USER MOD reduce.3.24.130724 H: found=0, std=0, add=388, rem=0, adj=12 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 Set 1.1: A 752 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 756 ASN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 716 LYS NZ :NH3+ 169:sc=-0.000986 (180deg=-0.133) USER MOD Single : A 720 THR OG1 : rot 180:sc= 0 USER MOD Single : A 722 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 725 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 729 LYS NZ :NH3+ 166:sc= 1.15 (180deg=0.967) USER MOD Single : A 738 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.1) USER MOD Single : A 741 THR OG1 : rot 180:sc= 0 USER MOD Single : A 743 ASN : amide:sc= -0.443 X(o=-0.44,f=-0.32) USER MOD Single : A 744 ASN : amide:sc= -4.69! C(o=-4.7!,f=-9.4!) USER MOD Single : A 748 LYS NZ :NH3+ 178:sc= 0.419 (180deg=0.411) USER MOD Single : A 751 THR OG1 : rot 180:sc= 0.544 USER MOD Single : A 753 THR OG1 : rot -87:sc= 1.28 USER MOD Single : A 755 THR OG1 : rot 45:sc= 0.159 USER MOD Single : A 758 THR OG1 : rot 180:sc= 0 USER MOD Single : A 762 THR OG1 : rot 47:sc= 0.14 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 716 -0.385 -4.199 1.751 1.00 13.00 N ATOM 2 CA LYS A 716 0.811 -3.683 1.077 1.00 3.51 C ATOM 3 C LYS A 716 1.614 -4.792 0.404 1.00 5.21 C ATOM 4 O LYS A 716 2.604 -4.524 -0.280 1.00 51.41 O ATOM 5 CB LYS A 716 1.712 -2.861 2.065 1.00 0.34 C ATOM 6 CG LYS A 716 1.917 -3.494 3.474 1.00 65.24 C ATOM 7 CD LYS A 716 2.673 -4.828 3.425 1.00 41.03 C ATOM 8 CE LYS A 716 4.093 -4.664 2.904 1.00 23.23 C ATOM 9 NZ LYS A 716 4.918 -3.810 3.787 1.00 5.03 N ATOM 0 HA LYS A 716 0.466 -3.010 0.292 1.00 3.51 H new ATOM 0 HB2 LYS A 716 2.690 -2.719 1.604 1.00 0.34 H new ATOM 0 HB3 LYS A 716 1.273 -1.872 2.191 1.00 0.34 H new ATOM 0 HG2 LYS A 716 2.465 -2.794 4.105 1.00 65.24 H new ATOM 0 HG3 LYS A 716 0.945 -3.650 3.942 1.00 65.24 H new ATOM 0 HD2 LYS A 716 2.702 -5.264 4.423 1.00 41.03 H new ATOM 0 HD3 LYS A 716 2.132 -5.527 2.787 1.00 41.03 H new ATOM 0 HE2 LYS A 716 4.559 -5.645 2.811 1.00 23.23 H new ATOM 0 HE3 LYS A 716 4.064 -4.229 1.905 1.00 23.23 H new ATOM 0 HZ1 LYS A 716 5.916 -3.876 3.500 1.00 5.03 H new ATOM 0 HZ2 LYS A 716 4.600 -2.823 3.711 1.00 5.03 H new ATOM 0 HZ3 LYS A 716 4.819 -4.131 4.771 1.00 5.03 H new ATOM 23 N LEU A 717 1.192 -6.024 0.589 1.00 11.23 N ATOM 24 CA LEU A 717 1.926 -7.157 0.075 1.00 74.00 C ATOM 25 C LEU A 717 1.847 -7.223 -1.447 1.00 25.32 C ATOM 26 O LEU A 717 2.845 -7.476 -2.108 1.00 55.14 O ATOM 27 CB LEU A 717 1.433 -8.453 0.715 1.00 74.02 C ATOM 28 CG LEU A 717 2.178 -9.736 0.321 1.00 63.35 C ATOM 29 CD1 LEU A 717 3.638 -9.660 0.735 1.00 1.34 C ATOM 30 CD2 LEU A 717 1.510 -10.949 0.942 1.00 64.43 C ATOM 0 H LEU A 717 0.340 -6.266 1.094 1.00 11.23 H new ATOM 0 HA LEU A 717 2.976 -7.029 0.340 1.00 74.00 H new ATOM 0 HB2 LEU A 717 1.492 -8.343 1.798 1.00 74.02 H new ATOM 0 HB3 LEU A 717 0.380 -8.579 0.464 1.00 74.02 H new ATOM 0 HG LEU A 717 2.137 -9.836 -0.764 1.00 63.35 H new ATOM 0 HD11 LEU A 717 4.147 -10.580 0.446 1.00 1.34 H new ATOM 0 HD12 LEU A 717 4.113 -8.812 0.241 1.00 1.34 H new ATOM 0 HD13 LEU A 717 3.704 -9.533 1.816 1.00 1.34 H new ATOM 0 HD21 LEU A 717 2.051 -11.850 0.653 1.00 64.43 H new ATOM 0 HD22 LEU A 717 1.519 -10.853 2.028 1.00 64.43 H new ATOM 0 HD23 LEU A 717 0.480 -11.016 0.592 1.00 64.43 H new ATOM 42 N LEU A 718 0.663 -6.953 -1.996 1.00 50.51 N ATOM 43 CA LEU A 718 0.471 -6.968 -3.458 1.00 32.43 C ATOM 44 C LEU A 718 1.378 -5.960 -4.133 1.00 13.03 C ATOM 45 O LEU A 718 1.939 -6.222 -5.204 1.00 72.05 O ATOM 46 CB LEU A 718 -1.007 -6.698 -3.849 1.00 3.50 C ATOM 47 CG LEU A 718 -2.011 -7.851 -3.630 1.00 62.21 C ATOM 48 CD1 LEU A 718 -2.226 -8.124 -2.159 1.00 0.14 C ATOM 49 CD2 LEU A 718 -3.332 -7.548 -4.318 1.00 44.21 C ATOM 0 H LEU A 718 -0.175 -6.722 -1.462 1.00 50.51 H new ATOM 0 HA LEU A 718 0.733 -7.968 -3.804 1.00 32.43 H new ATOM 0 HB2 LEU A 718 -1.355 -5.834 -3.283 1.00 3.50 H new ATOM 0 HB3 LEU A 718 -1.034 -6.421 -4.903 1.00 3.50 H new ATOM 0 HG LEU A 718 -1.586 -8.751 -4.075 1.00 62.21 H new ATOM 0 HD11 LEU A 718 -2.938 -8.941 -2.041 1.00 0.14 H new ATOM 0 HD12 LEU A 718 -1.278 -8.400 -1.698 1.00 0.14 H new ATOM 0 HD13 LEU A 718 -2.618 -7.229 -1.676 1.00 0.14 H new ATOM 0 HD21 LEU A 718 -4.026 -8.372 -4.152 1.00 44.21 H new ATOM 0 HD22 LEU A 718 -3.754 -6.630 -3.908 1.00 44.21 H new ATOM 0 HD23 LEU A 718 -3.165 -7.424 -5.388 1.00 44.21 H new ATOM 61 N ILE A 719 1.531 -4.823 -3.513 1.00 12.53 N ATOM 62 CA ILE A 719 2.379 -3.784 -4.045 1.00 31.25 C ATOM 63 C ILE A 719 3.860 -4.121 -3.838 1.00 60.51 C ATOM 64 O ILE A 719 4.680 -3.949 -4.751 1.00 0.23 O ATOM 65 CB ILE A 719 2.059 -2.399 -3.407 1.00 21.10 C ATOM 66 CG1 ILE A 719 0.579 -2.029 -3.637 1.00 13.53 C ATOM 67 CG2 ILE A 719 2.980 -1.314 -3.966 1.00 14.34 C ATOM 68 CD1 ILE A 719 0.161 -2.018 -5.099 1.00 53.21 C ATOM 0 H ILE A 719 1.076 -4.588 -2.631 1.00 12.53 H new ATOM 0 HA ILE A 719 2.176 -3.724 -5.114 1.00 31.25 H new ATOM 0 HB ILE A 719 2.235 -2.469 -2.334 1.00 21.10 H new ATOM 0 HG12 ILE A 719 -0.049 -2.737 -3.096 1.00 13.53 H new ATOM 0 HG13 ILE A 719 0.391 -1.044 -3.209 1.00 13.53 H new ATOM 0 HG21 ILE A 719 2.736 -0.357 -3.505 1.00 14.34 H new ATOM 0 HG22 ILE A 719 4.017 -1.569 -3.747 1.00 14.34 H new ATOM 0 HG23 ILE A 719 2.844 -1.242 -5.045 1.00 14.34 H new ATOM 0 HD11 ILE A 719 -0.893 -1.749 -5.174 1.00 53.21 H new ATOM 0 HD12 ILE A 719 0.762 -1.289 -5.644 1.00 53.21 H new ATOM 0 HD13 ILE A 719 0.314 -3.008 -5.529 1.00 53.21 H new ATOM 80 N THR A 720 4.195 -4.636 -2.651 1.00 54.24 N ATOM 81 CA THR A 720 5.585 -4.927 -2.310 1.00 13.21 C ATOM 82 C THR A 720 6.171 -6.011 -3.227 1.00 24.24 C ATOM 83 O THR A 720 7.368 -6.100 -3.387 1.00 12.45 O ATOM 84 CB THR A 720 5.754 -5.334 -0.800 1.00 44.32 C ATOM 85 OG1 THR A 720 7.050 -4.922 -0.316 1.00 43.31 O ATOM 86 CG2 THR A 720 5.616 -6.839 -0.615 1.00 62.22 C ATOM 0 H THR A 720 3.524 -4.858 -1.915 1.00 54.24 H new ATOM 0 HA THR A 720 6.143 -4.004 -2.466 1.00 13.21 H new ATOM 0 HB THR A 720 4.967 -4.835 -0.234 1.00 44.32 H new ATOM 0 HG1 THR A 720 7.144 -5.179 0.625 1.00 43.31 H new ATOM 0 HG21 THR A 720 5.738 -7.089 0.439 1.00 62.22 H new ATOM 0 HG22 THR A 720 4.630 -7.158 -0.952 1.00 62.22 H new ATOM 0 HG23 THR A 720 6.382 -7.349 -1.199 1.00 62.22 H new ATOM 94 N ILE A 721 5.297 -6.819 -3.830 1.00 71.22 N ATOM 95 CA ILE A 721 5.723 -7.830 -4.786 1.00 72.11 C ATOM 96 C ILE A 721 6.469 -7.180 -5.963 1.00 62.21 C ATOM 97 O ILE A 721 7.401 -7.756 -6.520 1.00 74.40 O ATOM 98 CB ILE A 721 4.509 -8.646 -5.326 1.00 73.55 C ATOM 99 CG1 ILE A 721 3.857 -9.463 -4.198 1.00 31.42 C ATOM 100 CG2 ILE A 721 4.923 -9.553 -6.476 1.00 3.52 C ATOM 101 CD1 ILE A 721 4.799 -10.447 -3.522 1.00 13.54 C ATOM 0 H ILE A 721 4.290 -6.789 -3.670 1.00 71.22 H new ATOM 0 HA ILE A 721 6.395 -8.511 -4.264 1.00 72.11 H new ATOM 0 HB ILE A 721 3.774 -7.937 -5.707 1.00 73.55 H new ATOM 0 HG12 ILE A 721 3.465 -8.777 -3.447 1.00 31.42 H new ATOM 0 HG13 ILE A 721 3.007 -10.011 -4.605 1.00 31.42 H new ATOM 0 HG21 ILE A 721 4.055 -10.109 -6.831 1.00 3.52 H new ATOM 0 HG22 ILE A 721 5.325 -8.949 -7.289 1.00 3.52 H new ATOM 0 HG23 ILE A 721 5.686 -10.252 -6.132 1.00 3.52 H new ATOM 0 HD11 ILE A 721 4.264 -10.984 -2.739 1.00 13.54 H new ATOM 0 HD12 ILE A 721 5.172 -11.158 -4.259 1.00 13.54 H new ATOM 0 HD13 ILE A 721 5.637 -9.906 -3.083 1.00 13.54 H new ATOM 113 N HIS A 722 6.071 -5.977 -6.305 1.00 12.23 N ATOM 114 CA HIS A 722 6.691 -5.256 -7.404 1.00 4.13 C ATOM 115 C HIS A 722 8.084 -4.778 -7.033 1.00 75.43 C ATOM 116 O HIS A 722 8.988 -4.774 -7.860 1.00 4.13 O ATOM 117 CB HIS A 722 5.823 -4.063 -7.832 1.00 21.04 C ATOM 118 CG HIS A 722 4.644 -4.430 -8.688 1.00 52.23 C ATOM 119 ND1 HIS A 722 4.486 -3.984 -9.977 1.00 73.33 N ATOM 120 CD2 HIS A 722 3.560 -5.197 -8.428 1.00 4.40 C ATOM 121 CE1 HIS A 722 3.367 -4.454 -10.472 1.00 3.02 C ATOM 122 NE2 HIS A 722 2.783 -5.196 -9.558 1.00 43.21 N ATOM 0 H HIS A 722 5.318 -5.471 -5.839 1.00 12.23 H new ATOM 0 HA HIS A 722 6.777 -5.947 -8.242 1.00 4.13 H new ATOM 0 HB2 HIS A 722 5.463 -3.552 -6.939 1.00 21.04 H new ATOM 0 HB3 HIS A 722 6.445 -3.353 -8.377 1.00 21.04 H new ATOM 0 HD2 HIS A 722 3.347 -5.713 -7.504 1.00 4.40 H new ATOM 0 HE1 HIS A 722 2.988 -4.263 -11.465 1.00 3.02 H new ATOM 0 HE2 HIS A 722 1.898 -5.690 -9.671 1.00 43.21 H new ATOM 131 N ASP A 723 8.259 -4.401 -5.781 1.00 73.02 N ATOM 132 CA ASP A 723 9.525 -3.820 -5.328 1.00 1.43 C ATOM 133 C ASP A 723 10.390 -4.827 -4.594 1.00 12.10 C ATOM 134 O ASP A 723 11.502 -4.502 -4.164 1.00 33.41 O ATOM 135 CB ASP A 723 9.277 -2.603 -4.436 1.00 74.10 C ATOM 136 CG ASP A 723 8.729 -1.422 -5.188 1.00 63.55 C ATOM 137 OD1 ASP A 723 9.484 -0.823 -6.000 1.00 4.34 O ATOM 138 OD2 ASP A 723 7.545 -1.066 -4.971 1.00 31.21 O ATOM 0 H ASP A 723 7.547 -4.483 -5.055 1.00 73.02 H new ATOM 0 HA ASP A 723 10.064 -3.508 -6.223 1.00 1.43 H new ATOM 0 HB2 ASP A 723 8.580 -2.877 -3.644 1.00 74.10 H new ATOM 0 HB3 ASP A 723 10.212 -2.317 -3.954 1.00 74.10 H new ATOM 143 N ARG A 724 9.886 -6.051 -4.452 1.00 45.20 N ATOM 144 CA ARG A 724 10.604 -7.113 -3.732 1.00 52.30 C ATOM 145 C ARG A 724 11.974 -7.384 -4.344 1.00 45.14 C ATOM 146 O ARG A 724 12.928 -7.692 -3.638 1.00 40.41 O ATOM 147 CB ARG A 724 9.770 -8.432 -3.671 1.00 22.32 C ATOM 148 CG ARG A 724 9.674 -9.192 -4.991 1.00 35.43 C ATOM 149 CD ARG A 724 8.890 -10.491 -4.837 1.00 12.35 C ATOM 150 NE ARG A 724 9.532 -11.419 -3.893 1.00 1.04 N ATOM 151 CZ ARG A 724 8.968 -12.544 -3.417 1.00 5.33 C ATOM 152 NH1 ARG A 724 7.786 -12.947 -3.870 1.00 2.15 N ATOM 153 NH2 ARG A 724 9.609 -13.277 -2.521 1.00 53.23 N ATOM 0 H ARG A 724 8.981 -6.337 -4.825 1.00 45.20 H new ATOM 0 HA ARG A 724 10.752 -6.754 -2.713 1.00 52.30 H new ATOM 0 HB2 ARG A 724 10.211 -9.089 -2.921 1.00 22.32 H new ATOM 0 HB3 ARG A 724 8.762 -8.192 -3.332 1.00 22.32 H new ATOM 0 HG2 ARG A 724 9.192 -8.563 -5.739 1.00 35.43 H new ATOM 0 HG3 ARG A 724 10.676 -9.413 -5.358 1.00 35.43 H new ATOM 0 HD2 ARG A 724 7.881 -10.266 -4.493 1.00 12.35 H new ATOM 0 HD3 ARG A 724 8.795 -10.973 -5.810 1.00 12.35 H new ATOM 0 HE ARG A 724 10.475 -11.193 -3.576 1.00 1.04 H new ATOM 0 HH11 ARG A 724 7.300 -12.403 -4.583 1.00 2.15 H new ATOM 0 HH12 ARG A 724 7.364 -13.801 -3.505 1.00 2.15 H new ATOM 0 HH21 ARG A 724 10.530 -12.989 -2.191 1.00 53.23 H new ATOM 0 HH22 ARG A 724 9.182 -14.130 -2.160 1.00 53.23 H new ATOM 167 N LYS A 725 12.067 -7.244 -5.646 1.00 3.12 N ATOM 168 CA LYS A 725 13.281 -7.548 -6.346 1.00 10.52 C ATOM 169 C LYS A 725 14.379 -6.524 -6.043 1.00 74.23 C ATOM 170 O LYS A 725 15.566 -6.843 -6.089 1.00 72.25 O ATOM 171 CB LYS A 725 13.023 -7.663 -7.855 1.00 22.04 C ATOM 172 CG LYS A 725 14.171 -8.290 -8.634 1.00 21.52 C ATOM 173 CD LYS A 725 14.642 -9.588 -7.969 1.00 43.41 C ATOM 174 CE LYS A 725 13.516 -10.620 -7.856 1.00 12.40 C ATOM 175 NZ LYS A 725 13.171 -11.215 -9.170 1.00 70.24 N ATOM 0 H LYS A 725 11.306 -6.918 -6.241 1.00 3.12 H new ATOM 0 HA LYS A 725 13.638 -8.514 -5.990 1.00 10.52 H new ATOM 0 HB2 LYS A 725 12.122 -8.256 -8.015 1.00 22.04 H new ATOM 0 HB3 LYS A 725 12.826 -6.669 -8.256 1.00 22.04 H new ATOM 0 HG2 LYS A 725 13.852 -8.496 -9.656 1.00 21.52 H new ATOM 0 HG3 LYS A 725 15.001 -7.586 -8.695 1.00 21.52 H new ATOM 0 HD2 LYS A 725 15.465 -10.012 -8.545 1.00 43.41 H new ATOM 0 HD3 LYS A 725 15.030 -9.365 -6.975 1.00 43.41 H new ATOM 0 HE2 LYS A 725 13.817 -11.410 -7.168 1.00 12.40 H new ATOM 0 HE3 LYS A 725 12.632 -10.146 -7.430 1.00 12.40 H new ATOM 0 HZ1 LYS A 725 12.405 -11.908 -9.047 1.00 70.24 H new ATOM 0 HZ2 LYS A 725 12.859 -10.465 -9.819 1.00 70.24 H new ATOM 0 HZ3 LYS A 725 14.007 -11.690 -9.566 1.00 70.24 H new ATOM 189 N GLU A 726 13.982 -5.320 -5.727 1.00 32.13 N ATOM 190 CA GLU A 726 14.926 -4.290 -5.404 1.00 20.10 C ATOM 191 C GLU A 726 15.056 -4.127 -3.893 1.00 11.44 C ATOM 192 O GLU A 726 16.073 -4.459 -3.324 1.00 13.34 O ATOM 193 CB GLU A 726 14.525 -2.954 -6.058 1.00 34.12 C ATOM 194 CG GLU A 726 15.512 -1.804 -5.817 1.00 53.13 C ATOM 195 CD GLU A 726 16.901 -2.093 -6.357 1.00 5.31 C ATOM 196 OE1 GLU A 726 17.068 -2.123 -7.589 1.00 30.12 O ATOM 197 OE2 GLU A 726 17.835 -2.274 -5.553 1.00 33.33 O ATOM 0 H GLU A 726 13.005 -5.030 -5.687 1.00 32.13 H new ATOM 0 HA GLU A 726 15.896 -4.588 -5.801 1.00 20.10 H new ATOM 0 HB2 GLU A 726 14.421 -3.107 -7.132 1.00 34.12 H new ATOM 0 HB3 GLU A 726 13.545 -2.660 -5.681 1.00 34.12 H new ATOM 0 HG2 GLU A 726 15.127 -0.898 -6.285 1.00 53.13 H new ATOM 0 HG3 GLU A 726 15.578 -1.607 -4.747 1.00 53.13 H new ATOM 204 N PHE A 727 13.997 -3.656 -3.261 1.00 63.25 N ATOM 205 CA PHE A 727 14.043 -3.279 -1.847 1.00 43.33 C ATOM 206 C PHE A 727 14.005 -4.481 -0.922 1.00 63.53 C ATOM 207 O PHE A 727 14.869 -4.622 -0.048 1.00 53.43 O ATOM 208 CB PHE A 727 12.905 -2.300 -1.510 1.00 43.21 C ATOM 209 CG PHE A 727 12.771 -1.975 -0.029 1.00 13.30 C ATOM 210 CD1 PHE A 727 13.867 -1.585 0.719 1.00 74.33 C ATOM 211 CD2 PHE A 727 11.548 -2.066 0.597 1.00 63.21 C ATOM 212 CE1 PHE A 727 13.737 -1.294 2.059 1.00 71.55 C ATOM 213 CE2 PHE A 727 11.414 -1.775 1.934 1.00 54.14 C ATOM 214 CZ PHE A 727 12.507 -1.386 2.665 1.00 53.24 C ATOM 0 H PHE A 727 13.087 -3.522 -3.701 1.00 63.25 H new ATOM 0 HA PHE A 727 14.999 -2.782 -1.682 1.00 43.33 H new ATOM 0 HB2 PHE A 727 13.066 -1.373 -2.060 1.00 43.21 H new ATOM 0 HB3 PHE A 727 11.964 -2.721 -1.863 1.00 43.21 H new ATOM 0 HD1 PHE A 727 14.835 -1.508 0.247 1.00 74.33 H new ATOM 0 HD2 PHE A 727 10.681 -2.370 0.029 1.00 63.21 H new ATOM 0 HE1 PHE A 727 14.601 -0.994 2.633 1.00 71.55 H new ATOM 0 HE2 PHE A 727 10.447 -1.853 2.409 1.00 54.14 H new ATOM 0 HZ PHE A 727 12.402 -1.153 3.714 1.00 53.24 H new ATOM 224 N ALA A 728 13.014 -5.343 -1.108 1.00 43.04 N ATOM 225 CA ALA A 728 12.808 -6.482 -0.210 1.00 22.20 C ATOM 226 C ALA A 728 14.051 -7.324 -0.081 1.00 54.02 C ATOM 227 O ALA A 728 14.414 -7.724 1.006 1.00 72.15 O ATOM 228 CB ALA A 728 11.646 -7.332 -0.672 1.00 63.51 C ATOM 0 H ALA A 728 12.339 -5.279 -1.870 1.00 43.04 H new ATOM 0 HA ALA A 728 12.575 -6.076 0.774 1.00 22.20 H new ATOM 0 HB1 ALA A 728 11.514 -8.171 0.012 1.00 63.51 H new ATOM 0 HB2 ALA A 728 10.738 -6.730 -0.687 1.00 63.51 H new ATOM 0 HB3 ALA A 728 11.847 -7.709 -1.675 1.00 63.51 H new ATOM 234 N LYS A 729 14.721 -7.558 -1.198 1.00 43.11 N ATOM 235 CA LYS A 729 15.897 -8.419 -1.228 1.00 31.12 C ATOM 236 C LYS A 729 17.019 -7.928 -0.273 1.00 0.32 C ATOM 237 O LYS A 729 17.849 -8.718 0.174 1.00 33.25 O ATOM 238 CB LYS A 729 16.410 -8.596 -2.672 1.00 1.23 C ATOM 239 CG LYS A 729 17.560 -9.606 -2.829 1.00 44.33 C ATOM 240 CD LYS A 729 17.230 -10.959 -2.168 1.00 24.12 C ATOM 241 CE LYS A 729 15.957 -11.587 -2.734 1.00 52.05 C ATOM 242 NZ LYS A 729 16.098 -11.966 -4.160 1.00 33.31 N ATOM 0 H LYS A 729 14.470 -7.161 -2.103 1.00 43.11 H new ATOM 0 HA LYS A 729 15.590 -9.397 -0.857 1.00 31.12 H new ATOM 0 HB2 LYS A 729 15.579 -8.913 -3.302 1.00 1.23 H new ATOM 0 HB3 LYS A 729 16.742 -7.628 -3.046 1.00 1.23 H new ATOM 0 HG2 LYS A 729 17.766 -9.760 -3.888 1.00 44.33 H new ATOM 0 HG3 LYS A 729 18.467 -9.196 -2.384 1.00 44.33 H new ATOM 0 HD2 LYS A 729 18.065 -11.644 -2.312 1.00 24.12 H new ATOM 0 HD3 LYS A 729 17.116 -10.817 -1.093 1.00 24.12 H new ATOM 0 HE2 LYS A 729 15.701 -12.471 -2.150 1.00 52.05 H new ATOM 0 HE3 LYS A 729 15.131 -10.884 -2.628 1.00 52.05 H new ATOM 0 HZ1 LYS A 729 15.313 -12.592 -4.432 1.00 33.31 H new ATOM 0 HZ2 LYS A 729 16.079 -11.110 -4.750 1.00 33.31 H new ATOM 0 HZ3 LYS A 729 17.001 -12.462 -4.300 1.00 33.31 H new ATOM 256 N PHE A 730 17.016 -6.643 0.047 1.00 44.45 N ATOM 257 CA PHE A 730 17.976 -6.102 0.993 1.00 14.33 C ATOM 258 C PHE A 730 17.717 -6.635 2.366 1.00 1.25 C ATOM 259 O PHE A 730 18.581 -7.247 2.972 1.00 10.40 O ATOM 260 CB PHE A 730 17.928 -4.594 1.022 1.00 60.25 C ATOM 261 CG PHE A 730 18.573 -3.940 -0.136 1.00 4.21 C ATOM 262 CD1 PHE A 730 19.942 -3.833 -0.203 1.00 53.23 C ATOM 263 CD2 PHE A 730 17.823 -3.428 -1.144 1.00 51.42 C ATOM 264 CE1 PHE A 730 20.550 -3.217 -1.273 1.00 34.20 C ATOM 265 CE2 PHE A 730 18.417 -2.809 -2.224 1.00 53.32 C ATOM 266 CZ PHE A 730 19.783 -2.704 -2.287 1.00 44.43 C ATOM 0 H PHE A 730 16.362 -5.959 -0.333 1.00 44.45 H new ATOM 0 HA PHE A 730 18.968 -6.412 0.665 1.00 14.33 H new ATOM 0 HB2 PHE A 730 16.886 -4.277 1.069 1.00 60.25 H new ATOM 0 HB3 PHE A 730 18.409 -4.245 1.936 1.00 60.25 H new ATOM 0 HD1 PHE A 730 20.548 -4.237 0.594 1.00 53.23 H new ATOM 0 HD2 PHE A 730 16.747 -3.506 -1.100 1.00 51.42 H new ATOM 0 HE1 PHE A 730 21.626 -3.138 -1.314 1.00 34.20 H new ATOM 0 HE2 PHE A 730 17.807 -2.407 -3.019 1.00 53.32 H new ATOM 0 HZ PHE A 730 20.252 -2.220 -3.131 1.00 44.43 H new ATOM 276 N GLU A 731 16.519 -6.412 2.858 1.00 41.30 N ATOM 277 CA GLU A 731 16.141 -6.867 4.186 1.00 2.21 C ATOM 278 C GLU A 731 16.048 -8.383 4.242 1.00 42.31 C ATOM 279 O GLU A 731 16.276 -8.986 5.292 1.00 33.23 O ATOM 280 CB GLU A 731 14.823 -6.221 4.633 1.00 54.42 C ATOM 281 CG GLU A 731 13.634 -6.545 3.751 1.00 12.34 C ATOM 282 CD GLU A 731 12.403 -5.787 4.146 1.00 61.25 C ATOM 283 OE1 GLU A 731 12.274 -4.615 3.759 1.00 1.24 O ATOM 284 OE2 GLU A 731 11.549 -6.356 4.847 1.00 32.23 O ATOM 0 H GLU A 731 15.782 -5.915 2.358 1.00 41.30 H new ATOM 0 HA GLU A 731 16.923 -6.555 4.879 1.00 2.21 H new ATOM 0 HB2 GLU A 731 14.602 -6.542 5.651 1.00 54.42 H new ATOM 0 HB3 GLU A 731 14.954 -5.139 4.661 1.00 54.42 H new ATOM 0 HG2 GLU A 731 13.881 -6.315 2.715 1.00 12.34 H new ATOM 0 HG3 GLU A 731 13.430 -7.615 3.800 1.00 12.34 H new ATOM 291 N GLU A 732 15.735 -8.996 3.096 1.00 24.30 N ATOM 292 CA GLU A 732 15.550 -10.445 3.013 1.00 2.54 C ATOM 293 C GLU A 732 16.760 -11.227 3.477 1.00 72.54 C ATOM 294 O GLU A 732 16.614 -12.288 4.017 1.00 22.02 O ATOM 295 CB GLU A 732 15.147 -10.893 1.602 1.00 3.23 C ATOM 296 CG GLU A 732 13.690 -10.646 1.265 1.00 23.21 C ATOM 297 CD GLU A 732 13.258 -11.353 0.003 1.00 31.41 C ATOM 298 OE1 GLU A 732 12.933 -12.554 0.081 1.00 24.34 O ATOM 299 OE2 GLU A 732 13.218 -10.713 -1.070 1.00 51.53 O ATOM 0 H GLU A 732 15.604 -8.507 2.210 1.00 24.30 H new ATOM 0 HA GLU A 732 14.733 -10.669 3.699 1.00 2.54 H new ATOM 0 HB2 GLU A 732 15.770 -10.371 0.875 1.00 3.23 H new ATOM 0 HB3 GLU A 732 15.357 -11.957 1.497 1.00 3.23 H new ATOM 0 HG2 GLU A 732 13.067 -10.979 2.095 1.00 23.21 H new ATOM 0 HG3 GLU A 732 13.524 -9.575 1.152 1.00 23.21 H new ATOM 306 N GLU A 733 17.948 -10.697 3.267 1.00 31.24 N ATOM 307 CA GLU A 733 19.161 -11.439 3.617 1.00 62.43 C ATOM 308 C GLU A 733 19.200 -11.804 5.107 1.00 14.35 C ATOM 309 O GLU A 733 19.352 -12.963 5.452 1.00 33.11 O ATOM 310 CB GLU A 733 20.405 -10.666 3.228 1.00 61.44 C ATOM 311 CG GLU A 733 20.512 -10.392 1.753 1.00 1.50 C ATOM 312 CD GLU A 733 21.834 -9.792 1.375 1.00 4.33 C ATOM 313 OE1 GLU A 733 22.041 -8.599 1.627 1.00 65.35 O ATOM 314 OE2 GLU A 733 22.688 -10.526 0.818 1.00 3.21 O ATOM 0 H GLU A 733 18.108 -9.774 2.864 1.00 31.24 H new ATOM 0 HA GLU A 733 19.140 -12.369 3.049 1.00 62.43 H new ATOM 0 HB2 GLU A 733 20.416 -9.718 3.766 1.00 61.44 H new ATOM 0 HB3 GLU A 733 21.284 -11.225 3.549 1.00 61.44 H new ATOM 0 HG2 GLU A 733 20.368 -11.322 1.203 1.00 1.50 H new ATOM 0 HG3 GLU A 733 19.711 -9.716 1.453 1.00 1.50 H new ATOM 321 N ARG A 734 19.053 -10.818 5.966 1.00 14.13 N ATOM 322 CA ARG A 734 18.997 -11.062 7.404 1.00 22.14 C ATOM 323 C ARG A 734 17.673 -11.661 7.810 1.00 44.02 C ATOM 324 O ARG A 734 17.620 -12.584 8.627 1.00 62.00 O ATOM 325 CB ARG A 734 19.274 -9.793 8.200 1.00 75.21 C ATOM 326 CG ARG A 734 20.647 -9.212 7.970 1.00 13.24 C ATOM 327 CD ARG A 734 21.731 -10.221 8.276 1.00 62.54 C ATOM 328 NE ARG A 734 23.063 -9.667 8.048 1.00 13.34 N ATOM 329 CZ ARG A 734 24.209 -10.289 8.329 1.00 73.01 C ATOM 330 NH1 ARG A 734 24.198 -11.528 8.820 1.00 1.14 N ATOM 331 NH2 ARG A 734 25.364 -9.680 8.104 1.00 0.20 N ATOM 0 H ARG A 734 18.969 -9.837 5.700 1.00 14.13 H new ATOM 0 HA ARG A 734 19.782 -11.782 7.635 1.00 22.14 H new ATOM 0 HB2 ARG A 734 18.526 -9.044 7.942 1.00 75.21 H new ATOM 0 HB3 ARG A 734 19.155 -10.009 9.262 1.00 75.21 H new ATOM 0 HG2 ARG A 734 20.736 -8.883 6.935 1.00 13.24 H new ATOM 0 HG3 ARG A 734 20.781 -8.331 8.597 1.00 13.24 H new ATOM 0 HD2 ARG A 734 21.644 -10.545 9.313 1.00 62.54 H new ATOM 0 HD3 ARG A 734 21.593 -11.105 7.653 1.00 62.54 H new ATOM 0 HE ARG A 734 23.121 -8.733 7.643 1.00 13.34 H new ATOM 0 HH11 ARG A 734 23.311 -12.004 8.982 1.00 1.14 H new ATOM 0 HH12 ARG A 734 25.077 -12.000 9.033 1.00 1.14 H new ATOM 0 HH21 ARG A 734 25.376 -8.737 7.716 1.00 0.20 H new ATOM 0 HH22 ARG A 734 26.241 -10.155 8.318 1.00 0.20 H new ATOM 345 N ALA A 735 16.599 -11.134 7.235 1.00 34.50 N ATOM 346 CA ALA A 735 15.252 -11.572 7.576 1.00 13.23 C ATOM 347 C ALA A 735 15.049 -13.049 7.271 1.00 13.33 C ATOM 348 O ALA A 735 14.626 -13.821 8.130 1.00 13.54 O ATOM 349 CB ALA A 735 14.214 -10.727 6.845 1.00 31.13 C ATOM 0 H ALA A 735 16.636 -10.400 6.528 1.00 34.50 H new ATOM 0 HA ALA A 735 15.122 -11.436 8.650 1.00 13.23 H new ATOM 0 HB1 ALA A 735 13.214 -11.068 7.112 1.00 31.13 H new ATOM 0 HB2 ALA A 735 14.329 -9.682 7.131 1.00 31.13 H new ATOM 0 HB3 ALA A 735 14.356 -10.826 5.769 1.00 31.13 H new ATOM 355 N ARG A 736 15.372 -13.437 6.078 1.00 11.44 N ATOM 356 CA ARG A 736 15.154 -14.790 5.634 1.00 14.11 C ATOM 357 C ARG A 736 16.255 -15.730 6.155 1.00 72.10 C ATOM 358 O ARG A 736 16.156 -16.936 6.032 1.00 14.02 O ATOM 359 CB ARG A 736 15.081 -14.833 4.109 1.00 35.21 C ATOM 360 CG ARG A 736 14.561 -16.122 3.547 1.00 0.32 C ATOM 361 CD ARG A 736 14.525 -16.085 2.050 1.00 30.21 C ATOM 362 NE ARG A 736 15.861 -15.995 1.460 1.00 72.33 N ATOM 363 CZ ARG A 736 16.097 -15.860 0.163 1.00 4.32 C ATOM 364 NH1 ARG A 736 15.080 -15.761 -0.693 1.00 71.11 N ATOM 365 NH2 ARG A 736 17.349 -15.833 -0.286 1.00 34.23 N ATOM 0 H ARG A 736 15.796 -12.828 5.378 1.00 11.44 H new ATOM 0 HA ARG A 736 14.205 -15.138 6.041 1.00 14.11 H new ATOM 0 HB2 ARG A 736 14.444 -14.018 3.765 1.00 35.21 H new ATOM 0 HB3 ARG A 736 16.077 -14.651 3.705 1.00 35.21 H new ATOM 0 HG2 ARG A 736 15.192 -16.947 3.878 1.00 0.32 H new ATOM 0 HG3 ARG A 736 13.559 -16.312 3.933 1.00 0.32 H new ATOM 0 HD2 ARG A 736 14.027 -16.981 1.679 1.00 30.21 H new ATOM 0 HD3 ARG A 736 13.929 -15.232 1.725 1.00 30.21 H new ATOM 0 HE ARG A 736 16.663 -16.039 2.088 1.00 72.33 H new ATOM 0 HH11 ARG A 736 14.120 -15.789 -0.350 1.00 71.11 H new ATOM 0 HH12 ARG A 736 15.262 -15.657 -1.691 1.00 71.11 H new ATOM 0 HH21 ARG A 736 18.127 -15.916 0.368 1.00 34.23 H new ATOM 0 HH22 ARG A 736 17.531 -15.729 -1.284 1.00 34.23 H new ATOM 379 N ALA A 737 17.284 -15.161 6.747 1.00 0.32 N ATOM 380 CA ALA A 737 18.371 -15.958 7.312 1.00 30.15 C ATOM 381 C ALA A 737 17.904 -16.713 8.552 1.00 30.12 C ATOM 382 O ALA A 737 18.444 -17.764 8.894 1.00 53.13 O ATOM 383 CB ALA A 737 19.540 -15.076 7.658 1.00 5.52 C ATOM 0 H ALA A 737 17.398 -14.153 6.853 1.00 0.32 H new ATOM 0 HA ALA A 737 18.683 -16.685 6.562 1.00 30.15 H new ATOM 0 HB1 ALA A 737 20.342 -15.683 8.078 1.00 5.52 H new ATOM 0 HB2 ALA A 737 19.897 -14.575 6.758 1.00 5.52 H new ATOM 0 HB3 ALA A 737 19.229 -14.330 8.389 1.00 5.52 H new ATOM 389 N LYS A 738 16.912 -16.175 9.210 1.00 3.43 N ATOM 390 CA LYS A 738 16.403 -16.753 10.434 1.00 71.12 C ATOM 391 C LYS A 738 14.908 -16.979 10.368 1.00 30.41 C ATOM 392 O LYS A 738 14.311 -17.555 11.277 1.00 12.13 O ATOM 393 CB LYS A 738 16.811 -15.894 11.653 1.00 52.21 C ATOM 394 CG LYS A 738 16.861 -14.398 11.381 1.00 11.51 C ATOM 395 CD LYS A 738 17.491 -13.649 12.538 1.00 11.13 C ATOM 396 CE LYS A 738 17.594 -12.159 12.244 1.00 52.23 C ATOM 397 NZ LYS A 738 16.265 -11.523 12.100 1.00 23.15 N ATOM 0 H LYS A 738 16.431 -15.324 8.916 1.00 3.43 H new ATOM 0 HA LYS A 738 16.857 -17.736 10.558 1.00 71.12 H new ATOM 0 HB2 LYS A 738 16.107 -16.080 12.464 1.00 52.21 H new ATOM 0 HB3 LYS A 738 17.791 -16.221 12.000 1.00 52.21 H new ATOM 0 HG2 LYS A 738 17.430 -14.211 10.471 1.00 11.51 H new ATOM 0 HG3 LYS A 738 15.852 -14.024 11.209 1.00 11.51 H new ATOM 0 HD2 LYS A 738 16.898 -13.803 13.440 1.00 11.13 H new ATOM 0 HD3 LYS A 738 18.484 -14.052 12.737 1.00 11.13 H new ATOM 0 HE2 LYS A 738 18.144 -11.669 13.048 1.00 52.23 H new ATOM 0 HE3 LYS A 738 18.167 -12.010 11.329 1.00 52.23 H new ATOM 0 HZ1 LYS A 738 16.376 -10.489 12.070 1.00 23.15 H new ATOM 0 HZ2 LYS A 738 15.818 -11.849 11.219 1.00 23.15 H new ATOM 0 HZ3 LYS A 738 15.666 -11.783 12.909 1.00 23.15 H new ATOM 411 N TRP A 739 14.302 -16.537 9.284 1.00 44.14 N ATOM 412 CA TRP A 739 12.870 -16.714 9.062 1.00 73.33 C ATOM 413 C TRP A 739 12.622 -17.086 7.623 1.00 72.44 C ATOM 414 O TRP A 739 11.676 -16.607 6.998 1.00 3.52 O ATOM 415 CB TRP A 739 12.092 -15.423 9.423 1.00 50.13 C ATOM 416 CG TRP A 739 12.301 -14.978 10.828 1.00 73.54 C ATOM 417 CD1 TRP A 739 13.388 -14.346 11.311 1.00 44.14 C ATOM 418 CD2 TRP A 739 11.402 -15.130 11.928 1.00 72.54 C ATOM 419 NE1 TRP A 739 13.253 -14.117 12.639 1.00 30.52 N ATOM 420 CE2 TRP A 739 12.032 -14.578 13.049 1.00 31.01 C ATOM 421 CE3 TRP A 739 10.129 -15.684 12.073 1.00 4.15 C ATOM 422 CZ2 TRP A 739 11.437 -14.557 14.307 1.00 22.33 C ATOM 423 CZ3 TRP A 739 9.534 -15.662 13.320 1.00 70.32 C ATOM 424 CH2 TRP A 739 10.189 -15.103 14.422 1.00 25.22 C ATOM 0 H TRP A 739 14.782 -16.045 8.530 1.00 44.14 H new ATOM 0 HA TRP A 739 12.514 -17.516 9.708 1.00 73.33 H new ATOM 0 HB2 TRP A 739 12.397 -14.624 8.748 1.00 50.13 H new ATOM 0 HB3 TRP A 739 11.028 -15.591 9.258 1.00 50.13 H new ATOM 0 HD1 TRP A 739 14.247 -14.062 10.722 1.00 44.14 H new ATOM 0 HE1 TRP A 739 13.949 -13.672 13.237 1.00 30.52 H new ATOM 0 HE3 TRP A 739 9.619 -16.121 11.227 1.00 4.15 H new ATOM 0 HZ2 TRP A 739 11.942 -14.126 15.159 1.00 22.33 H new ATOM 0 HZ3 TRP A 739 8.547 -16.083 13.446 1.00 70.32 H new ATOM 0 HH2 TRP A 739 9.699 -15.103 15.384 1.00 25.22 H new ATOM 435 N ASP A 740 13.475 -17.940 7.098 1.00 32.11 N ATOM 436 CA ASP A 740 13.366 -18.415 5.702 1.00 54.01 C ATOM 437 C ASP A 740 11.989 -19.004 5.421 1.00 15.34 C ATOM 438 O ASP A 740 11.377 -18.715 4.389 1.00 53.20 O ATOM 439 CB ASP A 740 14.456 -19.451 5.406 1.00 73.22 C ATOM 440 CG ASP A 740 14.452 -19.922 3.964 1.00 64.23 C ATOM 441 OD1 ASP A 740 15.091 -19.270 3.124 1.00 43.24 O ATOM 442 OD2 ASP A 740 13.829 -20.942 3.677 1.00 53.31 O ATOM 0 H ASP A 740 14.265 -18.333 7.609 1.00 32.11 H new ATOM 0 HA ASP A 740 13.504 -17.556 5.045 1.00 54.01 H new ATOM 0 HB2 ASP A 740 15.430 -19.022 5.639 1.00 73.22 H new ATOM 0 HB3 ASP A 740 14.321 -20.310 6.063 1.00 73.22 H new ATOM 447 N THR A 741 11.497 -19.799 6.346 1.00 4.35 N ATOM 448 CA THR A 741 10.199 -20.427 6.195 1.00 54.43 C ATOM 449 C THR A 741 9.048 -19.385 6.335 1.00 2.35 C ATOM 450 O THR A 741 7.932 -19.604 5.855 1.00 13.22 O ATOM 451 CB THR A 741 10.001 -21.609 7.221 1.00 53.53 C ATOM 452 OG1 THR A 741 8.802 -22.336 6.915 1.00 3.05 O ATOM 453 CG2 THR A 741 9.921 -21.090 8.651 1.00 65.52 C ATOM 0 H THR A 741 11.978 -20.028 7.216 1.00 4.35 H new ATOM 0 HA THR A 741 10.162 -20.847 5.190 1.00 54.43 H new ATOM 0 HB THR A 741 10.864 -22.269 7.136 1.00 53.53 H new ATOM 0 HG1 THR A 741 8.690 -23.068 7.557 1.00 3.05 H new ATOM 0 HG21 THR A 741 9.784 -21.928 9.335 1.00 65.52 H new ATOM 0 HG22 THR A 741 10.843 -20.565 8.900 1.00 65.52 H new ATOM 0 HG23 THR A 741 9.078 -20.405 8.743 1.00 65.52 H new ATOM 461 N ALA A 742 9.344 -18.265 6.983 1.00 63.20 N ATOM 462 CA ALA A 742 8.340 -17.252 7.255 1.00 15.53 C ATOM 463 C ALA A 742 8.233 -16.223 6.119 1.00 22.52 C ATOM 464 O ALA A 742 7.128 -15.871 5.693 1.00 51.10 O ATOM 465 CB ALA A 742 8.633 -16.557 8.574 1.00 20.42 C ATOM 0 H ALA A 742 10.276 -18.038 7.330 1.00 63.20 H new ATOM 0 HA ALA A 742 7.378 -17.759 7.324 1.00 15.53 H new ATOM 0 HB1 ALA A 742 7.872 -15.800 8.764 1.00 20.42 H new ATOM 0 HB2 ALA A 742 8.625 -17.290 9.381 1.00 20.42 H new ATOM 0 HB3 ALA A 742 9.613 -16.081 8.525 1.00 20.42 H new ATOM 471 N ASN A 743 9.379 -15.743 5.630 1.00 14.24 N ATOM 472 CA ASN A 743 9.382 -14.695 4.578 1.00 1.22 C ATOM 473 C ASN A 743 8.970 -15.258 3.257 1.00 2.34 C ATOM 474 O ASN A 743 8.276 -14.601 2.474 1.00 32.54 O ATOM 475 CB ASN A 743 10.777 -14.052 4.434 1.00 11.42 C ATOM 476 CG ASN A 743 11.196 -13.250 5.633 1.00 74.42 C ATOM 477 OD1 ASN A 743 10.925 -12.063 5.726 1.00 74.53 O ATOM 478 ND2 ASN A 743 11.861 -13.880 6.542 1.00 52.45 N ATOM 0 H ASN A 743 10.305 -16.048 5.931 1.00 14.24 H new ATOM 0 HA ASN A 743 8.666 -13.933 4.886 1.00 1.22 H new ATOM 0 HB2 ASN A 743 11.513 -14.836 4.257 1.00 11.42 H new ATOM 0 HB3 ASN A 743 10.781 -13.406 3.556 1.00 11.42 H new ATOM 0 HD21 ASN A 743 12.180 -13.386 7.375 1.00 52.45 H new ATOM 0 HD22 ASN A 743 12.067 -14.872 6.427 1.00 52.45 H new ATOM 485 N ASN A 744 9.374 -16.457 2.999 1.00 13.21 N ATOM 486 CA ASN A 744 9.058 -17.099 1.764 1.00 73.14 C ATOM 487 C ASN A 744 7.949 -18.102 1.932 1.00 41.31 C ATOM 488 O ASN A 744 7.876 -18.793 2.944 1.00 63.20 O ATOM 489 CB ASN A 744 10.279 -17.738 1.150 1.00 51.21 C ATOM 490 CG ASN A 744 11.125 -16.762 0.304 1.00 42.43 C ATOM 491 OD1 ASN A 744 12.332 -16.893 0.216 1.00 63.14 O ATOM 492 ND2 ASN A 744 10.486 -15.811 -0.328 1.00 12.03 N ATOM 0 H ASN A 744 9.933 -17.021 3.638 1.00 13.21 H new ATOM 0 HA ASN A 744 8.705 -16.329 1.078 1.00 73.14 H new ATOM 0 HB2 ASN A 744 10.901 -18.151 1.944 1.00 51.21 H new ATOM 0 HB3 ASN A 744 9.966 -18.573 0.523 1.00 51.21 H new ATOM 0 HD21 ASN A 744 11.000 -15.154 -0.914 1.00 12.03 H new ATOM 0 HD22 ASN A 744 9.474 -15.727 -0.234 1.00 12.03 H new ATOM 499 N PRO A 745 7.064 -18.191 0.937 1.00 24.25 N ATOM 500 CA PRO A 745 5.883 -19.078 0.975 1.00 33.12 C ATOM 501 C PRO A 745 6.242 -20.552 1.008 1.00 0.32 C ATOM 502 O PRO A 745 5.924 -21.270 1.971 1.00 53.13 O ATOM 503 CB PRO A 745 5.167 -18.745 -0.345 1.00 53.41 C ATOM 504 CG PRO A 745 6.241 -18.190 -1.216 1.00 55.31 C ATOM 505 CD PRO A 745 7.127 -17.422 -0.317 1.00 13.21 C ATOM 0 HA PRO A 745 5.288 -18.917 1.874 1.00 33.12 H new ATOM 0 HB2 PRO A 745 4.715 -19.633 -0.787 1.00 53.41 H new ATOM 0 HB3 PRO A 745 4.366 -18.022 -0.192 1.00 53.41 H new ATOM 0 HG2 PRO A 745 6.789 -18.987 -1.718 1.00 55.31 H new ATOM 0 HG3 PRO A 745 5.823 -17.551 -1.994 1.00 55.31 H new ATOM 0 HD2 PRO A 745 8.144 -17.363 -0.705 1.00 13.21 H new ATOM 0 HD3 PRO A 745 6.777 -16.398 -0.182 1.00 13.21 H new ATOM 513 N LEU A 746 6.886 -20.992 -0.018 1.00 42.30 N ATOM 514 CA LEU A 746 7.185 -22.355 -0.194 1.00 11.43 C ATOM 515 C LEU A 746 8.528 -22.637 0.338 1.00 44.43 C ATOM 516 O LEU A 746 8.751 -23.651 1.007 1.00 43.33 O ATOM 517 CB LEU A 746 7.128 -22.680 -1.676 1.00 73.40 C ATOM 518 CG LEU A 746 7.613 -24.062 -2.101 1.00 54.42 C ATOM 519 CD1 LEU A 746 6.709 -25.141 -1.540 1.00 55.13 C ATOM 520 CD2 LEU A 746 7.688 -24.160 -3.615 1.00 42.31 C ATOM 0 H LEU A 746 7.224 -20.392 -0.771 1.00 42.30 H new ATOM 0 HA LEU A 746 6.462 -22.970 0.341 1.00 11.43 H new ATOM 0 HB2 LEU A 746 6.096 -22.566 -2.008 1.00 73.40 H new ATOM 0 HB3 LEU A 746 7.719 -21.935 -2.209 1.00 73.40 H new ATOM 0 HG LEU A 746 8.615 -24.212 -1.698 1.00 54.42 H new ATOM 0 HD11 LEU A 746 7.072 -26.120 -1.855 1.00 55.13 H new ATOM 0 HD12 LEU A 746 6.710 -25.086 -0.451 1.00 55.13 H new ATOM 0 HD13 LEU A 746 5.694 -24.994 -1.910 1.00 55.13 H new ATOM 0 HD21 LEU A 746 8.036 -25.153 -3.899 1.00 42.31 H new ATOM 0 HD22 LEU A 746 6.699 -23.987 -4.040 1.00 42.31 H new ATOM 0 HD23 LEU A 746 8.382 -23.410 -3.994 1.00 42.31 H new HETATM 532 N PTR A 747 9.424 -21.730 0.074 1.00 62.34 N HETATM 533 CA PTR A 747 10.787 -21.864 0.457 1.00 3.32 C HETATM 534 C PTR A 747 11.499 -20.668 0.026 1.00 41.10 C HETATM 535 O PTR A 747 12.193 -20.027 0.792 1.00 21.14 O HETATM 536 CB PTR A 747 11.409 -23.046 -0.253 1.00 52.31 C HETATM 537 CG PTR A 747 12.573 -23.664 0.479 1.00 60.31 C HETATM 538 CD1 PTR A 747 13.540 -22.877 1.051 1.00 4.21 C HETATM 539 CD2 PTR A 747 12.693 -25.034 0.601 1.00 21.20 C HETATM 540 CE1 PTR A 747 14.597 -23.422 1.731 1.00 44.14 C HETATM 541 CE2 PTR A 747 13.751 -25.594 1.276 1.00 32.44 C HETATM 542 CZ PTR A 747 14.703 -24.778 1.841 1.00 44.23 C HETATM 543 OH PTR A 747 15.777 -25.342 2.544 1.00 35.78 O HETATM 544 P PTR A 747 17.299 -25.117 2.213 1.00 35.78 P HETATM 545 O1P PTR A 747 17.441 -23.932 1.234 1.00 35.78 O HETATM 546 O2P PTR A 747 17.992 -24.703 3.528 1.00 35.78 O HETATM 547 O3P PTR A 747 17.671 -26.442 1.708 1.00 35.78 O HETATM 0 HE2 PTR A 747 13.835 -26.677 1.363 1.00 32.44 H new HETATM 0 HE1 PTR A 747 15.350 -22.776 2.182 1.00 44.14 H new HETATM 0 HD2 PTR A 747 11.937 -25.681 0.155 1.00 21.20 H new HETATM 0 HD1 PTR A 747 13.466 -21.793 0.962 1.00 4.21 H new HETATM 0 HB3 PTR A 747 10.644 -23.808 -0.405 1.00 52.31 H new HETATM 0 HB2 PTR A 747 11.743 -22.728 -1.241 1.00 52.31 H new HETATM 0 HA PTR A 747 10.848 -22.003 1.536 1.00 3.32 H new HETATM 0 H PTR A 747 9.112 -20.892 -0.416 1.00 62.34 H new ATOM 556 N LYS A 748 11.342 -20.376 -1.219 1.00 55.11 N ATOM 557 CA LYS A 748 11.958 -19.287 -1.833 1.00 21.12 C ATOM 558 C LYS A 748 10.970 -18.585 -2.740 1.00 41.53 C ATOM 559 O LYS A 748 9.822 -19.014 -2.865 1.00 32.42 O ATOM 560 CB LYS A 748 13.162 -19.772 -2.636 1.00 34.52 C ATOM 561 CG LYS A 748 14.353 -20.208 -1.786 1.00 72.21 C ATOM 562 CD LYS A 748 14.776 -19.106 -0.848 1.00 62.44 C ATOM 563 CE LYS A 748 16.038 -19.465 -0.074 1.00 11.14 C ATOM 564 NZ LYS A 748 15.803 -20.537 0.898 1.00 32.33 N ATOM 0 H LYS A 748 10.754 -20.921 -1.849 1.00 55.11 H new ATOM 0 HA LYS A 748 12.297 -18.582 -1.074 1.00 21.12 H new ATOM 0 HB2 LYS A 748 12.852 -20.609 -3.262 1.00 34.52 H new ATOM 0 HB3 LYS A 748 13.482 -18.974 -3.306 1.00 34.52 H new ATOM 0 HG2 LYS A 748 14.090 -21.098 -1.214 1.00 72.21 H new ATOM 0 HG3 LYS A 748 15.187 -20.480 -2.433 1.00 72.21 H new ATOM 0 HD2 LYS A 748 14.948 -18.192 -1.417 1.00 62.44 H new ATOM 0 HD3 LYS A 748 13.968 -18.898 -0.147 1.00 62.44 H new ATOM 0 HE2 LYS A 748 16.816 -19.774 -0.773 1.00 11.14 H new ATOM 0 HE3 LYS A 748 16.408 -18.581 0.445 1.00 11.14 H new ATOM 0 HZ1 LYS A 748 16.695 -20.772 1.378 1.00 32.33 H new ATOM 0 HZ2 LYS A 748 15.105 -20.221 1.601 1.00 32.33 H new ATOM 0 HZ3 LYS A 748 15.442 -21.379 0.406 1.00 32.33 H new ATOM 578 N GLU A 749 11.409 -17.513 -3.357 1.00 30.10 N ATOM 579 CA GLU A 749 10.579 -16.758 -4.298 1.00 23.13 C ATOM 580 C GLU A 749 10.422 -17.542 -5.571 1.00 13.32 C ATOM 581 O GLU A 749 9.346 -17.575 -6.182 1.00 60.43 O ATOM 582 CB GLU A 749 11.210 -15.379 -4.584 1.00 41.14 C ATOM 583 CG GLU A 749 12.663 -15.437 -5.052 1.00 74.32 C ATOM 584 CD GLU A 749 13.293 -14.074 -5.170 1.00 23.11 C ATOM 585 OE1 GLU A 749 13.812 -13.559 -4.146 1.00 23.11 O ATOM 586 OE2 GLU A 749 13.299 -13.519 -6.265 1.00 74.11 O ATOM 0 H GLU A 749 12.346 -17.132 -3.229 1.00 30.10 H new ATOM 0 HA GLU A 749 9.595 -16.596 -3.858 1.00 23.13 H new ATOM 0 HB2 GLU A 749 10.616 -14.871 -5.344 1.00 41.14 H new ATOM 0 HB3 GLU A 749 11.156 -14.773 -3.680 1.00 41.14 H new ATOM 0 HG2 GLU A 749 13.241 -16.040 -4.352 1.00 74.32 H new ATOM 0 HG3 GLU A 749 12.709 -15.938 -6.019 1.00 74.32 H new ATOM 593 N ALA A 750 11.491 -18.167 -5.957 1.00 61.31 N ATOM 594 CA ALA A 750 11.524 -19.019 -7.075 1.00 23.15 C ATOM 595 C ALA A 750 12.303 -20.252 -6.714 1.00 72.34 C ATOM 596 O ALA A 750 13.365 -20.510 -7.262 1.00 43.12 O ATOM 597 CB ALA A 750 12.147 -18.311 -8.274 1.00 53.23 C ATOM 0 H ALA A 750 12.388 -18.086 -5.477 1.00 61.31 H new ATOM 0 HA ALA A 750 10.509 -19.299 -7.355 1.00 23.15 H new ATOM 0 HB1 ALA A 750 12.163 -18.988 -9.128 1.00 53.23 H new ATOM 0 HB2 ALA A 750 11.558 -17.428 -8.522 1.00 53.23 H new ATOM 0 HB3 ALA A 750 13.166 -18.011 -8.030 1.00 53.23 H new ATOM 603 N THR A 751 11.777 -20.982 -5.745 1.00 20.23 N ATOM 604 CA THR A 751 12.389 -22.218 -5.221 1.00 11.12 C ATOM 605 C THR A 751 12.892 -23.162 -6.353 1.00 61.42 C ATOM 606 O THR A 751 13.914 -23.831 -6.200 1.00 31.30 O ATOM 607 CB THR A 751 11.376 -22.989 -4.346 1.00 11.04 C ATOM 608 OG1 THR A 751 10.728 -22.071 -3.442 1.00 10.45 O ATOM 609 CG2 THR A 751 12.076 -24.075 -3.542 1.00 25.40 C ATOM 0 H THR A 751 10.900 -20.739 -5.285 1.00 20.23 H new ATOM 0 HA THR A 751 13.250 -21.910 -4.627 1.00 11.12 H new ATOM 0 HB THR A 751 10.638 -23.456 -4.998 1.00 11.04 H new ATOM 0 HG1 THR A 751 10.084 -22.558 -2.887 1.00 10.45 H new ATOM 0 HG21 THR A 751 11.344 -24.606 -2.933 1.00 25.40 H new ATOM 0 HG22 THR A 751 12.559 -24.777 -4.222 1.00 25.40 H new ATOM 0 HG23 THR A 751 12.827 -23.622 -2.895 1.00 25.40 H new ATOM 617 N SER A 752 12.187 -23.177 -7.475 1.00 30.43 N ATOM 618 CA SER A 752 12.508 -24.071 -8.575 1.00 31.41 C ATOM 619 C SER A 752 13.874 -23.732 -9.229 1.00 44.35 C ATOM 620 O SER A 752 14.469 -24.572 -9.904 1.00 23.40 O ATOM 621 CB SER A 752 11.390 -24.053 -9.605 1.00 41.42 C ATOM 622 OG SER A 752 10.123 -24.279 -8.971 1.00 53.10 O ATOM 0 H SER A 752 11.382 -22.574 -7.647 1.00 30.43 H new ATOM 0 HA SER A 752 12.599 -25.078 -8.168 1.00 31.41 H new ATOM 0 HB2 SER A 752 11.379 -23.094 -10.123 1.00 41.42 H new ATOM 0 HB3 SER A 752 11.569 -24.820 -10.359 1.00 41.42 H new ATOM 0 HG SER A 752 9.412 -24.263 -9.646 1.00 53.10 H new ATOM 628 N THR A 753 14.366 -22.510 -9.004 1.00 3.12 N ATOM 629 CA THR A 753 15.678 -22.115 -9.522 1.00 24.41 C ATOM 630 C THR A 753 16.789 -22.769 -8.692 1.00 0.12 C ATOM 631 O THR A 753 17.945 -22.863 -9.125 1.00 14.42 O ATOM 632 CB THR A 753 15.868 -20.569 -9.521 1.00 22.32 C ATOM 633 OG1 THR A 753 15.768 -20.064 -8.186 1.00 52.00 O ATOM 634 CG2 THR A 753 14.817 -19.893 -10.392 1.00 51.15 C ATOM 0 H THR A 753 13.882 -21.786 -8.473 1.00 3.12 H new ATOM 0 HA THR A 753 15.735 -22.457 -10.555 1.00 24.41 H new ATOM 0 HB THR A 753 16.856 -20.350 -9.925 1.00 22.32 H new ATOM 0 HG1 THR A 753 14.830 -19.874 -7.978 1.00 52.00 H new ATOM 0 HG21 THR A 753 14.970 -18.814 -10.376 1.00 51.15 H new ATOM 0 HG22 THR A 753 14.905 -20.256 -11.416 1.00 51.15 H new ATOM 0 HG23 THR A 753 13.823 -20.124 -10.009 1.00 51.15 H new ATOM 642 N PHE A 754 16.423 -23.217 -7.507 1.00 21.03 N ATOM 643 CA PHE A 754 17.325 -23.903 -6.631 1.00 3.54 C ATOM 644 C PHE A 754 17.068 -25.389 -6.725 1.00 23.04 C ATOM 645 O PHE A 754 17.903 -26.155 -7.223 1.00 2.24 O ATOM 646 CB PHE A 754 17.112 -23.436 -5.177 1.00 73.35 C ATOM 647 CG PHE A 754 17.214 -21.945 -4.979 1.00 22.24 C ATOM 648 CD1 PHE A 754 18.431 -21.352 -4.715 1.00 41.25 C ATOM 649 CD2 PHE A 754 16.083 -21.142 -5.053 1.00 15.13 C ATOM 650 CE1 PHE A 754 18.526 -19.987 -4.531 1.00 13.35 C ATOM 651 CE2 PHE A 754 16.173 -19.778 -4.869 1.00 33.12 C ATOM 652 CZ PHE A 754 17.395 -19.200 -4.608 1.00 63.22 C ATOM 0 H PHE A 754 15.481 -23.109 -7.131 1.00 21.03 H new ATOM 0 HA PHE A 754 18.351 -23.682 -6.925 1.00 3.54 H new ATOM 0 HB2 PHE A 754 16.129 -23.768 -4.842 1.00 73.35 H new ATOM 0 HB3 PHE A 754 17.848 -23.926 -4.540 1.00 73.35 H new ATOM 0 HD1 PHE A 754 19.320 -21.962 -4.651 1.00 41.25 H new ATOM 0 HD2 PHE A 754 15.122 -21.591 -5.257 1.00 15.13 H new ATOM 0 HE1 PHE A 754 19.485 -19.535 -4.327 1.00 13.35 H new ATOM 0 HE2 PHE A 754 15.286 -19.164 -4.930 1.00 33.12 H new ATOM 0 HZ PHE A 754 17.468 -18.132 -4.464 1.00 63.22 H new ATOM 662 N THR A 755 15.910 -25.787 -6.271 1.00 41.22 N ATOM 663 CA THR A 755 15.490 -27.143 -6.327 1.00 41.04 C ATOM 664 C THR A 755 14.048 -27.228 -6.816 1.00 43.53 C ATOM 665 O THR A 755 13.097 -26.956 -6.056 1.00 12.21 O ATOM 666 CB THR A 755 15.614 -27.839 -4.935 1.00 72.31 C ATOM 667 OG1 THR A 755 15.062 -26.985 -3.904 1.00 24.13 O ATOM 668 CG2 THR A 755 17.067 -28.152 -4.610 1.00 12.23 C ATOM 0 H THR A 755 15.227 -25.160 -5.846 1.00 41.22 H new ATOM 0 HA THR A 755 16.144 -27.663 -7.027 1.00 41.04 H new ATOM 0 HB THR A 755 15.056 -28.775 -4.973 1.00 72.31 H new ATOM 0 HG1 THR A 755 14.204 -26.620 -4.206 1.00 24.13 H new ATOM 0 HG21 THR A 755 17.126 -28.636 -3.635 1.00 12.23 H new ATOM 0 HG22 THR A 755 17.475 -28.817 -5.371 1.00 12.23 H new ATOM 0 HG23 THR A 755 17.643 -27.227 -4.591 1.00 12.23 H new ATOM 676 N ASN A 756 13.875 -27.559 -8.087 1.00 32.11 N ATOM 677 CA ASN A 756 12.537 -27.726 -8.644 1.00 65.02 C ATOM 678 C ASN A 756 11.859 -28.907 -7.993 1.00 13.31 C ATOM 679 O ASN A 756 10.677 -28.863 -7.674 1.00 22.22 O ATOM 680 CB ASN A 756 12.587 -27.907 -10.170 1.00 55.24 C ATOM 681 CG ASN A 756 11.194 -27.962 -10.797 1.00 14.42 C ATOM 682 OD1 ASN A 756 10.245 -27.360 -10.291 1.00 30.03 O ATOM 683 ND2 ASN A 756 11.067 -28.665 -11.887 1.00 4.13 N ATOM 0 H ASN A 756 14.635 -27.716 -8.748 1.00 32.11 H new ATOM 0 HA ASN A 756 11.962 -26.823 -8.438 1.00 65.02 H new ATOM 0 HB2 ASN A 756 13.149 -27.085 -10.612 1.00 55.24 H new ATOM 0 HB3 ASN A 756 13.125 -28.825 -10.407 1.00 55.24 H new ATOM 0 HD21 ASN A 756 10.160 -28.730 -12.349 1.00 4.13 H new ATOM 0 HD22 ASN A 756 11.875 -29.150 -12.278 1.00 4.13 H new ATOM 690 N ILE A 757 12.618 -29.951 -7.780 1.00 23.13 N ATOM 691 CA ILE A 757 12.141 -31.099 -7.064 1.00 51.22 C ATOM 692 C ILE A 757 12.365 -30.890 -5.563 1.00 70.34 C ATOM 693 O ILE A 757 13.498 -30.625 -5.123 1.00 52.12 O ATOM 694 CB ILE A 757 12.871 -32.397 -7.518 1.00 50.25 C ATOM 695 CG1 ILE A 757 12.705 -32.603 -9.030 1.00 63.24 C ATOM 696 CG2 ILE A 757 12.341 -33.604 -6.756 1.00 12.42 C ATOM 697 CD1 ILE A 757 13.423 -33.825 -9.563 1.00 63.05 C ATOM 0 H ILE A 757 13.584 -30.026 -8.099 1.00 23.13 H new ATOM 0 HA ILE A 757 11.078 -31.214 -7.276 1.00 51.22 H new ATOM 0 HB ILE A 757 13.933 -32.290 -7.297 1.00 50.25 H new ATOM 0 HG12 ILE A 757 11.643 -32.687 -9.261 1.00 63.24 H new ATOM 0 HG13 ILE A 757 13.075 -31.720 -9.550 1.00 63.24 H new ATOM 0 HG21 ILE A 757 12.863 -34.501 -7.087 1.00 12.42 H new ATOM 0 HG22 ILE A 757 12.506 -33.461 -5.688 1.00 12.42 H new ATOM 0 HG23 ILE A 757 11.273 -33.714 -6.946 1.00 12.42 H new ATOM 0 HD11 ILE A 757 13.259 -33.903 -10.638 1.00 63.05 H new ATOM 0 HD12 ILE A 757 14.491 -33.735 -9.364 1.00 63.05 H new ATOM 0 HD13 ILE A 757 13.037 -34.718 -9.071 1.00 63.05 H new ATOM 709 N THR A 758 11.307 -30.997 -4.800 1.00 5.42 N ATOM 710 CA THR A 758 11.365 -30.793 -3.369 1.00 53.13 C ATOM 711 C THR A 758 12.104 -31.962 -2.681 1.00 44.22 C ATOM 712 O THR A 758 12.979 -31.751 -1.828 1.00 10.10 O ATOM 713 CB THR A 758 9.938 -30.659 -2.788 1.00 44.34 C ATOM 714 OG1 THR A 758 9.210 -29.657 -3.534 1.00 2.41 O ATOM 715 CG2 THR A 758 9.985 -30.250 -1.329 1.00 24.54 C ATOM 0 H THR A 758 10.378 -31.228 -5.151 1.00 5.42 H new ATOM 0 HA THR A 758 11.915 -29.872 -3.178 1.00 53.13 H new ATOM 0 HB THR A 758 9.441 -31.626 -2.866 1.00 44.34 H new ATOM 0 HG1 THR A 758 8.305 -29.571 -3.169 1.00 2.41 H new ATOM 0 HG21 THR A 758 8.969 -30.162 -0.943 1.00 24.54 H new ATOM 0 HG22 THR A 758 10.527 -31.003 -0.757 1.00 24.54 H new ATOM 0 HG23 THR A 758 10.493 -29.290 -1.236 1.00 24.54 H new HETATM 723 N PTR A 759 11.748 -33.174 -3.058 1.00 10.44 N HETATM 724 CA PTR A 759 12.395 -34.363 -2.538 1.00 51.44 C HETATM 725 C PTR A 759 12.715 -35.322 -3.647 1.00 24.24 C HETATM 726 O PTR A 759 11.817 -35.919 -4.252 1.00 63.23 O HETATM 727 CB PTR A 759 11.541 -35.042 -1.448 1.00 2.23 C HETATM 728 CG PTR A 759 11.578 -34.318 -0.127 1.00 73.10 C HETATM 729 CD1 PTR A 759 12.536 -34.626 0.815 1.00 45.40 C HETATM 730 CD2 PTR A 759 10.675 -33.315 0.165 1.00 71.50 C HETATM 731 CE1 PTR A 759 12.600 -33.961 2.009 1.00 0.43 C HETATM 732 CE2 PTR A 759 10.727 -32.641 1.363 1.00 70.54 C HETATM 733 CZ PTR A 759 11.695 -32.966 2.282 1.00 74.22 C HETATM 734 OH PTR A 759 11.765 -32.273 3.493 1.00 35.78 O HETATM 735 P PTR A 759 13.013 -31.440 3.968 1.00 35.78 P HETATM 736 O1P PTR A 759 14.173 -31.662 2.993 1.00 35.78 O HETATM 737 O2P PTR A 759 12.636 -29.924 3.870 1.00 35.78 O HETATM 738 O3P PTR A 759 13.193 -31.939 5.326 1.00 35.78 O HETATM 0 HE2 PTR A 759 10.005 -31.854 1.582 1.00 70.54 H new HETATM 0 HE1 PTR A 759 13.366 -34.220 2.740 1.00 0.43 H new HETATM 0 HD2 PTR A 759 9.909 -33.053 -0.565 1.00 71.50 H new HETATM 0 HD1 PTR A 759 13.257 -35.416 0.604 1.00 45.40 H new HETATM 0 HB3 PTR A 759 10.508 -35.105 -1.791 1.00 2.23 H new HETATM 0 HB2 PTR A 759 11.892 -36.064 -1.305 1.00 2.23 H new HETATM 0 HA PTR A 759 13.331 -34.054 -2.073 1.00 51.44 H new HETATM 0 H PTR A 759 11.573 -33.085 -4.059 1.00 10.44 H new ATOM 747 N ARG A 760 13.979 -35.459 -3.929 1.00 44.40 N ATOM 748 CA ARG A 760 14.438 -36.307 -5.009 1.00 60.44 C ATOM 749 C ARG A 760 14.317 -37.767 -4.632 1.00 50.32 C ATOM 750 O ARG A 760 14.651 -38.159 -3.516 1.00 54.51 O ATOM 751 CB ARG A 760 15.881 -35.972 -5.359 1.00 62.31 C ATOM 752 CG ARG A 760 16.084 -34.545 -5.834 1.00 14.32 C ATOM 753 CD ARG A 760 17.550 -34.226 -5.996 1.00 33.40 C ATOM 754 NE ARG A 760 17.771 -32.843 -6.423 1.00 11.31 N ATOM 755 CZ ARG A 760 18.606 -31.981 -5.809 1.00 62.22 C ATOM 756 NH1 ARG A 760 19.240 -32.343 -4.696 1.00 55.03 N ATOM 757 NH2 ARG A 760 18.779 -30.754 -6.299 1.00 64.41 N ATOM 0 H ARG A 760 14.727 -34.988 -3.420 1.00 44.40 H new ATOM 0 HA ARG A 760 13.810 -36.125 -5.881 1.00 60.44 H new ATOM 0 HB2 ARG A 760 16.506 -36.145 -4.483 1.00 62.31 H new ATOM 0 HB3 ARG A 760 16.224 -36.655 -6.136 1.00 62.31 H new ATOM 0 HG2 ARG A 760 15.570 -34.399 -6.784 1.00 14.32 H new ATOM 0 HG3 ARG A 760 15.636 -33.854 -5.120 1.00 14.32 H new ATOM 0 HD2 ARG A 760 18.064 -34.399 -5.051 1.00 33.40 H new ATOM 0 HD3 ARG A 760 17.989 -34.905 -6.727 1.00 33.40 H new ATOM 0 HE ARG A 760 17.259 -32.509 -7.240 1.00 11.31 H new ATOM 0 HH11 ARG A 760 19.094 -33.274 -4.306 1.00 55.03 H new ATOM 0 HH12 ARG A 760 19.871 -31.689 -4.233 1.00 55.03 H new ATOM 0 HH21 ARG A 760 18.279 -30.466 -7.140 1.00 64.41 H new ATOM 0 HH22 ARG A 760 19.411 -30.103 -5.833 1.00 64.41 H new ATOM 771 N GLY A 761 13.839 -38.558 -5.547 1.00 5.20 N ATOM 772 CA GLY A 761 13.682 -39.946 -5.294 1.00 71.11 C ATOM 773 C GLY A 761 12.265 -40.394 -5.479 1.00 65.24 C ATOM 774 O GLY A 761 11.801 -40.563 -6.610 1.00 25.24 O ATOM 0 H GLY A 761 13.552 -38.256 -6.478 1.00 5.20 H new ATOM 0 HA2 GLY A 761 14.331 -40.512 -5.962 1.00 71.11 H new ATOM 0 HA3 GLY A 761 14.002 -40.167 -4.276 1.00 71.11 H new ATOM 778 N THR A 762 11.573 -40.569 -4.395 1.00 44.41 N ATOM 779 CA THR A 762 10.227 -41.042 -4.424 1.00 40.14 C ATOM 780 C THR A 762 9.300 -40.078 -3.695 1.00 72.42 C ATOM 781 O THR A 762 8.592 -39.309 -4.371 1.00 0.10 O ATOM 782 CB THR A 762 10.123 -42.452 -3.802 1.00 74.02 C ATOM 783 OG1 THR A 762 10.900 -42.503 -2.578 1.00 12.21 O ATOM 784 CG2 THR A 762 10.639 -43.505 -4.773 1.00 14.41 C ATOM 785 OXT THR A 762 9.308 -40.070 -2.452 1.00 35.78 O ATOM 0 H THR A 762 11.932 -40.385 -3.458 1.00 44.41 H new ATOM 0 HA THR A 762 9.918 -41.102 -5.467 1.00 40.14 H new ATOM 0 HB THR A 762 9.075 -42.659 -3.583 1.00 74.02 H new ATOM 0 HG1 THR A 762 10.697 -41.717 -2.029 1.00 12.21 H new ATOM 0 HG21 THR A 762 10.558 -44.492 -4.317 1.00 14.41 H new ATOM 0 HG22 THR A 762 10.047 -43.478 -5.688 1.00 14.41 H new ATOM 0 HG23 THR A 762 11.683 -43.300 -5.011 1.00 14.41 H new TER 793 THR A 762