USER MOD reduce.3.24.130724 H: found=0, std=0, add=387, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 389 hydrogens (16 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 NoAdj-H: A 747 PTR HN2 : A 747 PTR N : A 746 LEU C :(H bumps) USER MOD NoAdj-H: A 759 PTR HN2 : A 759 PTR N : A 758 THR C :(H bumps) USER MOD NoAdj-H: A 759 PTR H : A 759 PTR N : A 758 THR C :(H bumps) USER MOD Set 1.1: A 756 ASN : amide:sc= 0.276 K(o=0.57,f=0) USER MOD Set 1.2: A 758 THR OG1 : rot 109:sc= 0.296 USER MOD Single : A 716 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0587) USER MOD Single : A 720 THR OG1 : rot 180:sc= 0 USER MOD Single : A 722 HIS : no HD1:sc= -0.0621 X(o=-0.062,f=0) USER MOD Single : A 725 LYS NZ :NH3+ -165:sc= 0.00902 (180deg=0.00301) USER MOD Single : A 729 LYS NZ :NH3+ -163:sc= 1.21 (180deg=0.654) USER MOD Single : A 738 LYS NZ :NH3+ -170:sc= -0.0504 (180deg=-0.293) USER MOD Single : A 741 THR OG1 : rot 180:sc= 0 USER MOD Single : A 743 ASN : amide:sc= 0.94 K(o=0.94,f=-0.013) USER MOD Single : A 744 ASN : amide:sc= -2.64! C(o=-2.6!,f=-3.6!) USER MOD Single : A 748 LYS NZ :NH3+ -168:sc= 1.94 (180deg=1.19) USER MOD Single : A 751 THR OG1 : rot -100:sc= 0.368 USER MOD Single : A 752 SER OG : rot 180:sc= 0 USER MOD Single : A 753 THR OG1 : rot 180:sc= -0.156 USER MOD Single : A 755 THR OG1 : rot -7:sc=-0.00363 USER MOD Single : A 762 THR OG1 : rot 70:sc= 1.29 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 716 1.497 -5.594 1.668 1.00 13.00 N ATOM 2 CA LYS A 716 2.803 -5.083 1.219 1.00 3.51 C ATOM 3 C LYS A 716 3.544 -6.081 0.322 1.00 70.13 C ATOM 4 O LYS A 716 4.564 -5.746 -0.283 1.00 21.21 O ATOM 5 CB LYS A 716 3.689 -4.622 2.416 1.00 35.44 C ATOM 6 CG LYS A 716 3.769 -5.602 3.619 1.00 62.31 C ATOM 7 CD LYS A 716 4.502 -6.909 3.281 1.00 73.01 C ATOM 8 CE LYS A 716 5.943 -6.667 2.818 1.00 44.20 C ATOM 9 NZ LYS A 716 6.750 -5.931 3.829 1.00 11.41 N ATOM 0 HA LYS A 716 2.597 -4.204 0.609 1.00 3.51 H new ATOM 0 HB2 LYS A 716 4.700 -4.446 2.048 1.00 35.44 H new ATOM 0 HB3 LYS A 716 3.310 -3.666 2.776 1.00 35.44 H new ATOM 0 HG2 LYS A 716 4.278 -5.110 4.448 1.00 62.31 H new ATOM 0 HG3 LYS A 716 2.760 -5.835 3.958 1.00 62.31 H new ATOM 0 HD2 LYS A 716 4.509 -7.556 4.158 1.00 73.01 H new ATOM 0 HD3 LYS A 716 3.956 -7.437 2.499 1.00 73.01 H new ATOM 0 HE2 LYS A 716 6.419 -7.624 2.605 1.00 44.20 H new ATOM 0 HE3 LYS A 716 5.932 -6.102 1.886 1.00 44.20 H new ATOM 0 HZ1 LYS A 716 7.743 -5.896 3.522 1.00 11.41 H new ATOM 0 HZ2 LYS A 716 6.384 -4.963 3.927 1.00 11.41 H new ATOM 0 HZ3 LYS A 716 6.688 -6.419 4.745 1.00 11.41 H new ATOM 23 N LEU A 717 3.030 -7.293 0.234 1.00 62.23 N ATOM 24 CA LEU A 717 3.651 -8.322 -0.568 1.00 34.41 C ATOM 25 C LEU A 717 3.465 -8.040 -2.048 1.00 74.53 C ATOM 26 O LEU A 717 4.399 -8.134 -2.814 1.00 44.52 O ATOM 27 CB LEU A 717 3.092 -9.700 -0.200 1.00 60.42 C ATOM 28 CG LEU A 717 3.621 -10.896 -1.009 1.00 71.32 C ATOM 29 CD1 LEU A 717 5.103 -11.109 -0.757 1.00 55.01 C ATOM 30 CD2 LEU A 717 2.836 -12.154 -0.680 1.00 53.40 C ATOM 0 H LEU A 717 2.179 -7.587 0.712 1.00 62.23 H new ATOM 0 HA LEU A 717 4.721 -8.320 -0.358 1.00 34.41 H new ATOM 0 HB2 LEU A 717 3.302 -9.882 0.854 1.00 60.42 H new ATOM 0 HB3 LEU A 717 2.008 -9.668 -0.309 1.00 60.42 H new ATOM 0 HG LEU A 717 3.487 -10.674 -2.068 1.00 71.32 H new ATOM 0 HD11 LEU A 717 5.453 -11.961 -1.341 1.00 55.01 H new ATOM 0 HD12 LEU A 717 5.654 -10.216 -1.052 1.00 55.01 H new ATOM 0 HD13 LEU A 717 5.268 -11.303 0.303 1.00 55.01 H new ATOM 0 HD21 LEU A 717 3.226 -12.989 -1.263 1.00 53.40 H new ATOM 0 HD22 LEU A 717 2.934 -12.376 0.383 1.00 53.40 H new ATOM 0 HD23 LEU A 717 1.785 -12.001 -0.924 1.00 53.40 H new ATOM 42 N LEU A 718 2.258 -7.663 -2.427 1.00 55.32 N ATOM 43 CA LEU A 718 1.949 -7.353 -3.829 1.00 75.54 C ATOM 44 C LEU A 718 2.855 -6.246 -4.360 1.00 12.11 C ATOM 45 O LEU A 718 3.305 -6.288 -5.510 1.00 74.33 O ATOM 46 CB LEU A 718 0.479 -6.954 -3.978 1.00 4.03 C ATOM 47 CG LEU A 718 -0.550 -8.030 -3.608 1.00 21.31 C ATOM 48 CD1 LEU A 718 -1.960 -7.488 -3.742 1.00 14.11 C ATOM 49 CD2 LEU A 718 -0.369 -9.266 -4.474 1.00 23.32 C ATOM 0 H LEU A 718 1.468 -7.561 -1.790 1.00 55.32 H new ATOM 0 HA LEU A 718 2.130 -8.251 -4.419 1.00 75.54 H new ATOM 0 HB2 LEU A 718 0.297 -6.076 -3.358 1.00 4.03 H new ATOM 0 HB3 LEU A 718 0.307 -6.655 -5.012 1.00 4.03 H new ATOM 0 HG LEU A 718 -0.388 -8.314 -2.568 1.00 21.31 H new ATOM 0 HD11 LEU A 718 -2.676 -8.266 -3.475 1.00 14.11 H new ATOM 0 HD12 LEU A 718 -2.087 -6.635 -3.076 1.00 14.11 H new ATOM 0 HD13 LEU A 718 -2.133 -7.174 -4.771 1.00 14.11 H new ATOM 0 HD21 LEU A 718 -1.108 -10.017 -4.196 1.00 23.32 H new ATOM 0 HD22 LEU A 718 -0.501 -8.998 -5.522 1.00 23.32 H new ATOM 0 HD23 LEU A 718 0.632 -9.671 -4.326 1.00 23.32 H new ATOM 61 N ILE A 719 3.128 -5.271 -3.521 1.00 73.14 N ATOM 62 CA ILE A 719 4.002 -4.175 -3.893 1.00 4.01 C ATOM 63 C ILE A 719 5.479 -4.607 -3.865 1.00 31.10 C ATOM 64 O ILE A 719 6.274 -4.211 -4.738 1.00 24.11 O ATOM 65 CB ILE A 719 3.798 -2.936 -2.963 1.00 40.42 C ATOM 66 CG1 ILE A 719 2.340 -2.449 -3.027 1.00 61.25 C ATOM 67 CG2 ILE A 719 4.759 -1.802 -3.340 1.00 74.01 C ATOM 68 CD1 ILE A 719 1.857 -2.132 -4.426 1.00 12.13 C ATOM 0 H ILE A 719 2.757 -5.213 -2.573 1.00 73.14 H new ATOM 0 HA ILE A 719 3.737 -3.890 -4.911 1.00 4.01 H new ATOM 0 HB ILE A 719 4.019 -3.241 -1.940 1.00 40.42 H new ATOM 0 HG12 ILE A 719 1.693 -3.213 -2.595 1.00 61.25 H new ATOM 0 HG13 ILE A 719 2.238 -1.558 -2.408 1.00 61.25 H new ATOM 0 HG21 ILE A 719 4.596 -0.952 -2.678 1.00 74.01 H new ATOM 0 HG22 ILE A 719 5.788 -2.148 -3.240 1.00 74.01 H new ATOM 0 HG23 ILE A 719 4.577 -1.499 -4.371 1.00 74.01 H new ATOM 0 HD11 ILE A 719 0.821 -1.796 -4.386 1.00 12.13 H new ATOM 0 HD12 ILE A 719 2.477 -1.345 -4.856 1.00 12.13 H new ATOM 0 HD13 ILE A 719 1.924 -3.026 -5.046 1.00 12.13 H new ATOM 80 N THR A 720 5.841 -5.431 -2.881 1.00 22.14 N ATOM 81 CA THR A 720 7.225 -5.859 -2.728 1.00 41.23 C ATOM 82 C THR A 720 7.646 -6.786 -3.876 1.00 61.51 C ATOM 83 O THR A 720 8.806 -6.922 -4.154 1.00 61.42 O ATOM 84 CB THR A 720 7.495 -6.555 -1.335 1.00 70.41 C ATOM 85 OG1 THR A 720 8.889 -6.429 -0.981 1.00 30.41 O ATOM 86 CG2 THR A 720 7.137 -8.034 -1.380 1.00 32.20 C ATOM 0 H THR A 720 5.199 -5.811 -2.185 1.00 22.14 H new ATOM 0 HA THR A 720 7.833 -4.955 -2.762 1.00 41.23 H new ATOM 0 HB THR A 720 6.870 -6.060 -0.592 1.00 70.41 H new ATOM 0 HG1 THR A 720 9.047 -6.862 -0.116 1.00 30.41 H new ATOM 0 HG21 THR A 720 7.333 -8.486 -0.408 1.00 32.20 H new ATOM 0 HG22 THR A 720 6.081 -8.145 -1.625 1.00 32.20 H new ATOM 0 HG23 THR A 720 7.740 -8.531 -2.140 1.00 32.20 H new ATOM 94 N ILE A 721 6.658 -7.397 -4.547 1.00 23.00 N ATOM 95 CA ILE A 721 6.918 -8.279 -5.695 1.00 0.34 C ATOM 96 C ILE A 721 7.747 -7.552 -6.771 1.00 51.14 C ATOM 97 O ILE A 721 8.609 -8.149 -7.422 1.00 13.32 O ATOM 98 CB ILE A 721 5.590 -8.800 -6.318 1.00 43.43 C ATOM 99 CG1 ILE A 721 4.871 -9.730 -5.334 1.00 34.13 C ATOM 100 CG2 ILE A 721 5.848 -9.513 -7.640 1.00 52.40 C ATOM 101 CD1 ILE A 721 3.522 -10.214 -5.817 1.00 61.22 C ATOM 0 H ILE A 721 5.670 -7.296 -4.314 1.00 23.00 H new ATOM 0 HA ILE A 721 7.487 -9.132 -5.327 1.00 0.34 H new ATOM 0 HB ILE A 721 4.948 -7.942 -6.520 1.00 43.43 H new ATOM 0 HG12 ILE A 721 5.506 -10.594 -5.137 1.00 34.13 H new ATOM 0 HG13 ILE A 721 4.740 -9.208 -4.386 1.00 34.13 H new ATOM 0 HG21 ILE A 721 4.903 -9.867 -8.053 1.00 52.40 H new ATOM 0 HG22 ILE A 721 6.314 -8.821 -8.341 1.00 52.40 H new ATOM 0 HG23 ILE A 721 6.511 -10.362 -7.472 1.00 52.40 H new ATOM 0 HD11 ILE A 721 3.079 -10.866 -5.065 1.00 61.22 H new ATOM 0 HD12 ILE A 721 2.868 -9.359 -5.987 1.00 61.22 H new ATOM 0 HD13 ILE A 721 3.646 -10.766 -6.749 1.00 61.22 H new ATOM 113 N HIS A 722 7.502 -6.273 -6.917 1.00 1.14 N ATOM 114 CA HIS A 722 8.226 -5.461 -7.886 1.00 42.32 C ATOM 115 C HIS A 722 9.698 -5.343 -7.521 1.00 43.34 C ATOM 116 O HIS A 722 10.551 -5.253 -8.389 1.00 63.11 O ATOM 117 CB HIS A 722 7.610 -4.070 -7.992 1.00 2.15 C ATOM 118 CG HIS A 722 6.299 -4.029 -8.709 1.00 21.31 C ATOM 119 ND1 HIS A 722 5.300 -3.146 -8.395 1.00 72.32 N ATOM 120 CD2 HIS A 722 5.833 -4.762 -9.744 1.00 51.15 C ATOM 121 CE1 HIS A 722 4.281 -3.337 -9.200 1.00 61.44 C ATOM 122 NE2 HIS A 722 4.581 -4.309 -10.026 1.00 4.33 N ATOM 0 H HIS A 722 6.804 -5.762 -6.377 1.00 1.14 H new ATOM 0 HA HIS A 722 8.149 -5.961 -8.852 1.00 42.32 H new ATOM 0 HB2 HIS A 722 7.474 -3.669 -6.988 1.00 2.15 H new ATOM 0 HB3 HIS A 722 8.312 -3.413 -8.506 1.00 2.15 H new ATOM 0 HD2 HIS A 722 6.356 -5.558 -10.252 1.00 51.15 H new ATOM 0 HE1 HIS A 722 3.352 -2.786 -9.184 1.00 61.44 H new ATOM 0 HE2 HIS A 722 3.974 -4.668 -10.762 1.00 4.33 H new ATOM 131 N ASP A 723 9.978 -5.347 -6.232 1.00 72.55 N ATOM 132 CA ASP A 723 11.339 -5.157 -5.732 1.00 0.24 C ATOM 133 C ASP A 723 11.928 -6.436 -5.143 1.00 73.21 C ATOM 134 O ASP A 723 13.027 -6.422 -4.611 1.00 52.42 O ATOM 135 CB ASP A 723 11.398 -4.023 -4.693 1.00 45.32 C ATOM 136 CG ASP A 723 11.224 -2.650 -5.301 1.00 31.35 C ATOM 137 OD1 ASP A 723 12.203 -2.116 -5.854 1.00 64.31 O ATOM 138 OD2 ASP A 723 10.103 -2.094 -5.229 1.00 14.24 O ATOM 0 H ASP A 723 9.279 -5.480 -5.501 1.00 72.55 H new ATOM 0 HA ASP A 723 11.946 -4.880 -6.594 1.00 0.24 H new ATOM 0 HB2 ASP A 723 10.622 -4.183 -3.945 1.00 45.32 H new ATOM 0 HB3 ASP A 723 12.355 -4.065 -4.173 1.00 45.32 H new ATOM 143 N ARG A 724 11.184 -7.531 -5.217 1.00 5.20 N ATOM 144 CA ARG A 724 11.609 -8.791 -4.577 1.00 72.04 C ATOM 145 C ARG A 724 12.933 -9.312 -5.128 1.00 32.41 C ATOM 146 O ARG A 724 13.729 -9.903 -4.403 1.00 61.23 O ATOM 147 CB ARG A 724 10.502 -9.883 -4.626 1.00 63.05 C ATOM 148 CG ARG A 724 10.180 -10.424 -6.008 1.00 10.31 C ATOM 149 CD ARG A 724 9.060 -11.460 -5.937 1.00 14.51 C ATOM 150 NE ARG A 724 8.704 -11.991 -7.260 1.00 2.05 N ATOM 151 CZ ARG A 724 7.562 -12.655 -7.540 1.00 12.11 C ATOM 152 NH1 ARG A 724 6.651 -12.873 -6.582 1.00 40.04 N ATOM 153 NH2 ARG A 724 7.338 -13.092 -8.767 1.00 22.44 N ATOM 0 H ARG A 724 10.290 -7.584 -5.706 1.00 5.20 H new ATOM 0 HA ARG A 724 11.776 -8.550 -3.527 1.00 72.04 H new ATOM 0 HB2 ARG A 724 10.808 -10.715 -3.991 1.00 63.05 H new ATOM 0 HB3 ARG A 724 9.590 -9.471 -4.194 1.00 63.05 H new ATOM 0 HG2 ARG A 724 9.883 -9.606 -6.664 1.00 10.31 H new ATOM 0 HG3 ARG A 724 11.072 -10.875 -6.444 1.00 10.31 H new ATOM 0 HD2 ARG A 724 9.369 -12.281 -5.290 1.00 14.51 H new ATOM 0 HD3 ARG A 724 8.179 -11.008 -5.481 1.00 14.51 H new ATOM 0 HE ARG A 724 9.367 -11.848 -8.022 1.00 2.05 H new ATOM 0 HH11 ARG A 724 6.818 -12.537 -5.634 1.00 40.04 H new ATOM 0 HH12 ARG A 724 5.791 -13.375 -6.801 1.00 40.04 H new ATOM 0 HH21 ARG A 724 8.027 -12.928 -9.501 1.00 22.44 H new ATOM 0 HH22 ARG A 724 6.476 -13.594 -8.980 1.00 22.44 H new ATOM 167 N LYS A 725 13.159 -9.084 -6.382 1.00 21.10 N ATOM 168 CA LYS A 725 14.370 -9.527 -7.039 1.00 0.55 C ATOM 169 C LYS A 725 15.571 -8.688 -6.611 1.00 51.43 C ATOM 170 O LYS A 725 16.704 -9.184 -6.543 1.00 2.53 O ATOM 171 CB LYS A 725 14.189 -9.476 -8.545 1.00 22.34 C ATOM 172 CG LYS A 725 13.043 -10.337 -9.048 1.00 13.12 C ATOM 173 CD LYS A 725 12.223 -9.616 -10.113 1.00 20.32 C ATOM 174 CE LYS A 725 11.535 -8.376 -9.535 1.00 24.33 C ATOM 175 NZ LYS A 725 10.685 -7.703 -10.529 1.00 64.33 N ATOM 0 H LYS A 725 12.512 -8.584 -6.992 1.00 21.10 H new ATOM 0 HA LYS A 725 14.566 -10.557 -6.740 1.00 0.55 H new ATOM 0 HB2 LYS A 725 14.017 -8.443 -8.847 1.00 22.34 H new ATOM 0 HB3 LYS A 725 15.113 -9.799 -9.025 1.00 22.34 H new ATOM 0 HG2 LYS A 725 13.439 -11.266 -9.460 1.00 13.12 H new ATOM 0 HG3 LYS A 725 12.397 -10.608 -8.213 1.00 13.12 H new ATOM 0 HD2 LYS A 725 12.871 -9.324 -10.939 1.00 20.32 H new ATOM 0 HD3 LYS A 725 11.474 -10.295 -10.520 1.00 20.32 H new ATOM 0 HE2 LYS A 725 10.929 -8.665 -8.676 1.00 24.33 H new ATOM 0 HE3 LYS A 725 12.290 -7.679 -9.172 1.00 24.33 H new ATOM 0 HZ1 LYS A 725 10.444 -6.749 -10.191 1.00 64.33 H new ATOM 0 HZ2 LYS A 725 11.197 -7.631 -11.432 1.00 64.33 H new ATOM 0 HZ3 LYS A 725 9.813 -8.252 -10.668 1.00 64.33 H new ATOM 189 N GLU A 726 15.325 -7.440 -6.343 1.00 74.42 N ATOM 190 CA GLU A 726 16.364 -6.514 -5.987 1.00 73.10 C ATOM 191 C GLU A 726 16.427 -6.234 -4.470 1.00 61.12 C ATOM 192 O GLU A 726 17.314 -6.733 -3.781 1.00 62.14 O ATOM 193 CB GLU A 726 16.264 -5.189 -6.810 1.00 45.44 C ATOM 194 CG GLU A 726 14.836 -4.667 -7.058 1.00 31.42 C ATOM 195 CD GLU A 726 14.115 -5.401 -8.177 1.00 3.24 C ATOM 196 OE1 GLU A 726 14.283 -5.010 -9.356 1.00 11.20 O ATOM 197 OE2 GLU A 726 13.389 -6.361 -7.886 1.00 72.52 O ATOM 0 H GLU A 726 14.391 -7.031 -6.365 1.00 74.42 H new ATOM 0 HA GLU A 726 17.305 -6.998 -6.249 1.00 73.10 H new ATOM 0 HB2 GLU A 726 16.829 -4.416 -6.290 1.00 45.44 H new ATOM 0 HB3 GLU A 726 16.748 -5.344 -7.774 1.00 45.44 H new ATOM 0 HG2 GLU A 726 14.257 -4.761 -6.139 1.00 31.42 H new ATOM 0 HG3 GLU A 726 14.881 -3.605 -7.299 1.00 31.42 H new ATOM 204 N PHE A 727 15.473 -5.475 -3.965 1.00 44.15 N ATOM 205 CA PHE A 727 15.509 -5.009 -2.585 1.00 34.13 C ATOM 206 C PHE A 727 15.119 -6.096 -1.607 1.00 71.23 C ATOM 207 O PHE A 727 15.764 -6.273 -0.576 1.00 63.32 O ATOM 208 CB PHE A 727 14.616 -3.776 -2.398 1.00 60.33 C ATOM 209 CG PHE A 727 14.470 -3.355 -0.963 1.00 65.23 C ATOM 210 CD1 PHE A 727 15.570 -2.935 -0.234 1.00 34.15 C ATOM 211 CD2 PHE A 727 13.239 -3.398 -0.340 1.00 11.54 C ATOM 212 CE1 PHE A 727 15.438 -2.563 1.083 1.00 23.15 C ATOM 213 CE2 PHE A 727 13.103 -3.026 0.978 1.00 54.44 C ATOM 214 CZ PHE A 727 14.202 -2.609 1.690 1.00 52.52 C ATOM 0 H PHE A 727 14.656 -5.164 -4.491 1.00 44.15 H new ATOM 0 HA PHE A 727 16.541 -4.729 -2.371 1.00 34.13 H new ATOM 0 HB2 PHE A 727 15.030 -2.947 -2.972 1.00 60.33 H new ATOM 0 HB3 PHE A 727 13.629 -3.986 -2.809 1.00 60.33 H new ATOM 0 HD1 PHE A 727 16.541 -2.899 -0.705 1.00 34.15 H new ATOM 0 HD2 PHE A 727 12.372 -3.728 -0.894 1.00 11.54 H new ATOM 0 HE1 PHE A 727 16.302 -2.235 1.641 1.00 23.15 H new ATOM 0 HE2 PHE A 727 12.133 -3.062 1.452 1.00 54.44 H new ATOM 0 HZ PHE A 727 14.097 -2.318 2.725 1.00 52.52 H new ATOM 224 N ALA A 728 14.079 -6.822 -1.920 1.00 44.10 N ATOM 225 CA ALA A 728 13.614 -7.874 -1.044 1.00 63.11 C ATOM 226 C ALA A 728 14.649 -8.967 -0.926 1.00 11.43 C ATOM 227 O ALA A 728 14.769 -9.607 0.109 1.00 12.22 O ATOM 228 CB ALA A 728 12.311 -8.422 -1.508 1.00 75.13 C ATOM 0 H ALA A 728 13.535 -6.707 -2.775 1.00 44.10 H new ATOM 0 HA ALA A 728 13.459 -7.444 -0.054 1.00 63.11 H new ATOM 0 HB1 ALA A 728 11.986 -9.211 -0.830 1.00 75.13 H new ATOM 0 HB2 ALA A 728 11.566 -7.626 -1.522 1.00 75.13 H new ATOM 0 HB3 ALA A 728 12.425 -8.830 -2.512 1.00 75.13 H new ATOM 234 N LYS A 729 15.405 -9.174 -1.997 1.00 54.42 N ATOM 235 CA LYS A 729 16.487 -10.131 -1.988 1.00 34.54 C ATOM 236 C LYS A 729 17.534 -9.774 -0.903 1.00 24.22 C ATOM 237 O LYS A 729 18.230 -10.650 -0.384 1.00 54.14 O ATOM 238 CB LYS A 729 17.147 -10.225 -3.387 1.00 11.21 C ATOM 239 CG LYS A 729 18.321 -11.240 -3.508 1.00 11.44 C ATOM 240 CD LYS A 729 17.842 -12.711 -3.656 1.00 71.03 C ATOM 241 CE LYS A 729 17.170 -13.229 -2.399 1.00 72.51 C ATOM 242 NZ LYS A 729 16.821 -14.652 -2.498 1.00 23.30 N ATOM 0 H LYS A 729 15.282 -8.686 -2.884 1.00 54.42 H new ATOM 0 HA LYS A 729 16.073 -11.109 -1.743 1.00 34.54 H new ATOM 0 HB2 LYS A 729 16.381 -10.495 -4.114 1.00 11.21 H new ATOM 0 HB3 LYS A 729 17.514 -9.237 -3.663 1.00 11.21 H new ATOM 0 HG2 LYS A 729 18.935 -10.976 -4.369 1.00 11.44 H new ATOM 0 HG3 LYS A 729 18.957 -11.158 -2.626 1.00 11.44 H new ATOM 0 HD2 LYS A 729 17.146 -12.781 -4.492 1.00 71.03 H new ATOM 0 HD3 LYS A 729 18.695 -13.346 -3.897 1.00 71.03 H new ATOM 0 HE2 LYS A 729 17.833 -13.079 -1.547 1.00 72.51 H new ATOM 0 HE3 LYS A 729 16.268 -12.649 -2.207 1.00 72.51 H new ATOM 0 HZ1 LYS A 729 16.125 -14.891 -1.763 1.00 23.30 H new ATOM 0 HZ2 LYS A 729 16.415 -14.845 -3.436 1.00 23.30 H new ATOM 0 HZ3 LYS A 729 17.676 -15.229 -2.365 1.00 23.30 H new ATOM 256 N PHE A 730 17.620 -8.496 -0.570 1.00 34.41 N ATOM 257 CA PHE A 730 18.517 -8.031 0.465 1.00 70.25 C ATOM 258 C PHE A 730 18.016 -8.407 1.825 1.00 50.22 C ATOM 259 O PHE A 730 18.705 -9.082 2.582 1.00 15.33 O ATOM 260 CB PHE A 730 18.685 -6.539 0.387 1.00 15.13 C ATOM 261 CG PHE A 730 19.546 -6.094 -0.727 1.00 31.31 C ATOM 262 CD1 PHE A 730 20.823 -6.597 -0.865 1.00 43.34 C ATOM 263 CD2 PHE A 730 19.092 -5.169 -1.636 1.00 62.13 C ATOM 264 CE1 PHE A 730 21.638 -6.183 -1.897 1.00 4.00 C ATOM 265 CE2 PHE A 730 19.896 -4.747 -2.674 1.00 13.42 C ATOM 266 CZ PHE A 730 21.172 -5.255 -2.805 1.00 12.44 C ATOM 0 H PHE A 730 17.071 -7.758 -1.010 1.00 34.41 H new ATOM 0 HA PHE A 730 19.482 -8.512 0.304 1.00 70.25 H new ATOM 0 HB2 PHE A 730 17.703 -6.077 0.282 1.00 15.13 H new ATOM 0 HB3 PHE A 730 19.107 -6.181 1.326 1.00 15.13 H new ATOM 0 HD1 PHE A 730 21.189 -7.324 -0.156 1.00 43.34 H new ATOM 0 HD2 PHE A 730 18.094 -4.768 -1.536 1.00 62.13 H new ATOM 0 HE1 PHE A 730 22.636 -6.583 -1.994 1.00 4.00 H new ATOM 0 HE2 PHE A 730 19.527 -4.020 -3.383 1.00 13.42 H new ATOM 0 HZ PHE A 730 21.805 -4.927 -3.617 1.00 12.44 H new ATOM 276 N GLU A 731 16.800 -7.974 2.138 1.00 64.30 N ATOM 277 CA GLU A 731 16.186 -8.248 3.442 1.00 35.24 C ATOM 278 C GLU A 731 16.075 -9.746 3.696 1.00 54.23 C ATOM 279 O GLU A 731 16.072 -10.195 4.850 1.00 34.11 O ATOM 280 CB GLU A 731 14.813 -7.574 3.558 1.00 73.43 C ATOM 281 CG GLU A 731 13.786 -8.092 2.585 1.00 3.32 C ATOM 282 CD GLU A 731 12.443 -7.418 2.723 1.00 2.40 C ATOM 283 OE1 GLU A 731 12.377 -6.188 2.622 1.00 22.34 O ATOM 284 OE2 GLU A 731 11.434 -8.130 2.935 1.00 4.12 O ATOM 0 H GLU A 731 16.213 -7.429 1.506 1.00 64.30 H new ATOM 0 HA GLU A 731 16.837 -7.825 4.207 1.00 35.24 H new ATOM 0 HB2 GLU A 731 14.438 -7.711 4.572 1.00 73.43 H new ATOM 0 HB3 GLU A 731 14.933 -6.501 3.405 1.00 73.43 H new ATOM 0 HG2 GLU A 731 14.154 -7.950 1.569 1.00 3.32 H new ATOM 0 HG3 GLU A 731 13.664 -9.165 2.733 1.00 3.32 H new ATOM 291 N GLU A 732 15.988 -10.523 2.608 1.00 50.04 N ATOM 292 CA GLU A 732 15.885 -11.974 2.709 1.00 62.00 C ATOM 293 C GLU A 732 17.054 -12.592 3.464 1.00 32.14 C ATOM 294 O GLU A 732 16.897 -13.592 4.112 1.00 53.53 O ATOM 295 CB GLU A 732 15.715 -12.635 1.344 1.00 52.22 C ATOM 296 CG GLU A 732 14.284 -12.644 0.843 1.00 52.11 C ATOM 297 CD GLU A 732 14.127 -13.357 -0.476 1.00 2.41 C ATOM 298 OE1 GLU A 732 14.814 -14.387 -0.697 1.00 32.52 O ATOM 299 OE2 GLU A 732 13.311 -12.905 -1.303 1.00 62.33 O ATOM 0 H GLU A 732 15.987 -10.166 1.652 1.00 50.04 H new ATOM 0 HA GLU A 732 14.983 -12.168 3.289 1.00 62.00 H new ATOM 0 HB2 GLU A 732 16.341 -12.115 0.619 1.00 52.22 H new ATOM 0 HB3 GLU A 732 16.077 -13.662 1.400 1.00 52.22 H new ATOM 0 HG2 GLU A 732 13.647 -13.123 1.587 1.00 52.11 H new ATOM 0 HG3 GLU A 732 13.935 -11.617 0.738 1.00 52.11 H new ATOM 306 N GLU A 733 18.214 -11.985 3.378 1.00 64.03 N ATOM 307 CA GLU A 733 19.392 -12.523 4.051 1.00 72.14 C ATOM 308 C GLU A 733 19.147 -12.679 5.555 1.00 75.11 C ATOM 309 O GLU A 733 19.369 -13.741 6.117 1.00 45.14 O ATOM 310 CB GLU A 733 20.597 -11.637 3.805 1.00 73.02 C ATOM 311 CG GLU A 733 20.962 -11.514 2.353 1.00 62.15 C ATOM 312 CD GLU A 733 22.145 -10.617 2.125 1.00 52.32 C ATOM 313 OE1 GLU A 733 23.242 -10.940 2.615 1.00 44.51 O ATOM 314 OE2 GLU A 733 21.989 -9.573 1.450 1.00 70.10 O ATOM 0 H GLU A 733 18.376 -11.124 2.855 1.00 64.03 H new ATOM 0 HA GLU A 733 19.592 -13.511 3.635 1.00 72.14 H new ATOM 0 HB2 GLU A 733 20.396 -10.644 4.207 1.00 73.02 H new ATOM 0 HB3 GLU A 733 21.450 -12.036 4.354 1.00 73.02 H new ATOM 0 HG2 GLU A 733 21.180 -12.504 1.953 1.00 62.15 H new ATOM 0 HG3 GLU A 733 20.106 -11.127 1.799 1.00 62.15 H new ATOM 321 N ARG A 734 18.701 -11.623 6.177 1.00 72.12 N ATOM 322 CA ARG A 734 18.364 -11.630 7.584 1.00 61.14 C ATOM 323 C ARG A 734 17.039 -12.345 7.838 1.00 15.21 C ATOM 324 O ARG A 734 16.952 -13.224 8.684 1.00 20.13 O ATOM 325 CB ARG A 734 18.299 -10.199 8.125 1.00 51.54 C ATOM 326 CG ARG A 734 18.028 -10.106 9.621 1.00 64.40 C ATOM 327 CD ARG A 734 19.128 -10.783 10.424 1.00 22.11 C ATOM 328 NE ARG A 734 20.450 -10.218 10.125 1.00 54.43 N ATOM 329 CZ ARG A 734 21.609 -10.738 10.533 1.00 43.22 C ATOM 330 NH1 ARG A 734 21.623 -11.819 11.298 1.00 23.11 N ATOM 331 NH2 ARG A 734 22.748 -10.168 10.181 1.00 61.23 N ATOM 0 H ARG A 734 18.558 -10.721 5.722 1.00 72.12 H new ATOM 0 HA ARG A 734 19.148 -12.176 8.108 1.00 61.14 H new ATOM 0 HB2 ARG A 734 19.242 -9.697 7.907 1.00 51.54 H new ATOM 0 HB3 ARG A 734 17.518 -9.657 7.592 1.00 51.54 H new ATOM 0 HG2 ARG A 734 17.952 -9.059 9.915 1.00 64.40 H new ATOM 0 HG3 ARG A 734 17.069 -10.572 9.849 1.00 64.40 H new ATOM 0 HD2 ARG A 734 18.919 -10.675 11.488 1.00 22.11 H new ATOM 0 HD3 ARG A 734 19.132 -11.851 10.206 1.00 22.11 H new ATOM 0 HE ARG A 734 20.485 -9.366 9.565 1.00 54.43 H new ATOM 0 HH11 ARG A 734 20.745 -12.257 11.578 1.00 23.11 H new ATOM 0 HH12 ARG A 734 22.511 -12.213 11.608 1.00 23.11 H new ATOM 0 HH21 ARG A 734 22.741 -9.331 9.598 1.00 61.23 H new ATOM 0 HH22 ARG A 734 23.635 -10.565 10.492 1.00 61.23 H new ATOM 345 N ALA A 735 16.019 -11.958 7.082 1.00 20.41 N ATOM 346 CA ALA A 735 14.634 -12.397 7.336 1.00 32.12 C ATOM 347 C ALA A 735 14.422 -13.874 7.014 1.00 50.33 C ATOM 348 O ALA A 735 13.743 -14.586 7.744 1.00 32.52 O ATOM 349 CB ALA A 735 13.651 -11.531 6.542 1.00 32.42 C ATOM 0 H ALA A 735 16.117 -11.336 6.279 1.00 20.41 H new ATOM 0 HA ALA A 735 14.447 -12.273 8.403 1.00 32.12 H new ATOM 0 HB1 ALA A 735 12.632 -11.865 6.738 1.00 32.42 H new ATOM 0 HB2 ALA A 735 13.756 -10.489 6.846 1.00 32.42 H new ATOM 0 HB3 ALA A 735 13.864 -11.622 5.477 1.00 32.42 H new ATOM 355 N ARG A 736 15.005 -14.319 5.957 1.00 11.21 N ATOM 356 CA ARG A 736 14.794 -15.665 5.479 1.00 71.30 C ATOM 357 C ARG A 736 15.840 -16.617 6.076 1.00 73.01 C ATOM 358 O ARG A 736 15.763 -17.832 5.899 1.00 22.21 O ATOM 359 CB ARG A 736 14.891 -15.674 3.964 1.00 43.14 C ATOM 360 CG ARG A 736 14.398 -16.915 3.303 1.00 45.50 C ATOM 361 CD ARG A 736 14.794 -16.938 1.849 1.00 32.55 C ATOM 362 NE ARG A 736 16.251 -17.074 1.686 1.00 14.13 N ATOM 363 CZ ARG A 736 16.877 -17.258 0.521 1.00 42.53 C ATOM 364 NH1 ARG A 736 16.186 -17.281 -0.609 1.00 13.22 N ATOM 365 NH2 ARG A 736 18.193 -17.406 0.491 1.00 22.42 N ATOM 0 H ARG A 736 15.647 -13.767 5.388 1.00 11.21 H new ATOM 0 HA ARG A 736 13.805 -16.005 5.787 1.00 71.30 H new ATOM 0 HB2 ARG A 736 14.327 -14.826 3.575 1.00 43.14 H new ATOM 0 HB3 ARG A 736 15.933 -15.521 3.682 1.00 43.14 H new ATOM 0 HG2 ARG A 736 14.806 -17.789 3.810 1.00 45.50 H new ATOM 0 HG3 ARG A 736 13.313 -16.973 3.390 1.00 45.50 H new ATOM 0 HD2 ARG A 736 14.292 -17.766 1.348 1.00 32.55 H new ATOM 0 HD3 ARG A 736 14.457 -16.021 1.365 1.00 32.55 H new ATOM 0 HE ARG A 736 16.826 -17.024 2.527 1.00 14.13 H new ATOM 0 HH11 ARG A 736 15.174 -17.158 -0.590 1.00 13.22 H new ATOM 0 HH12 ARG A 736 16.666 -17.422 -1.498 1.00 13.22 H new ATOM 0 HH21 ARG A 736 18.729 -17.379 1.358 1.00 22.42 H new ATOM 0 HH22 ARG A 736 18.670 -17.547 -0.399 1.00 22.42 H new ATOM 379 N ALA A 737 16.813 -16.049 6.783 1.00 70.34 N ATOM 380 CA ALA A 737 17.914 -16.827 7.366 1.00 60.30 C ATOM 381 C ALA A 737 17.419 -17.984 8.238 1.00 44.23 C ATOM 382 O ALA A 737 17.832 -19.129 8.059 1.00 4.43 O ATOM 383 CB ALA A 737 18.828 -15.928 8.159 1.00 63.42 C ATOM 0 H ALA A 737 16.866 -15.048 6.969 1.00 70.34 H new ATOM 0 HA ALA A 737 18.468 -17.267 6.537 1.00 60.30 H new ATOM 0 HB1 ALA A 737 19.639 -16.518 8.585 1.00 63.42 H new ATOM 0 HB2 ALA A 737 19.242 -15.161 7.504 1.00 63.42 H new ATOM 0 HB3 ALA A 737 18.264 -15.453 8.962 1.00 63.42 H new ATOM 389 N LYS A 738 16.553 -17.686 9.159 1.00 55.42 N ATOM 390 CA LYS A 738 16.080 -18.676 10.098 1.00 23.51 C ATOM 391 C LYS A 738 14.600 -18.887 9.972 1.00 61.23 C ATOM 392 O LYS A 738 14.078 -19.930 10.344 1.00 74.11 O ATOM 393 CB LYS A 738 16.426 -18.254 11.517 1.00 73.24 C ATOM 394 CG LYS A 738 17.879 -17.916 11.703 1.00 70.51 C ATOM 395 CD LYS A 738 18.196 -17.609 13.135 1.00 45.10 C ATOM 396 CE LYS A 738 19.619 -17.126 13.283 1.00 32.10 C ATOM 397 NZ LYS A 738 20.600 -18.088 12.716 1.00 21.24 N ATOM 0 H LYS A 738 16.152 -16.757 9.286 1.00 55.42 H new ATOM 0 HA LYS A 738 16.575 -19.620 9.869 1.00 23.51 H new ATOM 0 HB2 LYS A 738 15.822 -17.388 11.788 1.00 73.24 H new ATOM 0 HB3 LYS A 738 16.157 -19.057 12.203 1.00 73.24 H new ATOM 0 HG2 LYS A 738 18.493 -18.751 11.365 1.00 70.51 H new ATOM 0 HG3 LYS A 738 18.136 -17.058 11.081 1.00 70.51 H new ATOM 0 HD2 LYS A 738 17.510 -16.849 13.508 1.00 45.10 H new ATOM 0 HD3 LYS A 738 18.046 -18.501 13.744 1.00 45.10 H new ATOM 0 HE2 LYS A 738 19.728 -16.163 12.785 1.00 32.10 H new ATOM 0 HE3 LYS A 738 19.839 -16.965 14.339 1.00 32.10 H new ATOM 0 HZ1 LYS A 738 21.563 -17.802 12.987 1.00 21.24 H new ATOM 0 HZ2 LYS A 738 20.405 -19.041 13.085 1.00 21.24 H new ATOM 0 HZ3 LYS A 738 20.520 -18.095 11.679 1.00 21.24 H new ATOM 411 N TRP A 739 13.926 -17.911 9.444 1.00 24.03 N ATOM 412 CA TRP A 739 12.486 -17.940 9.382 1.00 51.43 C ATOM 413 C TRP A 739 12.008 -18.004 7.954 1.00 61.52 C ATOM 414 O TRP A 739 10.949 -17.462 7.606 1.00 5.52 O ATOM 415 CB TRP A 739 11.909 -16.722 10.109 1.00 31.02 C ATOM 416 CG TRP A 739 12.371 -16.641 11.530 1.00 73.02 C ATOM 417 CD1 TRP A 739 13.598 -16.246 11.961 1.00 23.10 C ATOM 418 CD2 TRP A 739 11.623 -16.968 12.701 1.00 54.25 C ATOM 419 NE1 TRP A 739 13.676 -16.325 13.307 1.00 1.23 N ATOM 420 CE2 TRP A 739 12.472 -16.758 13.800 1.00 72.43 C ATOM 421 CE3 TRP A 739 10.320 -17.422 12.928 1.00 63.42 C ATOM 422 CZ2 TRP A 739 12.066 -16.983 15.111 1.00 74.13 C ATOM 423 CZ3 TRP A 739 9.916 -17.644 14.229 1.00 74.33 C ATOM 424 CH2 TRP A 739 10.786 -17.426 15.305 1.00 10.20 C ATOM 0 H TRP A 739 14.350 -17.074 9.044 1.00 24.03 H new ATOM 0 HA TRP A 739 12.131 -18.841 9.883 1.00 51.43 H new ATOM 0 HB2 TRP A 739 12.201 -15.814 9.581 1.00 31.02 H new ATOM 0 HB3 TRP A 739 10.820 -16.769 10.085 1.00 31.02 H new ATOM 0 HD1 TRP A 739 14.399 -15.915 11.317 1.00 23.10 H new ATOM 0 HE1 TRP A 739 14.498 -16.099 13.867 1.00 1.23 H new ATOM 0 HE3 TRP A 739 9.645 -17.595 12.103 1.00 63.42 H new ATOM 0 HZ2 TRP A 739 12.734 -16.815 15.943 1.00 74.13 H new ATOM 0 HZ3 TRP A 739 8.912 -17.992 14.421 1.00 74.33 H new ATOM 0 HH2 TRP A 739 10.439 -17.612 16.311 1.00 10.20 H new ATOM 435 N ASP A 740 12.774 -18.684 7.128 1.00 21.23 N ATOM 436 CA ASP A 740 12.422 -18.879 5.712 1.00 23.43 C ATOM 437 C ASP A 740 11.072 -19.562 5.560 1.00 73.05 C ATOM 438 O ASP A 740 10.327 -19.255 4.670 1.00 74.14 O ATOM 439 CB ASP A 740 13.513 -19.677 4.971 1.00 70.00 C ATOM 440 CG ASP A 740 13.691 -21.091 5.479 1.00 73.45 C ATOM 441 OD1 ASP A 740 14.053 -21.262 6.651 1.00 2.20 O ATOM 442 OD2 ASP A 740 13.483 -22.040 4.691 1.00 70.23 O ATOM 0 H ASP A 740 13.654 -19.120 7.403 1.00 21.23 H new ATOM 0 HA ASP A 740 12.352 -17.890 5.260 1.00 23.43 H new ATOM 0 HB2 ASP A 740 13.267 -19.711 3.910 1.00 70.00 H new ATOM 0 HB3 ASP A 740 14.461 -19.147 5.061 1.00 70.00 H new ATOM 447 N THR A 741 10.768 -20.463 6.452 1.00 25.13 N ATOM 448 CA THR A 741 9.501 -21.162 6.421 1.00 13.13 C ATOM 449 C THR A 741 8.324 -20.209 6.772 1.00 10.33 C ATOM 450 O THR A 741 7.180 -20.453 6.389 1.00 42.43 O ATOM 451 CB THR A 741 9.505 -22.397 7.393 1.00 54.33 C ATOM 452 OG1 THR A 741 8.227 -23.059 7.372 1.00 71.35 O ATOM 453 CG2 THR A 741 9.824 -21.965 8.817 1.00 72.35 C ATOM 0 H THR A 741 11.383 -20.737 7.219 1.00 25.13 H new ATOM 0 HA THR A 741 9.359 -21.527 5.404 1.00 13.13 H new ATOM 0 HB THR A 741 10.276 -23.087 7.050 1.00 54.33 H new ATOM 0 HG1 THR A 741 8.246 -23.827 7.981 1.00 71.35 H new ATOM 0 HG21 THR A 741 9.821 -22.837 9.471 1.00 72.35 H new ATOM 0 HG22 THR A 741 10.807 -21.495 8.843 1.00 72.35 H new ATOM 0 HG23 THR A 741 9.073 -21.253 9.158 1.00 72.35 H new ATOM 461 N ALA A 742 8.627 -19.122 7.466 1.00 23.23 N ATOM 462 CA ALA A 742 7.595 -18.213 7.952 1.00 24.21 C ATOM 463 C ALA A 742 7.375 -17.053 6.986 1.00 74.44 C ATOM 464 O ALA A 742 6.236 -16.692 6.680 1.00 40.01 O ATOM 465 CB ALA A 742 7.959 -17.694 9.335 1.00 14.40 C ATOM 0 H ALA A 742 9.579 -18.846 7.706 1.00 23.23 H new ATOM 0 HA ALA A 742 6.660 -18.770 8.019 1.00 24.21 H new ATOM 0 HB1 ALA A 742 7.180 -17.017 9.686 1.00 14.40 H new ATOM 0 HB2 ALA A 742 8.049 -18.532 10.026 1.00 14.40 H new ATOM 0 HB3 ALA A 742 8.908 -17.161 9.285 1.00 14.40 H new ATOM 471 N ASN A 743 8.459 -16.480 6.510 1.00 65.11 N ATOM 472 CA ASN A 743 8.389 -15.324 5.599 1.00 33.13 C ATOM 473 C ASN A 743 7.993 -15.748 4.228 1.00 54.53 C ATOM 474 O ASN A 743 7.344 -15.001 3.496 1.00 23.41 O ATOM 475 CB ASN A 743 9.740 -14.603 5.524 1.00 43.05 C ATOM 476 CG ASN A 743 10.148 -13.966 6.818 1.00 40.42 C ATOM 477 OD1 ASN A 743 9.830 -12.808 7.081 1.00 33.13 O ATOM 478 ND2 ASN A 743 10.851 -14.699 7.620 1.00 11.23 N ATOM 0 H ASN A 743 9.407 -16.785 6.730 1.00 65.11 H new ATOM 0 HA ASN A 743 7.637 -14.644 5.998 1.00 33.13 H new ATOM 0 HB2 ASN A 743 10.507 -15.315 5.221 1.00 43.05 H new ATOM 0 HB3 ASN A 743 9.692 -13.837 4.750 1.00 43.05 H new ATOM 0 HD21 ASN A 743 11.165 -14.320 8.513 1.00 11.23 H new ATOM 0 HD22 ASN A 743 11.091 -15.655 7.359 1.00 11.23 H new ATOM 485 N ASN A 744 8.375 -16.933 3.878 1.00 42.44 N ATOM 486 CA ASN A 744 8.181 -17.426 2.558 1.00 64.02 C ATOM 487 C ASN A 744 7.001 -18.358 2.477 1.00 21.54 C ATOM 488 O ASN A 744 6.631 -19.009 3.475 1.00 31.12 O ATOM 489 CB ASN A 744 9.442 -18.106 2.065 1.00 0.44 C ATOM 490 CG ASN A 744 10.550 -17.124 1.808 1.00 33.43 C ATOM 491 OD1 ASN A 744 11.356 -16.820 2.688 1.00 24.44 O ATOM 492 ND2 ASN A 744 10.593 -16.620 0.626 1.00 1.25 N ATOM 0 H ASN A 744 8.835 -17.590 4.508 1.00 42.44 H new ATOM 0 HA ASN A 744 7.963 -16.576 1.911 1.00 64.02 H new ATOM 0 HB2 ASN A 744 9.771 -18.838 2.803 1.00 0.44 H new ATOM 0 HB3 ASN A 744 9.223 -18.653 1.148 1.00 0.44 H new ATOM 0 HD21 ASN A 744 11.315 -15.940 0.387 1.00 1.25 H new ATOM 0 HD22 ASN A 744 9.905 -16.900 -0.073 1.00 1.25 H new ATOM 499 N PRO A 745 6.376 -18.441 1.281 1.00 50.21 N ATOM 500 CA PRO A 745 5.192 -19.261 1.054 1.00 31.45 C ATOM 501 C PRO A 745 5.456 -20.753 1.221 1.00 63.52 C ATOM 502 O PRO A 745 5.093 -21.352 2.235 1.00 53.14 O ATOM 503 CB PRO A 745 4.817 -18.944 -0.415 1.00 52.32 C ATOM 504 CG PRO A 745 6.087 -18.454 -1.023 1.00 30.13 C ATOM 505 CD PRO A 745 6.781 -17.710 0.056 1.00 23.04 C ATOM 0 HA PRO A 745 4.407 -19.037 1.776 1.00 31.45 H new ATOM 0 HB2 PRO A 745 4.445 -19.830 -0.930 1.00 52.32 H new ATOM 0 HB3 PRO A 745 4.032 -18.190 -0.471 1.00 52.32 H new ATOM 0 HG2 PRO A 745 6.696 -19.284 -1.382 1.00 30.13 H new ATOM 0 HG3 PRO A 745 5.889 -17.810 -1.880 1.00 30.13 H new ATOM 0 HD2 PRO A 745 7.863 -17.718 -0.080 1.00 23.04 H new ATOM 0 HD3 PRO A 745 6.472 -16.665 0.089 1.00 23.04 H new ATOM 513 N LEU A 746 6.089 -21.331 0.246 1.00 72.14 N ATOM 514 CA LEU A 746 6.259 -22.748 0.188 1.00 74.55 C ATOM 515 C LEU A 746 7.586 -23.161 0.766 1.00 72.14 C ATOM 516 O LEU A 746 7.681 -24.147 1.506 1.00 33.50 O ATOM 517 CB LEU A 746 6.136 -23.203 -1.257 1.00 50.23 C ATOM 518 CG LEU A 746 6.497 -24.655 -1.560 1.00 54.42 C ATOM 519 CD1 LEU A 746 5.574 -25.611 -0.814 1.00 1.44 C ATOM 520 CD2 LEU A 746 6.437 -24.906 -3.050 1.00 3.23 C ATOM 0 H LEU A 746 6.505 -20.827 -0.537 1.00 72.14 H new ATOM 0 HA LEU A 746 5.483 -23.224 0.787 1.00 74.55 H new ATOM 0 HB2 LEU A 746 5.108 -23.035 -1.578 1.00 50.23 H new ATOM 0 HB3 LEU A 746 6.770 -22.562 -1.869 1.00 50.23 H new ATOM 0 HG LEU A 746 7.515 -24.837 -1.217 1.00 54.42 H new ATOM 0 HD11 LEU A 746 5.851 -26.639 -1.046 1.00 1.44 H new ATOM 0 HD12 LEU A 746 5.667 -25.443 0.259 1.00 1.44 H new ATOM 0 HD13 LEU A 746 4.543 -25.435 -1.121 1.00 1.44 H new ATOM 0 HD21 LEU A 746 6.696 -25.945 -3.255 1.00 3.23 H new ATOM 0 HD22 LEU A 746 5.429 -24.705 -3.412 1.00 3.23 H new ATOM 0 HD23 LEU A 746 7.143 -24.249 -3.558 1.00 3.23 H new HETATM 532 N PTR A 747 8.593 -22.415 0.446 1.00 54.15 N HETATM 533 CA PTR A 747 9.910 -22.690 0.889 1.00 30.23 C HETATM 534 C PTR A 747 10.669 -21.439 0.858 1.00 54.12 C HETATM 535 O PTR A 747 11.079 -20.910 1.881 1.00 54.20 O HETATM 536 CB PTR A 747 10.563 -23.707 -0.060 1.00 55.21 C HETATM 537 CG PTR A 747 11.934 -24.141 0.334 1.00 13.11 C HETATM 538 CD1 PTR A 747 13.016 -23.756 -0.404 1.00 52.04 C HETATM 539 CD2 PTR A 747 12.140 -24.936 1.443 1.00 33.45 C HETATM 540 CE1 PTR A 747 14.298 -24.148 -0.056 1.00 44.34 C HETATM 541 CE2 PTR A 747 13.403 -25.335 1.809 1.00 73.05 C HETATM 542 CZ PTR A 747 14.483 -24.943 1.062 1.00 62.34 C HETATM 543 OH PTR A 747 15.781 -25.360 1.444 1.00 39.89 O HETATM 544 P PTR A 747 17.099 -24.494 1.316 1.00 39.89 P HETATM 545 O1P PTR A 747 17.754 -24.811 -0.010 1.00 39.89 O HETATM 546 O2P PTR A 747 18.075 -24.977 2.418 1.00 39.89 O HETATM 547 O3P PTR A 747 16.617 -23.149 1.488 1.00 39.89 O HETATM 0 HE2 PTR A 747 13.545 -25.961 2.690 1.00 73.05 H new HETATM 0 HE1 PTR A 747 15.152 -23.834 -0.656 1.00 44.34 H new HETATM 0 HD2 PTR A 747 11.285 -25.253 2.040 1.00 33.45 H new HETATM 0 HD1 PTR A 747 12.868 -23.129 -1.283 1.00 52.04 H new HETATM 0 HB3 PTR A 747 9.923 -24.587 -0.123 1.00 55.21 H new HETATM 0 HB2 PTR A 747 10.608 -23.273 -1.059 1.00 55.21 H new HETATM 0 HA PTR A 747 9.895 -23.101 1.899 1.00 30.23 H new HETATM 0 H PTR A 747 8.333 -21.466 0.177 1.00 54.15 H new ATOM 556 N LYS A 748 10.846 -20.963 -0.316 1.00 33.54 N ATOM 557 CA LYS A 748 11.460 -19.779 -0.573 1.00 10.41 C ATOM 558 C LYS A 748 10.581 -18.967 -1.493 1.00 13.24 C ATOM 559 O LYS A 748 9.427 -19.347 -1.757 1.00 45.42 O ATOM 560 CB LYS A 748 12.776 -20.052 -1.223 1.00 23.15 C ATOM 561 CG LYS A 748 13.961 -19.804 -0.336 1.00 41.11 C ATOM 562 CD LYS A 748 14.049 -20.797 0.813 1.00 35.44 C ATOM 563 CE LYS A 748 15.174 -20.439 1.764 1.00 75.41 C ATOM 564 NZ LYS A 748 15.368 -21.464 2.809 1.00 33.54 N ATOM 0 H LYS A 748 10.534 -21.446 -1.159 1.00 33.54 H new ATOM 0 HA LYS A 748 11.625 -19.222 0.349 1.00 10.41 H new ATOM 0 HB2 LYS A 748 12.796 -21.090 -1.556 1.00 23.15 H new ATOM 0 HB3 LYS A 748 12.865 -19.429 -2.113 1.00 23.15 H new ATOM 0 HG2 LYS A 748 14.873 -19.860 -0.930 1.00 41.11 H new ATOM 0 HG3 LYS A 748 13.904 -18.793 0.066 1.00 41.11 H new ATOM 0 HD2 LYS A 748 13.103 -20.815 1.355 1.00 35.44 H new ATOM 0 HD3 LYS A 748 14.209 -21.800 0.418 1.00 35.44 H new ATOM 0 HE2 LYS A 748 16.099 -20.317 1.200 1.00 75.41 H new ATOM 0 HE3 LYS A 748 14.959 -19.479 2.234 1.00 75.41 H new ATOM 0 HZ1 LYS A 748 15.998 -21.092 3.548 1.00 33.54 H new ATOM 0 HZ2 LYS A 748 14.449 -21.710 3.229 1.00 33.54 H new ATOM 0 HZ3 LYS A 748 15.794 -22.314 2.387 1.00 33.54 H new ATOM 578 N GLU A 749 11.091 -17.879 -1.970 1.00 65.54 N ATOM 579 CA GLU A 749 10.336 -16.994 -2.838 1.00 52.43 C ATOM 580 C GLU A 749 10.154 -17.612 -4.217 1.00 33.22 C ATOM 581 O GLU A 749 9.024 -17.763 -4.707 1.00 45.13 O ATOM 582 CB GLU A 749 11.035 -15.631 -2.943 1.00 60.53 C ATOM 583 CG GLU A 749 10.265 -14.588 -3.723 1.00 62.42 C ATOM 584 CD GLU A 749 8.870 -14.386 -3.195 1.00 53.13 C ATOM 585 OE1 GLU A 749 8.721 -14.038 -2.008 1.00 51.14 O ATOM 586 OE2 GLU A 749 7.908 -14.568 -3.967 1.00 32.24 O ATOM 0 H GLU A 749 12.042 -17.566 -1.777 1.00 65.54 H new ATOM 0 HA GLU A 749 9.347 -16.846 -2.403 1.00 52.43 H new ATOM 0 HB2 GLU A 749 11.218 -15.252 -1.937 1.00 60.53 H new ATOM 0 HB3 GLU A 749 12.009 -15.772 -3.412 1.00 60.53 H new ATOM 0 HG2 GLU A 749 10.804 -13.641 -3.687 1.00 62.42 H new ATOM 0 HG3 GLU A 749 10.214 -14.887 -4.770 1.00 62.42 H new ATOM 593 N ALA A 750 11.254 -17.988 -4.827 1.00 15.53 N ATOM 594 CA ALA A 750 11.248 -18.527 -6.179 1.00 74.52 C ATOM 595 C ALA A 750 10.527 -19.877 -6.263 1.00 65.11 C ATOM 596 O ALA A 750 10.102 -20.285 -7.336 1.00 64.41 O ATOM 597 CB ALA A 750 12.664 -18.645 -6.709 1.00 12.32 C ATOM 0 H ALA A 750 12.181 -17.931 -4.405 1.00 15.53 H new ATOM 0 HA ALA A 750 10.692 -17.827 -6.803 1.00 74.52 H new ATOM 0 HB1 ALA A 750 12.641 -19.050 -7.721 1.00 12.32 H new ATOM 0 HB2 ALA A 750 13.131 -17.660 -6.722 1.00 12.32 H new ATOM 0 HB3 ALA A 750 13.239 -19.310 -6.065 1.00 12.32 H new ATOM 603 N THR A 751 10.376 -20.552 -5.123 1.00 51.01 N ATOM 604 CA THR A 751 9.742 -21.871 -5.086 1.00 72.04 C ATOM 605 C THR A 751 8.284 -21.791 -5.542 1.00 12.35 C ATOM 606 O THR A 751 7.722 -22.764 -6.034 1.00 61.13 O ATOM 607 CB THR A 751 9.779 -22.462 -3.674 1.00 21.24 C ATOM 608 OG1 THR A 751 10.881 -21.911 -2.959 1.00 12.12 O ATOM 609 CG2 THR A 751 9.935 -23.972 -3.736 1.00 41.13 C ATOM 0 H THR A 751 10.684 -20.208 -4.213 1.00 51.01 H new ATOM 0 HA THR A 751 10.304 -22.513 -5.764 1.00 72.04 H new ATOM 0 HB THR A 751 8.844 -22.219 -3.168 1.00 21.24 H new ATOM 0 HG1 THR A 751 11.625 -22.549 -2.962 1.00 12.12 H new ATOM 0 HG21 THR A 751 9.960 -24.377 -2.724 1.00 41.13 H new ATOM 0 HG22 THR A 751 9.094 -24.403 -4.279 1.00 41.13 H new ATOM 0 HG23 THR A 751 10.864 -24.221 -4.249 1.00 41.13 H new ATOM 617 N SER A 752 7.689 -20.626 -5.377 1.00 15.44 N ATOM 618 CA SER A 752 6.323 -20.424 -5.747 1.00 52.14 C ATOM 619 C SER A 752 6.172 -20.448 -7.279 1.00 73.04 C ATOM 620 O SER A 752 5.256 -21.078 -7.814 1.00 30.04 O ATOM 621 CB SER A 752 5.805 -19.092 -5.163 1.00 10.14 C ATOM 622 OG SER A 752 4.412 -18.921 -5.394 1.00 74.25 O ATOM 0 H SER A 752 8.146 -19.803 -4.984 1.00 15.44 H new ATOM 0 HA SER A 752 5.723 -21.236 -5.335 1.00 52.14 H new ATOM 0 HB2 SER A 752 6.002 -19.064 -4.091 1.00 10.14 H new ATOM 0 HB3 SER A 752 6.352 -18.262 -5.610 1.00 10.14 H new ATOM 0 HG SER A 752 4.119 -18.069 -5.010 1.00 74.25 H new ATOM 628 N THR A 753 7.078 -19.789 -7.971 1.00 25.42 N ATOM 629 CA THR A 753 7.013 -19.723 -9.405 1.00 2.04 C ATOM 630 C THR A 753 7.719 -20.942 -10.085 1.00 74.33 C ATOM 631 O THR A 753 7.120 -21.613 -10.930 1.00 3.54 O ATOM 632 CB THR A 753 7.548 -18.351 -9.969 1.00 2.23 C ATOM 633 OG1 THR A 753 7.536 -18.355 -11.407 1.00 14.14 O ATOM 634 CG2 THR A 753 8.953 -18.040 -9.456 1.00 4.24 C ATOM 0 H THR A 753 7.867 -19.293 -7.557 1.00 25.42 H new ATOM 0 HA THR A 753 5.956 -19.780 -9.665 1.00 2.04 H new ATOM 0 HB THR A 753 6.879 -17.569 -9.611 1.00 2.23 H new ATOM 0 HG1 THR A 753 7.870 -17.496 -11.739 1.00 14.14 H new ATOM 0 HG21 THR A 753 9.287 -17.087 -9.866 1.00 4.24 H new ATOM 0 HG22 THR A 753 8.938 -17.981 -8.368 1.00 4.24 H new ATOM 0 HG23 THR A 753 9.637 -18.829 -9.768 1.00 4.24 H new ATOM 642 N PHE A 754 8.975 -21.234 -9.685 1.00 54.45 N ATOM 643 CA PHE A 754 9.734 -22.352 -10.279 1.00 14.15 C ATOM 644 C PHE A 754 11.003 -22.677 -9.467 1.00 35.13 C ATOM 645 O PHE A 754 11.826 -21.789 -9.184 1.00 64.41 O ATOM 646 CB PHE A 754 10.095 -22.069 -11.785 1.00 31.33 C ATOM 647 CG PHE A 754 10.978 -20.849 -12.022 1.00 11.44 C ATOM 648 CD1 PHE A 754 10.421 -19.598 -12.199 1.00 22.22 C ATOM 649 CD2 PHE A 754 12.357 -20.973 -12.071 1.00 53.32 C ATOM 650 CE1 PHE A 754 11.220 -18.492 -12.418 1.00 10.43 C ATOM 651 CE2 PHE A 754 13.157 -19.872 -12.291 1.00 20.42 C ATOM 652 CZ PHE A 754 12.588 -18.631 -12.464 1.00 11.34 C ATOM 0 H PHE A 754 9.478 -20.718 -8.963 1.00 54.45 H new ATOM 0 HA PHE A 754 9.085 -23.227 -10.246 1.00 14.15 H new ATOM 0 HB2 PHE A 754 10.598 -22.946 -12.193 1.00 31.33 H new ATOM 0 HB3 PHE A 754 9.169 -21.942 -12.346 1.00 31.33 H new ATOM 0 HD1 PHE A 754 9.348 -19.482 -12.166 1.00 22.22 H new ATOM 0 HD2 PHE A 754 12.811 -21.944 -11.935 1.00 53.32 H new ATOM 0 HE1 PHE A 754 10.771 -17.519 -12.553 1.00 10.43 H new ATOM 0 HE2 PHE A 754 14.231 -19.983 -12.328 1.00 20.42 H new ATOM 0 HZ PHE A 754 13.214 -17.768 -12.636 1.00 11.34 H new ATOM 662 N THR A 755 11.143 -23.930 -9.084 1.00 34.23 N ATOM 663 CA THR A 755 12.321 -24.410 -8.360 1.00 11.42 C ATOM 664 C THR A 755 12.443 -25.944 -8.471 1.00 72.35 C ATOM 665 O THR A 755 11.496 -26.672 -8.189 1.00 33.44 O ATOM 666 CB THR A 755 12.285 -24.003 -6.842 1.00 3.11 C ATOM 667 OG1 THR A 755 12.313 -22.571 -6.714 1.00 0.44 O ATOM 668 CG2 THR A 755 13.473 -24.588 -6.098 1.00 34.02 C ATOM 0 H THR A 755 10.446 -24.653 -9.263 1.00 34.23 H new ATOM 0 HA THR A 755 13.188 -23.938 -8.822 1.00 11.42 H new ATOM 0 HB THR A 755 11.364 -24.396 -6.410 1.00 3.11 H new ATOM 0 HG1 THR A 755 12.463 -22.167 -7.594 1.00 0.44 H new ATOM 0 HG21 THR A 755 13.427 -24.293 -5.050 1.00 34.02 H new ATOM 0 HG22 THR A 755 13.448 -25.675 -6.171 1.00 34.02 H new ATOM 0 HG23 THR A 755 14.398 -24.216 -6.539 1.00 34.02 H new ATOM 676 N ASN A 756 13.608 -26.405 -8.890 1.00 31.22 N ATOM 677 CA ASN A 756 13.888 -27.818 -8.995 1.00 63.51 C ATOM 678 C ASN A 756 14.419 -28.340 -7.678 1.00 73.01 C ATOM 679 O ASN A 756 15.618 -28.293 -7.409 1.00 62.35 O ATOM 680 CB ASN A 756 14.891 -28.098 -10.144 1.00 70.52 C ATOM 681 CG ASN A 756 15.253 -29.577 -10.278 1.00 13.10 C ATOM 682 OD1 ASN A 756 14.552 -30.341 -10.933 1.00 12.54 O ATOM 683 ND2 ASN A 756 16.358 -29.972 -9.686 1.00 5.43 N ATOM 0 H ASN A 756 14.385 -25.805 -9.167 1.00 31.22 H new ATOM 0 HA ASN A 756 12.960 -28.340 -9.228 1.00 63.51 H new ATOM 0 HB2 ASN A 756 14.464 -27.748 -11.084 1.00 70.52 H new ATOM 0 HB3 ASN A 756 15.800 -27.522 -9.973 1.00 70.52 H new ATOM 0 HD21 ASN A 756 16.659 -30.944 -9.763 1.00 5.43 H new ATOM 0 HD22 ASN A 756 16.915 -29.307 -9.150 1.00 5.43 H new ATOM 690 N ILE A 757 13.532 -28.803 -6.864 1.00 2.14 N ATOM 691 CA ILE A 757 13.872 -29.302 -5.535 1.00 74.40 C ATOM 692 C ILE A 757 14.071 -30.819 -5.531 1.00 41.24 C ATOM 693 O ILE A 757 13.966 -31.462 -4.486 1.00 13.22 O ATOM 694 CB ILE A 757 12.777 -28.941 -4.493 1.00 31.21 C ATOM 695 CG1 ILE A 757 11.395 -29.449 -4.949 1.00 54.21 C ATOM 696 CG2 ILE A 757 12.752 -27.444 -4.235 1.00 63.23 C ATOM 697 CD1 ILE A 757 10.291 -29.217 -3.935 1.00 71.25 C ATOM 0 H ILE A 757 12.538 -28.855 -7.085 1.00 2.14 H new ATOM 0 HA ILE A 757 14.809 -28.818 -5.260 1.00 74.40 H new ATOM 0 HB ILE A 757 13.022 -29.440 -3.555 1.00 31.21 H new ATOM 0 HG12 ILE A 757 11.127 -28.955 -5.883 1.00 54.21 H new ATOM 0 HG13 ILE A 757 11.462 -30.516 -5.161 1.00 54.21 H new ATOM 0 HG21 ILE A 757 11.978 -27.214 -3.503 1.00 63.23 H new ATOM 0 HG22 ILE A 757 13.721 -27.125 -3.852 1.00 63.23 H new ATOM 0 HG23 ILE A 757 12.539 -26.918 -5.166 1.00 63.23 H new ATOM 0 HD11 ILE A 757 9.350 -29.601 -4.328 1.00 71.25 H new ATOM 0 HD12 ILE A 757 10.535 -29.734 -3.007 1.00 71.25 H new ATOM 0 HD13 ILE A 757 10.194 -28.149 -3.741 1.00 71.25 H new ATOM 709 N THR A 758 14.365 -31.378 -6.680 1.00 21.44 N ATOM 710 CA THR A 758 14.548 -32.806 -6.798 1.00 74.21 C ATOM 711 C THR A 758 15.778 -33.283 -5.983 1.00 60.44 C ATOM 712 O THR A 758 15.698 -34.265 -5.236 1.00 2.11 O ATOM 713 CB THR A 758 14.707 -33.219 -8.266 1.00 41.25 C ATOM 714 OG1 THR A 758 13.665 -32.597 -9.048 1.00 51.04 O ATOM 715 CG2 THR A 758 14.599 -34.728 -8.405 1.00 41.45 C ATOM 0 H THR A 758 14.483 -30.863 -7.552 1.00 21.44 H new ATOM 0 HA THR A 758 13.656 -33.283 -6.392 1.00 74.21 H new ATOM 0 HB THR A 758 15.687 -32.899 -8.620 1.00 41.25 H new ATOM 0 HG1 THR A 758 14.053 -31.894 -9.610 1.00 51.04 H new ATOM 0 HG21 THR A 758 14.714 -35.006 -9.453 1.00 41.45 H new ATOM 0 HG22 THR A 758 15.382 -35.205 -7.815 1.00 41.45 H new ATOM 0 HG23 THR A 758 13.624 -35.057 -8.047 1.00 41.45 H new HETATM 723 N PTR A 759 16.887 -32.570 -6.117 1.00 51.25 N HETATM 724 CA PTR A 759 18.107 -32.917 -5.409 1.00 44.35 C HETATM 725 C PTR A 759 18.102 -32.316 -3.996 1.00 53.44 C HETATM 726 O PTR A 759 18.433 -32.993 -3.021 1.00 44.31 O HETATM 727 CB PTR A 759 19.344 -32.451 -6.204 1.00 13.44 C HETATM 728 CG PTR A 759 20.665 -32.720 -5.515 1.00 10.14 C HETATM 729 CD1 PTR A 759 21.148 -34.009 -5.375 1.00 3.41 C HETATM 730 CD2 PTR A 759 21.423 -31.682 -5.014 1.00 30.24 C HETATM 731 CE1 PTR A 759 22.353 -34.255 -4.745 1.00 73.20 C HETATM 732 CE2 PTR A 759 22.622 -31.913 -4.388 1.00 30.24 C HETATM 733 CZ PTR A 759 23.087 -33.202 -4.254 1.00 41.00 C HETATM 734 OH PTR A 759 24.317 -33.449 -3.604 1.00 39.89 O HETATM 735 P PTR A 759 25.498 -32.427 -3.500 1.00 39.89 P HETATM 736 O1P PTR A 759 25.675 -31.747 -4.852 1.00 39.89 O HETATM 737 O2P PTR A 759 26.793 -33.233 -3.238 1.00 39.89 O HETATM 738 O3P PTR A 759 25.073 -31.583 -2.390 1.00 39.89 O HETATM 0 HE2 PTR A 759 23.205 -31.078 -3.998 1.00 30.24 H new HETATM 0 HE1 PTR A 759 22.719 -35.276 -4.638 1.00 73.20 H new HETATM 0 HD2 PTR A 759 21.063 -30.659 -5.117 1.00 30.24 H new HETATM 0 HD1 PTR A 759 20.568 -34.844 -5.768 1.00 3.41 H new HETATM 0 HB3 PTR A 759 19.346 -32.948 -7.174 1.00 13.44 H new HETATM 0 HB2 PTR A 759 19.258 -31.381 -6.394 1.00 13.44 H new HETATM 0 HA PTR A 759 18.155 -34.002 -5.313 1.00 44.35 H new ATOM 747 N ARG A 760 17.736 -31.056 -3.902 1.00 24.04 N ATOM 748 CA ARG A 760 17.608 -30.388 -2.614 1.00 74.32 C ATOM 749 C ARG A 760 16.209 -29.846 -2.440 1.00 3.10 C ATOM 750 O ARG A 760 15.845 -28.820 -3.037 1.00 52.10 O ATOM 751 CB ARG A 760 18.638 -29.255 -2.466 1.00 35.45 C ATOM 752 CG ARG A 760 20.083 -29.723 -2.449 1.00 24.25 C ATOM 753 CD ARG A 760 20.356 -30.660 -1.279 1.00 62.01 C ATOM 754 NE ARG A 760 21.715 -31.204 -1.324 1.00 74.34 N ATOM 755 CZ ARG A 760 22.125 -32.301 -0.671 1.00 0.10 C ATOM 756 NH1 ARG A 760 21.287 -32.960 0.130 1.00 31.14 N ATOM 757 NH2 ARG A 760 23.366 -32.736 -0.825 1.00 62.40 N ATOM 0 H ARG A 760 17.519 -30.466 -4.705 1.00 24.04 H new ATOM 0 HA ARG A 760 17.803 -31.125 -1.835 1.00 74.32 H new ATOM 0 HB2 ARG A 760 18.506 -28.550 -3.287 1.00 35.45 H new ATOM 0 HB3 ARG A 760 18.433 -28.712 -1.543 1.00 35.45 H new ATOM 0 HG2 ARG A 760 20.312 -30.233 -3.385 1.00 24.25 H new ATOM 0 HG3 ARG A 760 20.745 -28.859 -2.386 1.00 24.25 H new ATOM 0 HD2 ARG A 760 20.210 -30.123 -0.342 1.00 62.01 H new ATOM 0 HD3 ARG A 760 19.636 -31.478 -1.293 1.00 62.01 H new ATOM 0 HE ARG A 760 22.401 -30.711 -1.895 1.00 74.34 H new ATOM 0 HH11 ARG A 760 20.329 -32.630 0.248 1.00 31.14 H new ATOM 0 HH12 ARG A 760 21.604 -33.794 0.624 1.00 31.14 H new ATOM 0 HH21 ARG A 760 24.009 -32.237 -1.440 1.00 62.40 H new ATOM 0 HH22 ARG A 760 23.679 -33.570 -0.329 1.00 62.40 H new ATOM 771 N GLY A 761 15.426 -30.531 -1.650 1.00 52.04 N ATOM 772 CA GLY A 761 14.056 -30.129 -1.423 1.00 31.34 C ATOM 773 C GLY A 761 13.136 -31.319 -1.284 1.00 24.11 C ATOM 774 O GLY A 761 11.996 -31.188 -0.824 1.00 12.35 O ATOM 0 H GLY A 761 15.711 -31.373 -1.150 1.00 52.04 H new ATOM 0 HA2 GLY A 761 14.001 -29.520 -0.521 1.00 31.34 H new ATOM 0 HA3 GLY A 761 13.719 -29.504 -2.250 1.00 31.34 H new ATOM 778 N THR A 762 13.619 -32.469 -1.687 1.00 34.03 N ATOM 779 CA THR A 762 12.877 -33.693 -1.583 1.00 0.33 C ATOM 780 C THR A 762 13.642 -34.694 -0.702 1.00 55.12 C ATOM 781 O THR A 762 13.213 -34.929 0.451 1.00 2.24 O ATOM 782 CB THR A 762 12.639 -34.316 -2.977 1.00 22.13 C ATOM 783 OG1 THR A 762 12.094 -33.312 -3.867 1.00 62.24 O ATOM 784 CG2 THR A 762 11.663 -35.487 -2.884 1.00 31.21 C ATOM 785 OXT THR A 762 14.696 -35.207 -1.158 1.00 39.89 O ATOM 0 H THR A 762 14.546 -32.578 -2.099 1.00 34.03 H new ATOM 0 HA THR A 762 11.911 -33.467 -1.132 1.00 0.33 H new ATOM 0 HB THR A 762 13.591 -34.681 -3.362 1.00 22.13 H new ATOM 0 HG1 THR A 762 12.782 -32.642 -4.065 1.00 62.24 H new ATOM 0 HG21 THR A 762 11.509 -35.912 -3.876 1.00 31.21 H new ATOM 0 HG22 THR A 762 12.072 -36.250 -2.222 1.00 31.21 H new ATOM 0 HG23 THR A 762 10.710 -35.136 -2.488 1.00 31.21 H new TER 793 THR A 762