USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1071 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 25 SER OG : rot 90:sc= 1.89 USER MOD Set 1.2: A 120 LYS NZ :NH3+ -172:sc= 0.832 (180deg=-0.143) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc=-0.00183 USER MOD Single : A 24 LYS NZ :NH3+ 168:sc= 0.131 (180deg=0.098) USER MOD Single : A 28 ASN : amide:sc= -0.0799 X(o=-0.08,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 100:sc= -0.773 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0.0103 USER MOD Single : A 37 LYS NZ :NH3+ -146:sc= 0.548 (180deg=0.332) USER MOD Single : A 39 LYS NZ :NH3+ -117:sc= 0.633 (180deg=-1.5!) USER MOD Single : A 41 LYS NZ :NH3+ -153:sc= 0.948 (180deg=-0.0256) USER MOD Single : A 46 LYS NZ :NH3+ 170:sc= -0.0071 (180deg=-0.122) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= 0.374 K(o=0.37,f=-3.2!) USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.096 USER MOD Single : A 72 TYR OH : rot 120:sc= 0 USER MOD Single : A 74 GLN : amide:sc= -0.473 K(o=-0.47,f=-1.6) USER MOD Single : A 75 LYS NZ :NH3+ 173:sc= -0.0137 (180deg=-0.107) USER MOD Single : A 84 MET CE :methyl -151:sc= -0.17 (180deg=-1) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=-0.055) USER MOD Single : A 89 GLN : amide:sc= -0.403 X(o=-0.4,f=-0.019) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -1.49 K(o=-1.5,f=-2.1) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 153:sc= 0.241 (180deg=0.0216) USER MOD Single : A 109 THR OG1 : rot 150:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0.0732 X(o=0.073,f=0) USER MOD Single : A 116 LYS NZ :NH3+ 157:sc= 0.888 (180deg=0.56) USER MOD Single : A 117 LYS NZ :NH3+ -169:sc= -0.0141 (180deg=-0.155) USER MOD Single : A 125 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0159) USER MOD ----------------------------------------------------------------- ATOM 20 N GLY A 2 1.836 13.735 -1.400 1.00 15.21 N ATOM 21 CA GLY A 2 2.681 12.601 -1.012 1.00 41.25 C ATOM 22 C GLY A 2 1.886 11.576 -0.203 1.00 31.53 C ATOM 23 O GLY A 2 1.668 11.764 0.999 1.00 53.15 O ATOM 0 HA2 GLY A 2 3.091 12.127 -1.904 1.00 41.25 H new ATOM 0 HA3 GLY A 2 3.526 12.958 -0.423 1.00 41.25 H new ATOM 27 N THR A 3 1.401 10.519 -0.866 1.00 54.12 N ATOM 28 CA THR A 3 0.485 9.537 -0.253 1.00 61.11 C ATOM 29 C THR A 3 0.907 8.102 -0.648 1.00 44.22 C ATOM 30 O THR A 3 0.816 7.730 -1.815 1.00 73.03 O ATOM 31 CB THR A 3 -0.975 9.853 -0.723 1.00 75.24 C ATOM 32 OG1 THR A 3 -1.296 11.226 -0.416 1.00 70.23 O ATOM 33 CG2 THR A 3 -2.020 8.942 -0.074 1.00 54.55 C ATOM 0 H THR A 3 1.629 10.317 -1.839 1.00 54.12 H new ATOM 0 HA THR A 3 0.529 9.605 0.834 1.00 61.11 H new ATOM 0 HB THR A 3 -1.006 9.676 -1.798 1.00 75.24 H new ATOM 0 HG1 THR A 3 -2.209 11.423 -0.712 1.00 70.23 H new ATOM 0 HG21 THR A 3 -3.012 9.209 -0.438 1.00 54.55 H new ATOM 0 HG22 THR A 3 -1.807 7.904 -0.329 1.00 54.55 H new ATOM 0 HG23 THR A 3 -1.986 9.064 1.009 1.00 54.55 H new ATOM 41 N VAL A 4 1.371 7.310 0.339 1.00 31.01 N ATOM 42 CA VAL A 4 1.991 5.986 0.096 1.00 31.44 C ATOM 43 C VAL A 4 1.007 4.847 0.451 1.00 43.43 C ATOM 44 O VAL A 4 0.716 4.614 1.621 1.00 33.42 O ATOM 45 CB VAL A 4 3.328 5.836 0.926 1.00 4.44 C ATOM 46 CG1 VAL A 4 4.046 4.506 0.612 1.00 24.43 C ATOM 47 CG2 VAL A 4 4.268 7.037 0.677 1.00 53.25 C ATOM 0 H VAL A 4 1.328 7.566 1.325 1.00 31.01 H new ATOM 0 HA VAL A 4 2.232 5.914 -0.965 1.00 31.44 H new ATOM 0 HB VAL A 4 3.058 5.824 1.982 1.00 4.44 H new ATOM 0 HG11 VAL A 4 4.961 4.438 1.201 1.00 24.43 H new ATOM 0 HG12 VAL A 4 3.391 3.671 0.862 1.00 24.43 H new ATOM 0 HG13 VAL A 4 4.294 4.468 -0.449 1.00 24.43 H new ATOM 0 HG21 VAL A 4 5.181 6.911 1.259 1.00 53.25 H new ATOM 0 HG22 VAL A 4 4.517 7.090 -0.383 1.00 53.25 H new ATOM 0 HG23 VAL A 4 3.769 7.958 0.979 1.00 53.25 H new ATOM 57 N VAL A 5 0.485 4.160 -0.577 1.00 44.45 N ATOM 58 CA VAL A 5 -0.443 3.026 -0.415 1.00 14.23 C ATOM 59 C VAL A 5 0.345 1.703 -0.543 1.00 62.45 C ATOM 60 O VAL A 5 0.864 1.391 -1.612 1.00 73.35 O ATOM 61 CB VAL A 5 -1.604 3.084 -1.490 1.00 72.24 C ATOM 62 CG1 VAL A 5 -2.684 1.997 -1.242 1.00 53.35 C ATOM 63 CG2 VAL A 5 -2.237 4.498 -1.538 1.00 14.51 C ATOM 0 H VAL A 5 0.695 4.376 -1.551 1.00 44.45 H new ATOM 0 HA VAL A 5 -0.903 3.083 0.572 1.00 14.23 H new ATOM 0 HB VAL A 5 -1.158 2.873 -2.462 1.00 72.24 H new ATOM 0 HG11 VAL A 5 -3.460 2.075 -2.003 1.00 53.35 H new ATOM 0 HG12 VAL A 5 -2.225 1.010 -1.292 1.00 53.35 H new ATOM 0 HG13 VAL A 5 -3.127 2.142 -0.257 1.00 53.35 H new ATOM 0 HG21 VAL A 5 -3.032 4.515 -2.283 1.00 14.51 H new ATOM 0 HG22 VAL A 5 -2.650 4.745 -0.560 1.00 14.51 H new ATOM 0 HG23 VAL A 5 -1.474 5.229 -1.805 1.00 14.51 H new ATOM 73 N ILE A 6 0.458 0.948 0.562 1.00 34.32 N ATOM 74 CA ILE A 6 1.214 -0.316 0.604 1.00 24.11 C ATOM 75 C ILE A 6 0.255 -1.508 0.443 1.00 54.52 C ATOM 76 O ILE A 6 -0.532 -1.813 1.338 1.00 3.25 O ATOM 77 CB ILE A 6 2.031 -0.440 1.949 1.00 61.44 C ATOM 78 CG1 ILE A 6 3.013 0.760 2.099 1.00 31.01 C ATOM 79 CG2 ILE A 6 2.794 -1.787 2.047 1.00 10.41 C ATOM 80 CD1 ILE A 6 3.985 0.924 0.938 1.00 33.24 C ATOM 0 H ILE A 6 0.028 1.197 1.453 1.00 34.32 H new ATOM 0 HA ILE A 6 1.925 -0.321 -0.222 1.00 24.11 H new ATOM 0 HB ILE A 6 1.314 -0.417 2.770 1.00 61.44 H new ATOM 0 HG12 ILE A 6 2.434 1.677 2.205 1.00 31.01 H new ATOM 0 HG13 ILE A 6 3.583 0.635 3.020 1.00 31.01 H new ATOM 0 HG21 ILE A 6 3.342 -1.827 2.989 1.00 10.41 H new ATOM 0 HG22 ILE A 6 2.083 -2.612 2.005 1.00 10.41 H new ATOM 0 HG23 ILE A 6 3.495 -1.870 1.216 1.00 10.41 H new ATOM 0 HD11 ILE A 6 4.632 1.782 1.123 1.00 33.24 H new ATOM 0 HD12 ILE A 6 4.593 0.025 0.843 1.00 33.24 H new ATOM 0 HD13 ILE A 6 3.426 1.083 0.016 1.00 33.24 H new ATOM 92 N VAL A 7 0.317 -2.153 -0.723 1.00 31.32 N ATOM 93 CA VAL A 7 -0.486 -3.338 -1.038 1.00 61.53 C ATOM 94 C VAL A 7 0.345 -4.604 -0.780 1.00 10.01 C ATOM 95 O VAL A 7 1.343 -4.857 -1.466 1.00 31.24 O ATOM 96 CB VAL A 7 -0.976 -3.301 -2.531 1.00 45.13 C ATOM 97 CG1 VAL A 7 -1.760 -4.578 -2.908 1.00 72.01 C ATOM 98 CG2 VAL A 7 -1.817 -2.031 -2.794 1.00 32.13 C ATOM 0 H VAL A 7 0.932 -1.865 -1.484 1.00 31.32 H new ATOM 0 HA VAL A 7 -1.366 -3.347 -0.396 1.00 61.53 H new ATOM 0 HB VAL A 7 -0.094 -3.267 -3.170 1.00 45.13 H new ATOM 0 HG11 VAL A 7 -2.082 -4.514 -3.948 1.00 72.01 H new ATOM 0 HG12 VAL A 7 -1.119 -5.450 -2.780 1.00 72.01 H new ATOM 0 HG13 VAL A 7 -2.634 -4.672 -2.263 1.00 72.01 H new ATOM 0 HG21 VAL A 7 -2.148 -2.022 -3.833 1.00 32.13 H new ATOM 0 HG22 VAL A 7 -2.686 -2.028 -2.136 1.00 32.13 H new ATOM 0 HG23 VAL A 7 -1.211 -1.146 -2.599 1.00 32.13 H new ATOM 108 N VAL A 8 -0.051 -5.365 0.245 1.00 52.23 N ATOM 109 CA VAL A 8 0.553 -6.659 0.580 1.00 22.01 C ATOM 110 C VAL A 8 -0.449 -7.767 0.222 1.00 33.53 C ATOM 111 O VAL A 8 -1.459 -7.935 0.905 1.00 74.13 O ATOM 112 CB VAL A 8 0.913 -6.728 2.116 1.00 33.33 C ATOM 113 CG1 VAL A 8 1.513 -8.099 2.508 1.00 54.30 C ATOM 114 CG2 VAL A 8 1.847 -5.561 2.526 1.00 71.11 C ATOM 0 H VAL A 8 -0.809 -5.097 0.873 1.00 52.23 H new ATOM 0 HA VAL A 8 1.476 -6.788 0.015 1.00 22.01 H new ATOM 0 HB VAL A 8 -0.018 -6.619 2.672 1.00 33.33 H new ATOM 0 HG11 VAL A 8 1.746 -8.103 3.573 1.00 54.30 H new ATOM 0 HG12 VAL A 8 0.792 -8.887 2.291 1.00 54.30 H new ATOM 0 HG13 VAL A 8 2.424 -8.274 1.936 1.00 54.30 H new ATOM 0 HG21 VAL A 8 2.077 -5.635 3.589 1.00 71.11 H new ATOM 0 HG22 VAL A 8 2.771 -5.615 1.950 1.00 71.11 H new ATOM 0 HG23 VAL A 8 1.351 -4.611 2.328 1.00 71.11 H new ATOM 124 N SER A 9 -0.199 -8.499 -0.867 1.00 53.35 N ATOM 125 CA SER A 9 -1.043 -9.637 -1.268 1.00 15.10 C ATOM 126 C SER A 9 -0.140 -10.828 -1.577 1.00 73.33 C ATOM 127 O SER A 9 0.787 -10.710 -2.386 1.00 51.00 O ATOM 128 CB SER A 9 -1.930 -9.269 -2.483 1.00 15.24 C ATOM 129 OG SER A 9 -2.702 -8.102 -2.231 1.00 11.04 O ATOM 0 H SER A 9 0.587 -8.325 -1.494 1.00 53.35 H new ATOM 0 HA SER A 9 -1.718 -9.899 -0.453 1.00 15.10 H new ATOM 0 HB2 SER A 9 -1.301 -9.108 -3.358 1.00 15.24 H new ATOM 0 HB3 SER A 9 -2.593 -10.102 -2.716 1.00 15.24 H new ATOM 0 HG SER A 9 -3.249 -7.896 -3.017 1.00 11.04 H new ATOM 135 N ARG A 10 -0.401 -11.967 -0.912 1.00 12.25 N ATOM 136 CA ARG A 10 0.423 -13.182 -1.035 1.00 60.33 C ATOM 137 C ARG A 10 0.249 -13.815 -2.426 1.00 54.40 C ATOM 138 O ARG A 10 1.160 -14.470 -2.944 1.00 43.20 O ATOM 139 CB ARG A 10 0.050 -14.190 0.082 1.00 50.52 C ATOM 140 CG ARG A 10 0.225 -13.634 1.517 1.00 11.44 C ATOM 141 CD ARG A 10 -0.193 -14.647 2.598 1.00 70.34 C ATOM 142 NE ARG A 10 0.687 -15.837 2.646 1.00 43.55 N ATOM 143 CZ ARG A 10 0.273 -17.118 2.719 1.00 61.33 C ATOM 144 NH1 ARG A 10 -1.026 -17.415 2.738 1.00 61.22 N ATOM 145 NH2 ARG A 10 1.173 -18.095 2.790 1.00 55.24 N ATOM 0 H ARG A 10 -1.190 -12.071 -0.274 1.00 12.25 H new ATOM 0 HA ARG A 10 1.472 -12.910 -0.920 1.00 60.33 H new ATOM 0 HB2 ARG A 10 -0.987 -14.499 -0.053 1.00 50.52 H new ATOM 0 HB3 ARG A 10 0.666 -15.083 -0.028 1.00 50.52 H new ATOM 0 HG2 ARG A 10 1.267 -13.354 1.670 1.00 11.44 H new ATOM 0 HG3 ARG A 10 -0.368 -12.726 1.626 1.00 11.44 H new ATOM 0 HD2 ARG A 10 -0.184 -14.156 3.571 1.00 70.34 H new ATOM 0 HD3 ARG A 10 -1.218 -14.967 2.411 1.00 70.34 H new ATOM 0 HE ARG A 10 1.693 -15.673 2.622 1.00 43.55 H new ATOM 0 HH11 ARG A 10 -1.720 -16.669 2.697 1.00 61.22 H new ATOM 0 HH12 ARG A 10 -1.326 -18.388 2.793 1.00 61.22 H new ATOM 0 HH21 ARG A 10 2.168 -17.872 2.789 1.00 55.24 H new ATOM 0 HH22 ARG A 10 0.868 -19.067 2.846 1.00 55.24 H new ATOM 159 N ASP A 11 -0.940 -13.595 -3.008 1.00 42.43 N ATOM 160 CA ASP A 11 -1.284 -14.041 -4.364 1.00 64.03 C ATOM 161 C ASP A 11 -0.960 -12.925 -5.392 1.00 3.15 C ATOM 162 O ASP A 11 -1.347 -11.764 -5.213 1.00 53.32 O ATOM 163 CB ASP A 11 -2.782 -14.433 -4.404 1.00 22.34 C ATOM 164 CG ASP A 11 -3.216 -15.014 -5.757 1.00 40.25 C ATOM 165 OD1 ASP A 11 -3.654 -14.248 -6.635 1.00 44.13 O ATOM 166 OD2 ASP A 11 -3.109 -16.247 -5.952 1.00 10.30 O ATOM 0 H ASP A 11 -1.698 -13.096 -2.543 1.00 42.43 H new ATOM 0 HA ASP A 11 -0.689 -14.915 -4.631 1.00 64.03 H new ATOM 0 HB2 ASP A 11 -2.981 -15.164 -3.621 1.00 22.34 H new ATOM 0 HB3 ASP A 11 -3.388 -13.554 -4.181 1.00 22.34 H new ATOM 171 N GLU A 12 -0.248 -13.313 -6.466 1.00 53.11 N ATOM 172 CA GLU A 12 0.282 -12.390 -7.499 1.00 35.51 C ATOM 173 C GLU A 12 -0.795 -11.906 -8.478 1.00 51.31 C ATOM 174 O GLU A 12 -0.693 -10.791 -9.013 1.00 73.55 O ATOM 175 CB GLU A 12 1.422 -13.095 -8.268 1.00 2.15 C ATOM 176 CG GLU A 12 2.617 -13.474 -7.381 1.00 73.44 C ATOM 177 CD GLU A 12 3.701 -14.278 -8.114 1.00 21.45 C ATOM 178 OE1 GLU A 12 4.168 -13.831 -9.185 1.00 14.53 O ATOM 179 OE2 GLU A 12 4.104 -15.347 -7.621 1.00 53.32 O ATOM 0 H GLU A 12 -0.019 -14.290 -6.648 1.00 53.11 H new ATOM 0 HA GLU A 12 0.656 -11.503 -6.988 1.00 35.51 H new ATOM 0 HB2 GLU A 12 1.029 -13.996 -8.739 1.00 2.15 H new ATOM 0 HB3 GLU A 12 1.767 -12.442 -9.069 1.00 2.15 H new ATOM 0 HG2 GLU A 12 3.062 -12.564 -6.979 1.00 73.44 H new ATOM 0 HG3 GLU A 12 2.258 -14.056 -6.532 1.00 73.44 H new ATOM 186 N ARG A 13 -1.819 -12.749 -8.714 1.00 72.03 N ATOM 187 CA ARG A 13 -2.922 -12.425 -9.637 1.00 40.13 C ATOM 188 C ARG A 13 -3.725 -11.238 -9.080 1.00 0.40 C ATOM 189 O ARG A 13 -4.158 -10.366 -9.832 1.00 21.34 O ATOM 190 CB ARG A 13 -3.846 -13.647 -9.835 1.00 31.21 C ATOM 191 CG ARG A 13 -3.126 -14.937 -10.289 1.00 5.12 C ATOM 192 CD ARG A 13 -4.028 -16.172 -10.144 1.00 34.42 C ATOM 193 NE ARG A 13 -4.470 -16.344 -8.746 1.00 33.41 N ATOM 194 CZ ARG A 13 -5.739 -16.463 -8.328 1.00 14.13 C ATOM 195 NH1 ARG A 13 -6.759 -16.440 -9.188 1.00 72.01 N ATOM 196 NH2 ARG A 13 -5.973 -16.592 -7.033 1.00 73.15 N ATOM 0 H ARG A 13 -1.904 -13.665 -8.274 1.00 72.03 H new ATOM 0 HA ARG A 13 -2.502 -12.156 -10.606 1.00 40.13 H new ATOM 0 HB2 ARG A 13 -4.365 -13.848 -8.898 1.00 31.21 H new ATOM 0 HB3 ARG A 13 -4.607 -13.394 -10.573 1.00 31.21 H new ATOM 0 HG2 ARG A 13 -2.815 -14.834 -11.329 1.00 5.12 H new ATOM 0 HG3 ARG A 13 -2.221 -15.076 -9.698 1.00 5.12 H new ATOM 0 HD2 ARG A 13 -4.897 -16.070 -10.794 1.00 34.42 H new ATOM 0 HD3 ARG A 13 -3.488 -17.061 -10.470 1.00 34.42 H new ATOM 0 HE ARG A 13 -3.743 -16.375 -8.031 1.00 33.41 H new ATOM 0 HH11 ARG A 13 -6.582 -16.330 -10.186 1.00 72.01 H new ATOM 0 HH12 ARG A 13 -7.716 -16.532 -8.847 1.00 72.01 H new ATOM 0 HH21 ARG A 13 -5.196 -16.600 -6.373 1.00 73.15 H new ATOM 0 HH22 ARG A 13 -6.931 -16.684 -6.694 1.00 73.15 H new ATOM 210 N ILE A 14 -3.876 -11.217 -7.741 1.00 23.04 N ATOM 211 CA ILE A 14 -4.500 -10.102 -7.019 1.00 51.23 C ATOM 212 C ILE A 14 -3.674 -8.804 -7.223 1.00 44.33 C ATOM 213 O ILE A 14 -4.234 -7.791 -7.618 1.00 4.43 O ATOM 214 CB ILE A 14 -4.667 -10.443 -5.484 1.00 30.32 C ATOM 215 CG1 ILE A 14 -5.576 -11.708 -5.299 1.00 54.24 C ATOM 216 CG2 ILE A 14 -5.238 -9.240 -4.697 1.00 1.21 C ATOM 217 CD1 ILE A 14 -5.781 -12.149 -3.854 1.00 44.32 C ATOM 0 H ILE A 14 -3.567 -11.976 -7.133 1.00 23.04 H new ATOM 0 HA ILE A 14 -5.498 -9.939 -7.426 1.00 51.23 H new ATOM 0 HB ILE A 14 -3.678 -10.662 -5.081 1.00 30.32 H new ATOM 0 HG12 ILE A 14 -6.551 -11.504 -5.743 1.00 54.24 H new ATOM 0 HG13 ILE A 14 -5.139 -12.536 -5.857 1.00 54.24 H new ATOM 0 HG21 ILE A 14 -5.340 -9.509 -3.646 1.00 1.21 H new ATOM 0 HG22 ILE A 14 -4.562 -8.390 -4.790 1.00 1.21 H new ATOM 0 HG23 ILE A 14 -6.215 -8.972 -5.100 1.00 1.21 H new ATOM 0 HD11 ILE A 14 -6.423 -13.030 -3.830 1.00 44.32 H new ATOM 0 HD12 ILE A 14 -4.817 -12.390 -3.407 1.00 44.32 H new ATOM 0 HD13 ILE A 14 -6.251 -11.343 -3.291 1.00 44.32 H new ATOM 229 N LEU A 15 -2.331 -8.889 -7.027 1.00 11.15 N ATOM 230 CA LEU A 15 -1.397 -7.730 -7.163 1.00 64.14 C ATOM 231 C LEU A 15 -1.536 -7.001 -8.526 1.00 14.45 C ATOM 232 O LEU A 15 -1.608 -5.768 -8.568 1.00 1.22 O ATOM 233 CB LEU A 15 0.078 -8.191 -6.983 1.00 71.01 C ATOM 234 CG LEU A 15 0.512 -8.623 -5.550 1.00 0.41 C ATOM 235 CD1 LEU A 15 1.928 -9.237 -5.576 1.00 3.21 C ATOM 236 CD2 LEU A 15 0.442 -7.431 -4.564 1.00 31.12 C ATOM 0 H LEU A 15 -1.863 -9.758 -6.771 1.00 11.15 H new ATOM 0 HA LEU A 15 -1.670 -7.026 -6.377 1.00 64.14 H new ATOM 0 HB2 LEU A 15 0.257 -9.028 -7.658 1.00 71.01 H new ATOM 0 HB3 LEU A 15 0.729 -7.378 -7.304 1.00 71.01 H new ATOM 0 HG LEU A 15 -0.184 -9.384 -5.199 1.00 0.41 H new ATOM 0 HD11 LEU A 15 2.215 -9.533 -4.567 1.00 3.21 H new ATOM 0 HD12 LEU A 15 1.933 -10.112 -6.226 1.00 3.21 H new ATOM 0 HD13 LEU A 15 2.637 -8.500 -5.953 1.00 3.21 H new ATOM 0 HD21 LEU A 15 0.750 -7.761 -3.572 1.00 31.12 H new ATOM 0 HD22 LEU A 15 1.107 -6.637 -4.905 1.00 31.12 H new ATOM 0 HD23 LEU A 15 -0.580 -7.055 -4.520 1.00 31.12 H new ATOM 248 N GLU A 16 -1.570 -7.781 -9.629 1.00 1.23 N ATOM 249 CA GLU A 16 -1.605 -7.229 -11.004 1.00 11.41 C ATOM 250 C GLU A 16 -2.995 -6.659 -11.356 1.00 1.45 C ATOM 251 O GLU A 16 -3.107 -5.754 -12.194 1.00 63.44 O ATOM 252 CB GLU A 16 -1.159 -8.296 -12.036 1.00 73.14 C ATOM 253 CG GLU A 16 -2.080 -9.529 -12.124 1.00 32.13 C ATOM 254 CD GLU A 16 -1.634 -10.546 -13.182 1.00 31.31 C ATOM 255 OE1 GLU A 16 -2.084 -10.452 -14.346 1.00 12.13 O ATOM 256 OE2 GLU A 16 -0.831 -11.444 -12.860 1.00 41.41 O ATOM 0 H GLU A 16 -1.574 -8.800 -9.594 1.00 1.23 H new ATOM 0 HA GLU A 16 -0.898 -6.400 -11.045 1.00 11.41 H new ATOM 0 HB2 GLU A 16 -1.103 -7.830 -13.020 1.00 73.14 H new ATOM 0 HB3 GLU A 16 -0.152 -8.628 -11.783 1.00 73.14 H new ATOM 0 HG2 GLU A 16 -2.114 -10.019 -11.151 1.00 32.13 H new ATOM 0 HG3 GLU A 16 -3.094 -9.201 -12.351 1.00 32.13 H new ATOM 263 N GLU A 17 -4.051 -7.191 -10.709 1.00 62.14 N ATOM 264 CA GLU A 17 -5.411 -6.638 -10.836 1.00 63.32 C ATOM 265 C GLU A 17 -5.496 -5.290 -10.115 1.00 74.03 C ATOM 266 O GLU A 17 -6.032 -4.321 -10.658 1.00 52.12 O ATOM 267 CB GLU A 17 -6.467 -7.619 -10.272 1.00 74.52 C ATOM 268 CG GLU A 17 -6.619 -8.911 -11.087 1.00 22.41 C ATOM 269 CD GLU A 17 -7.090 -8.669 -12.533 1.00 60.41 C ATOM 270 OE1 GLU A 17 -6.274 -8.785 -13.475 1.00 73.24 O ATOM 271 OE2 GLU A 17 -8.283 -8.341 -12.727 1.00 5.52 O ATOM 0 H GLU A 17 -3.987 -8.002 -10.094 1.00 62.14 H new ATOM 0 HA GLU A 17 -5.624 -6.490 -11.895 1.00 63.32 H new ATOM 0 HB2 GLU A 17 -6.197 -7.877 -9.248 1.00 74.52 H new ATOM 0 HB3 GLU A 17 -7.432 -7.113 -10.230 1.00 74.52 H new ATOM 0 HG2 GLU A 17 -5.663 -9.434 -11.107 1.00 22.41 H new ATOM 0 HG3 GLU A 17 -7.331 -9.567 -10.586 1.00 22.41 H new ATOM 278 N LEU A 18 -4.909 -5.243 -8.900 1.00 30.53 N ATOM 279 CA LEU A 18 -4.874 -4.039 -8.057 1.00 32.41 C ATOM 280 C LEU A 18 -3.981 -2.957 -8.684 1.00 64.10 C ATOM 281 O LEU A 18 -4.184 -1.762 -8.432 1.00 63.22 O ATOM 282 CB LEU A 18 -4.398 -4.390 -6.616 1.00 34.44 C ATOM 283 CG LEU A 18 -5.265 -5.440 -5.841 1.00 13.45 C ATOM 284 CD1 LEU A 18 -4.855 -5.543 -4.359 1.00 52.11 C ATOM 285 CD2 LEU A 18 -6.764 -5.147 -5.981 1.00 33.32 C ATOM 0 H LEU A 18 -4.444 -6.047 -8.478 1.00 30.53 H new ATOM 0 HA LEU A 18 -5.886 -3.640 -7.991 1.00 32.41 H new ATOM 0 HB2 LEU A 18 -3.376 -4.764 -6.674 1.00 34.44 H new ATOM 0 HB3 LEU A 18 -4.368 -3.471 -6.031 1.00 34.44 H new ATOM 0 HG LEU A 18 -5.072 -6.410 -6.300 1.00 13.45 H new ATOM 0 HD11 LEU A 18 -5.481 -6.282 -3.859 1.00 52.11 H new ATOM 0 HD12 LEU A 18 -3.810 -5.847 -4.291 1.00 52.11 H new ATOM 0 HD13 LEU A 18 -4.983 -4.573 -3.878 1.00 52.11 H new ATOM 0 HD21 LEU A 18 -7.334 -5.896 -5.431 1.00 33.32 H new ATOM 0 HD22 LEU A 18 -6.981 -4.158 -5.578 1.00 33.32 H new ATOM 0 HD23 LEU A 18 -7.044 -5.179 -7.034 1.00 33.32 H new ATOM 297 N LEU A 19 -3.005 -3.402 -9.513 1.00 12.01 N ATOM 298 CA LEU A 19 -2.158 -2.516 -10.325 1.00 54.11 C ATOM 299 C LEU A 19 -3.042 -1.674 -11.248 1.00 63.32 C ATOM 300 O LEU A 19 -2.992 -0.446 -11.199 1.00 75.13 O ATOM 301 CB LEU A 19 -1.131 -3.339 -11.148 1.00 41.32 C ATOM 302 CG LEU A 19 -0.167 -2.515 -12.063 1.00 23.44 C ATOM 303 CD1 LEU A 19 0.763 -1.610 -11.236 1.00 32.15 C ATOM 304 CD2 LEU A 19 0.639 -3.432 -13.002 1.00 73.23 C ATOM 0 H LEU A 19 -2.788 -4.392 -9.632 1.00 12.01 H new ATOM 0 HA LEU A 19 -1.599 -1.854 -9.664 1.00 54.11 H new ATOM 0 HB2 LEU A 19 -0.528 -3.927 -10.456 1.00 41.32 H new ATOM 0 HB3 LEU A 19 -1.678 -4.045 -11.773 1.00 41.32 H new ATOM 0 HG LEU A 19 -0.786 -1.868 -12.684 1.00 23.44 H new ATOM 0 HD11 LEU A 19 1.418 -1.053 -11.906 1.00 32.15 H new ATOM 0 HD12 LEU A 19 0.165 -0.912 -10.650 1.00 32.15 H new ATOM 0 HD13 LEU A 19 1.366 -2.223 -10.566 1.00 32.15 H new ATOM 0 HD21 LEU A 19 1.299 -2.827 -13.624 1.00 73.23 H new ATOM 0 HD22 LEU A 19 1.235 -4.126 -12.409 1.00 73.23 H new ATOM 0 HD23 LEU A 19 -0.045 -3.993 -13.638 1.00 73.23 H new ATOM 316 N GLU A 20 -3.895 -2.370 -12.034 1.00 4.41 N ATOM 317 CA GLU A 20 -4.867 -1.724 -12.931 1.00 52.14 C ATOM 318 C GLU A 20 -5.799 -0.772 -12.167 1.00 13.11 C ATOM 319 O GLU A 20 -5.994 0.359 -12.600 1.00 0.31 O ATOM 320 CB GLU A 20 -5.708 -2.783 -13.690 1.00 33.14 C ATOM 321 CG GLU A 20 -4.972 -3.484 -14.845 1.00 62.11 C ATOM 322 CD GLU A 20 -4.575 -2.514 -15.979 1.00 61.14 C ATOM 323 OE1 GLU A 20 -3.380 -2.174 -16.111 1.00 3.20 O ATOM 324 OE2 GLU A 20 -5.474 -2.082 -16.748 1.00 51.14 O ATOM 0 H GLU A 20 -3.925 -3.389 -12.061 1.00 4.41 H new ATOM 0 HA GLU A 20 -4.296 -1.138 -13.652 1.00 52.14 H new ATOM 0 HB2 GLU A 20 -6.042 -3.539 -12.979 1.00 33.14 H new ATOM 0 HB3 GLU A 20 -6.602 -2.301 -14.087 1.00 33.14 H new ATOM 0 HG2 GLU A 20 -4.076 -3.969 -14.457 1.00 62.11 H new ATOM 0 HG3 GLU A 20 -5.609 -4.270 -15.252 1.00 62.11 H new ATOM 331 N VAL A 21 -6.319 -1.227 -11.004 1.00 64.54 N ATOM 332 CA VAL A 21 -7.322 -0.466 -10.228 1.00 4.31 C ATOM 333 C VAL A 21 -6.812 0.957 -9.862 1.00 5.50 C ATOM 334 O VAL A 21 -7.589 1.916 -9.870 1.00 44.02 O ATOM 335 CB VAL A 21 -7.787 -1.231 -8.933 1.00 35.45 C ATOM 336 CG1 VAL A 21 -8.864 -0.434 -8.164 1.00 22.04 C ATOM 337 CG2 VAL A 21 -8.318 -2.646 -9.259 1.00 21.34 C ATOM 0 H VAL A 21 -6.059 -2.119 -10.583 1.00 64.54 H new ATOM 0 HA VAL A 21 -8.190 -0.362 -10.879 1.00 4.31 H new ATOM 0 HB VAL A 21 -6.906 -1.333 -8.300 1.00 35.45 H new ATOM 0 HG11 VAL A 21 -9.163 -0.990 -7.276 1.00 22.04 H new ATOM 0 HG12 VAL A 21 -8.458 0.533 -7.867 1.00 22.04 H new ATOM 0 HG13 VAL A 21 -9.732 -0.282 -8.806 1.00 22.04 H new ATOM 0 HG21 VAL A 21 -8.628 -3.139 -8.338 1.00 21.34 H new ATOM 0 HG22 VAL A 21 -9.170 -2.568 -9.934 1.00 21.34 H new ATOM 0 HG23 VAL A 21 -7.530 -3.229 -9.735 1.00 21.34 H new ATOM 347 N VAL A 22 -5.500 1.088 -9.578 1.00 43.13 N ATOM 348 CA VAL A 22 -4.872 2.410 -9.356 1.00 40.03 C ATOM 349 C VAL A 22 -4.844 3.224 -10.667 1.00 30.32 C ATOM 350 O VAL A 22 -5.277 4.376 -10.704 1.00 41.15 O ATOM 351 CB VAL A 22 -3.397 2.302 -8.824 1.00 60.51 C ATOM 352 CG1 VAL A 22 -2.836 3.700 -8.473 1.00 71.31 C ATOM 353 CG2 VAL A 22 -3.290 1.344 -7.625 1.00 33.15 C ATOM 0 H VAL A 22 -4.857 0.301 -9.497 1.00 43.13 H new ATOM 0 HA VAL A 22 -5.481 2.907 -8.600 1.00 40.03 H new ATOM 0 HB VAL A 22 -2.789 1.882 -9.626 1.00 60.51 H new ATOM 0 HG11 VAL A 22 -1.814 3.601 -8.107 1.00 71.31 H new ATOM 0 HG12 VAL A 22 -2.843 4.329 -9.363 1.00 71.31 H new ATOM 0 HG13 VAL A 22 -3.455 4.157 -7.701 1.00 71.31 H new ATOM 0 HG21 VAL A 22 -2.255 1.298 -7.288 1.00 33.15 H new ATOM 0 HG22 VAL A 22 -3.920 1.706 -6.813 1.00 33.15 H new ATOM 0 HG23 VAL A 22 -3.619 0.349 -7.924 1.00 33.15 H new ATOM 363 N LEU A 23 -4.363 2.566 -11.740 1.00 75.34 N ATOM 364 CA LEU A 23 -4.051 3.208 -13.028 1.00 24.42 C ATOM 365 C LEU A 23 -5.306 3.755 -13.748 1.00 23.12 C ATOM 366 O LEU A 23 -5.199 4.713 -14.516 1.00 25.25 O ATOM 367 CB LEU A 23 -3.298 2.205 -13.947 1.00 40.22 C ATOM 368 CG LEU A 23 -1.974 1.593 -13.374 1.00 32.21 C ATOM 369 CD1 LEU A 23 -1.369 0.546 -14.338 1.00 23.10 C ATOM 370 CD2 LEU A 23 -0.947 2.685 -13.022 1.00 50.40 C ATOM 0 H LEU A 23 -4.179 1.563 -11.735 1.00 75.34 H new ATOM 0 HA LEU A 23 -3.415 4.067 -12.813 1.00 24.42 H new ATOM 0 HB2 LEU A 23 -3.976 1.387 -14.187 1.00 40.22 H new ATOM 0 HB3 LEU A 23 -3.063 2.710 -14.884 1.00 40.22 H new ATOM 0 HG LEU A 23 -2.234 1.079 -12.449 1.00 32.21 H new ATOM 0 HD11 LEU A 23 -0.452 0.143 -13.908 1.00 23.10 H new ATOM 0 HD12 LEU A 23 -2.084 -0.262 -14.492 1.00 23.10 H new ATOM 0 HD13 LEU A 23 -1.144 1.019 -15.294 1.00 23.10 H new ATOM 0 HD21 LEU A 23 -0.043 2.221 -12.628 1.00 50.40 H new ATOM 0 HD22 LEU A 23 -0.701 3.256 -13.918 1.00 50.40 H new ATOM 0 HD23 LEU A 23 -1.369 3.353 -12.271 1.00 50.40 H new ATOM 382 N LYS A 24 -6.495 3.140 -13.518 1.00 33.24 N ATOM 383 CA LYS A 24 -7.751 3.598 -14.176 1.00 54.34 C ATOM 384 C LYS A 24 -8.400 4.722 -13.337 1.00 4.51 C ATOM 385 O LYS A 24 -9.043 5.619 -13.896 1.00 53.30 O ATOM 386 CB LYS A 24 -8.797 2.446 -14.418 1.00 24.53 C ATOM 387 CG LYS A 24 -8.247 1.008 -14.570 1.00 5.24 C ATOM 388 CD LYS A 24 -7.138 0.820 -15.631 1.00 50.24 C ATOM 389 CE LYS A 24 -7.615 0.969 -17.077 1.00 54.43 C ATOM 390 NZ LYS A 24 -6.504 0.684 -18.023 1.00 72.24 N ATOM 0 H LYS A 24 -6.612 2.341 -12.895 1.00 33.24 H new ATOM 0 HA LYS A 24 -7.465 3.967 -15.161 1.00 54.34 H new ATOM 0 HB2 LYS A 24 -9.503 2.451 -13.587 1.00 24.53 H new ATOM 0 HB3 LYS A 24 -9.363 2.688 -15.318 1.00 24.53 H new ATOM 0 HG2 LYS A 24 -7.859 0.684 -13.605 1.00 5.24 H new ATOM 0 HG3 LYS A 24 -9.077 0.346 -14.818 1.00 5.24 H new ATOM 0 HD2 LYS A 24 -6.347 1.547 -15.445 1.00 50.24 H new ATOM 0 HD3 LYS A 24 -6.697 -0.169 -15.507 1.00 50.24 H new ATOM 0 HE2 LYS A 24 -8.444 0.287 -17.265 1.00 54.43 H new ATOM 0 HE3 LYS A 24 -7.990 1.979 -17.240 1.00 54.43 H new ATOM 0 HZ1 LYS A 24 -6.884 0.589 -18.986 1.00 72.24 H new ATOM 0 HZ2 LYS A 24 -5.817 1.465 -17.997 1.00 72.24 H new ATOM 0 HZ3 LYS A 24 -6.032 -0.201 -17.748 1.00 72.24 H new ATOM 404 N SER A 25 -8.240 4.644 -11.992 1.00 73.12 N ATOM 405 CA SER A 25 -8.735 5.680 -11.059 1.00 43.44 C ATOM 406 C SER A 25 -7.988 7.004 -11.302 1.00 22.30 C ATOM 407 O SER A 25 -8.607 8.070 -11.401 1.00 61.12 O ATOM 408 CB SER A 25 -8.557 5.224 -9.586 1.00 64.13 C ATOM 409 OG SER A 25 -9.294 4.043 -9.312 1.00 51.43 O ATOM 0 H SER A 25 -7.768 3.867 -11.530 1.00 73.12 H new ATOM 0 HA SER A 25 -9.799 5.833 -11.242 1.00 43.44 H new ATOM 0 HB2 SER A 25 -7.500 5.049 -9.384 1.00 64.13 H new ATOM 0 HB3 SER A 25 -8.882 6.020 -8.916 1.00 64.13 H new ATOM 0 HG SER A 25 -8.735 3.259 -9.495 1.00 51.43 H new ATOM 415 N ASP A 26 -6.652 6.898 -11.422 1.00 32.05 N ATOM 416 CA ASP A 26 -5.766 8.025 -11.733 1.00 34.24 C ATOM 417 C ASP A 26 -4.410 7.481 -12.248 1.00 75.13 C ATOM 418 O ASP A 26 -3.676 6.843 -11.482 1.00 22.22 O ATOM 419 CB ASP A 26 -5.559 8.935 -10.491 1.00 35.33 C ATOM 420 CG ASP A 26 -4.787 10.224 -10.820 1.00 31.53 C ATOM 421 OD1 ASP A 26 -3.552 10.202 -10.808 1.00 62.33 O ATOM 422 OD2 ASP A 26 -5.416 11.271 -11.102 1.00 15.44 O ATOM 0 H ASP A 26 -6.156 6.015 -11.304 1.00 32.05 H new ATOM 0 HA ASP A 26 -6.228 8.635 -12.509 1.00 34.24 H new ATOM 0 HB2 ASP A 26 -6.530 9.196 -10.071 1.00 35.33 H new ATOM 0 HB3 ASP A 26 -5.019 8.379 -9.724 1.00 35.33 H new ATOM 427 N PRO A 27 -4.060 7.711 -13.556 1.00 52.43 N ATOM 428 CA PRO A 27 -2.779 7.240 -14.154 1.00 60.40 C ATOM 429 C PRO A 27 -1.541 8.044 -13.697 1.00 14.33 C ATOM 430 O PRO A 27 -0.404 7.617 -13.938 1.00 5.11 O ATOM 431 CB PRO A 27 -3.011 7.400 -15.689 1.00 12.30 C ATOM 432 CG PRO A 27 -4.478 7.708 -15.851 1.00 3.11 C ATOM 433 CD PRO A 27 -4.891 8.403 -14.575 1.00 44.24 C ATOM 0 HA PRO A 27 -2.554 6.220 -13.843 1.00 60.40 H new ATOM 0 HB2 PRO A 27 -2.395 8.202 -16.096 1.00 12.30 H new ATOM 0 HB3 PRO A 27 -2.741 6.489 -16.223 1.00 12.30 H new ATOM 0 HG2 PRO A 27 -4.651 8.345 -16.718 1.00 3.11 H new ATOM 0 HG3 PRO A 27 -5.055 6.796 -16.005 1.00 3.11 H new ATOM 0 HD2 PRO A 27 -4.685 9.473 -14.609 1.00 44.24 H new ATOM 0 HD3 PRO A 27 -5.957 8.289 -14.376 1.00 44.24 H new ATOM 441 N ASN A 28 -1.765 9.216 -13.072 1.00 62.23 N ATOM 442 CA ASN A 28 -0.670 10.113 -12.630 1.00 54.43 C ATOM 443 C ASN A 28 -0.055 9.601 -11.313 1.00 52.41 C ATOM 444 O ASN A 28 1.086 9.952 -10.985 1.00 74.42 O ATOM 445 CB ASN A 28 -1.179 11.573 -12.458 1.00 51.13 C ATOM 446 CG ASN A 28 -1.954 12.084 -13.675 1.00 70.21 C ATOM 447 OD1 ASN A 28 -1.379 12.642 -14.614 1.00 43.43 O ATOM 448 ND2 ASN A 28 -3.270 11.908 -13.654 1.00 31.10 N ATOM 0 H ASN A 28 -2.698 9.568 -12.859 1.00 62.23 H new ATOM 0 HA ASN A 28 0.100 10.111 -13.401 1.00 54.43 H new ATOM 0 HB2 ASN A 28 -1.819 11.627 -11.578 1.00 51.13 H new ATOM 0 HB3 ASN A 28 -0.328 12.229 -12.274 1.00 51.13 H new ATOM 0 HD21 ASN A 28 -3.841 12.239 -14.432 1.00 31.10 H new ATOM 0 HD22 ASN A 28 -3.710 11.442 -12.860 1.00 31.10 H new ATOM 455 N VAL A 29 -0.835 8.809 -10.545 1.00 40.52 N ATOM 456 CA VAL A 29 -0.332 8.107 -9.350 1.00 75.30 C ATOM 457 C VAL A 29 0.724 7.061 -9.771 1.00 13.43 C ATOM 458 O VAL A 29 0.481 6.262 -10.688 1.00 70.30 O ATOM 459 CB VAL A 29 -1.496 7.405 -8.542 1.00 34.12 C ATOM 460 CG1 VAL A 29 -0.954 6.631 -7.314 1.00 25.14 C ATOM 461 CG2 VAL A 29 -2.570 8.429 -8.105 1.00 65.21 C ATOM 0 H VAL A 29 -1.823 8.641 -10.736 1.00 40.52 H new ATOM 0 HA VAL A 29 0.121 8.849 -8.692 1.00 75.30 H new ATOM 0 HB VAL A 29 -1.962 6.684 -9.213 1.00 34.12 H new ATOM 0 HG11 VAL A 29 -1.783 6.162 -6.784 1.00 25.14 H new ATOM 0 HG12 VAL A 29 -0.256 5.863 -7.647 1.00 25.14 H new ATOM 0 HG13 VAL A 29 -0.441 7.322 -6.646 1.00 25.14 H new ATOM 0 HG21 VAL A 29 -3.357 7.917 -7.552 1.00 65.21 H new ATOM 0 HG22 VAL A 29 -2.113 9.186 -7.468 1.00 65.21 H new ATOM 0 HG23 VAL A 29 -2.998 8.906 -8.987 1.00 65.21 H new ATOM 471 N LYS A 30 1.896 7.102 -9.119 1.00 74.40 N ATOM 472 CA LYS A 30 2.996 6.167 -9.389 1.00 51.15 C ATOM 473 C LYS A 30 2.659 4.791 -8.796 1.00 43.13 C ATOM 474 O LYS A 30 2.090 4.699 -7.710 1.00 30.14 O ATOM 475 CB LYS A 30 4.319 6.726 -8.802 1.00 23.22 C ATOM 476 CG LYS A 30 5.591 5.895 -9.105 1.00 74.53 C ATOM 477 CD LYS A 30 5.882 5.777 -10.621 1.00 21.20 C ATOM 478 CE LYS A 30 7.176 5.003 -10.915 1.00 12.15 C ATOM 479 NZ LYS A 30 7.424 4.862 -12.380 1.00 44.20 N ATOM 0 H LYS A 30 2.107 7.784 -8.391 1.00 74.40 H new ATOM 0 HA LYS A 30 3.127 6.052 -10.465 1.00 51.15 H new ATOM 0 HB2 LYS A 30 4.467 7.736 -9.185 1.00 23.22 H new ATOM 0 HB3 LYS A 30 4.210 6.808 -7.721 1.00 23.22 H new ATOM 0 HG2 LYS A 30 6.446 6.355 -8.610 1.00 74.53 H new ATOM 0 HG3 LYS A 30 5.477 4.897 -8.683 1.00 74.53 H new ATOM 0 HD2 LYS A 30 5.045 5.278 -11.110 1.00 21.20 H new ATOM 0 HD3 LYS A 30 5.954 6.775 -11.052 1.00 21.20 H new ATOM 0 HE2 LYS A 30 8.019 5.517 -10.453 1.00 12.15 H new ATOM 0 HE3 LYS A 30 7.118 4.014 -10.461 1.00 12.15 H new ATOM 0 HZ1 LYS A 30 8.307 4.334 -12.533 1.00 44.20 H new ATOM 0 HZ2 LYS A 30 6.633 4.349 -12.818 1.00 44.20 H new ATOM 0 HZ3 LYS A 30 7.506 5.805 -12.811 1.00 44.20 H new ATOM 493 N THR A 31 2.978 3.732 -9.539 1.00 70.22 N ATOM 494 CA THR A 31 2.801 2.349 -9.087 1.00 62.10 C ATOM 495 C THR A 31 4.081 1.563 -9.364 1.00 22.23 C ATOM 496 O THR A 31 4.677 1.685 -10.445 1.00 21.40 O ATOM 497 CB THR A 31 1.596 1.667 -9.809 1.00 12.13 C ATOM 498 OG1 THR A 31 1.710 1.847 -11.229 1.00 54.11 O ATOM 499 CG2 THR A 31 0.239 2.207 -9.339 1.00 4.13 C ATOM 0 H THR A 31 3.369 3.808 -10.478 1.00 70.22 H new ATOM 0 HA THR A 31 2.591 2.358 -8.017 1.00 62.10 H new ATOM 0 HB THR A 31 1.635 0.608 -9.554 1.00 12.13 H new ATOM 0 HG1 THR A 31 2.075 1.033 -11.634 1.00 54.11 H new ATOM 0 HG21 THR A 31 -0.561 1.697 -9.875 1.00 4.13 H new ATOM 0 HG22 THR A 31 0.128 2.032 -8.269 1.00 4.13 H new ATOM 0 HG23 THR A 31 0.184 3.277 -9.539 1.00 4.13 H new ATOM 507 N VAL A 32 4.503 0.774 -8.372 1.00 10.02 N ATOM 508 CA VAL A 32 5.725 -0.031 -8.423 1.00 15.45 C ATOM 509 C VAL A 32 5.428 -1.405 -7.826 1.00 72.43 C ATOM 510 O VAL A 32 4.803 -1.484 -6.778 1.00 24.13 O ATOM 511 CB VAL A 32 6.904 0.630 -7.601 1.00 4.43 C ATOM 512 CG1 VAL A 32 8.189 -0.224 -7.690 1.00 22.13 C ATOM 513 CG2 VAL A 32 7.164 2.095 -8.035 1.00 53.43 C ATOM 0 H VAL A 32 3.994 0.676 -7.494 1.00 10.02 H new ATOM 0 HA VAL A 32 6.038 -0.106 -9.465 1.00 15.45 H new ATOM 0 HB VAL A 32 6.595 0.661 -6.556 1.00 4.43 H new ATOM 0 HG11 VAL A 32 8.983 0.253 -7.116 1.00 22.13 H new ATOM 0 HG12 VAL A 32 7.995 -1.217 -7.285 1.00 22.13 H new ATOM 0 HG13 VAL A 32 8.496 -0.311 -8.732 1.00 22.13 H new ATOM 0 HG21 VAL A 32 7.981 2.510 -7.445 1.00 53.43 H new ATOM 0 HG22 VAL A 32 7.430 2.120 -9.092 1.00 53.43 H new ATOM 0 HG23 VAL A 32 6.263 2.687 -7.874 1.00 53.43 H new ATOM 523 N ARG A 33 5.877 -2.480 -8.492 1.00 64.51 N ATOM 524 CA ARG A 33 5.839 -3.833 -7.934 1.00 14.51 C ATOM 525 C ARG A 33 7.287 -4.271 -7.650 1.00 40.45 C ATOM 526 O ARG A 33 8.004 -4.717 -8.552 1.00 62.54 O ATOM 527 CB ARG A 33 5.119 -4.833 -8.884 1.00 25.12 C ATOM 528 CG ARG A 33 5.044 -6.273 -8.317 1.00 22.11 C ATOM 529 CD ARG A 33 4.405 -7.302 -9.271 1.00 52.32 C ATOM 530 NE ARG A 33 4.653 -8.680 -8.807 1.00 35.44 N ATOM 531 CZ ARG A 33 4.001 -9.784 -9.211 1.00 54.33 C ATOM 532 NH1 ARG A 33 3.014 -9.724 -10.113 1.00 10.51 N ATOM 533 NH2 ARG A 33 4.373 -10.959 -8.730 1.00 0.31 N ATOM 0 H ARG A 33 6.275 -2.432 -9.430 1.00 64.51 H new ATOM 0 HA ARG A 33 5.262 -3.829 -7.009 1.00 14.51 H new ATOM 0 HB2 ARG A 33 4.109 -4.474 -9.079 1.00 25.12 H new ATOM 0 HB3 ARG A 33 5.641 -4.854 -9.841 1.00 25.12 H new ATOM 0 HG2 ARG A 33 6.052 -6.605 -8.067 1.00 22.11 H new ATOM 0 HG3 ARG A 33 4.475 -6.255 -7.388 1.00 22.11 H new ATOM 0 HD2 ARG A 33 3.332 -7.124 -9.337 1.00 52.32 H new ATOM 0 HD3 ARG A 33 4.811 -7.174 -10.274 1.00 52.32 H new ATOM 0 HE ARG A 33 5.390 -8.807 -8.113 1.00 35.44 H new ATOM 0 HH11 ARG A 33 2.741 -8.825 -10.511 1.00 10.51 H new ATOM 0 HH12 ARG A 33 2.535 -10.577 -10.403 1.00 10.51 H new ATOM 0 HH21 ARG A 33 5.143 -11.017 -8.064 1.00 0.31 H new ATOM 0 HH22 ARG A 33 3.890 -11.807 -9.025 1.00 0.31 H new ATOM 547 N THR A 34 7.733 -4.035 -6.416 1.00 13.54 N ATOM 548 CA THR A 34 9.050 -4.481 -5.919 1.00 3.24 C ATOM 549 C THR A 34 8.838 -5.390 -4.700 1.00 72.22 C ATOM 550 O THR A 34 7.734 -5.459 -4.157 1.00 42.13 O ATOM 551 CB THR A 34 9.983 -3.261 -5.565 1.00 21.31 C ATOM 552 OG1 THR A 34 11.259 -3.721 -5.071 1.00 63.03 O ATOM 553 CG2 THR A 34 9.342 -2.320 -4.534 1.00 11.21 C ATOM 0 H THR A 34 7.190 -3.524 -5.720 1.00 13.54 H new ATOM 0 HA THR A 34 9.556 -5.040 -6.706 1.00 3.24 H new ATOM 0 HB THR A 34 10.130 -2.699 -6.488 1.00 21.31 H new ATOM 0 HG1 THR A 34 11.825 -2.950 -4.858 1.00 63.03 H new ATOM 0 HG21 THR A 34 10.022 -1.495 -4.322 1.00 11.21 H new ATOM 0 HG22 THR A 34 8.407 -1.926 -4.933 1.00 11.21 H new ATOM 0 HG23 THR A 34 9.141 -2.870 -3.615 1.00 11.21 H new ATOM 561 N ASP A 35 9.884 -6.112 -4.306 1.00 33.41 N ATOM 562 CA ASP A 35 9.897 -6.939 -3.082 1.00 41.14 C ATOM 563 C ASP A 35 10.861 -6.341 -2.044 1.00 63.11 C ATOM 564 O ASP A 35 10.733 -6.610 -0.845 1.00 64.35 O ATOM 565 CB ASP A 35 10.308 -8.396 -3.427 1.00 1.11 C ATOM 566 CG ASP A 35 11.741 -8.507 -3.980 1.00 51.00 C ATOM 567 OD1 ASP A 35 12.652 -8.974 -3.263 1.00 12.23 O ATOM 568 OD2 ASP A 35 11.963 -8.113 -5.141 1.00 43.04 O ATOM 0 H ASP A 35 10.760 -6.146 -4.827 1.00 33.41 H new ATOM 0 HA ASP A 35 8.894 -6.951 -2.655 1.00 41.14 H new ATOM 0 HB2 ASP A 35 10.222 -9.013 -2.532 1.00 1.11 H new ATOM 0 HB3 ASP A 35 9.610 -8.800 -4.161 1.00 1.11 H new ATOM 573 N ASP A 36 11.815 -5.520 -2.530 1.00 24.52 N ATOM 574 CA ASP A 36 12.915 -4.972 -1.717 1.00 21.52 C ATOM 575 C ASP A 36 12.506 -3.637 -1.062 1.00 20.04 C ATOM 576 O ASP A 36 12.244 -2.647 -1.752 1.00 11.11 O ATOM 577 CB ASP A 36 14.164 -4.790 -2.609 1.00 4.44 C ATOM 578 CG ASP A 36 15.352 -4.147 -1.878 1.00 62.21 C ATOM 579 OD1 ASP A 36 15.696 -2.984 -2.176 1.00 61.25 O ATOM 580 OD2 ASP A 36 15.937 -4.799 -0.995 1.00 13.40 O ATOM 0 H ASP A 36 11.842 -5.218 -3.504 1.00 24.52 H new ATOM 0 HA ASP A 36 13.147 -5.670 -0.913 1.00 21.52 H new ATOM 0 HB2 ASP A 36 14.469 -5.762 -2.996 1.00 4.44 H new ATOM 0 HB3 ASP A 36 13.900 -4.174 -3.468 1.00 4.44 H new ATOM 585 N LYS A 37 12.494 -3.637 0.281 1.00 71.12 N ATOM 586 CA LYS A 37 12.047 -2.502 1.120 1.00 72.52 C ATOM 587 C LYS A 37 13.057 -1.333 1.165 1.00 62.30 C ATOM 588 O LYS A 37 12.738 -0.260 1.698 1.00 31.34 O ATOM 589 CB LYS A 37 11.747 -3.022 2.550 1.00 50.30 C ATOM 590 CG LYS A 37 12.940 -3.709 3.256 1.00 73.41 C ATOM 591 CD LYS A 37 12.528 -4.373 4.592 1.00 61.53 C ATOM 592 CE LYS A 37 13.666 -5.174 5.245 1.00 53.53 C ATOM 593 NZ LYS A 37 13.234 -5.821 6.518 1.00 52.01 N ATOM 0 H LYS A 37 12.800 -4.441 0.830 1.00 71.12 H new ATOM 0 HA LYS A 37 11.145 -2.093 0.665 1.00 72.52 H new ATOM 0 HB2 LYS A 37 11.414 -2.185 3.163 1.00 50.30 H new ATOM 0 HB3 LYS A 37 10.918 -3.728 2.498 1.00 50.30 H new ATOM 0 HG2 LYS A 37 13.366 -4.463 2.594 1.00 73.41 H new ATOM 0 HG3 LYS A 37 13.721 -2.972 3.444 1.00 73.41 H new ATOM 0 HD2 LYS A 37 12.191 -3.602 5.285 1.00 61.53 H new ATOM 0 HD3 LYS A 37 11.681 -5.036 4.415 1.00 61.53 H new ATOM 0 HE2 LYS A 37 14.017 -5.938 4.551 1.00 53.53 H new ATOM 0 HE3 LYS A 37 14.509 -4.512 5.443 1.00 53.53 H new ATOM 0 HZ1 LYS A 37 14.031 -5.840 7.186 1.00 52.01 H new ATOM 0 HZ2 LYS A 37 12.448 -5.281 6.932 1.00 52.01 H new ATOM 0 HZ3 LYS A 37 12.922 -6.794 6.324 1.00 52.01 H new ATOM 607 N GLU A 38 14.267 -1.545 0.614 1.00 1.53 N ATOM 608 CA GLU A 38 15.314 -0.501 0.537 1.00 15.31 C ATOM 609 C GLU A 38 15.040 0.412 -0.674 1.00 11.45 C ATOM 610 O GLU A 38 15.201 1.635 -0.601 1.00 50.12 O ATOM 611 CB GLU A 38 16.721 -1.145 0.413 1.00 41.44 C ATOM 612 CG GLU A 38 17.028 -2.224 1.467 1.00 63.30 C ATOM 613 CD GLU A 38 18.455 -2.791 1.341 1.00 44.24 C ATOM 614 OE1 GLU A 38 18.683 -3.674 0.478 1.00 55.33 O ATOM 615 OE2 GLU A 38 19.354 -2.359 2.106 1.00 30.11 O ATOM 0 H GLU A 38 14.548 -2.439 0.211 1.00 1.53 H new ATOM 0 HA GLU A 38 15.290 0.092 1.451 1.00 15.31 H new ATOM 0 HB2 GLU A 38 16.818 -1.587 -0.579 1.00 41.44 H new ATOM 0 HB3 GLU A 38 17.473 -0.360 0.487 1.00 41.44 H new ATOM 0 HG2 GLU A 38 16.896 -1.801 2.463 1.00 63.30 H new ATOM 0 HG3 GLU A 38 16.309 -3.037 1.369 1.00 63.30 H new ATOM 622 N LYS A 39 14.618 -0.225 -1.784 1.00 51.42 N ATOM 623 CA LYS A 39 14.235 0.453 -3.030 1.00 54.31 C ATOM 624 C LYS A 39 12.970 1.299 -2.825 1.00 41.31 C ATOM 625 O LYS A 39 12.887 2.436 -3.314 1.00 24.43 O ATOM 626 CB LYS A 39 14.033 -0.584 -4.151 1.00 73.44 C ATOM 627 CG LYS A 39 13.588 0.022 -5.496 1.00 14.34 C ATOM 628 CD LYS A 39 13.698 -0.983 -6.646 1.00 15.02 C ATOM 629 CE LYS A 39 13.067 -0.479 -7.953 1.00 71.01 C ATOM 630 NZ LYS A 39 11.595 -0.297 -7.832 1.00 52.22 N ATOM 0 H LYS A 39 14.534 -1.240 -1.837 1.00 51.42 H new ATOM 0 HA LYS A 39 15.038 1.129 -3.324 1.00 54.31 H new ATOM 0 HB2 LYS A 39 14.966 -1.128 -4.301 1.00 73.44 H new ATOM 0 HB3 LYS A 39 13.288 -1.312 -3.828 1.00 73.44 H new ATOM 0 HG2 LYS A 39 12.557 0.367 -5.414 1.00 14.34 H new ATOM 0 HG3 LYS A 39 14.200 0.896 -5.719 1.00 14.34 H new ATOM 0 HD2 LYS A 39 14.749 -1.210 -6.822 1.00 15.02 H new ATOM 0 HD3 LYS A 39 13.215 -1.915 -6.353 1.00 15.02 H new ATOM 0 HE2 LYS A 39 13.527 0.468 -8.235 1.00 71.01 H new ATOM 0 HE3 LYS A 39 13.279 -1.187 -8.754 1.00 71.01 H new ATOM 0 HZ1 LYS A 39 11.110 -0.944 -8.486 1.00 52.22 H new ATOM 0 HZ2 LYS A 39 11.299 -0.504 -6.857 1.00 52.22 H new ATOM 0 HZ3 LYS A 39 11.346 0.685 -8.069 1.00 52.22 H new ATOM 644 N VAL A 40 12.008 0.734 -2.061 1.00 73.34 N ATOM 645 CA VAL A 40 10.752 1.419 -1.712 1.00 14.34 C ATOM 646 C VAL A 40 11.025 2.790 -1.059 1.00 33.41 C ATOM 647 O VAL A 40 10.345 3.759 -1.373 1.00 14.45 O ATOM 648 CB VAL A 40 9.856 0.561 -0.747 1.00 33.43 C ATOM 649 CG1 VAL A 40 8.511 1.259 -0.464 1.00 62.03 C ATOM 650 CG2 VAL A 40 9.610 -0.853 -1.304 1.00 54.22 C ATOM 0 H VAL A 40 12.084 -0.206 -1.673 1.00 73.34 H new ATOM 0 HA VAL A 40 10.214 1.562 -2.649 1.00 14.34 H new ATOM 0 HB VAL A 40 10.403 0.466 0.191 1.00 33.43 H new ATOM 0 HG11 VAL A 40 7.914 0.641 0.206 1.00 62.03 H new ATOM 0 HG12 VAL A 40 8.694 2.227 0.002 1.00 62.03 H new ATOM 0 HG13 VAL A 40 7.972 1.404 -1.400 1.00 62.03 H new ATOM 0 HG21 VAL A 40 8.987 -1.415 -0.608 1.00 54.22 H new ATOM 0 HG22 VAL A 40 9.105 -0.782 -2.267 1.00 54.22 H new ATOM 0 HG23 VAL A 40 10.564 -1.365 -1.431 1.00 54.22 H new ATOM 660 N LYS A 41 12.058 2.848 -0.180 1.00 64.34 N ATOM 661 CA LYS A 41 12.460 4.091 0.517 1.00 45.24 C ATOM 662 C LYS A 41 12.792 5.205 -0.478 1.00 43.03 C ATOM 663 O LYS A 41 12.309 6.335 -0.339 1.00 1.05 O ATOM 664 CB LYS A 41 13.696 3.863 1.419 1.00 25.44 C ATOM 665 CG LYS A 41 13.466 2.893 2.586 1.00 62.41 C ATOM 666 CD LYS A 41 14.672 2.856 3.550 1.00 64.45 C ATOM 667 CE LYS A 41 14.495 1.837 4.678 1.00 14.15 C ATOM 668 NZ LYS A 41 14.472 0.439 4.171 1.00 24.14 N ATOM 0 H LYS A 41 12.630 2.039 0.062 1.00 64.34 H new ATOM 0 HA LYS A 41 11.610 4.387 1.131 1.00 45.24 H new ATOM 0 HB2 LYS A 41 14.513 3.484 0.805 1.00 25.44 H new ATOM 0 HB3 LYS A 41 14.018 4.824 1.821 1.00 25.44 H new ATOM 0 HG2 LYS A 41 12.572 3.190 3.134 1.00 62.41 H new ATOM 0 HG3 LYS A 41 13.283 1.892 2.195 1.00 62.41 H new ATOM 0 HD2 LYS A 41 15.574 2.616 2.988 1.00 64.45 H new ATOM 0 HD3 LYS A 41 14.818 3.847 3.980 1.00 64.45 H new ATOM 0 HE2 LYS A 41 15.307 1.948 5.397 1.00 14.15 H new ATOM 0 HE3 LYS A 41 13.567 2.044 5.211 1.00 14.15 H new ATOM 0 HZ1 LYS A 41 13.921 -0.157 4.821 1.00 24.14 H new ATOM 0 HZ2 LYS A 41 14.034 0.419 3.228 1.00 24.14 H new ATOM 0 HZ3 LYS A 41 15.445 0.076 4.109 1.00 24.14 H new ATOM 682 N GLU A 42 13.606 4.842 -1.489 1.00 71.34 N ATOM 683 CA GLU A 42 14.036 5.758 -2.557 1.00 21.43 C ATOM 684 C GLU A 42 12.816 6.338 -3.284 1.00 22.41 C ATOM 685 O GLU A 42 12.730 7.544 -3.516 1.00 30.35 O ATOM 686 CB GLU A 42 14.943 5.025 -3.572 1.00 15.12 C ATOM 687 CG GLU A 42 16.218 4.417 -2.968 1.00 53.53 C ATOM 688 CD GLU A 42 17.096 3.724 -4.022 1.00 44.33 C ATOM 689 OE1 GLU A 42 17.078 2.475 -4.119 1.00 1.35 O ATOM 690 OE2 GLU A 42 17.799 4.436 -4.781 1.00 10.22 O ATOM 0 H GLU A 42 13.984 3.900 -1.585 1.00 71.34 H new ATOM 0 HA GLU A 42 14.602 6.570 -2.100 1.00 21.43 H new ATOM 0 HB2 GLU A 42 14.367 4.231 -4.046 1.00 15.12 H new ATOM 0 HB3 GLU A 42 15.227 5.725 -4.357 1.00 15.12 H new ATOM 0 HG2 GLU A 42 16.795 5.202 -2.479 1.00 53.53 H new ATOM 0 HG3 GLU A 42 15.943 3.696 -2.198 1.00 53.53 H new ATOM 697 N GLU A 43 11.866 5.445 -3.586 1.00 73.35 N ATOM 698 CA GLU A 43 10.648 5.764 -4.351 1.00 4.35 C ATOM 699 C GLU A 43 9.601 6.536 -3.509 1.00 54.23 C ATOM 700 O GLU A 43 8.791 7.287 -4.069 1.00 22.32 O ATOM 701 CB GLU A 43 10.084 4.448 -4.941 1.00 32.33 C ATOM 702 CG GLU A 43 11.123 3.695 -5.804 1.00 62.33 C ATOM 703 CD GLU A 43 10.613 2.390 -6.408 1.00 1.31 C ATOM 704 OE1 GLU A 43 10.469 2.307 -7.655 1.00 72.21 O ATOM 705 OE2 GLU A 43 10.381 1.422 -5.649 1.00 54.44 O ATOM 0 H GLU A 43 11.920 4.466 -3.303 1.00 73.35 H new ATOM 0 HA GLU A 43 10.903 6.443 -5.165 1.00 4.35 H new ATOM 0 HB2 GLU A 43 9.754 3.801 -4.128 1.00 32.33 H new ATOM 0 HB3 GLU A 43 9.206 4.672 -5.547 1.00 32.33 H new ATOM 0 HG2 GLU A 43 11.451 4.351 -6.610 1.00 62.33 H new ATOM 0 HG3 GLU A 43 11.999 3.480 -5.192 1.00 62.33 H new ATOM 712 N ILE A 44 9.649 6.374 -2.167 1.00 23.41 N ATOM 713 CA ILE A 44 8.822 7.163 -1.221 1.00 40.55 C ATOM 714 C ILE A 44 9.326 8.622 -1.194 1.00 53.24 C ATOM 715 O ILE A 44 8.529 9.568 -1.132 1.00 74.05 O ATOM 716 CB ILE A 44 8.840 6.528 0.236 1.00 31.41 C ATOM 717 CG1 ILE A 44 8.051 5.177 0.264 1.00 72.21 C ATOM 718 CG2 ILE A 44 8.287 7.499 1.313 1.00 52.34 C ATOM 719 CD1 ILE A 44 8.082 4.455 1.607 1.00 74.04 C ATOM 0 H ILE A 44 10.259 5.696 -1.709 1.00 23.41 H new ATOM 0 HA ILE A 44 7.787 7.147 -1.564 1.00 40.55 H new ATOM 0 HB ILE A 44 9.884 6.334 0.481 1.00 31.41 H new ATOM 0 HG12 ILE A 44 7.013 5.371 -0.006 1.00 72.21 H new ATOM 0 HG13 ILE A 44 8.461 4.516 -0.499 1.00 72.21 H new ATOM 0 HG21 ILE A 44 8.321 7.017 2.290 1.00 52.34 H new ATOM 0 HG22 ILE A 44 8.895 8.404 1.334 1.00 52.34 H new ATOM 0 HG23 ILE A 44 7.256 7.760 1.073 1.00 52.34 H new ATOM 0 HD11 ILE A 44 7.511 3.529 1.536 1.00 74.04 H new ATOM 0 HD12 ILE A 44 9.114 4.225 1.873 1.00 74.04 H new ATOM 0 HD13 ILE A 44 7.644 5.094 2.374 1.00 74.04 H new ATOM 731 N GLU A 45 10.669 8.781 -1.276 1.00 21.22 N ATOM 732 CA GLU A 45 11.322 10.102 -1.360 1.00 62.00 C ATOM 733 C GLU A 45 10.951 10.806 -2.671 1.00 14.35 C ATOM 734 O GLU A 45 10.632 11.995 -2.666 1.00 21.53 O ATOM 735 CB GLU A 45 12.859 9.973 -1.258 1.00 61.54 C ATOM 736 CG GLU A 45 13.366 9.411 0.076 1.00 15.41 C ATOM 737 CD GLU A 45 14.896 9.290 0.123 1.00 24.21 C ATOM 738 OE1 GLU A 45 15.443 8.331 -0.460 1.00 3.13 O ATOM 739 OE2 GLU A 45 15.564 10.167 0.724 1.00 44.10 O ATOM 0 H GLU A 45 11.324 7.999 -1.285 1.00 21.22 H new ATOM 0 HA GLU A 45 10.966 10.698 -0.520 1.00 62.00 H new ATOM 0 HB2 GLU A 45 13.211 9.330 -2.065 1.00 61.54 H new ATOM 0 HB3 GLU A 45 13.304 10.955 -1.416 1.00 61.54 H new ATOM 0 HG2 GLU A 45 13.031 10.056 0.888 1.00 15.41 H new ATOM 0 HG3 GLU A 45 12.922 8.430 0.245 1.00 15.41 H new ATOM 746 N LYS A 46 10.983 10.031 -3.783 1.00 62.25 N ATOM 747 CA LYS A 46 10.614 10.518 -5.129 1.00 5.33 C ATOM 748 C LYS A 46 9.159 11.016 -5.139 1.00 15.14 C ATOM 749 O LYS A 46 8.847 12.046 -5.745 1.00 41.41 O ATOM 750 CB LYS A 46 10.799 9.398 -6.193 1.00 33.35 C ATOM 751 CG LYS A 46 12.253 8.890 -6.348 1.00 71.20 C ATOM 752 CD LYS A 46 12.390 7.746 -7.382 1.00 2.42 C ATOM 753 CE LYS A 46 12.029 8.182 -8.813 1.00 23.33 C ATOM 754 NZ LYS A 46 12.882 9.311 -9.281 1.00 72.03 N ATOM 0 H LYS A 46 11.266 9.051 -3.768 1.00 62.25 H new ATOM 0 HA LYS A 46 11.275 11.348 -5.381 1.00 5.33 H new ATOM 0 HB2 LYS A 46 10.160 8.555 -5.929 1.00 33.35 H new ATOM 0 HB3 LYS A 46 10.453 9.771 -7.157 1.00 33.35 H new ATOM 0 HG2 LYS A 46 12.892 9.721 -6.648 1.00 71.20 H new ATOM 0 HG3 LYS A 46 12.615 8.542 -5.380 1.00 71.20 H new ATOM 0 HD2 LYS A 46 13.414 7.373 -7.369 1.00 2.42 H new ATOM 0 HD3 LYS A 46 11.745 6.918 -7.087 1.00 2.42 H new ATOM 0 HE2 LYS A 46 12.143 7.336 -9.490 1.00 23.33 H new ATOM 0 HE3 LYS A 46 10.981 8.480 -8.849 1.00 23.33 H new ATOM 0 HZ1 LYS A 46 12.728 9.464 -10.298 1.00 72.03 H new ATOM 0 HZ2 LYS A 46 12.632 10.175 -8.759 1.00 72.03 H new ATOM 0 HZ3 LYS A 46 13.883 9.083 -9.113 1.00 72.03 H new ATOM 768 N ALA A 47 8.288 10.276 -4.435 1.00 10.40 N ATOM 769 CA ALA A 47 6.869 10.618 -4.309 1.00 51.22 C ATOM 770 C ALA A 47 6.666 11.889 -3.472 1.00 33.45 C ATOM 771 O ALA A 47 5.902 12.773 -3.865 1.00 35.01 O ATOM 772 CB ALA A 47 6.084 9.438 -3.723 1.00 33.23 C ATOM 0 H ALA A 47 8.551 9.425 -3.939 1.00 10.40 H new ATOM 0 HA ALA A 47 6.484 10.826 -5.307 1.00 51.22 H new ATOM 0 HB1 ALA A 47 5.032 9.708 -3.636 1.00 33.23 H new ATOM 0 HB2 ALA A 47 6.183 8.573 -4.379 1.00 33.23 H new ATOM 0 HB3 ALA A 47 6.478 9.192 -2.737 1.00 33.23 H new ATOM 778 N ARG A 48 7.397 11.990 -2.347 1.00 31.34 N ATOM 779 CA ARG A 48 7.231 13.094 -1.384 1.00 73.54 C ATOM 780 C ARG A 48 7.687 14.439 -1.972 1.00 21.32 C ATOM 781 O ARG A 48 6.955 15.435 -1.901 1.00 44.35 O ATOM 782 CB ARG A 48 8.015 12.798 -0.078 1.00 43.22 C ATOM 783 CG ARG A 48 7.874 13.902 0.998 1.00 20.44 C ATOM 784 CD ARG A 48 8.647 13.607 2.293 1.00 50.31 C ATOM 785 NE ARG A 48 8.502 14.703 3.269 1.00 23.13 N ATOM 786 CZ ARG A 48 9.260 14.895 4.363 1.00 33.14 C ATOM 787 NH1 ARG A 48 10.255 14.052 4.676 1.00 42.50 N ATOM 788 NH2 ARG A 48 9.003 15.946 5.138 1.00 40.31 N ATOM 0 H ARG A 48 8.114 11.315 -2.081 1.00 31.34 H new ATOM 0 HA ARG A 48 6.167 13.169 -1.158 1.00 73.54 H new ATOM 0 HB2 ARG A 48 7.667 11.852 0.337 1.00 43.22 H new ATOM 0 HB3 ARG A 48 9.070 12.671 -0.319 1.00 43.22 H new ATOM 0 HG2 ARG A 48 8.225 14.847 0.584 1.00 20.44 H new ATOM 0 HG3 ARG A 48 6.818 14.031 1.237 1.00 20.44 H new ATOM 0 HD2 ARG A 48 8.284 12.677 2.731 1.00 50.31 H new ATOM 0 HD3 ARG A 48 9.702 13.460 2.063 1.00 50.31 H new ATOM 0 HE ARG A 48 7.757 15.379 3.098 1.00 23.13 H new ATOM 0 HH11 ARG A 48 10.448 13.247 4.080 1.00 42.50 H new ATOM 0 HH12 ARG A 48 10.818 14.215 5.510 1.00 42.50 H new ATOM 0 HH21 ARG A 48 8.245 16.584 4.897 1.00 40.31 H new ATOM 0 HH22 ARG A 48 9.564 16.113 5.973 1.00 40.31 H new ATOM 802 N LYS A 49 8.890 14.442 -2.572 1.00 53.24 N ATOM 803 CA LYS A 49 9.528 15.674 -3.088 1.00 21.42 C ATOM 804 C LYS A 49 8.779 16.247 -4.308 1.00 1.33 C ATOM 805 O LYS A 49 8.852 17.448 -4.582 1.00 21.40 O ATOM 806 CB LYS A 49 11.012 15.403 -3.442 1.00 1.42 C ATOM 807 CG LYS A 49 11.244 14.422 -4.616 1.00 43.35 C ATOM 808 CD LYS A 49 12.744 14.111 -4.853 1.00 42.54 C ATOM 809 CE LYS A 49 13.579 15.369 -5.161 1.00 73.23 C ATOM 810 NZ LYS A 49 15.019 15.049 -5.404 1.00 64.30 N ATOM 0 H LYS A 49 9.447 13.599 -2.714 1.00 53.24 H new ATOM 0 HA LYS A 49 9.480 16.423 -2.297 1.00 21.42 H new ATOM 0 HB2 LYS A 49 11.490 16.352 -3.684 1.00 1.42 H new ATOM 0 HB3 LYS A 49 11.513 15.010 -2.557 1.00 1.42 H new ATOM 0 HG2 LYS A 49 10.712 13.492 -4.416 1.00 43.35 H new ATOM 0 HG3 LYS A 49 10.817 14.844 -5.526 1.00 43.35 H new ATOM 0 HD2 LYS A 49 13.151 13.619 -3.970 1.00 42.54 H new ATOM 0 HD3 LYS A 49 12.837 13.408 -5.681 1.00 42.54 H new ATOM 0 HE2 LYS A 49 13.168 15.870 -6.037 1.00 73.23 H new ATOM 0 HE3 LYS A 49 13.500 16.068 -4.328 1.00 73.23 H new ATOM 0 HZ1 LYS A 49 15.540 15.926 -5.607 1.00 64.30 H new ATOM 0 HZ2 LYS A 49 15.421 14.595 -4.559 1.00 64.30 H new ATOM 0 HZ3 LYS A 49 15.099 14.403 -6.215 1.00 64.30 H new ATOM 824 N GLN A 50 8.079 15.367 -5.039 1.00 52.35 N ATOM 825 CA GLN A 50 7.233 15.759 -6.181 1.00 4.42 C ATOM 826 C GLN A 50 5.782 15.986 -5.734 1.00 50.14 C ATOM 827 O GLN A 50 4.977 16.549 -6.485 1.00 14.00 O ATOM 828 CB GLN A 50 7.311 14.682 -7.295 1.00 20.31 C ATOM 829 CG GLN A 50 8.728 14.505 -7.876 1.00 2.50 C ATOM 830 CD GLN A 50 8.807 13.505 -9.030 1.00 35.33 C ATOM 831 OE1 GLN A 50 8.644 13.868 -10.196 1.00 15.12 O ATOM 832 NE2 GLN A 50 9.050 12.242 -8.720 1.00 12.30 N ATOM 0 H GLN A 50 8.082 14.363 -4.857 1.00 52.35 H new ATOM 0 HA GLN A 50 7.605 16.701 -6.584 1.00 4.42 H new ATOM 0 HB2 GLN A 50 6.969 13.728 -6.893 1.00 20.31 H new ATOM 0 HB3 GLN A 50 6.627 14.952 -8.100 1.00 20.31 H new ATOM 0 HG2 GLN A 50 9.091 15.473 -8.222 1.00 2.50 H new ATOM 0 HG3 GLN A 50 9.398 14.179 -7.080 1.00 2.50 H new ATOM 0 HE21 GLN A 50 9.181 11.972 -7.745 1.00 12.30 H new ATOM 0 HE22 GLN A 50 9.107 11.538 -9.456 1.00 12.30 H new ATOM 841 N GLY A 51 5.465 15.539 -4.498 1.00 41.22 N ATOM 842 CA GLY A 51 4.119 15.657 -3.929 1.00 73.23 C ATOM 843 C GLY A 51 3.123 14.650 -4.500 1.00 34.34 C ATOM 844 O GLY A 51 1.923 14.736 -4.219 1.00 62.31 O ATOM 0 H GLY A 51 6.137 15.090 -3.876 1.00 41.22 H new ATOM 0 HA2 GLY A 51 4.178 15.525 -2.849 1.00 73.23 H new ATOM 0 HA3 GLY A 51 3.746 16.665 -4.107 1.00 73.23 H new ATOM 848 N ARG A 52 3.624 13.686 -5.295 1.00 52.13 N ATOM 849 CA ARG A 52 2.785 12.688 -5.973 1.00 74.25 C ATOM 850 C ARG A 52 2.508 11.499 -5.020 1.00 1.13 C ATOM 851 O ARG A 52 3.284 11.252 -4.085 1.00 73.33 O ATOM 852 CB ARG A 52 3.466 12.193 -7.289 1.00 34.11 C ATOM 853 CG ARG A 52 4.706 11.294 -7.100 1.00 73.33 C ATOM 854 CD ARG A 52 5.280 10.764 -8.429 1.00 73.13 C ATOM 855 NE ARG A 52 5.845 11.842 -9.269 1.00 3.51 N ATOM 856 CZ ARG A 52 5.364 12.239 -10.460 1.00 23.03 C ATOM 857 NH1 ARG A 52 4.281 11.665 -10.983 1.00 21.21 N ATOM 858 NH2 ARG A 52 5.971 13.219 -11.120 1.00 44.35 N ATOM 0 H ARG A 52 4.621 13.580 -5.483 1.00 52.13 H new ATOM 0 HA ARG A 52 1.836 13.153 -6.242 1.00 74.25 H new ATOM 0 HB2 ARG A 52 2.728 11.645 -7.875 1.00 34.11 H new ATOM 0 HB3 ARG A 52 3.757 13.064 -7.876 1.00 34.11 H new ATOM 0 HG2 ARG A 52 5.479 11.857 -6.577 1.00 73.33 H new ATOM 0 HG3 ARG A 52 4.441 10.450 -6.464 1.00 73.33 H new ATOM 0 HD2 ARG A 52 6.055 10.027 -8.219 1.00 73.13 H new ATOM 0 HD3 ARG A 52 4.494 10.250 -8.982 1.00 73.13 H new ATOM 0 HE ARG A 52 6.670 12.326 -8.914 1.00 3.51 H new ATOM 0 HH11 ARG A 52 3.807 10.916 -10.479 1.00 21.21 H new ATOM 0 HH12 ARG A 52 3.926 11.975 -11.887 1.00 21.21 H new ATOM 0 HH21 ARG A 52 6.797 13.666 -10.723 1.00 44.35 H new ATOM 0 HH22 ARG A 52 5.611 13.525 -12.024 1.00 44.35 H new ATOM 872 N PRO A 53 1.364 10.787 -5.196 1.00 15.25 N ATOM 873 CA PRO A 53 1.122 9.504 -4.516 1.00 35.35 C ATOM 874 C PRO A 53 1.884 8.346 -5.195 1.00 60.44 C ATOM 875 O PRO A 53 2.252 8.430 -6.378 1.00 13.03 O ATOM 876 CB PRO A 53 -0.423 9.322 -4.614 1.00 34.34 C ATOM 877 CG PRO A 53 -0.943 10.609 -5.207 1.00 23.10 C ATOM 878 CD PRO A 53 0.192 11.186 -6.002 1.00 10.35 C ATOM 0 HA PRO A 53 1.478 9.499 -3.486 1.00 35.35 H new ATOM 0 HB2 PRO A 53 -0.679 8.469 -5.242 1.00 34.34 H new ATOM 0 HB3 PRO A 53 -0.860 9.137 -3.632 1.00 34.34 H new ATOM 0 HG2 PRO A 53 -1.810 10.424 -5.842 1.00 23.10 H new ATOM 0 HG3 PRO A 53 -1.262 11.298 -4.425 1.00 23.10 H new ATOM 0 HD2 PRO A 53 0.233 10.777 -7.012 1.00 10.35 H new ATOM 0 HD3 PRO A 53 0.113 12.269 -6.100 1.00 10.35 H new ATOM 886 N ILE A 54 2.098 7.261 -4.438 1.00 34.24 N ATOM 887 CA ILE A 54 2.762 6.049 -4.933 1.00 40.02 C ATOM 888 C ILE A 54 2.113 4.818 -4.280 1.00 11.52 C ATOM 889 O ILE A 54 1.708 4.873 -3.119 1.00 11.43 O ATOM 890 CB ILE A 54 4.318 6.080 -4.665 1.00 41.22 C ATOM 891 CG1 ILE A 54 5.026 4.882 -5.371 1.00 10.10 C ATOM 892 CG2 ILE A 54 4.642 6.104 -3.148 1.00 71.42 C ATOM 893 CD1 ILE A 54 6.542 4.934 -5.334 1.00 40.42 C ATOM 0 H ILE A 54 1.814 7.200 -3.460 1.00 34.24 H new ATOM 0 HA ILE A 54 2.633 5.997 -6.014 1.00 40.02 H new ATOM 0 HB ILE A 54 4.705 7.005 -5.091 1.00 41.22 H new ATOM 0 HG12 ILE A 54 4.696 3.955 -4.903 1.00 10.10 H new ATOM 0 HG13 ILE A 54 4.702 4.847 -6.411 1.00 10.10 H new ATOM 0 HG21 ILE A 54 5.723 6.125 -3.007 1.00 71.42 H new ATOM 0 HG22 ILE A 54 4.200 6.992 -2.695 1.00 71.42 H new ATOM 0 HG23 ILE A 54 4.232 5.212 -2.674 1.00 71.42 H new ATOM 0 HD11 ILE A 54 6.949 4.063 -5.848 1.00 40.42 H new ATOM 0 HD12 ILE A 54 6.887 5.841 -5.830 1.00 40.42 H new ATOM 0 HD13 ILE A 54 6.881 4.935 -4.298 1.00 40.42 H new ATOM 905 N VAL A 55 1.976 3.726 -5.048 1.00 45.21 N ATOM 906 CA VAL A 55 1.387 2.467 -4.568 1.00 23.51 C ATOM 907 C VAL A 55 2.392 1.329 -4.807 1.00 60.34 C ATOM 908 O VAL A 55 2.778 1.076 -5.949 1.00 51.24 O ATOM 909 CB VAL A 55 0.017 2.157 -5.289 1.00 2.31 C ATOM 910 CG1 VAL A 55 -0.670 0.918 -4.677 1.00 31.22 C ATOM 911 CG2 VAL A 55 -0.933 3.379 -5.254 1.00 11.44 C ATOM 0 H VAL A 55 2.272 3.692 -6.023 1.00 45.21 H new ATOM 0 HA VAL A 55 1.175 2.558 -3.503 1.00 23.51 H new ATOM 0 HB VAL A 55 0.245 1.939 -6.332 1.00 2.31 H new ATOM 0 HG11 VAL A 55 -1.611 0.731 -5.195 1.00 31.22 H new ATOM 0 HG12 VAL A 55 -0.018 0.051 -4.783 1.00 31.22 H new ATOM 0 HG13 VAL A 55 -0.867 1.096 -3.620 1.00 31.22 H new ATOM 0 HG21 VAL A 55 -1.866 3.129 -5.759 1.00 11.44 H new ATOM 0 HG22 VAL A 55 -1.142 3.648 -4.219 1.00 11.44 H new ATOM 0 HG23 VAL A 55 -0.461 4.221 -5.759 1.00 11.44 H new ATOM 921 N ILE A 56 2.818 0.662 -3.723 1.00 61.33 N ATOM 922 CA ILE A 56 3.850 -0.390 -3.765 1.00 43.11 C ATOM 923 C ILE A 56 3.188 -1.770 -3.601 1.00 12.23 C ATOM 924 O ILE A 56 2.485 -2.008 -2.620 1.00 14.43 O ATOM 925 CB ILE A 56 4.917 -0.166 -2.630 1.00 65.22 C ATOM 926 CG1 ILE A 56 5.568 1.250 -2.739 1.00 45.13 C ATOM 927 CG2 ILE A 56 6.008 -1.267 -2.637 1.00 52.44 C ATOM 928 CD1 ILE A 56 6.456 1.465 -3.959 1.00 71.04 C ATOM 0 H ILE A 56 2.455 0.837 -2.786 1.00 61.33 H new ATOM 0 HA ILE A 56 4.358 -0.344 -4.728 1.00 43.11 H new ATOM 0 HB ILE A 56 4.388 -0.230 -1.679 1.00 65.22 H new ATOM 0 HG12 ILE A 56 4.774 1.997 -2.751 1.00 45.13 H new ATOM 0 HG13 ILE A 56 6.161 1.430 -1.842 1.00 45.13 H new ATOM 0 HG21 ILE A 56 6.724 -1.075 -1.838 1.00 52.44 H new ATOM 0 HG22 ILE A 56 5.543 -2.241 -2.481 1.00 52.44 H new ATOM 0 HG23 ILE A 56 6.525 -1.261 -3.597 1.00 52.44 H new ATOM 0 HD11 ILE A 56 6.859 2.478 -3.942 1.00 71.04 H new ATOM 0 HD12 ILE A 56 7.276 0.748 -3.943 1.00 71.04 H new ATOM 0 HD13 ILE A 56 5.868 1.324 -4.866 1.00 71.04 H new ATOM 940 N PHE A 57 3.430 -2.666 -4.564 1.00 64.45 N ATOM 941 CA PHE A 57 2.847 -4.014 -4.599 1.00 63.11 C ATOM 942 C PHE A 57 3.928 -5.035 -4.239 1.00 34.33 C ATOM 943 O PHE A 57 4.862 -5.253 -5.020 1.00 12.31 O ATOM 944 CB PHE A 57 2.271 -4.309 -6.011 1.00 22.32 C ATOM 945 CG PHE A 57 1.201 -3.316 -6.461 1.00 71.04 C ATOM 946 CD1 PHE A 57 -0.145 -3.538 -6.174 1.00 14.15 C ATOM 947 CD2 PHE A 57 1.545 -2.150 -7.152 1.00 42.14 C ATOM 948 CE1 PHE A 57 -1.106 -2.626 -6.557 1.00 54.51 C ATOM 949 CE2 PHE A 57 0.579 -1.245 -7.536 1.00 24.54 C ATOM 950 CZ PHE A 57 -0.747 -1.484 -7.240 1.00 51.04 C ATOM 0 H PHE A 57 4.046 -2.473 -5.354 1.00 64.45 H new ATOM 0 HA PHE A 57 2.033 -4.081 -3.877 1.00 63.11 H new ATOM 0 HB2 PHE A 57 3.086 -4.302 -6.734 1.00 22.32 H new ATOM 0 HB3 PHE A 57 1.847 -5.313 -6.018 1.00 22.32 H new ATOM 0 HD1 PHE A 57 -0.438 -4.433 -5.646 1.00 14.15 H new ATOM 0 HD2 PHE A 57 2.581 -1.956 -7.388 1.00 42.14 H new ATOM 0 HE1 PHE A 57 -2.144 -2.807 -6.321 1.00 54.51 H new ATOM 0 HE2 PHE A 57 0.860 -0.349 -8.069 1.00 24.54 H new ATOM 0 HZ PHE A 57 -1.504 -0.776 -7.544 1.00 51.04 H new ATOM 960 N ILE A 58 3.823 -5.630 -3.043 1.00 33.11 N ATOM 961 CA ILE A 58 4.764 -6.662 -2.578 1.00 63.21 C ATOM 962 C ILE A 58 4.011 -7.976 -2.332 1.00 14.24 C ATOM 963 O ILE A 58 2.979 -7.993 -1.638 1.00 75.41 O ATOM 964 CB ILE A 58 5.537 -6.240 -1.269 1.00 75.34 C ATOM 965 CG1 ILE A 58 6.164 -4.819 -1.433 1.00 20.23 C ATOM 966 CG2 ILE A 58 6.632 -7.286 -0.915 1.00 61.52 C ATOM 967 CD1 ILE A 58 6.972 -4.331 -0.247 1.00 14.15 C ATOM 0 H ILE A 58 3.087 -5.412 -2.372 1.00 33.11 H new ATOM 0 HA ILE A 58 5.509 -6.793 -3.363 1.00 63.21 H new ATOM 0 HB ILE A 58 4.822 -6.205 -0.447 1.00 75.34 H new ATOM 0 HG12 ILE A 58 6.806 -4.822 -2.314 1.00 20.23 H new ATOM 0 HG13 ILE A 58 5.363 -4.105 -1.625 1.00 20.23 H new ATOM 0 HG21 ILE A 58 7.153 -6.975 -0.009 1.00 61.52 H new ATOM 0 HG22 ILE A 58 6.167 -8.258 -0.751 1.00 61.52 H new ATOM 0 HG23 ILE A 58 7.345 -7.359 -1.736 1.00 61.52 H new ATOM 0 HD11 ILE A 58 7.365 -3.336 -0.459 1.00 14.15 H new ATOM 0 HD12 ILE A 58 6.334 -4.289 0.636 1.00 14.15 H new ATOM 0 HD13 ILE A 58 7.800 -5.016 -0.064 1.00 14.15 H new ATOM 979 N ARG A 59 4.532 -9.068 -2.922 1.00 2.23 N ATOM 980 CA ARG A 59 4.009 -10.415 -2.708 1.00 40.14 C ATOM 981 C ARG A 59 4.353 -10.881 -1.289 1.00 44.23 C ATOM 982 O ARG A 59 5.525 -11.160 -0.992 1.00 4.11 O ATOM 983 CB ARG A 59 4.588 -11.387 -3.769 1.00 12.52 C ATOM 984 CG ARG A 59 4.195 -12.866 -3.564 1.00 24.43 C ATOM 985 CD ARG A 59 4.874 -13.798 -4.572 1.00 13.14 C ATOM 986 NE ARG A 59 6.342 -13.688 -4.545 1.00 42.22 N ATOM 987 CZ ARG A 59 7.187 -14.332 -5.365 1.00 40.55 C ATOM 988 NH1 ARG A 59 6.741 -15.156 -6.319 1.00 33.44 N ATOM 989 NH2 ARG A 59 8.486 -14.128 -5.232 1.00 25.13 N ATOM 0 H ARG A 59 5.328 -9.033 -3.559 1.00 2.23 H new ATOM 0 HA ARG A 59 2.924 -10.405 -2.816 1.00 40.14 H new ATOM 0 HB2 ARG A 59 4.253 -11.069 -4.756 1.00 12.52 H new ATOM 0 HB3 ARG A 59 5.675 -11.308 -3.761 1.00 12.52 H new ATOM 0 HG2 ARG A 59 4.462 -13.173 -2.553 1.00 24.43 H new ATOM 0 HG3 ARG A 59 3.113 -12.967 -3.652 1.00 24.43 H new ATOM 0 HD2 ARG A 59 4.587 -14.828 -4.360 1.00 13.14 H new ATOM 0 HD3 ARG A 59 4.514 -13.567 -5.575 1.00 13.14 H new ATOM 0 HE ARG A 59 6.751 -13.070 -3.844 1.00 42.22 H new ATOM 0 HH11 ARG A 59 5.739 -15.306 -6.436 1.00 33.44 H new ATOM 0 HH12 ARG A 59 7.403 -15.634 -6.930 1.00 33.44 H new ATOM 0 HH21 ARG A 59 8.831 -13.490 -4.515 1.00 25.13 H new ATOM 0 HH22 ARG A 59 9.143 -14.609 -5.846 1.00 25.13 H new ATOM 1003 N GLY A 60 3.319 -10.915 -0.425 1.00 71.15 N ATOM 1004 CA GLY A 60 3.433 -11.416 0.941 1.00 33.01 C ATOM 1005 C GLY A 60 4.551 -10.772 1.754 1.00 65.40 C ATOM 1006 O GLY A 60 5.439 -11.473 2.259 1.00 64.14 O ATOM 0 H GLY A 60 2.382 -10.592 -0.665 1.00 71.15 H new ATOM 0 HA2 GLY A 60 2.486 -11.254 1.455 1.00 33.01 H new ATOM 0 HA3 GLY A 60 3.598 -12.493 0.908 1.00 33.01 H new ATOM 1010 N ALA A 61 4.546 -9.431 1.819 1.00 31.32 N ATOM 1011 CA ALA A 61 5.446 -8.685 2.705 1.00 65.34 C ATOM 1012 C ALA A 61 5.161 -9.057 4.168 1.00 22.12 C ATOM 1013 O ALA A 61 4.066 -8.785 4.677 1.00 51.11 O ATOM 1014 CB ALA A 61 5.286 -7.174 2.495 1.00 60.05 C ATOM 0 H ALA A 61 3.925 -8.842 1.265 1.00 31.32 H new ATOM 0 HA ALA A 61 6.475 -8.952 2.464 1.00 65.34 H new ATOM 0 HB1 ALA A 61 5.963 -6.640 3.162 1.00 60.05 H new ATOM 0 HB2 ALA A 61 5.523 -6.923 1.461 1.00 60.05 H new ATOM 0 HB3 ALA A 61 4.258 -6.883 2.712 1.00 60.05 H new ATOM 1020 N THR A 62 6.130 -9.724 4.810 1.00 64.13 N ATOM 1021 CA THR A 62 6.042 -10.103 6.230 1.00 34.24 C ATOM 1022 C THR A 62 6.147 -8.851 7.128 1.00 71.41 C ATOM 1023 O THR A 62 6.536 -7.777 6.651 1.00 61.43 O ATOM 1024 CB THR A 62 7.145 -11.147 6.604 1.00 50.03 C ATOM 1025 OG1 THR A 62 7.015 -11.550 7.976 1.00 74.00 O ATOM 1026 CG2 THR A 62 8.563 -10.605 6.359 1.00 74.12 C ATOM 0 H THR A 62 6.998 -10.017 4.361 1.00 64.13 H new ATOM 0 HA THR A 62 5.071 -10.570 6.398 1.00 34.24 H new ATOM 0 HB THR A 62 6.998 -12.010 5.954 1.00 50.03 H new ATOM 0 HG1 THR A 62 7.712 -12.204 8.192 1.00 74.00 H new ATOM 0 HG21 THR A 62 9.295 -11.365 6.633 1.00 74.12 H new ATOM 0 HG22 THR A 62 8.679 -10.353 5.305 1.00 74.12 H new ATOM 0 HG23 THR A 62 8.721 -9.713 6.965 1.00 74.12 H new ATOM 1034 N GLU A 63 5.831 -9.020 8.426 1.00 75.00 N ATOM 1035 CA GLU A 63 5.737 -7.920 9.408 1.00 24.13 C ATOM 1036 C GLU A 63 7.036 -7.087 9.460 1.00 62.23 C ATOM 1037 O GLU A 63 6.979 -5.871 9.599 1.00 51.51 O ATOM 1038 CB GLU A 63 5.352 -8.519 10.804 1.00 41.12 C ATOM 1039 CG GLU A 63 5.006 -7.501 11.934 1.00 32.44 C ATOM 1040 CD GLU A 63 6.241 -6.961 12.684 1.00 43.21 C ATOM 1041 OE1 GLU A 63 6.915 -7.764 13.363 1.00 44.22 O ATOM 1042 OE2 GLU A 63 6.552 -5.756 12.582 1.00 10.34 O ATOM 0 H GLU A 63 5.631 -9.936 8.828 1.00 75.00 H new ATOM 0 HA GLU A 63 4.956 -7.225 9.100 1.00 24.13 H new ATOM 0 HB2 GLU A 63 4.495 -9.178 10.666 1.00 41.12 H new ATOM 0 HB3 GLU A 63 6.180 -9.140 11.147 1.00 41.12 H new ATOM 0 HG2 GLU A 63 4.460 -6.663 11.501 1.00 32.44 H new ATOM 0 HG3 GLU A 63 4.338 -7.980 12.650 1.00 32.44 H new ATOM 1049 N GLU A 64 8.199 -7.750 9.293 1.00 50.50 N ATOM 1050 CA GLU A 64 9.509 -7.073 9.377 1.00 65.23 C ATOM 1051 C GLU A 64 9.833 -6.250 8.100 1.00 3.10 C ATOM 1052 O GLU A 64 10.701 -5.373 8.132 1.00 14.52 O ATOM 1053 CB GLU A 64 10.625 -8.080 9.777 1.00 60.43 C ATOM 1054 CG GLU A 64 11.048 -9.122 8.712 1.00 73.13 C ATOM 1055 CD GLU A 64 12.146 -8.616 7.756 1.00 42.15 C ATOM 1056 OE1 GLU A 64 13.278 -8.374 8.224 1.00 52.32 O ATOM 1057 OE2 GLU A 64 11.889 -8.448 6.551 1.00 72.04 O ATOM 0 H GLU A 64 8.257 -8.750 9.100 1.00 50.50 H new ATOM 0 HA GLU A 64 9.459 -6.333 10.176 1.00 65.23 H new ATOM 0 HB2 GLU A 64 11.509 -7.510 10.063 1.00 60.43 H new ATOM 0 HB3 GLU A 64 10.293 -8.619 10.664 1.00 60.43 H new ATOM 0 HG2 GLU A 64 11.403 -10.021 9.216 1.00 73.13 H new ATOM 0 HG3 GLU A 64 10.173 -9.408 8.128 1.00 73.13 H new ATOM 1064 N VAL A 65 9.159 -6.553 6.972 1.00 5.14 N ATOM 1065 CA VAL A 65 9.200 -5.695 5.762 1.00 31.44 C ATOM 1066 C VAL A 65 8.260 -4.484 5.940 1.00 62.21 C ATOM 1067 O VAL A 65 8.656 -3.322 5.727 1.00 52.45 O ATOM 1068 CB VAL A 65 8.796 -6.489 4.451 1.00 33.30 C ATOM 1069 CG1 VAL A 65 8.753 -5.573 3.201 1.00 11.42 C ATOM 1070 CG2 VAL A 65 9.740 -7.688 4.204 1.00 24.54 C ATOM 0 H VAL A 65 8.578 -7.385 6.870 1.00 5.14 H new ATOM 0 HA VAL A 65 10.229 -5.355 5.642 1.00 31.44 H new ATOM 0 HB VAL A 65 7.788 -6.869 4.618 1.00 33.30 H new ATOM 0 HG11 VAL A 65 8.472 -6.162 2.328 1.00 11.42 H new ATOM 0 HG12 VAL A 65 8.021 -4.781 3.356 1.00 11.42 H new ATOM 0 HG13 VAL A 65 9.736 -5.132 3.039 1.00 11.42 H new ATOM 0 HG21 VAL A 65 9.435 -8.211 3.297 1.00 24.54 H new ATOM 0 HG22 VAL A 65 10.762 -7.328 4.089 1.00 24.54 H new ATOM 0 HG23 VAL A 65 9.689 -8.372 5.051 1.00 24.54 H new ATOM 1080 N VAL A 66 7.014 -4.777 6.365 1.00 42.20 N ATOM 1081 CA VAL A 66 5.934 -3.781 6.440 1.00 51.23 C ATOM 1082 C VAL A 66 6.243 -2.707 7.502 1.00 35.12 C ATOM 1083 O VAL A 66 6.019 -1.520 7.249 1.00 42.25 O ATOM 1084 CB VAL A 66 4.548 -4.457 6.737 1.00 3.11 C ATOM 1085 CG1 VAL A 66 3.406 -3.415 6.731 1.00 41.32 C ATOM 1086 CG2 VAL A 66 4.249 -5.595 5.737 1.00 54.04 C ATOM 0 H VAL A 66 6.732 -5.710 6.665 1.00 42.20 H new ATOM 0 HA VAL A 66 5.873 -3.297 5.465 1.00 51.23 H new ATOM 0 HB VAL A 66 4.607 -4.893 7.734 1.00 3.11 H new ATOM 0 HG11 VAL A 66 2.459 -3.912 6.939 1.00 41.32 H new ATOM 0 HG12 VAL A 66 3.597 -2.662 7.496 1.00 41.32 H new ATOM 0 HG13 VAL A 66 3.356 -2.935 5.754 1.00 41.32 H new ATOM 0 HG21 VAL A 66 3.282 -6.041 5.972 1.00 54.04 H new ATOM 0 HG22 VAL A 66 4.227 -5.193 4.724 1.00 54.04 H new ATOM 0 HG23 VAL A 66 5.026 -6.356 5.808 1.00 54.04 H new ATOM 1096 N ARG A 67 6.799 -3.138 8.667 1.00 4.42 N ATOM 1097 CA ARG A 67 7.183 -2.225 9.770 1.00 32.05 C ATOM 1098 C ARG A 67 8.103 -1.106 9.240 1.00 14.44 C ATOM 1099 O ARG A 67 7.901 0.060 9.538 1.00 55.25 O ATOM 1100 CB ARG A 67 7.919 -2.984 10.936 1.00 54.21 C ATOM 1101 CG ARG A 67 9.311 -3.555 10.558 1.00 3.11 C ATOM 1102 CD ARG A 67 10.145 -4.047 11.750 1.00 64.42 C ATOM 1103 NE ARG A 67 9.620 -5.279 12.376 1.00 64.04 N ATOM 1104 CZ ARG A 67 10.365 -6.174 13.062 1.00 10.32 C ATOM 1105 NH1 ARG A 67 11.684 -5.996 13.227 1.00 22.41 N ATOM 1106 NH2 ARG A 67 9.785 -7.259 13.566 1.00 44.12 N ATOM 0 H ARG A 67 6.991 -4.120 8.863 1.00 4.42 H new ATOM 0 HA ARG A 67 6.262 -1.799 10.167 1.00 32.05 H new ATOM 0 HB2 ARG A 67 8.037 -2.302 11.778 1.00 54.21 H new ATOM 0 HB3 ARG A 67 7.285 -3.803 11.276 1.00 54.21 H new ATOM 0 HG2 ARG A 67 9.173 -4.382 9.862 1.00 3.11 H new ATOM 0 HG3 ARG A 67 9.874 -2.785 10.031 1.00 3.11 H new ATOM 0 HD2 ARG A 67 11.167 -4.227 11.417 1.00 64.42 H new ATOM 0 HD3 ARG A 67 10.188 -3.259 12.501 1.00 64.42 H new ATOM 0 HE ARG A 67 8.622 -5.468 12.283 1.00 64.04 H new ATOM 0 HH11 ARG A 67 12.141 -5.174 12.832 1.00 22.41 H new ATOM 0 HH12 ARG A 67 12.230 -6.682 13.748 1.00 22.41 H new ATOM 0 HH21 ARG A 67 8.785 -7.411 13.434 1.00 44.12 H new ATOM 0 HH22 ARG A 67 10.340 -7.939 14.085 1.00 44.12 H new ATOM 1120 N ASP A 68 9.038 -1.523 8.365 1.00 64.45 N ATOM 1121 CA ASP A 68 10.161 -0.726 7.875 1.00 14.40 C ATOM 1122 C ASP A 68 9.695 0.352 6.898 1.00 34.23 C ATOM 1123 O ASP A 68 10.055 1.526 7.026 1.00 42.43 O ATOM 1124 CB ASP A 68 11.175 -1.687 7.202 1.00 2.44 C ATOM 1125 CG ASP A 68 12.331 -0.957 6.501 1.00 2.25 C ATOM 1126 OD1 ASP A 68 12.341 -0.882 5.252 1.00 31.44 O ATOM 1127 OD2 ASP A 68 13.235 -0.456 7.205 1.00 72.21 O ATOM 0 H ASP A 68 9.024 -2.463 7.969 1.00 64.45 H new ATOM 0 HA ASP A 68 10.635 -0.207 8.709 1.00 14.40 H new ATOM 0 HB2 ASP A 68 11.583 -2.359 7.956 1.00 2.44 H new ATOM 0 HB3 ASP A 68 10.650 -2.306 6.474 1.00 2.44 H new ATOM 1132 N ILE A 69 8.894 -0.078 5.921 1.00 24.40 N ATOM 1133 CA ILE A 69 8.358 0.799 4.878 1.00 32.43 C ATOM 1134 C ILE A 69 7.364 1.820 5.458 1.00 22.14 C ATOM 1135 O ILE A 69 7.444 3.024 5.160 1.00 52.54 O ATOM 1136 CB ILE A 69 7.661 -0.054 3.770 1.00 51.01 C ATOM 1137 CG1 ILE A 69 8.677 -1.044 3.122 1.00 33.42 C ATOM 1138 CG2 ILE A 69 7.002 0.849 2.708 1.00 42.34 C ATOM 1139 CD1 ILE A 69 8.069 -1.977 2.100 1.00 14.54 C ATOM 0 H ILE A 69 8.597 -1.050 5.831 1.00 24.40 H new ATOM 0 HA ILE A 69 9.191 1.351 4.442 1.00 32.43 H new ATOM 0 HB ILE A 69 6.870 -0.641 4.237 1.00 51.01 H new ATOM 0 HG12 ILE A 69 9.472 -0.471 2.646 1.00 33.42 H new ATOM 0 HG13 ILE A 69 9.140 -1.638 3.910 1.00 33.42 H new ATOM 0 HG21 ILE A 69 6.524 0.229 1.949 1.00 42.34 H new ATOM 0 HG22 ILE A 69 6.253 1.483 3.183 1.00 42.34 H new ATOM 0 HG23 ILE A 69 7.762 1.475 2.240 1.00 42.34 H new ATOM 0 HD11 ILE A 69 8.843 -2.631 1.699 1.00 14.54 H new ATOM 0 HD12 ILE A 69 7.294 -2.580 2.573 1.00 14.54 H new ATOM 0 HD13 ILE A 69 7.631 -1.394 1.290 1.00 14.54 H new ATOM 1151 N VAL A 70 6.445 1.322 6.294 1.00 31.41 N ATOM 1152 CA VAL A 70 5.372 2.134 6.868 1.00 72.31 C ATOM 1153 C VAL A 70 5.936 3.187 7.840 1.00 62.54 C ATOM 1154 O VAL A 70 5.585 4.364 7.725 1.00 50.42 O ATOM 1155 CB VAL A 70 4.290 1.234 7.566 1.00 14.24 C ATOM 1156 CG1 VAL A 70 3.263 2.075 8.345 1.00 31.32 C ATOM 1157 CG2 VAL A 70 3.578 0.333 6.526 1.00 3.35 C ATOM 0 H VAL A 70 6.427 0.346 6.590 1.00 31.41 H new ATOM 0 HA VAL A 70 4.881 2.665 6.052 1.00 72.31 H new ATOM 0 HB VAL A 70 4.807 0.599 8.285 1.00 14.24 H new ATOM 0 HG11 VAL A 70 2.532 1.415 8.813 1.00 31.32 H new ATOM 0 HG12 VAL A 70 3.775 2.653 9.114 1.00 31.32 H new ATOM 0 HG13 VAL A 70 2.754 2.753 7.660 1.00 31.32 H new ATOM 0 HG21 VAL A 70 2.832 -0.283 7.028 1.00 3.35 H new ATOM 0 HG22 VAL A 70 3.089 0.957 5.778 1.00 3.35 H new ATOM 0 HG23 VAL A 70 4.311 -0.310 6.039 1.00 3.35 H new ATOM 1167 N GLU A 71 6.854 2.763 8.750 1.00 63.31 N ATOM 1168 CA GLU A 71 7.468 3.681 9.739 1.00 44.33 C ATOM 1169 C GLU A 71 8.225 4.799 9.024 1.00 22.23 C ATOM 1170 O GLU A 71 8.163 5.945 9.437 1.00 64.50 O ATOM 1171 CB GLU A 71 8.422 2.946 10.727 1.00 21.12 C ATOM 1172 CG GLU A 71 9.769 2.470 10.131 1.00 15.54 C ATOM 1173 CD GLU A 71 10.656 1.704 11.124 1.00 42.55 C ATOM 1174 OE1 GLU A 71 10.491 0.470 11.263 1.00 40.14 O ATOM 1175 OE2 GLU A 71 11.524 2.330 11.770 1.00 72.32 O ATOM 0 H GLU A 71 7.181 1.799 8.816 1.00 63.31 H new ATOM 0 HA GLU A 71 6.653 4.103 10.327 1.00 44.33 H new ATOM 0 HB2 GLU A 71 8.631 3.612 11.564 1.00 21.12 H new ATOM 0 HB3 GLU A 71 7.899 2.080 11.132 1.00 21.12 H new ATOM 0 HG2 GLU A 71 9.568 1.831 9.271 1.00 15.54 H new ATOM 0 HG3 GLU A 71 10.318 3.337 9.763 1.00 15.54 H new ATOM 1182 N TYR A 72 8.896 4.430 7.911 1.00 52.14 N ATOM 1183 CA TYR A 72 9.690 5.344 7.098 1.00 51.41 C ATOM 1184 C TYR A 72 8.790 6.417 6.471 1.00 2.24 C ATOM 1185 O TYR A 72 9.100 7.602 6.528 1.00 45.34 O ATOM 1186 CB TYR A 72 10.435 4.545 6.003 1.00 74.44 C ATOM 1187 CG TYR A 72 11.351 5.395 5.117 1.00 42.35 C ATOM 1188 CD1 TYR A 72 12.640 5.733 5.537 1.00 51.45 C ATOM 1189 CD2 TYR A 72 10.927 5.872 3.869 1.00 72.41 C ATOM 1190 CE1 TYR A 72 13.463 6.506 4.748 1.00 43.01 C ATOM 1191 CE2 TYR A 72 11.750 6.646 3.084 1.00 52.34 C ATOM 1192 CZ TYR A 72 13.019 6.956 3.529 1.00 34.03 C ATOM 1193 OH TYR A 72 13.855 7.716 2.749 1.00 71.21 O ATOM 0 H TYR A 72 8.894 3.473 7.557 1.00 52.14 H new ATOM 0 HA TYR A 72 10.423 5.845 7.729 1.00 51.41 H new ATOM 0 HB2 TYR A 72 11.030 3.766 6.479 1.00 74.44 H new ATOM 0 HB3 TYR A 72 9.701 4.044 5.372 1.00 74.44 H new ATOM 0 HD1 TYR A 72 12.996 5.383 6.495 1.00 51.45 H new ATOM 0 HD2 TYR A 72 9.936 5.627 3.517 1.00 72.41 H new ATOM 0 HE1 TYR A 72 14.457 6.758 5.088 1.00 43.01 H new ATOM 0 HE2 TYR A 72 11.406 7.008 2.127 1.00 52.34 H new ATOM 0 HH TYR A 72 14.006 7.263 1.893 1.00 71.21 H new ATOM 1203 N ALA A 73 7.659 5.976 5.898 1.00 72.11 N ATOM 1204 CA ALA A 73 6.689 6.868 5.248 1.00 51.23 C ATOM 1205 C ALA A 73 5.961 7.761 6.277 1.00 61.01 C ATOM 1206 O ALA A 73 5.527 8.861 5.941 1.00 63.21 O ATOM 1207 CB ALA A 73 5.704 6.044 4.411 1.00 43.20 C ATOM 0 H ALA A 73 7.392 4.992 5.873 1.00 72.11 H new ATOM 0 HA ALA A 73 7.228 7.540 4.580 1.00 51.23 H new ATOM 0 HB1 ALA A 73 4.987 6.711 3.932 1.00 43.20 H new ATOM 0 HB2 ALA A 73 6.250 5.489 3.648 1.00 43.20 H new ATOM 0 HB3 ALA A 73 5.173 5.345 5.057 1.00 43.20 H new ATOM 1213 N GLN A 74 5.852 7.281 7.536 1.00 43.53 N ATOM 1214 CA GLN A 74 5.314 8.088 8.654 1.00 13.02 C ATOM 1215 C GLN A 74 6.377 9.087 9.164 1.00 24.31 C ATOM 1216 O GLN A 74 6.030 10.164 9.659 1.00 31.32 O ATOM 1217 CB GLN A 74 4.838 7.187 9.819 1.00 65.22 C ATOM 1218 CG GLN A 74 3.696 6.219 9.473 1.00 65.42 C ATOM 1219 CD GLN A 74 3.229 5.406 10.681 1.00 45.01 C ATOM 1220 OE1 GLN A 74 3.781 4.351 10.989 1.00 63.11 O ATOM 1221 NE2 GLN A 74 2.210 5.891 11.381 1.00 51.32 N ATOM 0 H GLN A 74 6.130 6.337 7.804 1.00 43.53 H new ATOM 0 HA GLN A 74 4.455 8.643 8.276 1.00 13.02 H new ATOM 0 HB2 GLN A 74 5.688 6.607 10.179 1.00 65.22 H new ATOM 0 HB3 GLN A 74 4.515 7.825 10.642 1.00 65.22 H new ATOM 0 HG2 GLN A 74 2.854 6.784 9.072 1.00 65.42 H new ATOM 0 HG3 GLN A 74 4.026 5.539 8.688 1.00 65.42 H new ATOM 0 HE21 GLN A 74 1.771 6.769 11.102 1.00 51.32 H new ATOM 0 HE22 GLN A 74 1.866 5.386 12.198 1.00 51.32 H new ATOM 1230 N LYS A 75 7.672 8.714 9.033 1.00 34.51 N ATOM 1231 CA LYS A 75 8.809 9.619 9.329 1.00 31.42 C ATOM 1232 C LYS A 75 8.849 10.752 8.293 1.00 22.35 C ATOM 1233 O LYS A 75 9.275 11.867 8.599 1.00 51.43 O ATOM 1234 CB LYS A 75 10.170 8.856 9.339 1.00 24.14 C ATOM 1235 CG LYS A 75 10.352 7.866 10.517 1.00 60.41 C ATOM 1236 CD LYS A 75 11.739 7.175 10.521 1.00 25.32 C ATOM 1237 CE LYS A 75 12.904 8.166 10.700 1.00 4.24 C ATOM 1238 NZ LYS A 75 12.771 8.979 11.945 1.00 13.35 N ATOM 0 H LYS A 75 7.957 7.785 8.722 1.00 34.51 H new ATOM 0 HA LYS A 75 8.658 10.034 10.325 1.00 31.42 H new ATOM 0 HB2 LYS A 75 10.269 8.307 8.403 1.00 24.14 H new ATOM 0 HB3 LYS A 75 10.979 9.586 9.368 1.00 24.14 H new ATOM 0 HG2 LYS A 75 10.216 8.400 11.457 1.00 60.41 H new ATOM 0 HG3 LYS A 75 9.573 7.105 10.468 1.00 60.41 H new ATOM 0 HD2 LYS A 75 11.769 6.438 11.324 1.00 25.32 H new ATOM 0 HD3 LYS A 75 11.871 6.632 9.585 1.00 25.32 H new ATOM 0 HE2 LYS A 75 13.845 7.616 10.727 1.00 4.24 H new ATOM 0 HE3 LYS A 75 12.948 8.831 9.838 1.00 4.24 H new ATOM 0 HZ1 LYS A 75 13.633 9.545 12.084 1.00 13.35 H new ATOM 0 HZ2 LYS A 75 11.951 9.613 11.860 1.00 13.35 H new ATOM 0 HZ3 LYS A 75 12.637 8.347 12.760 1.00 13.35 H new ATOM 1252 N GLU A 76 8.390 10.443 7.064 1.00 12.31 N ATOM 1253 CA GLU A 76 8.235 11.433 5.988 1.00 31.20 C ATOM 1254 C GLU A 76 6.941 12.258 6.165 1.00 30.41 C ATOM 1255 O GLU A 76 6.734 13.236 5.448 1.00 60.05 O ATOM 1256 CB GLU A 76 8.242 10.730 4.601 1.00 62.32 C ATOM 1257 CG GLU A 76 9.479 9.849 4.304 1.00 4.24 C ATOM 1258 CD GLU A 76 10.821 10.537 4.613 1.00 51.30 C ATOM 1259 OE1 GLU A 76 11.281 11.367 3.798 1.00 54.25 O ATOM 1260 OE2 GLU A 76 11.422 10.259 5.677 1.00 33.14 O ATOM 0 H GLU A 76 8.117 9.498 6.793 1.00 12.31 H new ATOM 0 HA GLU A 76 9.080 12.120 6.041 1.00 31.20 H new ATOM 0 HB2 GLU A 76 7.349 10.109 4.524 1.00 62.32 H new ATOM 0 HB3 GLU A 76 8.168 11.493 3.826 1.00 62.32 H new ATOM 0 HG2 GLU A 76 9.409 8.932 4.888 1.00 4.24 H new ATOM 0 HG3 GLU A 76 9.463 9.560 3.253 1.00 4.24 H new ATOM 1267 N GLY A 77 6.076 11.835 7.111 1.00 73.41 N ATOM 1268 CA GLY A 77 4.826 12.543 7.427 1.00 33.04 C ATOM 1269 C GLY A 77 3.731 12.345 6.381 1.00 14.31 C ATOM 1270 O GLY A 77 2.811 13.164 6.271 1.00 61.10 O ATOM 0 H GLY A 77 6.227 10.997 7.672 1.00 73.41 H new ATOM 0 HA2 GLY A 77 4.459 12.201 8.395 1.00 33.04 H new ATOM 0 HA3 GLY A 77 5.036 13.608 7.524 1.00 33.04 H new ATOM 1274 N LEU A 78 3.845 11.253 5.611 1.00 35.14 N ATOM 1275 CA LEU A 78 2.921 10.927 4.508 1.00 32.32 C ATOM 1276 C LEU A 78 1.785 10.018 5.005 1.00 61.55 C ATOM 1277 O LEU A 78 1.973 9.248 5.957 1.00 41.42 O ATOM 1278 CB LEU A 78 3.704 10.242 3.348 1.00 21.21 C ATOM 1279 CG LEU A 78 4.958 11.020 2.828 1.00 62.30 C ATOM 1280 CD1 LEU A 78 5.650 10.273 1.669 1.00 35.21 C ATOM 1281 CD2 LEU A 78 4.600 12.467 2.427 1.00 51.13 C ATOM 0 H LEU A 78 4.586 10.564 5.735 1.00 35.14 H new ATOM 0 HA LEU A 78 2.477 11.850 4.136 1.00 32.32 H new ATOM 0 HB2 LEU A 78 4.024 9.255 3.682 1.00 21.21 H new ATOM 0 HB3 LEU A 78 3.021 10.090 2.512 1.00 21.21 H new ATOM 0 HG LEU A 78 5.669 11.073 3.653 1.00 62.30 H new ATOM 0 HD11 LEU A 78 6.516 10.844 1.334 1.00 35.21 H new ATOM 0 HD12 LEU A 78 5.973 9.290 2.011 1.00 35.21 H new ATOM 0 HD13 LEU A 78 4.950 10.157 0.841 1.00 35.21 H new ATOM 0 HD21 LEU A 78 5.495 12.978 2.071 1.00 51.13 H new ATOM 0 HD22 LEU A 78 3.852 12.450 1.635 1.00 51.13 H new ATOM 0 HD23 LEU A 78 4.201 12.996 3.292 1.00 51.13 H new ATOM 1293 N ARG A 79 0.605 10.132 4.363 1.00 45.13 N ATOM 1294 CA ARG A 79 -0.554 9.277 4.661 1.00 62.24 C ATOM 1295 C ARG A 79 -0.310 7.869 4.086 1.00 2.11 C ATOM 1296 O ARG A 79 -0.215 7.704 2.862 1.00 33.20 O ATOM 1297 CB ARG A 79 -1.850 9.894 4.069 1.00 72.22 C ATOM 1298 CG ARG A 79 -3.136 9.085 4.376 1.00 62.43 C ATOM 1299 CD ARG A 79 -4.392 9.657 3.695 1.00 64.35 C ATOM 1300 NE ARG A 79 -4.772 10.983 4.222 1.00 74.13 N ATOM 1301 CZ ARG A 79 -5.839 11.698 3.815 1.00 53.20 C ATOM 1302 NH1 ARG A 79 -6.642 11.216 2.867 1.00 61.12 N ATOM 1303 NH2 ARG A 79 -6.094 12.893 4.360 1.00 30.42 N ATOM 0 H ARG A 79 0.432 10.817 3.627 1.00 45.13 H new ATOM 0 HA ARG A 79 -0.680 9.204 5.741 1.00 62.24 H new ATOM 0 HB2 ARG A 79 -1.969 10.905 4.458 1.00 72.22 H new ATOM 0 HB3 ARG A 79 -1.737 9.980 2.988 1.00 72.22 H new ATOM 0 HG2 ARG A 79 -2.994 8.054 4.053 1.00 62.43 H new ATOM 0 HG3 ARG A 79 -3.294 9.063 5.454 1.00 62.43 H new ATOM 0 HD2 ARG A 79 -4.215 9.734 2.622 1.00 64.35 H new ATOM 0 HD3 ARG A 79 -5.222 8.964 3.833 1.00 64.35 H new ATOM 0 HE ARG A 79 -4.182 11.388 4.949 1.00 74.13 H new ATOM 0 HH11 ARG A 79 -6.449 10.306 2.449 1.00 61.12 H new ATOM 0 HH12 ARG A 79 -7.450 11.757 2.559 1.00 61.12 H new ATOM 0 HH21 ARG A 79 -5.480 13.264 5.085 1.00 30.42 H new ATOM 0 HH22 ARG A 79 -6.902 13.433 4.050 1.00 30.42 H new ATOM 1317 N VAL A 80 -0.171 6.870 4.977 1.00 60.22 N ATOM 1318 CA VAL A 80 0.111 5.473 4.598 1.00 41.11 C ATOM 1319 C VAL A 80 -1.189 4.637 4.627 1.00 2.32 C ATOM 1320 O VAL A 80 -1.805 4.474 5.686 1.00 41.31 O ATOM 1321 CB VAL A 80 1.193 4.817 5.541 1.00 1.42 C ATOM 1322 CG1 VAL A 80 1.682 3.459 4.977 1.00 75.31 C ATOM 1323 CG2 VAL A 80 2.379 5.777 5.787 1.00 71.23 C ATOM 0 H VAL A 80 -0.251 7.010 5.984 1.00 60.22 H new ATOM 0 HA VAL A 80 0.513 5.484 3.585 1.00 41.11 H new ATOM 0 HB VAL A 80 0.717 4.625 6.502 1.00 1.42 H new ATOM 0 HG11 VAL A 80 2.427 3.033 5.649 1.00 75.31 H new ATOM 0 HG12 VAL A 80 0.837 2.775 4.891 1.00 75.31 H new ATOM 0 HG13 VAL A 80 2.127 3.612 3.994 1.00 75.31 H new ATOM 0 HG21 VAL A 80 3.107 5.296 6.440 1.00 71.23 H new ATOM 0 HG22 VAL A 80 2.851 6.023 4.836 1.00 71.23 H new ATOM 0 HG23 VAL A 80 2.016 6.690 6.259 1.00 71.23 H new ATOM 1333 N LEU A 81 -1.610 4.141 3.453 1.00 52.33 N ATOM 1334 CA LEU A 81 -2.813 3.292 3.299 1.00 3.54 C ATOM 1335 C LEU A 81 -2.351 1.842 3.043 1.00 62.21 C ATOM 1336 O LEU A 81 -1.871 1.550 1.954 1.00 64.13 O ATOM 1337 CB LEU A 81 -3.683 3.760 2.078 1.00 1.14 C ATOM 1338 CG LEU A 81 -4.264 5.220 2.057 1.00 11.32 C ATOM 1339 CD1 LEU A 81 -5.134 5.520 3.284 1.00 74.44 C ATOM 1340 CD2 LEU A 81 -3.163 6.277 1.874 1.00 33.43 C ATOM 0 H LEU A 81 -1.124 4.317 2.573 1.00 52.33 H new ATOM 0 HA LEU A 81 -3.415 3.366 4.205 1.00 3.54 H new ATOM 0 HB2 LEU A 81 -3.079 3.636 1.179 1.00 1.14 H new ATOM 0 HB3 LEU A 81 -4.524 3.072 1.994 1.00 1.14 H new ATOM 0 HG LEU A 81 -4.915 5.278 1.185 1.00 11.32 H new ATOM 0 HD11 LEU A 81 -5.511 6.541 3.222 1.00 74.44 H new ATOM 0 HD12 LEU A 81 -5.973 4.824 3.314 1.00 74.44 H new ATOM 0 HD13 LEU A 81 -4.537 5.408 4.189 1.00 74.44 H new ATOM 0 HD21 LEU A 81 -3.611 7.271 1.865 1.00 33.43 H new ATOM 0 HD22 LEU A 81 -2.451 6.207 2.696 1.00 33.43 H new ATOM 0 HD23 LEU A 81 -2.646 6.104 0.930 1.00 33.43 H new ATOM 1352 N VAL A 82 -2.499 0.924 4.013 1.00 61.35 N ATOM 1353 CA VAL A 82 -2.016 -0.468 3.847 1.00 44.33 C ATOM 1354 C VAL A 82 -3.204 -1.419 3.631 1.00 55.12 C ATOM 1355 O VAL A 82 -4.070 -1.553 4.502 1.00 74.13 O ATOM 1356 CB VAL A 82 -1.133 -0.953 5.061 1.00 4.41 C ATOM 1357 CG1 VAL A 82 -0.530 -2.362 4.809 1.00 4.15 C ATOM 1358 CG2 VAL A 82 -0.023 0.077 5.377 1.00 21.20 C ATOM 0 H VAL A 82 -2.943 1.112 4.912 1.00 61.35 H new ATOM 0 HA VAL A 82 -1.375 -0.483 2.966 1.00 44.33 H new ATOM 0 HB VAL A 82 -1.786 -1.032 5.930 1.00 4.41 H new ATOM 0 HG11 VAL A 82 0.071 -2.659 5.668 1.00 4.15 H new ATOM 0 HG12 VAL A 82 -1.336 -3.082 4.663 1.00 4.15 H new ATOM 0 HG13 VAL A 82 0.098 -2.335 3.919 1.00 4.15 H new ATOM 0 HG21 VAL A 82 0.574 -0.278 6.217 1.00 21.20 H new ATOM 0 HG22 VAL A 82 0.617 0.201 4.504 1.00 21.20 H new ATOM 0 HG23 VAL A 82 -0.477 1.034 5.633 1.00 21.20 H new ATOM 1368 N ILE A 83 -3.247 -2.048 2.443 1.00 33.23 N ATOM 1369 CA ILE A 83 -4.272 -3.035 2.068 1.00 2.54 C ATOM 1370 C ILE A 83 -3.617 -4.419 1.998 1.00 64.14 C ATOM 1371 O ILE A 83 -2.777 -4.671 1.126 1.00 62.23 O ATOM 1372 CB ILE A 83 -4.923 -2.689 0.675 1.00 2.02 C ATOM 1373 CG1 ILE A 83 -5.477 -1.238 0.694 1.00 15.11 C ATOM 1374 CG2 ILE A 83 -6.035 -3.707 0.301 1.00 21.50 C ATOM 1375 CD1 ILE A 83 -6.043 -0.751 -0.622 1.00 71.34 C ATOM 0 H ILE A 83 -2.561 -1.882 1.707 1.00 33.23 H new ATOM 0 HA ILE A 83 -5.063 -3.021 2.818 1.00 2.54 H new ATOM 0 HB ILE A 83 -4.151 -2.758 -0.092 1.00 2.02 H new ATOM 0 HG12 ILE A 83 -6.256 -1.173 1.453 1.00 15.11 H new ATOM 0 HG13 ILE A 83 -4.677 -0.564 1.000 1.00 15.11 H new ATOM 0 HG21 ILE A 83 -6.463 -3.439 -0.665 1.00 21.50 H new ATOM 0 HG22 ILE A 83 -5.608 -4.708 0.244 1.00 21.50 H new ATOM 0 HG23 ILE A 83 -6.816 -3.689 1.061 1.00 21.50 H new ATOM 0 HD11 ILE A 83 -6.404 0.271 -0.507 1.00 71.34 H new ATOM 0 HD12 ILE A 83 -5.265 -0.777 -1.385 1.00 71.34 H new ATOM 0 HD13 ILE A 83 -6.869 -1.396 -0.924 1.00 71.34 H new ATOM 1387 N MET A 84 -3.973 -5.295 2.936 1.00 20.24 N ATOM 1388 CA MET A 84 -3.469 -6.674 2.991 1.00 15.35 C ATOM 1389 C MET A 84 -4.588 -7.630 2.552 1.00 44.33 C ATOM 1390 O MET A 84 -5.641 -7.689 3.187 1.00 13.23 O ATOM 1391 CB MET A 84 -2.962 -6.974 4.428 1.00 14.22 C ATOM 1392 CG MET A 84 -1.643 -6.264 4.789 1.00 60.11 C ATOM 1393 SD MET A 84 -1.311 -6.230 6.563 1.00 35.13 S ATOM 1394 CE MET A 84 -2.447 -4.954 7.119 1.00 3.11 C ATOM 0 H MET A 84 -4.625 -5.070 3.688 1.00 20.24 H new ATOM 0 HA MET A 84 -2.628 -6.813 2.312 1.00 15.35 H new ATOM 0 HB2 MET A 84 -3.730 -6.677 5.142 1.00 14.22 H new ATOM 0 HB3 MET A 84 -2.825 -8.050 4.536 1.00 14.22 H new ATOM 0 HG2 MET A 84 -0.818 -6.765 4.282 1.00 60.11 H new ATOM 0 HG3 MET A 84 -1.674 -5.241 4.413 1.00 60.11 H new ATOM 0 HE1 MET A 84 -2.040 -4.464 8.004 1.00 3.11 H new ATOM 0 HE2 MET A 84 -2.583 -4.218 6.327 1.00 3.11 H new ATOM 0 HE3 MET A 84 -3.409 -5.405 7.364 1.00 3.11 H new ATOM 1404 N VAL A 85 -4.364 -8.351 1.434 1.00 31.34 N ATOM 1405 CA VAL A 85 -5.369 -9.243 0.825 1.00 4.02 C ATOM 1406 C VAL A 85 -4.822 -10.675 0.728 1.00 50.50 C ATOM 1407 O VAL A 85 -3.777 -10.887 0.092 1.00 74.21 O ATOM 1408 CB VAL A 85 -5.784 -8.792 -0.627 1.00 14.22 C ATOM 1409 CG1 VAL A 85 -6.945 -9.672 -1.159 1.00 54.33 C ATOM 1410 CG2 VAL A 85 -6.136 -7.288 -0.685 1.00 63.44 C ATOM 0 H VAL A 85 -3.479 -8.330 0.928 1.00 31.34 H new ATOM 0 HA VAL A 85 -6.245 -9.196 1.472 1.00 4.02 H new ATOM 0 HB VAL A 85 -4.923 -8.936 -1.280 1.00 14.22 H new ATOM 0 HG11 VAL A 85 -7.218 -9.346 -2.163 1.00 54.33 H new ATOM 0 HG12 VAL A 85 -6.627 -10.714 -1.190 1.00 54.33 H new ATOM 0 HG13 VAL A 85 -7.807 -9.575 -0.499 1.00 54.33 H new ATOM 0 HG21 VAL A 85 -6.416 -7.019 -1.703 1.00 63.44 H new ATOM 0 HG22 VAL A 85 -6.969 -7.083 -0.013 1.00 63.44 H new ATOM 0 HG23 VAL A 85 -5.271 -6.700 -0.380 1.00 63.44 H new ATOM 1420 N ASP A 86 -5.540 -11.627 1.356 1.00 33.43 N ATOM 1421 CA ASP A 86 -5.308 -13.080 1.221 1.00 55.21 C ATOM 1422 C ASP A 86 -6.317 -13.851 2.096 1.00 60.44 C ATOM 1423 O ASP A 86 -6.967 -13.271 2.978 1.00 33.21 O ATOM 1424 CB ASP A 86 -3.845 -13.492 1.585 1.00 73.42 C ATOM 1425 CG ASP A 86 -3.499 -14.935 1.168 1.00 5.13 C ATOM 1426 OD1 ASP A 86 -3.382 -15.205 -0.049 1.00 11.20 O ATOM 1427 OD2 ASP A 86 -3.352 -15.804 2.050 1.00 54.45 O ATOM 0 H ASP A 86 -6.313 -11.404 1.984 1.00 33.43 H new ATOM 0 HA ASP A 86 -5.455 -13.338 0.172 1.00 55.21 H new ATOM 0 HB2 ASP A 86 -3.150 -12.805 1.102 1.00 73.42 H new ATOM 0 HB3 ASP A 86 -3.702 -13.387 2.660 1.00 73.42 H new ATOM 1432 N GLN A 87 -6.424 -15.157 1.826 1.00 3.24 N ATOM 1433 CA GLN A 87 -7.304 -16.093 2.539 1.00 21.01 C ATOM 1434 C GLN A 87 -6.803 -16.336 3.978 1.00 70.22 C ATOM 1435 O GLN A 87 -7.603 -16.423 4.922 1.00 63.33 O ATOM 1436 CB GLN A 87 -7.347 -17.428 1.748 1.00 14.03 C ATOM 1437 CG GLN A 87 -7.696 -17.257 0.249 1.00 1.05 C ATOM 1438 CD GLN A 87 -7.457 -18.512 -0.606 1.00 3.13 C ATOM 1439 OE1 GLN A 87 -7.589 -19.647 -0.141 1.00 11.52 O ATOM 1440 NE2 GLN A 87 -7.112 -18.315 -1.872 1.00 42.13 N ATOM 0 H GLN A 87 -5.886 -15.606 1.085 1.00 3.24 H new ATOM 0 HA GLN A 87 -8.305 -15.668 2.609 1.00 21.01 H new ATOM 0 HB2 GLN A 87 -6.378 -17.920 1.832 1.00 14.03 H new ATOM 0 HB3 GLN A 87 -8.081 -18.089 2.209 1.00 14.03 H new ATOM 0 HG2 GLN A 87 -8.743 -16.968 0.163 1.00 1.05 H new ATOM 0 HG3 GLN A 87 -7.104 -16.437 -0.158 1.00 1.05 H new ATOM 0 HE21 GLN A 87 -7.010 -17.366 -2.231 1.00 42.13 H new ATOM 0 HE22 GLN A 87 -6.949 -19.113 -2.486 1.00 42.13 H new ATOM 1449 N ASP A 88 -5.468 -16.456 4.116 1.00 73.40 N ATOM 1450 CA ASP A 88 -4.801 -16.664 5.412 1.00 1.43 C ATOM 1451 C ASP A 88 -4.724 -15.338 6.182 1.00 11.31 C ATOM 1452 O ASP A 88 -3.792 -14.549 6.007 1.00 50.10 O ATOM 1453 CB ASP A 88 -3.382 -17.271 5.226 1.00 45.10 C ATOM 1454 CG ASP A 88 -3.415 -18.691 4.643 1.00 60.45 C ATOM 1455 OD1 ASP A 88 -3.476 -18.837 3.400 1.00 71.44 O ATOM 1456 OD2 ASP A 88 -3.398 -19.675 5.420 1.00 21.25 O ATOM 0 H ASP A 88 -4.822 -16.411 3.328 1.00 73.40 H new ATOM 0 HA ASP A 88 -5.392 -17.376 5.989 1.00 1.43 H new ATOM 0 HB2 ASP A 88 -2.799 -16.626 4.568 1.00 45.10 H new ATOM 0 HB3 ASP A 88 -2.871 -17.290 6.188 1.00 45.10 H new ATOM 1461 N GLN A 89 -5.740 -15.114 7.025 1.00 22.40 N ATOM 1462 CA GLN A 89 -5.848 -13.942 7.904 1.00 43.14 C ATOM 1463 C GLN A 89 -4.773 -13.952 9.009 1.00 24.41 C ATOM 1464 O GLN A 89 -4.515 -12.922 9.599 1.00 31.14 O ATOM 1465 CB GLN A 89 -7.266 -13.912 8.544 1.00 22.40 C ATOM 1466 CG GLN A 89 -8.432 -13.781 7.538 1.00 34.15 C ATOM 1467 CD GLN A 89 -8.471 -12.453 6.770 1.00 14.30 C ATOM 1468 OE1 GLN A 89 -8.871 -12.412 5.603 1.00 1.13 O ATOM 1469 NE2 GLN A 89 -8.143 -11.347 7.433 1.00 44.01 N ATOM 0 H GLN A 89 -6.527 -15.756 7.117 1.00 22.40 H new ATOM 0 HA GLN A 89 -5.688 -13.048 7.301 1.00 43.14 H new ATOM 0 HB2 GLN A 89 -7.406 -14.824 9.124 1.00 22.40 H new ATOM 0 HB3 GLN A 89 -7.315 -13.079 9.245 1.00 22.40 H new ATOM 0 HG2 GLN A 89 -8.368 -14.598 6.820 1.00 34.15 H new ATOM 0 HG3 GLN A 89 -9.373 -13.902 8.075 1.00 34.15 H new ATOM 0 HE21 GLN A 89 -7.815 -11.409 8.397 1.00 44.01 H new ATOM 0 HE22 GLN A 89 -8.219 -10.438 6.977 1.00 44.01 H new ATOM 1478 N GLU A 90 -4.153 -15.124 9.250 1.00 0.44 N ATOM 1479 CA GLU A 90 -3.205 -15.353 10.370 1.00 71.14 C ATOM 1480 C GLU A 90 -2.087 -14.286 10.440 1.00 10.35 C ATOM 1481 O GLU A 90 -1.946 -13.574 11.440 1.00 4.05 O ATOM 1482 CB GLU A 90 -2.579 -16.769 10.240 1.00 54.32 C ATOM 1483 CG GLU A 90 -3.603 -17.911 10.054 1.00 63.22 C ATOM 1484 CD GLU A 90 -4.700 -17.942 11.138 1.00 63.21 C ATOM 1485 OE1 GLU A 90 -4.437 -18.436 12.259 1.00 33.35 O ATOM 1486 OE2 GLU A 90 -5.827 -17.469 10.878 1.00 75.43 O ATOM 0 H GLU A 90 -4.295 -15.950 8.669 1.00 0.44 H new ATOM 0 HA GLU A 90 -3.774 -15.274 11.296 1.00 71.14 H new ATOM 0 HB2 GLU A 90 -1.893 -16.772 9.393 1.00 54.32 H new ATOM 0 HB3 GLU A 90 -1.985 -16.973 11.131 1.00 54.32 H new ATOM 0 HG2 GLU A 90 -4.074 -17.810 9.076 1.00 63.22 H new ATOM 0 HG3 GLU A 90 -3.075 -18.865 10.056 1.00 63.22 H new ATOM 1493 N GLU A 91 -1.312 -14.189 9.349 1.00 52.31 N ATOM 1494 CA GLU A 91 -0.160 -13.277 9.251 1.00 14.22 C ATOM 1495 C GLU A 91 -0.603 -11.841 8.911 1.00 24.54 C ATOM 1496 O GLU A 91 0.008 -10.878 9.385 1.00 0.22 O ATOM 1497 CB GLU A 91 0.853 -13.832 8.214 1.00 54.44 C ATOM 1498 CG GLU A 91 0.255 -14.180 6.833 1.00 74.34 C ATOM 1499 CD GLU A 91 1.290 -14.779 5.869 1.00 51.53 C ATOM 1500 OE1 GLU A 91 1.900 -14.020 5.089 1.00 45.13 O ATOM 1501 OE2 GLU A 91 1.516 -16.008 5.904 1.00 71.53 O ATOM 0 H GLU A 91 -1.467 -14.743 8.506 1.00 52.31 H new ATOM 0 HA GLU A 91 0.333 -13.224 10.222 1.00 14.22 H new ATOM 0 HB2 GLU A 91 1.645 -13.097 8.074 1.00 54.44 H new ATOM 0 HB3 GLU A 91 1.318 -14.727 8.627 1.00 54.44 H new ATOM 0 HG2 GLU A 91 -0.564 -14.887 6.965 1.00 74.34 H new ATOM 0 HG3 GLU A 91 -0.170 -13.280 6.389 1.00 74.34 H new ATOM 1508 N LEU A 92 -1.688 -11.722 8.121 1.00 44.21 N ATOM 1509 CA LEU A 92 -2.263 -10.417 7.715 1.00 34.43 C ATOM 1510 C LEU A 92 -2.759 -9.613 8.936 1.00 42.24 C ATOM 1511 O LEU A 92 -2.545 -8.403 9.020 1.00 73.21 O ATOM 1512 CB LEU A 92 -3.441 -10.620 6.710 1.00 25.14 C ATOM 1513 CG LEU A 92 -3.076 -10.787 5.196 1.00 65.32 C ATOM 1514 CD1 LEU A 92 -2.108 -11.957 4.927 1.00 50.45 C ATOM 1515 CD2 LEU A 92 -4.367 -10.924 4.366 1.00 20.42 C ATOM 0 H LEU A 92 -2.193 -12.525 7.745 1.00 44.21 H new ATOM 0 HA LEU A 92 -1.468 -9.852 7.228 1.00 34.43 H new ATOM 0 HB2 LEU A 92 -4.001 -11.502 7.021 1.00 25.14 H new ATOM 0 HB3 LEU A 92 -4.113 -9.767 6.802 1.00 25.14 H new ATOM 0 HG LEU A 92 -2.539 -9.889 4.889 1.00 65.32 H new ATOM 0 HD11 LEU A 92 -1.897 -12.016 3.859 1.00 50.45 H new ATOM 0 HD12 LEU A 92 -1.178 -11.793 5.472 1.00 50.45 H new ATOM 0 HD13 LEU A 92 -2.564 -12.890 5.259 1.00 50.45 H new ATOM 0 HD21 LEU A 92 -4.112 -11.040 3.313 1.00 20.42 H new ATOM 0 HD22 LEU A 92 -4.925 -11.798 4.703 1.00 20.42 H new ATOM 0 HD23 LEU A 92 -4.979 -10.031 4.495 1.00 20.42 H new ATOM 1527 N GLU A 93 -3.418 -10.317 9.869 1.00 23.21 N ATOM 1528 CA GLU A 93 -4.050 -9.710 11.056 1.00 15.25 C ATOM 1529 C GLU A 93 -2.987 -9.345 12.094 1.00 34.44 C ATOM 1530 O GLU A 93 -3.122 -8.333 12.784 1.00 11.32 O ATOM 1531 CB GLU A 93 -5.126 -10.689 11.608 1.00 52.24 C ATOM 1532 CG GLU A 93 -6.047 -10.157 12.746 1.00 71.33 C ATOM 1533 CD GLU A 93 -5.554 -10.436 14.190 1.00 3.41 C ATOM 1534 OE1 GLU A 93 -4.957 -9.539 14.830 1.00 71.42 O ATOM 1535 OE2 GLU A 93 -5.784 -11.556 14.695 1.00 74.15 O ATOM 0 H GLU A 93 -3.529 -11.330 9.823 1.00 23.21 H new ATOM 0 HA GLU A 93 -4.551 -8.779 10.791 1.00 15.25 H new ATOM 0 HB2 GLU A 93 -5.759 -11.000 10.777 1.00 52.24 H new ATOM 0 HB3 GLU A 93 -4.617 -11.581 11.973 1.00 52.24 H new ATOM 0 HG2 GLU A 93 -6.163 -9.080 12.622 1.00 71.33 H new ATOM 0 HG3 GLU A 93 -7.036 -10.600 12.626 1.00 71.33 H new ATOM 1542 N ARG A 94 -1.914 -10.161 12.160 1.00 42.54 N ATOM 1543 CA ARG A 94 -0.742 -9.897 13.018 1.00 23.30 C ATOM 1544 C ARG A 94 -0.114 -8.520 12.679 1.00 24.41 C ATOM 1545 O ARG A 94 0.236 -7.739 13.575 1.00 2.40 O ATOM 1546 CB ARG A 94 0.299 -11.040 12.841 1.00 34.23 C ATOM 1547 CG ARG A 94 1.593 -10.891 13.688 1.00 63.21 C ATOM 1548 CD ARG A 94 1.320 -10.877 15.211 1.00 10.22 C ATOM 1549 NE ARG A 94 2.544 -10.682 16.015 1.00 32.22 N ATOM 1550 CZ ARG A 94 2.613 -10.774 17.357 1.00 1.44 C ATOM 1551 NH1 ARG A 94 1.525 -11.049 18.086 1.00 24.53 N ATOM 1552 NH2 ARG A 94 3.781 -10.586 17.966 1.00 11.33 N ATOM 0 H ARG A 94 -1.837 -11.022 11.619 1.00 42.54 H new ATOM 0 HA ARG A 94 -1.061 -9.868 14.060 1.00 23.30 H new ATOM 0 HB2 ARG A 94 -0.177 -11.987 13.097 1.00 34.23 H new ATOM 0 HB3 ARG A 94 0.577 -11.097 11.789 1.00 34.23 H new ATOM 0 HG2 ARG A 94 2.271 -11.712 13.453 1.00 63.21 H new ATOM 0 HG3 ARG A 94 2.101 -9.968 13.407 1.00 63.21 H new ATOM 0 HD2 ARG A 94 0.611 -10.082 15.440 1.00 10.22 H new ATOM 0 HD3 ARG A 94 0.849 -11.817 15.499 1.00 10.22 H new ATOM 0 HE ARG A 94 3.405 -10.460 15.514 1.00 32.22 H new ATOM 0 HH11 ARG A 94 0.626 -11.193 17.626 1.00 24.53 H new ATOM 0 HH12 ARG A 94 1.595 -11.115 19.101 1.00 24.53 H new ATOM 0 HH21 ARG A 94 4.614 -10.374 17.417 1.00 11.33 H new ATOM 0 HH22 ARG A 94 3.843 -10.654 18.982 1.00 11.33 H new ATOM 1566 N ILE A 95 0.002 -8.244 11.366 1.00 22.43 N ATOM 1567 CA ILE A 95 0.536 -6.971 10.844 1.00 2.04 C ATOM 1568 C ILE A 95 -0.488 -5.828 11.043 1.00 14.44 C ATOM 1569 O ILE A 95 -0.143 -4.743 11.506 1.00 50.45 O ATOM 1570 CB ILE A 95 0.906 -7.111 9.320 1.00 42.23 C ATOM 1571 CG1 ILE A 95 1.898 -8.291 9.095 1.00 74.34 C ATOM 1572 CG2 ILE A 95 1.496 -5.799 8.765 1.00 11.05 C ATOM 1573 CD1 ILE A 95 2.253 -8.549 7.639 1.00 63.13 C ATOM 0 H ILE A 95 -0.273 -8.900 10.635 1.00 22.43 H new ATOM 0 HA ILE A 95 1.441 -6.727 11.401 1.00 2.04 H new ATOM 0 HB ILE A 95 -0.014 -7.325 8.776 1.00 42.23 H new ATOM 0 HG12 ILE A 95 2.815 -8.089 9.649 1.00 74.34 H new ATOM 0 HG13 ILE A 95 1.465 -9.198 9.516 1.00 74.34 H new ATOM 0 HG21 ILE A 95 1.741 -5.928 7.711 1.00 11.05 H new ATOM 0 HG22 ILE A 95 0.765 -4.997 8.872 1.00 11.05 H new ATOM 0 HG23 ILE A 95 2.399 -5.543 9.319 1.00 11.05 H new ATOM 0 HD11 ILE A 95 2.948 -9.387 7.577 1.00 63.13 H new ATOM 0 HD12 ILE A 95 1.348 -8.786 7.080 1.00 63.13 H new ATOM 0 HD13 ILE A 95 2.719 -7.659 7.215 1.00 63.13 H new ATOM 1585 N TYR A 96 -1.754 -6.124 10.717 1.00 74.34 N ATOM 1586 CA TYR A 96 -2.893 -5.182 10.808 1.00 35.44 C ATOM 1587 C TYR A 96 -3.023 -4.552 12.204 1.00 34.31 C ATOM 1588 O TYR A 96 -3.212 -3.338 12.337 1.00 61.15 O ATOM 1589 CB TYR A 96 -4.179 -5.970 10.431 1.00 54.31 C ATOM 1590 CG TYR A 96 -5.525 -5.251 10.605 1.00 33.24 C ATOM 1591 CD1 TYR A 96 -5.928 -4.241 9.734 1.00 55.43 C ATOM 1592 CD2 TYR A 96 -6.404 -5.603 11.640 1.00 54.43 C ATOM 1593 CE1 TYR A 96 -7.154 -3.621 9.882 1.00 64.32 C ATOM 1594 CE2 TYR A 96 -7.626 -4.981 11.787 1.00 4.23 C ATOM 1595 CZ TYR A 96 -7.994 -3.986 10.908 1.00 12.01 C ATOM 1596 OH TYR A 96 -9.217 -3.364 11.044 1.00 64.14 O ATOM 0 H TYR A 96 -2.027 -7.045 10.374 1.00 74.34 H new ATOM 0 HA TYR A 96 -2.731 -4.350 10.122 1.00 35.44 H new ATOM 0 HB2 TYR A 96 -4.093 -6.276 9.388 1.00 54.31 H new ATOM 0 HB3 TYR A 96 -4.204 -6.881 11.030 1.00 54.31 H new ATOM 0 HD1 TYR A 96 -5.272 -3.938 8.931 1.00 55.43 H new ATOM 0 HD2 TYR A 96 -6.118 -6.377 12.336 1.00 54.43 H new ATOM 0 HE1 TYR A 96 -7.453 -2.848 9.190 1.00 64.32 H new ATOM 0 HE2 TYR A 96 -8.291 -5.272 12.587 1.00 4.23 H new ATOM 0 HH TYR A 96 -9.690 -3.737 11.817 1.00 64.14 H new ATOM 1606 N GLU A 97 -2.891 -5.398 13.227 1.00 53.21 N ATOM 1607 CA GLU A 97 -3.125 -5.018 14.627 1.00 70.14 C ATOM 1608 C GLU A 97 -1.981 -4.135 15.168 1.00 51.34 C ATOM 1609 O GLU A 97 -2.226 -3.217 15.964 1.00 52.10 O ATOM 1610 CB GLU A 97 -3.312 -6.312 15.489 1.00 24.13 C ATOM 1611 CG GLU A 97 -4.518 -6.298 16.459 1.00 10.34 C ATOM 1612 CD GLU A 97 -4.306 -5.499 17.758 1.00 71.44 C ATOM 1613 OE1 GLU A 97 -4.396 -4.256 17.742 1.00 15.40 O ATOM 1614 OE2 GLU A 97 -4.049 -6.117 18.816 1.00 22.05 O ATOM 0 H GLU A 97 -2.617 -6.373 13.110 1.00 53.21 H new ATOM 0 HA GLU A 97 -4.035 -4.421 14.687 1.00 70.14 H new ATOM 0 HB2 GLU A 97 -3.419 -7.163 14.817 1.00 24.13 H new ATOM 0 HB3 GLU A 97 -2.404 -6.476 16.069 1.00 24.13 H new ATOM 0 HG2 GLU A 97 -5.380 -5.886 15.935 1.00 10.34 H new ATOM 0 HG3 GLU A 97 -4.765 -7.327 16.721 1.00 10.34 H new ATOM 1621 N GLN A 98 -0.723 -4.417 14.744 1.00 1.34 N ATOM 1622 CA GLN A 98 0.440 -3.622 15.180 1.00 10.35 C ATOM 1623 C GLN A 98 0.464 -2.249 14.479 1.00 52.54 C ATOM 1624 O GLN A 98 0.668 -1.228 15.139 1.00 51.34 O ATOM 1625 CB GLN A 98 1.787 -4.424 15.064 1.00 71.30 C ATOM 1626 CG GLN A 98 2.223 -4.978 13.679 1.00 15.44 C ATOM 1627 CD GLN A 98 2.934 -3.997 12.734 1.00 24.14 C ATOM 1628 OE1 GLN A 98 2.892 -4.161 11.515 1.00 33.24 O ATOM 1629 NE2 GLN A 98 3.581 -2.975 13.275 1.00 73.32 N ATOM 0 H GLN A 98 -0.495 -5.181 14.108 1.00 1.34 H new ATOM 0 HA GLN A 98 0.332 -3.417 16.245 1.00 10.35 H new ATOM 0 HB2 GLN A 98 2.586 -3.777 15.425 1.00 71.30 H new ATOM 0 HB3 GLN A 98 1.726 -5.268 15.751 1.00 71.30 H new ATOM 0 HG2 GLN A 98 2.884 -5.829 13.846 1.00 15.44 H new ATOM 0 HG3 GLN A 98 1.337 -5.358 13.171 1.00 15.44 H new ATOM 0 HE21 GLN A 98 3.600 -2.862 14.289 1.00 73.32 H new ATOM 0 HE22 GLN A 98 4.060 -2.301 12.678 1.00 73.32 H new ATOM 1638 N LEU A 99 0.167 -2.235 13.158 1.00 52.20 N ATOM 1639 CA LEU A 99 0.069 -0.991 12.355 1.00 32.14 C ATOM 1640 C LEU A 99 -1.045 -0.059 12.872 1.00 75.12 C ATOM 1641 O LEU A 99 -0.911 1.170 12.825 1.00 20.32 O ATOM 1642 CB LEU A 99 -0.217 -1.313 10.869 1.00 3.34 C ATOM 1643 CG LEU A 99 0.894 -2.040 10.063 1.00 43.05 C ATOM 1644 CD1 LEU A 99 0.405 -2.341 8.630 1.00 73.54 C ATOM 1645 CD2 LEU A 99 2.198 -1.219 10.048 1.00 42.30 C ATOM 0 H LEU A 99 -0.011 -3.083 12.619 1.00 52.20 H new ATOM 0 HA LEU A 99 1.030 -0.486 12.451 1.00 32.14 H new ATOM 0 HB2 LEU A 99 -1.118 -1.925 10.825 1.00 3.34 H new ATOM 0 HB3 LEU A 99 -0.443 -0.376 10.360 1.00 3.34 H new ATOM 0 HG LEU A 99 1.112 -2.987 10.556 1.00 43.05 H new ATOM 0 HD11 LEU A 99 1.193 -2.851 8.076 1.00 73.54 H new ATOM 0 HD12 LEU A 99 -0.478 -2.978 8.673 1.00 73.54 H new ATOM 0 HD13 LEU A 99 0.154 -1.407 8.127 1.00 73.54 H new ATOM 0 HD21 LEU A 99 2.957 -1.753 9.477 1.00 42.30 H new ATOM 0 HD22 LEU A 99 2.012 -0.249 9.587 1.00 42.30 H new ATOM 0 HD23 LEU A 99 2.548 -1.074 11.070 1.00 42.30 H new ATOM 1657 N LYS A 100 -2.154 -0.666 13.335 1.00 43.31 N ATOM 1658 CA LYS A 100 -3.326 0.070 13.850 1.00 33.24 C ATOM 1659 C LYS A 100 -2.915 0.919 15.084 1.00 43.15 C ATOM 1660 O LYS A 100 -3.399 2.044 15.265 1.00 62.23 O ATOM 1661 CB LYS A 100 -4.486 -0.942 14.171 1.00 43.11 C ATOM 1662 CG LYS A 100 -5.931 -0.401 13.965 1.00 15.13 C ATOM 1663 CD LYS A 100 -6.379 0.632 15.028 1.00 41.45 C ATOM 1664 CE LYS A 100 -7.720 1.308 14.680 1.00 63.13 C ATOM 1665 NZ LYS A 100 -8.843 0.337 14.555 1.00 74.11 N ATOM 0 H LYS A 100 -2.264 -1.680 13.363 1.00 43.31 H new ATOM 0 HA LYS A 100 -3.699 0.762 13.095 1.00 33.24 H new ATOM 0 HB2 LYS A 100 -4.356 -1.825 13.546 1.00 43.11 H new ATOM 0 HB3 LYS A 100 -4.384 -1.267 15.206 1.00 43.11 H new ATOM 0 HG2 LYS A 100 -5.998 0.057 12.978 1.00 15.13 H new ATOM 0 HG3 LYS A 100 -6.626 -1.240 13.975 1.00 15.13 H new ATOM 0 HD2 LYS A 100 -6.468 0.136 15.994 1.00 41.45 H new ATOM 0 HD3 LYS A 100 -5.609 1.396 15.132 1.00 41.45 H new ATOM 0 HE2 LYS A 100 -7.963 2.040 15.450 1.00 63.13 H new ATOM 0 HE3 LYS A 100 -7.613 1.855 13.743 1.00 63.13 H new ATOM 0 HZ1 LYS A 100 -9.718 0.847 14.320 1.00 74.11 H new ATOM 0 HZ2 LYS A 100 -8.628 -0.347 13.802 1.00 74.11 H new ATOM 0 HZ3 LYS A 100 -8.967 -0.168 15.456 1.00 74.11 H new ATOM 1679 N LYS A 101 -1.990 0.372 15.903 1.00 63.43 N ATOM 1680 CA LYS A 101 -1.433 1.072 17.084 1.00 25.15 C ATOM 1681 C LYS A 101 -0.568 2.281 16.666 1.00 24.44 C ATOM 1682 O LYS A 101 -0.593 3.327 17.322 1.00 73.34 O ATOM 1683 CB LYS A 101 -0.606 0.093 17.960 1.00 11.50 C ATOM 1684 CG LYS A 101 -1.421 -1.108 18.487 1.00 55.31 C ATOM 1685 CD LYS A 101 -0.631 -1.988 19.478 1.00 52.23 C ATOM 1686 CE LYS A 101 -1.421 -3.224 19.934 1.00 25.41 C ATOM 1687 NZ LYS A 101 -1.694 -4.161 18.808 1.00 21.04 N ATOM 0 H LYS A 101 -1.609 -0.564 15.766 1.00 63.43 H new ATOM 0 HA LYS A 101 -2.271 1.446 17.672 1.00 25.15 H new ATOM 0 HB2 LYS A 101 0.237 -0.279 17.377 1.00 11.50 H new ATOM 0 HB3 LYS A 101 -0.191 0.639 18.807 1.00 11.50 H new ATOM 0 HG2 LYS A 101 -2.323 -0.741 18.976 1.00 55.31 H new ATOM 0 HG3 LYS A 101 -1.742 -1.719 17.644 1.00 55.31 H new ATOM 0 HD2 LYS A 101 0.300 -2.309 19.010 1.00 52.23 H new ATOM 0 HD3 LYS A 101 -0.361 -1.393 20.350 1.00 52.23 H new ATOM 0 HE2 LYS A 101 -0.862 -3.745 20.711 1.00 25.41 H new ATOM 0 HE3 LYS A 101 -2.365 -2.907 20.378 1.00 25.41 H new ATOM 0 HZ1 LYS A 101 -1.796 -5.128 19.178 1.00 21.04 H new ATOM 0 HZ2 LYS A 101 -2.572 -3.880 18.328 1.00 21.04 H new ATOM 0 HZ3 LYS A 101 -0.905 -4.130 18.132 1.00 21.04 H new ATOM 1701 N ASP A 102 0.175 2.122 15.552 1.00 41.32 N ATOM 1702 CA ASP A 102 1.022 3.193 14.960 1.00 1.20 C ATOM 1703 C ASP A 102 0.181 4.349 14.366 1.00 64.44 C ATOM 1704 O ASP A 102 0.740 5.385 13.981 1.00 70.44 O ATOM 1705 CB ASP A 102 1.951 2.599 13.862 1.00 11.42 C ATOM 1706 CG ASP A 102 3.066 1.707 14.418 1.00 71.13 C ATOM 1707 OD1 ASP A 102 4.233 2.151 14.487 1.00 63.31 O ATOM 1708 OD2 ASP A 102 2.783 0.560 14.801 1.00 74.02 O ATOM 0 H ASP A 102 0.209 1.246 15.031 1.00 41.32 H new ATOM 0 HA ASP A 102 1.624 3.607 15.768 1.00 1.20 H new ATOM 0 HB2 ASP A 102 1.348 2.019 13.163 1.00 11.42 H new ATOM 0 HB3 ASP A 102 2.399 3.416 13.296 1.00 11.42 H new ATOM 1713 N GLY A 103 -1.154 4.154 14.277 1.00 41.11 N ATOM 1714 CA GLY A 103 -2.070 5.176 13.754 1.00 31.03 C ATOM 1715 C GLY A 103 -2.141 5.172 12.241 1.00 31.23 C ATOM 1716 O GLY A 103 -2.562 6.158 11.628 1.00 41.22 O ATOM 0 H GLY A 103 -1.617 3.291 14.564 1.00 41.11 H new ATOM 0 HA2 GLY A 103 -3.067 5.009 14.162 1.00 31.03 H new ATOM 0 HA3 GLY A 103 -1.746 6.159 14.097 1.00 31.03 H new ATOM 1720 N VAL A 104 -1.712 4.055 11.637 1.00 10.33 N ATOM 1721 CA VAL A 104 -1.689 3.879 10.180 1.00 41.43 C ATOM 1722 C VAL A 104 -3.084 3.483 9.698 1.00 71.24 C ATOM 1723 O VAL A 104 -3.731 2.647 10.343 1.00 63.51 O ATOM 1724 CB VAL A 104 -0.667 2.763 9.762 1.00 13.01 C ATOM 1725 CG1 VAL A 104 -0.450 2.733 8.232 1.00 51.42 C ATOM 1726 CG2 VAL A 104 0.660 2.929 10.513 1.00 3.22 C ATOM 0 H VAL A 104 -1.369 3.243 12.150 1.00 10.33 H new ATOM 0 HA VAL A 104 -1.382 4.820 9.725 1.00 41.43 H new ATOM 0 HB VAL A 104 -1.094 1.800 10.044 1.00 13.01 H new ATOM 0 HG11 VAL A 104 0.263 1.948 7.981 1.00 51.42 H new ATOM 0 HG12 VAL A 104 -1.399 2.534 7.734 1.00 51.42 H new ATOM 0 HG13 VAL A 104 -0.061 3.696 7.901 1.00 51.42 H new ATOM 0 HG21 VAL A 104 1.352 2.144 10.207 1.00 3.22 H new ATOM 0 HG22 VAL A 104 1.090 3.903 10.281 1.00 3.22 H new ATOM 0 HG23 VAL A 104 0.482 2.857 11.586 1.00 3.22 H new ATOM 1736 N ASP A 105 -3.540 4.066 8.574 1.00 42.33 N ATOM 1737 CA ASP A 105 -4.826 3.687 7.980 1.00 14.23 C ATOM 1738 C ASP A 105 -4.637 2.331 7.293 1.00 40.10 C ATOM 1739 O ASP A 105 -3.995 2.239 6.244 1.00 62.44 O ATOM 1740 CB ASP A 105 -5.314 4.754 6.976 1.00 73.12 C ATOM 1741 CG ASP A 105 -6.750 4.494 6.481 1.00 41.42 C ATOM 1742 OD1 ASP A 105 -7.705 5.006 7.110 1.00 73.22 O ATOM 1743 OD2 ASP A 105 -6.937 3.784 5.467 1.00 3.52 O ATOM 0 H ASP A 105 -3.039 4.795 8.066 1.00 42.33 H new ATOM 0 HA ASP A 105 -5.590 3.615 8.754 1.00 14.23 H new ATOM 0 HB2 ASP A 105 -5.269 5.736 7.446 1.00 73.12 H new ATOM 0 HB3 ASP A 105 -4.638 4.778 6.121 1.00 73.12 H new ATOM 1748 N VAL A 106 -5.156 1.279 7.930 1.00 41.53 N ATOM 1749 CA VAL A 106 -4.946 -0.105 7.497 1.00 51.44 C ATOM 1750 C VAL A 106 -6.260 -0.864 7.430 1.00 55.03 C ATOM 1751 O VAL A 106 -7.201 -0.580 8.183 1.00 61.42 O ATOM 1752 CB VAL A 106 -3.945 -0.855 8.458 1.00 44.15 C ATOM 1753 CG1 VAL A 106 -2.552 -0.216 8.401 1.00 21.52 C ATOM 1754 CG2 VAL A 106 -4.457 -0.899 9.923 1.00 1.24 C ATOM 0 H VAL A 106 -5.736 1.363 8.765 1.00 41.53 H new ATOM 0 HA VAL A 106 -4.512 -0.069 6.498 1.00 51.44 H new ATOM 0 HB VAL A 106 -3.878 -1.884 8.104 1.00 44.15 H new ATOM 0 HG11 VAL A 106 -1.879 -0.750 9.072 1.00 21.52 H new ATOM 0 HG12 VAL A 106 -2.168 -0.271 7.382 1.00 21.52 H new ATOM 0 HG13 VAL A 106 -2.618 0.828 8.708 1.00 21.52 H new ATOM 0 HG21 VAL A 106 -3.734 -1.425 10.546 1.00 1.24 H new ATOM 0 HG22 VAL A 106 -4.584 0.118 10.295 1.00 1.24 H new ATOM 0 HG23 VAL A 106 -5.414 -1.420 9.959 1.00 1.24 H new ATOM 1764 N ARG A 107 -6.309 -1.837 6.517 1.00 64.12 N ATOM 1765 CA ARG A 107 -7.415 -2.771 6.409 1.00 31.10 C ATOM 1766 C ARG A 107 -6.925 -4.088 5.809 1.00 60.24 C ATOM 1767 O ARG A 107 -5.980 -4.118 5.005 1.00 64.43 O ATOM 1768 CB ARG A 107 -8.588 -2.188 5.576 1.00 31.22 C ATOM 1769 CG ARG A 107 -8.345 -2.024 4.046 1.00 21.31 C ATOM 1770 CD ARG A 107 -9.655 -1.684 3.309 1.00 45.34 C ATOM 1771 NE ARG A 107 -10.734 -2.625 3.689 1.00 51.30 N ATOM 1772 CZ ARG A 107 -12.047 -2.370 3.620 1.00 33.32 C ATOM 1773 NH1 ARG A 107 -12.490 -1.210 3.167 1.00 70.31 N ATOM 1774 NH2 ARG A 107 -12.916 -3.271 4.038 1.00 2.01 N ATOM 0 H ARG A 107 -5.572 -1.994 5.829 1.00 64.12 H new ATOM 0 HA ARG A 107 -7.799 -2.955 7.412 1.00 31.10 H new ATOM 0 HB2 ARG A 107 -9.457 -2.831 5.716 1.00 31.22 H new ATOM 0 HB3 ARG A 107 -8.845 -1.211 5.987 1.00 31.22 H new ATOM 0 HG2 ARG A 107 -7.612 -1.236 3.874 1.00 21.31 H new ATOM 0 HG3 ARG A 107 -7.925 -2.944 3.641 1.00 21.31 H new ATOM 0 HD2 ARG A 107 -9.956 -0.664 3.546 1.00 45.34 H new ATOM 0 HD3 ARG A 107 -9.493 -1.726 2.232 1.00 45.34 H new ATOM 0 HE ARG A 107 -10.454 -3.544 4.032 1.00 51.30 H new ATOM 0 HH11 ARG A 107 -11.829 -0.495 2.864 1.00 70.31 H new ATOM 0 HH12 ARG A 107 -13.493 -1.030 3.120 1.00 70.31 H new ATOM 0 HH21 ARG A 107 -12.587 -4.161 4.413 1.00 2.01 H new ATOM 0 HH22 ARG A 107 -13.916 -3.078 3.986 1.00 2.01 H new ATOM 1788 N VAL A 108 -7.564 -5.182 6.224 1.00 22.45 N ATOM 1789 CA VAL A 108 -7.377 -6.504 5.626 1.00 54.11 C ATOM 1790 C VAL A 108 -8.677 -6.908 4.934 1.00 2.12 C ATOM 1791 O VAL A 108 -9.761 -6.466 5.342 1.00 24.25 O ATOM 1792 CB VAL A 108 -6.963 -7.592 6.694 1.00 15.14 C ATOM 1793 CG1 VAL A 108 -5.532 -7.342 7.211 1.00 60.32 C ATOM 1794 CG2 VAL A 108 -7.964 -7.650 7.876 1.00 54.20 C ATOM 0 H VAL A 108 -8.234 -5.175 6.993 1.00 22.45 H new ATOM 0 HA VAL A 108 -6.560 -6.447 4.906 1.00 54.11 H new ATOM 0 HB VAL A 108 -6.987 -8.559 6.192 1.00 15.14 H new ATOM 0 HG11 VAL A 108 -5.272 -8.105 7.945 1.00 60.32 H new ATOM 0 HG12 VAL A 108 -4.831 -7.386 6.377 1.00 60.32 H new ATOM 0 HG13 VAL A 108 -5.480 -6.358 7.677 1.00 60.32 H new ATOM 0 HG21 VAL A 108 -7.643 -8.411 8.588 1.00 54.20 H new ATOM 0 HG22 VAL A 108 -7.998 -6.680 8.372 1.00 54.20 H new ATOM 0 HG23 VAL A 108 -8.956 -7.900 7.501 1.00 54.20 H new ATOM 1804 N THR A 109 -8.580 -7.708 3.868 1.00 71.33 N ATOM 1805 CA THR A 109 -9.756 -8.291 3.221 1.00 53.31 C ATOM 1806 C THR A 109 -9.419 -9.666 2.649 1.00 72.53 C ATOM 1807 O THR A 109 -8.248 -10.025 2.455 1.00 4.43 O ATOM 1808 CB THR A 109 -10.364 -7.374 2.081 1.00 41.52 C ATOM 1809 OG1 THR A 109 -11.708 -7.798 1.761 1.00 1.33 O ATOM 1810 CG2 THR A 109 -9.525 -7.388 0.790 1.00 32.12 C ATOM 0 H THR A 109 -7.694 -7.967 3.434 1.00 71.33 H new ATOM 0 HA THR A 109 -10.517 -8.382 3.996 1.00 53.31 H new ATOM 0 HB THR A 109 -10.362 -6.357 2.474 1.00 41.52 H new ATOM 0 HG1 THR A 109 -12.232 -7.026 1.462 1.00 1.33 H new ATOM 0 HG21 THR A 109 -9.991 -6.742 0.046 1.00 32.12 H new ATOM 0 HG22 THR A 109 -8.520 -7.027 1.006 1.00 32.12 H new ATOM 0 HG23 THR A 109 -9.470 -8.406 0.403 1.00 32.12 H new ATOM 1818 N ASP A 110 -10.479 -10.411 2.399 1.00 14.15 N ATOM 1819 CA ASP A 110 -10.463 -11.643 1.636 1.00 11.43 C ATOM 1820 C ASP A 110 -11.388 -11.456 0.426 1.00 51.10 C ATOM 1821 O ASP A 110 -12.319 -10.638 0.481 1.00 75.23 O ATOM 1822 CB ASP A 110 -10.915 -12.830 2.531 1.00 11.52 C ATOM 1823 CG ASP A 110 -11.191 -14.130 1.750 1.00 32.54 C ATOM 1824 OD1 ASP A 110 -12.358 -14.592 1.728 1.00 41.31 O ATOM 1825 OD2 ASP A 110 -10.244 -14.696 1.155 1.00 45.35 O ATOM 0 H ASP A 110 -11.410 -10.165 2.735 1.00 14.15 H new ATOM 0 HA ASP A 110 -9.457 -11.874 1.287 1.00 11.43 H new ATOM 0 HB2 ASP A 110 -10.145 -13.023 3.278 1.00 11.52 H new ATOM 0 HB3 ASP A 110 -11.818 -12.543 3.070 1.00 11.52 H new ATOM 1830 N ASN A 111 -11.063 -12.194 -0.639 1.00 34.13 N ATOM 1831 CA ASN A 111 -11.803 -12.299 -1.924 1.00 64.44 C ATOM 1832 C ASN A 111 -11.171 -11.384 -2.976 1.00 15.41 C ATOM 1833 O ASN A 111 -10.802 -10.237 -2.685 1.00 22.21 O ATOM 1834 CB ASN A 111 -13.357 -12.055 -1.860 1.00 45.25 C ATOM 1835 CG ASN A 111 -14.129 -13.140 -1.111 1.00 1.22 C ATOM 1836 OD1 ASN A 111 -14.527 -14.154 -1.697 1.00 1.15 O ATOM 1837 ND2 ASN A 111 -14.386 -12.926 0.172 1.00 32.23 N ATOM 0 H ASN A 111 -10.225 -12.775 -0.639 1.00 34.13 H new ATOM 0 HA ASN A 111 -11.706 -13.349 -2.202 1.00 64.44 H new ATOM 0 HB2 ASN A 111 -13.544 -11.094 -1.380 1.00 45.25 H new ATOM 0 HB3 ASN A 111 -13.745 -11.984 -2.876 1.00 45.25 H new ATOM 0 HD21 ASN A 111 -14.926 -13.608 0.705 1.00 32.23 H new ATOM 0 HD22 ASN A 111 -14.043 -12.079 0.626 1.00 32.23 H new ATOM 1844 N GLU A 112 -11.082 -11.938 -4.194 1.00 3.11 N ATOM 1845 CA GLU A 112 -10.514 -11.290 -5.388 1.00 43.52 C ATOM 1846 C GLU A 112 -11.251 -9.984 -5.725 1.00 14.54 C ATOM 1847 O GLU A 112 -10.621 -8.955 -5.992 1.00 41.03 O ATOM 1848 CB GLU A 112 -10.610 -12.305 -6.557 1.00 73.11 C ATOM 1849 CG GLU A 112 -10.063 -11.833 -7.914 1.00 4.42 C ATOM 1850 CD GLU A 112 -10.222 -12.902 -9.011 1.00 74.22 C ATOM 1851 OE1 GLU A 112 -11.343 -13.039 -9.563 1.00 41.41 O ATOM 1852 OE2 GLU A 112 -9.242 -13.618 -9.319 1.00 55.23 O ATOM 0 H GLU A 112 -11.415 -12.883 -4.383 1.00 3.11 H new ATOM 0 HA GLU A 112 -9.475 -11.016 -5.206 1.00 43.52 H new ATOM 0 HB2 GLU A 112 -10.076 -13.211 -6.269 1.00 73.11 H new ATOM 0 HB3 GLU A 112 -11.657 -12.580 -6.687 1.00 73.11 H new ATOM 0 HG2 GLU A 112 -10.583 -10.924 -8.217 1.00 4.42 H new ATOM 0 HG3 GLU A 112 -9.009 -11.577 -7.809 1.00 4.42 H new ATOM 1859 N ASP A 113 -12.589 -10.044 -5.668 1.00 30.31 N ATOM 1860 CA ASP A 113 -13.461 -8.898 -5.957 1.00 2.54 C ATOM 1861 C ASP A 113 -13.287 -7.796 -4.903 1.00 43.40 C ATOM 1862 O ASP A 113 -12.978 -6.653 -5.250 1.00 74.22 O ATOM 1863 CB ASP A 113 -14.943 -9.343 -6.015 1.00 70.50 C ATOM 1864 CG ASP A 113 -15.233 -10.319 -7.166 1.00 62.14 C ATOM 1865 OD1 ASP A 113 -14.910 -11.524 -7.038 1.00 24.22 O ATOM 1866 OD2 ASP A 113 -15.768 -9.888 -8.213 1.00 32.11 O ATOM 0 H ASP A 113 -13.098 -10.892 -5.419 1.00 30.31 H new ATOM 0 HA ASP A 113 -13.174 -8.496 -6.929 1.00 2.54 H new ATOM 0 HB2 ASP A 113 -15.212 -9.815 -5.070 1.00 70.50 H new ATOM 0 HB3 ASP A 113 -15.577 -8.463 -6.124 1.00 70.50 H new ATOM 1871 N GLU A 114 -13.430 -8.175 -3.608 1.00 21.22 N ATOM 1872 CA GLU A 114 -13.394 -7.219 -2.476 1.00 33.35 C ATOM 1873 C GLU A 114 -12.085 -6.415 -2.464 1.00 40.51 C ATOM 1874 O GLU A 114 -12.111 -5.213 -2.231 1.00 33.13 O ATOM 1875 CB GLU A 114 -13.591 -7.946 -1.124 1.00 11.34 C ATOM 1876 CG GLU A 114 -14.891 -8.767 -1.030 1.00 12.33 C ATOM 1877 CD GLU A 114 -16.172 -7.953 -1.315 1.00 63.01 C ATOM 1878 OE1 GLU A 114 -16.662 -7.968 -2.468 1.00 1.22 O ATOM 1879 OE2 GLU A 114 -16.698 -7.303 -0.386 1.00 52.14 O ATOM 0 H GLU A 114 -13.572 -9.144 -3.322 1.00 21.22 H new ATOM 0 HA GLU A 114 -14.220 -6.522 -2.615 1.00 33.35 H new ATOM 0 HB2 GLU A 114 -12.743 -8.609 -0.954 1.00 11.34 H new ATOM 0 HB3 GLU A 114 -13.583 -7.207 -0.323 1.00 11.34 H new ATOM 0 HG2 GLU A 114 -14.836 -9.597 -1.735 1.00 12.33 H new ATOM 0 HG3 GLU A 114 -14.963 -9.201 -0.033 1.00 12.33 H new ATOM 1886 N ALA A 115 -10.974 -7.098 -2.798 1.00 74.53 N ATOM 1887 CA ALA A 115 -9.636 -6.492 -2.927 1.00 60.34 C ATOM 1888 C ALA A 115 -9.652 -5.249 -3.834 1.00 14.24 C ATOM 1889 O ALA A 115 -9.197 -4.169 -3.440 1.00 70.43 O ATOM 1890 CB ALA A 115 -8.659 -7.533 -3.497 1.00 25.04 C ATOM 0 H ALA A 115 -10.981 -8.100 -2.988 1.00 74.53 H new ATOM 0 HA ALA A 115 -9.315 -6.173 -1.935 1.00 60.34 H new ATOM 0 HB1 ALA A 115 -7.669 -7.088 -3.594 1.00 25.04 H new ATOM 0 HB2 ALA A 115 -8.608 -8.390 -2.825 1.00 25.04 H new ATOM 0 HB3 ALA A 115 -9.007 -7.860 -4.477 1.00 25.04 H new ATOM 1896 N LYS A 116 -10.250 -5.430 -5.023 1.00 63.24 N ATOM 1897 CA LYS A 116 -10.254 -4.431 -6.098 1.00 14.51 C ATOM 1898 C LYS A 116 -11.113 -3.212 -5.743 1.00 32.43 C ATOM 1899 O LYS A 116 -10.735 -2.074 -6.040 1.00 44.25 O ATOM 1900 CB LYS A 116 -10.733 -5.089 -7.415 1.00 3.35 C ATOM 1901 CG LYS A 116 -9.891 -6.325 -7.816 1.00 43.51 C ATOM 1902 CD LYS A 116 -10.324 -6.959 -9.156 1.00 52.34 C ATOM 1903 CE LYS A 116 -10.109 -6.026 -10.358 1.00 65.35 C ATOM 1904 NZ LYS A 116 -10.434 -6.697 -11.644 1.00 74.52 N ATOM 0 H LYS A 116 -10.750 -6.286 -5.265 1.00 63.24 H new ATOM 0 HA LYS A 116 -9.236 -4.066 -6.231 1.00 14.51 H new ATOM 0 HB2 LYS A 116 -11.776 -5.386 -7.307 1.00 3.35 H new ATOM 0 HB3 LYS A 116 -10.693 -4.353 -8.218 1.00 3.35 H new ATOM 0 HG2 LYS A 116 -8.843 -6.034 -7.883 1.00 43.51 H new ATOM 0 HG3 LYS A 116 -9.964 -7.075 -7.028 1.00 43.51 H new ATOM 0 HD2 LYS A 116 -9.764 -7.881 -9.314 1.00 52.34 H new ATOM 0 HD3 LYS A 116 -11.378 -7.232 -9.099 1.00 52.34 H new ATOM 0 HE2 LYS A 116 -10.731 -5.138 -10.244 1.00 65.35 H new ATOM 0 HE3 LYS A 116 -9.072 -5.689 -10.376 1.00 65.35 H new ATOM 0 HZ1 LYS A 116 -10.657 -5.980 -12.363 1.00 74.52 H new ATOM 0 HZ2 LYS A 116 -9.618 -7.260 -11.958 1.00 74.52 H new ATOM 0 HZ3 LYS A 116 -11.255 -7.322 -11.512 1.00 74.52 H new ATOM 1918 N LYS A 117 -12.253 -3.457 -5.074 1.00 14.42 N ATOM 1919 CA LYS A 117 -13.187 -2.383 -4.687 1.00 73.43 C ATOM 1920 C LYS A 117 -12.566 -1.514 -3.576 1.00 13.11 C ATOM 1921 O LYS A 117 -12.598 -0.279 -3.652 1.00 1.41 O ATOM 1922 CB LYS A 117 -14.572 -2.953 -4.238 1.00 53.44 C ATOM 1923 CG LYS A 117 -15.523 -3.378 -5.394 1.00 74.13 C ATOM 1924 CD LYS A 117 -14.991 -4.557 -6.233 1.00 44.22 C ATOM 1925 CE LYS A 117 -16.000 -5.052 -7.283 1.00 2.24 C ATOM 1926 NZ LYS A 117 -17.268 -5.545 -6.672 1.00 42.33 N ATOM 0 H LYS A 117 -12.551 -4.390 -4.789 1.00 14.42 H new ATOM 0 HA LYS A 117 -13.364 -1.761 -5.564 1.00 73.43 H new ATOM 0 HB2 LYS A 117 -14.400 -3.816 -3.595 1.00 53.44 H new ATOM 0 HB3 LYS A 117 -15.077 -2.200 -3.632 1.00 53.44 H new ATOM 0 HG2 LYS A 117 -16.491 -3.650 -4.974 1.00 74.13 H new ATOM 0 HG3 LYS A 117 -15.689 -2.523 -6.049 1.00 74.13 H new ATOM 0 HD2 LYS A 117 -14.072 -4.253 -6.735 1.00 44.22 H new ATOM 0 HD3 LYS A 117 -14.733 -5.381 -5.568 1.00 44.22 H new ATOM 0 HE2 LYS A 117 -16.226 -4.241 -7.975 1.00 2.24 H new ATOM 0 HE3 LYS A 117 -15.547 -5.853 -7.867 1.00 2.24 H new ATOM 0 HZ1 LYS A 117 -17.834 -6.035 -7.394 1.00 42.33 H new ATOM 0 HZ2 LYS A 117 -17.047 -6.205 -5.899 1.00 42.33 H new ATOM 0 HZ3 LYS A 117 -17.808 -4.740 -6.296 1.00 42.33 H new ATOM 1940 N ARG A 118 -11.950 -2.177 -2.571 1.00 22.42 N ATOM 1941 CA ARG A 118 -11.344 -1.486 -1.407 1.00 23.33 C ATOM 1942 C ARG A 118 -9.994 -0.833 -1.783 1.00 45.34 C ATOM 1943 O ARG A 118 -9.478 0.016 -1.041 1.00 13.32 O ATOM 1944 CB ARG A 118 -11.183 -2.454 -0.201 1.00 4.34 C ATOM 1945 CG ARG A 118 -12.453 -3.280 0.124 1.00 3.23 C ATOM 1946 CD ARG A 118 -13.752 -2.434 0.324 1.00 4.03 C ATOM 1947 NE ARG A 118 -14.883 -2.943 -0.477 1.00 64.42 N ATOM 1948 CZ ARG A 118 -15.575 -4.075 -0.240 1.00 54.22 C ATOM 1949 NH1 ARG A 118 -15.287 -4.866 0.793 1.00 32.20 N ATOM 1950 NH2 ARG A 118 -16.568 -4.413 -1.048 1.00 71.15 N ATOM 0 H ARG A 118 -11.859 -3.192 -2.542 1.00 22.42 H new ATOM 0 HA ARG A 118 -12.024 -0.689 -1.105 1.00 23.33 H new ATOM 0 HB2 ARG A 118 -10.360 -3.139 -0.407 1.00 4.34 H new ATOM 0 HB3 ARG A 118 -10.904 -1.876 0.680 1.00 4.34 H new ATOM 0 HG2 ARG A 118 -12.622 -3.993 -0.683 1.00 3.23 H new ATOM 0 HG3 ARG A 118 -12.271 -3.859 1.029 1.00 3.23 H new ATOM 0 HD2 ARG A 118 -14.026 -2.438 1.379 1.00 4.03 H new ATOM 0 HD3 ARG A 118 -13.553 -1.398 0.050 1.00 4.03 H new ATOM 0 HE ARG A 118 -15.167 -2.387 -1.284 1.00 64.42 H new ATOM 0 HH11 ARG A 118 -14.527 -4.620 1.427 1.00 32.20 H new ATOM 0 HH12 ARG A 118 -15.827 -5.717 0.950 1.00 32.20 H new ATOM 0 HH21 ARG A 118 -16.804 -3.818 -1.842 1.00 71.15 H new ATOM 0 HH22 ARG A 118 -17.097 -5.268 -0.876 1.00 71.15 H new ATOM 1964 N LEU A 119 -9.439 -1.248 -2.936 1.00 41.31 N ATOM 1965 CA LEU A 119 -8.269 -0.608 -3.555 1.00 65.23 C ATOM 1966 C LEU A 119 -8.670 0.809 -4.045 1.00 75.44 C ATOM 1967 O LEU A 119 -8.097 1.813 -3.601 1.00 52.54 O ATOM 1968 CB LEU A 119 -7.746 -1.511 -4.724 1.00 71.12 C ATOM 1969 CG LEU A 119 -6.250 -1.357 -5.174 1.00 41.42 C ATOM 1970 CD1 LEU A 119 -5.944 0.020 -5.779 1.00 50.04 C ATOM 1971 CD2 LEU A 119 -5.290 -1.678 -4.016 1.00 31.24 C ATOM 0 H LEU A 119 -9.794 -2.043 -3.467 1.00 41.31 H new ATOM 0 HA LEU A 119 -7.459 -0.497 -2.834 1.00 65.23 H new ATOM 0 HB2 LEU A 119 -7.901 -2.551 -4.435 1.00 71.12 H new ATOM 0 HB3 LEU A 119 -8.375 -1.325 -5.594 1.00 71.12 H new ATOM 0 HG LEU A 119 -6.090 -2.085 -5.970 1.00 41.42 H new ATOM 0 HD11 LEU A 119 -4.895 0.064 -6.070 1.00 50.04 H new ATOM 0 HD12 LEU A 119 -6.571 0.180 -6.656 1.00 50.04 H new ATOM 0 HD13 LEU A 119 -6.149 0.795 -5.041 1.00 50.04 H new ATOM 0 HD21 LEU A 119 -4.260 -1.564 -4.355 1.00 31.24 H new ATOM 0 HD22 LEU A 119 -5.478 -0.995 -3.188 1.00 31.24 H new ATOM 0 HD23 LEU A 119 -5.451 -2.704 -3.684 1.00 31.24 H new ATOM 1983 N LYS A 120 -9.689 0.858 -4.940 1.00 3.22 N ATOM 1984 CA LYS A 120 -10.233 2.120 -5.512 1.00 25.32 C ATOM 1985 C LYS A 120 -10.795 3.055 -4.409 1.00 64.02 C ATOM 1986 O LYS A 120 -10.759 4.282 -4.536 1.00 15.01 O ATOM 1987 CB LYS A 120 -11.336 1.789 -6.565 1.00 60.24 C ATOM 1988 CG LYS A 120 -12.035 3.023 -7.195 1.00 12.34 C ATOM 1989 CD LYS A 120 -13.159 2.642 -8.186 1.00 3.43 C ATOM 1990 CE LYS A 120 -12.628 2.021 -9.488 1.00 54.55 C ATOM 1991 NZ LYS A 120 -11.805 2.986 -10.272 1.00 22.32 N ATOM 0 H LYS A 120 -10.159 0.022 -5.287 1.00 3.22 H new ATOM 0 HA LYS A 120 -9.416 2.651 -6.000 1.00 25.32 H new ATOM 0 HB2 LYS A 120 -10.888 1.197 -7.363 1.00 60.24 H new ATOM 0 HB3 LYS A 120 -12.093 1.164 -6.091 1.00 60.24 H new ATOM 0 HG2 LYS A 120 -12.453 3.641 -6.401 1.00 12.34 H new ATOM 0 HG3 LYS A 120 -11.292 3.629 -7.713 1.00 12.34 H new ATOM 0 HD2 LYS A 120 -13.837 1.937 -7.704 1.00 3.43 H new ATOM 0 HD3 LYS A 120 -13.741 3.532 -8.426 1.00 3.43 H new ATOM 0 HE2 LYS A 120 -12.029 1.141 -9.252 1.00 54.55 H new ATOM 0 HE3 LYS A 120 -13.467 1.682 -10.096 1.00 54.55 H new ATOM 0 HZ1 LYS A 120 -11.580 2.576 -11.201 1.00 22.32 H new ATOM 0 HZ2 LYS A 120 -12.337 3.870 -10.403 1.00 22.32 H new ATOM 0 HZ3 LYS A 120 -10.923 3.186 -9.759 1.00 22.32 H new ATOM 2005 N GLU A 121 -11.285 2.434 -3.336 1.00 3.42 N ATOM 2006 CA GLU A 121 -11.812 3.112 -2.139 1.00 63.31 C ATOM 2007 C GLU A 121 -10.765 4.052 -1.505 1.00 13.14 C ATOM 2008 O GLU A 121 -11.070 5.189 -1.150 1.00 21.53 O ATOM 2009 CB GLU A 121 -12.228 2.021 -1.137 1.00 13.20 C ATOM 2010 CG GLU A 121 -12.796 2.515 0.195 1.00 2.20 C ATOM 2011 CD GLU A 121 -12.826 1.408 1.255 1.00 61.13 C ATOM 2012 OE1 GLU A 121 -11.758 1.134 1.848 1.00 55.23 O ATOM 2013 OE2 GLU A 121 -13.900 0.817 1.507 1.00 42.14 O ATOM 0 H GLU A 121 -11.330 1.417 -3.268 1.00 3.42 H new ATOM 0 HA GLU A 121 -12.663 3.734 -2.416 1.00 63.31 H new ATOM 0 HB2 GLU A 121 -12.973 1.384 -1.613 1.00 13.20 H new ATOM 0 HB3 GLU A 121 -11.359 1.396 -0.929 1.00 13.20 H new ATOM 0 HG2 GLU A 121 -12.194 3.348 0.558 1.00 2.20 H new ATOM 0 HG3 GLU A 121 -13.806 2.895 0.039 1.00 2.20 H new ATOM 2020 N LEU A 122 -9.520 3.564 -1.380 1.00 45.01 N ATOM 2021 CA LEU A 122 -8.420 4.350 -0.786 1.00 60.23 C ATOM 2022 C LEU A 122 -7.787 5.280 -1.836 1.00 53.14 C ATOM 2023 O LEU A 122 -7.121 6.265 -1.484 1.00 11.13 O ATOM 2024 CB LEU A 122 -7.378 3.421 -0.098 1.00 42.11 C ATOM 2025 CG LEU A 122 -7.943 2.509 1.055 1.00 44.15 C ATOM 2026 CD1 LEU A 122 -6.816 1.830 1.859 1.00 40.41 C ATOM 2027 CD2 LEU A 122 -8.859 3.301 1.998 1.00 11.31 C ATOM 0 H LEU A 122 -9.247 2.629 -1.682 1.00 45.01 H new ATOM 0 HA LEU A 122 -8.829 4.989 -0.004 1.00 60.23 H new ATOM 0 HB2 LEU A 122 -6.930 2.781 -0.858 1.00 42.11 H new ATOM 0 HB3 LEU A 122 -6.578 4.040 0.310 1.00 42.11 H new ATOM 0 HG LEU A 122 -8.531 1.728 0.573 1.00 44.15 H new ATOM 0 HD11 LEU A 122 -7.251 1.211 2.644 1.00 40.41 H new ATOM 0 HD12 LEU A 122 -6.219 1.206 1.193 1.00 40.41 H new ATOM 0 HD13 LEU A 122 -6.180 2.592 2.309 1.00 40.41 H new ATOM 0 HD21 LEU A 122 -9.232 2.642 2.782 1.00 11.31 H new ATOM 0 HD22 LEU A 122 -8.297 4.119 2.449 1.00 11.31 H new ATOM 0 HD23 LEU A 122 -9.700 3.705 1.434 1.00 11.31 H new ATOM 2039 N LEU A 123 -8.038 4.990 -3.132 1.00 40.44 N ATOM 2040 CA LEU A 123 -7.738 5.937 -4.225 1.00 44.20 C ATOM 2041 C LEU A 123 -8.622 7.195 -4.110 1.00 40.34 C ATOM 2042 O LEU A 123 -8.238 8.239 -4.597 1.00 1.31 O ATOM 2043 CB LEU A 123 -7.876 5.268 -5.633 1.00 33.32 C ATOM 2044 CG LEU A 123 -6.558 4.698 -6.259 1.00 2.14 C ATOM 2045 CD1 LEU A 123 -5.551 5.830 -6.586 1.00 15.03 C ATOM 2046 CD2 LEU A 123 -5.917 3.623 -5.349 1.00 22.22 C ATOM 0 H LEU A 123 -8.447 4.109 -3.445 1.00 40.44 H new ATOM 0 HA LEU A 123 -6.696 6.241 -4.122 1.00 44.20 H new ATOM 0 HB2 LEU A 123 -8.599 4.456 -5.557 1.00 33.32 H new ATOM 0 HB3 LEU A 123 -8.293 6.002 -6.322 1.00 33.32 H new ATOM 0 HG LEU A 123 -6.827 4.215 -7.198 1.00 2.14 H new ATOM 0 HD11 LEU A 123 -4.648 5.400 -7.019 1.00 15.03 H new ATOM 0 HD12 LEU A 123 -6.000 6.522 -7.298 1.00 15.03 H new ATOM 0 HD13 LEU A 123 -5.296 6.365 -5.671 1.00 15.03 H new ATOM 0 HD21 LEU A 123 -5.005 3.249 -5.814 1.00 22.22 H new ATOM 0 HD22 LEU A 123 -5.677 4.062 -4.381 1.00 22.22 H new ATOM 0 HD23 LEU A 123 -6.617 2.799 -5.210 1.00 22.22 H new ATOM 2058 N GLU A 124 -9.793 7.083 -3.447 1.00 74.03 N ATOM 2059 CA GLU A 124 -10.642 8.258 -3.134 1.00 42.42 C ATOM 2060 C GLU A 124 -9.951 9.148 -2.084 1.00 43.32 C ATOM 2061 O GLU A 124 -10.006 10.374 -2.166 1.00 14.25 O ATOM 2062 CB GLU A 124 -12.039 7.818 -2.626 1.00 73.03 C ATOM 2063 CG GLU A 124 -12.807 6.888 -3.591 1.00 62.51 C ATOM 2064 CD GLU A 124 -14.177 6.464 -3.042 1.00 42.51 C ATOM 2065 OE1 GLU A 124 -14.219 5.696 -2.054 1.00 35.55 O ATOM 2066 OE2 GLU A 124 -15.218 6.906 -3.580 1.00 73.53 O ATOM 0 H GLU A 124 -10.173 6.195 -3.118 1.00 74.03 H new ATOM 0 HA GLU A 124 -10.780 8.830 -4.051 1.00 42.42 H new ATOM 0 HB2 GLU A 124 -11.920 7.310 -1.669 1.00 73.03 H new ATOM 0 HB3 GLU A 124 -12.642 8.707 -2.442 1.00 73.03 H new ATOM 0 HG2 GLU A 124 -12.944 7.396 -4.546 1.00 62.51 H new ATOM 0 HG3 GLU A 124 -12.207 5.999 -3.786 1.00 62.51 H new ATOM 2073 N LYS A 125 -9.268 8.500 -1.115 1.00 4.14 N ATOM 2074 CA LYS A 125 -8.482 9.193 -0.063 1.00 32.31 C ATOM 2075 C LYS A 125 -7.177 9.774 -0.640 1.00 33.55 C ATOM 2076 O LYS A 125 -6.520 10.603 -0.001 1.00 12.20 O ATOM 2077 CB LYS A 125 -8.190 8.246 1.148 1.00 30.10 C ATOM 2078 CG LYS A 125 -9.409 7.979 2.072 1.00 4.33 C ATOM 2079 CD LYS A 125 -10.542 7.177 1.389 1.00 62.42 C ATOM 2080 CE LYS A 125 -11.838 7.177 2.207 1.00 31.12 C ATOM 2081 NZ LYS A 125 -11.647 6.617 3.568 1.00 22.12 N ATOM 0 H LYS A 125 -9.244 7.483 -1.038 1.00 4.14 H new ATOM 0 HA LYS A 125 -9.084 10.023 0.306 1.00 32.31 H new ATOM 0 HB2 LYS A 125 -7.825 7.292 0.766 1.00 30.10 H new ATOM 0 HB3 LYS A 125 -7.387 8.679 1.745 1.00 30.10 H new ATOM 0 HG2 LYS A 125 -9.072 7.436 2.955 1.00 4.33 H new ATOM 0 HG3 LYS A 125 -9.808 8.933 2.417 1.00 4.33 H new ATOM 0 HD2 LYS A 125 -10.738 7.599 0.404 1.00 62.42 H new ATOM 0 HD3 LYS A 125 -10.213 6.149 1.235 1.00 62.42 H new ATOM 0 HE2 LYS A 125 -12.215 8.197 2.286 1.00 31.12 H new ATOM 0 HE3 LYS A 125 -12.596 6.597 1.681 1.00 31.12 H new ATOM 0 HZ1 LYS A 125 -12.566 6.560 4.052 1.00 22.12 H new ATOM 0 HZ2 LYS A 125 -11.233 5.666 3.497 1.00 22.12 H new ATOM 0 HZ3 LYS A 125 -11.008 7.233 4.110 1.00 22.12 H new ATOM 2095 N VAL A 126 -6.796 9.293 -1.830 1.00 60.14 N ATOM 2096 CA VAL A 126 -5.791 9.948 -2.679 1.00 20.04 C ATOM 2097 C VAL A 126 -6.421 11.171 -3.407 1.00 33.10 C ATOM 2098 O VAL A 126 -5.870 12.284 -3.365 1.00 61.34 O ATOM 2099 CB VAL A 126 -5.193 8.923 -3.721 1.00 34.23 C ATOM 2100 CG1 VAL A 126 -4.302 9.615 -4.772 1.00 74.33 C ATOM 2101 CG2 VAL A 126 -4.428 7.782 -3.000 1.00 11.55 C ATOM 0 H VAL A 126 -7.176 8.437 -2.233 1.00 60.14 H new ATOM 0 HA VAL A 126 -4.976 10.303 -2.048 1.00 20.04 H new ATOM 0 HB VAL A 126 -6.033 8.483 -4.258 1.00 34.23 H new ATOM 0 HG11 VAL A 126 -3.913 8.870 -5.467 1.00 74.33 H new ATOM 0 HG12 VAL A 126 -4.890 10.351 -5.320 1.00 74.33 H new ATOM 0 HG13 VAL A 126 -3.471 10.114 -4.273 1.00 74.33 H new ATOM 0 HG21 VAL A 126 -4.026 7.090 -3.740 1.00 11.55 H new ATOM 0 HG22 VAL A 126 -3.610 8.204 -2.416 1.00 11.55 H new ATOM 0 HG23 VAL A 126 -5.110 7.249 -2.337 1.00 11.55 H new