.021,f=0) USER MOD Single : A 732 MET CE :methyl -156:sc= 0 (180deg=-0.472) USER MOD Single : A 739 SER OG : rot 180:sc= -0.0104 USER MOD Single : A 740 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 741 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 742 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 743 GLN : amide:sc= -1.15 K(o=-1.2,f=0) USER MOD Single : A 749 SER OG : rot -21:sc= 0.0644 USER MOD Single : A 751 ASN : amide:sc= -0.918 X(o=-0.92,f=-0.75) USER MOD Single : A 752 SER OG : rot -81:sc= 0.876 USER MOD Single : A 753 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 760 GLN : amide:sc= -2.24 K(o=-2.2,f=-1.4) USER MOD Single : A 771 SER OG : rot -170:sc= 0 USER MOD Single : A 772 SER OG : rot 180:sc= 0 USER MOD Single : A 776 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 781 THR OG1 : rot 180:sc= 0 USER MOD Single : A 783 SER OG : rot 40:sc= 0.156 USER MOD Single : A 784 LYS NZ :NH3+ -175:sc= 1.25 (180deg=1.21) USER MOD Single : A 801 DGP O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 717 -11.839 -12.624 -7.257 1.00 0.00 N ATOM 2 CA PRO A 717 -10.532 -12.511 -6.577 1.00 0.00 C ATOM 3 C PRO A 717 -9.490 -11.944 -7.534 1.00 0.00 C ATOM 4 O PRO A 717 -9.059 -12.620 -8.470 1.00 0.00 O ATOM 5 CB PRO A 717 -10.108 -13.881 -6.091 1.00 0.00 C ATOM 6 CG PRO A 717 -10.903 -14.807 -6.938 1.00 0.00 C ATOM 7 CD PRO A 717 -12.166 -14.067 -7.333 1.00 0.00 C ATOM 0 HA PRO A 717 -10.620 -11.835 -5.726 1.00 0.00 H new ATOM 0 HB2 PRO A 717 -9.037 -14.039 -6.218 1.00 0.00 H new ATOM 0 HB3 PRO A 717 -10.327 -14.017 -5.032 1.00 0.00 H new ATOM 0 HG2 PRO A 717 -10.337 -15.104 -7.821 1.00 0.00 H new ATOM 0 HG3 PRO A 717 -11.144 -15.719 -6.392 1.00 0.00 H new ATOM 0 HD2 PRO A 717 -12.480 -14.343 -8.340 1.00 0.00 H new ATOM 0 HD3 PRO A 717 -12.989 -14.316 -6.663 1.00 0.00 H new ATOM 15 N GLU A 718 -9.102 -10.697 -7.314 1.00 0.00 N ATOM 16 CA GLU A 718 -8.178 -10.025 -8.213 1.00 0.00 C ATOM 17 C GLU A 718 -6.822 -9.852 -7.550 1.00 0.00 C ATOM 18 O GLU A 718 -6.719 -9.306 -6.449 1.00 0.00 O ATOM 19 CB GLU A 718 -8.726 -8.662 -8.651 1.00 0.00 C ATOM 20 CG GLU A 718 -9.982 -8.737 -9.515 1.00 0.00 C ATOM 21 CD GLU A 718 -11.214 -9.171 -8.744 1.00 0.00 C ATOM 22 OE1 GLU A 718 -11.775 -8.342 -7.998 1.00 0.00 O ATOM 23 OE2 GLU A 718 -11.631 -10.340 -8.881 1.00 0.00 O ATOM 0 H GLU A 718 -9.412 -10.132 -6.523 1.00 0.00 H new ATOM 0 HA GLU A 718 -8.062 -10.648 -9.100 1.00 0.00 H new ATOM 0 HB2 GLU A 718 -8.945 -8.069 -7.763 1.00 0.00 H new ATOM 0 HB3 GLU A 718 -7.950 -8.132 -9.204 1.00 0.00 H new ATOM 0 HG2 GLU A 718 -10.167 -7.760 -9.962 1.00 0.00 H new ATOM 0 HG3 GLU A 718 -9.810 -9.435 -10.335 1.00 0.00 H new ATOM 30 N GLY A 719 -5.791 -10.329 -8.221 1.00 0.00 N ATOM 31 CA GLY A 719 -4.449 -10.221 -7.701 1.00 0.00 C ATOM 32 C GLY A 719 -3.462 -10.999 -8.537 1.00 0.00 C ATOM 33 O GLY A 719 -3.768 -12.106 -8.986 1.00 0.00 O ATOM 0 H GLY A 719 -5.861 -10.794 -9.126 1.00 0.00 H new ATOM 0 HA2 GLY A 719 -4.154 -9.172 -7.671 1.00 0.00 H new ATOM 0 HA3 GLY A 719 -4.426 -10.588 -6.675 1.00 0.00 H new ATOM 37 N VAL A 720 -2.287 -10.418 -8.745 1.00 0.00 N ATOM 38 CA VAL A 720 -1.239 -11.031 -9.555 1.00 0.00 C ATOM 39 C VAL A 720 -1.747 -11.293 -10.972 1.00 0.00 C ATOM 40 O VAL A 720 -1.942 -12.439 -11.389 1.00 0.00 O ATOM 41 CB VAL A 720 -0.707 -12.347 -8.930 1.00 0.00 C ATOM 42 CG1 VAL A 720 0.540 -12.825 -9.661 1.00 0.00 C ATOM 43 CG2 VAL A 720 -0.422 -12.166 -7.442 1.00 0.00 C ATOM 0 H VAL A 720 -2.033 -9.509 -8.358 1.00 0.00 H new ATOM 0 HA VAL A 720 -0.408 -10.326 -9.591 1.00 0.00 H new ATOM 0 HB VAL A 720 -1.480 -13.108 -9.037 1.00 0.00 H new ATOM 0 HG11 VAL A 720 0.896 -13.749 -9.206 1.00 0.00 H new ATOM 0 HG12 VAL A 720 0.301 -13.005 -10.709 1.00 0.00 H new ATOM 0 HG13 VAL A 720 1.317 -12.063 -9.592 1.00 0.00 H new ATOM 0 HG21 VAL A 720 -0.050 -13.102 -7.026 1.00 0.00 H new ATOM 0 HG22 VAL A 720 0.328 -11.386 -7.307 1.00 0.00 H new ATOM 0 HG23 VAL A 720 -1.340 -11.880 -6.928 1.00 0.00 H new ATOM 53 N GLU A 721 -2.001 -10.216 -11.697 1.00 0.00 N ATOM 54 CA GLU A 721 -2.452 -10.315 -13.072 1.00 0.00 C ATOM 55 C GLU A 721 -1.262 -10.147 -14.012 1.00 0.00 C ATOM 56 O GLU A 721 -1.110 -9.132 -14.690 1.00 0.00 O ATOM 57 CB GLU A 721 -3.573 -9.296 -13.378 1.00 0.00 C ATOM 58 CG GLU A 721 -3.217 -7.828 -13.132 1.00 0.00 C ATOM 59 CD GLU A 721 -3.075 -7.470 -11.666 1.00 0.00 C ATOM 60 OE1 GLU A 721 -1.955 -7.586 -11.127 1.00 0.00 O ATOM 61 OE2 GLU A 721 -4.076 -7.051 -11.047 1.00 0.00 O ATOM 0 H GLU A 721 -1.902 -9.261 -11.353 1.00 0.00 H new ATOM 0 HA GLU A 721 -2.883 -11.303 -13.230 1.00 0.00 H new ATOM 0 HB2 GLU A 721 -3.868 -9.410 -14.421 1.00 0.00 H new ATOM 0 HB3 GLU A 721 -4.443 -9.547 -12.771 1.00 0.00 H new ATOM 0 HG2 GLU A 721 -2.282 -7.600 -13.644 1.00 0.00 H new ATOM 0 HG3 GLU A 721 -3.987 -7.198 -13.577 1.00 0.00 H new ATOM 68 N SER A 722 -0.403 -11.157 -14.015 1.00 0.00 N ATOM 69 CA SER A 722 0.843 -11.119 -14.762 1.00 0.00 C ATOM 70 C SER A 722 0.592 -11.165 -16.268 1.00 0.00 C ATOM 71 O SER A 722 0.374 -12.234 -16.839 1.00 0.00 O ATOM 72 CB SER A 722 1.726 -12.294 -14.339 1.00 0.00 C ATOM 73 OG SER A 722 1.789 -12.396 -12.923 1.00 0.00 O ATOM 0 H SER A 722 -0.552 -12.024 -13.499 1.00 0.00 H new ATOM 0 HA SER A 722 1.349 -10.180 -14.539 1.00 0.00 H new ATOM 0 HB2 SER A 722 1.331 -13.220 -14.757 1.00 0.00 H new ATOM 0 HB3 SER A 722 2.730 -12.164 -14.743 1.00 0.00 H new ATOM 0 HG SER A 722 2.357 -13.155 -12.675 1.00 0.00 H new ATOM 79 N GLN A 723 0.597 -9.996 -16.895 1.00 0.00 N ATOM 80 CA GLN A 723 0.459 -9.901 -18.341 1.00 0.00 C ATOM 81 C GLN A 723 1.555 -9.015 -18.912 1.00 0.00 C ATOM 82 O GLN A 723 2.279 -9.415 -19.824 1.00 0.00 O ATOM 83 CB GLN A 723 -0.921 -9.361 -18.725 1.00 0.00 C ATOM 84 CG GLN A 723 -2.064 -10.292 -18.344 1.00 0.00 C ATOM 85 CD GLN A 723 -3.412 -9.800 -18.831 1.00 0.00 C ATOM 86 OE1 GLN A 723 -3.642 -8.597 -18.951 1.00 0.00 O ATOM 87 NE2 GLN A 723 -4.310 -10.729 -19.115 1.00 0.00 N ATOM 0 H GLN A 723 0.696 -9.098 -16.422 1.00 0.00 H new ATOM 0 HA GLN A 723 0.558 -10.901 -18.763 1.00 0.00 H new ATOM 0 HB2 GLN A 723 -1.072 -8.396 -18.242 1.00 0.00 H new ATOM 0 HB3 GLN A 723 -0.948 -9.187 -19.801 1.00 0.00 H new ATOM 0 HG2 GLN A 723 -1.873 -11.282 -18.758 1.00 0.00 H new ATOM 0 HG3 GLN A 723 -2.092 -10.400 -17.260 1.00 0.00 H new ATOM 0 HE21 GLN A 723 -4.077 -11.715 -19.001 1.00 0.00 H new ATOM 0 HE22 GLN A 723 -5.235 -10.459 -19.448 1.00 0.00 H new ATOM 96 N ASP A 724 1.688 -7.815 -18.363 1.00 0.00 N ATOM 97 CA ASP A 724 2.757 -6.910 -18.765 1.00 0.00 C ATOM 98 C ASP A 724 4.043 -7.251 -18.033 1.00 0.00 C ATOM 99 O ASP A 724 4.517 -6.504 -17.174 1.00 0.00 O ATOM 100 CB ASP A 724 2.379 -5.447 -18.522 1.00 0.00 C ATOM 101 CG ASP A 724 1.735 -4.807 -19.732 1.00 0.00 C ATOM 102 OD1 ASP A 724 0.533 -5.039 -19.972 1.00 0.00 O ATOM 103 OD2 ASP A 724 2.435 -4.066 -20.457 1.00 0.00 O ATOM 0 H ASP A 724 1.071 -7.446 -17.640 1.00 0.00 H new ATOM 0 HA ASP A 724 2.913 -7.039 -19.836 1.00 0.00 H new ATOM 0 HB2 ASP A 724 1.694 -5.388 -17.676 1.00 0.00 H new ATOM 0 HB3 ASP A 724 3.272 -4.885 -18.250 1.00 0.00 H new ATOM 108 N GLY A 725 4.581 -8.408 -18.364 1.00 0.00 N ATOM 109 CA GLY A 725 5.821 -8.858 -17.784 1.00 0.00 C ATOM 110 C GLY A 725 6.429 -9.965 -18.608 1.00 0.00 C ATOM 111 O GLY A 725 7.018 -10.902 -18.074 1.00 0.00 O ATOM 0 H GLY A 725 4.171 -9.055 -19.038 1.00 0.00 H new ATOM 0 HA2 GLY A 725 6.519 -8.024 -17.716 1.00 0.00 H new ATOM 0 HA3 GLY A 725 5.645 -9.210 -16.768 1.00 0.00 H new ATOM 115 N VAL A 726 6.286 -9.856 -19.922 1.00 0.00 N ATOM 116 CA VAL A 726 6.772 -10.875 -20.821 1.00 0.00 C ATOM 117 C VAL A 726 7.939 -10.338 -21.628 1.00 0.00 C ATOM 118 O VAL A 726 7.783 -9.687 -22.660 1.00 0.00 O ATOM 119 CB VAL A 726 5.656 -11.433 -21.732 1.00 0.00 C ATOM 120 CG1 VAL A 726 4.891 -10.320 -22.435 1.00 0.00 C ATOM 121 CG2 VAL A 726 6.216 -12.427 -22.739 1.00 0.00 C ATOM 0 H VAL A 726 5.835 -9.066 -20.383 1.00 0.00 H new ATOM 0 HA VAL A 726 7.121 -11.716 -20.221 1.00 0.00 H new ATOM 0 HB VAL A 726 4.950 -11.960 -21.091 1.00 0.00 H new ATOM 0 HG11 VAL A 726 4.115 -10.754 -23.066 1.00 0.00 H new ATOM 0 HG12 VAL A 726 4.432 -9.668 -21.692 1.00 0.00 H new ATOM 0 HG13 VAL A 726 5.578 -9.740 -23.052 1.00 0.00 H new ATOM 0 HG21 VAL A 726 5.408 -12.803 -23.367 1.00 0.00 H new ATOM 0 HG22 VAL A 726 6.960 -11.932 -23.363 1.00 0.00 H new ATOM 0 HG23 VAL A 726 6.681 -13.258 -22.209 1.00 0.00 H new ATOM 131 N ASP A 727 9.108 -10.579 -21.092 1.00 0.00 N ATOM 132 CA ASP A 727 10.349 -10.159 -21.709 1.00 0.00 C ATOM 133 C ASP A 727 11.366 -11.271 -21.531 1.00 0.00 C ATOM 134 O ASP A 727 11.482 -11.829 -20.438 1.00 0.00 O ATOM 135 CB ASP A 727 10.845 -8.846 -21.082 1.00 0.00 C ATOM 136 CG ASP A 727 12.205 -8.405 -21.598 1.00 0.00 C ATOM 137 OD1 ASP A 727 13.222 -9.014 -21.206 1.00 0.00 O ATOM 138 OD2 ASP A 727 12.259 -7.424 -22.370 1.00 0.00 O ATOM 0 H ASP A 727 9.231 -11.075 -20.209 1.00 0.00 H new ATOM 0 HA ASP A 727 10.197 -9.970 -22.772 1.00 0.00 H new ATOM 0 HB2 ASP A 727 10.117 -8.060 -21.281 1.00 0.00 H new ATOM 0 HB3 ASP A 727 10.897 -8.966 -20.000 1.00 0.00 H new ATOM 143 N HIS A 728 12.074 -11.608 -22.601 1.00 0.00 N ATOM 144 CA HIS A 728 12.979 -12.755 -22.595 1.00 0.00 C ATOM 145 C HIS A 728 14.000 -12.652 -21.464 1.00 0.00 C ATOM 146 O HIS A 728 14.248 -13.623 -20.746 1.00 0.00 O ATOM 147 CB HIS A 728 13.698 -12.875 -23.945 1.00 0.00 C ATOM 148 CG HIS A 728 14.528 -14.122 -24.085 1.00 0.00 C ATOM 149 ND1 HIS A 728 14.085 -15.276 -24.693 1.00 0.00 N ATOM 150 CD2 HIS A 728 15.801 -14.378 -23.686 1.00 0.00 C ATOM 151 CE1 HIS A 728 15.073 -16.176 -24.643 1.00 0.00 C ATOM 152 NE2 HIS A 728 16.140 -15.681 -24.043 1.00 0.00 N ATOM 0 H HIS A 728 12.040 -11.104 -23.487 1.00 0.00 H new ATOM 0 HA HIS A 728 12.380 -13.651 -22.429 1.00 0.00 H new ATOM 0 HB2 HIS A 728 12.957 -12.852 -24.744 1.00 0.00 H new ATOM 0 HB3 HIS A 728 14.341 -12.005 -24.082 1.00 0.00 H new ATOM 0 HD2 HIS A 728 16.448 -13.682 -23.173 1.00 0.00 H new ATOM 0 HE1 HIS A 728 15.007 -17.178 -25.042 1.00 0.00 H new ATOM 0 HE2 HIS A 728 17.028 -16.154 -23.876 1.00 0.00 H new ATOM 160 N PHE A 729 14.562 -11.471 -21.285 1.00 0.00 N ATOM 161 CA PHE A 729 15.609 -11.282 -20.302 1.00 0.00 C ATOM 162 C PHE A 729 15.016 -11.114 -18.911 1.00 0.00 C ATOM 163 O PHE A 729 15.571 -11.611 -17.935 1.00 0.00 O ATOM 164 CB PHE A 729 16.487 -10.093 -20.687 1.00 0.00 C ATOM 165 CG PHE A 729 17.227 -10.324 -21.974 1.00 0.00 C ATOM 166 CD1 PHE A 729 18.134 -11.365 -22.082 1.00 0.00 C ATOM 167 CD2 PHE A 729 17.003 -9.519 -23.078 1.00 0.00 C ATOM 168 CE1 PHE A 729 18.807 -11.597 -23.265 1.00 0.00 C ATOM 169 CE2 PHE A 729 17.672 -9.750 -24.266 1.00 0.00 C ATOM 170 CZ PHE A 729 18.572 -10.791 -24.357 1.00 0.00 C ATOM 0 H PHE A 729 14.311 -10.631 -21.807 1.00 0.00 H new ATOM 0 HA PHE A 729 16.239 -12.171 -20.283 1.00 0.00 H new ATOM 0 HB2 PHE A 729 15.867 -9.202 -20.782 1.00 0.00 H new ATOM 0 HB3 PHE A 729 17.203 -9.899 -19.888 1.00 0.00 H new ATOM 0 HD1 PHE A 729 18.317 -12.003 -21.230 1.00 0.00 H new ATOM 0 HD2 PHE A 729 16.299 -8.703 -23.011 1.00 0.00 H new ATOM 0 HE1 PHE A 729 19.516 -12.409 -23.334 1.00 0.00 H new ATOM 0 HE2 PHE A 729 17.490 -9.116 -25.121 1.00 0.00 H new ATOM 0 HZ PHE A 729 19.093 -10.974 -25.285 1.00 0.00 H new ATOM 180 N ARG A 730 13.870 -10.442 -18.829 1.00 0.00 N ATOM 181 CA ARG A 730 13.142 -10.318 -17.567 1.00 0.00 C ATOM 182 C ARG A 730 12.824 -11.702 -17.007 1.00 0.00 C ATOM 183 O ARG A 730 12.999 -11.955 -15.814 1.00 0.00 O ATOM 184 CB ARG A 730 11.839 -9.534 -17.771 1.00 0.00 C ATOM 185 CG ARG A 730 10.970 -9.412 -16.523 1.00 0.00 C ATOM 186 CD ARG A 730 11.619 -8.559 -15.441 1.00 0.00 C ATOM 187 NE ARG A 730 11.722 -7.149 -15.822 1.00 0.00 N ATOM 188 CZ ARG A 730 10.977 -6.175 -15.288 1.00 0.00 C ATOM 189 NH1 ARG A 730 10.018 -6.461 -14.412 1.00 0.00 N ATOM 190 NH2 ARG A 730 11.184 -4.909 -15.637 1.00 0.00 N ATOM 0 H ARG A 730 13.425 -9.975 -19.620 1.00 0.00 H new ATOM 0 HA ARG A 730 13.771 -9.778 -16.860 1.00 0.00 H new ATOM 0 HB2 ARG A 730 12.084 -8.533 -18.126 1.00 0.00 H new ATOM 0 HB3 ARG A 730 11.258 -10.018 -18.556 1.00 0.00 H new ATOM 0 HG2 ARG A 730 10.008 -8.978 -16.795 1.00 0.00 H new ATOM 0 HG3 ARG A 730 10.769 -10.407 -16.125 1.00 0.00 H new ATOM 0 HD2 ARG A 730 11.039 -8.642 -14.522 1.00 0.00 H new ATOM 0 HD3 ARG A 730 12.615 -8.947 -15.226 1.00 0.00 H new ATOM 0 HE ARG A 730 12.403 -6.894 -16.538 1.00 0.00 H new ATOM 0 HH11 ARG A 730 9.846 -7.430 -14.142 1.00 0.00 H new ATOM 0 HH12 ARG A 730 9.455 -5.712 -14.010 1.00 0.00 H new ATOM 0 HH21 ARG A 730 11.912 -4.679 -16.313 1.00 0.00 H new ATOM 0 HH22 ARG A 730 10.615 -4.168 -15.229 1.00 0.00 H new ATOM 204 N ALA A 731 12.379 -12.596 -17.886 1.00 0.00 N ATOM 205 CA ALA A 731 12.025 -13.956 -17.498 1.00 0.00 C ATOM 206 C ALA A 731 13.244 -14.723 -17.000 1.00 0.00 C ATOM 207 O ALA A 731 13.201 -15.354 -15.945 1.00 0.00 O ATOM 208 CB ALA A 731 11.380 -14.688 -18.666 1.00 0.00 C ATOM 0 H ALA A 731 12.255 -12.399 -18.879 1.00 0.00 H new ATOM 0 HA ALA A 731 11.308 -13.896 -16.679 1.00 0.00 H new ATOM 0 HB1 ALA A 731 11.121 -15.702 -18.362 1.00 0.00 H new ATOM 0 HB2 ALA A 731 10.477 -14.160 -18.973 1.00 0.00 H new ATOM 0 HB3 ALA A 731 12.079 -14.727 -19.501 1.00 0.00 H new ATOM 214 N MET A 732 14.337 -14.649 -17.749 1.00 0.00 N ATOM 215 CA MET A 732 15.551 -15.372 -17.384 1.00 0.00 C ATOM 216 C MET A 732 16.144 -14.833 -16.083 1.00 0.00 C ATOM 217 O MET A 732 16.672 -15.595 -15.275 1.00 0.00 O ATOM 218 CB MET A 732 16.584 -15.317 -18.515 1.00 0.00 C ATOM 219 CG MET A 732 16.100 -15.974 -19.798 1.00 0.00 C ATOM 220 SD MET A 732 17.345 -17.031 -20.574 1.00 0.00 S ATOM 221 CE MET A 732 18.681 -15.868 -20.830 1.00 0.00 C ATOM 0 H MET A 732 14.409 -14.101 -18.606 1.00 0.00 H new ATOM 0 HA MET A 732 15.279 -16.415 -17.223 1.00 0.00 H new ATOM 0 HB2 MET A 732 16.835 -14.276 -18.719 1.00 0.00 H new ATOM 0 HB3 MET A 732 17.500 -15.807 -18.186 1.00 0.00 H new ATOM 0 HG2 MET A 732 15.213 -16.569 -19.581 1.00 0.00 H new ATOM 0 HG3 MET A 732 15.800 -15.199 -20.504 1.00 0.00 H new ATOM 0 HE1 MET A 732 19.317 -16.218 -21.643 1.00 0.00 H new ATOM 0 HE2 MET A 732 18.269 -14.892 -21.086 1.00 0.00 H new ATOM 0 HE3 MET A 732 19.271 -15.785 -19.917 1.00 0.00 H new ATOM 231 N ILE A 733 16.035 -13.525 -15.877 1.00 0.00 N ATOM 232 CA ILE A 733 16.550 -12.891 -14.666 1.00 0.00 C ATOM 233 C ILE A 733 15.677 -13.208 -13.452 1.00 0.00 C ATOM 234 O ILE A 733 16.195 -13.513 -12.376 1.00 0.00 O ATOM 235 CB ILE A 733 16.674 -11.357 -14.832 1.00 0.00 C ATOM 236 CG1 ILE A 733 17.732 -11.022 -15.886 1.00 0.00 C ATOM 237 CG2 ILE A 733 17.019 -10.693 -13.503 1.00 0.00 C ATOM 238 CD1 ILE A 733 17.847 -9.542 -16.181 1.00 0.00 C ATOM 0 H ILE A 733 15.594 -12.881 -16.534 1.00 0.00 H new ATOM 0 HA ILE A 733 17.545 -13.303 -14.498 1.00 0.00 H new ATOM 0 HB ILE A 733 15.711 -10.970 -15.165 1.00 0.00 H new ATOM 0 HG12 ILE A 733 18.700 -11.393 -15.548 1.00 0.00 H new ATOM 0 HG13 ILE A 733 17.493 -11.550 -16.809 1.00 0.00 H new ATOM 0 HG21 ILE A 733 17.101 -9.615 -13.645 1.00 0.00 H new ATOM 0 HG22 ILE A 733 16.235 -10.905 -12.776 1.00 0.00 H new ATOM 0 HG23 ILE A 733 17.968 -11.084 -13.137 1.00 0.00 H new ATOM 0 HD11 ILE A 733 18.616 -9.380 -16.937 1.00 0.00 H new ATOM 0 HD12 ILE A 733 16.891 -9.169 -16.550 1.00 0.00 H new ATOM 0 HD13 ILE A 733 18.117 -9.009 -15.269 1.00 0.00 H new ATOM 250 N VAL A 734 14.358 -13.161 -13.616 1.00 0.00 N ATOM 251 CA VAL A 734 13.462 -13.386 -12.489 1.00 0.00 C ATOM 252 C VAL A 734 13.570 -14.827 -11.982 1.00 0.00 C ATOM 253 O VAL A 734 13.543 -15.065 -10.775 1.00 0.00 O ATOM 254 CB VAL A 734 11.987 -13.030 -12.817 1.00 0.00 C ATOM 255 CG1 VAL A 734 11.381 -13.989 -13.830 1.00 0.00 C ATOM 256 CG2 VAL A 734 11.148 -12.997 -11.549 1.00 0.00 C ATOM 0 H VAL A 734 13.893 -12.972 -14.504 1.00 0.00 H new ATOM 0 HA VAL A 734 13.783 -12.710 -11.696 1.00 0.00 H new ATOM 0 HB VAL A 734 11.987 -12.037 -13.266 1.00 0.00 H new ATOM 0 HG11 VAL A 734 10.349 -13.702 -14.030 1.00 0.00 H new ATOM 0 HG12 VAL A 734 11.954 -13.950 -14.756 1.00 0.00 H new ATOM 0 HG13 VAL A 734 11.405 -15.003 -13.431 1.00 0.00 H new ATOM 0 HG21 VAL A 734 10.118 -12.746 -11.801 1.00 0.00 H new ATOM 0 HG22 VAL A 734 11.176 -13.975 -11.069 1.00 0.00 H new ATOM 0 HG23 VAL A 734 11.548 -12.247 -10.867 1.00 0.00 H new ATOM 266 N GLU A 735 13.734 -15.779 -12.899 1.00 0.00 N ATOM 267 CA GLU A 735 13.914 -17.174 -12.512 1.00 0.00 C ATOM 268 C GLU A 735 15.322 -17.394 -11.971 1.00 0.00 C ATOM 269 O GLU A 735 15.546 -18.261 -11.129 1.00 0.00 O ATOM 270 CB GLU A 735 13.650 -18.112 -13.690 1.00 0.00 C ATOM 271 CG GLU A 735 12.231 -18.045 -14.225 1.00 0.00 C ATOM 272 CD GLU A 735 11.903 -19.206 -15.142 1.00 0.00 C ATOM 273 OE1 GLU A 735 12.167 -19.114 -16.359 1.00 0.00 O ATOM 274 OE2 GLU A 735 11.389 -20.230 -14.646 1.00 0.00 O ATOM 0 H GLU A 735 13.746 -15.611 -13.905 1.00 0.00 H new ATOM 0 HA GLU A 735 13.192 -17.402 -11.728 1.00 0.00 H new ATOM 0 HB2 GLU A 735 14.343 -17.871 -14.496 1.00 0.00 H new ATOM 0 HB3 GLU A 735 13.863 -19.135 -13.381 1.00 0.00 H new ATOM 0 HG2 GLU A 735 11.531 -18.037 -13.390 1.00 0.00 H new ATOM 0 HG3 GLU A 735 12.093 -17.109 -14.766 1.00 0.00 H new ATOM 281 N PHE A 736 16.265 -16.597 -12.462 1.00 0.00 N ATOM 282 CA PHE A 736 17.643 -16.637 -11.989 1.00 0.00 C ATOM 283 C PHE A 736 17.726 -16.280 -10.505 1.00 0.00 C ATOM 284 O PHE A 736 18.479 -16.895 -9.749 1.00 0.00 O ATOM 285 CB PHE A 736 18.499 -15.675 -12.821 1.00 0.00 C ATOM 286 CG PHE A 736 19.849 -15.376 -12.237 1.00 0.00 C ATOM 287 CD1 PHE A 736 20.820 -16.359 -12.148 1.00 0.00 C ATOM 288 CD2 PHE A 736 20.148 -14.101 -11.785 1.00 0.00 C ATOM 289 CE1 PHE A 736 22.064 -16.075 -11.619 1.00 0.00 C ATOM 290 CE2 PHE A 736 21.388 -13.811 -11.257 1.00 0.00 C ATOM 291 CZ PHE A 736 22.346 -14.798 -11.174 1.00 0.00 C ATOM 0 H PHE A 736 16.096 -15.908 -13.195 1.00 0.00 H new ATOM 0 HA PHE A 736 18.023 -17.652 -12.107 1.00 0.00 H new ATOM 0 HB2 PHE A 736 18.634 -16.098 -13.817 1.00 0.00 H new ATOM 0 HB3 PHE A 736 17.955 -14.738 -12.943 1.00 0.00 H new ATOM 0 HD1 PHE A 736 20.603 -17.358 -12.496 1.00 0.00 H new ATOM 0 HD2 PHE A 736 19.400 -13.324 -11.847 1.00 0.00 H new ATOM 0 HE1 PHE A 736 22.814 -16.849 -11.553 1.00 0.00 H new ATOM 0 HE2 PHE A 736 21.608 -12.813 -10.909 1.00 0.00 H new ATOM 0 HZ PHE A 736 23.318 -14.573 -10.761 1.00 0.00 H new ATOM 301 N MET A 737 16.939 -15.294 -10.092 1.00 0.00 N ATOM 302 CA MET A 737 16.912 -14.876 -8.693 1.00 0.00 C ATOM 303 C MET A 737 16.431 -16.011 -7.799 1.00 0.00 C ATOM 304 O MET A 737 16.882 -16.151 -6.662 1.00 0.00 O ATOM 305 CB MET A 737 16.014 -13.652 -8.499 1.00 0.00 C ATOM 306 CG MET A 737 16.445 -12.437 -9.301 1.00 0.00 C ATOM 307 SD MET A 737 15.584 -10.931 -8.805 1.00 0.00 S ATOM 308 CE MET A 737 13.870 -11.433 -8.948 1.00 0.00 C ATOM 0 H MET A 737 16.312 -14.770 -10.702 1.00 0.00 H new ATOM 0 HA MET A 737 17.931 -14.609 -8.412 1.00 0.00 H new ATOM 0 HB2 MET A 737 14.993 -13.915 -8.777 1.00 0.00 H new ATOM 0 HB3 MET A 737 15.998 -13.390 -7.441 1.00 0.00 H new ATOM 0 HG2 MET A 737 17.519 -12.292 -9.183 1.00 0.00 H new ATOM 0 HG3 MET A 737 16.263 -12.623 -10.359 1.00 0.00 H new ATOM 0 HE1 MET A 737 13.292 -10.629 -9.405 1.00 0.00 H new ATOM 0 HE2 MET A 737 13.803 -12.326 -9.569 1.00 0.00 H new ATOM 0 HE3 MET A 737 13.470 -11.649 -7.957 1.00 0.00 H new ATOM 318 N ALA A 738 15.531 -16.830 -8.329 1.00 0.00 N ATOM 319 CA ALA A 738 14.971 -17.943 -7.575 1.00 0.00 C ATOM 320 C ALA A 738 15.777 -19.221 -7.802 1.00 0.00 C ATOM 321 O ALA A 738 15.427 -20.291 -7.298 1.00 0.00 O ATOM 322 CB ALA A 738 13.512 -18.158 -7.960 1.00 0.00 C ATOM 0 H ALA A 738 15.173 -16.743 -9.280 1.00 0.00 H new ATOM 0 HA ALA A 738 15.023 -17.697 -6.514 1.00 0.00 H new ATOM 0 HB1 ALA A 738 13.104 -18.993 -7.390 1.00 0.00 H new ATOM 0 HB2 ALA A 738 12.941 -17.256 -7.741 1.00 0.00 H new ATOM 0 HB3 ALA A 738 13.446 -18.380 -9.025 1.00 0.00 H new ATOM 328 N SER A 739 16.858 -19.103 -8.557 1.00 0.00 N ATOM 329 CA SER A 739 17.712 -20.238 -8.853 1.00 0.00 C ATOM 330 C SER A 739 18.901 -20.245 -7.901 1.00 0.00 C ATOM 331 O SER A 739 19.154 -19.254 -7.211 1.00 0.00 O ATOM 332 CB SER A 739 18.189 -20.175 -10.311 1.00 0.00 C ATOM 333 OG SER A 739 18.879 -21.356 -10.682 1.00 0.00 O ATOM 0 H SER A 739 17.164 -18.226 -8.977 1.00 0.00 H new ATOM 0 HA SER A 739 17.146 -21.160 -8.717 1.00 0.00 H new ATOM 0 HB2 SER A 739 17.332 -20.030 -10.969 1.00 0.00 H new ATOM 0 HB3 SER A 739 18.843 -19.313 -10.444 1.00 0.00 H new ATOM 0 HG SER A 739 19.168 -21.286 -11.616 1.00 0.00 H new ATOM 339 N LYS A 740 19.631 -21.354 -7.861 1.00 0.00 N ATOM 340 CA LYS A 740 20.769 -21.476 -6.964 1.00 0.00 C ATOM 341 C LYS A 740 22.044 -20.969 -7.623 1.00 0.00 C ATOM 342 O LYS A 740 23.115 -20.967 -7.009 1.00 0.00 O ATOM 343 CB LYS A 740 20.941 -22.922 -6.503 1.00 0.00 C ATOM 344 CG LYS A 740 19.791 -23.415 -5.639 1.00 0.00 C ATOM 345 CD LYS A 740 20.034 -24.829 -5.149 1.00 0.00 C ATOM 346 CE LYS A 740 18.879 -25.335 -4.302 1.00 0.00 C ATOM 347 NZ LYS A 740 19.146 -26.696 -3.766 1.00 0.00 N ATOM 0 H LYS A 740 19.455 -22.177 -8.437 1.00 0.00 H new ATOM 0 HA LYS A 740 20.573 -20.856 -6.089 1.00 0.00 H new ATOM 0 HB2 LYS A 740 21.033 -23.567 -7.377 1.00 0.00 H new ATOM 0 HB3 LYS A 740 21.872 -23.010 -5.943 1.00 0.00 H new ATOM 0 HG2 LYS A 740 19.664 -22.749 -4.785 1.00 0.00 H new ATOM 0 HG3 LYS A 740 18.864 -23.381 -6.211 1.00 0.00 H new ATOM 0 HD2 LYS A 740 20.177 -25.491 -6.003 1.00 0.00 H new ATOM 0 HD3 LYS A 740 20.954 -24.859 -4.565 1.00 0.00 H new ATOM 0 HE2 LYS A 740 18.704 -24.646 -3.476 1.00 0.00 H new ATOM 0 HE3 LYS A 740 17.968 -25.352 -4.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 740 18.336 -27.009 -3.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 740 19.288 -27.358 -4.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 740 20.001 -26.674 -3.174 1.00 0.00 H new ATOM 361 N LYS A 741 21.928 -20.535 -8.873 1.00 0.00 N ATOM 362 CA LYS A 741 23.043 -19.904 -9.557 1.00 0.00 C ATOM 363 C LYS A 741 23.370 -18.576 -8.896 1.00 0.00 C ATOM 364 O LYS A 741 22.476 -17.779 -8.605 1.00 0.00 O ATOM 365 CB LYS A 741 22.733 -19.673 -11.037 1.00 0.00 C ATOM 366 CG LYS A 741 22.657 -20.946 -11.866 1.00 0.00 C ATOM 367 CD LYS A 741 22.501 -20.625 -13.345 1.00 0.00 C ATOM 368 CE LYS A 741 22.530 -21.880 -14.202 1.00 0.00 C ATOM 369 NZ LYS A 741 22.447 -21.566 -15.653 1.00 0.00 N ATOM 0 H LYS A 741 21.076 -20.609 -9.429 1.00 0.00 H new ATOM 0 HA LYS A 741 23.900 -20.574 -9.487 1.00 0.00 H new ATOM 0 HB2 LYS A 741 21.784 -19.143 -11.119 1.00 0.00 H new ATOM 0 HB3 LYS A 741 23.499 -19.023 -11.460 1.00 0.00 H new ATOM 0 HG2 LYS A 741 23.559 -21.539 -11.712 1.00 0.00 H new ATOM 0 HG3 LYS A 741 21.816 -21.553 -11.531 1.00 0.00 H new ATOM 0 HD2 LYS A 741 21.561 -20.097 -13.505 1.00 0.00 H new ATOM 0 HD3 LYS A 741 23.301 -19.953 -13.657 1.00 0.00 H new ATOM 0 HE2 LYS A 741 23.447 -22.434 -14.003 1.00 0.00 H new ATOM 0 HE3 LYS A 741 21.699 -22.529 -13.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 741 22.470 -22.449 -16.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 741 21.560 -21.060 -15.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 741 23.253 -20.968 -15.926 1.00 0.00 H new ATOM 383 N MET A 742 24.646 -18.348 -8.644 1.00 0.00 N ATOM 384 CA MET A 742 25.089 -17.097 -8.049 1.00 0.00 C ATOM 385 C MET A 742 25.361 -16.076 -9.144 1.00 0.00 C ATOM 386 O MET A 742 25.321 -14.865 -8.910 1.00 0.00 O ATOM 387 CB MET A 742 26.350 -17.310 -7.200 1.00 0.00 C ATOM 388 CG MET A 742 27.588 -17.687 -8.002 1.00 0.00 C ATOM 389 SD MET A 742 29.026 -17.996 -6.961 1.00 0.00 S ATOM 390 CE MET A 742 30.268 -18.327 -8.209 1.00 0.00 C ATOM 0 H MET A 742 25.395 -19.012 -8.841 1.00 0.00 H new ATOM 0 HA MET A 742 24.300 -16.725 -7.396 1.00 0.00 H new ATOM 0 HB2 MET A 742 26.557 -16.397 -6.642 1.00 0.00 H new ATOM 0 HB3 MET A 742 26.153 -18.093 -6.468 1.00 0.00 H new ATOM 0 HG2 MET A 742 27.375 -18.577 -8.593 1.00 0.00 H new ATOM 0 HG3 MET A 742 27.819 -16.886 -8.704 1.00 0.00 H new ATOM 0 HE1 MET A 742 31.222 -18.538 -7.726 1.00 0.00 H new ATOM 0 HE2 MET A 742 29.965 -19.188 -8.805 1.00 0.00 H new ATOM 0 HE3 MET A 742 30.374 -17.457 -8.857 1.00 0.00 H new ATOM 400 N GLN A 743 25.625 -16.585 -10.342 1.00 0.00 N ATOM 401 CA GLN A 743 25.924 -15.748 -11.488 1.00 0.00 C ATOM 402 C GLN A 743 25.288 -16.331 -12.746 1.00 0.00 C ATOM 403 O GLN A 743 25.249 -17.546 -12.928 1.00 0.00 O ATOM 404 CB GLN A 743 27.441 -15.611 -11.671 1.00 0.00 C ATOM 405 CG GLN A 743 28.161 -16.932 -11.916 1.00 0.00 C ATOM 406 CD GLN A 743 29.667 -16.775 -12.023 1.00 0.00 C ATOM 407 OE1 GLN A 743 30.422 -17.689 -11.701 1.00 0.00 O ATOM 408 NE2 GLN A 743 30.117 -15.610 -12.466 1.00 0.00 N ATOM 0 H GLN A 743 25.637 -17.585 -10.541 1.00 0.00 H new ATOM 0 HA GLN A 743 25.507 -14.756 -11.313 1.00 0.00 H new ATOM 0 HB2 GLN A 743 27.636 -14.943 -12.510 1.00 0.00 H new ATOM 0 HB3 GLN A 743 27.862 -15.140 -10.783 1.00 0.00 H new ATOM 0 HG2 GLN A 743 27.930 -17.622 -11.104 1.00 0.00 H new ATOM 0 HG3 GLN A 743 27.782 -17.381 -12.834 1.00 0.00 H new ATOM 0 HE21 GLN A 743 29.460 -14.874 -12.724 1.00 0.00 H new ATOM 0 HE22 GLN A 743 31.121 -15.449 -12.549 1.00 0.00 H new ATOM 417 N LEU A 744 24.762 -15.455 -13.585 1.00 0.00 N ATOM 418 CA LEU A 744 24.170 -15.849 -14.849 1.00 0.00 C ATOM 419 C LEU A 744 24.933 -15.196 -15.987 1.00 0.00 C ATOM 420 O LEU A 744 24.811 -13.991 -16.222 1.00 0.00 O ATOM 421 CB LEU A 744 22.694 -15.446 -14.898 1.00 0.00 C ATOM 422 CG LEU A 744 21.933 -15.849 -16.167 1.00 0.00 C ATOM 423 CD1 LEU A 744 21.923 -17.360 -16.345 1.00 0.00 C ATOM 424 CD2 LEU A 744 20.511 -15.318 -16.121 1.00 0.00 C ATOM 0 H LEU A 744 24.734 -14.451 -13.408 1.00 0.00 H new ATOM 0 HA LEU A 744 24.230 -16.933 -14.950 1.00 0.00 H new ATOM 0 HB2 LEU A 744 22.188 -15.886 -14.039 1.00 0.00 H new ATOM 0 HB3 LEU A 744 22.629 -14.364 -14.786 1.00 0.00 H new ATOM 0 HG LEU A 744 22.448 -15.410 -17.021 1.00 0.00 H new ATOM 0 HD11 LEU A 744 21.376 -17.616 -17.253 1.00 0.00 H new ATOM 0 HD12 LEU A 744 22.947 -17.724 -16.424 1.00 0.00 H new ATOM 0 HD13 LEU A 744 21.438 -17.824 -15.486 1.00 0.00 H new ATOM 0 HD21 LEU A 744 19.983 -15.612 -17.028 1.00 0.00 H new ATOM 0 HD22 LEU A 744 19.997 -15.730 -15.253 1.00 0.00 H new ATOM 0 HD23 LEU A 744 20.531 -14.231 -16.049 1.00 0.00 H new ATOM 436 N GLU A 745 25.756 -15.983 -16.647 1.00 0.00 N ATOM 437 CA GLU A 745 26.541 -15.500 -17.770 1.00 0.00 C ATOM 438 C GLU A 745 25.740 -15.633 -19.055 1.00 0.00 C ATOM 439 O GLU A 745 25.500 -16.743 -19.537 1.00 0.00 O ATOM 440 CB GLU A 745 27.868 -16.265 -17.907 1.00 0.00 C ATOM 441 CG GLU A 745 28.246 -17.112 -16.699 1.00 0.00 C ATOM 442 CD GLU A 745 27.478 -18.418 -16.645 1.00 0.00 C ATOM 443 OE1 GLU A 745 27.901 -19.389 -17.304 1.00 0.00 O ATOM 444 OE2 GLU A 745 26.440 -18.475 -15.958 1.00 0.00 O ATOM 0 H GLU A 745 25.901 -16.968 -16.425 1.00 0.00 H new ATOM 0 HA GLU A 745 26.775 -14.451 -17.585 1.00 0.00 H new ATOM 0 HB2 GLU A 745 27.809 -16.912 -18.782 1.00 0.00 H new ATOM 0 HB3 GLU A 745 28.667 -15.547 -18.094 1.00 0.00 H new ATOM 0 HG2 GLU A 745 29.315 -17.323 -16.727 1.00 0.00 H new ATOM 0 HG3 GLU A 745 28.057 -16.545 -15.788 1.00 0.00 H new ATOM 451 N PHE A 746 25.317 -14.505 -19.596 1.00 0.00 N ATOM 452 CA PHE A 746 24.561 -14.490 -20.834 1.00 0.00 C ATOM 453 C PHE A 746 25.488 -14.707 -22.024 1.00 0.00 C ATOM 454 O PHE A 746 26.652 -14.308 -21.988 1.00 0.00 O ATOM 455 CB PHE A 746 23.815 -13.167 -20.993 1.00 0.00 C ATOM 456 CG PHE A 746 22.666 -12.988 -20.041 1.00 0.00 C ATOM 457 CD1 PHE A 746 22.878 -12.549 -18.745 1.00 0.00 C ATOM 458 CD2 PHE A 746 21.368 -13.254 -20.450 1.00 0.00 C ATOM 459 CE1 PHE A 746 21.819 -12.380 -17.876 1.00 0.00 C ATOM 460 CE2 PHE A 746 20.306 -13.085 -19.584 1.00 0.00 C ATOM 461 CZ PHE A 746 20.531 -12.647 -18.297 1.00 0.00 C ATOM 0 H PHE A 746 25.486 -13.583 -19.194 1.00 0.00 H new ATOM 0 HA PHE A 746 23.833 -15.300 -20.798 1.00 0.00 H new ATOM 0 HB2 PHE A 746 24.519 -12.347 -20.853 1.00 0.00 H new ATOM 0 HB3 PHE A 746 23.441 -13.095 -22.014 1.00 0.00 H new ATOM 0 HD1 PHE A 746 23.883 -12.337 -18.411 1.00 0.00 H new ATOM 0 HD2 PHE A 746 21.186 -13.597 -21.458 1.00 0.00 H new ATOM 0 HE1 PHE A 746 21.998 -12.039 -16.867 1.00 0.00 H new ATOM 0 HE2 PHE A 746 19.300 -13.296 -19.915 1.00 0.00 H new ATOM 0 HZ PHE A 746 19.701 -12.513 -17.619 1.00 0.00 H new ATOM 471 N PRO A 747 24.984 -15.349 -23.090 1.00 0.00 N ATOM 472 CA PRO A 747 25.767 -15.608 -24.302 1.00 0.00 C ATOM 473 C PRO A 747 26.208 -14.317 -24.993 1.00 0.00 C ATOM 474 O PRO A 747 25.526 -13.295 -24.909 1.00 0.00 O ATOM 475 CB PRO A 747 24.800 -16.388 -25.205 1.00 0.00 C ATOM 476 CG PRO A 747 23.728 -16.887 -24.297 1.00 0.00 C ATOM 477 CD PRO A 747 23.615 -15.878 -23.196 1.00 0.00 C ATOM 0 HA PRO A 747 26.687 -16.147 -24.078 1.00 0.00 H new ATOM 0 HB2 PRO A 747 24.388 -15.748 -25.985 1.00 0.00 H new ATOM 0 HB3 PRO A 747 25.308 -17.213 -25.705 1.00 0.00 H new ATOM 0 HG2 PRO A 747 22.783 -16.990 -24.830 1.00 0.00 H new ATOM 0 HG3 PRO A 747 23.980 -17.871 -23.900 1.00 0.00 H new ATOM 0 HD2 PRO A 747 22.897 -15.094 -23.439 1.00 0.00 H new ATOM 0 HD3 PRO A 747 23.285 -16.334 -22.263 1.00 0.00 H new ATOM 485 N PRO A 748 27.349 -14.350 -25.701 1.00 0.00 N ATOM 486 CA PRO A 748 27.874 -13.179 -26.421 1.00 0.00 C ATOM 487 C PRO A 748 26.972 -12.746 -27.575 1.00 0.00 C ATOM 488 O PRO A 748 27.198 -11.709 -28.200 1.00 0.00 O ATOM 489 CB PRO A 748 29.225 -13.656 -26.958 1.00 0.00 C ATOM 490 CG PRO A 748 29.131 -15.143 -26.982 1.00 0.00 C ATOM 491 CD PRO A 748 28.227 -15.523 -25.845 1.00 0.00 C ATOM 0 HA PRO A 748 27.942 -12.308 -25.769 1.00 0.00 H new ATOM 0 HB2 PRO A 748 29.416 -13.257 -27.954 1.00 0.00 H new ATOM 0 HB3 PRO A 748 30.043 -13.323 -26.319 1.00 0.00 H new ATOM 0 HG2 PRO A 748 28.729 -15.492 -27.933 1.00 0.00 H new ATOM 0 HG3 PRO A 748 30.115 -15.597 -26.866 1.00 0.00 H new ATOM 0 HD2 PRO A 748 27.658 -16.426 -26.068 1.00 0.00 H new ATOM 0 HD3 PRO A 748 28.790 -15.718 -24.932 1.00 0.00 H new ATOM 499 N SER A 749 25.955 -13.554 -27.857 1.00 0.00 N ATOM 500 CA SER A 749 24.993 -13.251 -28.908 1.00 0.00 C ATOM 501 C SER A 749 24.129 -12.050 -28.528 1.00 0.00 C ATOM 502 O SER A 749 23.473 -11.452 -29.384 1.00 0.00 O ATOM 503 CB SER A 749 24.113 -14.471 -29.191 1.00 0.00 C ATOM 504 OG SER A 749 23.190 -14.202 -30.231 1.00 0.00 O ATOM 0 H SER A 749 25.776 -14.431 -27.367 1.00 0.00 H new ATOM 0 HA SER A 749 25.546 -12.999 -29.813 1.00 0.00 H new ATOM 0 HB2 SER A 749 24.739 -15.319 -29.467 1.00 0.00 H new ATOM 0 HB3 SER A 749 23.575 -14.753 -28.286 1.00 0.00 H new ATOM 0 HG SER A 749 23.068 -13.233 -30.318 1.00 0.00 H new ATOM 510 N LEU A 750 24.114 -11.720 -27.241 1.00 0.00 N ATOM 511 CA LEU A 750 23.445 -10.516 -26.768 1.00 0.00 C ATOM 512 C LEU A 750 24.157 -9.282 -27.305 1.00 0.00 C ATOM 513 O LEU A 750 25.290 -8.995 -26.908 1.00 0.00 O ATOM 514 CB LEU A 750 23.445 -10.452 -25.241 1.00 0.00 C ATOM 515 CG LEU A 750 22.295 -11.168 -24.536 1.00 0.00 C ATOM 516 CD1 LEU A 750 22.404 -12.678 -24.692 1.00 0.00 C ATOM 517 CD2 LEU A 750 22.270 -10.771 -23.070 1.00 0.00 C ATOM 0 H LEU A 750 24.558 -12.271 -26.507 1.00 0.00 H new ATOM 0 HA LEU A 750 22.416 -10.544 -27.125 1.00 0.00 H new ATOM 0 HB2 LEU A 750 24.383 -10.873 -24.880 1.00 0.00 H new ATOM 0 HB3 LEU A 750 23.431 -9.404 -24.942 1.00 0.00 H new ATOM 0 HG LEU A 750 21.357 -10.864 -25.001 1.00 0.00 H new ATOM 0 HD11 LEU A 750 21.571 -13.158 -24.179 1.00 0.00 H new ATOM 0 HD12 LEU A 750 22.376 -12.937 -25.750 1.00 0.00 H new ATOM 0 HD13 LEU A 750 23.343 -13.022 -24.259 1.00 0.00 H new ATOM 0 HD21 LEU A 750 21.449 -11.283 -22.568 1.00 0.00 H new ATOM 0 HD22 LEU A 750 23.213 -11.052 -22.601 1.00 0.00 H new ATOM 0 HD23 LEU A 750 22.130 -9.693 -22.987 1.00 0.00 H new ATOM 529 N ASN A 751 23.514 -8.561 -28.211 1.00 0.00 N ATOM 530 CA ASN A 751 24.081 -7.315 -28.706 1.00 0.00 C ATOM 531 C ASN A 751 23.778 -6.183 -27.727 1.00 0.00 C ATOM 532 O ASN A 751 23.198 -6.419 -26.664 1.00 0.00 O ATOM 533 CB ASN A 751 23.594 -6.978 -30.130 1.00 0.00 C ATOM 534 CG ASN A 751 22.092 -7.110 -30.320 1.00 0.00 C ATOM 535 OD1 ASN A 751 21.599 -8.164 -30.721 1.00 0.00 O ATOM 536 ND2 ASN A 751 21.357 -6.037 -30.072 1.00 0.00 N ATOM 0 H ASN A 751 22.611 -8.812 -28.614 1.00 0.00 H new ATOM 0 HA ASN A 751 25.162 -7.439 -28.775 1.00 0.00 H new ATOM 0 HB2 ASN A 751 23.892 -5.958 -30.372 1.00 0.00 H new ATOM 0 HB3 ASN A 751 24.098 -7.634 -30.840 1.00 0.00 H new ATOM 0 HD21 ASN A 751 20.347 -6.067 -30.212 1.00 0.00 H new ATOM 0 HD22 ASN A 751 21.801 -5.180 -29.741 1.00 0.00 H new ATOM 543 N SER A 752 24.180 -4.964 -28.075 1.00 0.00 N ATOM 544 CA SER A 752 24.053 -3.814 -27.180 1.00 0.00 C ATOM 545 C SER A 752 22.645 -3.694 -26.593 1.00 0.00 C ATOM 546 O SER A 752 22.483 -3.543 -25.383 1.00 0.00 O ATOM 547 CB SER A 752 24.425 -2.540 -27.931 1.00 0.00 C ATOM 548 OG SER A 752 25.678 -2.693 -28.581 1.00 0.00 O ATOM 0 H SER A 752 24.600 -4.744 -28.978 1.00 0.00 H new ATOM 0 HA SER A 752 24.737 -3.962 -26.344 1.00 0.00 H new ATOM 0 HB2 SER A 752 23.654 -2.306 -28.665 1.00 0.00 H new ATOM 0 HB3 SER A 752 24.469 -1.701 -27.236 1.00 0.00 H new ATOM 0 HG SER A 752 26.401 -2.544 -27.937 1.00 0.00 H new ATOM 554 N HIS A 753 21.636 -3.781 -27.455 1.00 0.00 N ATOM 555 CA HIS A 753 20.240 -3.724 -27.025 1.00 0.00 C ATOM 556 C HIS A 753 19.928 -4.804 -25.991 1.00 0.00 C ATOM 557 O HIS A 753 19.317 -4.523 -24.960 1.00 0.00 O ATOM 558 CB HIS A 753 19.316 -3.880 -28.240 1.00 0.00 C ATOM 559 CG HIS A 753 17.862 -4.020 -27.897 1.00 0.00 C ATOM 560 ND1 HIS A 753 17.175 -5.213 -27.950 1.00 0.00 N ATOM 561 CD2 HIS A 753 16.960 -3.087 -27.496 1.00 0.00 C ATOM 562 CE1 HIS A 753 15.910 -4.979 -27.588 1.00 0.00 C ATOM 563 NE2 HIS A 753 15.725 -3.703 -27.301 1.00 0.00 N ATOM 0 H HIS A 753 21.759 -3.892 -28.461 1.00 0.00 H new ATOM 0 HA HIS A 753 20.070 -2.754 -26.557 1.00 0.00 H new ATOM 0 HB2 HIS A 753 19.442 -3.015 -28.891 1.00 0.00 H new ATOM 0 HB3 HIS A 753 19.629 -4.755 -28.809 1.00 0.00 H new ATOM 0 HD2 HIS A 753 17.167 -2.037 -27.352 1.00 0.00 H new ATOM 0 HE1 HIS A 753 15.140 -5.734 -27.537 1.00 0.00 H new ATOM 0 HE2 HIS A 753 14.857 -3.260 -26.999 1.00 0.00 H new ATOM 571 N ASP A 754 20.357 -6.027 -26.267 1.00 0.00 N ATOM 572 CA ASP A 754 20.048 -7.160 -25.401 1.00 0.00 C ATOM 573 C ASP A 754 20.705 -6.996 -24.045 1.00 0.00 C ATOM 574 O ASP A 754 20.069 -7.191 -23.008 1.00 0.00 O ATOM 575 CB ASP A 754 20.508 -8.472 -26.030 1.00 0.00 C ATOM 576 CG ASP A 754 19.920 -8.704 -27.402 1.00 0.00 C ATOM 577 OD1 ASP A 754 18.700 -8.491 -27.580 1.00 0.00 O ATOM 578 OD2 ASP A 754 20.683 -9.071 -28.313 1.00 0.00 O ATOM 0 H ASP A 754 20.921 -6.262 -27.084 1.00 0.00 H new ATOM 0 HA ASP A 754 18.966 -7.188 -25.274 1.00 0.00 H new ATOM 0 HB2 ASP A 754 21.596 -8.473 -26.101 1.00 0.00 H new ATOM 0 HB3 ASP A 754 20.231 -9.299 -25.377 1.00 0.00 H new ATOM 583 N ARG A 755 21.983 -6.633 -24.058 1.00 0.00 N ATOM 584 CA ARG A 755 22.718 -6.386 -22.827 1.00 0.00 C ATOM 585 C ARG A 755 22.047 -5.268 -22.046 1.00 0.00 C ATOM 586 O ARG A 755 21.834 -5.383 -20.845 1.00 0.00 O ATOM 587 CB ARG A 755 24.168 -6.006 -23.129 1.00 0.00 C ATOM 588 CG ARG A 755 24.891 -7.004 -24.013 1.00 0.00 C ATOM 589 CD ARG A 755 26.320 -6.561 -24.297 1.00 0.00 C ATOM 590 NE ARG A 755 26.975 -7.412 -25.290 1.00 0.00 N ATOM 591 CZ ARG A 755 27.955 -7.005 -26.103 1.00 0.00 C ATOM 592 NH1 ARG A 755 28.413 -5.761 -26.031 1.00 0.00 N ATOM 593 NH2 ARG A 755 28.477 -7.846 -26.988 1.00 0.00 N ATOM 0 H ARG A 755 22.530 -6.504 -24.909 1.00 0.00 H new ATOM 0 HA ARG A 755 22.716 -7.300 -22.233 1.00 0.00 H new ATOM 0 HB2 ARG A 755 24.185 -5.029 -23.611 1.00 0.00 H new ATOM 0 HB3 ARG A 755 24.711 -5.907 -22.189 1.00 0.00 H new ATOM 0 HG2 ARG A 755 24.901 -7.981 -23.529 1.00 0.00 H new ATOM 0 HG3 ARG A 755 24.350 -7.119 -24.953 1.00 0.00 H new ATOM 0 HD2 ARG A 755 26.315 -5.530 -24.651 1.00 0.00 H new ATOM 0 HD3 ARG A 755 26.895 -6.578 -23.371 1.00 0.00 H new ATOM 0 HE ARG A 755 26.663 -8.380 -25.367 1.00 0.00 H new ATOM 0 HH11 ARG A 755 28.017 -5.110 -25.353 1.00 0.00 H new ATOM 0 HH12 ARG A 755 29.161 -5.456 -26.654 1.00 0.00 H new ATOM 0 HH21 ARG A 755 28.130 -8.803 -27.048 1.00 0.00 H new ATOM 0 HH22 ARG A 755 29.225 -7.535 -27.608 1.00 0.00 H new ATOM 607 N LEU A 756 21.699 -4.200 -22.759 1.00 0.00 N ATOM 608 CA LEU A 756 21.029 -3.044 -22.169 1.00 0.00 C ATOM 609 C LEU A 756 19.762 -3.469 -21.438 1.00 0.00 C ATOM 610 O LEU A 756 19.507 -3.028 -20.314 1.00 0.00 O ATOM 611 CB LEU A 756 20.711 -2.027 -23.275 1.00 0.00 C ATOM 612 CG LEU A 756 20.052 -0.709 -22.849 1.00 0.00 C ATOM 613 CD1 LEU A 756 18.552 -0.871 -22.640 1.00 0.00 C ATOM 614 CD2 LEU A 756 20.716 -0.146 -21.601 1.00 0.00 C ATOM 0 H LEU A 756 21.873 -4.111 -23.760 1.00 0.00 H new ATOM 0 HA LEU A 756 21.689 -2.580 -21.436 1.00 0.00 H new ATOM 0 HB2 LEU A 756 21.641 -1.788 -23.791 1.00 0.00 H new ATOM 0 HB3 LEU A 756 20.058 -2.511 -24.001 1.00 0.00 H new ATOM 0 HG LEU A 756 20.194 0.003 -23.662 1.00 0.00 H new ATOM 0 HD11 LEU A 756 18.121 0.084 -22.339 1.00 0.00 H new ATOM 0 HD12 LEU A 756 18.089 -1.201 -23.570 1.00 0.00 H new ATOM 0 HD13 LEU A 756 18.371 -1.612 -21.861 1.00 0.00 H new ATOM 0 HD21 LEU A 756 20.230 0.788 -21.320 1.00 0.00 H new ATOM 0 HD22 LEU A 756 20.624 -0.863 -20.785 1.00 0.00 H new ATOM 0 HD23 LEU A 756 21.771 0.040 -21.803 1.00 0.00 H new ATOM 626 N ARG A 757 18.969 -4.318 -22.083 1.00 0.00 N ATOM 627 CA ARG A 757 17.759 -4.842 -21.466 1.00 0.00 C ATOM 628 C ARG A 757 18.098 -5.489 -20.129 1.00 0.00 C ATOM 629 O ARG A 757 17.490 -5.176 -19.108 1.00 0.00 O ATOM 630 CB ARG A 757 17.074 -5.869 -22.375 1.00 0.00 C ATOM 631 CG ARG A 757 16.557 -5.297 -23.687 1.00 0.00 C ATOM 632 CD ARG A 757 15.454 -4.271 -23.463 1.00 0.00 C ATOM 633 NE ARG A 757 14.250 -4.863 -22.880 1.00 0.00 N ATOM 634 CZ ARG A 757 13.198 -4.156 -22.468 1.00 0.00 C ATOM 635 NH1 ARG A 757 13.187 -2.833 -22.593 1.00 0.00 N ATOM 636 NH2 ARG A 757 12.144 -4.778 -21.963 1.00 0.00 N ATOM 0 H ARG A 757 19.143 -4.656 -23.030 1.00 0.00 H new ATOM 0 HA ARG A 757 17.072 -4.010 -21.308 1.00 0.00 H new ATOM 0 HB2 ARG A 757 17.779 -6.670 -22.594 1.00 0.00 H new ATOM 0 HB3 ARG A 757 16.241 -6.317 -21.834 1.00 0.00 H new ATOM 0 HG2 ARG A 757 17.380 -4.833 -24.230 1.00 0.00 H new ATOM 0 HG3 ARG A 757 16.179 -6.106 -24.312 1.00 0.00 H new ATOM 0 HD2 ARG A 757 15.823 -3.483 -22.806 1.00 0.00 H new ATOM 0 HD3 ARG A 757 15.201 -3.801 -24.413 1.00 0.00 H new ATOM 0 HE ARG A 757 14.213 -5.878 -22.783 1.00 0.00 H new ATOM 0 HH11 ARG A 757 13.987 -2.353 -23.006 1.00 0.00 H new ATOM 0 HH12 ARG A 757 12.379 -2.297 -22.276 1.00 0.00 H new ATOM 0 HH21 ARG A 757 12.139 -5.795 -21.890 1.00 0.00 H new ATOM 0 HH22 ARG A 757 11.337 -4.240 -21.647 1.00 0.00 H new ATOM 650 N VAL A 758 19.096 -6.367 -20.145 1.00 0.00 N ATOM 651 CA VAL A 758 19.546 -7.048 -18.936 1.00 0.00 C ATOM 652 C VAL A 758 20.009 -6.044 -17.882 1.00 0.00 C ATOM 653 O VAL A 758 19.608 -6.131 -16.720 1.00 0.00 O ATOM 654 CB VAL A 758 20.694 -8.036 -19.234 1.00 0.00 C ATOM 655 CG1 VAL A 758 21.161 -8.724 -17.960 1.00 0.00 C ATOM 656 CG2 VAL A 758 20.261 -9.066 -20.261 1.00 0.00 C ATOM 0 H VAL A 758 19.611 -6.625 -20.987 1.00 0.00 H new ATOM 0 HA VAL A 758 18.693 -7.607 -18.553 1.00 0.00 H new ATOM 0 HB VAL A 758 21.529 -7.468 -19.643 1.00 0.00 H new ATOM 0 HG11 VAL A 758 21.970 -9.415 -18.195 1.00 0.00 H new ATOM 0 HG12 VAL A 758 21.517 -7.976 -17.252 1.00 0.00 H new ATOM 0 HG13 VAL A 758 20.330 -9.275 -17.518 1.00 0.00 H new ATOM 0 HG21 VAL A 758 21.084 -9.753 -20.457 1.00 0.00 H new ATOM 0 HG22 VAL A 758 19.406 -9.624 -19.879 1.00 0.00 H new ATOM 0 HG23 VAL A 758 19.981 -8.562 -21.186 1.00 0.00 H new ATOM 666 N HIS A 759 20.842 -5.089 -18.297 1.00 0.00 N ATOM 667 CA HIS A 759 21.355 -4.065 -17.389 1.00 0.00 C ATOM 668 C HIS A 759 20.214 -3.340 -16.689 1.00 0.00 C ATOM 669 O HIS A 759 20.124 -3.355 -15.465 1.00 0.00 O ATOM 670 CB HIS A 759 22.225 -3.040 -18.129 1.00 0.00 C ATOM 671 CG HIS A 759 23.557 -3.557 -18.579 1.00 0.00 C ATOM 672 ND1 HIS A 759 24.526 -3.916 -17.679 1.00 0.00 N ATOM 673 CD2 HIS A 759 24.038 -3.722 -19.834 1.00 0.00 C ATOM 674 CE1 HIS A 759 25.566 -4.290 -18.390 1.00 0.00 C ATOM 675 NE2 HIS A 759 25.325 -4.189 -19.706 1.00 0.00 N ATOM 0 H HIS A 759 21.176 -5.004 -19.257 1.00 0.00 H new ATOM 0 HA HIS A 759 21.970 -4.576 -16.648 1.00 0.00 H new ATOM 0 HB2 HIS A 759 21.677 -2.680 -19.000 1.00 0.00 H new ATOM 0 HB3 HIS A 759 22.385 -2.182 -17.477 1.00 0.00 H new ATOM 0 HD2 HIS A 759 23.513 -3.525 -20.757 1.00 0.00 H new ATOM 0 HE1 HIS A 759 26.498 -4.635 -17.968 1.00 0.00 H new ATOM 0 HE2 HIS A 759 25.970 -4.414 -20.463 1.00 0.00 H new ATOM 683 N GLN A 760 19.333 -2.724 -17.469 1.00 0.00 N ATOM 684 CA GLN A 760 18.226 -1.950 -16.914 1.00 0.00 C ATOM 685 C GLN A 760 17.305 -2.801 -16.041 1.00 0.00 C ATOM 686 O GLN A 760 16.787 -2.325 -15.028 1.00 0.00 O ATOM 687 CB GLN A 760 17.426 -1.285 -18.029 1.00 0.00 C ATOM 688 CG GLN A 760 18.090 -0.032 -18.574 1.00 0.00 C ATOM 689 CD GLN A 760 17.198 0.735 -19.536 1.00 0.00 C ATOM 690 OE1 GLN A 760 15.974 0.680 -19.445 1.00 0.00 O ATOM 691 NE2 GLN A 760 17.804 1.478 -20.448 1.00 0.00 N ATOM 0 H GLN A 760 19.363 -2.745 -18.488 1.00 0.00 H new ATOM 0 HA GLN A 760 18.662 -1.181 -16.276 1.00 0.00 H new ATOM 0 HB2 GLN A 760 17.286 -1.997 -18.842 1.00 0.00 H new ATOM 0 HB3 GLN A 760 16.435 -1.030 -17.654 1.00 0.00 H new ATOM 0 HG2 GLN A 760 18.365 0.618 -17.744 1.00 0.00 H new ATOM 0 HG3 GLN A 760 19.014 -0.308 -19.083 1.00 0.00 H new ATOM 0 HE21 GLN A 760 18.823 1.499 -20.494 1.00 0.00 H new ATOM 0 HE22 GLN A 760 17.252 2.030 -21.105 1.00 0.00 H new ATOM 700 N ILE A 761 17.101 -4.051 -16.426 1.00 0.00 N ATOM 701 CA ILE A 761 16.249 -4.947 -15.655 1.00 0.00 C ATOM 702 C ILE A 761 16.914 -5.339 -14.332 1.00 0.00 C ATOM 703 O ILE A 761 16.298 -5.240 -13.273 1.00 0.00 O ATOM 704 CB ILE A 761 15.868 -6.209 -16.462 1.00 0.00 C ATOM 705 CG1 ILE A 761 14.948 -5.825 -17.626 1.00 0.00 C ATOM 706 CG2 ILE A 761 15.196 -7.243 -15.568 1.00 0.00 C ATOM 707 CD1 ILE A 761 14.658 -6.967 -18.575 1.00 0.00 C ATOM 0 H ILE A 761 17.510 -4.468 -17.262 1.00 0.00 H new ATOM 0 HA ILE A 761 15.331 -4.403 -15.432 1.00 0.00 H new ATOM 0 HB ILE A 761 16.779 -6.654 -16.863 1.00 0.00 H new ATOM 0 HG12 ILE A 761 14.007 -5.450 -17.225 1.00 0.00 H new ATOM 0 HG13 ILE A 761 15.405 -5.008 -18.184 1.00 0.00 H new ATOM 0 HG21 ILE A 761 14.937 -8.122 -16.159 1.00 0.00 H new ATOM 0 HG22 ILE A 761 15.879 -7.531 -14.769 1.00 0.00 H new ATOM 0 HG23 ILE A 761 14.290 -6.817 -15.136 1.00 0.00 H new ATOM 0 HD11 ILE A 761 14.001 -6.620 -19.372 1.00 0.00 H new ATOM 0 HD12 ILE A 761 15.592 -7.328 -19.006 1.00 0.00 H new ATOM 0 HD13 ILE A 761 14.172 -7.777 -18.032 1.00 0.00 H new ATOM 719 N ALA A 762 18.175 -5.751 -14.387 1.00 0.00 N ATOM 720 CA ALA A 762 18.907 -6.130 -13.184 1.00 0.00 C ATOM 721 C ALA A 762 19.100 -4.919 -12.280 1.00 0.00 C ATOM 722 O ALA A 762 19.071 -5.027 -11.055 1.00 0.00 O ATOM 723 CB ALA A 762 20.247 -6.754 -13.550 1.00 0.00 C ATOM 0 H ALA A 762 18.712 -5.831 -15.251 1.00 0.00 H new ATOM 0 HA ALA A 762 18.325 -6.874 -12.640 1.00 0.00 H new ATOM 0 HB1 ALA A 762 20.780 -7.031 -12.640 1.00 0.00 H new ATOM 0 HB2 ALA A 762 20.080 -7.643 -14.158 1.00 0.00 H new ATOM 0 HB3 ALA A 762 20.841 -6.035 -14.114 1.00 0.00 H new ATOM 729 N GLU A 763 19.272 -3.764 -12.907 1.00 0.00 N ATOM 730 CA GLU A 763 19.393 -2.497 -12.205 1.00 0.00 C ATOM 731 C GLU A 763 18.100 -2.184 -11.452 1.00 0.00 C ATOM 732 O GLU A 763 18.128 -1.666 -10.335 1.00 0.00 O ATOM 733 CB GLU A 763 19.719 -1.398 -13.221 1.00 0.00 C ATOM 734 CG GLU A 763 20.050 -0.044 -12.621 1.00 0.00 C ATOM 735 CD GLU A 763 20.647 0.898 -13.650 1.00 0.00 C ATOM 736 OE1 GLU A 763 19.891 1.425 -14.494 1.00 0.00 O ATOM 737 OE2 GLU A 763 21.882 1.100 -13.636 1.00 0.00 O ATOM 0 H GLU A 763 19.332 -3.681 -13.922 1.00 0.00 H new ATOM 0 HA GLU A 763 20.197 -2.554 -11.471 1.00 0.00 H new ATOM 0 HB2 GLU A 763 20.563 -1.725 -13.828 1.00 0.00 H new ATOM 0 HB3 GLU A 763 18.869 -1.282 -13.893 1.00 0.00 H new ATOM 0 HG2 GLU A 763 19.146 0.399 -12.204 1.00 0.00 H new ATOM 0 HG3 GLU A 763 20.751 -0.173 -11.797 1.00 0.00 H new ATOM 744 N GLU A 764 16.970 -2.529 -12.062 1.00 0.00 N ATOM 745 CA GLU A 764 15.668 -2.327 -11.439 1.00 0.00 C ATOM 746 C GLU A 764 15.441 -3.350 -10.326 1.00 0.00 C ATOM 747 O GLU A 764 14.895 -3.028 -9.269 1.00 0.00 O ATOM 748 CB GLU A 764 14.556 -2.435 -12.484 1.00 0.00 C ATOM 749 CG GLU A 764 13.171 -2.137 -11.934 1.00 0.00 C ATOM 750 CD GLU A 764 13.003 -0.687 -11.528 1.00 0.00 C ATOM 751 OE1 GLU A 764 13.662 -0.249 -10.561 1.00 0.00 O ATOM 752 OE2 GLU A 764 12.199 0.020 -12.168 1.00 0.00 O ATOM 0 H GLU A 764 16.931 -2.951 -12.990 1.00 0.00 H new ATOM 0 HA GLU A 764 15.648 -1.328 -11.004 1.00 0.00 H new ATOM 0 HB2 GLU A 764 14.769 -1.746 -13.301 1.00 0.00 H new ATOM 0 HB3 GLU A 764 14.562 -3.440 -12.905 1.00 0.00 H new ATOM 0 HG2 GLU A 764 12.424 -2.388 -12.687 1.00 0.00 H new ATOM 0 HG3 GLU A 764 12.982 -2.776 -11.071 1.00 0.00 H new ATOM 759 N HIS A 765 15.868 -4.581 -10.570 1.00 0.00 N ATOM 760 CA HIS A 765 15.727 -5.653 -9.588 1.00 0.00 C ATOM 761 C HIS A 765 16.647 -5.435 -8.392 1.00 0.00 C ATOM 762 O HIS A 765 16.406 -5.966 -7.311 1.00 0.00 O ATOM 763 CB HIS A 765 16.024 -7.012 -10.227 1.00 0.00 C ATOM 764 CG HIS A 765 14.903 -7.546 -11.066 1.00 0.00 C ATOM 765 ND1 HIS A 765 14.547 -8.874 -11.105 1.00 0.00 N ATOM 766 CD2 HIS A 765 14.056 -6.908 -11.913 1.00 0.00 C ATOM 767 CE1 HIS A 765 13.520 -9.002 -11.955 1.00 0.00 C ATOM 768 NE2 HIS A 765 13.183 -7.837 -12.471 1.00 0.00 N ATOM 0 H HIS A 765 16.316 -4.865 -11.441 1.00 0.00 H new ATOM 0 HA HIS A 765 14.696 -5.641 -9.236 1.00 0.00 H new ATOM 0 HB2 HIS A 765 16.918 -6.924 -10.845 1.00 0.00 H new ATOM 0 HB3 HIS A 765 16.250 -7.731 -9.440 1.00 0.00 H new ATOM 0 HD1 HIS A 765 14.988 -9.629 -10.579 1.00 0.00 H new ATOM 0 HD2 HIS A 765 14.059 -5.848 -12.121 1.00 0.00 H new ATOM 0 HE1 HIS A 765 13.032 -9.937 -12.187 1.00 0.00 H new ATOM 776 N GLY A 766 17.701 -4.653 -8.594 1.00 0.00 N ATOM 777 CA GLY A 766 18.629 -4.363 -7.518 1.00 0.00 C ATOM 778 C GLY A 766 19.749 -5.379 -7.442 1.00 0.00 C ATOM 779 O GLY A 766 20.373 -5.560 -6.395 1.00 0.00 O ATOM 0 H GLY A 766 17.930 -4.214 -9.486 1.00 0.00 H new ATOM 0 HA2 GLY A 766 19.051 -3.369 -7.662 1.00 0.00 H new ATOM 0 HA3 GLY A 766 18.091 -4.346 -6.570 1.00 0.00 H new ATOM 783 N LEU A 767 20.012 -6.039 -8.559 1.00 0.00 N ATOM 784 CA LEU A 767 21.048 -7.055 -8.622 1.00 0.00 C ATOM 785 C LEU A 767 22.360 -6.438 -9.087 1.00 0.00 C ATOM 786 O LEU A 767 22.437 -5.233 -9.329 1.00 0.00 O ATOM 787 CB LEU A 767 20.635 -8.178 -9.575 1.00 0.00 C ATOM 788 CG LEU A 767 19.292 -8.845 -9.261 1.00 0.00 C ATOM 789 CD1 LEU A 767 18.954 -9.879 -10.325 1.00 0.00 C ATOM 790 CD2 LEU A 767 19.320 -9.490 -7.882 1.00 0.00 C ATOM 0 H LEU A 767 19.518 -5.887 -9.439 1.00 0.00 H new ATOM 0 HA LEU A 767 21.185 -7.473 -7.625 1.00 0.00 H new ATOM 0 HB2 LEU A 767 20.594 -7.776 -10.587 1.00 0.00 H new ATOM 0 HB3 LEU A 767 21.412 -8.943 -9.567 1.00 0.00 H new ATOM 0 HG LEU A 767 18.518 -8.077 -9.263 1.00 0.00 H new ATOM 0 HD11 LEU A 767 17.997 -10.345 -10.089 1.00 0.00 H new ATOM 0 HD12 LEU A 767 18.890 -9.392 -11.298 1.00 0.00 H new ATOM 0 HD13 LEU A 767 19.732 -10.642 -10.351 1.00 0.00 H new ATOM 0 HD21 LEU A 767 18.356 -9.958 -7.679 1.00 0.00 H new ATOM 0 HD22 LEU A 767 20.104 -10.246 -7.850 1.00 0.00 H new ATOM 0 HD23 LEU A 767 19.519 -8.728 -7.128 1.00 0.00 H new ATOM 802 N ARG A 768 23.391 -7.262 -9.201 1.00 0.00 N ATOM 803 CA ARG A 768 24.680 -6.803 -9.689 1.00 0.00 C ATOM 804 C ARG A 768 24.879 -7.280 -11.120 1.00 0.00 C ATOM 805 O ARG A 768 24.727 -8.462 -11.408 1.00 0.00 O ATOM 806 CB ARG A 768 25.809 -7.322 -8.795 1.00 0.00 C ATOM 807 CG ARG A 768 27.188 -6.830 -9.206 1.00 0.00 C ATOM 808 CD ARG A 768 28.259 -7.253 -8.211 1.00 0.00 C ATOM 809 NE ARG A 768 28.424 -8.706 -8.147 1.00 0.00 N ATOM 810 CZ ARG A 768 29.210 -9.325 -7.264 1.00 0.00 C ATOM 811 NH1 ARG A 768 29.871 -8.622 -6.350 1.00 0.00 N ATOM 812 NH2 ARG A 768 29.323 -10.648 -7.285 1.00 0.00 N ATOM 0 H ARG A 768 23.358 -8.253 -8.961 1.00 0.00 H new ATOM 0 HA ARG A 768 24.701 -5.713 -9.666 1.00 0.00 H new ATOM 0 HB2 ARG A 768 25.616 -7.017 -7.766 1.00 0.00 H new ATOM 0 HB3 ARG A 768 25.802 -8.412 -8.811 1.00 0.00 H new ATOM 0 HG2 ARG A 768 27.434 -7.221 -10.193 1.00 0.00 H new ATOM 0 HG3 ARG A 768 27.177 -5.743 -9.288 1.00 0.00 H new ATOM 0 HD2 ARG A 768 29.209 -6.795 -8.488 1.00 0.00 H new ATOM 0 HD3 ARG A 768 28.000 -6.876 -7.222 1.00 0.00 H new ATOM 0 HE ARG A 768 27.909 -9.278 -8.816 1.00 0.00 H new ATOM 0 HH11 ARG A 768 29.778 -7.607 -6.322 1.00 0.00 H new ATOM 0 HH12 ARG A 768 30.471 -9.098 -5.676 1.00 0.00 H new ATOM 0 HH21 ARG A 768 28.808 -11.193 -7.977 1.00 0.00 H new ATOM 0 HH22 ARG A 768 29.924 -11.119 -6.609 1.00 0.00 H new ATOM 826 N HIS A 769 25.209 -6.364 -12.011 1.00 0.00 N ATOM 827 CA HIS A 769 25.359 -6.693 -13.421 1.00 0.00 C ATOM 828 C HIS A 769 26.614 -6.055 -13.990 1.00 0.00 C ATOM 829 O HIS A 769 26.863 -4.866 -13.799 1.00 0.00 O ATOM 830 CB HIS A 769 24.118 -6.261 -14.222 1.00 0.00 C ATOM 831 CG HIS A 769 23.617 -4.879 -13.899 1.00 0.00 C ATOM 832 ND1 HIS A 769 23.750 -3.843 -14.786 1.00 0.00 N ATOM 833 CD2 HIS A 769 22.975 -4.432 -12.792 1.00 0.00 C ATOM 834 CE1 HIS A 769 23.193 -2.798 -14.209 1.00 0.00 C ATOM 835 NE2 HIS A 769 22.710 -3.103 -12.997 1.00 0.00 N ATOM 0 H HIS A 769 25.379 -5.384 -11.785 1.00 0.00 H new ATOM 0 HA HIS A 769 25.456 -7.775 -13.507 1.00 0.00 H new ATOM 0 HB2 HIS A 769 24.352 -6.309 -15.285 1.00 0.00 H new ATOM 0 HB3 HIS A 769 23.316 -6.976 -14.039 1.00 0.00 H new ATOM 0 HD1 HIS A 769 24.190 -3.875 -15.705 1.00 0.00 H new ATOM 0 HD2 HIS A 769 22.721 -5.012 -11.917 1.00 0.00 H new ATOM 0 HE1 HIS A 769 23.133 -1.817 -14.657 1.00 0.00 H new ATOM 843 N ASP A 770 27.417 -6.859 -14.666 1.00 0.00 N ATOM 844 CA ASP A 770 28.663 -6.378 -15.236 1.00 0.00 C ATOM 845 C ASP A 770 28.995 -7.149 -16.502 1.00 0.00 C ATOM 846 O ASP A 770 28.537 -8.277 -16.691 1.00 0.00 O ATOM 847 CB ASP A 770 29.797 -6.508 -14.216 1.00 0.00 C ATOM 848 CG ASP A 770 31.029 -5.728 -14.618 1.00 0.00 C ATOM 849 OD1 ASP A 770 31.050 -4.496 -14.410 1.00 0.00 O ATOM 850 OD2 ASP A 770 31.979 -6.332 -15.141 1.00 0.00 O ATOM 0 H ASP A 770 27.228 -7.847 -14.833 1.00 0.00 H new ATOM 0 HA ASP A 770 28.547 -5.325 -15.493 1.00 0.00 H new ATOM 0 HB2 ASP A 770 29.450 -6.157 -13.244 1.00 0.00 H new ATOM 0 HB3 ASP A 770 30.058 -7.560 -14.100 1.00 0.00 H new ATOM 855 N SER A 771 29.775 -6.534 -17.371 1.00 0.00 N ATOM 856 CA SER A 771 30.117 -7.139 -18.640 1.00 0.00 C ATOM 857 C SER A 771 31.541 -7.680 -18.613 1.00 0.00 C ATOM 858 O SER A 771 32.418 -7.118 -17.962 1.00 0.00 O ATOM 859 CB SER A 771 29.967 -6.114 -19.759 1.00 0.00 C ATOM 860 OG SER A 771 28.691 -5.496 -19.721 1.00 0.00 O ATOM 0 H SER A 771 30.184 -5.612 -17.218 1.00 0.00 H new ATOM 0 HA SER A 771 29.438 -7.972 -18.822 1.00 0.00 H new ATOM 0 HB2 SER A 771 30.744 -5.355 -19.667 1.00 0.00 H new ATOM 0 HB3 SER A 771 30.109 -6.601 -20.724 1.00 0.00 H new ATOM 0 HG SER A 771 28.561 -4.964 -20.534 1.00 0.00 H new ATOM 866 N SER A 772 31.769 -8.765 -19.321 1.00 0.00 N ATOM 867 CA SER A 772 33.088 -9.363 -19.384 1.00 0.00 C ATOM 868 C SER A 772 33.430 -9.704 -20.826 1.00 0.00 C ATOM 869 O SER A 772 32.552 -10.048 -21.611 1.00 0.00 O ATOM 870 CB SER A 772 33.144 -10.613 -18.504 1.00 0.00 C ATOM 871 OG SER A 772 34.461 -11.130 -18.417 1.00 0.00 O ATOM 0 H SER A 772 31.056 -9.254 -19.863 1.00 0.00 H new ATOM 0 HA SER A 772 33.823 -8.650 -19.010 1.00 0.00 H new ATOM 0 HB2 SER A 772 32.780 -10.372 -17.505 1.00 0.00 H new ATOM 0 HB3 SER A 772 32.479 -11.375 -18.910 1.00 0.00 H new ATOM 0 HG SER A 772 34.463 -11.927 -17.847 1.00 0.00 H new ATOM 877 N GLY A 773 34.697 -9.585 -21.173 1.00 0.00 N ATOM 878 CA GLY A 773 35.115 -9.851 -22.532 1.00 0.00 C ATOM 879 C GLY A 773 35.282 -8.576 -23.327 1.00 0.00 C ATOM 880 O GLY A 773 35.147 -7.477 -22.787 1.00 0.00 O ATOM 0 H GLY A 773 35.447 -9.309 -20.539 1.00 0.00 H new ATOM 0 HA2 GLY A 773 36.057 -10.399 -22.522 1.00 0.00 H new ATOM 0 HA3 GLY A 773 34.379 -10.490 -23.020 1.00 0.00 H new ATOM 884 N GLU A 774 35.561 -8.716 -24.613 1.00 0.00 N ATOM 885 CA GLU A 774 35.828 -7.564 -25.462 1.00 0.00 C ATOM 886 C GLU A 774 35.107 -7.687 -26.799 1.00 0.00 C ATOM 887 O GLU A 774 35.148 -8.741 -27.436 1.00 0.00 O ATOM 888 CB GLU A 774 37.331 -7.434 -25.709 1.00 0.00 C ATOM 889 CG GLU A 774 38.149 -7.208 -24.446 1.00 0.00 C ATOM 890 CD GLU A 774 39.638 -7.299 -24.697 1.00 0.00 C ATOM 891 OE1 GLU A 774 40.156 -8.429 -24.801 1.00 0.00 O ATOM 892 OE2 GLU A 774 40.300 -6.243 -24.783 1.00 0.00 O ATOM 0 H GLU A 774 35.609 -9.615 -25.092 1.00 0.00 H new ATOM 0 HA GLU A 774 35.460 -6.676 -24.948 1.00 0.00 H new ATOM 0 HB2 GLU A 774 37.687 -8.338 -26.203 1.00 0.00 H new ATOM 0 HB3 GLU A 774 37.506 -6.606 -26.396 1.00 0.00 H new ATOM 0 HG2 GLU A 774 37.912 -6.227 -24.034 1.00 0.00 H new ATOM 0 HG3 GLU A 774 37.864 -7.946 -23.696 1.00 0.00 H new ATOM 899 N GLY A 775 34.442 -6.608 -27.205 1.00 0.00 N ATOM 900 CA GLY A 775 33.822 -6.545 -28.521 1.00 0.00 C ATOM 901 C GLY A 775 32.721 -7.569 -28.719 1.00 0.00 C ATOM 902 O GLY A 775 31.698 -7.537 -28.030 1.00 0.00 O ATOM 0 H GLY A 775 34.320 -5.767 -26.640 1.00 0.00 H new ATOM 0 HA2 GLY A 775 33.411 -5.547 -28.673 1.00 0.00 H new ATOM 0 HA3 GLY A 775 34.588 -6.694 -29.282 1.00 0.00 H new ATOM 906 N LYS A 776 32.932 -8.484 -29.659 1.00 0.00 N ATOM 907 CA LYS A 776 31.934 -9.502 -29.971 1.00 0.00 C ATOM 908 C LYS A 776 32.025 -10.666 -28.997 1.00 0.00 C ATOM 909 O LYS A 776 31.109 -11.481 -28.901 1.00 0.00 O ATOM 910 CB LYS A 776 32.094 -10.002 -31.405 1.00 0.00 C ATOM 911 CG LYS A 776 31.720 -8.965 -32.451 1.00 0.00 C ATOM 912 CD LYS A 776 31.729 -9.559 -33.846 1.00 0.00 C ATOM 913 CE LYS A 776 31.210 -8.570 -34.874 1.00 0.00 C ATOM 914 NZ LYS A 776 31.134 -9.170 -36.231 1.00 0.00 N ATOM 0 H LYS A 776 33.783 -8.542 -30.218 1.00 0.00 H new ATOM 0 HA LYS A 776 30.950 -9.043 -29.873 1.00 0.00 H new ATOM 0 HB2 LYS A 776 33.128 -10.309 -31.562 1.00 0.00 H new ATOM 0 HB3 LYS A 776 31.474 -10.888 -31.544 1.00 0.00 H new ATOM 0 HG2 LYS A 776 30.731 -8.564 -32.231 1.00 0.00 H new ATOM 0 HG3 LYS A 776 32.420 -8.130 -32.405 1.00 0.00 H new ATOM 0 HD2 LYS A 776 32.743 -9.860 -34.108 1.00 0.00 H new ATOM 0 HD3 LYS A 776 31.115 -10.460 -33.863 1.00 0.00 H new ATOM 0 HE2 LYS A 776 30.221 -8.221 -34.575 1.00 0.00 H new ATOM 0 HE3 LYS A 776 31.862 -7.697 -34.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 776 30.775 -8.463 -36.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 776 32.082 -9.480 -36.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 776 30.492 -9.988 -36.213 1.00 0.00 H new ATOM 928 N ARG A 777 33.134 -10.735 -28.275 1.00 0.00 N ATOM 929 CA ARG A 777 33.310 -11.745 -27.243 1.00 0.00 C ATOM 930 C ARG A 777 32.950 -11.163 -25.886 1.00 0.00 C ATOM 931 O ARG A 777 33.237 -11.751 -24.847 1.00 0.00 O ATOM 932 CB ARG A 777 34.748 -12.279 -27.241 1.00 0.00 C ATOM 933 CG ARG A 777 35.072 -13.112 -28.469 1.00 0.00 C ATOM 934 CD ARG A 777 36.455 -13.738 -28.381 1.00 0.00 C ATOM 935 NE ARG A 777 36.691 -14.676 -29.480 1.00 0.00 N ATOM 936 CZ ARG A 777 37.568 -15.676 -29.440 1.00 0.00 C ATOM 937 NH1 ARG A 777 38.345 -15.851 -28.379 1.00 0.00 N ATOM 938 NH2 ARG A 777 37.673 -16.498 -30.474 1.00 0.00 N ATOM 0 H ARG A 777 33.926 -10.102 -28.386 1.00 0.00 H new ATOM 0 HA ARG A 777 32.645 -12.582 -27.455 1.00 0.00 H new ATOM 0 HB2 ARG A 777 35.441 -11.440 -27.184 1.00 0.00 H new ATOM 0 HB3 ARG A 777 34.905 -12.883 -26.347 1.00 0.00 H new ATOM 0 HG2 ARG A 777 34.325 -13.897 -28.582 1.00 0.00 H new ATOM 0 HG3 ARG A 777 35.013 -12.485 -29.359 1.00 0.00 H new ATOM 0 HD2 ARG A 777 37.212 -12.954 -28.402 1.00 0.00 H new ATOM 0 HD3 ARG A 777 36.560 -14.258 -27.429 1.00 0.00 H new ATOM 0 HE ARG A 777 36.146 -14.555 -30.334 1.00 0.00 H new ATOM 0 HH11 ARG A 777 38.273 -15.216 -27.584 1.00 0.00 H new ATOM 0 HH12 ARG A 777 39.014 -16.621 -28.358 1.00 0.00 H new ATOM 0 HH21 ARG A 777 37.083 -16.363 -31.295 1.00 0.00 H new ATOM 0 HH22 ARG A 777 38.344 -17.266 -30.449 1.00 0.00 H new ATOM 952 N ARG A 778 32.323 -9.995 -25.912 1.00 0.00 N ATOM 953 CA ARG A 778 31.848 -9.357 -24.700 1.00 0.00 C ATOM 954 C ARG A 778 30.467 -9.878 -24.341 1.00 0.00 C ATOM 955 O ARG A 778 29.516 -9.757 -25.115 1.00 0.00 O ATOM 956 CB ARG A 778 31.810 -7.842 -24.879 1.00 0.00 C ATOM 957 CG ARG A 778 31.266 -7.086 -23.674 1.00 0.00 C ATOM 958 CD ARG A 778 31.308 -5.588 -23.910 1.00 0.00 C ATOM 959 NE ARG A 778 30.714 -4.827 -22.810 1.00 0.00 N ATOM 960 CZ ARG A 778 31.007 -3.550 -22.551 1.00 0.00 C ATOM 961 NH1 ARG A 778 31.893 -2.905 -23.302 1.00 0.00 N ATOM 962 NH2 ARG A 778 30.418 -2.924 -21.537 1.00 0.00 N ATOM 0 H ARG A 778 32.133 -9.471 -26.766 1.00 0.00 H new ATOM 0 HA ARG A 778 32.535 -9.595 -23.888 1.00 0.00 H new ATOM 0 HB2 ARG A 778 32.818 -7.487 -25.092 1.00 0.00 H new ATOM 0 HB3 ARG A 778 31.198 -7.605 -25.749 1.00 0.00 H new ATOM 0 HG2 ARG A 778 30.241 -7.398 -23.476 1.00 0.00 H new ATOM 0 HG3 ARG A 778 31.851 -7.335 -22.789 1.00 0.00 H new ATOM 0 HD2 ARG A 778 32.343 -5.274 -24.046 1.00 0.00 H new ATOM 0 HD3 ARG A 778 30.780 -5.355 -24.835 1.00 0.00 H new ATOM 0 HE ARG A 778 30.039 -5.298 -22.208 1.00 0.00 H new ATOM 0 HH11 ARG A 778 32.350 -3.385 -24.077 1.00 0.00 H new ATOM 0 HH12 ARG A 778 32.116 -1.930 -23.103 1.00 0.00 H new ATOM 0 HH21 ARG A 778 29.742 -3.419 -20.956 1.00 0.00 H new ATOM 0 HH22 ARG A 778 30.643 -1.949 -21.340 1.00 0.00 H new ATOM 976 N PHE A 779 30.371 -10.457 -23.165 1.00 0.00 N ATOM 977 CA PHE A 779 29.115 -10.974 -22.658 1.00 0.00 C ATOM 978 C PHE A 779 28.770 -10.276 -21.349 1.00 0.00 C ATOM 979 O PHE A 779 29.532 -9.434 -20.871 1.00 0.00 O ATOM 980 CB PHE A 779 29.193 -12.497 -22.469 1.00 0.00 C ATOM 981 CG PHE A 779 30.319 -12.964 -21.584 1.00 0.00 C ATOM 982 CD1 PHE A 779 31.585 -13.173 -22.110 1.00 0.00 C ATOM 983 CD2 PHE A 779 30.113 -13.199 -20.234 1.00 0.00 C ATOM 984 CE1 PHE A 779 32.621 -13.607 -21.308 1.00 0.00 C ATOM 985 CE2 PHE A 779 31.146 -13.634 -19.427 1.00 0.00 C ATOM 986 CZ PHE A 779 32.403 -13.837 -19.965 1.00 0.00 C ATOM 0 H PHE A 779 31.160 -10.584 -22.531 1.00 0.00 H new ATOM 0 HA PHE A 779 28.325 -10.772 -23.382 1.00 0.00 H new ATOM 0 HB2 PHE A 779 28.250 -12.846 -22.049 1.00 0.00 H new ATOM 0 HB3 PHE A 779 29.299 -12.966 -23.447 1.00 0.00 H new ATOM 0 HD1 PHE A 779 31.762 -12.994 -23.160 1.00 0.00 H new ATOM 0 HD2 PHE A 779 29.133 -13.040 -19.808 1.00 0.00 H new ATOM 0 HE1 PHE A 779 33.602 -13.766 -21.731 1.00 0.00 H new ATOM 0 HE2 PHE A 779 30.972 -13.815 -18.377 1.00 0.00 H new ATOM 0 HZ PHE A 779 33.213 -14.175 -19.335 1.00 0.00 H new ATOM 996 N ILE A 780 27.633 -10.613 -20.770 1.00 0.00 N ATOM 997 CA ILE A 780 27.209 -9.972 -19.537 1.00 0.00 C ATOM 998 C ILE A 780 26.922 -11.012 -18.461 1.00 0.00 C ATOM 999 O ILE A 780 26.298 -12.038 -18.721 1.00 0.00 O ATOM 1000 CB ILE A 780 25.977 -9.062 -19.761 1.00 0.00 C ATOM 1001 CG1 ILE A 780 25.517 -8.441 -18.439 1.00 0.00 C ATOM 1002 CG2 ILE A 780 24.844 -9.834 -20.417 1.00 0.00 C ATOM 1003 CD1 ILE A 780 24.364 -7.475 -18.597 1.00 0.00 C ATOM 0 H ILE A 780 26.991 -11.320 -21.128 1.00 0.00 H new ATOM 0 HA ILE A 780 28.028 -9.338 -19.197 1.00 0.00 H new ATOM 0 HB ILE A 780 26.269 -8.256 -20.434 1.00 0.00 H new ATOM 0 HG12 ILE A 780 25.223 -9.237 -17.755 1.00 0.00 H new ATOM 0 HG13 ILE A 780 26.357 -7.920 -17.979 1.00 0.00 H new ATOM 0 HG21 ILE A 780 23.990 -9.173 -20.564 1.00 0.00 H new ATOM 0 HG22 ILE A 780 25.176 -10.217 -21.382 1.00 0.00 H new ATOM 0 HG23 ILE A 780 24.552 -10.666 -19.777 1.00 0.00 H new ATOM 0 HD11 ILE A 780 24.090 -7.073 -17.622 1.00 0.00 H new ATOM 0 HD12 ILE A 780 24.661 -6.659 -19.255 1.00 0.00 H new ATOM 0 HD13 ILE A 780 23.509 -7.996 -19.028 1.00 0.00 H new ATOM 1015 N THR A 781 27.411 -10.751 -17.261 1.00 0.00 N ATOM 1016 CA THR A 781 27.232 -11.660 -16.149 1.00 0.00 C ATOM 1017 C THR A 781 26.467 -10.978 -15.024 1.00 0.00 C ATOM 1018 O THR A 781 26.892 -9.943 -14.508 1.00 0.00 O ATOM 1019 CB THR A 781 28.591 -12.160 -15.623 1.00 0.00 C ATOM 1020 OG1 THR A 781 29.371 -12.661 -16.713 1.00 0.00 O ATOM 1021 CG2 THR A 781 28.406 -13.257 -14.584 1.00 0.00 C ATOM 0 H THR A 781 27.939 -9.909 -17.034 1.00 0.00 H new ATOM 0 HA THR A 781 26.659 -12.516 -16.505 1.00 0.00 H new ATOM 0 HB THR A 781 29.105 -11.323 -15.151 1.00 0.00 H new ATOM 0 HG1 THR A 781 30.236 -12.977 -16.378 1.00 0.00 H new ATOM 0 HG21 THR A 781 29.381 -13.591 -14.230 1.00 0.00 H new ATOM 0 HG22 THR A 781 27.829 -12.870 -13.745 1.00 0.00 H new ATOM 0 HG23 THR A 781 27.875 -14.097 -15.032 1.00 0.00 H new ATOM 1029 N VAL A 782 25.327 -11.546 -14.670 1.00 0.00 N ATOM 1030 CA VAL A 782 24.515 -11.011 -13.589 1.00 0.00 C ATOM 1031 C VAL A 782 24.728 -11.830 -12.325 1.00 0.00 C ATOM 1032 O VAL A 782 24.733 -13.054 -12.366 1.00 0.00 O ATOM 1033 CB VAL A 782 23.016 -11.007 -13.958 1.00 0.00 C ATOM 1034 CG1 VAL A 782 22.179 -10.373 -12.856 1.00 0.00 C ATOM 1035 CG2 VAL A 782 22.804 -10.278 -15.267 1.00 0.00 C ATOM 0 H VAL A 782 24.942 -12.379 -15.116 1.00 0.00 H new ATOM 0 HA VAL A 782 24.826 -9.981 -13.416 1.00 0.00 H new ATOM 0 HB VAL A 782 22.691 -12.041 -14.071 1.00 0.00 H new ATOM 0 HG11 VAL A 782 21.128 -10.385 -13.145 1.00 0.00 H new ATOM 0 HG12 VAL A 782 22.308 -10.936 -11.932 1.00 0.00 H new ATOM 0 HG13 VAL A 782 22.501 -9.343 -12.701 1.00 0.00 H new ATOM 0 HG21 VAL A 782 21.743 -10.281 -15.518 1.00 0.00 H new ATOM 0 HG22 VAL A 782 23.151 -9.249 -15.171 1.00 0.00 H new ATOM 0 HG23 VAL A 782 23.365 -10.778 -16.057 1.00 0.00 H new ATOM 1045 N SER A 783 24.924 -11.150 -11.216 1.00 0.00 N ATOM 1046 CA SER A 783 25.143 -11.804 -9.944 1.00 0.00 C ATOM 1047 C SER A 783 24.077 -11.370 -8.952 1.00 0.00 C ATOM 1048 O SER A 783 23.673 -10.201 -8.921 1.00 0.00 O ATOM 1049 CB SER A 783 26.542 -11.466 -9.425 1.00 0.00 C ATOM 1050 OG SER A 783 26.798 -12.078 -8.174 1.00 0.00 O ATOM 0 H SER A 783 24.936 -10.131 -11.170 1.00 0.00 H new ATOM 0 HA SER A 783 25.074 -12.884 -10.071 1.00 0.00 H new ATOM 0 HB2 SER A 783 27.288 -11.793 -10.150 1.00 0.00 H new ATOM 0 HB3 SER A 783 26.643 -10.385 -9.329 1.00 0.00 H new ATOM 0 HG SER A 783 26.432 -12.987 -8.173 1.00 0.00 H new ATOM 1056 N LYS A 784 23.612 -12.315 -8.154 1.00 0.00 N ATOM 1057 CA LYS A 784 22.564 -12.040 -7.190 1.00 0.00 C ATOM 1058 C LYS A 784 23.115 -11.265 -6.009 1.00 0.00 C ATOM 1059 O LYS A 784 24.243 -11.488 -5.573 1.00 0.00 O ATOM 1060 CB LYS A 784 21.925 -13.331 -6.693 1.00 0.00 C ATOM 1061 CG LYS A 784 21.176 -14.105 -7.766 1.00 0.00 C ATOM 1062 CD LYS A 784 20.321 -15.220 -7.174 1.00 0.00 C ATOM 1063 CE LYS A 784 21.142 -16.207 -6.356 1.00 0.00 C ATOM 1064 NZ LYS A 784 20.301 -17.294 -5.785 1.00 0.00 N ATOM 0 H LYS A 784 23.944 -13.279 -8.155 1.00 0.00 H new ATOM 0 HA LYS A 784 21.804 -11.441 -7.692 1.00 0.00 H new ATOM 0 HB2 LYS A 784 22.702 -13.971 -6.274 1.00 0.00 H new ATOM 0 HB3 LYS A 784 21.236 -13.094 -5.883 1.00 0.00 H new ATOM 0 HG2 LYS A 784 20.541 -13.421 -8.329 1.00 0.00 H new ATOM 0 HG3 LYS A 784 21.890 -14.531 -8.471 1.00 0.00 H new ATOM 0 HD2 LYS A 784 19.547 -14.784 -6.543 1.00 0.00 H new ATOM 0 HD3 LYS A 784 19.814 -15.752 -7.979 1.00 0.00 H new ATOM 0 HE2 LYS A 784 21.918 -16.642 -6.986 1.00 0.00 H new ATOM 0 HE3 LYS A 784 21.647 -15.677 -5.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 784 20.883 -17.895 -5.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 784 19.525 -16.878 -5.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 784 19.907 -17.870 -6.556 1.00 0.00 H new ATOM 1078 N ARG A 785 22.309 -10.362 -5.496 1.00 0.00 N ATOM 1079 CA ARG A 785 22.689 -9.557 -4.351 1.00 0.00 C ATOM 1080 C ARG A 785 21.928 -10.011 -3.117 1.00 0.00 C ATOM 1081 O ARG A 785 20.829 -9.533 -2.841 1.00 0.00 O ATOM 1082 CB ARG A 785 22.429 -8.081 -4.640 1.00 0.00 C ATOM 1083 CG ARG A 785 23.393 -7.491 -5.658 1.00 0.00 C ATOM 1084 CD ARG A 785 24.687 -7.022 -5.003 1.00 0.00 C ATOM 1085 NE ARG A 785 25.440 -8.104 -4.367 1.00 0.00 N ATOM 1086 CZ ARG A 785 25.877 -8.061 -3.105 1.00 0.00 C ATOM 1087 NH1 ARG A 785 25.557 -7.036 -2.320 1.00 0.00 N ATOM 1088 NH2 ARG A 785 26.623 -9.048 -2.628 1.00 0.00 N ATOM 0 H ARG A 785 21.376 -10.164 -5.857 1.00 0.00 H new ATOM 0 HA ARG A 785 23.754 -9.686 -4.161 1.00 0.00 H new ATOM 0 HB2 ARG A 785 21.409 -7.963 -5.005 1.00 0.00 H new ATOM 0 HB3 ARG A 785 22.502 -7.517 -3.710 1.00 0.00 H new ATOM 0 HG2 ARG A 785 23.620 -8.237 -6.419 1.00 0.00 H new ATOM 0 HG3 ARG A 785 22.917 -6.652 -6.166 1.00 0.00 H new ATOM 0 HD2 ARG A 785 25.315 -6.546 -5.756 1.00 0.00 H new ATOM 0 HD3 ARG A 785 24.454 -6.263 -4.256 1.00 0.00 H new ATOM 0 HE ARG A 785 25.643 -8.938 -4.918 1.00 0.00 H new ATOM 0 HH11 ARG A 785 24.976 -6.279 -2.681 1.00 0.00 H new ATOM 0 HH12 ARG A 785 25.893 -7.007 -1.357 1.00 0.00 H new ATOM 0 HH21 ARG A 785 26.863 -9.840 -3.224 1.00 0.00 H new ATOM 0 HH22 ARG A 785 26.957 -9.015 -1.665 1.00 0.00 H new ATOM 1102 N ALA A 786 22.507 -10.961 -2.396 1.00 0.00 N ATOM 1103 CA ALA A 786 21.870 -11.522 -1.216 1.00 0.00 C ATOM 1104 C ALA A 786 22.190 -10.678 0.008 1.00 0.00 C ATOM 1105 O ALA A 786 21.315 -9.899 0.439 1.00 0.00 O ATOM 1106 CB ALA A 786 22.313 -12.962 -1.005 1.00 0.00 C ATOM 0 H ALA A 786 23.421 -11.360 -2.610 1.00 0.00 H new ATOM 0 HA ALA A 786 20.791 -11.516 -1.367 1.00 0.00 H new ATOM 0 HB1 ALA A 786 21.826 -13.366 -0.117 1.00 0.00 H new ATOM 0 HB2 ALA A 786 22.036 -13.559 -1.874 1.00 0.00 H new ATOM 0 HB3 ALA A 786 23.394 -12.994 -0.872 1.00 0.00 H new TER 1112 ALA A 786 HETATM 1113 P DGP A 801 27.328 -2.195 -24.931 1.00 0.00 P HETATM 1114 OP1 DGP A 801 27.893 -0.939 -24.380 1.00 0.00 O HETATM 1115 OP2 DGP A 801 27.762 -3.504 -24.375 1.00 0.00 O HETATM 1116 OP3 DGP A 801 27.578 -2.217 -26.505 1.00 0.00 O HETATM 1117 O5' DGP A 801 25.743 -2.116 -24.833 1.00 0.00 O HETATM 1118 C5' DGP A 801 25.065 -2.461 -23.626 1.00 0.00 C HETATM 1119 C4' DGP A 801 24.310 -1.270 -23.083 1.00 0.00 C HETATM 1120 O4' DGP A 801 24.206 -1.404 -21.652 1.00 0.00 O HETATM 1121 C3' DGP A 801 24.961 0.089 -23.347 1.00 0.00 C HETATM 1122 O3' DGP A 801 24.106 0.909 -24.146 1.00 0.00 O HETATM 1123 C2' DGP A 801 25.169 0.710 -21.976 1.00 0.00 C HETATM 1124 C1' DGP A 801 24.316 -0.133 -21.043 1.00 0.00 C HETATM 1125 N9 DGP A 801 24.889 -0.319 -19.713 1.00 0.00 N HETATM 1126 C8 DGP A 801 26.162 -0.742 -19.418 1.00 0.00 C HETATM 1127 N7 DGP A 801 26.393 -0.826 -18.137 1.00 0.00 N HETATM 1128 C5 DGP A 801 25.199 -0.437 -17.547 1.00 0.00 C HETATM 1129 C6 DGP A 801 24.848 -0.331 -16.177 1.00 0.00 C HETATM 1130 O6 DGP A 801 25.549 -0.568 -15.185 1.00 0.00 O HETATM 1131 N1 DGP A 801 23.536 0.100 -16.010 1.00 0.00 N HETATM 1132 C2 DGP A 801 22.675 0.389 -17.042 1.00 0.00 C HETATM 1133 N2 DGP A 801 21.448 0.789 -16.681 1.00 0.00 N HETATM 1134 N3 DGP A 801 22.987 0.298 -18.326 1.00 0.00 N HETATM 1135 C4 DGP A 801 24.259 -0.120 -18.506 1.00 0.00 C HETATM 0 HO3' DGP A 801 24.537 1.775 -24.304 1.00 0.00 H new HETATM 0 HN22 DGP A 801 20.757 1.020 -17.394 1.00 0.00 H new HETATM 0 HN21 DGP A 801 21.206 0.862 -15.693 1.00 0.00 H new HETATM 0 H5'' DGP A 801 24.374 -3.283 -23.813 1.00 0.00 H new HETATM 0 H2'' DGP A 801 26.219 0.686 -21.684 1.00 0.00 H new HETATM 0 HN1 DGP A 801 23.189 0.209 -15.057 1.00 0.00 H new HETATM 0 H8 DGP A 801 26.905 -0.983 -20.178 1.00 0.00 H new HETATM 0 H5' DGP A 801 25.784 -2.811 -22.886 1.00 0.00 H new HETATM 0 H4' DGP A 801 23.351 -1.278 -23.601 1.00 0.00 H new HETATM 0 H3' DGP A 801 25.899 -0.011 -23.893 1.00 0.00 H new HETATM 0 H2' DGP A 801 24.859 1.755 -21.962 1.00 0.00 H new HETATM 0 H1' DGP A 801 23.365 0.379 -20.898 1.00 0.00 H new