USER MOD reduce.3.24.130724 H: found=0, std=0, add=387, rem=0, adj=11 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 Single : A 716 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0101) USER MOD Single : A 720 THR OG1 : rot 180:sc= 0 USER MOD Single : A 722 HIS : no HD1:sc= -0.0831 X(o=-0.083,f=0) USER MOD Single : A 725 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 729 LYS NZ :NH3+ -127:sc= 0.0213 (180deg=0) USER MOD Single : A 738 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 741 THR OG1 : rot 180:sc= 0 USER MOD Single : A 743 ASN : amide:sc= 0.139 X(o=0.14,f=-0.0076) USER MOD Single : A 744 ASN : amide:sc= -4.4! C(o=-4.4!,f=-4.5!) USER MOD Single : A 748 LYS NZ :NH3+ 168:sc= 1.06 (180deg=0.958) USER MOD Single : A 751 THR OG1 : rot 180:sc= 0 USER MOD Single : A 752 SER OG : rot 80:sc= 0.266 USER MOD Single : A 753 THR OG1 : rot 180:sc= 0 USER MOD Single : A 755 THR OG1 : rot 180:sc= -0.178 USER MOD Single : A 756 ASN : amide:sc= -0.0533 K(o=-0.053,f=-5.8!) USER MOD Single : A 758 THR OG1 : rot 180:sc= 0 USER MOD Single : A 762 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 716 1.117 -6.742 -8.102 1.00 13.00 N ATOM 2 CA LYS A 716 2.511 -6.383 -8.398 1.00 3.51 C ATOM 3 C LYS A 716 3.477 -7.494 -7.974 1.00 34.43 C ATOM 4 O LYS A 716 4.689 -7.316 -8.012 1.00 55.51 O ATOM 5 CB LYS A 716 2.887 -5.046 -7.693 1.00 4.41 C ATOM 6 CG LYS A 716 2.690 -5.029 -6.152 1.00 4.01 C ATOM 7 CD LYS A 716 3.795 -5.801 -5.424 1.00 54.44 C ATOM 8 CE LYS A 716 3.514 -5.926 -3.948 1.00 54.31 C ATOM 9 NZ LYS A 716 3.567 -4.613 -3.259 1.00 41.13 N ATOM 0 HA LYS A 716 2.600 -6.254 -9.477 1.00 3.51 H new ATOM 0 HB2 LYS A 716 3.931 -4.820 -7.912 1.00 4.41 H new ATOM 0 HB3 LYS A 716 2.290 -4.245 -8.128 1.00 4.41 H new ATOM 0 HG2 LYS A 716 2.676 -3.998 -5.800 1.00 4.01 H new ATOM 0 HG3 LYS A 716 1.721 -5.464 -5.905 1.00 4.01 H new ATOM 0 HD2 LYS A 716 3.892 -6.795 -5.861 1.00 54.44 H new ATOM 0 HD3 LYS A 716 4.749 -5.294 -5.570 1.00 54.44 H new ATOM 0 HE2 LYS A 716 2.530 -6.372 -3.803 1.00 54.31 H new ATOM 0 HE3 LYS A 716 4.240 -6.602 -3.497 1.00 54.31 H new ATOM 0 HZ1 LYS A 716 3.419 -4.750 -2.239 1.00 41.13 H new ATOM 0 HZ2 LYS A 716 4.497 -4.175 -3.418 1.00 41.13 H new ATOM 0 HZ3 LYS A 716 2.823 -3.992 -3.637 1.00 41.13 H new ATOM 23 N LEU A 717 2.941 -8.621 -7.592 1.00 51.33 N ATOM 24 CA LEU A 717 3.724 -9.693 -6.998 1.00 60.25 C ATOM 25 C LEU A 717 4.746 -10.297 -7.981 1.00 32.53 C ATOM 26 O LEU A 717 5.798 -10.765 -7.571 1.00 4.32 O ATOM 27 CB LEU A 717 2.807 -10.757 -6.426 1.00 14.31 C ATOM 28 CG LEU A 717 3.478 -11.948 -5.743 1.00 25.33 C ATOM 29 CD1 LEU A 717 4.222 -11.504 -4.498 1.00 75.54 C ATOM 30 CD2 LEU A 717 2.458 -13.020 -5.409 1.00 4.14 C ATOM 0 H LEU A 717 1.947 -8.831 -7.680 1.00 51.33 H new ATOM 0 HA LEU A 717 4.307 -9.260 -6.185 1.00 60.25 H new ATOM 0 HB2 LEU A 717 2.143 -10.281 -5.705 1.00 14.31 H new ATOM 0 HB3 LEU A 717 2.181 -11.136 -7.234 1.00 14.31 H new ATOM 0 HG LEU A 717 4.203 -12.375 -6.436 1.00 25.33 H new ATOM 0 HD11 LEU A 717 4.692 -12.368 -4.028 1.00 75.54 H new ATOM 0 HD12 LEU A 717 4.988 -10.778 -4.771 1.00 75.54 H new ATOM 0 HD13 LEU A 717 3.522 -11.047 -3.799 1.00 75.54 H new ATOM 0 HD21 LEU A 717 2.957 -13.859 -4.924 1.00 4.14 H new ATOM 0 HD22 LEU A 717 1.704 -12.608 -4.738 1.00 4.14 H new ATOM 0 HD23 LEU A 717 1.979 -13.364 -6.325 1.00 4.14 H new ATOM 42 N LEU A 718 4.437 -10.264 -9.258 1.00 0.31 N ATOM 43 CA LEU A 718 5.373 -10.752 -10.273 1.00 70.40 C ATOM 44 C LEU A 718 6.466 -9.723 -10.504 1.00 23.25 C ATOM 45 O LEU A 718 7.608 -10.060 -10.844 1.00 4.11 O ATOM 46 CB LEU A 718 4.648 -11.075 -11.611 1.00 31.15 C ATOM 47 CG LEU A 718 3.689 -12.296 -11.617 1.00 64.22 C ATOM 48 CD1 LEU A 718 2.431 -12.027 -10.795 1.00 3.40 C ATOM 49 CD2 LEU A 718 3.328 -12.684 -13.042 1.00 24.22 C ATOM 0 H LEU A 718 3.555 -9.909 -9.627 1.00 0.31 H new ATOM 0 HA LEU A 718 5.817 -11.677 -9.906 1.00 70.40 H new ATOM 0 HB2 LEU A 718 4.078 -10.195 -11.908 1.00 31.15 H new ATOM 0 HB3 LEU A 718 5.407 -11.237 -12.377 1.00 31.15 H new ATOM 0 HG LEU A 718 4.213 -13.131 -11.151 1.00 64.22 H new ATOM 0 HD11 LEU A 718 1.784 -12.904 -10.823 1.00 3.40 H new ATOM 0 HD12 LEU A 718 2.709 -11.814 -9.763 1.00 3.40 H new ATOM 0 HD13 LEU A 718 1.900 -11.171 -11.212 1.00 3.40 H new ATOM 0 HD21 LEU A 718 2.655 -13.542 -13.026 1.00 24.22 H new ATOM 0 HD22 LEU A 718 2.835 -11.845 -13.534 1.00 24.22 H new ATOM 0 HD23 LEU A 718 4.234 -12.944 -13.589 1.00 24.22 H new ATOM 61 N ILE A 719 6.115 -8.478 -10.310 1.00 53.12 N ATOM 62 CA ILE A 719 7.033 -7.379 -10.489 1.00 5.24 C ATOM 63 C ILE A 719 7.957 -7.224 -9.264 1.00 15.45 C ATOM 64 O ILE A 719 9.153 -6.980 -9.404 1.00 14.22 O ATOM 65 CB ILE A 719 6.264 -6.041 -10.733 1.00 3.10 C ATOM 66 CG1 ILE A 719 5.284 -6.188 -11.916 1.00 25.21 C ATOM 67 CG2 ILE A 719 7.234 -4.885 -10.978 1.00 3.44 C ATOM 68 CD1 ILE A 719 5.945 -6.583 -13.228 1.00 62.34 C ATOM 0 H ILE A 719 5.179 -8.195 -10.022 1.00 53.12 H new ATOM 0 HA ILE A 719 7.641 -7.604 -11.365 1.00 5.24 H new ATOM 0 HB ILE A 719 5.691 -5.813 -9.834 1.00 3.10 H new ATOM 0 HG12 ILE A 719 4.533 -6.936 -11.661 1.00 25.21 H new ATOM 0 HG13 ILE A 719 4.758 -5.244 -12.057 1.00 25.21 H new ATOM 0 HG21 ILE A 719 6.671 -3.967 -11.145 1.00 3.44 H new ATOM 0 HG22 ILE A 719 7.880 -4.762 -10.109 1.00 3.44 H new ATOM 0 HG23 ILE A 719 7.844 -5.101 -11.855 1.00 3.44 H new ATOM 0 HD11 ILE A 719 5.187 -6.665 -14.007 1.00 62.34 H new ATOM 0 HD12 ILE A 719 6.675 -5.825 -13.510 1.00 62.34 H new ATOM 0 HD13 ILE A 719 6.447 -7.543 -13.108 1.00 62.34 H new ATOM 80 N THR A 720 7.390 -7.399 -8.067 1.00 73.22 N ATOM 81 CA THR A 720 8.127 -7.174 -6.821 1.00 41.40 C ATOM 82 C THR A 720 9.267 -8.184 -6.639 1.00 51.42 C ATOM 83 O THR A 720 10.182 -7.960 -5.845 1.00 61.11 O ATOM 84 CB THR A 720 7.193 -7.206 -5.585 1.00 20.33 C ATOM 85 OG1 THR A 720 7.845 -6.593 -4.462 1.00 3.24 O ATOM 86 CG2 THR A 720 6.803 -8.638 -5.228 1.00 63.42 C ATOM 0 H THR A 720 6.423 -7.696 -7.935 1.00 73.22 H new ATOM 0 HA THR A 720 8.561 -6.177 -6.900 1.00 41.40 H new ATOM 0 HB THR A 720 6.287 -6.652 -5.832 1.00 20.33 H new ATOM 0 HG1 THR A 720 7.248 -6.615 -3.685 1.00 3.24 H new ATOM 0 HG21 THR A 720 6.148 -8.630 -4.357 1.00 63.42 H new ATOM 0 HG22 THR A 720 6.282 -9.094 -6.070 1.00 63.42 H new ATOM 0 HG23 THR A 720 7.700 -9.214 -5.002 1.00 63.42 H new ATOM 94 N ILE A 721 9.210 -9.279 -7.393 1.00 33.43 N ATOM 95 CA ILE A 721 10.237 -10.304 -7.359 1.00 31.14 C ATOM 96 C ILE A 721 11.608 -9.695 -7.614 1.00 11.32 C ATOM 97 O ILE A 721 12.602 -10.072 -6.981 1.00 25.21 O ATOM 98 CB ILE A 721 9.962 -11.384 -8.435 1.00 52.33 C ATOM 99 CG1 ILE A 721 8.651 -12.114 -8.140 1.00 32.41 C ATOM 100 CG2 ILE A 721 11.119 -12.360 -8.529 1.00 30.22 C ATOM 101 CD1 ILE A 721 8.261 -13.129 -9.194 1.00 14.11 C ATOM 0 H ILE A 721 8.449 -9.476 -8.043 1.00 33.43 H new ATOM 0 HA ILE A 721 10.219 -10.761 -6.370 1.00 31.14 H new ATOM 0 HB ILE A 721 9.865 -10.888 -9.401 1.00 52.33 H new ATOM 0 HG12 ILE A 721 8.737 -12.619 -7.178 1.00 32.41 H new ATOM 0 HG13 ILE A 721 7.851 -11.379 -8.044 1.00 32.41 H new ATOM 0 HG21 ILE A 721 10.902 -13.109 -9.291 1.00 30.22 H new ATOM 0 HG22 ILE A 721 12.028 -11.822 -8.797 1.00 30.22 H new ATOM 0 HG23 ILE A 721 11.259 -12.852 -7.567 1.00 30.22 H new ATOM 0 HD11 ILE A 721 7.321 -13.603 -8.912 1.00 14.11 H new ATOM 0 HD12 ILE A 721 8.141 -12.628 -10.155 1.00 14.11 H new ATOM 0 HD13 ILE A 721 9.040 -13.887 -9.275 1.00 14.11 H new ATOM 113 N HIS A 722 11.646 -8.735 -8.509 1.00 53.32 N ATOM 114 CA HIS A 722 12.871 -8.101 -8.898 1.00 53.21 C ATOM 115 C HIS A 722 13.536 -7.405 -7.715 1.00 54.35 C ATOM 116 O HIS A 722 14.761 -7.402 -7.596 1.00 33.23 O ATOM 117 CB HIS A 722 12.618 -7.111 -10.009 1.00 72.15 C ATOM 118 CG HIS A 722 13.820 -6.815 -10.798 1.00 72.20 C ATOM 119 ND1 HIS A 722 14.280 -5.547 -11.030 1.00 64.40 N ATOM 120 CD2 HIS A 722 14.659 -7.641 -11.429 1.00 14.30 C ATOM 121 CE1 HIS A 722 15.357 -5.607 -11.777 1.00 54.21 C ATOM 122 NE2 HIS A 722 15.610 -6.868 -12.033 1.00 31.10 N ATOM 0 H HIS A 722 10.820 -8.375 -8.987 1.00 53.32 H new ATOM 0 HA HIS A 722 13.549 -8.875 -9.258 1.00 53.21 H new ATOM 0 HB2 HIS A 722 11.844 -7.504 -10.669 1.00 72.15 H new ATOM 0 HB3 HIS A 722 12.233 -6.185 -9.582 1.00 72.15 H new ATOM 0 HD2 HIS A 722 14.597 -8.719 -11.457 1.00 14.30 H new ATOM 0 HE1 HIS A 722 15.936 -4.763 -12.122 1.00 54.21 H new ATOM 0 HE2 HIS A 722 16.390 -7.215 -12.592 1.00 31.10 H new ATOM 131 N ASP A 723 12.733 -6.827 -6.845 1.00 24.43 N ATOM 132 CA ASP A 723 13.260 -6.161 -5.655 1.00 62.40 C ATOM 133 C ASP A 723 13.437 -7.136 -4.531 1.00 2.23 C ATOM 134 O ASP A 723 14.278 -6.943 -3.659 1.00 2.40 O ATOM 135 CB ASP A 723 12.358 -5.009 -5.211 1.00 64.34 C ATOM 136 CG ASP A 723 12.462 -3.803 -6.114 1.00 73.32 C ATOM 137 OD1 ASP A 723 11.848 -3.809 -7.200 1.00 35.03 O ATOM 138 OD2 ASP A 723 13.163 -2.838 -5.744 1.00 25.23 O ATOM 0 H ASP A 723 11.717 -6.801 -6.932 1.00 24.43 H new ATOM 0 HA ASP A 723 14.233 -5.748 -5.920 1.00 62.40 H new ATOM 0 HB2 ASP A 723 11.324 -5.352 -5.188 1.00 64.34 H new ATOM 0 HB3 ASP A 723 12.621 -4.719 -4.194 1.00 64.34 H new ATOM 143 N ARG A 724 12.645 -8.190 -4.550 1.00 53.20 N ATOM 144 CA ARG A 724 12.720 -9.216 -3.548 1.00 73.05 C ATOM 145 C ARG A 724 14.057 -9.943 -3.622 1.00 64.21 C ATOM 146 O ARG A 724 14.729 -10.130 -2.615 1.00 41.45 O ATOM 147 CB ARG A 724 11.570 -10.208 -3.709 1.00 33.45 C ATOM 148 CG ARG A 724 11.476 -11.205 -2.587 1.00 10.24 C ATOM 149 CD ARG A 724 10.362 -12.198 -2.806 1.00 34.01 C ATOM 150 NE ARG A 724 10.236 -13.094 -1.667 1.00 53.20 N ATOM 151 CZ ARG A 724 10.760 -14.312 -1.609 1.00 71.51 C ATOM 152 NH1 ARG A 724 11.340 -14.848 -2.696 1.00 54.50 N ATOM 153 NH2 ARG A 724 10.688 -15.012 -0.484 1.00 32.41 N ATOM 0 H ARG A 724 11.934 -8.352 -5.263 1.00 53.20 H new ATOM 0 HA ARG A 724 12.637 -8.743 -2.570 1.00 73.05 H new ATOM 0 HB2 ARG A 724 10.632 -9.657 -3.774 1.00 33.45 H new ATOM 0 HB3 ARG A 724 11.692 -10.743 -4.651 1.00 33.45 H new ATOM 0 HG2 ARG A 724 12.423 -11.737 -2.494 1.00 10.24 H new ATOM 0 HG3 ARG A 724 11.313 -10.678 -1.647 1.00 10.24 H new ATOM 0 HD2 ARG A 724 9.422 -11.668 -2.963 1.00 34.01 H new ATOM 0 HD3 ARG A 724 10.557 -12.776 -3.709 1.00 34.01 H new ATOM 0 HE ARG A 724 9.709 -12.764 -0.858 1.00 53.20 H new ATOM 0 HH11 ARG A 724 11.378 -14.319 -3.567 1.00 54.50 H new ATOM 0 HH12 ARG A 724 11.742 -15.784 -2.650 1.00 54.50 H new ATOM 0 HH21 ARG A 724 10.230 -14.614 0.336 1.00 32.41 H new ATOM 0 HH22 ARG A 724 11.091 -15.948 -0.439 1.00 32.41 H new ATOM 167 N LYS A 725 14.439 -10.334 -4.819 1.00 71.54 N ATOM 168 CA LYS A 725 15.712 -11.009 -5.031 1.00 61.52 C ATOM 169 C LYS A 725 16.872 -10.053 -4.811 1.00 23.32 C ATOM 170 O LYS A 725 17.996 -10.471 -4.558 1.00 63.52 O ATOM 171 CB LYS A 725 15.780 -11.618 -6.433 1.00 53.34 C ATOM 172 CG LYS A 725 14.724 -12.713 -6.722 1.00 64.54 C ATOM 173 CD LYS A 725 14.957 -14.000 -5.888 1.00 21.22 C ATOM 174 CE LYS A 725 14.486 -13.848 -4.450 1.00 22.22 C ATOM 175 NZ LYS A 725 14.771 -15.051 -3.636 1.00 2.21 N ATOM 0 H LYS A 725 13.887 -10.198 -5.666 1.00 71.54 H new ATOM 0 HA LYS A 725 15.789 -11.817 -4.303 1.00 61.52 H new ATOM 0 HB2 LYS A 725 15.664 -10.820 -7.166 1.00 53.34 H new ATOM 0 HB3 LYS A 725 16.773 -12.044 -6.580 1.00 53.34 H new ATOM 0 HG2 LYS A 725 13.730 -12.320 -6.507 1.00 64.54 H new ATOM 0 HG3 LYS A 725 14.746 -12.963 -7.783 1.00 64.54 H new ATOM 0 HD2 LYS A 725 14.431 -14.833 -6.354 1.00 21.22 H new ATOM 0 HD3 LYS A 725 16.018 -14.249 -5.896 1.00 21.22 H new ATOM 0 HE2 LYS A 725 14.974 -12.983 -4.000 1.00 22.22 H new ATOM 0 HE3 LYS A 725 13.414 -13.651 -4.440 1.00 22.22 H new ATOM 0 HZ1 LYS A 725 14.432 -14.901 -2.664 1.00 2.21 H new ATOM 0 HZ2 LYS A 725 14.285 -15.873 -4.049 1.00 2.21 H new ATOM 0 HZ3 LYS A 725 15.796 -15.226 -3.622 1.00 2.21 H new ATOM 189 N GLU A 726 16.587 -8.776 -4.911 1.00 21.21 N ATOM 190 CA GLU A 726 17.576 -7.761 -4.720 1.00 13.24 C ATOM 191 C GLU A 726 17.735 -7.425 -3.227 1.00 24.02 C ATOM 192 O GLU A 726 18.606 -7.962 -2.554 1.00 52.12 O ATOM 193 CB GLU A 726 17.210 -6.501 -5.522 1.00 61.12 C ATOM 194 CG GLU A 726 18.192 -5.355 -5.377 1.00 5.24 C ATOM 195 CD GLU A 726 17.778 -4.148 -6.160 1.00 15.44 C ATOM 196 OE1 GLU A 726 17.020 -3.313 -5.621 1.00 41.02 O ATOM 197 OE2 GLU A 726 18.195 -4.023 -7.318 1.00 3.41 O ATOM 0 H GLU A 726 15.657 -8.418 -5.128 1.00 21.21 H new ATOM 0 HA GLU A 726 18.531 -8.140 -5.084 1.00 13.24 H new ATOM 0 HB2 GLU A 726 17.134 -6.766 -6.576 1.00 61.12 H new ATOM 0 HB3 GLU A 726 16.224 -6.159 -5.208 1.00 61.12 H new ATOM 0 HG2 GLU A 726 18.283 -5.088 -4.324 1.00 5.24 H new ATOM 0 HG3 GLU A 726 19.178 -5.680 -5.709 1.00 5.24 H new ATOM 204 N PHE A 727 16.866 -6.560 -2.726 1.00 12.25 N ATOM 205 CA PHE A 727 16.967 -6.059 -1.374 1.00 43.55 C ATOM 206 C PHE A 727 16.449 -7.045 -0.342 1.00 51.32 C ATOM 207 O PHE A 727 17.112 -7.302 0.660 1.00 54.44 O ATOM 208 CB PHE A 727 16.257 -4.712 -1.234 1.00 34.11 C ATOM 209 CG PHE A 727 16.199 -4.205 0.180 1.00 51.44 C ATOM 210 CD1 PHE A 727 17.358 -3.969 0.891 1.00 62.23 C ATOM 211 CD2 PHE A 727 14.986 -3.979 0.795 1.00 32.25 C ATOM 212 CE1 PHE A 727 17.306 -3.516 2.185 1.00 23.32 C ATOM 213 CE2 PHE A 727 14.928 -3.526 2.090 1.00 72.21 C ATOM 214 CZ PHE A 727 16.089 -3.294 2.786 1.00 3.31 C ATOM 0 H PHE A 727 16.073 -6.189 -3.249 1.00 12.25 H new ATOM 0 HA PHE A 727 18.029 -5.919 -1.175 1.00 43.55 H new ATOM 0 HB2 PHE A 727 16.768 -3.976 -1.854 1.00 34.11 H new ATOM 0 HB3 PHE A 727 15.242 -4.804 -1.620 1.00 34.11 H new ATOM 0 HD1 PHE A 727 18.316 -4.143 0.424 1.00 62.23 H new ATOM 0 HD2 PHE A 727 14.070 -4.160 0.252 1.00 32.25 H new ATOM 0 HE1 PHE A 727 18.220 -3.334 2.731 1.00 23.32 H new ATOM 0 HE2 PHE A 727 13.971 -3.353 2.560 1.00 72.21 H new ATOM 0 HZ PHE A 727 16.046 -2.937 3.805 1.00 3.31 H new ATOM 224 N ALA A 728 15.258 -7.595 -0.584 1.00 63.33 N ATOM 225 CA ALA A 728 14.600 -8.479 0.400 1.00 31.13 C ATOM 226 C ALA A 728 15.491 -9.642 0.827 1.00 21.31 C ATOM 227 O ALA A 728 15.440 -10.074 1.949 1.00 11.11 O ATOM 228 CB ALA A 728 13.273 -8.985 -0.117 1.00 61.24 C ATOM 0 H ALA A 728 14.727 -7.450 -1.443 1.00 63.33 H new ATOM 0 HA ALA A 728 14.416 -7.872 1.287 1.00 31.13 H new ATOM 0 HB1 ALA A 728 12.814 -9.633 0.630 1.00 61.24 H new ATOM 0 HB2 ALA A 728 12.615 -8.140 -0.318 1.00 61.24 H new ATOM 0 HB3 ALA A 728 13.432 -9.548 -1.037 1.00 61.24 H new ATOM 234 N LYS A 729 16.321 -10.125 -0.077 1.00 4.30 N ATOM 235 CA LYS A 729 17.198 -11.244 0.235 1.00 20.12 C ATOM 236 C LYS A 729 18.227 -10.877 1.321 1.00 20.15 C ATOM 237 O LYS A 729 18.698 -11.745 2.063 1.00 43.31 O ATOM 238 CB LYS A 729 17.880 -11.795 -1.040 1.00 64.22 C ATOM 239 CG LYS A 729 18.860 -12.974 -0.804 1.00 32.11 C ATOM 240 CD LYS A 729 18.243 -14.093 0.078 1.00 44.21 C ATOM 241 CE LYS A 729 16.931 -14.603 -0.481 1.00 33.21 C ATOM 242 NZ LYS A 729 16.350 -15.677 0.352 1.00 71.11 N ATOM 0 H LYS A 729 16.409 -9.766 -1.028 1.00 4.30 H new ATOM 0 HA LYS A 729 16.578 -12.042 0.643 1.00 20.12 H new ATOM 0 HB2 LYS A 729 17.106 -12.120 -1.736 1.00 64.22 H new ATOM 0 HB3 LYS A 729 18.423 -10.983 -1.523 1.00 64.22 H new ATOM 0 HG2 LYS A 729 19.155 -13.395 -1.765 1.00 32.11 H new ATOM 0 HG3 LYS A 729 19.766 -12.599 -0.328 1.00 32.11 H new ATOM 0 HD2 LYS A 729 18.948 -14.920 0.158 1.00 44.21 H new ATOM 0 HD3 LYS A 729 18.083 -13.712 1.086 1.00 44.21 H new ATOM 0 HE2 LYS A 729 16.223 -13.777 -0.552 1.00 33.21 H new ATOM 0 HE3 LYS A 729 17.089 -14.976 -1.493 1.00 33.21 H new ATOM 0 HZ1 LYS A 729 16.143 -16.505 -0.243 1.00 71.11 H new ATOM 0 HZ2 LYS A 729 17.027 -15.945 1.095 1.00 71.11 H new ATOM 0 HZ3 LYS A 729 15.470 -15.338 0.791 1.00 71.11 H new ATOM 256 N PHE A 730 18.555 -9.610 1.419 1.00 53.00 N ATOM 257 CA PHE A 730 19.463 -9.144 2.450 1.00 72.03 C ATOM 258 C PHE A 730 18.838 -9.280 3.796 1.00 50.10 C ATOM 259 O PHE A 730 19.386 -9.919 4.675 1.00 51.14 O ATOM 260 CB PHE A 730 19.856 -7.704 2.219 1.00 34.40 C ATOM 261 CG PHE A 730 20.819 -7.510 1.110 1.00 13.41 C ATOM 262 CD1 PHE A 730 22.173 -7.688 1.317 1.00 24.13 C ATOM 263 CD2 PHE A 730 20.381 -7.141 -0.136 1.00 20.44 C ATOM 264 CE1 PHE A 730 23.076 -7.502 0.291 1.00 60.02 C ATOM 265 CE2 PHE A 730 21.275 -6.951 -1.174 1.00 35.42 C ATOM 266 CZ PHE A 730 22.626 -7.133 -0.959 1.00 44.32 C ATOM 0 H PHE A 730 18.208 -8.879 0.798 1.00 53.00 H new ATOM 0 HA PHE A 730 20.360 -9.762 2.405 1.00 72.03 H new ATOM 0 HB2 PHE A 730 18.958 -7.122 2.012 1.00 34.40 H new ATOM 0 HB3 PHE A 730 20.289 -7.305 3.136 1.00 34.40 H new ATOM 0 HD1 PHE A 730 22.529 -7.977 2.295 1.00 24.13 H new ATOM 0 HD2 PHE A 730 19.325 -6.997 -0.309 1.00 20.44 H new ATOM 0 HE1 PHE A 730 24.132 -7.645 0.466 1.00 60.02 H new ATOM 0 HE2 PHE A 730 20.917 -6.661 -2.151 1.00 35.42 H new ATOM 0 HZ PHE A 730 23.328 -6.987 -1.767 1.00 44.32 H new ATOM 276 N GLU A 731 17.667 -8.689 3.950 1.00 11.40 N ATOM 277 CA GLU A 731 16.955 -8.714 5.210 1.00 23.43 C ATOM 278 C GLU A 731 16.493 -10.132 5.548 1.00 32.54 C ATOM 279 O GLU A 731 16.394 -10.500 6.718 1.00 65.23 O ATOM 280 CB GLU A 731 15.750 -7.753 5.168 1.00 4.00 C ATOM 281 CG GLU A 731 14.716 -8.112 4.118 1.00 13.13 C ATOM 282 CD GLU A 731 13.540 -7.183 4.093 1.00 0.34 C ATOM 283 OE1 GLU A 731 13.613 -6.145 3.426 1.00 12.40 O ATOM 284 OE2 GLU A 731 12.509 -7.499 4.741 1.00 21.05 O ATOM 0 H GLU A 731 17.186 -8.181 3.207 1.00 11.40 H new ATOM 0 HA GLU A 731 17.639 -8.383 5.992 1.00 23.43 H new ATOM 0 HB2 GLU A 731 15.271 -7.743 6.147 1.00 4.00 H new ATOM 0 HB3 GLU A 731 16.110 -6.742 4.979 1.00 4.00 H new ATOM 0 HG2 GLU A 731 15.191 -8.110 3.137 1.00 13.13 H new ATOM 0 HG3 GLU A 731 14.363 -9.127 4.300 1.00 13.13 H new ATOM 291 N GLU A 732 16.240 -10.931 4.504 1.00 41.02 N ATOM 292 CA GLU A 732 15.712 -12.290 4.668 1.00 14.31 C ATOM 293 C GLU A 732 16.614 -13.185 5.478 1.00 10.40 C ATOM 294 O GLU A 732 16.143 -14.065 6.157 1.00 43.32 O ATOM 295 CB GLU A 732 15.397 -12.940 3.335 1.00 61.44 C ATOM 296 CG GLU A 732 13.987 -12.701 2.848 1.00 42.41 C ATOM 297 CD GLU A 732 13.635 -13.570 1.676 1.00 62.10 C ATOM 298 OE1 GLU A 732 13.488 -14.790 1.864 1.00 31.53 O ATOM 299 OE2 GLU A 732 13.496 -13.044 0.565 1.00 60.20 O ATOM 0 H GLU A 732 16.393 -10.658 3.533 1.00 41.02 H new ATOM 0 HA GLU A 732 14.785 -12.171 5.228 1.00 14.31 H new ATOM 0 HB2 GLU A 732 16.096 -12.566 2.587 1.00 61.44 H new ATOM 0 HB3 GLU A 732 15.564 -14.014 3.419 1.00 61.44 H new ATOM 0 HG2 GLU A 732 13.287 -12.891 3.662 1.00 42.41 H new ATOM 0 HG3 GLU A 732 13.874 -11.654 2.568 1.00 42.41 H new ATOM 306 N GLU A 733 17.903 -12.974 5.395 1.00 53.15 N ATOM 307 CA GLU A 733 18.847 -13.806 6.143 1.00 31.14 C ATOM 308 C GLU A 733 18.587 -13.735 7.652 1.00 11.40 C ATOM 309 O GLU A 733 18.459 -14.759 8.315 1.00 71.13 O ATOM 310 CB GLU A 733 20.281 -13.436 5.815 1.00 61.20 C ATOM 311 CG GLU A 733 20.632 -13.675 4.370 1.00 25.41 C ATOM 312 CD GLU A 733 22.083 -13.420 4.062 1.00 45.40 C ATOM 313 OE1 GLU A 733 22.444 -12.253 3.771 1.00 41.22 O ATOM 314 OE2 GLU A 733 22.876 -14.386 4.085 1.00 3.24 O ATOM 0 H GLU A 733 18.332 -12.244 4.826 1.00 53.15 H new ATOM 0 HA GLU A 733 18.689 -14.839 5.833 1.00 31.14 H new ATOM 0 HB2 GLU A 733 20.444 -12.385 6.054 1.00 61.20 H new ATOM 0 HB3 GLU A 733 20.954 -14.015 6.448 1.00 61.20 H new ATOM 0 HG2 GLU A 733 20.387 -14.705 4.109 1.00 25.41 H new ATOM 0 HG3 GLU A 733 20.016 -13.032 3.742 1.00 25.41 H new ATOM 321 N ARG A 734 18.509 -12.543 8.174 1.00 0.13 N ATOM 322 CA ARG A 734 18.179 -12.342 9.563 1.00 12.13 C ATOM 323 C ARG A 734 16.704 -12.622 9.811 1.00 14.30 C ATOM 324 O ARG A 734 16.345 -13.304 10.768 1.00 61.51 O ATOM 325 CB ARG A 734 18.532 -10.911 10.007 1.00 61.50 C ATOM 326 CG ARG A 734 18.178 -10.602 11.451 1.00 11.03 C ATOM 327 CD ARG A 734 18.931 -11.499 12.409 1.00 73.21 C ATOM 328 NE ARG A 734 18.466 -11.338 13.779 1.00 63.31 N ATOM 329 CZ ARG A 734 18.514 -12.285 14.711 1.00 41.00 C ATOM 330 NH1 ARG A 734 19.029 -13.483 14.426 1.00 52.21 N ATOM 331 NH2 ARG A 734 18.047 -12.040 15.925 1.00 64.22 N ATOM 0 H ARG A 734 18.672 -11.682 7.652 1.00 0.13 H new ATOM 0 HA ARG A 734 18.769 -13.042 10.154 1.00 12.13 H new ATOM 0 HB2 ARG A 734 19.601 -10.752 9.865 1.00 61.50 H new ATOM 0 HB3 ARG A 734 18.015 -10.204 9.359 1.00 61.50 H new ATOM 0 HG2 ARG A 734 18.409 -9.559 11.669 1.00 11.03 H new ATOM 0 HG3 ARG A 734 17.105 -10.728 11.599 1.00 11.03 H new ATOM 0 HD2 ARG A 734 18.811 -12.539 12.104 1.00 73.21 H new ATOM 0 HD3 ARG A 734 19.996 -11.273 12.358 1.00 73.21 H new ATOM 0 HE ARG A 734 18.075 -10.434 14.043 1.00 63.31 H new ATOM 0 HH11 ARG A 734 19.388 -13.675 13.490 1.00 52.21 H new ATOM 0 HH12 ARG A 734 19.064 -14.207 15.144 1.00 52.21 H new ATOM 0 HH21 ARG A 734 17.651 -11.126 16.144 1.00 64.22 H new ATOM 0 HH22 ARG A 734 18.083 -12.765 16.641 1.00 64.22 H new ATOM 345 N ALA A 735 15.863 -12.103 8.932 1.00 35.41 N ATOM 346 CA ALA A 735 14.418 -12.201 9.082 1.00 72.52 C ATOM 347 C ALA A 735 13.948 -13.636 9.094 1.00 41.31 C ATOM 348 O ALA A 735 13.346 -14.078 10.039 1.00 1.13 O ATOM 349 CB ALA A 735 13.709 -11.418 7.985 1.00 4.43 C ATOM 0 H ALA A 735 16.161 -11.602 8.095 1.00 35.41 H new ATOM 0 HA ALA A 735 14.163 -11.764 10.048 1.00 72.52 H new ATOM 0 HB1 ALA A 735 12.630 -11.504 8.115 1.00 4.43 H new ATOM 0 HB2 ALA A 735 13.999 -10.369 8.042 1.00 4.43 H new ATOM 0 HB3 ALA A 735 13.990 -11.820 7.012 1.00 4.43 H new ATOM 355 N ARG A 736 14.257 -14.363 8.055 1.00 24.15 N ATOM 356 CA ARG A 736 13.772 -15.723 7.906 1.00 20.34 C ATOM 357 C ARG A 736 14.435 -16.655 8.919 1.00 23.41 C ATOM 358 O ARG A 736 13.953 -17.762 9.166 1.00 23.40 O ATOM 359 CB ARG A 736 14.027 -16.228 6.493 1.00 14.21 C ATOM 360 CG ARG A 736 13.259 -17.480 6.138 1.00 14.54 C ATOM 361 CD ARG A 736 13.804 -18.119 4.885 1.00 63.22 C ATOM 362 NE ARG A 736 15.146 -18.713 5.099 1.00 45.01 N ATOM 363 CZ ARG A 736 16.105 -18.820 4.151 1.00 74.52 C ATOM 364 NH1 ARG A 736 15.880 -18.366 2.913 1.00 74.10 N ATOM 365 NH2 ARG A 736 17.281 -19.391 4.447 1.00 53.13 N ATOM 0 H ARG A 736 14.847 -14.040 7.289 1.00 24.15 H new ATOM 0 HA ARG A 736 12.698 -15.717 8.093 1.00 20.34 H new ATOM 0 HB2 ARG A 736 13.766 -15.441 5.785 1.00 14.21 H new ATOM 0 HB3 ARG A 736 15.093 -16.423 6.375 1.00 14.21 H new ATOM 0 HG2 ARG A 736 13.313 -18.189 6.964 1.00 14.54 H new ATOM 0 HG3 ARG A 736 12.206 -17.236 5.996 1.00 14.54 H new ATOM 0 HD2 ARG A 736 13.116 -18.893 4.545 1.00 63.22 H new ATOM 0 HD3 ARG A 736 13.861 -17.372 4.093 1.00 63.22 H new ATOM 0 HE ARG A 736 15.362 -19.067 6.031 1.00 45.01 H new ATOM 0 HH11 ARG A 736 14.984 -17.938 2.682 1.00 74.10 H new ATOM 0 HH12 ARG A 736 16.605 -18.448 2.200 1.00 74.10 H new ATOM 0 HH21 ARG A 736 17.453 -19.745 5.388 1.00 53.13 H new ATOM 0 HH22 ARG A 736 18.003 -19.471 3.731 1.00 53.13 H new ATOM 379 N ALA A 737 15.535 -16.199 9.510 1.00 32.51 N ATOM 380 CA ALA A 737 16.264 -17.007 10.480 1.00 25.12 C ATOM 381 C ALA A 737 15.386 -17.362 11.689 1.00 15.33 C ATOM 382 O ALA A 737 15.460 -18.474 12.213 1.00 73.33 O ATOM 383 CB ALA A 737 17.529 -16.297 10.924 1.00 70.32 C ATOM 0 H ALA A 737 15.939 -15.279 9.335 1.00 32.51 H new ATOM 0 HA ALA A 737 16.545 -17.940 9.991 1.00 25.12 H new ATOM 0 HB1 ALA A 737 18.059 -16.916 11.648 1.00 70.32 H new ATOM 0 HB2 ALA A 737 18.169 -16.120 10.060 1.00 70.32 H new ATOM 0 HB3 ALA A 737 17.269 -15.344 11.384 1.00 70.32 H new ATOM 389 N LYS A 738 14.550 -16.415 12.115 1.00 21.23 N ATOM 390 CA LYS A 738 13.672 -16.625 13.275 1.00 70.21 C ATOM 391 C LYS A 738 12.251 -16.188 12.993 1.00 41.52 C ATOM 392 O LYS A 738 11.361 -16.347 13.833 1.00 72.04 O ATOM 393 CB LYS A 738 14.222 -15.901 14.510 1.00 70.52 C ATOM 394 CG LYS A 738 15.524 -16.481 15.022 1.00 54.33 C ATOM 395 CD LYS A 738 15.355 -17.948 15.371 1.00 11.10 C ATOM 396 CE LYS A 738 16.680 -18.612 15.619 1.00 43.22 C ATOM 397 NZ LYS A 738 16.522 -20.055 15.911 1.00 55.34 N ATOM 0 H LYS A 738 14.459 -15.497 11.679 1.00 21.23 H new ATOM 0 HA LYS A 738 13.652 -17.696 13.477 1.00 70.21 H new ATOM 0 HB2 LYS A 738 14.373 -14.849 14.267 1.00 70.52 H new ATOM 0 HB3 LYS A 738 13.478 -15.941 15.306 1.00 70.52 H new ATOM 0 HG2 LYS A 738 16.301 -16.369 14.265 1.00 54.33 H new ATOM 0 HG3 LYS A 738 15.854 -15.928 15.902 1.00 54.33 H new ATOM 0 HD2 LYS A 738 14.728 -18.042 16.258 1.00 11.10 H new ATOM 0 HD3 LYS A 738 14.837 -18.459 14.559 1.00 11.10 H new ATOM 0 HE2 LYS A 738 17.320 -18.485 14.746 1.00 43.22 H new ATOM 0 HE3 LYS A 738 17.181 -18.124 16.455 1.00 43.22 H new ATOM 0 HZ1 LYS A 738 17.457 -20.480 16.077 1.00 55.34 H new ATOM 0 HZ2 LYS A 738 15.932 -20.175 16.759 1.00 55.34 H new ATOM 0 HZ3 LYS A 738 16.066 -20.525 15.103 1.00 55.34 H new ATOM 411 N TRP A 739 12.036 -15.639 11.825 1.00 65.31 N ATOM 412 CA TRP A 739 10.731 -15.138 11.440 1.00 71.33 C ATOM 413 C TRP A 739 10.382 -15.623 10.054 1.00 11.44 C ATOM 414 O TRP A 739 9.767 -14.903 9.262 1.00 74.21 O ATOM 415 CB TRP A 739 10.713 -13.591 11.490 1.00 52.13 C ATOM 416 CG TRP A 739 11.120 -13.042 12.819 1.00 13.11 C ATOM 417 CD1 TRP A 739 12.385 -12.961 13.309 1.00 11.40 C ATOM 418 CD2 TRP A 739 10.266 -12.503 13.824 1.00 2.50 C ATOM 419 NE1 TRP A 739 12.375 -12.437 14.555 1.00 52.44 N ATOM 420 CE2 TRP A 739 11.085 -12.130 14.900 1.00 63.10 C ATOM 421 CE3 TRP A 739 8.888 -12.301 13.923 1.00 13.51 C ATOM 422 CZ2 TRP A 739 10.576 -11.568 16.062 1.00 41.30 C ATOM 423 CZ3 TRP A 739 8.384 -11.740 15.076 1.00 51.23 C ATOM 424 CH2 TRP A 739 9.225 -11.379 16.131 1.00 11.05 C ATOM 0 H TRP A 739 12.756 -15.524 11.111 1.00 65.31 H new ATOM 0 HA TRP A 739 9.987 -15.514 12.142 1.00 71.33 H new ATOM 0 HB2 TRP A 739 11.381 -13.201 10.722 1.00 52.13 H new ATOM 0 HB3 TRP A 739 9.710 -13.237 11.249 1.00 52.13 H new ATOM 0 HD1 TRP A 739 13.273 -13.271 12.778 1.00 11.40 H new ATOM 0 HE1 TRP A 739 13.196 -12.293 15.144 1.00 52.44 H new ATOM 0 HE3 TRP A 739 8.231 -12.579 13.112 1.00 13.51 H new ATOM 0 HZ2 TRP A 739 11.223 -11.291 16.881 1.00 41.30 H new ATOM 0 HZ3 TRP A 739 7.320 -11.577 15.166 1.00 51.23 H new ATOM 0 HH2 TRP A 739 8.798 -10.941 17.021 1.00 11.05 H new ATOM 435 N ASP A 740 10.772 -16.851 9.758 1.00 64.21 N ATOM 436 CA ASP A 740 10.459 -17.486 8.466 1.00 51.14 C ATOM 437 C ASP A 740 8.957 -17.468 8.198 1.00 15.13 C ATOM 438 O ASP A 740 8.521 -17.203 7.078 1.00 30.33 O ATOM 439 CB ASP A 740 11.006 -18.950 8.408 1.00 14.32 C ATOM 440 CG ASP A 740 10.379 -19.882 9.443 1.00 32.13 C ATOM 441 OD1 ASP A 740 10.845 -19.889 10.605 1.00 54.53 O ATOM 442 OD2 ASP A 740 9.427 -20.612 9.100 1.00 71.30 O ATOM 0 H ASP A 740 11.310 -17.441 10.393 1.00 64.21 H new ATOM 0 HA ASP A 740 10.954 -16.907 7.687 1.00 51.14 H new ATOM 0 HB2 ASP A 740 10.828 -19.356 7.412 1.00 14.32 H new ATOM 0 HB3 ASP A 740 12.086 -18.931 8.556 1.00 14.32 H new ATOM 447 N THR A 741 8.179 -17.700 9.235 1.00 63.20 N ATOM 448 CA THR A 741 6.742 -17.737 9.124 1.00 74.12 C ATOM 449 C THR A 741 6.158 -16.306 8.973 1.00 12.54 C ATOM 450 O THR A 741 5.037 -16.122 8.496 1.00 4.44 O ATOM 451 CB THR A 741 6.090 -18.472 10.347 1.00 50.24 C ATOM 452 OG1 THR A 741 4.716 -18.774 10.069 1.00 64.05 O ATOM 453 CG2 THR A 741 6.179 -17.625 11.617 1.00 51.51 C ATOM 0 H THR A 741 8.529 -17.868 10.178 1.00 63.20 H new ATOM 0 HA THR A 741 6.499 -18.304 8.225 1.00 74.12 H new ATOM 0 HB THR A 741 6.642 -19.398 10.510 1.00 50.24 H new ATOM 0 HG1 THR A 741 4.320 -19.234 10.838 1.00 64.05 H new ATOM 0 HG21 THR A 741 5.718 -18.163 12.446 1.00 51.51 H new ATOM 0 HG22 THR A 741 7.225 -17.427 11.850 1.00 51.51 H new ATOM 0 HG23 THR A 741 5.657 -16.681 11.462 1.00 51.51 H new ATOM 461 N ALA A 742 6.931 -15.313 9.377 1.00 60.11 N ATOM 462 CA ALA A 742 6.475 -13.938 9.342 1.00 61.11 C ATOM 463 C ALA A 742 6.654 -13.334 7.954 1.00 3.21 C ATOM 464 O ALA A 742 5.969 -12.373 7.588 1.00 22.12 O ATOM 465 CB ALA A 742 7.209 -13.107 10.384 1.00 51.40 C ATOM 0 H ALA A 742 7.879 -15.436 9.733 1.00 60.11 H new ATOM 0 HA ALA A 742 5.411 -13.930 9.577 1.00 61.11 H new ATOM 0 HB1 ALA A 742 6.854 -12.077 10.344 1.00 51.40 H new ATOM 0 HB2 ALA A 742 7.020 -13.518 11.376 1.00 51.40 H new ATOM 0 HB3 ALA A 742 8.279 -13.130 10.180 1.00 51.40 H new ATOM 471 N ASN A 743 7.567 -13.905 7.178 1.00 70.32 N ATOM 472 CA ASN A 743 7.853 -13.391 5.833 1.00 73.14 C ATOM 473 C ASN A 743 7.258 -14.283 4.780 1.00 74.32 C ATOM 474 O ASN A 743 6.777 -13.807 3.746 1.00 51.13 O ATOM 475 CB ASN A 743 9.373 -13.280 5.611 1.00 73.15 C ATOM 476 CG ASN A 743 10.027 -12.273 6.524 1.00 54.30 C ATOM 477 OD1 ASN A 743 10.169 -11.106 6.178 1.00 30.25 O ATOM 478 ND2 ASN A 743 10.413 -12.706 7.689 1.00 31.11 N ATOM 0 H ASN A 743 8.121 -14.718 7.449 1.00 70.32 H new ATOM 0 HA ASN A 743 7.403 -12.401 5.752 1.00 73.14 H new ATOM 0 HB2 ASN A 743 9.830 -14.257 5.768 1.00 73.15 H new ATOM 0 HB3 ASN A 743 9.564 -13.002 4.575 1.00 73.15 H new ATOM 0 HD21 ASN A 743 10.851 -12.066 8.351 1.00 31.11 H new ATOM 0 HD22 ASN A 743 10.277 -13.685 7.940 1.00 31.11 H new ATOM 485 N ASN A 744 7.282 -15.567 5.035 1.00 44.10 N ATOM 486 CA ASN A 744 6.725 -16.540 4.126 1.00 0.33 C ATOM 487 C ASN A 744 5.403 -17.037 4.611 1.00 24.20 C ATOM 488 O ASN A 744 5.112 -16.966 5.795 1.00 3.51 O ATOM 489 CB ASN A 744 7.691 -17.690 3.902 1.00 52.12 C ATOM 490 CG ASN A 744 8.675 -17.404 2.778 1.00 11.20 C ATOM 491 OD1 ASN A 744 9.837 -17.811 2.824 1.00 42.43 O ATOM 492 ND2 ASN A 744 8.209 -16.733 1.754 1.00 43.21 N ATOM 0 H ASN A 744 7.689 -15.969 5.880 1.00 44.10 H new ATOM 0 HA ASN A 744 6.563 -16.046 3.168 1.00 0.33 H new ATOM 0 HB2 ASN A 744 8.241 -17.885 4.823 1.00 52.12 H new ATOM 0 HB3 ASN A 744 7.129 -18.594 3.669 1.00 52.12 H new ATOM 0 HD21 ASN A 744 8.814 -16.531 0.958 1.00 43.21 H new ATOM 0 HD22 ASN A 744 7.241 -16.412 1.752 1.00 43.21 H new ATOM 499 N PRO A 745 4.563 -17.544 3.704 1.00 22.43 N ATOM 500 CA PRO A 745 3.261 -18.039 4.062 1.00 60.00 C ATOM 501 C PRO A 745 3.329 -19.337 4.856 1.00 10.53 C ATOM 502 O PRO A 745 3.111 -19.355 6.073 1.00 31.12 O ATOM 503 CB PRO A 745 2.574 -18.266 2.701 1.00 41.30 C ATOM 504 CG PRO A 745 3.693 -18.472 1.739 1.00 34.33 C ATOM 505 CD PRO A 745 4.829 -17.658 2.246 1.00 74.01 C ATOM 0 HA PRO A 745 2.726 -17.344 4.710 1.00 60.00 H new ATOM 0 HB2 PRO A 745 1.914 -19.133 2.731 1.00 41.30 H new ATOM 0 HB3 PRO A 745 1.963 -17.409 2.419 1.00 41.30 H new ATOM 0 HG2 PRO A 745 3.965 -19.526 1.678 1.00 34.33 H new ATOM 0 HG3 PRO A 745 3.406 -18.158 0.735 1.00 34.33 H new ATOM 0 HD2 PRO A 745 5.786 -18.142 2.051 1.00 74.01 H new ATOM 0 HD3 PRO A 745 4.864 -16.679 1.768 1.00 74.01 H new ATOM 513 N LEU A 746 3.631 -20.381 4.184 1.00 74.44 N ATOM 514 CA LEU A 746 3.595 -21.688 4.756 1.00 31.41 C ATOM 515 C LEU A 746 4.957 -22.111 5.234 1.00 23.42 C ATOM 516 O LEU A 746 5.101 -22.684 6.310 1.00 23.33 O ATOM 517 CB LEU A 746 3.060 -22.671 3.729 1.00 11.45 C ATOM 518 CG LEU A 746 3.039 -24.149 4.133 1.00 53.10 C ATOM 519 CD1 LEU A 746 2.088 -24.377 5.301 1.00 4.23 C ATOM 520 CD2 LEU A 746 2.655 -25.021 2.947 1.00 44.32 C ATOM 0 H LEU A 746 3.916 -20.361 3.205 1.00 74.44 H new ATOM 0 HA LEU A 746 2.934 -21.674 5.623 1.00 31.41 H new ATOM 0 HB2 LEU A 746 2.043 -22.374 3.472 1.00 11.45 H new ATOM 0 HB3 LEU A 746 3.658 -22.575 2.823 1.00 11.45 H new ATOM 0 HG LEU A 746 4.042 -24.430 4.454 1.00 53.10 H new ATOM 0 HD11 LEU A 746 2.089 -25.433 5.571 1.00 4.23 H new ATOM 0 HD12 LEU A 746 2.413 -23.784 6.156 1.00 4.23 H new ATOM 0 HD13 LEU A 746 1.080 -24.077 5.014 1.00 4.23 H new ATOM 0 HD21 LEU A 746 2.645 -26.067 3.253 1.00 44.32 H new ATOM 0 HD22 LEU A 746 1.664 -24.737 2.593 1.00 44.32 H new ATOM 0 HD23 LEU A 746 3.380 -24.884 2.145 1.00 44.32 H new HETATM 532 N PTR A 747 5.952 -21.820 4.437 1.00 54.15 N HETATM 533 CA PTR A 747 7.292 -22.214 4.715 1.00 35.03 C HETATM 534 C PTR A 747 8.208 -21.316 4.032 1.00 43.05 C HETATM 535 O PTR A 747 8.949 -20.573 4.650 1.00 4.40 O HETATM 536 CB PTR A 747 7.500 -23.633 4.193 1.00 41.33 C HETATM 537 CG PTR A 747 8.901 -24.155 4.223 1.00 12.34 C HETATM 538 CD1 PTR A 747 9.436 -24.717 3.099 1.00 74.33 C HETATM 539 CD2 PTR A 747 9.680 -24.104 5.373 1.00 10.10 C HETATM 540 CE1 PTR A 747 10.722 -25.227 3.085 1.00 11.45 C HETATM 541 CE2 PTR A 747 10.969 -24.603 5.382 1.00 2.13 C HETATM 542 CZ PTR A 747 11.487 -25.166 4.233 1.00 2.02 C HETATM 543 OH PTR A 747 12.787 -25.690 4.233 1.00 38.57 O HETATM 544 P PTR A 747 14.081 -24.907 3.780 1.00 38.57 P HETATM 545 O1P PTR A 747 14.026 -23.482 4.329 1.00 38.57 O HETATM 546 O2P PTR A 747 15.292 -25.605 4.458 1.00 38.57 O HETATM 547 O3P PTR A 747 14.034 -25.056 2.334 1.00 38.57 O HETATM 0 HE2 PTR A 747 11.571 -24.552 6.289 1.00 2.13 H new HETATM 0 HE1 PTR A 747 11.127 -25.673 2.177 1.00 11.45 H new HETATM 0 HD2 PTR A 747 9.268 -23.664 6.281 1.00 10.10 H new HETATM 0 HD1 PTR A 747 8.835 -24.765 2.191 1.00 74.33 H new HETATM 0 HB3 PTR A 747 6.872 -24.307 4.776 1.00 41.33 H new HETATM 0 HB2 PTR A 747 7.142 -23.674 3.164 1.00 41.33 H new HETATM 0 HA PTR A 747 7.478 -22.177 5.788 1.00 35.03 H new HETATM 0 H PTR A 747 5.771 -21.015 3.837 1.00 54.15 H new ATOM 556 N LYS A 748 8.141 -21.361 2.748 1.00 51.30 N ATOM 557 CA LYS A 748 9.028 -20.689 1.913 1.00 61.52 C ATOM 558 C LYS A 748 8.325 -20.293 0.665 1.00 23.13 C ATOM 559 O LYS A 748 7.237 -20.769 0.385 1.00 33.13 O ATOM 560 CB LYS A 748 10.170 -21.621 1.555 1.00 0.03 C ATOM 561 CG LYS A 748 11.135 -21.916 2.686 1.00 24.32 C ATOM 562 CD LYS A 748 11.829 -20.690 3.147 1.00 71.12 C ATOM 563 CE LYS A 748 13.246 -20.575 2.553 1.00 71.00 C ATOM 564 NZ LYS A 748 13.263 -20.694 1.075 1.00 12.34 N ATOM 0 H LYS A 748 7.431 -21.894 2.246 1.00 51.30 H new ATOM 0 HA LYS A 748 9.410 -19.803 2.420 1.00 61.52 H new ATOM 0 HB2 LYS A 748 9.752 -22.563 1.199 1.00 0.03 H new ATOM 0 HB3 LYS A 748 10.728 -21.186 0.726 1.00 0.03 H new ATOM 0 HG2 LYS A 748 10.593 -22.363 3.520 1.00 24.32 H new ATOM 0 HG3 LYS A 748 11.871 -22.648 2.355 1.00 24.32 H new ATOM 0 HD2 LYS A 748 11.245 -19.814 2.865 1.00 71.12 H new ATOM 0 HD3 LYS A 748 11.891 -20.695 4.235 1.00 71.12 H new ATOM 0 HE2 LYS A 748 13.678 -19.617 2.840 1.00 71.00 H new ATOM 0 HE3 LYS A 748 13.879 -21.352 2.982 1.00 71.00 H new ATOM 0 HZ1 LYS A 748 14.196 -20.410 0.715 1.00 12.34 H new ATOM 0 HZ2 LYS A 748 13.073 -21.680 0.804 1.00 12.34 H new ATOM 0 HZ3 LYS A 748 12.532 -20.076 0.669 1.00 12.34 H new ATOM 578 N GLU A 749 8.931 -19.459 -0.068 1.00 63.50 N ATOM 579 CA GLU A 749 8.424 -19.054 -1.364 1.00 50.13 C ATOM 580 C GLU A 749 8.606 -20.196 -2.349 1.00 21.22 C ATOM 581 O GLU A 749 7.797 -20.404 -3.252 1.00 61.14 O ATOM 582 CB GLU A 749 9.170 -17.782 -1.880 1.00 24.15 C ATOM 583 CG GLU A 749 10.670 -17.988 -2.177 1.00 51.32 C ATOM 584 CD GLU A 749 11.489 -18.287 -0.943 1.00 4.14 C ATOM 585 OE1 GLU A 749 11.626 -19.478 -0.588 1.00 53.14 O ATOM 586 OE2 GLU A 749 11.988 -17.343 -0.324 1.00 74.42 O ATOM 0 H GLU A 749 9.811 -19.013 0.193 1.00 63.50 H new ATOM 0 HA GLU A 749 7.366 -18.811 -1.270 1.00 50.13 H new ATOM 0 HB2 GLU A 749 8.679 -17.433 -2.788 1.00 24.15 H new ATOM 0 HB3 GLU A 749 9.066 -16.991 -1.137 1.00 24.15 H new ATOM 0 HG2 GLU A 749 10.783 -18.807 -2.887 1.00 51.32 H new ATOM 0 HG3 GLU A 749 11.064 -17.093 -2.658 1.00 51.32 H new ATOM 593 N ALA A 750 9.668 -20.953 -2.135 1.00 51.31 N ATOM 594 CA ALA A 750 10.052 -22.030 -3.004 1.00 23.14 C ATOM 595 C ALA A 750 9.172 -23.249 -2.850 1.00 42.45 C ATOM 596 O ALA A 750 9.348 -24.222 -3.559 1.00 24.53 O ATOM 597 CB ALA A 750 11.485 -22.376 -2.791 1.00 51.01 C ATOM 0 H ALA A 750 10.292 -20.827 -1.338 1.00 51.31 H new ATOM 0 HA ALA A 750 9.917 -21.682 -4.028 1.00 23.14 H new ATOM 0 HB1 ALA A 750 11.764 -23.194 -3.455 1.00 51.01 H new ATOM 0 HB2 ALA A 750 12.105 -21.506 -3.006 1.00 51.01 H new ATOM 0 HB3 ALA A 750 11.635 -22.682 -1.756 1.00 51.01 H new ATOM 603 N THR A 751 8.243 -23.204 -1.926 1.00 73.21 N ATOM 604 CA THR A 751 7.246 -24.237 -1.844 1.00 22.22 C ATOM 605 C THR A 751 5.937 -23.726 -2.442 1.00 55.10 C ATOM 606 O THR A 751 5.146 -24.492 -2.978 1.00 31.44 O ATOM 607 CB THR A 751 7.022 -24.773 -0.375 1.00 33.11 C ATOM 608 OG1 THR A 751 6.131 -25.892 -0.398 1.00 13.25 O ATOM 609 CG2 THR A 751 6.442 -23.699 0.527 1.00 43.22 C ATOM 0 H THR A 751 8.159 -22.467 -1.226 1.00 73.21 H new ATOM 0 HA THR A 751 7.611 -25.089 -2.418 1.00 22.22 H new ATOM 0 HB THR A 751 7.993 -25.071 0.021 1.00 33.11 H new ATOM 0 HG1 THR A 751 5.996 -26.222 0.515 1.00 13.25 H new ATOM 0 HG21 THR A 751 6.301 -24.103 1.530 1.00 43.22 H new ATOM 0 HG22 THR A 751 7.126 -22.852 0.570 1.00 43.22 H new ATOM 0 HG23 THR A 751 5.482 -23.370 0.130 1.00 43.22 H new ATOM 617 N SER A 752 5.742 -22.408 -2.375 1.00 44.32 N ATOM 618 CA SER A 752 4.601 -21.777 -2.969 1.00 74.32 C ATOM 619 C SER A 752 4.688 -21.878 -4.495 1.00 63.14 C ATOM 620 O SER A 752 3.753 -22.325 -5.150 1.00 70.42 O ATOM 621 CB SER A 752 4.539 -20.322 -2.534 1.00 22.43 C ATOM 622 OG SER A 752 4.671 -20.219 -1.122 1.00 72.33 O ATOM 0 H SER A 752 6.379 -21.764 -1.905 1.00 44.32 H new ATOM 0 HA SER A 752 3.693 -22.281 -2.639 1.00 74.32 H new ATOM 0 HB2 SER A 752 5.333 -19.756 -3.022 1.00 22.43 H new ATOM 0 HB3 SER A 752 3.593 -19.882 -2.850 1.00 22.43 H new ATOM 0 HG SER A 752 5.617 -20.287 -0.876 1.00 72.33 H new ATOM 628 N THR A 753 5.831 -21.476 -5.050 1.00 34.25 N ATOM 629 CA THR A 753 6.059 -21.600 -6.477 1.00 5.03 C ATOM 630 C THR A 753 6.618 -22.996 -6.790 1.00 45.42 C ATOM 631 O THR A 753 6.623 -23.442 -7.941 1.00 42.41 O ATOM 632 CB THR A 753 7.043 -20.488 -7.007 1.00 44.01 C ATOM 633 OG1 THR A 753 7.149 -20.563 -8.436 1.00 20.42 O ATOM 634 CG2 THR A 753 8.430 -20.638 -6.389 1.00 61.54 C ATOM 0 H THR A 753 6.606 -21.064 -4.530 1.00 34.25 H new ATOM 0 HA THR A 753 5.105 -21.464 -6.987 1.00 5.03 H new ATOM 0 HB THR A 753 6.637 -19.519 -6.719 1.00 44.01 H new ATOM 0 HG1 THR A 753 7.761 -19.868 -8.756 1.00 20.42 H new ATOM 0 HG21 THR A 753 9.086 -19.857 -6.774 1.00 61.54 H new ATOM 0 HG22 THR A 753 8.357 -20.549 -5.305 1.00 61.54 H new ATOM 0 HG23 THR A 753 8.839 -21.615 -6.646 1.00 61.54 H new ATOM 642 N PHE A 754 7.065 -23.670 -5.730 1.00 1.42 N ATOM 643 CA PHE A 754 7.673 -24.991 -5.794 1.00 72.05 C ATOM 644 C PHE A 754 8.847 -25.042 -6.762 1.00 72.15 C ATOM 645 O PHE A 754 8.704 -25.430 -7.929 1.00 22.22 O ATOM 646 CB PHE A 754 6.659 -26.085 -6.082 1.00 12.15 C ATOM 647 CG PHE A 754 7.202 -27.448 -5.833 1.00 54.14 C ATOM 648 CD1 PHE A 754 7.769 -27.759 -4.606 1.00 55.45 C ATOM 649 CD2 PHE A 754 7.151 -28.420 -6.807 1.00 32.54 C ATOM 650 CE1 PHE A 754 8.274 -29.014 -4.364 1.00 73.22 C ATOM 651 CE2 PHE A 754 7.656 -29.681 -6.571 1.00 55.13 C ATOM 652 CZ PHE A 754 8.218 -29.978 -5.348 1.00 50.21 C ATOM 0 H PHE A 754 7.011 -23.299 -4.781 1.00 1.42 H new ATOM 0 HA PHE A 754 8.073 -25.187 -4.799 1.00 72.05 H new ATOM 0 HB2 PHE A 754 5.777 -25.930 -5.461 1.00 12.15 H new ATOM 0 HB3 PHE A 754 6.335 -26.011 -7.120 1.00 12.15 H new ATOM 0 HD1 PHE A 754 7.814 -27.007 -3.832 1.00 55.45 H new ATOM 0 HD2 PHE A 754 6.711 -28.192 -7.766 1.00 32.54 H new ATOM 0 HE1 PHE A 754 8.714 -29.245 -3.405 1.00 73.22 H new ATOM 0 HE2 PHE A 754 7.611 -30.435 -7.343 1.00 55.13 H new ATOM 0 HZ PHE A 754 8.614 -30.965 -5.161 1.00 50.21 H new ATOM 662 N THR A 755 9.985 -24.624 -6.290 1.00 51.31 N ATOM 663 CA THR A 755 11.186 -24.614 -7.090 1.00 61.43 C ATOM 664 C THR A 755 12.432 -24.846 -6.189 1.00 14.11 C ATOM 665 O THR A 755 13.557 -24.760 -6.639 1.00 33.52 O ATOM 666 CB THR A 755 11.330 -23.249 -7.852 1.00 54.45 C ATOM 667 OG1 THR A 755 10.057 -22.876 -8.409 1.00 55.43 O ATOM 668 CG2 THR A 755 12.340 -23.365 -8.991 1.00 13.13 C ATOM 0 H THR A 755 10.112 -24.279 -5.339 1.00 51.31 H new ATOM 0 HA THR A 755 11.117 -25.419 -7.822 1.00 61.43 H new ATOM 0 HB THR A 755 11.675 -22.497 -7.142 1.00 54.45 H new ATOM 0 HG1 THR A 755 10.145 -22.023 -8.884 1.00 55.43 H new ATOM 0 HG21 THR A 755 12.422 -22.407 -9.504 1.00 13.13 H new ATOM 0 HG22 THR A 755 13.313 -23.645 -8.587 1.00 13.13 H new ATOM 0 HG23 THR A 755 12.007 -24.126 -9.696 1.00 13.13 H new ATOM 676 N ASN A 756 12.193 -25.176 -4.922 1.00 24.45 N ATOM 677 CA ASN A 756 13.290 -25.358 -3.940 1.00 3.25 C ATOM 678 C ASN A 756 14.161 -26.553 -4.288 1.00 44.00 C ATOM 679 O ASN A 756 15.389 -26.479 -4.231 1.00 41.02 O ATOM 680 CB ASN A 756 12.739 -25.495 -2.496 1.00 13.20 C ATOM 681 CG ASN A 756 11.752 -26.651 -2.322 1.00 74.45 C ATOM 682 OD1 ASN A 756 11.015 -27.009 -3.251 1.00 12.23 O ATOM 683 ND2 ASN A 756 11.743 -27.233 -1.165 1.00 23.01 N ATOM 0 H ASN A 756 11.259 -25.325 -4.540 1.00 24.45 H new ATOM 0 HA ASN A 756 13.910 -24.463 -3.987 1.00 3.25 H new ATOM 0 HB2 ASN A 756 13.574 -25.635 -1.810 1.00 13.20 H new ATOM 0 HB3 ASN A 756 12.248 -24.564 -2.214 1.00 13.20 H new ATOM 0 HD21 ASN A 756 11.113 -28.017 -0.993 1.00 23.01 H new ATOM 0 HD22 ASN A 756 12.366 -26.908 -0.426 1.00 23.01 H new ATOM 690 N ILE A 757 13.540 -27.629 -4.651 1.00 44.04 N ATOM 691 CA ILE A 757 14.256 -28.823 -5.027 1.00 63.25 C ATOM 692 C ILE A 757 14.387 -28.912 -6.538 1.00 52.44 C ATOM 693 O ILE A 757 14.784 -29.935 -7.082 1.00 54.13 O ATOM 694 CB ILE A 757 13.557 -30.095 -4.491 1.00 2.51 C ATOM 695 CG1 ILE A 757 12.116 -30.181 -5.016 1.00 30.45 C ATOM 696 CG2 ILE A 757 13.579 -30.108 -2.961 1.00 34.50 C ATOM 697 CD1 ILE A 757 11.393 -31.443 -4.612 1.00 73.40 C ATOM 0 H ILE A 757 12.525 -27.713 -4.698 1.00 44.04 H new ATOM 0 HA ILE A 757 15.249 -28.762 -4.581 1.00 63.25 H new ATOM 0 HB ILE A 757 14.101 -30.968 -4.850 1.00 2.51 H new ATOM 0 HG12 ILE A 757 11.555 -29.320 -4.652 1.00 30.45 H new ATOM 0 HG13 ILE A 757 12.131 -30.115 -6.104 1.00 30.45 H new ATOM 0 HG21 ILE A 757 13.084 -31.008 -2.598 1.00 34.50 H new ATOM 0 HG22 ILE A 757 14.611 -30.096 -2.612 1.00 34.50 H new ATOM 0 HG23 ILE A 757 13.057 -29.229 -2.582 1.00 34.50 H new ATOM 0 HD11 ILE A 757 10.382 -31.430 -5.020 1.00 73.40 H new ATOM 0 HD12 ILE A 757 11.930 -32.309 -4.999 1.00 73.40 H new ATOM 0 HD13 ILE A 757 11.344 -31.502 -3.525 1.00 73.40 H new ATOM 709 N THR A 758 14.063 -27.841 -7.201 1.00 74.34 N ATOM 710 CA THR A 758 14.113 -27.797 -8.622 1.00 33.34 C ATOM 711 C THR A 758 15.230 -26.866 -9.081 1.00 33.42 C ATOM 712 O THR A 758 15.173 -25.651 -8.865 1.00 24.35 O ATOM 713 CB THR A 758 12.780 -27.307 -9.195 1.00 63.02 C ATOM 714 OG1 THR A 758 11.693 -27.976 -8.516 1.00 11.01 O ATOM 715 CG2 THR A 758 12.700 -27.604 -10.688 1.00 33.13 C ATOM 0 H THR A 758 13.756 -26.972 -6.764 1.00 74.34 H new ATOM 0 HA THR A 758 14.307 -28.806 -8.985 1.00 33.34 H new ATOM 0 HB THR A 758 12.707 -26.230 -9.046 1.00 63.02 H new ATOM 0 HG1 THR A 758 10.838 -27.663 -8.879 1.00 11.01 H new ATOM 0 HG21 THR A 758 11.746 -27.249 -11.079 1.00 33.13 H new ATOM 0 HG22 THR A 758 13.515 -27.097 -11.204 1.00 33.13 H new ATOM 0 HG23 THR A 758 12.781 -28.679 -10.850 1.00 33.13 H new HETATM 723 N PTR A 759 16.220 -27.422 -9.690 1.00 45.11 N HETATM 724 CA PTR A 759 17.337 -26.663 -10.161 1.00 4.24 C HETATM 725 C PTR A 759 17.425 -26.733 -11.665 1.00 42.01 C HETATM 726 O PTR A 759 16.565 -27.341 -12.323 1.00 32.44 O HETATM 727 CB PTR A 759 18.634 -27.163 -9.527 1.00 41.03 C HETATM 728 CG PTR A 759 18.763 -26.851 -8.056 1.00 65.35 C HETATM 729 CD1 PTR A 759 19.417 -25.711 -7.635 1.00 24.41 C HETATM 730 CD2 PTR A 759 18.236 -27.700 -7.091 1.00 31.21 C HETATM 731 CE1 PTR A 759 19.550 -25.416 -6.303 1.00 61.34 C HETATM 732 CE2 PTR A 759 18.359 -27.413 -5.747 1.00 44.23 C HETATM 733 CZ PTR A 759 19.019 -26.267 -5.356 1.00 23.02 C HETATM 734 OH PTR A 759 19.155 -25.971 -3.980 1.00 38.57 O HETATM 735 P PTR A 759 19.103 -24.518 -3.354 1.00 38.57 P HETATM 736 O1P PTR A 759 18.477 -23.556 -4.359 1.00 38.57 O HETATM 737 O2P PTR A 759 18.142 -24.573 -2.128 1.00 38.57 O HETATM 738 O3P PTR A 759 20.507 -24.286 -3.023 1.00 38.57 O HETATM 0 HE2 PTR A 759 17.938 -28.086 -5.001 1.00 44.23 H new HETATM 0 HE1 PTR A 759 20.074 -24.512 -5.993 1.00 61.34 H new HETATM 0 HD2 PTR A 759 17.717 -28.607 -7.400 1.00 31.21 H new HETATM 0 HD1 PTR A 759 19.836 -25.031 -8.377 1.00 24.41 H new HETATM 0 HB3 PTR A 759 18.701 -28.242 -9.665 1.00 41.03 H new HETATM 0 HB2 PTR A 759 19.478 -26.721 -10.056 1.00 41.03 H new HETATM 0 HA PTR A 759 17.192 -25.623 -9.870 1.00 4.24 H new ATOM 747 N ARG A 760 18.420 -26.108 -12.218 1.00 62.32 N ATOM 748 CA ARG A 760 18.641 -26.155 -13.639 1.00 24.15 C ATOM 749 C ARG A 760 19.806 -27.065 -13.968 1.00 13.13 C ATOM 750 O ARG A 760 20.972 -26.690 -13.809 1.00 12.10 O ATOM 751 CB ARG A 760 18.875 -24.751 -14.204 1.00 71.11 C ATOM 752 CG ARG A 760 17.684 -23.786 -14.056 1.00 24.43 C ATOM 753 CD ARG A 760 16.472 -24.220 -14.900 1.00 55.03 C ATOM 754 NE ARG A 760 15.794 -25.418 -14.361 1.00 64.22 N ATOM 755 CZ ARG A 760 14.633 -25.910 -14.822 1.00 70.33 C ATOM 756 NH1 ARG A 760 13.999 -25.303 -15.823 1.00 0.15 N ATOM 757 NH2 ARG A 760 14.110 -27.004 -14.272 1.00 51.52 N ATOM 0 H ARG A 760 19.102 -25.552 -11.702 1.00 62.32 H new ATOM 0 HA ARG A 760 17.745 -26.562 -14.107 1.00 24.15 H new ATOM 0 HB2 ARG A 760 19.741 -24.315 -13.707 1.00 71.11 H new ATOM 0 HB3 ARG A 760 19.125 -24.838 -15.262 1.00 71.11 H new ATOM 0 HG2 ARG A 760 17.392 -23.731 -13.007 1.00 24.43 H new ATOM 0 HG3 ARG A 760 17.992 -22.784 -14.355 1.00 24.43 H new ATOM 0 HD2 ARG A 760 15.759 -23.398 -14.952 1.00 55.03 H new ATOM 0 HD3 ARG A 760 16.800 -24.422 -15.920 1.00 55.03 H new ATOM 0 HE ARG A 760 16.240 -25.905 -13.584 1.00 64.22 H new ATOM 0 HH11 ARG A 760 14.395 -24.462 -16.242 1.00 0.15 H new ATOM 0 HH12 ARG A 760 13.117 -25.679 -16.171 1.00 0.15 H new ATOM 0 HH21 ARG A 760 14.591 -27.467 -13.501 1.00 51.52 H new ATOM 0 HH22 ARG A 760 13.228 -27.379 -14.621 1.00 51.52 H new ATOM 771 N GLY A 761 19.493 -28.250 -14.397 1.00 52.13 N ATOM 772 CA GLY A 761 20.500 -29.207 -14.728 1.00 34.34 C ATOM 773 C GLY A 761 19.921 -30.577 -14.872 1.00 10.45 C ATOM 774 O GLY A 761 20.032 -31.199 -15.923 1.00 75.32 O ATOM 0 H GLY A 761 18.536 -28.578 -14.526 1.00 52.13 H new ATOM 0 HA2 GLY A 761 20.989 -28.917 -15.658 1.00 34.34 H new ATOM 0 HA3 GLY A 761 21.267 -29.214 -13.954 1.00 34.34 H new ATOM 778 N THR A 762 19.299 -31.047 -13.838 1.00 52.21 N ATOM 779 CA THR A 762 18.664 -32.317 -13.863 1.00 50.50 C ATOM 780 C THR A 762 17.312 -32.258 -13.116 1.00 12.50 C ATOM 781 O THR A 762 17.231 -32.709 -11.978 1.00 30.22 O ATOM 782 CB THR A 762 19.602 -33.458 -13.289 1.00 75.43 C ATOM 783 OG1 THR A 762 18.893 -34.708 -13.208 1.00 73.32 O ATOM 784 CG2 THR A 762 20.176 -33.085 -11.910 1.00 12.22 C ATOM 785 OXT THR A 762 16.343 -31.720 -13.697 1.00 38.57 O ATOM 0 H THR A 762 19.219 -30.554 -12.949 1.00 52.21 H new ATOM 0 HA THR A 762 18.466 -32.573 -14.904 1.00 50.50 H new ATOM 0 HB THR A 762 20.437 -33.568 -13.981 1.00 75.43 H new ATOM 0 HG1 THR A 762 19.489 -35.400 -12.853 1.00 73.32 H new ATOM 0 HG21 THR A 762 20.814 -33.893 -11.551 1.00 12.22 H new ATOM 0 HG22 THR A 762 20.763 -32.170 -11.995 1.00 12.22 H new ATOM 0 HG23 THR A 762 19.359 -32.927 -11.206 1.00 12.22 H new TER 793 THR A 762