USER MOD reduce.3.24.130724 H: found=0, std=0, add=588, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 594 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 173 HIS : +bothHN:sc= -2.6! C(o=-2.2!,f=-6.4!) USER MOD Set 1.2: B 172 SER OG : rot 73:sc= 0.353 USER MOD Set 2.1: A 172 SER OG : rot -114:sc= 0.218 USER MOD Set 2.2: B 173 HIS : no HE2:sc= -1.87! C(o=-1.7!,f=-7.1!) USER MOD Single : A 158 SER OG : rot 180:sc= 0 USER MOD Single : A 163 LYS NZ :NH3+ -118:sc= -0.165 (180deg=-0.533) USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD Single : A 182 TYR OH : rot 180:sc= 0 USER MOD Single : A 188 THR OG1 : rot -74:sc= 0.299 USER MOD Single : B 158 SER OG : rot 180:sc= 0 USER MOD Single : B 163 LYS NZ :NH3+ 172:sc=-0.00782 (180deg=-0.113) USER MOD Single : B 168 SER OG : rot 180:sc= 0 USER MOD Single : B 182 TYR OH : rot 180:sc= 0 USER MOD Single : B 188 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 154 22.607 14.480 8.350 1.00 7.39 N ATOM 2 CA GLY A 154 22.794 13.500 9.455 1.00 6.86 C ATOM 3 C GLY A 154 23.124 12.112 8.945 1.00 6.54 C ATOM 4 O GLY A 154 24.290 11.784 8.727 1.00 6.88 O ATOM 0 HA2 GLY A 154 23.595 13.843 10.110 1.00 6.86 H new ATOM 0 HA3 GLY A 154 21.886 13.457 10.057 1.00 6.86 H new ATOM 10 N GLY A 155 22.094 11.292 8.757 1.00 6.02 N ATOM 11 CA GLY A 155 22.303 9.941 8.269 1.00 5.78 C ATOM 12 C GLY A 155 22.671 9.903 6.801 1.00 5.75 C ATOM 13 O GLY A 155 22.760 10.943 6.148 1.00 5.85 O ATOM 0 H GLY A 155 21.120 11.539 8.934 1.00 6.02 H new ATOM 0 HA2 GLY A 155 23.094 9.467 8.850 1.00 5.78 H new ATOM 0 HA3 GLY A 155 21.397 9.357 8.428 1.00 5.78 H new ATOM 17 N ILE A 156 22.886 8.700 6.283 1.00 5.70 N ATOM 18 CA ILE A 156 23.244 8.522 4.881 1.00 5.80 C ATOM 19 C ILE A 156 22.073 8.865 3.966 1.00 5.41 C ATOM 20 O ILE A 156 22.257 9.121 2.776 1.00 5.56 O ATOM 21 CB ILE A 156 23.689 7.075 4.599 1.00 5.96 C ATOM 22 CG1 ILE A 156 24.672 6.604 5.671 1.00 6.37 C ATOM 23 CG2 ILE A 156 24.313 6.972 3.215 1.00 6.20 C ATOM 24 CD1 ILE A 156 25.796 7.584 5.932 1.00 6.75 C ATOM 0 H ILE A 156 22.819 7.832 6.814 1.00 5.70 H new ATOM 0 HA ILE A 156 24.073 9.200 4.677 1.00 5.80 H new ATOM 0 HB ILE A 156 22.812 6.428 4.628 1.00 5.96 H new ATOM 0 HG12 ILE A 156 24.129 6.431 6.600 1.00 6.37 H new ATOM 0 HG13 ILE A 156 25.098 5.648 5.367 1.00 6.37 H new ATOM 0 HG21 ILE A 156 24.622 5.943 3.031 1.00 6.20 H new ATOM 0 HG22 ILE A 156 23.583 7.271 2.463 1.00 6.20 H new ATOM 0 HG23 ILE A 156 25.182 7.628 3.158 1.00 6.20 H new ATOM 0 HD11 ILE A 156 26.455 7.185 6.703 1.00 6.75 H new ATOM 0 HD12 ILE A 156 26.364 7.739 5.015 1.00 6.75 H new ATOM 0 HD13 ILE A 156 25.380 8.534 6.266 1.00 6.75 H new ATOM 36 N PHE A 157 20.870 8.869 4.530 1.00 5.00 N ATOM 37 CA PHE A 157 19.671 9.179 3.776 1.00 4.63 C ATOM 38 C PHE A 157 18.546 9.604 4.712 1.00 4.39 C ATOM 39 O PHE A 157 18.128 10.762 4.711 1.00 4.40 O ATOM 40 CB PHE A 157 19.244 7.955 2.977 1.00 4.37 C ATOM 41 CG PHE A 157 19.976 7.797 1.675 1.00 4.67 C ATOM 42 CD1 PHE A 157 19.564 8.488 0.546 1.00 5.11 C ATOM 43 CD2 PHE A 157 21.077 6.960 1.580 1.00 4.81 C ATOM 44 CE1 PHE A 157 20.236 8.345 -0.653 1.00 5.45 C ATOM 45 CE2 PHE A 157 21.752 6.814 0.383 1.00 5.12 C ATOM 46 CZ PHE A 157 21.331 7.507 -0.735 1.00 5.34 C ATOM 0 H PHE A 157 20.704 8.659 5.514 1.00 5.00 H new ATOM 0 HA PHE A 157 19.885 10.003 3.096 1.00 4.63 H new ATOM 0 HB2 PHE A 157 19.403 7.063 3.583 1.00 4.37 H new ATOM 0 HB3 PHE A 157 18.174 8.018 2.777 1.00 4.37 H new ATOM 0 HD1 PHE A 157 18.709 9.145 0.604 1.00 5.11 H new ATOM 0 HD2 PHE A 157 21.411 6.416 2.451 1.00 4.81 H new ATOM 0 HE1 PHE A 157 19.905 8.888 -1.526 1.00 5.45 H new ATOM 0 HE2 PHE A 157 22.608 6.158 0.322 1.00 5.12 H new ATOM 0 HZ PHE A 157 21.857 7.394 -1.672 1.00 5.34 H new ATOM 56 N SER A 158 18.064 8.657 5.514 1.00 4.26 N ATOM 57 CA SER A 158 16.987 8.914 6.471 1.00 4.14 C ATOM 58 C SER A 158 15.902 9.826 5.886 1.00 3.77 C ATOM 59 O SER A 158 14.951 9.349 5.269 1.00 3.49 O ATOM 60 CB SER A 158 17.559 9.519 7.757 1.00 4.62 C ATOM 61 OG SER A 158 18.401 8.596 8.424 1.00 5.17 O ATOM 0 H SER A 158 18.405 7.696 5.520 1.00 4.26 H new ATOM 0 HA SER A 158 16.516 7.959 6.701 1.00 4.14 H new ATOM 0 HB2 SER A 158 18.121 10.422 7.519 1.00 4.62 H new ATOM 0 HB3 SER A 158 16.744 9.815 8.417 1.00 4.62 H new ATOM 0 HG SER A 158 18.755 9.007 9.240 1.00 5.17 H new ATOM 67 N ALA A 159 16.049 11.134 6.071 1.00 3.88 N ATOM 68 CA ALA A 159 15.067 12.087 5.565 1.00 3.60 C ATOM 69 C ALA A 159 14.872 11.940 4.060 1.00 3.30 C ATOM 70 O ALA A 159 13.747 11.803 3.582 1.00 2.93 O ATOM 71 CB ALA A 159 15.485 13.508 5.911 1.00 3.89 C ATOM 0 H ALA A 159 16.835 11.557 6.565 1.00 3.88 H new ATOM 0 HA ALA A 159 14.113 11.872 6.046 1.00 3.60 H new ATOM 0 HB1 ALA A 159 14.744 14.209 5.528 1.00 3.89 H new ATOM 0 HB2 ALA A 159 15.557 13.613 6.994 1.00 3.89 H new ATOM 0 HB3 ALA A 159 16.454 13.722 5.460 1.00 3.89 H new ATOM 77 N GLU A 160 15.972 11.975 3.315 1.00 3.54 N ATOM 78 CA GLU A 160 15.914 11.848 1.862 1.00 3.42 C ATOM 79 C GLU A 160 15.202 10.562 1.457 1.00 3.10 C ATOM 80 O GLU A 160 14.125 10.598 0.861 1.00 2.83 O ATOM 81 CB GLU A 160 17.325 11.874 1.271 1.00 3.86 C ATOM 82 CG GLU A 160 17.351 11.803 -0.248 1.00 4.24 C ATOM 83 CD GLU A 160 18.747 11.966 -0.814 1.00 4.74 C ATOM 84 OE1 GLU A 160 19.459 10.948 -0.940 1.00 5.36 O ATOM 85 OE2 GLU A 160 19.128 13.112 -1.131 1.00 4.91 O ATOM 0 H GLU A 160 16.913 12.090 3.692 1.00 3.54 H new ATOM 0 HA GLU A 160 15.348 12.693 1.469 1.00 3.42 H new ATOM 0 HB2 GLU A 160 17.828 12.786 1.592 1.00 3.86 H new ATOM 0 HB3 GLU A 160 17.895 11.037 1.675 1.00 3.86 H new ATOM 0 HG2 GLU A 160 16.941 10.846 -0.571 1.00 4.24 H new ATOM 0 HG3 GLU A 160 16.704 12.580 -0.656 1.00 4.24 H new ATOM 92 N PHE A 161 15.808 9.426 1.783 1.00 3.19 N ATOM 93 CA PHE A 161 15.228 8.130 1.455 1.00 2.94 C ATOM 94 C PHE A 161 13.782 8.044 1.937 1.00 2.53 C ATOM 95 O PHE A 161 12.883 7.690 1.174 1.00 2.23 O ATOM 96 CB PHE A 161 16.059 7.006 2.082 1.00 3.21 C ATOM 97 CG PHE A 161 15.434 5.646 1.952 1.00 3.05 C ATOM 98 CD1 PHE A 161 15.576 4.912 0.786 1.00 3.21 C ATOM 99 CD2 PHE A 161 14.704 5.102 2.998 1.00 3.13 C ATOM 100 CE1 PHE A 161 15.001 3.661 0.665 1.00 3.12 C ATOM 101 CE2 PHE A 161 14.126 3.852 2.882 1.00 3.04 C ATOM 102 CZ PHE A 161 14.275 3.131 1.714 1.00 2.87 C ATOM 0 H PHE A 161 16.701 9.377 2.274 1.00 3.19 H new ATOM 0 HA PHE A 161 15.236 8.017 0.371 1.00 2.94 H new ATOM 0 HB2 PHE A 161 17.043 6.990 1.614 1.00 3.21 H new ATOM 0 HB3 PHE A 161 16.212 7.226 3.139 1.00 3.21 H new ATOM 0 HD1 PHE A 161 16.142 5.322 -0.037 1.00 3.21 H new ATOM 0 HD2 PHE A 161 14.586 5.662 3.914 1.00 3.13 H new ATOM 0 HE1 PHE A 161 15.119 3.098 -0.249 1.00 3.12 H new ATOM 0 HE2 PHE A 161 13.559 3.440 3.704 1.00 3.04 H new ATOM 0 HZ PHE A 161 13.825 2.154 1.621 1.00 2.87 H new ATOM 112 N LEU A 162 13.568 8.371 3.207 1.00 2.59 N ATOM 113 CA LEU A 162 12.234 8.326 3.795 1.00 2.33 C ATOM 114 C LEU A 162 11.291 9.311 3.107 1.00 2.06 C ATOM 115 O LEU A 162 10.094 9.052 2.983 1.00 1.79 O ATOM 116 CB LEU A 162 12.309 8.629 5.293 1.00 2.64 C ATOM 117 CG LEU A 162 13.073 7.594 6.122 1.00 2.96 C ATOM 118 CD1 LEU A 162 13.295 8.099 7.538 1.00 3.31 C ATOM 119 CD2 LEU A 162 12.323 6.274 6.140 1.00 2.83 C ATOM 0 H LEU A 162 14.302 8.670 3.849 1.00 2.59 H new ATOM 0 HA LEU A 162 11.836 7.322 3.651 1.00 2.33 H new ATOM 0 HB2 LEU A 162 12.781 9.602 5.429 1.00 2.64 H new ATOM 0 HB3 LEU A 162 11.295 8.709 5.684 1.00 2.64 H new ATOM 0 HG LEU A 162 14.047 7.434 5.660 1.00 2.96 H new ATOM 0 HD11 LEU A 162 13.840 7.348 8.111 1.00 3.31 H new ATOM 0 HD12 LEU A 162 13.873 9.023 7.508 1.00 3.31 H new ATOM 0 HD13 LEU A 162 12.332 8.289 8.012 1.00 3.31 H new ATOM 0 HD21 LEU A 162 12.879 5.548 6.733 1.00 2.83 H new ATOM 0 HD22 LEU A 162 11.336 6.422 6.579 1.00 2.83 H new ATOM 0 HD23 LEU A 162 12.215 5.903 5.121 1.00 2.83 H new ATOM 131 N LYS A 163 11.835 10.439 2.662 1.00 2.21 N ATOM 132 CA LYS A 163 11.034 11.456 1.988 1.00 2.08 C ATOM 133 C LYS A 163 10.329 10.872 0.769 1.00 1.82 C ATOM 134 O LYS A 163 9.204 11.256 0.448 1.00 1.70 O ATOM 135 CB LYS A 163 11.910 12.639 1.569 1.00 2.39 C ATOM 136 CG LYS A 163 11.161 13.700 0.779 1.00 2.32 C ATOM 137 CD LYS A 163 12.031 14.915 0.506 1.00 2.58 C ATOM 138 CE LYS A 163 13.268 14.548 -0.298 1.00 2.67 C ATOM 139 NZ LYS A 163 12.920 14.007 -1.641 1.00 3.11 N ATOM 0 H LYS A 163 12.824 10.672 2.755 1.00 2.21 H new ATOM 0 HA LYS A 163 10.278 11.808 2.690 1.00 2.08 H new ATOM 0 HB2 LYS A 163 12.339 13.097 2.460 1.00 2.39 H new ATOM 0 HB3 LYS A 163 12.742 12.270 0.969 1.00 2.39 H new ATOM 0 HG2 LYS A 163 10.820 13.277 -0.166 1.00 2.32 H new ATOM 0 HG3 LYS A 163 10.272 14.005 1.331 1.00 2.32 H new ATOM 0 HD2 LYS A 163 11.453 15.663 -0.036 1.00 2.58 H new ATOM 0 HD3 LYS A 163 12.332 15.368 1.451 1.00 2.58 H new ATOM 0 HE2 LYS A 163 13.899 15.429 -0.414 1.00 2.67 H new ATOM 0 HE3 LYS A 163 13.851 13.808 0.251 1.00 2.67 H new ATOM 0 HZ1 LYS A 163 13.262 13.028 -1.720 1.00 3.11 H new ATOM 0 HZ2 LYS A 163 11.888 14.024 -1.765 1.00 3.11 H new ATOM 0 HZ3 LYS A 163 13.367 14.591 -2.377 1.00 3.11 H new ATOM 153 N VAL A 164 10.996 9.944 0.093 1.00 1.85 N ATOM 154 CA VAL A 164 10.433 9.304 -1.089 1.00 1.76 C ATOM 155 C VAL A 164 10.016 7.871 -0.787 1.00 1.57 C ATOM 156 O VAL A 164 10.021 7.013 -1.669 1.00 1.72 O ATOM 157 CB VAL A 164 11.435 9.297 -2.257 1.00 2.14 C ATOM 158 CG1 VAL A 164 11.802 10.717 -2.657 1.00 2.52 C ATOM 159 CG2 VAL A 164 12.678 8.503 -1.886 1.00 2.66 C ATOM 0 H VAL A 164 11.929 9.618 0.344 1.00 1.85 H new ATOM 0 HA VAL A 164 9.557 9.885 -1.376 1.00 1.76 H new ATOM 0 HB VAL A 164 10.963 8.815 -3.113 1.00 2.14 H new ATOM 0 HG11 VAL A 164 12.511 10.690 -3.484 1.00 2.52 H new ATOM 0 HG12 VAL A 164 10.904 11.252 -2.966 1.00 2.52 H new ATOM 0 HG13 VAL A 164 12.254 11.229 -1.808 1.00 2.52 H new ATOM 0 HG21 VAL A 164 13.376 8.508 -2.723 1.00 2.66 H new ATOM 0 HG22 VAL A 164 13.152 8.955 -1.015 1.00 2.66 H new ATOM 0 HG23 VAL A 164 12.398 7.476 -1.654 1.00 2.66 H new ATOM 169 N PHE A 165 9.653 7.619 0.467 1.00 1.35 N ATOM 170 CA PHE A 165 9.235 6.288 0.888 1.00 1.22 C ATOM 171 C PHE A 165 7.953 6.357 1.711 1.00 0.99 C ATOM 172 O PHE A 165 6.919 5.819 1.316 1.00 0.85 O ATOM 173 CB PHE A 165 10.342 5.623 1.705 1.00 1.48 C ATOM 174 CG PHE A 165 10.045 4.196 2.065 1.00 1.47 C ATOM 175 CD1 PHE A 165 10.396 3.168 1.208 1.00 1.78 C ATOM 176 CD2 PHE A 165 9.415 3.885 3.260 1.00 1.99 C ATOM 177 CE1 PHE A 165 10.126 1.853 1.535 1.00 1.84 C ATOM 178 CE2 PHE A 165 9.142 2.572 3.592 1.00 2.06 C ATOM 179 CZ PHE A 165 9.498 1.554 2.728 1.00 1.62 C ATOM 0 H PHE A 165 9.640 8.319 1.208 1.00 1.35 H new ATOM 0 HA PHE A 165 9.041 5.693 -0.005 1.00 1.22 H new ATOM 0 HB2 PHE A 165 11.273 5.661 1.139 1.00 1.48 H new ATOM 0 HB3 PHE A 165 10.501 6.195 2.619 1.00 1.48 H new ATOM 0 HD1 PHE A 165 10.886 3.396 0.273 1.00 1.78 H new ATOM 0 HD2 PHE A 165 9.135 4.677 3.938 1.00 1.99 H new ATOM 0 HE1 PHE A 165 10.406 1.059 0.858 1.00 1.84 H new ATOM 0 HE2 PHE A 165 8.651 2.341 4.526 1.00 2.06 H new ATOM 0 HZ PHE A 165 9.286 0.527 2.985 1.00 1.62 H new ATOM 189 N LEU A 166 8.031 7.023 2.859 1.00 1.07 N ATOM 190 CA LEU A 166 6.878 7.166 3.740 1.00 1.04 C ATOM 191 C LEU A 166 5.643 7.637 2.971 1.00 0.80 C ATOM 192 O LEU A 166 4.612 6.963 2.981 1.00 0.80 O ATOM 193 CB LEU A 166 7.197 8.136 4.882 1.00 1.31 C ATOM 194 CG LEU A 166 8.217 7.623 5.899 1.00 1.61 C ATOM 195 CD1 LEU A 166 8.469 8.667 6.976 1.00 1.88 C ATOM 196 CD2 LEU A 166 7.740 6.319 6.519 1.00 1.72 C ATOM 0 H LEU A 166 8.881 7.472 3.201 1.00 1.07 H new ATOM 0 HA LEU A 166 6.655 6.185 4.161 1.00 1.04 H new ATOM 0 HB2 LEU A 166 7.569 9.067 4.455 1.00 1.31 H new ATOM 0 HB3 LEU A 166 6.271 8.373 5.406 1.00 1.31 H new ATOM 0 HG LEU A 166 9.156 7.434 5.380 1.00 1.61 H new ATOM 0 HD11 LEU A 166 9.197 8.284 7.691 1.00 1.88 H new ATOM 0 HD12 LEU A 166 8.855 9.577 6.517 1.00 1.88 H new ATOM 0 HD13 LEU A 166 7.536 8.889 7.493 1.00 1.88 H new ATOM 0 HD21 LEU A 166 8.478 5.968 7.240 1.00 1.72 H new ATOM 0 HD22 LEU A 166 6.788 6.483 7.024 1.00 1.72 H new ATOM 0 HD23 LEU A 166 7.612 5.570 5.738 1.00 1.72 H new ATOM 208 N PRO A 167 5.719 8.799 2.292 1.00 0.73 N ATOM 209 CA PRO A 167 4.588 9.334 1.524 1.00 0.67 C ATOM 210 C PRO A 167 4.166 8.405 0.391 1.00 0.55 C ATOM 211 O PRO A 167 3.036 8.473 -0.091 1.00 0.58 O ATOM 212 CB PRO A 167 5.120 10.656 0.958 1.00 0.86 C ATOM 213 CG PRO A 167 6.602 10.530 1.014 1.00 0.98 C ATOM 214 CD PRO A 167 6.897 9.680 2.215 1.00 0.91 C ATOM 0 HA PRO A 167 3.701 9.452 2.146 1.00 0.67 H new ATOM 0 HB2 PRO A 167 4.776 10.815 -0.064 1.00 0.86 H new ATOM 0 HB3 PRO A 167 4.774 11.505 1.547 1.00 0.86 H new ATOM 0 HG2 PRO A 167 6.990 10.070 0.105 1.00 0.98 H new ATOM 0 HG3 PRO A 167 7.074 11.508 1.102 1.00 0.98 H new ATOM 0 HD2 PRO A 167 7.819 9.112 2.091 1.00 0.91 H new ATOM 0 HD3 PRO A 167 7.012 10.281 3.117 1.00 0.91 H new ATOM 222 N SER A 168 5.080 7.537 -0.030 1.00 0.55 N ATOM 223 CA SER A 168 4.798 6.597 -1.107 1.00 0.52 C ATOM 224 C SER A 168 3.886 5.473 -0.624 1.00 0.39 C ATOM 225 O SER A 168 2.846 5.203 -1.226 1.00 0.33 O ATOM 226 CB SER A 168 6.101 6.011 -1.652 1.00 0.66 C ATOM 227 OG SER A 168 5.849 5.080 -2.690 1.00 1.47 O ATOM 0 H SER A 168 6.021 7.466 0.358 1.00 0.55 H new ATOM 0 HA SER A 168 4.288 7.138 -1.904 1.00 0.52 H new ATOM 0 HB2 SER A 168 6.736 6.814 -2.026 1.00 0.66 H new ATOM 0 HB3 SER A 168 6.648 5.522 -0.846 1.00 0.66 H new ATOM 0 HG SER A 168 6.699 4.722 -3.022 1.00 1.47 H new ATOM 233 N LEU A 169 4.281 4.824 0.466 1.00 0.40 N ATOM 234 CA LEU A 169 3.496 3.730 1.030 1.00 0.36 C ATOM 235 C LEU A 169 2.127 4.221 1.485 1.00 0.28 C ATOM 236 O LEU A 169 1.105 3.596 1.199 1.00 0.26 O ATOM 237 CB LEU A 169 4.239 3.088 2.200 1.00 0.47 C ATOM 238 CG LEU A 169 5.586 2.458 1.842 1.00 0.59 C ATOM 239 CD1 LEU A 169 6.169 1.733 3.044 1.00 0.73 C ATOM 240 CD2 LEU A 169 5.431 1.506 0.666 1.00 0.62 C ATOM 0 H LEU A 169 5.138 5.035 0.976 1.00 0.40 H new ATOM 0 HA LEU A 169 3.351 2.982 0.251 1.00 0.36 H new ATOM 0 HB2 LEU A 169 4.401 3.845 2.967 1.00 0.47 H new ATOM 0 HB3 LEU A 169 3.601 2.321 2.639 1.00 0.47 H new ATOM 0 HG LEU A 169 6.274 3.252 1.553 1.00 0.59 H new ATOM 0 HD11 LEU A 169 7.127 1.290 2.772 1.00 0.73 H new ATOM 0 HD12 LEU A 169 6.314 2.441 3.860 1.00 0.73 H new ATOM 0 HD13 LEU A 169 5.484 0.947 3.363 1.00 0.73 H new ATOM 0 HD21 LEU A 169 6.399 1.066 0.424 1.00 0.62 H new ATOM 0 HD22 LEU A 169 4.728 0.715 0.928 1.00 0.62 H new ATOM 0 HD23 LEU A 169 5.055 2.054 -0.198 1.00 0.62 H new ATOM 252 N LEU A 170 2.111 5.346 2.195 1.00 0.31 N ATOM 253 CA LEU A 170 0.863 5.917 2.687 1.00 0.33 C ATOM 254 C LEU A 170 -0.147 6.059 1.553 1.00 0.26 C ATOM 255 O LEU A 170 -1.282 5.592 1.659 1.00 0.27 O ATOM 256 CB LEU A 170 1.120 7.281 3.331 1.00 0.42 C ATOM 257 CG LEU A 170 1.951 7.247 4.614 1.00 0.52 C ATOM 258 CD1 LEU A 170 2.138 8.652 5.167 1.00 0.63 C ATOM 259 CD2 LEU A 170 1.293 6.348 5.650 1.00 0.60 C ATOM 0 H LEU A 170 2.946 5.878 2.441 1.00 0.31 H new ATOM 0 HA LEU A 170 0.451 5.243 3.438 1.00 0.33 H new ATOM 0 HB2 LEU A 170 1.626 7.918 2.606 1.00 0.42 H new ATOM 0 HB3 LEU A 170 0.160 7.748 3.551 1.00 0.42 H new ATOM 0 HG LEU A 170 2.933 6.838 4.378 1.00 0.52 H new ATOM 0 HD11 LEU A 170 2.732 8.608 6.080 1.00 0.63 H new ATOM 0 HD12 LEU A 170 2.652 9.268 4.429 1.00 0.63 H new ATOM 0 HD13 LEU A 170 1.164 9.088 5.388 1.00 0.63 H new ATOM 0 HD21 LEU A 170 1.897 6.335 6.557 1.00 0.60 H new ATOM 0 HD22 LEU A 170 0.298 6.728 5.882 1.00 0.60 H new ATOM 0 HD23 LEU A 170 1.211 5.336 5.254 1.00 0.60 H new ATOM 271 N LEU A 171 0.273 6.701 0.470 1.00 0.23 N ATOM 272 CA LEU A 171 -0.595 6.898 -0.684 1.00 0.22 C ATOM 273 C LEU A 171 -1.093 5.560 -1.220 1.00 0.18 C ATOM 274 O LEU A 171 -2.271 5.409 -1.542 1.00 0.21 O ATOM 275 CB LEU A 171 0.144 7.657 -1.788 1.00 0.26 C ATOM 276 CG LEU A 171 0.475 9.116 -1.466 1.00 0.33 C ATOM 277 CD1 LEU A 171 1.362 9.711 -2.547 1.00 0.39 C ATOM 278 CD2 LEU A 171 -0.803 9.929 -1.316 1.00 0.40 C ATOM 0 H LEU A 171 1.209 7.094 0.367 1.00 0.23 H new ATOM 0 HA LEU A 171 -1.454 7.488 -0.363 1.00 0.22 H new ATOM 0 HB2 LEU A 171 1.073 7.131 -2.010 1.00 0.26 H new ATOM 0 HB3 LEU A 171 -0.462 7.630 -2.694 1.00 0.26 H new ATOM 0 HG LEU A 171 1.017 9.148 -0.521 1.00 0.33 H new ATOM 0 HD11 LEU A 171 1.588 10.749 -2.302 1.00 0.39 H new ATOM 0 HD12 LEU A 171 2.290 9.143 -2.610 1.00 0.39 H new ATOM 0 HD13 LEU A 171 0.845 9.669 -3.506 1.00 0.39 H new ATOM 0 HD21 LEU A 171 -0.551 10.964 -1.087 1.00 0.40 H new ATOM 0 HD22 LEU A 171 -1.370 9.891 -2.246 1.00 0.40 H new ATOM 0 HD23 LEU A 171 -1.405 9.515 -0.507 1.00 0.40 H new ATOM 290 N SER A 172 -0.190 4.590 -1.310 1.00 0.16 N ATOM 291 CA SER A 172 -0.543 3.266 -1.806 1.00 0.16 C ATOM 292 C SER A 172 -1.661 2.657 -0.968 1.00 0.15 C ATOM 293 O SER A 172 -2.686 2.228 -1.498 1.00 0.19 O ATOM 294 CB SER A 172 0.682 2.350 -1.788 1.00 0.19 C ATOM 295 OG SER A 172 1.669 2.802 -2.699 1.00 0.23 O ATOM 0 H SER A 172 0.790 4.696 -1.046 1.00 0.16 H new ATOM 0 HA SER A 172 -0.895 3.368 -2.832 1.00 0.16 H new ATOM 0 HB2 SER A 172 1.100 2.315 -0.782 1.00 0.19 H new ATOM 0 HB3 SER A 172 0.384 1.333 -2.044 1.00 0.19 H new ATOM 0 HG SER A 172 1.773 2.147 -3.420 1.00 0.23 H new ATOM 301 N HIS A 173 -1.458 2.626 0.345 1.00 0.13 N ATOM 302 CA HIS A 173 -2.451 2.076 1.259 1.00 0.17 C ATOM 303 C HIS A 173 -3.744 2.886 1.204 1.00 0.22 C ATOM 304 O HIS A 173 -4.827 2.331 1.021 1.00 0.27 O ATOM 305 CB HIS A 173 -1.904 2.058 2.688 1.00 0.20 C ATOM 306 CG HIS A 173 -0.704 1.178 2.858 1.00 0.20 C ATOM 307 ND1 HIS A 173 0.582 1.666 2.951 1.00 0.25 N ATOM 308 CD2 HIS A 173 -0.600 -0.170 2.957 1.00 0.25 C ATOM 309 CE1 HIS A 173 1.425 0.658 3.099 1.00 0.29 C ATOM 310 NE2 HIS A 173 0.733 -0.466 3.106 1.00 0.27 N ATOM 0 H HIS A 173 -0.614 2.976 0.799 1.00 0.13 H new ATOM 0 HA HIS A 173 -2.670 1.054 0.950 1.00 0.17 H new ATOM 0 HB2 HIS A 173 -1.643 3.075 2.981 1.00 0.20 H new ATOM 0 HB3 HIS A 173 -2.690 1.722 3.365 1.00 0.20 H new ATOM 0 HD1 HIS A 173 0.843 2.651 2.912 1.00 0.25 H new ATOM 0 HD2 HIS A 173 -1.414 -0.879 2.925 1.00 0.25 H new ATOM 0 HE1 HIS A 173 2.497 0.740 3.197 1.00 0.29 H new ATOM 0 HE2 HIS A 173 1.125 -1.403 3.206 1.00 0.27 H new ATOM 319 N LEU A 174 -3.619 4.201 1.363 1.00 0.23 N ATOM 320 CA LEU A 174 -4.776 5.090 1.335 1.00 0.29 C ATOM 321 C LEU A 174 -5.527 4.973 0.012 1.00 0.29 C ATOM 322 O LEU A 174 -6.739 4.757 -0.006 1.00 0.34 O ATOM 323 CB LEU A 174 -4.340 6.538 1.558 1.00 0.32 C ATOM 324 CG LEU A 174 -3.708 6.823 2.923 1.00 0.36 C ATOM 325 CD1 LEU A 174 -3.229 8.264 2.996 1.00 0.41 C ATOM 326 CD2 LEU A 174 -4.698 6.532 4.040 1.00 0.47 C ATOM 0 H LEU A 174 -2.728 4.674 1.513 1.00 0.23 H new ATOM 0 HA LEU A 174 -5.447 4.790 2.140 1.00 0.29 H new ATOM 0 HB2 LEU A 174 -3.626 6.810 0.781 1.00 0.32 H new ATOM 0 HB3 LEU A 174 -5.208 7.186 1.434 1.00 0.32 H new ATOM 0 HG LEU A 174 -2.847 6.167 3.048 1.00 0.36 H new ATOM 0 HD11 LEU A 174 -2.782 8.450 3.973 1.00 0.41 H new ATOM 0 HD12 LEU A 174 -2.486 8.440 2.218 1.00 0.41 H new ATOM 0 HD13 LEU A 174 -4.074 8.936 2.850 1.00 0.41 H new ATOM 0 HD21 LEU A 174 -4.232 6.740 5.003 1.00 0.47 H new ATOM 0 HD22 LEU A 174 -5.579 7.163 3.919 1.00 0.47 H new ATOM 0 HD23 LEU A 174 -4.994 5.484 4.000 1.00 0.47 H new ATOM 338 N LEU A 175 -4.804 5.115 -1.094 1.00 0.26 N ATOM 339 CA LEU A 175 -5.412 5.022 -2.416 1.00 0.28 C ATOM 340 C LEU A 175 -6.188 3.718 -2.564 1.00 0.27 C ATOM 341 O LEU A 175 -7.352 3.720 -2.963 1.00 0.29 O ATOM 342 CB LEU A 175 -4.343 5.125 -3.507 1.00 0.30 C ATOM 343 CG LEU A 175 -3.733 6.516 -3.687 1.00 0.33 C ATOM 344 CD1 LEU A 175 -2.556 6.463 -4.649 1.00 0.37 C ATOM 345 CD2 LEU A 175 -4.786 7.496 -4.183 1.00 0.41 C ATOM 0 H LEU A 175 -3.800 5.294 -1.101 1.00 0.26 H new ATOM 0 HA LEU A 175 -6.108 5.853 -2.527 1.00 0.28 H new ATOM 0 HB2 LEU A 175 -3.543 4.421 -3.278 1.00 0.30 H new ATOM 0 HB3 LEU A 175 -4.781 4.812 -4.455 1.00 0.30 H new ATOM 0 HG LEU A 175 -3.368 6.861 -2.720 1.00 0.33 H new ATOM 0 HD11 LEU A 175 -2.135 7.462 -4.764 1.00 0.37 H new ATOM 0 HD12 LEU A 175 -1.794 5.791 -4.254 1.00 0.37 H new ATOM 0 HD13 LEU A 175 -2.895 6.098 -5.619 1.00 0.37 H new ATOM 0 HD21 LEU A 175 -4.337 8.481 -4.306 1.00 0.41 H new ATOM 0 HD22 LEU A 175 -5.179 7.154 -5.140 1.00 0.41 H new ATOM 0 HD23 LEU A 175 -5.598 7.556 -3.458 1.00 0.41 H new ATOM 357 N ALA A 176 -5.537 2.606 -2.239 1.00 0.26 N ATOM 358 CA ALA A 176 -6.172 1.297 -2.333 1.00 0.27 C ATOM 359 C ALA A 176 -7.490 1.281 -1.566 1.00 0.26 C ATOM 360 O ALA A 176 -8.533 0.905 -2.106 1.00 0.27 O ATOM 361 CB ALA A 176 -5.236 0.220 -1.808 1.00 0.27 C ATOM 0 H ALA A 176 -4.572 2.585 -1.909 1.00 0.26 H new ATOM 0 HA ALA A 176 -6.387 1.091 -3.382 1.00 0.27 H new ATOM 0 HB1 ALA A 176 -5.722 -0.753 -1.884 1.00 0.27 H new ATOM 0 HB2 ALA A 176 -4.320 0.215 -2.398 1.00 0.27 H new ATOM 0 HB3 ALA A 176 -4.994 0.425 -0.765 1.00 0.27 H new ATOM 367 N ILE A 177 -7.440 1.695 -0.304 1.00 0.27 N ATOM 368 CA ILE A 177 -8.634 1.737 0.527 1.00 0.28 C ATOM 369 C ILE A 177 -9.688 2.634 -0.110 1.00 0.26 C ATOM 370 O ILE A 177 -10.870 2.290 -0.146 1.00 0.26 O ATOM 371 CB ILE A 177 -8.318 2.244 1.950 1.00 0.31 C ATOM 372 CG1 ILE A 177 -7.307 1.318 2.629 1.00 0.36 C ATOM 373 CG2 ILE A 177 -9.590 2.340 2.780 1.00 0.33 C ATOM 374 CD1 ILE A 177 -6.851 1.813 3.984 1.00 0.62 C ATOM 0 H ILE A 177 -6.588 2.005 0.163 1.00 0.27 H new ATOM 0 HA ILE A 177 -9.016 0.719 0.604 1.00 0.28 H new ATOM 0 HB ILE A 177 -7.883 3.241 1.873 1.00 0.31 H new ATOM 0 HG12 ILE A 177 -7.751 0.329 2.743 1.00 0.36 H new ATOM 0 HG13 ILE A 177 -6.438 1.204 1.981 1.00 0.36 H new ATOM 0 HG21 ILE A 177 -9.346 2.699 3.780 1.00 0.33 H new ATOM 0 HG22 ILE A 177 -10.283 3.034 2.304 1.00 0.33 H new ATOM 0 HG23 ILE A 177 -10.053 1.356 2.851 1.00 0.33 H new ATOM 0 HD11 ILE A 177 -6.136 1.108 4.407 1.00 0.62 H new ATOM 0 HD12 ILE A 177 -6.377 2.789 3.874 1.00 0.62 H new ATOM 0 HD13 ILE A 177 -7.711 1.900 4.648 1.00 0.62 H new ATOM 386 N GLY A 178 -9.251 3.781 -0.622 1.00 0.26 N ATOM 387 CA GLY A 178 -10.169 4.701 -1.261 1.00 0.27 C ATOM 388 C GLY A 178 -11.006 4.015 -2.321 1.00 0.26 C ATOM 389 O GLY A 178 -12.214 4.234 -2.408 1.00 0.28 O ATOM 0 H GLY A 178 -8.278 4.088 -0.605 1.00 0.26 H new ATOM 0 HA2 GLY A 178 -10.824 5.142 -0.509 1.00 0.27 H new ATOM 0 HA3 GLY A 178 -9.608 5.519 -1.714 1.00 0.27 H new ATOM 393 N LEU A 179 -10.360 3.181 -3.131 1.00 0.25 N ATOM 394 CA LEU A 179 -11.056 2.447 -4.179 1.00 0.27 C ATOM 395 C LEU A 179 -12.096 1.524 -3.562 1.00 0.26 C ATOM 396 O LEU A 179 -13.222 1.422 -4.049 1.00 0.28 O ATOM 397 CB LEU A 179 -10.069 1.629 -5.016 1.00 0.33 C ATOM 398 CG LEU A 179 -8.994 2.445 -5.734 1.00 0.36 C ATOM 399 CD1 LEU A 179 -8.078 1.533 -6.536 1.00 0.43 C ATOM 400 CD2 LEU A 179 -9.632 3.490 -6.637 1.00 0.43 C ATOM 0 H LEU A 179 -9.358 2.998 -3.081 1.00 0.25 H new ATOM 0 HA LEU A 179 -11.551 3.166 -4.832 1.00 0.27 H new ATOM 0 HB2 LEU A 179 -9.579 0.904 -4.366 1.00 0.33 H new ATOM 0 HB3 LEU A 179 -10.630 1.062 -5.759 1.00 0.33 H new ATOM 0 HG LEU A 179 -8.394 2.960 -4.983 1.00 0.36 H new ATOM 0 HD11 LEU A 179 -7.319 2.132 -7.040 1.00 0.43 H new ATOM 0 HD12 LEU A 179 -7.594 0.823 -5.866 1.00 0.43 H new ATOM 0 HD13 LEU A 179 -8.664 0.990 -7.278 1.00 0.43 H new ATOM 0 HD21 LEU A 179 -8.852 4.061 -7.140 1.00 0.43 H new ATOM 0 HD22 LEU A 179 -10.256 2.995 -7.381 1.00 0.43 H new ATOM 0 HD23 LEU A 179 -10.245 4.163 -6.038 1.00 0.43 H new ATOM 412 N GLY A 180 -11.704 0.850 -2.484 1.00 0.25 N ATOM 413 CA GLY A 180 -12.614 -0.051 -1.804 1.00 0.27 C ATOM 414 C GLY A 180 -13.837 0.668 -1.270 1.00 0.26 C ATOM 415 O GLY A 180 -14.962 0.196 -1.433 1.00 0.29 O ATOM 0 H GLY A 180 -10.773 0.913 -2.071 1.00 0.25 H new ATOM 0 HA2 GLY A 180 -12.927 -0.836 -2.492 1.00 0.27 H new ATOM 0 HA3 GLY A 180 -12.092 -0.539 -0.980 1.00 0.27 H new ATOM 419 N ILE A 181 -13.617 1.812 -0.631 1.00 0.28 N ATOM 420 CA ILE A 181 -14.713 2.599 -0.076 1.00 0.34 C ATOM 421 C ILE A 181 -15.683 3.030 -1.171 1.00 0.32 C ATOM 422 O ILE A 181 -16.900 2.915 -1.019 1.00 0.36 O ATOM 423 CB ILE A 181 -14.196 3.856 0.652 1.00 0.42 C ATOM 424 CG1 ILE A 181 -13.199 3.468 1.746 1.00 0.49 C ATOM 425 CG2 ILE A 181 -15.357 4.642 1.243 1.00 0.49 C ATOM 426 CD1 ILE A 181 -13.788 2.570 2.811 1.00 0.89 C ATOM 0 H ILE A 181 -12.691 2.215 -0.485 1.00 0.28 H new ATOM 0 HA ILE A 181 -15.229 1.960 0.641 1.00 0.34 H new ATOM 0 HB ILE A 181 -13.684 4.489 -0.072 1.00 0.42 H new ATOM 0 HG12 ILE A 181 -12.348 2.964 1.288 1.00 0.49 H new ATOM 0 HG13 ILE A 181 -12.818 4.374 2.217 1.00 0.49 H new ATOM 0 HG21 ILE A 181 -14.975 5.526 1.753 1.00 0.49 H new ATOM 0 HG22 ILE A 181 -16.033 4.947 0.445 1.00 0.49 H new ATOM 0 HG23 ILE A 181 -15.895 4.016 1.955 1.00 0.49 H new ATOM 0 HD11 ILE A 181 -13.024 2.336 3.553 1.00 0.89 H new ATOM 0 HD12 ILE A 181 -14.621 3.079 3.296 1.00 0.89 H new ATOM 0 HD13 ILE A 181 -14.144 1.647 2.353 1.00 0.89 H new ATOM 438 N TYR A 182 -15.134 3.525 -2.276 1.00 0.31 N ATOM 439 CA TYR A 182 -15.945 3.973 -3.402 1.00 0.35 C ATOM 440 C TYR A 182 -16.890 2.868 -3.864 1.00 0.36 C ATOM 441 O TYR A 182 -18.089 3.089 -4.028 1.00 0.42 O ATOM 442 CB TYR A 182 -15.042 4.415 -4.558 1.00 0.39 C ATOM 443 CG TYR A 182 -15.785 4.697 -5.845 1.00 0.51 C ATOM 444 CD1 TYR A 182 -16.678 5.757 -5.939 1.00 1.19 C ATOM 445 CD2 TYR A 182 -15.589 3.902 -6.968 1.00 1.43 C ATOM 446 CE1 TYR A 182 -17.355 6.016 -7.117 1.00 1.21 C ATOM 447 CE2 TYR A 182 -16.262 4.155 -8.148 1.00 1.56 C ATOM 448 CZ TYR A 182 -17.144 5.212 -8.217 1.00 0.81 C ATOM 449 OH TYR A 182 -17.815 5.468 -9.390 1.00 0.98 O ATOM 0 H TYR A 182 -14.129 3.626 -2.415 1.00 0.31 H new ATOM 0 HA TYR A 182 -16.546 4.822 -3.076 1.00 0.35 H new ATOM 0 HB2 TYR A 182 -14.500 5.312 -4.259 1.00 0.39 H new ATOM 0 HB3 TYR A 182 -14.299 3.639 -4.742 1.00 0.39 H new ATOM 0 HD1 TYR A 182 -16.846 6.388 -5.079 1.00 1.19 H new ATOM 0 HD2 TYR A 182 -14.899 3.073 -6.918 1.00 1.43 H new ATOM 0 HE1 TYR A 182 -18.046 6.844 -7.175 1.00 1.21 H new ATOM 0 HE2 TYR A 182 -16.098 3.528 -9.012 1.00 1.56 H new ATOM 0 HH TYR A 182 -17.552 4.810 -10.067 1.00 0.98 H new ATOM 459 N ILE A 183 -16.340 1.680 -4.080 1.00 0.35 N ATOM 460 CA ILE A 183 -17.133 0.541 -4.522 1.00 0.43 C ATOM 461 C ILE A 183 -18.184 0.161 -3.480 1.00 0.45 C ATOM 462 O ILE A 183 -19.351 -0.048 -3.812 1.00 0.55 O ATOM 463 CB ILE A 183 -16.241 -0.679 -4.816 1.00 0.48 C ATOM 464 CG1 ILE A 183 -15.186 -0.319 -5.864 1.00 0.54 C ATOM 465 CG2 ILE A 183 -17.083 -1.855 -5.288 1.00 0.56 C ATOM 466 CD1 ILE A 183 -14.200 -1.434 -6.139 1.00 0.83 C ATOM 0 H ILE A 183 -15.347 1.480 -3.956 1.00 0.35 H new ATOM 0 HA ILE A 183 -17.637 0.841 -5.441 1.00 0.43 H new ATOM 0 HB ILE A 183 -15.734 -0.970 -3.896 1.00 0.48 H new ATOM 0 HG12 ILE A 183 -15.687 -0.051 -6.794 1.00 0.54 H new ATOM 0 HG13 ILE A 183 -14.640 0.563 -5.530 1.00 0.54 H new ATOM 0 HG21 ILE A 183 -16.435 -2.708 -5.491 1.00 0.56 H new ATOM 0 HG22 ILE A 183 -17.802 -2.122 -4.514 1.00 0.56 H new ATOM 0 HG23 ILE A 183 -17.615 -1.579 -6.198 1.00 0.56 H new ATOM 0 HD11 ILE A 183 -13.482 -1.108 -6.892 1.00 0.83 H new ATOM 0 HD12 ILE A 183 -13.672 -1.688 -5.220 1.00 0.83 H new ATOM 0 HD13 ILE A 183 -14.735 -2.311 -6.504 1.00 0.83 H new ATOM 478 N GLY A 184 -17.762 0.072 -2.223 1.00 0.40 N ATOM 479 CA GLY A 184 -18.679 -0.286 -1.153 1.00 0.46 C ATOM 480 C GLY A 184 -19.800 0.721 -0.972 1.00 0.52 C ATOM 481 O GLY A 184 -20.976 0.354 -0.965 1.00 0.64 O ATOM 0 H GLY A 184 -16.801 0.241 -1.925 1.00 0.40 H new ATOM 0 HA2 GLY A 184 -19.108 -1.266 -1.362 1.00 0.46 H new ATOM 0 HA3 GLY A 184 -18.123 -0.374 -0.220 1.00 0.46 H new ATOM 485 N ARG A 185 -19.439 1.993 -0.824 1.00 0.48 N ATOM 486 CA ARG A 185 -20.429 3.051 -0.637 1.00 0.59 C ATOM 487 C ARG A 185 -21.359 3.162 -1.845 1.00 0.67 C ATOM 488 O ARG A 185 -22.415 3.788 -1.766 1.00 0.83 O ATOM 489 CB ARG A 185 -19.734 4.390 -0.379 1.00 0.59 C ATOM 490 CG ARG A 185 -19.056 4.972 -1.605 1.00 0.51 C ATOM 491 CD ARG A 185 -19.964 5.949 -2.335 1.00 0.85 C ATOM 492 NE ARG A 185 -20.230 7.144 -1.539 1.00 1.32 N ATOM 493 CZ ARG A 185 -21.056 8.114 -1.915 1.00 1.98 C ATOM 494 NH1 ARG A 185 -21.700 8.030 -3.071 1.00 2.27 N ATOM 495 NH2 ARG A 185 -21.237 9.171 -1.135 1.00 2.54 N ATOM 0 H ARG A 185 -18.471 2.316 -0.830 1.00 0.48 H new ATOM 0 HA ARG A 185 -21.035 2.792 0.231 1.00 0.59 H new ATOM 0 HB2 ARG A 185 -20.468 5.105 -0.007 1.00 0.59 H new ATOM 0 HB3 ARG A 185 -18.991 4.258 0.408 1.00 0.59 H new ATOM 0 HG2 ARG A 185 -18.138 5.480 -1.308 1.00 0.51 H new ATOM 0 HG3 ARG A 185 -18.770 4.166 -2.281 1.00 0.51 H new ATOM 0 HD2 ARG A 185 -19.502 6.237 -3.279 1.00 0.85 H new ATOM 0 HD3 ARG A 185 -20.906 5.457 -2.578 1.00 0.85 H new ATOM 0 HE ARG A 185 -19.754 7.239 -0.642 1.00 1.32 H new ATOM 0 HH11 ARG A 185 -21.562 7.219 -3.674 1.00 2.27 H new ATOM 0 HH12 ARG A 185 -22.334 8.776 -3.357 1.00 2.27 H new ATOM 0 HH21 ARG A 185 -20.742 9.239 -0.246 1.00 2.54 H new ATOM 0 HH22 ARG A 185 -21.871 9.916 -1.424 1.00 2.54 H new ATOM 509 N ARG A 186 -20.962 2.555 -2.963 1.00 0.63 N ATOM 510 CA ARG A 186 -21.772 2.587 -4.177 1.00 0.74 C ATOM 511 C ARG A 186 -22.701 1.376 -4.247 1.00 0.85 C ATOM 512 O ARG A 186 -23.170 1.005 -5.324 1.00 1.06 O ATOM 513 CB ARG A 186 -20.874 2.625 -5.415 1.00 0.80 C ATOM 514 CG ARG A 186 -20.144 3.945 -5.602 1.00 1.24 C ATOM 515 CD ARG A 186 -20.845 4.834 -6.617 1.00 1.58 C ATOM 516 NE ARG A 186 -22.209 5.167 -6.212 1.00 2.38 N ATOM 517 CZ ARG A 186 -23.144 5.592 -7.057 1.00 2.95 C ATOM 518 NH1 ARG A 186 -22.863 5.731 -8.346 1.00 2.93 N ATOM 519 NH2 ARG A 186 -24.360 5.880 -6.613 1.00 3.95 N ATOM 0 H ARG A 186 -20.088 2.037 -3.052 1.00 0.63 H new ATOM 0 HA ARG A 186 -22.382 3.490 -4.150 1.00 0.74 H new ATOM 0 HB2 ARG A 186 -20.141 1.821 -5.345 1.00 0.80 H new ATOM 0 HB3 ARG A 186 -21.481 2.427 -6.299 1.00 0.80 H new ATOM 0 HG2 ARG A 186 -20.080 4.464 -4.646 1.00 1.24 H new ATOM 0 HG3 ARG A 186 -19.122 3.753 -5.930 1.00 1.24 H new ATOM 0 HD2 ARG A 186 -20.273 5.752 -6.749 1.00 1.58 H new ATOM 0 HD3 ARG A 186 -20.868 4.331 -7.584 1.00 1.58 H new ATOM 0 HE ARG A 186 -22.458 5.068 -5.228 1.00 2.38 H new ATOM 0 HH11 ARG A 186 -21.928 5.512 -8.691 1.00 2.93 H new ATOM 0 HH12 ARG A 186 -23.582 6.057 -8.992 1.00 2.93 H new ATOM 0 HH21 ARG A 186 -24.579 5.776 -5.622 1.00 3.95 H new ATOM 0 HH22 ARG A 186 -25.076 6.206 -7.262 1.00 3.95 H new ATOM 533 N LEU A 187 -22.962 0.759 -3.096 1.00 0.93 N ATOM 534 CA LEU A 187 -23.836 -0.405 -3.033 1.00 1.08 C ATOM 535 C LEU A 187 -25.232 -0.010 -2.567 1.00 1.31 C ATOM 536 O LEU A 187 -26.133 0.205 -3.379 1.00 1.52 O ATOM 537 CB LEU A 187 -23.251 -1.458 -2.088 1.00 1.05 C ATOM 538 CG LEU A 187 -22.062 -2.235 -2.647 1.00 1.00 C ATOM 539 CD1 LEU A 187 -21.531 -3.217 -1.614 1.00 1.13 C ATOM 540 CD2 LEU A 187 -22.471 -2.960 -3.914 1.00 1.23 C ATOM 0 H LEU A 187 -22.579 1.048 -2.196 1.00 0.93 H new ATOM 0 HA LEU A 187 -23.911 -0.827 -4.035 1.00 1.08 H new ATOM 0 HB2 LEU A 187 -22.943 -0.966 -1.165 1.00 1.05 H new ATOM 0 HB3 LEU A 187 -24.037 -2.166 -1.825 1.00 1.05 H new ATOM 0 HG LEU A 187 -21.263 -1.533 -2.886 1.00 1.00 H new ATOM 0 HD11 LEU A 187 -20.684 -3.761 -2.031 1.00 1.13 H new ATOM 0 HD12 LEU A 187 -21.211 -2.673 -0.726 1.00 1.13 H new ATOM 0 HD13 LEU A 187 -22.317 -3.922 -1.344 1.00 1.13 H new ATOM 0 HD21 LEU A 187 -21.618 -3.513 -4.308 1.00 1.23 H new ATOM 0 HD22 LEU A 187 -23.281 -3.654 -3.691 1.00 1.23 H new ATOM 0 HD23 LEU A 187 -22.808 -2.235 -4.655 1.00 1.23 H new ATOM 552 N THR A 188 -25.401 0.084 -1.255 1.00 1.39 N ATOM 553 CA THR A 188 -26.685 0.457 -0.675 1.00 1.70 C ATOM 554 C THR A 188 -26.656 1.889 -0.150 1.00 2.02 C ATOM 555 O THR A 188 -26.395 2.073 1.057 1.00 2.43 O ATOM 556 CB THR A 188 -27.080 -0.494 0.471 1.00 2.42 C ATOM 557 OG1 THR A 188 -28.181 0.054 1.206 1.00 2.91 O ATOM 558 CG2 THR A 188 -25.905 -0.737 1.407 1.00 3.05 C ATOM 559 OXT THR A 188 -26.893 2.815 -0.953 1.00 2.74 O ATOM 0 H THR A 188 -24.665 -0.093 -0.571 1.00 1.39 H new ATOM 0 HA THR A 188 -27.427 0.381 -1.470 1.00 1.70 H new ATOM 0 HB THR A 188 -27.375 -1.448 0.035 1.00 2.42 H new ATOM 0 HG1 THR A 188 -27.866 0.799 1.760 1.00 2.91 H new ATOM 0 HG21 THR A 188 -26.210 -1.411 2.207 1.00 3.05 H new ATOM 0 HG22 THR A 188 -25.082 -1.185 0.849 1.00 3.05 H new ATOM 0 HG23 THR A 188 -25.579 0.211 1.836 1.00 3.05 H new TER 567 THR A 188 ATOM 568 N GLY B 154 20.057 -2.466 -6.923 1.00 7.40 N ATOM 569 CA GLY B 154 21.461 -2.181 -7.328 1.00 7.27 C ATOM 570 C GLY B 154 22.447 -2.400 -6.198 1.00 7.05 C ATOM 571 O GLY B 154 22.521 -1.600 -5.265 1.00 7.46 O ATOM 0 HA2 GLY B 154 21.730 -2.820 -8.169 1.00 7.27 H new ATOM 0 HA3 GLY B 154 21.534 -1.150 -7.675 1.00 7.27 H new ATOM 577 N GLY B 155 23.207 -3.487 -6.280 1.00 6.55 N ATOM 578 CA GLY B 155 24.183 -3.787 -5.251 1.00 6.48 C ATOM 579 C GLY B 155 24.518 -5.263 -5.181 1.00 6.39 C ATOM 580 O GLY B 155 24.296 -6.003 -6.140 1.00 6.42 O ATOM 0 H GLY B 155 23.164 -4.165 -7.041 1.00 6.55 H new ATOM 0 HA2 GLY B 155 25.094 -3.220 -5.442 1.00 6.48 H new ATOM 0 HA3 GLY B 155 23.800 -3.459 -4.285 1.00 6.48 H new ATOM 584 N ILE B 156 25.053 -5.691 -4.044 1.00 6.43 N ATOM 585 CA ILE B 156 25.421 -7.087 -3.848 1.00 6.52 C ATOM 586 C ILE B 156 24.186 -7.972 -3.727 1.00 6.01 C ATOM 587 O ILE B 156 24.072 -8.995 -4.403 1.00 6.10 O ATOM 588 CB ILE B 156 26.286 -7.265 -2.586 1.00 6.85 C ATOM 589 CG1 ILE B 156 27.480 -6.312 -2.624 1.00 7.40 C ATOM 590 CG2 ILE B 156 26.754 -8.708 -2.463 1.00 7.17 C ATOM 591 CD1 ILE B 156 28.323 -6.353 -1.369 1.00 7.86 C ATOM 0 H ILE B 156 25.242 -5.089 -3.242 1.00 6.43 H new ATOM 0 HA ILE B 156 25.996 -7.387 -4.724 1.00 6.52 H new ATOM 0 HB ILE B 156 25.682 -7.026 -1.711 1.00 6.85 H new ATOM 0 HG12 ILE B 156 28.106 -6.560 -3.481 1.00 7.40 H new ATOM 0 HG13 ILE B 156 27.119 -5.295 -2.777 1.00 7.40 H new ATOM 0 HG21 ILE B 156 27.364 -8.817 -1.566 1.00 7.17 H new ATOM 0 HG22 ILE B 156 25.888 -9.367 -2.396 1.00 7.17 H new ATOM 0 HG23 ILE B 156 27.345 -8.975 -3.339 1.00 7.17 H new ATOM 0 HD11 ILE B 156 29.152 -5.652 -1.465 1.00 7.86 H new ATOM 0 HD12 ILE B 156 27.711 -6.076 -0.511 1.00 7.86 H new ATOM 0 HD13 ILE B 156 28.714 -7.360 -1.226 1.00 7.86 H new ATOM 603 N PHE B 157 23.261 -7.569 -2.863 1.00 5.61 N ATOM 604 CA PHE B 157 22.032 -8.324 -2.647 1.00 5.13 C ATOM 605 C PHE B 157 21.051 -8.124 -3.798 1.00 4.75 C ATOM 606 O PHE B 157 20.737 -9.064 -4.528 1.00 4.74 O ATOM 607 CB PHE B 157 21.372 -7.898 -1.334 1.00 4.94 C ATOM 608 CG PHE B 157 22.227 -8.148 -0.124 1.00 5.41 C ATOM 609 CD1 PHE B 157 22.799 -9.393 0.092 1.00 5.51 C ATOM 610 CD2 PHE B 157 22.456 -7.140 0.798 1.00 6.05 C ATOM 611 CE1 PHE B 157 23.585 -9.625 1.204 1.00 6.07 C ATOM 612 CE2 PHE B 157 23.241 -7.367 1.913 1.00 6.60 C ATOM 613 CZ PHE B 157 23.806 -8.611 2.116 1.00 6.54 C ATOM 0 H PHE B 157 23.339 -6.722 -2.300 1.00 5.61 H new ATOM 0 HA PHE B 157 22.296 -9.380 -2.596 1.00 5.13 H new ATOM 0 HB2 PHE B 157 21.131 -6.836 -1.386 1.00 4.94 H new ATOM 0 HB3 PHE B 157 20.430 -8.434 -1.220 1.00 4.94 H new ATOM 0 HD1 PHE B 157 22.628 -10.190 -0.617 1.00 5.51 H new ATOM 0 HD2 PHE B 157 22.016 -6.166 0.644 1.00 6.05 H new ATOM 0 HE1 PHE B 157 24.026 -10.598 1.360 1.00 6.07 H new ATOM 0 HE2 PHE B 157 23.412 -6.573 2.624 1.00 6.60 H new ATOM 0 HZ PHE B 157 24.420 -8.791 2.986 1.00 6.54 H new ATOM 623 N SER B 158 20.574 -6.895 -3.952 1.00 4.58 N ATOM 624 CA SER B 158 19.621 -6.571 -5.006 1.00 4.37 C ATOM 625 C SER B 158 18.406 -7.493 -4.944 1.00 3.99 C ATOM 626 O SER B 158 17.410 -7.173 -4.298 1.00 3.65 O ATOM 627 CB SER B 158 20.291 -6.666 -6.379 1.00 4.69 C ATOM 628 OG SER B 158 19.345 -6.498 -7.420 1.00 5.34 O ATOM 0 H SER B 158 20.832 -6.106 -3.360 1.00 4.58 H new ATOM 0 HA SER B 158 19.280 -5.547 -4.853 1.00 4.37 H new ATOM 0 HB2 SER B 158 21.067 -5.905 -6.462 1.00 4.69 H new ATOM 0 HB3 SER B 158 20.782 -7.634 -6.482 1.00 4.69 H new ATOM 0 HG SER B 158 19.798 -6.561 -8.287 1.00 5.34 H new ATOM 634 N ALA B 159 18.490 -8.643 -5.604 1.00 4.16 N ATOM 635 CA ALA B 159 17.383 -9.592 -5.613 1.00 3.90 C ATOM 636 C ALA B 159 16.990 -9.988 -4.193 1.00 3.60 C ATOM 637 O ALA B 159 15.832 -9.855 -3.799 1.00 3.22 O ATOM 638 CB ALA B 159 17.750 -10.825 -6.425 1.00 4.29 C ATOM 0 H ALA B 159 19.308 -8.939 -6.137 1.00 4.16 H new ATOM 0 HA ALA B 159 16.525 -9.108 -6.079 1.00 3.90 H new ATOM 0 HB1 ALA B 159 16.914 -11.524 -6.423 1.00 4.29 H new ATOM 0 HB2 ALA B 159 17.975 -10.532 -7.450 1.00 4.29 H new ATOM 0 HB3 ALA B 159 18.625 -11.304 -5.985 1.00 4.29 H new ATOM 644 N GLU B 160 17.963 -10.467 -3.426 1.00 3.85 N ATOM 645 CA GLU B 160 17.715 -10.887 -2.051 1.00 3.76 C ATOM 646 C GLU B 160 17.090 -9.759 -1.236 1.00 3.40 C ATOM 647 O GLU B 160 16.268 -10.001 -0.353 1.00 3.20 O ATOM 648 CB GLU B 160 19.018 -11.344 -1.393 1.00 4.23 C ATOM 649 CG GLU B 160 18.825 -11.917 0.001 1.00 4.68 C ATOM 650 CD GLU B 160 17.920 -13.133 0.012 1.00 5.24 C ATOM 651 OE1 GLU B 160 18.429 -14.252 -0.211 1.00 5.52 O ATOM 652 OE2 GLU B 160 16.704 -12.967 0.242 1.00 5.73 O ATOM 0 H GLU B 160 18.930 -10.574 -3.732 1.00 3.85 H new ATOM 0 HA GLU B 160 17.014 -11.721 -2.076 1.00 3.76 H new ATOM 0 HB2 GLU B 160 19.490 -12.097 -2.024 1.00 4.23 H new ATOM 0 HB3 GLU B 160 19.704 -10.499 -1.338 1.00 4.23 H new ATOM 0 HG2 GLU B 160 19.796 -12.188 0.416 1.00 4.68 H new ATOM 0 HG3 GLU B 160 18.404 -11.149 0.650 1.00 4.68 H new ATOM 659 N PHE B 161 17.482 -8.526 -1.538 1.00 3.41 N ATOM 660 CA PHE B 161 16.959 -7.364 -0.828 1.00 3.14 C ATOM 661 C PHE B 161 15.547 -7.026 -1.297 1.00 2.66 C ATOM 662 O PHE B 161 14.617 -6.947 -0.493 1.00 2.36 O ATOM 663 CB PHE B 161 17.878 -6.158 -1.036 1.00 3.41 C ATOM 664 CG PHE B 161 17.438 -4.929 -0.290 1.00 3.29 C ATOM 665 CD1 PHE B 161 16.337 -4.203 -0.715 1.00 3.38 C ATOM 666 CD2 PHE B 161 18.123 -4.502 0.836 1.00 3.56 C ATOM 667 CE1 PHE B 161 15.929 -3.072 -0.032 1.00 3.38 C ATOM 668 CE2 PHE B 161 17.720 -3.373 1.523 1.00 3.54 C ATOM 669 CZ PHE B 161 16.622 -2.657 1.089 1.00 3.27 C ATOM 0 H PHE B 161 18.159 -8.305 -2.268 1.00 3.41 H new ATOM 0 HA PHE B 161 16.921 -7.607 0.234 1.00 3.14 H new ATOM 0 HB2 PHE B 161 18.887 -6.422 -0.720 1.00 3.41 H new ATOM 0 HB3 PHE B 161 17.927 -5.928 -2.100 1.00 3.41 H new ATOM 0 HD1 PHE B 161 15.791 -4.524 -1.590 1.00 3.38 H new ATOM 0 HD2 PHE B 161 18.982 -5.058 1.181 1.00 3.56 H new ATOM 0 HE1 PHE B 161 15.070 -2.514 -0.374 1.00 3.38 H new ATOM 0 HE2 PHE B 161 18.263 -3.051 2.399 1.00 3.54 H new ATOM 0 HZ PHE B 161 16.305 -1.774 1.625 1.00 3.27 H new ATOM 679 N LEU B 162 15.393 -6.830 -2.603 1.00 2.66 N ATOM 680 CA LEU B 162 14.096 -6.497 -3.182 1.00 2.34 C ATOM 681 C LEU B 162 13.091 -7.626 -2.968 1.00 2.05 C ATOM 682 O LEU B 162 11.887 -7.387 -2.870 1.00 1.74 O ATOM 683 CB LEU B 162 14.242 -6.204 -4.676 1.00 2.65 C ATOM 684 CG LEU B 162 15.247 -5.104 -5.024 1.00 2.99 C ATOM 685 CD1 LEU B 162 15.309 -4.891 -6.528 1.00 3.37 C ATOM 686 CD2 LEU B 162 14.888 -3.810 -4.313 1.00 2.86 C ATOM 0 H LEU B 162 16.152 -6.896 -3.281 1.00 2.66 H new ATOM 0 HA LEU B 162 13.722 -5.606 -2.677 1.00 2.34 H new ATOM 0 HB2 LEU B 162 14.540 -7.121 -5.183 1.00 2.65 H new ATOM 0 HB3 LEU B 162 13.267 -5.923 -5.073 1.00 2.65 H new ATOM 0 HG LEU B 162 16.233 -5.420 -4.684 1.00 2.99 H new ATOM 0 HD11 LEU B 162 16.029 -4.105 -6.755 1.00 3.37 H new ATOM 0 HD12 LEU B 162 15.617 -5.817 -7.014 1.00 3.37 H new ATOM 0 HD13 LEU B 162 14.325 -4.599 -6.895 1.00 3.37 H new ATOM 0 HD21 LEU B 162 15.614 -3.039 -4.572 1.00 2.86 H new ATOM 0 HD22 LEU B 162 13.893 -3.490 -4.621 1.00 2.86 H new ATOM 0 HD23 LEU B 162 14.900 -3.972 -3.235 1.00 2.86 H new ATOM 698 N LYS B 163 13.592 -8.855 -2.899 1.00 2.25 N ATOM 699 CA LYS B 163 12.735 -10.018 -2.695 1.00 2.14 C ATOM 700 C LYS B 163 11.903 -9.870 -1.425 1.00 1.89 C ATOM 701 O LYS B 163 10.745 -10.286 -1.378 1.00 1.77 O ATOM 702 CB LYS B 163 13.581 -11.292 -2.622 1.00 2.52 C ATOM 703 CG LYS B 163 13.922 -11.878 -3.984 1.00 2.86 C ATOM 704 CD LYS B 163 15.030 -12.913 -3.884 1.00 3.27 C ATOM 705 CE LYS B 163 14.699 -13.985 -2.859 1.00 3.42 C ATOM 706 NZ LYS B 163 13.423 -14.680 -3.177 1.00 3.86 N ATOM 0 H LYS B 163 14.585 -9.072 -2.981 1.00 2.25 H new ATOM 0 HA LYS B 163 12.054 -10.089 -3.543 1.00 2.14 H new ATOM 0 HB2 LYS B 163 14.506 -11.073 -2.088 1.00 2.52 H new ATOM 0 HB3 LYS B 163 13.045 -12.040 -2.038 1.00 2.52 H new ATOM 0 HG2 LYS B 163 13.033 -12.336 -4.417 1.00 2.86 H new ATOM 0 HG3 LYS B 163 14.229 -11.079 -4.658 1.00 2.86 H new ATOM 0 HD2 LYS B 163 15.186 -13.376 -4.858 1.00 3.27 H new ATOM 0 HD3 LYS B 163 15.964 -12.422 -3.610 1.00 3.27 H new ATOM 0 HE2 LYS B 163 15.509 -14.713 -2.820 1.00 3.42 H new ATOM 0 HE3 LYS B 163 14.629 -13.533 -1.870 1.00 3.42 H new ATOM 0 HZ1 LYS B 163 13.300 -15.490 -2.536 1.00 3.86 H new ATOM 0 HZ2 LYS B 163 12.629 -14.020 -3.057 1.00 3.86 H new ATOM 0 HZ3 LYS B 163 13.447 -15.017 -4.161 1.00 3.86 H new ATOM 720 N VAL B 164 12.499 -9.276 -0.396 1.00 1.96 N ATOM 721 CA VAL B 164 11.809 -9.073 0.874 1.00 1.90 C ATOM 722 C VAL B 164 11.264 -7.654 0.983 1.00 1.71 C ATOM 723 O VAL B 164 11.128 -7.113 2.082 1.00 1.94 O ATOM 724 CB VAL B 164 12.743 -9.342 2.069 1.00 2.30 C ATOM 725 CG1 VAL B 164 13.255 -10.773 2.036 1.00 2.46 C ATOM 726 CG2 VAL B 164 13.900 -8.354 2.076 1.00 2.87 C ATOM 0 H VAL B 164 13.457 -8.927 -0.416 1.00 1.96 H new ATOM 0 HA VAL B 164 10.981 -9.781 0.900 1.00 1.90 H new ATOM 0 HB VAL B 164 12.174 -9.206 2.989 1.00 2.30 H new ATOM 0 HG11 VAL B 164 13.913 -10.944 2.888 1.00 2.46 H new ATOM 0 HG12 VAL B 164 12.412 -11.462 2.085 1.00 2.46 H new ATOM 0 HG13 VAL B 164 13.808 -10.940 1.111 1.00 2.46 H new ATOM 0 HG21 VAL B 164 14.549 -8.560 2.927 1.00 2.87 H new ATOM 0 HG22 VAL B 164 14.470 -8.455 1.152 1.00 2.87 H new ATOM 0 HG23 VAL B 164 13.511 -7.339 2.153 1.00 2.87 H new ATOM 736 N PHE B 165 10.950 -7.053 -0.162 1.00 1.47 N ATOM 737 CA PHE B 165 10.423 -5.693 -0.192 1.00 1.36 C ATOM 738 C PHE B 165 9.362 -5.538 -1.276 1.00 1.08 C ATOM 739 O PHE B 165 8.291 -4.979 -1.036 1.00 0.94 O ATOM 740 CB PHE B 165 11.559 -4.696 -0.429 1.00 1.64 C ATOM 741 CG PHE B 165 11.090 -3.280 -0.592 1.00 1.70 C ATOM 742 CD1 PHE B 165 10.546 -2.590 0.479 1.00 1.78 C ATOM 743 CD2 PHE B 165 11.190 -2.640 -1.817 1.00 2.38 C ATOM 744 CE1 PHE B 165 10.111 -1.288 0.331 1.00 1.96 C ATOM 745 CE2 PHE B 165 10.756 -1.337 -1.970 1.00 2.48 C ATOM 746 CZ PHE B 165 10.216 -0.660 -0.894 1.00 2.01 C ATOM 0 H PHE B 165 11.051 -7.486 -1.080 1.00 1.47 H new ATOM 0 HA PHE B 165 9.958 -5.489 0.772 1.00 1.36 H new ATOM 0 HB2 PHE B 165 12.255 -4.745 0.408 1.00 1.64 H new ATOM 0 HB3 PHE B 165 12.111 -4.992 -1.321 1.00 1.64 H new ATOM 0 HD1 PHE B 165 10.461 -3.076 1.440 1.00 1.78 H new ATOM 0 HD2 PHE B 165 11.612 -3.165 -2.661 1.00 2.38 H new ATOM 0 HE1 PHE B 165 9.689 -0.761 1.174 1.00 1.96 H new ATOM 0 HE2 PHE B 165 10.839 -0.849 -2.930 1.00 2.48 H new ATOM 0 HZ PHE B 165 9.877 0.359 -1.011 1.00 2.01 H new ATOM 756 N LEU B 166 9.666 -6.036 -2.468 1.00 1.17 N ATOM 757 CA LEU B 166 8.745 -5.951 -3.594 1.00 1.12 C ATOM 758 C LEU B 166 7.383 -6.567 -3.263 1.00 0.85 C ATOM 759 O LEU B 166 6.363 -5.881 -3.323 1.00 0.92 O ATOM 760 CB LEU B 166 9.349 -6.623 -4.832 1.00 1.40 C ATOM 761 CG LEU B 166 10.577 -5.920 -5.414 1.00 1.78 C ATOM 762 CD1 LEU B 166 11.103 -6.675 -6.624 1.00 2.14 C ATOM 763 CD2 LEU B 166 10.243 -4.483 -5.785 1.00 2.03 C ATOM 0 H LEU B 166 10.547 -6.505 -2.680 1.00 1.17 H new ATOM 0 HA LEU B 166 8.585 -4.894 -3.807 1.00 1.12 H new ATOM 0 HB2 LEU B 166 9.623 -7.646 -4.575 1.00 1.40 H new ATOM 0 HB3 LEU B 166 8.583 -6.683 -5.605 1.00 1.40 H new ATOM 0 HG LEU B 166 11.357 -5.907 -4.653 1.00 1.78 H new ATOM 0 HD11 LEU B 166 11.976 -6.159 -7.023 1.00 2.14 H new ATOM 0 HD12 LEU B 166 11.383 -7.686 -6.329 1.00 2.14 H new ATOM 0 HD13 LEU B 166 10.328 -6.722 -7.389 1.00 2.14 H new ATOM 0 HD21 LEU B 166 11.128 -3.999 -6.197 1.00 2.03 H new ATOM 0 HD22 LEU B 166 9.446 -4.475 -6.528 1.00 2.03 H new ATOM 0 HD23 LEU B 166 9.916 -3.944 -4.896 1.00 2.03 H new ATOM 775 N PRO B 167 7.342 -7.866 -2.899 1.00 0.73 N ATOM 776 CA PRO B 167 6.085 -8.554 -2.576 1.00 0.63 C ATOM 777 C PRO B 167 5.275 -7.832 -1.503 1.00 0.56 C ATOM 778 O PRO B 167 4.060 -7.682 -1.628 1.00 0.69 O ATOM 779 CB PRO B 167 6.533 -9.933 -2.068 1.00 0.87 C ATOM 780 CG PRO B 167 7.999 -9.814 -1.822 1.00 1.07 C ATOM 781 CD PRO B 167 8.498 -8.765 -2.771 1.00 0.96 C ATOM 0 HA PRO B 167 5.427 -8.601 -3.444 1.00 0.63 H new ATOM 0 HB2 PRO B 167 6.003 -10.205 -1.155 1.00 0.87 H new ATOM 0 HB3 PRO B 167 6.321 -10.709 -2.803 1.00 0.87 H new ATOM 0 HG2 PRO B 167 8.199 -9.531 -0.789 1.00 1.07 H new ATOM 0 HG3 PRO B 167 8.501 -10.766 -1.994 1.00 1.07 H new ATOM 0 HD2 PRO B 167 9.372 -8.246 -2.377 1.00 0.96 H new ATOM 0 HD3 PRO B 167 8.786 -9.192 -3.731 1.00 0.96 H new ATOM 789 N SER B 168 5.951 -7.390 -0.450 1.00 0.55 N ATOM 790 CA SER B 168 5.286 -6.689 0.643 1.00 0.55 C ATOM 791 C SER B 168 4.411 -5.556 0.116 1.00 0.44 C ATOM 792 O SER B 168 3.282 -5.370 0.570 1.00 0.41 O ATOM 793 CB SER B 168 6.320 -6.136 1.626 1.00 0.72 C ATOM 794 OG SER B 168 7.079 -7.181 2.211 1.00 1.59 O ATOM 0 H SER B 168 6.957 -7.504 -0.329 1.00 0.55 H new ATOM 0 HA SER B 168 4.647 -7.404 1.161 1.00 0.55 H new ATOM 0 HB2 SER B 168 6.985 -5.445 1.108 1.00 0.72 H new ATOM 0 HB3 SER B 168 5.816 -5.567 2.407 1.00 0.72 H new ATOM 0 HG SER B 168 7.733 -6.801 2.834 1.00 1.59 H new ATOM 800 N LEU B 169 4.937 -4.804 -0.843 1.00 0.46 N ATOM 801 CA LEU B 169 4.205 -3.686 -1.428 1.00 0.45 C ATOM 802 C LEU B 169 2.929 -4.161 -2.119 1.00 0.33 C ATOM 803 O LEU B 169 1.867 -3.555 -1.964 1.00 0.31 O ATOM 804 CB LEU B 169 5.091 -2.933 -2.422 1.00 0.60 C ATOM 805 CG LEU B 169 6.363 -2.331 -1.821 1.00 0.77 C ATOM 806 CD1 LEU B 169 7.045 -1.414 -2.823 1.00 1.09 C ATOM 807 CD2 LEU B 169 6.044 -1.580 -0.538 1.00 0.77 C ATOM 0 H LEU B 169 5.869 -4.948 -1.233 1.00 0.46 H new ATOM 0 HA LEU B 169 3.922 -3.012 -0.620 1.00 0.45 H new ATOM 0 HB2 LEU B 169 5.373 -3.615 -3.225 1.00 0.60 H new ATOM 0 HB3 LEU B 169 4.506 -2.132 -2.874 1.00 0.60 H new ATOM 0 HG LEU B 169 7.048 -3.144 -1.580 1.00 0.77 H new ATOM 0 HD11 LEU B 169 7.947 -0.995 -2.378 1.00 1.09 H new ATOM 0 HD12 LEU B 169 7.310 -1.982 -3.714 1.00 1.09 H new ATOM 0 HD13 LEU B 169 6.367 -0.606 -3.097 1.00 1.09 H new ATOM 0 HD21 LEU B 169 6.961 -1.159 -0.125 1.00 0.77 H new ATOM 0 HD22 LEU B 169 5.340 -0.776 -0.752 1.00 0.77 H new ATOM 0 HD23 LEU B 169 5.602 -2.266 0.185 1.00 0.77 H new ATOM 819 N LEU B 170 3.033 -5.248 -2.878 1.00 0.34 N ATOM 820 CA LEU B 170 1.879 -5.793 -3.586 1.00 0.36 C ATOM 821 C LEU B 170 0.785 -6.199 -2.605 1.00 0.28 C ATOM 822 O LEU B 170 -0.377 -5.825 -2.763 1.00 0.32 O ATOM 823 CB LEU B 170 2.281 -6.995 -4.445 1.00 0.47 C ATOM 824 CG LEU B 170 3.089 -6.665 -5.703 1.00 0.59 C ATOM 825 CD1 LEU B 170 4.453 -6.101 -5.339 1.00 0.60 C ATOM 826 CD2 LEU B 170 3.240 -7.902 -6.575 1.00 0.72 C ATOM 0 H LEU B 170 3.900 -5.767 -3.018 1.00 0.34 H new ATOM 0 HA LEU B 170 1.492 -5.012 -4.240 1.00 0.36 H new ATOM 0 HB2 LEU B 170 2.863 -7.681 -3.830 1.00 0.47 H new ATOM 0 HB3 LEU B 170 1.376 -7.525 -4.744 1.00 0.47 H new ATOM 0 HG LEU B 170 2.547 -5.905 -6.266 1.00 0.59 H new ATOM 0 HD11 LEU B 170 5.008 -5.875 -6.249 1.00 0.60 H new ATOM 0 HD12 LEU B 170 4.326 -5.189 -4.755 1.00 0.60 H new ATOM 0 HD13 LEU B 170 5.005 -6.834 -4.751 1.00 0.60 H new ATOM 0 HD21 LEU B 170 3.817 -7.651 -7.465 1.00 0.72 H new ATOM 0 HD22 LEU B 170 3.757 -8.681 -6.015 1.00 0.72 H new ATOM 0 HD23 LEU B 170 2.254 -8.261 -6.870 1.00 0.72 H new ATOM 838 N LEU B 171 1.166 -6.966 -1.588 1.00 0.24 N ATOM 839 CA LEU B 171 0.219 -7.421 -0.579 1.00 0.26 C ATOM 840 C LEU B 171 -0.540 -6.244 0.025 1.00 0.23 C ATOM 841 O LEU B 171 -1.752 -6.312 0.228 1.00 0.29 O ATOM 842 CB LEU B 171 0.948 -8.194 0.522 1.00 0.32 C ATOM 843 CG LEU B 171 1.713 -9.431 0.043 1.00 0.38 C ATOM 844 CD1 LEU B 171 2.435 -10.096 1.206 1.00 0.47 C ATOM 845 CD2 LEU B 171 0.769 -10.414 -0.633 1.00 0.50 C ATOM 0 H LEU B 171 2.124 -7.285 -1.442 1.00 0.24 H new ATOM 0 HA LEU B 171 -0.500 -8.083 -1.062 1.00 0.26 H new ATOM 0 HB2 LEU B 171 1.648 -7.520 1.016 1.00 0.32 H new ATOM 0 HB3 LEU B 171 0.220 -8.503 1.272 1.00 0.32 H new ATOM 0 HG LEU B 171 2.458 -9.113 -0.687 1.00 0.38 H new ATOM 0 HD11 LEU B 171 2.973 -10.973 0.847 1.00 0.47 H new ATOM 0 HD12 LEU B 171 3.141 -9.392 1.646 1.00 0.47 H new ATOM 0 HD13 LEU B 171 1.708 -10.400 1.960 1.00 0.47 H new ATOM 0 HD21 LEU B 171 1.330 -11.287 -0.967 1.00 0.50 H new ATOM 0 HD22 LEU B 171 0.001 -10.726 0.074 1.00 0.50 H new ATOM 0 HD23 LEU B 171 0.299 -9.935 -1.492 1.00 0.50 H new ATOM 857 N SER B 172 0.182 -5.163 0.309 1.00 0.18 N ATOM 858 CA SER B 172 -0.426 -3.971 0.890 1.00 0.19 C ATOM 859 C SER B 172 -1.531 -3.427 -0.010 1.00 0.14 C ATOM 860 O SER B 172 -2.641 -3.155 0.450 1.00 0.18 O ATOM 861 CB SER B 172 0.632 -2.892 1.126 1.00 0.23 C ATOM 862 OG SER B 172 1.575 -3.305 2.100 1.00 0.31 O ATOM 0 H SER B 172 1.186 -5.089 0.146 1.00 0.18 H new ATOM 0 HA SER B 172 -0.867 -4.252 1.847 1.00 0.19 H new ATOM 0 HB2 SER B 172 1.145 -2.671 0.190 1.00 0.23 H new ATOM 0 HB3 SER B 172 0.149 -1.970 1.451 1.00 0.23 H new ATOM 0 HG SER B 172 2.166 -3.986 1.715 1.00 0.31 H new ATOM 868 N HIS B 173 -1.221 -3.268 -1.293 1.00 0.12 N ATOM 869 CA HIS B 173 -2.193 -2.755 -2.255 1.00 0.15 C ATOM 870 C HIS B 173 -3.433 -3.642 -2.309 1.00 0.20 C ATOM 871 O HIS B 173 -4.556 -3.161 -2.167 1.00 0.25 O ATOM 872 CB HIS B 173 -1.567 -2.662 -3.647 1.00 0.19 C ATOM 873 CG HIS B 173 -0.460 -1.659 -3.749 1.00 0.21 C ATOM 874 ND1 HIS B 173 0.875 -2.008 -3.738 1.00 0.26 N ATOM 875 CD2 HIS B 173 -0.494 -0.311 -3.878 1.00 0.25 C ATOM 876 CE1 HIS B 173 1.612 -0.917 -3.857 1.00 0.30 C ATOM 877 NE2 HIS B 173 0.806 0.124 -3.944 1.00 0.28 N ATOM 0 H HIS B 173 -0.307 -3.486 -1.691 1.00 0.12 H new ATOM 0 HA HIS B 173 -2.492 -1.759 -1.927 1.00 0.15 H new ATOM 0 HB2 HIS B 173 -1.183 -3.643 -3.928 1.00 0.19 H new ATOM 0 HB3 HIS B 173 -2.344 -2.406 -4.368 1.00 0.19 H new ATOM 0 HD1 HIS B 173 1.236 -2.958 -3.652 1.00 0.26 H new ATOM 0 HD2 HIS B 173 -1.379 0.306 -3.921 1.00 0.25 H new ATOM 0 HE1 HIS B 173 2.691 -0.883 -3.879 1.00 0.30 H new ATOM 886 N LEU B 174 -3.223 -4.938 -2.511 1.00 0.21 N ATOM 887 CA LEU B 174 -4.329 -5.886 -2.590 1.00 0.28 C ATOM 888 C LEU B 174 -5.143 -5.890 -1.300 1.00 0.28 C ATOM 889 O LEU B 174 -6.364 -5.740 -1.326 1.00 0.31 O ATOM 890 CB LEU B 174 -3.803 -7.293 -2.881 1.00 0.32 C ATOM 891 CG LEU B 174 -3.019 -7.435 -4.187 1.00 0.34 C ATOM 892 CD1 LEU B 174 -2.570 -8.874 -4.387 1.00 0.40 C ATOM 893 CD2 LEU B 174 -3.861 -6.970 -5.367 1.00 0.44 C ATOM 0 H LEU B 174 -2.299 -5.356 -2.623 1.00 0.21 H new ATOM 0 HA LEU B 174 -4.982 -5.573 -3.405 1.00 0.28 H new ATOM 0 HB2 LEU B 174 -3.162 -7.603 -2.055 1.00 0.32 H new ATOM 0 HB3 LEU B 174 -4.647 -7.982 -2.905 1.00 0.32 H new ATOM 0 HG LEU B 174 -2.132 -6.804 -4.126 1.00 0.34 H new ATOM 0 HD11 LEU B 174 -2.014 -8.955 -5.321 1.00 0.40 H new ATOM 0 HD12 LEU B 174 -1.931 -9.174 -3.557 1.00 0.40 H new ATOM 0 HD13 LEU B 174 -3.443 -9.525 -4.427 1.00 0.40 H new ATOM 0 HD21 LEU B 174 -3.288 -7.078 -6.288 1.00 0.44 H new ATOM 0 HD22 LEU B 174 -4.765 -7.575 -5.429 1.00 0.44 H new ATOM 0 HD23 LEU B 174 -4.133 -5.924 -5.230 1.00 0.44 H new ATOM 905 N LEU B 175 -4.461 -6.065 -0.173 1.00 0.27 N ATOM 906 CA LEU B 175 -5.126 -6.086 1.125 1.00 0.30 C ATOM 907 C LEU B 175 -5.798 -4.746 1.416 1.00 0.27 C ATOM 908 O LEU B 175 -6.925 -4.700 1.909 1.00 0.28 O ATOM 909 CB LEU B 175 -4.123 -6.422 2.231 1.00 0.33 C ATOM 910 CG LEU B 175 -3.480 -7.806 2.121 1.00 0.38 C ATOM 911 CD1 LEU B 175 -2.477 -8.019 3.244 1.00 0.43 C ATOM 912 CD2 LEU B 175 -4.544 -8.891 2.141 1.00 0.46 C ATOM 0 H LEU B 175 -3.450 -6.194 -0.132 1.00 0.27 H new ATOM 0 HA LEU B 175 -5.896 -6.857 1.098 1.00 0.30 H new ATOM 0 HB2 LEU B 175 -3.334 -5.670 2.226 1.00 0.33 H new ATOM 0 HB3 LEU B 175 -4.628 -6.348 3.194 1.00 0.33 H new ATOM 0 HG LEU B 175 -2.949 -7.864 1.171 1.00 0.38 H new ATOM 0 HD11 LEU B 175 -2.030 -9.009 3.150 1.00 0.43 H new ATOM 0 HD12 LEU B 175 -1.696 -7.261 3.183 1.00 0.43 H new ATOM 0 HD13 LEU B 175 -2.985 -7.941 4.205 1.00 0.43 H new ATOM 0 HD21 LEU B 175 -4.068 -9.869 2.062 1.00 0.46 H new ATOM 0 HD22 LEU B 175 -5.104 -8.834 3.075 1.00 0.46 H new ATOM 0 HD23 LEU B 175 -5.224 -8.749 1.301 1.00 0.46 H new ATOM 924 N ALA B 176 -5.099 -3.658 1.106 1.00 0.25 N ATOM 925 CA ALA B 176 -5.625 -2.318 1.339 1.00 0.23 C ATOM 926 C ALA B 176 -7.011 -2.150 0.721 1.00 0.20 C ATOM 927 O ALA B 176 -7.958 -1.745 1.399 1.00 0.20 O ATOM 928 CB ALA B 176 -4.668 -1.274 0.783 1.00 0.24 C ATOM 0 H ALA B 176 -4.167 -3.679 0.693 1.00 0.25 H new ATOM 0 HA ALA B 176 -5.720 -2.176 2.416 1.00 0.23 H new ATOM 0 HB1 ALA B 176 -5.072 -0.278 0.963 1.00 0.24 H new ATOM 0 HB2 ALA B 176 -3.700 -1.368 1.276 1.00 0.24 H new ATOM 0 HB3 ALA B 176 -4.545 -1.427 -0.289 1.00 0.24 H new ATOM 934 N ILE B 177 -7.130 -2.468 -0.564 1.00 0.20 N ATOM 935 CA ILE B 177 -8.406 -2.349 -1.257 1.00 0.20 C ATOM 936 C ILE B 177 -9.450 -3.259 -0.620 1.00 0.20 C ATOM 937 O ILE B 177 -10.600 -2.864 -0.430 1.00 0.20 O ATOM 938 CB ILE B 177 -8.279 -2.691 -2.755 1.00 0.24 C ATOM 939 CG1 ILE B 177 -7.205 -1.821 -3.409 1.00 0.25 C ATOM 940 CG2 ILE B 177 -9.616 -2.499 -3.456 1.00 0.26 C ATOM 941 CD1 ILE B 177 -7.100 -2.010 -4.906 1.00 0.31 C ATOM 0 H ILE B 177 -6.362 -2.808 -1.143 1.00 0.20 H new ATOM 0 HA ILE B 177 -8.722 -1.310 -1.167 1.00 0.20 H new ATOM 0 HB ILE B 177 -7.984 -3.736 -2.850 1.00 0.24 H new ATOM 0 HG12 ILE B 177 -7.420 -0.773 -3.198 1.00 0.25 H new ATOM 0 HG13 ILE B 177 -6.240 -2.046 -2.954 1.00 0.25 H new ATOM 0 HG21 ILE B 177 -9.511 -2.744 -4.513 1.00 0.26 H new ATOM 0 HG22 ILE B 177 -10.361 -3.154 -3.004 1.00 0.26 H new ATOM 0 HG23 ILE B 177 -9.935 -1.462 -3.354 1.00 0.26 H new ATOM 0 HD11 ILE B 177 -6.318 -1.361 -5.301 1.00 0.31 H new ATOM 0 HD12 ILE B 177 -6.854 -3.049 -5.125 1.00 0.31 H new ATOM 0 HD13 ILE B 177 -8.052 -1.756 -5.372 1.00 0.31 H new ATOM 953 N GLY B 178 -9.040 -4.480 -0.291 1.00 0.23 N ATOM 954 CA GLY B 178 -9.952 -5.421 0.332 1.00 0.26 C ATOM 955 C GLY B 178 -10.609 -4.835 1.565 1.00 0.24 C ATOM 956 O GLY B 178 -11.831 -4.888 1.713 1.00 0.26 O ATOM 0 H GLY B 178 -8.096 -4.834 -0.444 1.00 0.23 H new ATOM 0 HA2 GLY B 178 -10.719 -5.712 -0.385 1.00 0.26 H new ATOM 0 HA3 GLY B 178 -9.410 -6.327 0.605 1.00 0.26 H new ATOM 960 N LEU B 179 -9.793 -4.274 2.451 1.00 0.25 N ATOM 961 CA LEU B 179 -10.300 -3.664 3.672 1.00 0.28 C ATOM 962 C LEU B 179 -11.335 -2.599 3.339 1.00 0.25 C ATOM 963 O LEU B 179 -12.405 -2.545 3.945 1.00 0.29 O ATOM 964 CB LEU B 179 -9.154 -3.050 4.479 1.00 0.33 C ATOM 965 CG LEU B 179 -8.106 -4.049 4.973 1.00 0.39 C ATOM 966 CD1 LEU B 179 -7.059 -3.347 5.823 1.00 0.47 C ATOM 967 CD2 LEU B 179 -8.770 -5.168 5.760 1.00 0.43 C ATOM 0 H LEU B 179 -8.779 -4.230 2.346 1.00 0.25 H new ATOM 0 HA LEU B 179 -10.774 -4.439 4.274 1.00 0.28 H new ATOM 0 HB2 LEU B 179 -8.658 -2.299 3.864 1.00 0.33 H new ATOM 0 HB3 LEU B 179 -9.573 -2.530 5.340 1.00 0.33 H new ATOM 0 HG LEU B 179 -7.608 -4.485 4.107 1.00 0.39 H new ATOM 0 HD11 LEU B 179 -6.322 -4.073 6.166 1.00 0.47 H new ATOM 0 HD12 LEU B 179 -6.563 -2.579 5.229 1.00 0.47 H new ATOM 0 HD13 LEU B 179 -7.540 -2.885 6.685 1.00 0.47 H new ATOM 0 HD21 LEU B 179 -8.011 -5.870 6.105 1.00 0.43 H new ATOM 0 HD22 LEU B 179 -9.293 -4.748 6.619 1.00 0.43 H new ATOM 0 HD23 LEU B 179 -9.483 -5.689 5.121 1.00 0.43 H new ATOM 979 N GLY B 180 -11.010 -1.753 2.366 1.00 0.22 N ATOM 980 CA GLY B 180 -11.928 -0.707 1.959 1.00 0.23 C ATOM 981 C GLY B 180 -13.295 -1.258 1.600 1.00 0.22 C ATOM 982 O GLY B 180 -14.320 -0.679 1.960 1.00 0.27 O ATOM 0 H GLY B 180 -10.128 -1.774 1.853 1.00 0.22 H new ATOM 0 HA2 GLY B 180 -12.030 0.019 2.765 1.00 0.23 H new ATOM 0 HA3 GLY B 180 -11.515 -0.176 1.102 1.00 0.23 H new ATOM 986 N ILE B 181 -13.305 -2.381 0.889 1.00 0.21 N ATOM 987 CA ILE B 181 -14.551 -3.019 0.482 1.00 0.27 C ATOM 988 C ILE B 181 -15.389 -3.397 1.698 1.00 0.29 C ATOM 989 O ILE B 181 -16.566 -3.048 1.787 1.00 0.35 O ATOM 990 CB ILE B 181 -14.283 -4.284 -0.361 1.00 0.34 C ATOM 991 CG1 ILE B 181 -13.470 -3.930 -1.607 1.00 0.38 C ATOM 992 CG2 ILE B 181 -15.593 -4.955 -0.751 1.00 0.44 C ATOM 993 CD1 ILE B 181 -14.205 -3.023 -2.569 1.00 0.93 C ATOM 0 H ILE B 181 -12.463 -2.868 0.583 1.00 0.21 H new ATOM 0 HA ILE B 181 -15.099 -2.298 -0.125 1.00 0.27 H new ATOM 0 HB ILE B 181 -13.706 -4.985 0.242 1.00 0.34 H new ATOM 0 HG12 ILE B 181 -12.542 -3.446 -1.301 1.00 0.38 H new ATOM 0 HG13 ILE B 181 -13.195 -4.849 -2.125 1.00 0.38 H new ATOM 0 HG21 ILE B 181 -15.383 -5.845 -1.345 1.00 0.44 H new ATOM 0 HG22 ILE B 181 -16.138 -5.239 0.149 1.00 0.44 H new ATOM 0 HG23 ILE B 181 -16.197 -4.262 -1.337 1.00 0.44 H new ATOM 0 HD11 ILE B 181 -13.569 -2.813 -3.429 1.00 0.93 H new ATOM 0 HD12 ILE B 181 -15.119 -3.513 -2.904 1.00 0.93 H new ATOM 0 HD13 ILE B 181 -14.457 -2.089 -2.068 1.00 0.93 H new ATOM 1005 N TYR B 182 -14.773 -4.110 2.635 1.00 0.31 N ATOM 1006 CA TYR B 182 -15.460 -4.534 3.848 1.00 0.40 C ATOM 1007 C TYR B 182 -16.068 -3.337 4.573 1.00 0.44 C ATOM 1008 O TYR B 182 -17.249 -3.344 4.921 1.00 0.52 O ATOM 1009 CB TYR B 182 -14.490 -5.272 4.774 1.00 0.44 C ATOM 1010 CG TYR B 182 -15.166 -5.955 5.940 1.00 0.56 C ATOM 1011 CD1 TYR B 182 -15.627 -7.260 5.830 1.00 1.42 C ATOM 1012 CD2 TYR B 182 -15.341 -5.298 7.152 1.00 1.25 C ATOM 1013 CE1 TYR B 182 -16.244 -7.892 6.893 1.00 1.52 C ATOM 1014 CE2 TYR B 182 -15.957 -5.922 8.220 1.00 1.30 C ATOM 1015 CZ TYR B 182 -16.406 -7.220 8.085 1.00 0.84 C ATOM 1016 OH TYR B 182 -17.019 -7.845 9.146 1.00 0.99 O ATOM 0 H TYR B 182 -13.799 -4.406 2.577 1.00 0.31 H new ATOM 0 HA TYR B 182 -16.266 -5.211 3.565 1.00 0.40 H new ATOM 0 HB2 TYR B 182 -13.944 -6.017 4.195 1.00 0.44 H new ATOM 0 HB3 TYR B 182 -13.755 -4.563 5.156 1.00 0.44 H new ATOM 0 HD1 TYR B 182 -15.501 -7.790 4.898 1.00 1.42 H new ATOM 0 HD2 TYR B 182 -14.990 -4.283 7.261 1.00 1.25 H new ATOM 0 HE1 TYR B 182 -16.597 -8.907 6.790 1.00 1.52 H new ATOM 0 HE2 TYR B 182 -16.086 -5.397 9.155 1.00 1.30 H new ATOM 0 HH TYR B 182 -17.053 -7.233 9.911 1.00 0.99 H new ATOM 1026 N ILE B 183 -15.252 -2.311 4.797 1.00 0.44 N ATOM 1027 CA ILE B 183 -15.705 -1.105 5.482 1.00 0.55 C ATOM 1028 C ILE B 183 -16.816 -0.408 4.702 1.00 0.56 C ATOM 1029 O ILE B 183 -17.831 -0.008 5.271 1.00 0.67 O ATOM 1030 CB ILE B 183 -14.545 -0.113 5.693 1.00 0.60 C ATOM 1031 CG1 ILE B 183 -13.398 -0.791 6.444 1.00 0.63 C ATOM 1032 CG2 ILE B 183 -15.030 1.117 6.446 1.00 0.74 C ATOM 1033 CD1 ILE B 183 -12.200 0.108 6.661 1.00 1.10 C ATOM 0 H ILE B 183 -14.272 -2.291 4.514 1.00 0.44 H new ATOM 0 HA ILE B 183 -16.090 -1.420 6.452 1.00 0.55 H new ATOM 0 HB ILE B 183 -14.176 0.207 4.719 1.00 0.60 H new ATOM 0 HG12 ILE B 183 -13.762 -1.136 7.411 1.00 0.63 H new ATOM 0 HG13 ILE B 183 -13.083 -1.674 5.888 1.00 0.63 H new ATOM 0 HG21 ILE B 183 -14.199 1.808 6.587 1.00 0.74 H new ATOM 0 HG22 ILE B 183 -15.817 1.608 5.873 1.00 0.74 H new ATOM 0 HG23 ILE B 183 -15.422 0.817 7.418 1.00 0.74 H new ATOM 0 HD11 ILE B 183 -11.427 -0.440 7.199 1.00 1.10 H new ATOM 0 HD12 ILE B 183 -11.810 0.433 5.697 1.00 1.10 H new ATOM 0 HD13 ILE B 183 -12.500 0.979 7.244 1.00 1.10 H new ATOM 1045 N GLY B 184 -16.614 -0.268 3.396 1.00 0.49 N ATOM 1046 CA GLY B 184 -17.603 0.382 2.556 1.00 0.55 C ATOM 1047 C GLY B 184 -18.968 -0.270 2.657 1.00 0.61 C ATOM 1048 O GLY B 184 -19.974 0.410 2.862 1.00 0.72 O ATOM 0 H GLY B 184 -15.782 -0.594 2.904 1.00 0.49 H new ATOM 0 HA2 GLY B 184 -17.683 1.431 2.840 1.00 0.55 H new ATOM 0 HA3 GLY B 184 -17.268 0.357 1.519 1.00 0.55 H new ATOM 1052 N ARG B 185 -19.001 -1.589 2.513 1.00 0.58 N ATOM 1053 CA ARG B 185 -20.250 -2.336 2.586 1.00 0.70 C ATOM 1054 C ARG B 185 -20.916 -2.170 3.952 1.00 0.81 C ATOM 1055 O ARG B 185 -22.110 -2.427 4.101 1.00 0.96 O ATOM 1056 CB ARG B 185 -19.999 -3.817 2.301 1.00 0.71 C ATOM 1057 CG ARG B 185 -19.022 -4.464 3.260 1.00 0.66 C ATOM 1058 CD ARG B 185 -19.090 -5.981 3.180 1.00 0.80 C ATOM 1059 NE ARG B 185 -18.806 -6.468 1.835 1.00 1.20 N ATOM 1060 CZ ARG B 185 -18.852 -7.751 1.492 1.00 1.57 C ATOM 1061 NH1 ARG B 185 -19.159 -8.670 2.398 1.00 1.68 N ATOM 1062 NH2 ARG B 185 -18.589 -8.117 0.245 1.00 2.16 N ATOM 0 H ARG B 185 -18.176 -2.164 2.345 1.00 0.58 H new ATOM 0 HA ARG B 185 -20.925 -1.936 1.829 1.00 0.70 H new ATOM 0 HB2 ARG B 185 -20.947 -4.352 2.346 1.00 0.71 H new ATOM 0 HB3 ARG B 185 -19.621 -3.923 1.284 1.00 0.71 H new ATOM 0 HG2 ARG B 185 -18.010 -4.131 3.031 1.00 0.66 H new ATOM 0 HG3 ARG B 185 -19.241 -4.141 4.278 1.00 0.66 H new ATOM 0 HD2 ARG B 185 -18.376 -6.414 3.881 1.00 0.80 H new ATOM 0 HD3 ARG B 185 -20.081 -6.317 3.486 1.00 0.80 H new ATOM 0 HE ARG B 185 -18.558 -5.786 1.118 1.00 1.20 H new ATOM 0 HH11 ARG B 185 -19.360 -8.392 3.359 1.00 1.68 H new ATOM 0 HH12 ARG B 185 -19.194 -9.655 2.134 1.00 1.68 H new ATOM 0 HH21 ARG B 185 -18.351 -7.413 -0.454 1.00 2.16 H new ATOM 0 HH22 ARG B 185 -18.625 -9.102 -0.016 1.00 2.16 H new ATOM 1076 N ARG B 186 -20.140 -1.743 4.945 1.00 0.81 N ATOM 1077 CA ARG B 186 -20.668 -1.543 6.291 1.00 0.96 C ATOM 1078 C ARG B 186 -20.643 -0.065 6.665 1.00 1.01 C ATOM 1079 O ARG B 186 -20.287 0.297 7.786 1.00 1.13 O ATOM 1080 CB ARG B 186 -19.863 -2.353 7.308 1.00 1.01 C ATOM 1081 CG ARG B 186 -18.420 -1.900 7.443 1.00 1.69 C ATOM 1082 CD ARG B 186 -17.661 -2.747 8.451 1.00 1.93 C ATOM 1083 NE ARG B 186 -18.233 -2.652 9.790 1.00 2.51 N ATOM 1084 CZ ARG B 186 -17.587 -3.022 10.892 1.00 3.04 C ATOM 1085 NH1 ARG B 186 -16.357 -3.510 10.809 1.00 3.17 N ATOM 1086 NH2 ARG B 186 -18.171 -2.905 12.076 1.00 3.82 N ATOM 0 H ARG B 186 -19.148 -1.530 4.843 1.00 0.81 H new ATOM 0 HA ARG B 186 -21.702 -1.889 6.305 1.00 0.96 H new ATOM 0 HB2 ARG B 186 -20.349 -2.284 8.281 1.00 1.01 H new ATOM 0 HB3 ARG B 186 -19.879 -3.403 7.018 1.00 1.01 H new ATOM 0 HG2 ARG B 186 -17.927 -1.959 6.473 1.00 1.69 H new ATOM 0 HG3 ARG B 186 -18.393 -0.855 7.751 1.00 1.69 H new ATOM 0 HD2 ARG B 186 -17.668 -3.788 8.127 1.00 1.93 H new ATOM 0 HD3 ARG B 186 -16.619 -2.429 8.479 1.00 1.93 H new ATOM 0 HE ARG B 186 -19.179 -2.282 9.886 1.00 2.51 H new ATOM 0 HH11 ARG B 186 -15.905 -3.602 9.899 1.00 3.17 H new ATOM 0 HH12 ARG B 186 -15.863 -3.793 11.655 1.00 3.17 H new ATOM 0 HH21 ARG B 186 -19.117 -2.531 12.143 1.00 3.82 H new ATOM 0 HH22 ARG B 186 -17.674 -3.189 12.920 1.00 3.82 H new ATOM 1100 N LEU B 187 -21.022 0.785 5.716 1.00 1.01 N ATOM 1101 CA LEU B 187 -21.045 2.225 5.942 1.00 1.13 C ATOM 1102 C LEU B 187 -22.411 2.685 6.440 1.00 1.19 C ATOM 1103 O LEU B 187 -22.633 2.811 7.644 1.00 1.41 O ATOM 1104 CB LEU B 187 -20.682 2.970 4.656 1.00 1.19 C ATOM 1105 CG LEU B 187 -19.190 3.046 4.349 1.00 1.31 C ATOM 1106 CD1 LEU B 187 -18.960 3.689 2.991 1.00 1.51 C ATOM 1107 CD2 LEU B 187 -18.472 3.823 5.440 1.00 1.63 C ATOM 0 H LEU B 187 -21.318 0.501 4.782 1.00 1.01 H new ATOM 0 HA LEU B 187 -20.307 2.454 6.711 1.00 1.13 H new ATOM 0 HB2 LEU B 187 -21.185 2.484 3.819 1.00 1.19 H new ATOM 0 HB3 LEU B 187 -21.076 3.984 4.719 1.00 1.19 H new ATOM 0 HG LEU B 187 -18.785 2.035 4.320 1.00 1.31 H new ATOM 0 HD11 LEU B 187 -17.890 3.736 2.787 1.00 1.51 H new ATOM 0 HD12 LEU B 187 -19.451 3.096 2.220 1.00 1.51 H new ATOM 0 HD13 LEU B 187 -19.374 4.697 2.991 1.00 1.51 H new ATOM 0 HD21 LEU B 187 -17.407 3.872 5.212 1.00 1.63 H new ATOM 0 HD22 LEU B 187 -18.878 4.833 5.495 1.00 1.63 H new ATOM 0 HD23 LEU B 187 -18.615 3.322 6.398 1.00 1.63 H new ATOM 1119 N THR B 188 -23.321 2.935 5.506 1.00 1.18 N ATOM 1120 CA THR B 188 -24.665 3.383 5.845 1.00 1.42 C ATOM 1121 C THR B 188 -25.723 2.460 5.249 1.00 1.73 C ATOM 1122 O THR B 188 -26.166 2.725 4.112 1.00 2.31 O ATOM 1123 CB THR B 188 -24.911 4.822 5.353 1.00 1.57 C ATOM 1124 OG1 THR B 188 -26.308 5.131 5.419 1.00 2.12 O ATOM 1125 CG2 THR B 188 -24.410 5.001 3.928 1.00 1.44 C ATOM 1126 OXT THR B 188 -26.099 1.479 5.924 1.00 2.10 O ATOM 0 H THR B 188 -23.151 2.834 4.505 1.00 1.18 H new ATOM 0 HA THR B 188 -24.745 3.358 6.932 1.00 1.42 H new ATOM 0 HB THR B 188 -24.359 5.503 6.001 1.00 1.57 H new ATOM 0 HG1 THR B 188 -26.455 6.048 5.106 1.00 2.12 H new ATOM 0 HG21 THR B 188 -24.595 6.025 3.603 1.00 1.44 H new ATOM 0 HG22 THR B 188 -23.340 4.796 3.890 1.00 1.44 H new ATOM 0 HG23 THR B 188 -24.935 4.311 3.268 1.00 1.44 H new TER 1134 THR B 188