USER MOD reduce.3.24.130724 H: found=0, std=0, add=588, rem=0, adj=12 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 188 THR OG1 : rot 73:sc= 1.14 USER MOD Set 1.2: B 188 THR OG1 : rot 55:sc= 2.19 USER MOD Set 2.1: A 173 HIS : no HE2:sc= -3.56! C(o=-2.3!,f=-6.7!) USER MOD Set 2.2: B 172 SER OG : rot 67:sc= 1.25 USER MOD Set 3.1: A 172 SER OG : rot 76:sc= 1.28 USER MOD Set 3.2: B 173 HIS : +bothHN:sc= -1.53! C(o=-0.25!,f=-7.5!) USER MOD Single : A 158 SER OG : rot 180:sc= 0.204 USER MOD Single : A 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 : B 158 SER OG : rot 180:sc=-0.00117 USER MOD Single : B 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 168 SER OG : rot 180:sc= 0 USER MOD Single : B 182 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 154 23.904 4.504 4.759 1.00 7.39 N ATOM 2 CA GLY A 154 24.905 5.124 3.849 1.00 6.86 C ATOM 3 C GLY A 154 24.442 5.146 2.406 1.00 6.54 C ATOM 4 O GLY A 154 25.089 4.571 1.530 1.00 6.88 O ATOM 0 HA2 GLY A 154 25.108 6.143 4.178 1.00 6.86 H new ATOM 0 HA3 GLY A 154 25.844 4.574 3.918 1.00 6.86 H new ATOM 10 N GLY A 155 23.319 5.812 2.157 1.00 6.02 N ATOM 11 CA GLY A 155 22.789 5.894 0.809 1.00 5.78 C ATOM 12 C GLY A 155 23.152 7.195 0.121 1.00 5.75 C ATOM 13 O GLY A 155 23.529 8.168 0.773 1.00 5.85 O ATOM 0 H GLY A 155 22.767 6.296 2.865 1.00 6.02 H new ATOM 0 HA2 GLY A 155 23.168 5.058 0.221 1.00 5.78 H new ATOM 0 HA3 GLY A 155 21.704 5.794 0.842 1.00 5.78 H new ATOM 17 N ILE A 156 23.036 7.213 -1.204 1.00 5.70 N ATOM 18 CA ILE A 156 23.355 8.404 -1.983 1.00 5.80 C ATOM 19 C ILE A 156 22.307 9.493 -1.776 1.00 5.41 C ATOM 20 O ILE A 156 22.610 10.571 -1.265 1.00 5.56 O ATOM 21 CB ILE A 156 23.455 8.078 -3.485 1.00 5.96 C ATOM 22 CG1 ILE A 156 24.446 6.936 -3.715 1.00 6.37 C ATOM 23 CG2 ILE A 156 23.872 9.315 -4.268 1.00 6.20 C ATOM 24 CD1 ILE A 156 24.586 6.538 -5.168 1.00 6.75 C ATOM 0 H ILE A 156 22.724 6.417 -1.760 1.00 5.70 H new ATOM 0 HA ILE A 156 24.322 8.765 -1.632 1.00 5.80 H new ATOM 0 HB ILE A 156 22.475 7.760 -3.840 1.00 5.96 H new ATOM 0 HG12 ILE A 156 25.423 7.231 -3.332 1.00 6.37 H new ATOM 0 HG13 ILE A 156 24.127 6.068 -3.138 1.00 6.37 H new ATOM 0 HG21 ILE A 156 23.939 9.069 -5.328 1.00 6.20 H new ATOM 0 HG22 ILE A 156 23.133 10.103 -4.124 1.00 6.20 H new ATOM 0 HG23 ILE A 156 24.844 9.659 -3.914 1.00 6.20 H new ATOM 0 HD11 ILE A 156 25.305 5.723 -5.254 1.00 6.75 H new ATOM 0 HD12 ILE A 156 23.619 6.211 -5.550 1.00 6.75 H new ATOM 0 HD13 ILE A 156 24.935 7.393 -5.747 1.00 6.75 H new ATOM 36 N PHE A 157 21.072 9.205 -2.176 1.00 5.00 N ATOM 37 CA PHE A 157 19.979 10.160 -2.032 1.00 4.63 C ATOM 38 C PHE A 157 19.498 10.216 -0.585 1.00 4.39 C ATOM 39 O PHE A 157 19.279 11.294 -0.037 1.00 4.40 O ATOM 40 CB PHE A 157 18.816 9.782 -2.953 1.00 4.37 C ATOM 41 CG PHE A 157 19.185 9.744 -4.410 1.00 4.67 C ATOM 42 CD1 PHE A 157 19.273 10.915 -5.149 1.00 4.81 C ATOM 43 CD2 PHE A 157 19.439 8.537 -5.043 1.00 5.11 C ATOM 44 CE1 PHE A 157 19.607 10.881 -6.490 1.00 5.12 C ATOM 45 CE2 PHE A 157 19.773 8.498 -6.383 1.00 5.45 C ATOM 46 CZ PHE A 157 19.858 9.671 -7.107 1.00 5.34 C ATOM 0 H PHE A 157 20.804 8.318 -2.602 1.00 5.00 H new ATOM 0 HA PHE A 157 20.350 11.145 -2.314 1.00 4.63 H new ATOM 0 HB2 PHE A 157 18.434 8.804 -2.659 1.00 4.37 H new ATOM 0 HB3 PHE A 157 18.005 10.497 -2.811 1.00 4.37 H new ATOM 0 HD1 PHE A 157 19.078 11.864 -4.671 1.00 4.81 H new ATOM 0 HD2 PHE A 157 19.375 7.616 -4.482 1.00 5.11 H new ATOM 0 HE1 PHE A 157 19.672 11.799 -7.055 1.00 5.12 H new ATOM 0 HE2 PHE A 157 19.968 7.551 -6.864 1.00 5.45 H new ATOM 0 HZ PHE A 157 20.120 9.642 -8.154 1.00 5.34 H new ATOM 56 N SER A 158 19.346 9.041 0.022 1.00 4.26 N ATOM 57 CA SER A 158 18.896 8.925 1.409 1.00 4.14 C ATOM 58 C SER A 158 17.734 9.871 1.719 1.00 3.77 C ATOM 59 O SER A 158 16.571 9.494 1.586 1.00 3.49 O ATOM 60 CB SER A 158 20.059 9.186 2.368 1.00 4.62 C ATOM 61 OG SER A 158 20.594 10.484 2.182 1.00 5.17 O ATOM 0 H SER A 158 19.530 8.146 -0.431 1.00 4.26 H new ATOM 0 HA SER A 158 18.534 7.906 1.548 1.00 4.14 H new ATOM 0 HB2 SER A 158 19.717 9.075 3.397 1.00 4.62 H new ATOM 0 HB3 SER A 158 20.839 8.442 2.209 1.00 4.62 H new ATOM 0 HG SER A 158 21.335 10.625 2.808 1.00 5.17 H new ATOM 67 N ALA A 159 18.050 11.093 2.135 1.00 3.88 N ATOM 68 CA ALA A 159 17.025 12.075 2.470 1.00 3.60 C ATOM 69 C ALA A 159 16.076 12.312 1.300 1.00 3.30 C ATOM 70 O ALA A 159 14.862 12.154 1.432 1.00 2.93 O ATOM 71 CB ALA A 159 17.669 13.383 2.902 1.00 3.89 C ATOM 0 H ALA A 159 19.007 11.427 2.248 1.00 3.88 H new ATOM 0 HA ALA A 159 16.439 11.677 3.299 1.00 3.60 H new ATOM 0 HB1 ALA A 159 16.892 14.107 3.149 1.00 3.89 H new ATOM 0 HB2 ALA A 159 18.294 13.209 3.778 1.00 3.89 H new ATOM 0 HB3 ALA A 159 18.282 13.772 2.089 1.00 3.89 H new ATOM 77 N GLU A 160 16.635 12.691 0.156 1.00 3.54 N ATOM 78 CA GLU A 160 15.832 12.954 -1.033 1.00 3.42 C ATOM 79 C GLU A 160 14.972 11.746 -1.389 1.00 3.10 C ATOM 80 O GLU A 160 13.759 11.866 -1.558 1.00 2.83 O ATOM 81 CB GLU A 160 16.734 13.321 -2.213 1.00 3.86 C ATOM 82 CG GLU A 160 15.972 13.593 -3.499 1.00 4.24 C ATOM 83 CD GLU A 160 16.863 14.127 -4.603 1.00 4.74 C ATOM 84 OE1 GLU A 160 17.552 13.315 -5.255 1.00 4.91 O ATOM 85 OE2 GLU A 160 16.871 15.358 -4.816 1.00 5.36 O ATOM 0 H GLU A 160 17.638 12.823 0.027 1.00 3.54 H new ATOM 0 HA GLU A 160 15.172 13.794 -0.816 1.00 3.42 H new ATOM 0 HB2 GLU A 160 17.318 14.204 -1.953 1.00 3.86 H new ATOM 0 HB3 GLU A 160 17.442 12.510 -2.384 1.00 3.86 H new ATOM 0 HG2 GLU A 160 15.495 12.673 -3.836 1.00 4.24 H new ATOM 0 HG3 GLU A 160 15.176 14.311 -3.300 1.00 4.24 H new ATOM 92 N PHE A 161 15.605 10.583 -1.502 1.00 3.19 N ATOM 93 CA PHE A 161 14.891 9.357 -1.835 1.00 2.94 C ATOM 94 C PHE A 161 13.868 9.016 -0.756 1.00 2.53 C ATOM 95 O PHE A 161 12.699 8.766 -1.050 1.00 2.23 O ATOM 96 CB PHE A 161 15.871 8.197 -2.009 1.00 3.21 C ATOM 97 CG PHE A 161 15.200 6.892 -2.323 1.00 3.05 C ATOM 98 CD1 PHE A 161 14.849 6.577 -3.626 1.00 3.13 C ATOM 99 CD2 PHE A 161 14.917 5.982 -1.318 1.00 3.21 C ATOM 100 CE1 PHE A 161 14.228 5.377 -3.920 1.00 3.04 C ATOM 101 CE2 PHE A 161 14.297 4.781 -1.605 1.00 3.12 C ATOM 102 CZ PHE A 161 13.952 4.479 -2.908 1.00 2.87 C ATOM 0 H PHE A 161 16.609 10.464 -1.368 1.00 3.19 H new ATOM 0 HA PHE A 161 14.364 9.519 -2.775 1.00 2.94 H new ATOM 0 HB2 PHE A 161 16.571 8.439 -2.809 1.00 3.21 H new ATOM 0 HB3 PHE A 161 16.456 8.086 -1.096 1.00 3.21 H new ATOM 0 HD1 PHE A 161 15.063 7.276 -4.421 1.00 3.13 H new ATOM 0 HD2 PHE A 161 15.184 6.214 -0.298 1.00 3.21 H new ATOM 0 HE1 PHE A 161 13.959 5.143 -4.939 1.00 3.04 H new ATOM 0 HE2 PHE A 161 14.083 4.080 -0.812 1.00 3.12 H new ATOM 0 HZ PHE A 161 13.467 3.541 -3.135 1.00 2.87 H new ATOM 112 N LEU A 162 14.319 9.005 0.493 1.00 2.59 N ATOM 113 CA LEU A 162 13.447 8.699 1.621 1.00 2.33 C ATOM 114 C LEU A 162 12.332 9.733 1.740 1.00 2.06 C ATOM 115 O LEU A 162 11.245 9.435 2.235 1.00 1.79 O ATOM 116 CB LEU A 162 14.256 8.654 2.920 1.00 2.64 C ATOM 117 CG LEU A 162 15.267 7.508 3.015 1.00 2.96 C ATOM 118 CD1 LEU A 162 16.188 7.707 4.209 1.00 3.31 C ATOM 119 CD2 LEU A 162 14.547 6.174 3.115 1.00 2.83 C ATOM 0 H LEU A 162 15.286 9.205 0.751 1.00 2.59 H new ATOM 0 HA LEU A 162 12.997 7.722 1.447 1.00 2.33 H new ATOM 0 HB2 LEU A 162 14.789 9.598 3.031 1.00 2.64 H new ATOM 0 HB3 LEU A 162 13.564 8.578 3.759 1.00 2.64 H new ATOM 0 HG LEU A 162 15.874 7.507 2.110 1.00 2.96 H new ATOM 0 HD11 LEU A 162 16.900 6.883 4.261 1.00 3.31 H new ATOM 0 HD12 LEU A 162 16.728 8.647 4.099 1.00 3.31 H new ATOM 0 HD13 LEU A 162 15.597 7.734 5.124 1.00 3.31 H new ATOM 0 HD21 LEU A 162 15.279 5.369 3.182 1.00 2.83 H new ATOM 0 HD22 LEU A 162 13.917 6.166 4.005 1.00 2.83 H new ATOM 0 HD23 LEU A 162 13.927 6.028 2.230 1.00 2.83 H new ATOM 131 N LYS A 163 12.611 10.949 1.283 1.00 2.21 N ATOM 132 CA LYS A 163 11.631 12.029 1.337 1.00 2.08 C ATOM 133 C LYS A 163 10.354 11.641 0.600 1.00 1.82 C ATOM 134 O LYS A 163 9.250 11.963 1.039 1.00 1.70 O ATOM 135 CB LYS A 163 12.210 13.306 0.730 1.00 2.39 C ATOM 136 CG LYS A 163 11.250 14.485 0.769 1.00 2.32 C ATOM 137 CD LYS A 163 11.815 15.693 0.042 1.00 2.58 C ATOM 138 CE LYS A 163 13.114 16.168 0.673 1.00 2.67 C ATOM 139 NZ LYS A 163 13.625 17.408 0.025 1.00 3.11 N ATOM 0 H LYS A 163 13.506 11.212 0.871 1.00 2.21 H new ATOM 0 HA LYS A 163 11.388 12.210 2.384 1.00 2.08 H new ATOM 0 HB2 LYS A 163 13.122 13.572 1.265 1.00 2.39 H new ATOM 0 HB3 LYS A 163 12.492 13.112 -0.305 1.00 2.39 H new ATOM 0 HG2 LYS A 163 10.302 14.197 0.315 1.00 2.32 H new ATOM 0 HG3 LYS A 163 11.040 14.749 1.805 1.00 2.32 H new ATOM 0 HD2 LYS A 163 11.989 15.441 -1.004 1.00 2.58 H new ATOM 0 HD3 LYS A 163 11.085 16.502 0.058 1.00 2.58 H new ATOM 0 HE2 LYS A 163 12.955 16.352 1.735 1.00 2.67 H new ATOM 0 HE3 LYS A 163 13.865 15.382 0.595 1.00 2.67 H new ATOM 0 HZ1 LYS A 163 14.512 17.699 0.484 1.00 3.11 H new ATOM 0 HZ2 LYS A 163 13.801 17.225 -0.984 1.00 3.11 H new ATOM 0 HZ3 LYS A 163 12.920 18.166 0.122 1.00 3.11 H new ATOM 153 N VAL A 164 10.512 10.951 -0.524 1.00 1.85 N ATOM 154 CA VAL A 164 9.370 10.525 -1.323 1.00 1.76 C ATOM 155 C VAL A 164 9.203 9.008 -1.299 1.00 1.57 C ATOM 156 O VAL A 164 8.554 8.434 -2.173 1.00 1.72 O ATOM 157 CB VAL A 164 9.504 10.991 -2.785 1.00 2.14 C ATOM 158 CG1 VAL A 164 9.555 12.509 -2.860 1.00 2.52 C ATOM 159 CG2 VAL A 164 10.737 10.378 -3.431 1.00 2.66 C ATOM 0 H VAL A 164 11.418 10.675 -0.902 1.00 1.85 H new ATOM 0 HA VAL A 164 8.489 10.987 -0.877 1.00 1.76 H new ATOM 0 HB VAL A 164 8.627 10.652 -3.336 1.00 2.14 H new ATOM 0 HG11 VAL A 164 9.650 12.819 -3.901 1.00 2.52 H new ATOM 0 HG12 VAL A 164 8.640 12.925 -2.439 1.00 2.52 H new ATOM 0 HG13 VAL A 164 10.412 12.873 -2.294 1.00 2.52 H new ATOM 0 HG21 VAL A 164 10.814 10.719 -4.463 1.00 2.66 H new ATOM 0 HG22 VAL A 164 11.626 10.684 -2.880 1.00 2.66 H new ATOM 0 HG23 VAL A 164 10.655 9.291 -3.413 1.00 2.66 H new ATOM 169 N PHE A 165 9.791 8.361 -0.296 1.00 1.35 N ATOM 170 CA PHE A 165 9.695 6.912 -0.167 1.00 1.22 C ATOM 171 C PHE A 165 8.597 6.532 0.820 1.00 0.99 C ATOM 172 O PHE A 165 7.751 5.688 0.526 1.00 0.85 O ATOM 173 CB PHE A 165 11.032 6.321 0.287 1.00 1.48 C ATOM 174 CG PHE A 165 11.046 4.819 0.303 1.00 1.47 C ATOM 175 CD1 PHE A 165 11.203 4.103 -0.874 1.00 1.78 C ATOM 176 CD2 PHE A 165 10.898 4.123 1.491 1.00 1.99 C ATOM 177 CE1 PHE A 165 11.215 2.721 -0.864 1.00 1.84 C ATOM 178 CE2 PHE A 165 10.907 2.742 1.507 1.00 2.06 C ATOM 179 CZ PHE A 165 11.065 2.039 0.328 1.00 1.62 C ATOM 0 H PHE A 165 10.337 8.816 0.436 1.00 1.35 H new ATOM 0 HA PHE A 165 9.444 6.502 -1.145 1.00 1.22 H new ATOM 0 HB2 PHE A 165 11.822 6.677 -0.375 1.00 1.48 H new ATOM 0 HB3 PHE A 165 11.263 6.690 1.286 1.00 1.48 H new ATOM 0 HD1 PHE A 165 11.317 4.631 -1.809 1.00 1.78 H new ATOM 0 HD2 PHE A 165 10.774 4.667 2.416 1.00 1.99 H new ATOM 0 HE1 PHE A 165 11.342 2.175 -1.787 1.00 1.84 H new ATOM 0 HE2 PHE A 165 10.791 2.212 2.441 1.00 2.06 H new ATOM 0 HZ PHE A 165 11.071 0.959 0.338 1.00 1.62 H new ATOM 189 N LEU A 166 8.617 7.158 1.993 1.00 1.07 N ATOM 190 CA LEU A 166 7.612 6.888 3.014 1.00 1.04 C ATOM 191 C LEU A 166 6.214 7.263 2.525 1.00 0.80 C ATOM 192 O LEU A 166 5.264 6.506 2.721 1.00 0.80 O ATOM 193 CB LEU A 166 7.935 7.638 4.312 1.00 1.31 C ATOM 194 CG LEU A 166 9.321 7.360 4.894 1.00 1.61 C ATOM 195 CD1 LEU A 166 9.547 8.191 6.147 1.00 1.88 C ATOM 196 CD2 LEU A 166 9.482 5.878 5.199 1.00 1.72 C ATOM 0 H LEU A 166 9.315 7.853 2.259 1.00 1.07 H new ATOM 0 HA LEU A 166 7.630 5.817 3.217 1.00 1.04 H new ATOM 0 HB2 LEU A 166 7.844 8.708 4.127 1.00 1.31 H new ATOM 0 HB3 LEU A 166 7.185 7.378 5.060 1.00 1.31 H new ATOM 0 HG LEU A 166 10.070 7.642 4.154 1.00 1.61 H new ATOM 0 HD11 LEU A 166 10.538 7.981 6.549 1.00 1.88 H new ATOM 0 HD12 LEU A 166 9.472 9.250 5.900 1.00 1.88 H new ATOM 0 HD13 LEU A 166 8.793 7.938 6.892 1.00 1.88 H new ATOM 0 HD21 LEU A 166 10.474 5.697 5.613 1.00 1.72 H new ATOM 0 HD22 LEU A 166 8.726 5.571 5.922 1.00 1.72 H new ATOM 0 HD23 LEU A 166 9.361 5.302 4.281 1.00 1.72 H new ATOM 208 N PRO A 167 6.061 8.437 1.877 1.00 0.73 N ATOM 209 CA PRO A 167 4.759 8.883 1.367 1.00 0.67 C ATOM 210 C PRO A 167 4.170 7.895 0.367 1.00 0.55 C ATOM 211 O PRO A 167 3.000 7.526 0.461 1.00 0.58 O ATOM 212 CB PRO A 167 5.071 10.217 0.678 1.00 0.86 C ATOM 213 CG PRO A 167 6.358 10.668 1.274 1.00 0.98 C ATOM 214 CD PRO A 167 7.125 9.416 1.587 1.00 0.91 C ATOM 0 HA PRO A 167 4.019 8.969 2.163 1.00 0.67 H new ATOM 0 HB2 PRO A 167 5.158 10.093 -0.401 1.00 0.86 H new ATOM 0 HB3 PRO A 167 4.279 10.945 0.852 1.00 0.86 H new ATOM 0 HG2 PRO A 167 6.910 11.301 0.579 1.00 0.98 H new ATOM 0 HG3 PRO A 167 6.187 11.257 2.175 1.00 0.98 H new ATOM 0 HD2 PRO A 167 7.744 9.102 0.747 1.00 0.91 H new ATOM 0 HD3 PRO A 167 7.790 9.553 2.440 1.00 0.91 H new ATOM 222 N SER A 168 4.990 7.464 -0.588 1.00 0.55 N ATOM 223 CA SER A 168 4.550 6.517 -1.609 1.00 0.52 C ATOM 224 C SER A 168 3.809 5.342 -0.981 1.00 0.39 C ATOM 225 O SER A 168 2.733 4.956 -1.439 1.00 0.33 O ATOM 226 CB SER A 168 5.748 6.008 -2.413 1.00 0.66 C ATOM 227 OG SER A 168 5.341 5.079 -3.403 1.00 1.47 O ATOM 0 H SER A 168 5.963 7.756 -0.676 1.00 0.55 H new ATOM 0 HA SER A 168 3.866 7.038 -2.279 1.00 0.52 H new ATOM 0 HB2 SER A 168 6.256 6.849 -2.886 1.00 0.66 H new ATOM 0 HB3 SER A 168 6.467 5.538 -1.742 1.00 0.66 H new ATOM 0 HG SER A 168 6.125 4.770 -3.904 1.00 1.47 H new ATOM 233 N LEU A 169 4.393 4.775 0.070 1.00 0.40 N ATOM 234 CA LEU A 169 3.784 3.647 0.763 1.00 0.36 C ATOM 235 C LEU A 169 2.438 4.043 1.359 1.00 0.28 C ATOM 236 O LEU A 169 1.431 3.368 1.146 1.00 0.26 O ATOM 237 CB LEU A 169 4.714 3.134 1.865 1.00 0.47 C ATOM 238 CG LEU A 169 6.133 2.791 1.408 1.00 0.59 C ATOM 239 CD1 LEU A 169 6.898 2.096 2.522 1.00 0.73 C ATOM 240 CD2 LEU A 169 6.095 1.922 0.159 1.00 0.62 C ATOM 0 H LEU A 169 5.286 5.078 0.459 1.00 0.40 H new ATOM 0 HA LEU A 169 3.621 2.850 0.038 1.00 0.36 H new ATOM 0 HB2 LEU A 169 4.774 3.889 2.649 1.00 0.47 H new ATOM 0 HB3 LEU A 169 4.268 2.245 2.311 1.00 0.47 H new ATOM 0 HG LEU A 169 6.651 3.719 1.164 1.00 0.59 H new ATOM 0 HD11 LEU A 169 7.905 1.859 2.179 1.00 0.73 H new ATOM 0 HD12 LEU A 169 6.955 2.754 3.389 1.00 0.73 H new ATOM 0 HD13 LEU A 169 6.383 1.176 2.798 1.00 0.73 H new ATOM 0 HD21 LEU A 169 7.113 1.688 -0.152 1.00 0.62 H new ATOM 0 HD22 LEU A 169 5.560 0.997 0.375 1.00 0.62 H new ATOM 0 HD23 LEU A 169 5.585 2.458 -0.642 1.00 0.62 H new ATOM 252 N LEU A 170 2.428 5.142 2.109 1.00 0.31 N ATOM 253 CA LEU A 170 1.204 5.631 2.731 1.00 0.33 C ATOM 254 C LEU A 170 0.136 5.897 1.678 1.00 0.26 C ATOM 255 O LEU A 170 -0.992 5.416 1.788 1.00 0.27 O ATOM 256 CB LEU A 170 1.485 6.906 3.530 1.00 0.42 C ATOM 257 CG LEU A 170 2.397 6.720 4.743 1.00 0.52 C ATOM 258 CD1 LEU A 170 2.630 8.049 5.445 1.00 0.63 C ATOM 259 CD2 LEU A 170 1.799 5.703 5.705 1.00 0.60 C ATOM 0 H LEU A 170 3.254 5.709 2.300 1.00 0.31 H new ATOM 0 HA LEU A 170 0.836 4.863 3.412 1.00 0.33 H new ATOM 0 HB2 LEU A 170 1.936 7.642 2.864 1.00 0.42 H new ATOM 0 HB3 LEU A 170 0.536 7.322 3.868 1.00 0.42 H new ATOM 0 HG LEU A 170 3.360 6.343 4.397 1.00 0.52 H new ATOM 0 HD11 LEU A 170 3.281 7.897 6.306 1.00 0.63 H new ATOM 0 HD12 LEU A 170 3.100 8.748 4.754 1.00 0.63 H new ATOM 0 HD13 LEU A 170 1.676 8.456 5.780 1.00 0.63 H new ATOM 0 HD21 LEU A 170 2.460 5.582 6.563 1.00 0.60 H new ATOM 0 HD22 LEU A 170 0.824 6.053 6.044 1.00 0.60 H new ATOM 0 HD23 LEU A 170 1.684 4.745 5.197 1.00 0.60 H new ATOM 271 N LEU A 171 0.498 6.667 0.657 1.00 0.23 N ATOM 272 CA LEU A 171 -0.429 6.989 -0.421 1.00 0.22 C ATOM 273 C LEU A 171 -1.031 5.716 -1.005 1.00 0.18 C ATOM 274 O LEU A 171 -2.242 5.621 -1.201 1.00 0.21 O ATOM 275 CB LEU A 171 0.286 7.780 -1.519 1.00 0.26 C ATOM 276 CG LEU A 171 0.856 9.130 -1.081 1.00 0.33 C ATOM 277 CD1 LEU A 171 1.629 9.779 -2.219 1.00 0.39 C ATOM 278 CD2 LEU A 171 -0.258 10.048 -0.601 1.00 0.40 C ATOM 0 H LEU A 171 1.425 7.079 0.554 1.00 0.23 H new ATOM 0 HA LEU A 171 -1.233 7.601 -0.011 1.00 0.22 H new ATOM 0 HB2 LEU A 171 1.099 7.171 -1.913 1.00 0.26 H new ATOM 0 HB3 LEU A 171 -0.413 7.947 -2.338 1.00 0.26 H new ATOM 0 HG LEU A 171 1.544 8.960 -0.253 1.00 0.33 H new ATOM 0 HD11 LEU A 171 2.027 10.738 -1.888 1.00 0.39 H new ATOM 0 HD12 LEU A 171 2.451 9.129 -2.518 1.00 0.39 H new ATOM 0 HD13 LEU A 171 0.964 9.936 -3.068 1.00 0.39 H new ATOM 0 HD21 LEU A 171 0.166 11.004 -0.293 1.00 0.40 H new ATOM 0 HD22 LEU A 171 -0.970 10.210 -1.410 1.00 0.40 H new ATOM 0 HD23 LEU A 171 -0.769 9.588 0.245 1.00 0.40 H new ATOM 290 N SER A 172 -0.174 4.739 -1.281 1.00 0.16 N ATOM 291 CA SER A 172 -0.617 3.468 -1.841 1.00 0.16 C ATOM 292 C SER A 172 -1.745 2.872 -1.007 1.00 0.15 C ATOM 293 O SER A 172 -2.799 2.516 -1.535 1.00 0.19 O ATOM 294 CB SER A 172 0.552 2.485 -1.915 1.00 0.19 C ATOM 295 OG SER A 172 1.525 2.915 -2.851 1.00 0.23 O ATOM 0 H SER A 172 0.832 4.803 -1.126 1.00 0.16 H new ATOM 0 HA SER A 172 -0.991 3.653 -2.848 1.00 0.16 H new ATOM 0 HB2 SER A 172 1.010 2.385 -0.931 1.00 0.19 H new ATOM 0 HB3 SER A 172 0.184 1.499 -2.197 1.00 0.19 H new ATOM 0 HG SER A 172 2.050 3.647 -2.464 1.00 0.23 H new ATOM 301 N HIS A 173 -1.519 2.765 0.299 1.00 0.13 N ATOM 302 CA HIS A 173 -2.520 2.210 1.203 1.00 0.17 C ATOM 303 C HIS A 173 -3.789 3.056 1.189 1.00 0.22 C ATOM 304 O HIS A 173 -4.888 2.541 0.988 1.00 0.27 O ATOM 305 CB HIS A 173 -1.967 2.127 2.626 1.00 0.20 C ATOM 306 CG HIS A 173 -0.746 1.268 2.749 1.00 0.20 C ATOM 307 ND1 HIS A 173 0.525 1.783 2.898 1.00 0.25 N ATOM 308 CD2 HIS A 173 -0.606 -0.079 2.756 1.00 0.25 C ATOM 309 CE1 HIS A 173 1.392 0.790 2.990 1.00 0.29 C ATOM 310 NE2 HIS A 173 0.732 -0.349 2.907 1.00 0.27 N ATOM 0 H HIS A 173 -0.653 3.055 0.754 1.00 0.13 H new ATOM 0 HA HIS A 173 -2.766 1.205 0.859 1.00 0.17 H new ATOM 0 HB2 HIS A 173 -1.729 3.133 2.973 1.00 0.20 H new ATOM 0 HB3 HIS A 173 -2.742 1.737 3.285 1.00 0.20 H new ATOM 0 HD1 HIS A 173 0.759 2.775 2.932 1.00 0.25 H new ATOM 0 HD2 HIS A 173 -1.399 -0.806 2.661 1.00 0.25 H new ATOM 0 HE1 HIS A 173 2.460 0.893 3.112 1.00 0.29 H new ATOM 319 N LEU A 174 -3.628 4.358 1.402 1.00 0.23 N ATOM 320 CA LEU A 174 -4.761 5.275 1.418 1.00 0.29 C ATOM 321 C LEU A 174 -5.538 5.207 0.107 1.00 0.29 C ATOM 322 O LEU A 174 -6.759 5.052 0.104 1.00 0.34 O ATOM 323 CB LEU A 174 -4.283 6.706 1.669 1.00 0.32 C ATOM 324 CG LEU A 174 -3.540 6.914 2.991 1.00 0.36 C ATOM 325 CD1 LEU A 174 -3.117 8.367 3.142 1.00 0.41 C ATOM 326 CD2 LEU A 174 -4.410 6.486 4.162 1.00 0.47 C ATOM 0 H LEU A 174 -2.724 4.801 1.566 1.00 0.23 H new ATOM 0 HA LEU A 174 -5.426 4.975 2.228 1.00 0.29 H new ATOM 0 HB2 LEU A 174 -3.628 7.004 0.850 1.00 0.32 H new ATOM 0 HB3 LEU A 174 -5.146 7.371 1.645 1.00 0.32 H new ATOM 0 HG LEU A 174 -2.643 6.295 2.984 1.00 0.36 H new ATOM 0 HD11 LEU A 174 -2.590 8.496 4.087 1.00 0.41 H new ATOM 0 HD12 LEU A 174 -2.457 8.641 2.319 1.00 0.41 H new ATOM 0 HD13 LEU A 174 -4.000 9.006 3.128 1.00 0.41 H new ATOM 0 HD21 LEU A 174 -3.867 6.640 5.094 1.00 0.47 H new ATOM 0 HD22 LEU A 174 -5.324 7.080 4.172 1.00 0.47 H new ATOM 0 HD23 LEU A 174 -4.664 5.431 4.060 1.00 0.47 H new ATOM 338 N LEU A 175 -4.823 5.324 -1.007 1.00 0.26 N ATOM 339 CA LEU A 175 -5.448 5.272 -2.324 1.00 0.28 C ATOM 340 C LEU A 175 -6.164 3.941 -2.532 1.00 0.27 C ATOM 341 O LEU A 175 -7.294 3.903 -3.019 1.00 0.29 O ATOM 342 CB LEU A 175 -4.400 5.483 -3.419 1.00 0.30 C ATOM 343 CG LEU A 175 -3.767 6.875 -3.445 1.00 0.33 C ATOM 344 CD1 LEU A 175 -2.744 6.976 -4.567 1.00 0.37 C ATOM 345 CD2 LEU A 175 -4.839 7.944 -3.602 1.00 0.41 C ATOM 0 H LEU A 175 -3.812 5.455 -1.024 1.00 0.26 H new ATOM 0 HA LEU A 175 -6.186 6.072 -2.382 1.00 0.28 H new ATOM 0 HB2 LEU A 175 -3.610 4.743 -3.293 1.00 0.30 H new ATOM 0 HB3 LEU A 175 -4.864 5.293 -4.387 1.00 0.30 H new ATOM 0 HG LEU A 175 -3.254 7.038 -2.497 1.00 0.33 H new ATOM 0 HD11 LEU A 175 -2.304 7.973 -4.570 1.00 0.37 H new ATOM 0 HD12 LEU A 175 -1.960 6.234 -4.413 1.00 0.37 H new ATOM 0 HD13 LEU A 175 -3.234 6.793 -5.523 1.00 0.37 H new ATOM 0 HD21 LEU A 175 -4.371 8.928 -3.619 1.00 0.41 H new ATOM 0 HD22 LEU A 175 -5.379 7.783 -4.535 1.00 0.41 H new ATOM 0 HD23 LEU A 175 -5.535 7.887 -2.765 1.00 0.41 H new ATOM 357 N ALA A 176 -5.500 2.852 -2.160 1.00 0.26 N ATOM 358 CA ALA A 176 -6.077 1.522 -2.302 1.00 0.27 C ATOM 359 C ALA A 176 -7.402 1.426 -1.553 1.00 0.26 C ATOM 360 O ALA A 176 -8.425 1.030 -2.119 1.00 0.27 O ATOM 361 CB ALA A 176 -5.102 0.474 -1.791 1.00 0.27 C ATOM 0 H ALA A 176 -4.563 2.865 -1.758 1.00 0.26 H new ATOM 0 HA ALA A 176 -6.270 1.339 -3.359 1.00 0.27 H new ATOM 0 HB1 ALA A 176 -5.542 -0.517 -1.901 1.00 0.27 H new ATOM 0 HB2 ALA A 176 -4.177 0.526 -2.366 1.00 0.27 H new ATOM 0 HB3 ALA A 176 -4.886 0.660 -0.739 1.00 0.27 H new ATOM 367 N ILE A 177 -7.381 1.795 -0.275 1.00 0.27 N ATOM 368 CA ILE A 177 -8.583 1.759 0.544 1.00 0.28 C ATOM 369 C ILE A 177 -9.662 2.646 -0.061 1.00 0.26 C ATOM 370 O ILE A 177 -10.830 2.267 -0.122 1.00 0.26 O ATOM 371 CB ILE A 177 -8.296 2.210 1.991 1.00 0.31 C ATOM 372 CG1 ILE A 177 -7.247 1.300 2.633 1.00 0.36 C ATOM 373 CG2 ILE A 177 -9.576 2.208 2.816 1.00 0.33 C ATOM 374 CD1 ILE A 177 -6.863 1.713 4.037 1.00 0.62 C ATOM 0 H ILE A 177 -6.546 2.121 0.212 1.00 0.27 H new ATOM 0 HA ILE A 177 -8.931 0.726 0.570 1.00 0.28 H new ATOM 0 HB ILE A 177 -7.906 3.227 1.964 1.00 0.31 H new ATOM 0 HG12 ILE A 177 -7.629 0.279 2.655 1.00 0.36 H new ATOM 0 HG13 ILE A 177 -6.354 1.293 2.008 1.00 0.36 H new ATOM 0 HG21 ILE A 177 -9.353 2.529 3.834 1.00 0.33 H new ATOM 0 HG22 ILE A 177 -10.298 2.892 2.369 1.00 0.33 H new ATOM 0 HG23 ILE A 177 -9.994 1.202 2.836 1.00 0.33 H new ATOM 0 HD11 ILE A 177 -6.116 1.022 4.428 1.00 0.62 H new ATOM 0 HD12 ILE A 177 -6.451 2.722 4.020 1.00 0.62 H new ATOM 0 HD13 ILE A 177 -7.746 1.693 4.676 1.00 0.62 H new ATOM 386 N GLY A 178 -9.260 3.828 -0.520 1.00 0.26 N ATOM 387 CA GLY A 178 -10.206 4.745 -1.125 1.00 0.27 C ATOM 388 C GLY A 178 -11.019 4.077 -2.213 1.00 0.26 C ATOM 389 O GLY A 178 -12.231 4.270 -2.302 1.00 0.28 O ATOM 0 H GLY A 178 -8.298 4.165 -0.483 1.00 0.26 H new ATOM 0 HA2 GLY A 178 -10.876 5.135 -0.358 1.00 0.27 H new ATOM 0 HA3 GLY A 178 -9.670 5.597 -1.543 1.00 0.27 H new ATOM 393 N LEU A 179 -10.347 3.286 -3.046 1.00 0.25 N ATOM 394 CA LEU A 179 -11.020 2.572 -4.120 1.00 0.27 C ATOM 395 C LEU A 179 -12.039 1.606 -3.535 1.00 0.26 C ATOM 396 O LEU A 179 -13.189 1.559 -3.972 1.00 0.28 O ATOM 397 CB LEU A 179 -10.006 1.806 -4.974 1.00 0.33 C ATOM 398 CG LEU A 179 -8.913 2.666 -5.609 1.00 0.36 C ATOM 399 CD1 LEU A 179 -7.951 1.801 -6.411 1.00 0.43 C ATOM 400 CD2 LEU A 179 -9.526 3.742 -6.491 1.00 0.43 C ATOM 0 H LEU A 179 -9.341 3.126 -2.996 1.00 0.25 H new ATOM 0 HA LEU A 179 -11.531 3.296 -4.755 1.00 0.27 H new ATOM 0 HB2 LEU A 179 -9.533 1.045 -4.354 1.00 0.33 H new ATOM 0 HB3 LEU A 179 -10.542 1.284 -5.766 1.00 0.33 H new ATOM 0 HG LEU A 179 -8.353 3.154 -4.811 1.00 0.36 H new ATOM 0 HD11 LEU A 179 -7.180 2.430 -6.856 1.00 0.43 H new ATOM 0 HD12 LEU A 179 -7.486 1.068 -5.752 1.00 0.43 H new ATOM 0 HD13 LEU A 179 -8.498 1.285 -7.200 1.00 0.43 H new ATOM 0 HD21 LEU A 179 -8.733 4.344 -6.934 1.00 0.43 H new ATOM 0 HD22 LEU A 179 -10.112 3.274 -7.282 1.00 0.43 H new ATOM 0 HD23 LEU A 179 -10.173 4.380 -5.890 1.00 0.43 H new ATOM 412 N GLY A 180 -11.608 0.842 -2.537 1.00 0.25 N ATOM 413 CA GLY A 180 -12.496 -0.109 -1.894 1.00 0.27 C ATOM 414 C GLY A 180 -13.722 0.560 -1.303 1.00 0.26 C ATOM 415 O GLY A 180 -14.849 0.121 -1.532 1.00 0.29 O ATOM 0 H GLY A 180 -10.660 0.864 -2.162 1.00 0.25 H new ATOM 0 HA2 GLY A 180 -12.808 -0.860 -2.620 1.00 0.27 H new ATOM 0 HA3 GLY A 180 -11.955 -0.633 -1.106 1.00 0.27 H new ATOM 419 N ILE A 181 -13.502 1.628 -0.542 1.00 0.28 N ATOM 420 CA ILE A 181 -14.597 2.363 0.082 1.00 0.34 C ATOM 421 C ILE A 181 -15.640 2.769 -0.955 1.00 0.32 C ATOM 422 O ILE A 181 -16.841 2.605 -0.738 1.00 0.36 O ATOM 423 CB ILE A 181 -14.084 3.626 0.806 1.00 0.42 C ATOM 424 CG1 ILE A 181 -13.067 3.247 1.882 1.00 0.49 C ATOM 425 CG2 ILE A 181 -15.243 4.398 1.423 1.00 0.49 C ATOM 426 CD1 ILE A 181 -13.665 2.463 3.028 1.00 0.89 C ATOM 0 H ILE A 181 -12.575 2.004 -0.343 1.00 0.28 H new ATOM 0 HA ILE A 181 -15.055 1.697 0.814 1.00 0.34 H new ATOM 0 HB ILE A 181 -13.594 4.267 0.073 1.00 0.42 H new ATOM 0 HG12 ILE A 181 -12.270 2.659 1.427 1.00 0.49 H new ATOM 0 HG13 ILE A 181 -12.609 4.155 2.274 1.00 0.49 H new ATOM 0 HG21 ILE A 181 -14.861 5.285 1.929 1.00 0.49 H new ATOM 0 HG22 ILE A 181 -15.938 4.698 0.639 1.00 0.49 H new ATOM 0 HG23 ILE A 181 -15.760 3.764 2.143 1.00 0.49 H new ATOM 0 HD11 ILE A 181 -12.886 2.228 3.754 1.00 0.89 H new ATOM 0 HD12 ILE A 181 -14.442 3.057 3.509 1.00 0.89 H new ATOM 0 HD13 ILE A 181 -14.098 1.538 2.649 1.00 0.89 H new ATOM 438 N TYR A 182 -15.173 3.298 -2.080 1.00 0.31 N ATOM 439 CA TYR A 182 -16.063 3.731 -3.151 1.00 0.35 C ATOM 440 C TYR A 182 -16.929 2.574 -3.644 1.00 0.36 C ATOM 441 O TYR A 182 -18.130 2.735 -3.851 1.00 0.42 O ATOM 442 CB TYR A 182 -15.247 4.309 -4.310 1.00 0.39 C ATOM 443 CG TYR A 182 -16.092 4.822 -5.455 1.00 0.51 C ATOM 444 CD1 TYR A 182 -16.705 6.067 -5.387 1.00 1.43 C ATOM 445 CD2 TYR A 182 -16.272 4.065 -6.605 1.00 1.19 C ATOM 446 CE1 TYR A 182 -17.474 6.542 -6.433 1.00 1.56 C ATOM 447 CE2 TYR A 182 -17.038 4.532 -7.656 1.00 1.21 C ATOM 448 CZ TYR A 182 -17.637 5.770 -7.565 1.00 0.81 C ATOM 449 OH TYR A 182 -18.401 6.239 -8.609 1.00 0.98 O ATOM 0 H TYR A 182 -14.181 3.438 -2.274 1.00 0.31 H new ATOM 0 HA TYR A 182 -16.721 4.505 -2.756 1.00 0.35 H new ATOM 0 HB2 TYR A 182 -14.627 5.123 -3.935 1.00 0.39 H new ATOM 0 HB3 TYR A 182 -14.571 3.540 -4.685 1.00 0.39 H new ATOM 0 HD1 TYR A 182 -16.579 6.674 -4.502 1.00 1.43 H new ATOM 0 HD2 TYR A 182 -15.805 3.094 -6.679 1.00 1.19 H new ATOM 0 HE1 TYR A 182 -17.944 7.512 -6.365 1.00 1.56 H new ATOM 0 HE2 TYR A 182 -17.167 3.930 -8.544 1.00 1.21 H new ATOM 0 HH TYR A 182 -18.413 5.575 -9.329 1.00 0.98 H new ATOM 459 N ILE A 183 -16.311 1.411 -3.832 1.00 0.35 N ATOM 460 CA ILE A 183 -17.032 0.231 -4.297 1.00 0.43 C ATOM 461 C ILE A 183 -18.102 -0.193 -3.294 1.00 0.45 C ATOM 462 O ILE A 183 -19.253 -0.428 -3.661 1.00 0.55 O ATOM 463 CB ILE A 183 -16.075 -0.954 -4.543 1.00 0.48 C ATOM 464 CG1 ILE A 183 -14.990 -0.561 -5.546 1.00 0.54 C ATOM 465 CG2 ILE A 183 -16.850 -2.166 -5.042 1.00 0.56 C ATOM 466 CD1 ILE A 183 -13.920 -1.617 -5.728 1.00 0.83 C ATOM 0 H ILE A 183 -15.315 1.261 -3.670 1.00 0.35 H new ATOM 0 HA ILE A 183 -17.509 0.504 -5.238 1.00 0.43 H new ATOM 0 HB ILE A 183 -15.595 -1.216 -3.600 1.00 0.48 H new ATOM 0 HG12 ILE A 183 -15.455 -0.357 -6.510 1.00 0.54 H new ATOM 0 HG13 ILE A 183 -14.521 0.366 -5.216 1.00 0.54 H new ATOM 0 HG21 ILE A 183 -16.161 -2.994 -5.211 1.00 0.56 H new ATOM 0 HG22 ILE A 183 -17.591 -2.456 -4.297 1.00 0.56 H new ATOM 0 HG23 ILE A 183 -17.354 -1.917 -5.976 1.00 0.56 H new ATOM 0 HD11 ILE A 183 -13.185 -1.269 -6.453 1.00 0.83 H new ATOM 0 HD12 ILE A 183 -13.428 -1.804 -4.774 1.00 0.83 H new ATOM 0 HD13 ILE A 183 -14.376 -2.539 -6.088 1.00 0.83 H new ATOM 478 N GLY A 184 -17.713 -0.289 -2.027 1.00 0.40 N ATOM 479 CA GLY A 184 -18.646 -0.687 -0.988 1.00 0.46 C ATOM 480 C GLY A 184 -19.801 0.284 -0.830 1.00 0.52 C ATOM 481 O GLY A 184 -20.964 -0.118 -0.848 1.00 0.64 O ATOM 0 H GLY A 184 -16.766 -0.098 -1.700 1.00 0.40 H new ATOM 0 HA2 GLY A 184 -19.039 -1.677 -1.219 1.00 0.46 H new ATOM 0 HA3 GLY A 184 -18.114 -0.768 -0.040 1.00 0.46 H new ATOM 485 N ARG A 185 -19.480 1.565 -0.672 1.00 0.48 N ATOM 486 CA ARG A 185 -20.501 2.593 -0.504 1.00 0.59 C ATOM 487 C ARG A 185 -21.422 2.651 -1.718 1.00 0.67 C ATOM 488 O ARG A 185 -22.588 3.031 -1.607 1.00 0.83 O ATOM 489 CB ARG A 185 -19.847 3.959 -0.273 1.00 0.59 C ATOM 490 CG ARG A 185 -18.937 4.405 -1.402 1.00 0.51 C ATOM 491 CD ARG A 185 -19.700 5.173 -2.472 1.00 0.85 C ATOM 492 NE ARG A 185 -20.360 6.357 -1.929 1.00 1.32 N ATOM 493 CZ ARG A 185 -21.090 7.194 -2.659 1.00 1.98 C ATOM 494 NH1 ARG A 185 -21.262 6.970 -3.955 1.00 2.27 N ATOM 495 NH2 ARG A 185 -21.651 8.254 -2.093 1.00 2.54 N ATOM 0 H ARG A 185 -18.522 1.915 -0.657 1.00 0.48 H new ATOM 0 HA ARG A 185 -21.101 2.335 0.369 1.00 0.59 H new ATOM 0 HB2 ARG A 185 -20.629 4.706 -0.133 1.00 0.59 H new ATOM 0 HB3 ARG A 185 -19.271 3.923 0.652 1.00 0.59 H new ATOM 0 HG2 ARG A 185 -18.141 5.033 -1.001 1.00 0.51 H new ATOM 0 HG3 ARG A 185 -18.460 3.534 -1.850 1.00 0.51 H new ATOM 0 HD2 ARG A 185 -19.013 5.472 -3.263 1.00 0.85 H new ATOM 0 HD3 ARG A 185 -20.444 4.519 -2.926 1.00 0.85 H new ATOM 0 HE ARG A 185 -20.255 6.553 -0.933 1.00 1.32 H new ATOM 0 HH11 ARG A 185 -20.834 6.154 -4.393 1.00 2.27 H new ATOM 0 HH12 ARG A 185 -21.823 7.613 -4.514 1.00 2.27 H new ATOM 0 HH21 ARG A 185 -21.522 8.428 -1.096 1.00 2.54 H new ATOM 0 HH22 ARG A 185 -22.211 8.896 -2.655 1.00 2.54 H new ATOM 509 N ARG A 186 -20.892 2.272 -2.876 1.00 0.63 N ATOM 510 CA ARG A 186 -21.670 2.281 -4.110 1.00 0.74 C ATOM 511 C ARG A 186 -22.857 1.330 -4.006 1.00 0.85 C ATOM 512 O ARG A 186 -23.911 1.568 -4.596 1.00 1.06 O ATOM 513 CB ARG A 186 -20.789 1.884 -5.297 1.00 0.80 C ATOM 514 CG ARG A 186 -20.837 2.863 -6.461 1.00 1.24 C ATOM 515 CD ARG A 186 -22.085 2.672 -7.313 1.00 1.58 C ATOM 516 NE ARG A 186 -23.297 3.119 -6.632 1.00 2.38 N ATOM 517 CZ ARG A 186 -24.521 2.957 -7.127 1.00 2.95 C ATOM 518 NH1 ARG A 186 -24.691 2.369 -8.302 1.00 2.93 N ATOM 519 NH2 ARG A 186 -25.574 3.388 -6.447 1.00 3.95 N ATOM 0 H ARG A 186 -19.929 1.955 -2.986 1.00 0.63 H new ATOM 0 HA ARG A 186 -22.046 3.292 -4.268 1.00 0.74 H new ATOM 0 HB2 ARG A 186 -19.758 1.792 -4.956 1.00 0.80 H new ATOM 0 HB3 ARG A 186 -21.096 0.900 -5.651 1.00 0.80 H new ATOM 0 HG2 ARG A 186 -20.811 3.883 -6.078 1.00 1.24 H new ATOM 0 HG3 ARG A 186 -19.950 2.733 -7.082 1.00 1.24 H new ATOM 0 HD2 ARG A 186 -21.972 3.223 -8.247 1.00 1.58 H new ATOM 0 HD3 ARG A 186 -22.186 1.619 -7.574 1.00 1.58 H new ATOM 0 HE ARG A 186 -23.200 3.581 -5.728 1.00 2.38 H new ATOM 0 HH11 ARG A 186 -23.882 2.039 -8.829 1.00 2.93 H new ATOM 0 HH12 ARG A 186 -25.631 2.246 -8.679 1.00 2.93 H new ATOM 0 HH21 ARG A 186 -25.446 3.844 -5.544 1.00 3.95 H new ATOM 0 HH22 ARG A 186 -26.512 3.264 -6.827 1.00 3.95 H new ATOM 533 N LEU A 187 -22.676 0.251 -3.250 1.00 0.93 N ATOM 534 CA LEU A 187 -23.729 -0.741 -3.067 1.00 1.08 C ATOM 535 C LEU A 187 -24.836 -0.191 -2.177 1.00 1.31 C ATOM 536 O LEU A 187 -25.995 -0.109 -2.582 1.00 1.52 O ATOM 537 CB LEU A 187 -23.154 -2.016 -2.445 1.00 1.05 C ATOM 538 CG LEU A 187 -21.744 -2.381 -2.909 1.00 1.00 C ATOM 539 CD1 LEU A 187 -21.362 -3.771 -2.423 1.00 1.13 C ATOM 540 CD2 LEU A 187 -21.648 -2.296 -4.422 1.00 1.23 C ATOM 0 H LEU A 187 -21.809 0.042 -2.754 1.00 0.93 H new ATOM 0 HA LEU A 187 -24.148 -0.977 -4.045 1.00 1.08 H new ATOM 0 HB2 LEU A 187 -23.146 -1.902 -1.361 1.00 1.05 H new ATOM 0 HB3 LEU A 187 -23.822 -2.847 -2.673 1.00 1.05 H new ATOM 0 HG LEU A 187 -21.042 -1.667 -2.478 1.00 1.00 H new ATOM 0 HD11 LEU A 187 -20.355 -4.012 -2.764 1.00 1.13 H new ATOM 0 HD12 LEU A 187 -21.392 -3.797 -1.334 1.00 1.13 H new ATOM 0 HD13 LEU A 187 -22.065 -4.502 -2.823 1.00 1.13 H new ATOM 0 HD21 LEU A 187 -20.638 -2.559 -4.738 1.00 1.23 H new ATOM 0 HD22 LEU A 187 -22.360 -2.988 -4.871 1.00 1.23 H new ATOM 0 HD23 LEU A 187 -21.876 -1.280 -4.745 1.00 1.23 H new ATOM 552 N THR A 188 -24.461 0.184 -0.957 1.00 1.39 N ATOM 553 CA THR A 188 -25.405 0.731 0.016 1.00 1.70 C ATOM 554 C THR A 188 -26.716 -0.054 0.033 1.00 2.02 C ATOM 555 O THR A 188 -27.677 0.381 -0.634 1.00 2.43 O ATOM 556 CB THR A 188 -25.706 2.218 -0.259 1.00 2.42 C ATOM 557 OG1 THR A 188 -26.810 2.652 0.545 1.00 2.91 O ATOM 558 CG2 THR A 188 -26.017 2.454 -1.730 1.00 3.05 C ATOM 559 OXT THR A 188 -26.767 -1.100 0.715 1.00 2.74 O ATOM 0 H THR A 188 -23.502 0.119 -0.616 1.00 1.39 H new ATOM 0 HA THR A 188 -24.928 0.641 0.992 1.00 1.70 H new ATOM 0 HB THR A 188 -24.818 2.795 -0.000 1.00 2.42 H new ATOM 0 HG1 THR A 188 -26.521 2.740 1.477 1.00 2.91 H new ATOM 0 HG21 THR A 188 -26.225 3.512 -1.893 1.00 3.05 H new ATOM 0 HG22 THR A 188 -25.161 2.155 -2.335 1.00 3.05 H new ATOM 0 HG23 THR A 188 -26.888 1.865 -2.017 1.00 3.05 H new TER 567 THR A 188 ATOM 568 N GLY B 154 26.844 -6.939 -2.014 1.00 7.40 N ATOM 569 CA GLY B 154 25.569 -7.481 -1.473 1.00 7.27 C ATOM 570 C GLY B 154 25.177 -6.837 -0.158 1.00 7.05 C ATOM 571 O GLY B 154 24.690 -5.706 -0.133 1.00 7.46 O ATOM 0 HA2 GLY B 154 24.773 -7.325 -2.202 1.00 7.27 H new ATOM 0 HA3 GLY B 154 25.666 -8.557 -1.332 1.00 7.27 H new ATOM 577 N GLY B 155 25.389 -7.556 0.939 1.00 6.55 N ATOM 578 CA GLY B 155 25.049 -7.030 2.247 1.00 6.48 C ATOM 579 C GLY B 155 24.665 -8.118 3.230 1.00 6.39 C ATOM 580 O GLY B 155 24.580 -9.291 2.867 1.00 6.42 O ATOM 0 H GLY B 155 25.790 -8.494 0.945 1.00 6.55 H new ATOM 0 HA2 GLY B 155 25.898 -6.471 2.642 1.00 6.48 H new ATOM 0 HA3 GLY B 155 24.222 -6.326 2.148 1.00 6.48 H new ATOM 584 N ILE B 156 24.431 -7.727 4.479 1.00 6.43 N ATOM 585 CA ILE B 156 24.053 -8.672 5.518 1.00 6.52 C ATOM 586 C ILE B 156 22.647 -9.206 5.287 1.00 6.01 C ATOM 587 O ILE B 156 22.452 -10.402 5.066 1.00 6.10 O ATOM 588 CB ILE B 156 24.112 -8.012 6.905 1.00 6.85 C ATOM 589 CG1 ILE B 156 25.391 -7.188 7.041 1.00 7.40 C ATOM 590 CG2 ILE B 156 24.035 -9.066 7.999 1.00 7.17 C ATOM 591 CD1 ILE B 156 26.648 -7.979 6.761 1.00 7.86 C ATOM 0 H ILE B 156 24.497 -6.759 4.794 1.00 6.43 H new ATOM 0 HA ILE B 156 24.763 -9.498 5.477 1.00 6.52 H new ATOM 0 HB ILE B 156 23.256 -7.345 7.013 1.00 6.85 H new ATOM 0 HG12 ILE B 156 25.343 -6.341 6.356 1.00 7.40 H new ATOM 0 HG13 ILE B 156 25.445 -6.779 8.050 1.00 7.40 H new ATOM 0 HG21 ILE B 156 24.078 -8.582 8.975 1.00 7.17 H new ATOM 0 HG22 ILE B 156 23.099 -9.617 7.908 1.00 7.17 H new ATOM 0 HG23 ILE B 156 24.873 -9.756 7.899 1.00 7.17 H new ATOM 0 HD11 ILE B 156 27.518 -7.332 6.876 1.00 7.86 H new ATOM 0 HD12 ILE B 156 26.719 -8.810 7.463 1.00 7.86 H new ATOM 0 HD13 ILE B 156 26.615 -8.366 5.742 1.00 7.86 H new ATOM 603 N PHE B 157 21.672 -8.309 5.338 1.00 5.61 N ATOM 604 CA PHE B 157 20.277 -8.684 5.133 1.00 5.13 C ATOM 605 C PHE B 157 19.990 -8.911 3.654 1.00 4.75 C ATOM 606 O PHE B 157 19.760 -10.041 3.223 1.00 4.74 O ATOM 607 CB PHE B 157 19.347 -7.599 5.678 1.00 4.94 C ATOM 608 CG PHE B 157 19.645 -7.209 7.098 1.00 5.41 C ATOM 609 CD1 PHE B 157 19.591 -8.151 8.112 1.00 5.51 C ATOM 610 CD2 PHE B 157 19.972 -5.902 7.417 1.00 6.05 C ATOM 611 CE1 PHE B 157 19.860 -7.796 9.420 1.00 6.07 C ATOM 612 CE2 PHE B 157 20.243 -5.541 8.723 1.00 6.60 C ATOM 613 CZ PHE B 157 20.187 -6.489 9.727 1.00 6.54 C ATOM 0 H PHE B 157 21.820 -7.316 5.519 1.00 5.61 H new ATOM 0 HA PHE B 157 20.095 -9.614 5.672 1.00 5.13 H new ATOM 0 HB2 PHE B 157 19.422 -6.716 5.044 1.00 4.94 H new ATOM 0 HB3 PHE B 157 18.317 -7.950 5.615 1.00 4.94 H new ATOM 0 HD1 PHE B 157 19.336 -9.174 7.878 1.00 5.51 H new ATOM 0 HD2 PHE B 157 20.016 -5.157 6.637 1.00 6.05 H new ATOM 0 HE1 PHE B 157 19.815 -8.540 10.202 1.00 6.07 H new ATOM 0 HE2 PHE B 157 20.498 -4.519 8.959 1.00 6.60 H new ATOM 0 HZ PHE B 157 20.398 -6.209 10.749 1.00 6.54 H new ATOM 623 N SER B 158 20.003 -7.829 2.880 1.00 4.58 N ATOM 624 CA SER B 158 19.738 -7.899 1.446 1.00 4.37 C ATOM 625 C SER B 158 18.542 -8.812 1.155 1.00 3.99 C ATOM 626 O SER B 158 17.396 -8.380 1.271 1.00 3.65 O ATOM 627 CB SER B 158 20.990 -8.363 0.694 1.00 4.69 C ATOM 628 OG SER B 158 20.744 -8.480 -0.697 1.00 5.34 O ATOM 0 H SER B 158 20.195 -6.888 3.224 1.00 4.58 H new ATOM 0 HA SER B 158 19.482 -6.900 1.092 1.00 4.37 H new ATOM 0 HB2 SER B 158 21.801 -7.655 0.863 1.00 4.69 H new ATOM 0 HB3 SER B 158 21.318 -9.324 1.089 1.00 4.69 H new ATOM 0 HG SER B 158 21.561 -8.776 -1.150 1.00 5.34 H new ATOM 634 N ALA B 159 18.797 -10.073 0.804 1.00 4.16 N ATOM 635 CA ALA B 159 17.716 -11.004 0.515 1.00 3.90 C ATOM 636 C ALA B 159 16.772 -11.110 1.704 1.00 3.60 C ATOM 637 O ALA B 159 15.559 -11.235 1.540 1.00 3.22 O ATOM 638 CB ALA B 159 18.274 -12.371 0.153 1.00 4.29 C ATOM 0 H ALA B 159 19.734 -10.466 0.715 1.00 4.16 H new ATOM 0 HA ALA B 159 17.153 -10.625 -0.338 1.00 3.90 H new ATOM 0 HB1 ALA B 159 17.452 -13.055 -0.060 1.00 4.29 H new ATOM 0 HB2 ALA B 159 18.910 -12.283 -0.728 1.00 4.29 H new ATOM 0 HB3 ALA B 159 18.860 -12.757 0.987 1.00 4.29 H new ATOM 644 N GLU B 160 17.340 -11.059 2.906 1.00 3.85 N ATOM 645 CA GLU B 160 16.551 -11.140 4.128 1.00 3.76 C ATOM 646 C GLU B 160 15.545 -9.998 4.190 1.00 3.40 C ATOM 647 O GLU B 160 14.431 -10.161 4.689 1.00 3.20 O ATOM 648 CB GLU B 160 17.459 -11.102 5.358 1.00 4.23 C ATOM 649 CG GLU B 160 16.725 -11.382 6.660 1.00 4.68 C ATOM 650 CD GLU B 160 17.629 -11.286 7.873 1.00 5.24 C ATOM 651 OE1 GLU B 160 18.380 -12.249 8.131 1.00 5.52 O ATOM 652 OE2 GLU B 160 17.583 -10.249 8.566 1.00 5.73 O ATOM 0 H GLU B 160 18.344 -10.962 3.058 1.00 3.85 H new ATOM 0 HA GLU B 160 16.010 -12.086 4.121 1.00 3.76 H new ATOM 0 HB2 GLU B 160 18.256 -11.835 5.234 1.00 4.23 H new ATOM 0 HB3 GLU B 160 17.933 -10.122 5.420 1.00 4.23 H new ATOM 0 HG2 GLU B 160 15.902 -10.675 6.768 1.00 4.68 H new ATOM 0 HG3 GLU B 160 16.285 -12.378 6.618 1.00 4.68 H new ATOM 659 N PHE B 161 15.951 -8.841 3.678 1.00 3.41 N ATOM 660 CA PHE B 161 15.094 -7.663 3.671 1.00 3.14 C ATOM 661 C PHE B 161 14.052 -7.758 2.561 1.00 2.66 C ATOM 662 O PHE B 161 12.898 -7.371 2.745 1.00 2.36 O ATOM 663 CB PHE B 161 15.939 -6.401 3.488 1.00 3.41 C ATOM 664 CG PHE B 161 15.211 -5.132 3.828 1.00 3.29 C ATOM 665 CD1 PHE B 161 14.288 -4.588 2.949 1.00 3.38 C ATOM 666 CD2 PHE B 161 15.452 -4.483 5.029 1.00 3.56 C ATOM 667 CE1 PHE B 161 13.619 -3.419 3.262 1.00 3.38 C ATOM 668 CE2 PHE B 161 14.786 -3.314 5.346 1.00 3.54 C ATOM 669 CZ PHE B 161 13.868 -2.781 4.462 1.00 3.27 C ATOM 0 H PHE B 161 16.871 -8.695 3.262 1.00 3.41 H new ATOM 0 HA PHE B 161 14.574 -7.611 4.628 1.00 3.14 H new ATOM 0 HB2 PHE B 161 16.829 -6.477 4.112 1.00 3.41 H new ATOM 0 HB3 PHE B 161 16.278 -6.349 2.454 1.00 3.41 H new ATOM 0 HD1 PHE B 161 14.089 -5.082 2.010 1.00 3.38 H new ATOM 0 HD2 PHE B 161 16.168 -4.895 5.725 1.00 3.56 H new ATOM 0 HE1 PHE B 161 12.902 -3.005 2.569 1.00 3.38 H new ATOM 0 HE2 PHE B 161 14.983 -2.817 6.285 1.00 3.54 H new ATOM 0 HZ PHE B 161 13.346 -1.868 4.708 1.00 3.27 H new ATOM 679 N LEU B 162 14.468 -8.278 1.410 1.00 2.66 N ATOM 680 CA LEU B 162 13.569 -8.421 0.270 1.00 2.34 C ATOM 681 C LEU B 162 12.424 -9.375 0.597 1.00 2.05 C ATOM 682 O LEU B 162 11.304 -9.203 0.116 1.00 1.74 O ATOM 683 CB LEU B 162 14.334 -8.929 -0.956 1.00 2.65 C ATOM 684 CG LEU B 162 15.598 -8.142 -1.313 1.00 2.99 C ATOM 685 CD1 LEU B 162 16.074 -8.508 -2.710 1.00 3.37 C ATOM 686 CD2 LEU B 162 15.352 -6.644 -1.204 1.00 2.86 C ATOM 0 H LEU B 162 15.419 -8.606 1.242 1.00 2.66 H new ATOM 0 HA LEU B 162 13.151 -7.439 0.047 1.00 2.34 H new ATOM 0 HB2 LEU B 162 14.610 -9.970 -0.786 1.00 2.65 H new ATOM 0 HB3 LEU B 162 13.662 -8.914 -1.814 1.00 2.65 H new ATOM 0 HG LEU B 162 16.379 -8.408 -0.601 1.00 2.99 H new ATOM 0 HD11 LEU B 162 16.973 -7.940 -2.948 1.00 3.37 H new ATOM 0 HD12 LEU B 162 16.297 -9.574 -2.751 1.00 3.37 H new ATOM 0 HD13 LEU B 162 15.294 -8.273 -3.434 1.00 3.37 H new ATOM 0 HD21 LEU B 162 16.264 -6.106 -1.462 1.00 2.86 H new ATOM 0 HD22 LEU B 162 14.554 -6.356 -1.888 1.00 2.86 H new ATOM 0 HD23 LEU B 162 15.061 -6.396 -0.183 1.00 2.86 H new ATOM 698 N LYS B 163 12.709 -10.381 1.419 1.00 2.25 N ATOM 699 CA LYS B 163 11.698 -11.359 1.806 1.00 2.14 C ATOM 700 C LYS B 163 10.490 -10.675 2.434 1.00 1.89 C ATOM 701 O LYS B 163 9.374 -11.192 2.383 1.00 1.77 O ATOM 702 CB LYS B 163 12.285 -12.383 2.782 1.00 2.52 C ATOM 703 CG LYS B 163 13.205 -13.399 2.122 1.00 2.86 C ATOM 704 CD LYS B 163 13.536 -14.547 3.063 1.00 3.27 C ATOM 705 CE LYS B 163 14.416 -14.092 4.215 1.00 3.42 C ATOM 706 NZ LYS B 163 14.518 -15.126 5.282 1.00 3.86 N ATOM 0 H LYS B 163 13.629 -10.540 1.829 1.00 2.25 H new ATOM 0 HA LYS B 163 11.372 -11.877 0.904 1.00 2.14 H new ATOM 0 HB2 LYS B 163 12.839 -11.856 3.559 1.00 2.52 H new ATOM 0 HB3 LYS B 163 11.469 -12.911 3.275 1.00 2.52 H new ATOM 0 HG2 LYS B 163 12.730 -13.790 1.222 1.00 2.86 H new ATOM 0 HG3 LYS B 163 14.126 -12.907 1.808 1.00 2.86 H new ATOM 0 HD2 LYS B 163 12.613 -14.973 3.456 1.00 3.27 H new ATOM 0 HD3 LYS B 163 14.042 -15.338 2.509 1.00 3.27 H new ATOM 0 HE2 LYS B 163 15.412 -13.859 3.840 1.00 3.42 H new ATOM 0 HE3 LYS B 163 14.012 -13.173 4.639 1.00 3.42 H new ATOM 0 HZ1 LYS B 163 15.127 -14.775 6.048 1.00 3.86 H new ATOM 0 HZ2 LYS B 163 13.571 -15.331 5.659 1.00 3.86 H new ATOM 0 HZ3 LYS B 163 14.928 -15.995 4.885 1.00 3.86 H new ATOM 720 N VAL B 164 10.721 -9.508 3.027 1.00 1.96 N ATOM 721 CA VAL B 164 9.650 -8.750 3.663 1.00 1.90 C ATOM 722 C VAL B 164 9.706 -7.279 3.261 1.00 1.71 C ATOM 723 O VAL B 164 9.617 -6.389 4.107 1.00 1.94 O ATOM 724 CB VAL B 164 9.721 -8.856 5.198 1.00 2.30 C ATOM 725 CG1 VAL B 164 9.531 -10.299 5.644 1.00 2.46 C ATOM 726 CG2 VAL B 164 11.040 -8.300 5.712 1.00 2.87 C ATOM 0 H VAL B 164 11.639 -9.067 3.080 1.00 1.96 H new ATOM 0 HA VAL B 164 8.709 -9.182 3.321 1.00 1.90 H new ATOM 0 HB VAL B 164 8.913 -8.260 5.622 1.00 2.30 H new ATOM 0 HG11 VAL B 164 9.584 -10.354 6.731 1.00 2.46 H new ATOM 0 HG12 VAL B 164 8.558 -10.658 5.310 1.00 2.46 H new ATOM 0 HG13 VAL B 164 10.315 -10.920 5.211 1.00 2.46 H new ATOM 0 HG21 VAL B 164 11.071 -8.384 6.798 1.00 2.87 H new ATOM 0 HG22 VAL B 164 11.866 -8.865 5.280 1.00 2.87 H new ATOM 0 HG23 VAL B 164 11.129 -7.252 5.426 1.00 2.87 H new ATOM 736 N PHE B 165 9.853 -7.032 1.964 1.00 1.47 N ATOM 737 CA PHE B 165 9.922 -5.670 1.448 1.00 1.36 C ATOM 738 C PHE B 165 9.190 -5.553 0.114 1.00 1.08 C ATOM 739 O PHE B 165 8.305 -4.714 -0.048 1.00 0.94 O ATOM 740 CB PHE B 165 11.380 -5.238 1.283 1.00 1.64 C ATOM 741 CG PHE B 165 11.536 -3.880 0.662 1.00 1.70 C ATOM 742 CD1 PHE B 165 10.689 -2.841 1.014 1.00 1.78 C ATOM 743 CD2 PHE B 165 12.527 -3.642 -0.277 1.00 2.38 C ATOM 744 CE1 PHE B 165 10.829 -1.591 0.442 1.00 1.96 C ATOM 745 CE2 PHE B 165 12.671 -2.394 -0.854 1.00 2.48 C ATOM 746 CZ PHE B 165 11.821 -1.367 -0.494 1.00 2.01 C ATOM 0 H PHE B 165 9.927 -7.757 1.251 1.00 1.47 H new ATOM 0 HA PHE B 165 9.434 -5.012 2.167 1.00 1.36 H new ATOM 0 HB2 PHE B 165 11.864 -5.240 2.260 1.00 1.64 H new ATOM 0 HB3 PHE B 165 11.901 -5.972 0.668 1.00 1.64 H new ATOM 0 HD1 PHE B 165 9.911 -3.010 1.744 1.00 1.78 H new ATOM 0 HD2 PHE B 165 13.195 -4.441 -0.562 1.00 2.38 H new ATOM 0 HE1 PHE B 165 10.164 -0.789 0.726 1.00 1.96 H new ATOM 0 HE2 PHE B 165 13.447 -2.223 -1.585 1.00 2.48 H new ATOM 0 HZ PHE B 165 11.931 -0.391 -0.943 1.00 2.01 H new ATOM 756 N LEU B 166 9.567 -6.401 -0.838 1.00 1.17 N ATOM 757 CA LEU B 166 8.946 -6.394 -2.157 1.00 1.12 C ATOM 758 C LEU B 166 7.517 -6.941 -2.109 1.00 0.85 C ATOM 759 O LEU B 166 6.573 -6.241 -2.474 1.00 0.92 O ATOM 760 CB LEU B 166 9.790 -7.199 -3.152 1.00 1.40 C ATOM 761 CG LEU B 166 11.098 -6.535 -3.586 1.00 1.78 C ATOM 762 CD1 LEU B 166 10.816 -5.276 -4.392 1.00 2.14 C ATOM 763 CD2 LEU B 166 11.969 -6.212 -2.381 1.00 2.03 C ATOM 0 H LEU B 166 10.299 -7.101 -0.720 1.00 1.17 H new ATOM 0 HA LEU B 166 8.896 -5.358 -2.492 1.00 1.12 H new ATOM 0 HB2 LEU B 166 10.023 -8.166 -2.707 1.00 1.40 H new ATOM 0 HB3 LEU B 166 9.188 -7.393 -4.040 1.00 1.40 H new ATOM 0 HG LEU B 166 11.641 -7.237 -4.219 1.00 1.78 H new ATOM 0 HD11 LEU B 166 11.758 -4.817 -4.692 1.00 2.14 H new ATOM 0 HD12 LEU B 166 10.239 -5.534 -5.280 1.00 2.14 H new ATOM 0 HD13 LEU B 166 10.248 -4.573 -3.782 1.00 2.14 H new ATOM 0 HD21 LEU B 166 12.893 -5.741 -2.716 1.00 2.03 H new ATOM 0 HD22 LEU B 166 11.435 -5.532 -1.718 1.00 2.03 H new ATOM 0 HD23 LEU B 166 12.204 -7.132 -1.845 1.00 2.03 H new ATOM 775 N PRO B 167 7.335 -8.198 -1.662 1.00 0.73 N ATOM 776 CA PRO B 167 6.006 -8.816 -1.579 1.00 0.63 C ATOM 777 C PRO B 167 5.059 -8.039 -0.670 1.00 0.56 C ATOM 778 O PRO B 167 3.841 -8.087 -0.843 1.00 0.69 O ATOM 779 CB PRO B 167 6.280 -10.210 -1.000 1.00 0.87 C ATOM 780 CG PRO B 167 7.640 -10.127 -0.396 1.00 1.07 C ATOM 781 CD PRO B 167 8.394 -9.112 -1.205 1.00 0.96 C ATOM 0 HA PRO B 167 5.515 -8.839 -2.552 1.00 0.63 H new ATOM 0 HB2 PRO B 167 5.534 -10.479 -0.252 1.00 0.87 H new ATOM 0 HB3 PRO B 167 6.241 -10.973 -1.777 1.00 0.87 H new ATOM 0 HG2 PRO B 167 7.584 -9.827 0.651 1.00 1.07 H new ATOM 0 HG3 PRO B 167 8.139 -11.096 -0.424 1.00 1.07 H new ATOM 0 HD2 PRO B 167 9.143 -8.594 -0.606 1.00 0.96 H new ATOM 0 HD3 PRO B 167 8.918 -9.572 -2.042 1.00 0.96 H new ATOM 789 N SER B 168 5.624 -7.324 0.296 1.00 0.55 N ATOM 790 CA SER B 168 4.823 -6.537 1.226 1.00 0.55 C ATOM 791 C SER B 168 4.046 -5.454 0.488 1.00 0.44 C ATOM 792 O SER B 168 2.876 -5.207 0.781 1.00 0.41 O ATOM 793 CB SER B 168 5.716 -5.902 2.294 1.00 0.72 C ATOM 794 OG SER B 168 6.410 -6.892 3.033 1.00 1.59 O ATOM 0 H SER B 168 6.630 -7.273 0.455 1.00 0.55 H new ATOM 0 HA SER B 168 4.112 -7.206 1.710 1.00 0.55 H new ATOM 0 HB2 SER B 168 6.431 -5.229 1.821 1.00 0.72 H new ATOM 0 HB3 SER B 168 5.109 -5.299 2.969 1.00 0.72 H new ATOM 0 HG SER B 168 6.975 -6.461 3.708 1.00 1.59 H new ATOM 800 N LEU B 169 4.703 -4.811 -0.471 1.00 0.46 N ATOM 801 CA LEU B 169 4.074 -3.753 -1.252 1.00 0.45 C ATOM 802 C LEU B 169 2.857 -4.282 -2.006 1.00 0.33 C ATOM 803 O LEU B 169 1.801 -3.651 -2.015 1.00 0.31 O ATOM 804 CB LEU B 169 5.078 -3.152 -2.240 1.00 0.60 C ATOM 805 CG LEU B 169 6.334 -2.554 -1.604 1.00 0.77 C ATOM 806 CD1 LEU B 169 7.227 -1.936 -2.669 1.00 1.09 C ATOM 807 CD2 LEU B 169 5.958 -1.519 -0.554 1.00 0.77 C ATOM 0 H LEU B 169 5.671 -5.004 -0.726 1.00 0.46 H new ATOM 0 HA LEU B 169 3.743 -2.976 -0.563 1.00 0.45 H new ATOM 0 HB2 LEU B 169 5.380 -3.927 -2.944 1.00 0.60 H new ATOM 0 HB3 LEU B 169 4.576 -2.375 -2.817 1.00 0.60 H new ATOM 0 HG LEU B 169 6.888 -3.355 -1.114 1.00 0.77 H new ATOM 0 HD11 LEU B 169 8.116 -1.515 -2.199 1.00 1.09 H new ATOM 0 HD12 LEU B 169 7.523 -2.703 -3.385 1.00 1.09 H new ATOM 0 HD13 LEU B 169 6.682 -1.147 -3.187 1.00 1.09 H new ATOM 0 HD21 LEU B 169 6.864 -1.104 -0.112 1.00 0.77 H new ATOM 0 HD22 LEU B 169 5.383 -0.720 -1.021 1.00 0.77 H new ATOM 0 HD23 LEU B 169 5.358 -1.991 0.224 1.00 0.77 H new ATOM 819 N LEU B 170 3.012 -5.444 -2.630 1.00 0.34 N ATOM 820 CA LEU B 170 1.925 -6.053 -3.388 1.00 0.36 C ATOM 821 C LEU B 170 0.746 -6.378 -2.479 1.00 0.28 C ATOM 822 O LEU B 170 -0.394 -6.014 -2.769 1.00 0.32 O ATOM 823 CB LEU B 170 2.409 -7.322 -4.095 1.00 0.47 C ATOM 824 CG LEU B 170 3.353 -7.090 -5.280 1.00 0.59 C ATOM 825 CD1 LEU B 170 4.637 -6.416 -4.823 1.00 0.60 C ATOM 826 CD2 LEU B 170 3.660 -8.404 -5.984 1.00 0.72 C ATOM 0 H LEU B 170 3.878 -5.983 -2.626 1.00 0.34 H new ATOM 0 HA LEU B 170 1.595 -5.336 -4.140 1.00 0.36 H new ATOM 0 HB2 LEU B 170 2.916 -7.954 -3.366 1.00 0.47 H new ATOM 0 HB3 LEU B 170 1.539 -7.876 -4.447 1.00 0.47 H new ATOM 0 HG LEU B 170 2.854 -6.428 -5.988 1.00 0.59 H new ATOM 0 HD11 LEU B 170 5.292 -6.261 -5.681 1.00 0.60 H new ATOM 0 HD12 LEU B 170 4.401 -5.454 -4.368 1.00 0.60 H new ATOM 0 HD13 LEU B 170 5.140 -7.049 -4.092 1.00 0.60 H new ATOM 0 HD21 LEU B 170 4.332 -8.219 -6.822 1.00 0.72 H new ATOM 0 HD22 LEU B 170 4.135 -9.090 -5.283 1.00 0.72 H new ATOM 0 HD23 LEU B 170 2.733 -8.845 -6.352 1.00 0.72 H new ATOM 838 N LEU B 171 1.027 -7.067 -1.379 1.00 0.24 N ATOM 839 CA LEU B 171 -0.010 -7.436 -0.422 1.00 0.26 C ATOM 840 C LEU B 171 -0.722 -6.194 0.103 1.00 0.23 C ATOM 841 O LEU B 171 -1.944 -6.182 0.253 1.00 0.29 O ATOM 842 CB LEU B 171 0.597 -8.223 0.740 1.00 0.32 C ATOM 843 CG LEU B 171 1.292 -9.525 0.345 1.00 0.38 C ATOM 844 CD1 LEU B 171 1.898 -10.198 1.566 1.00 0.47 C ATOM 845 CD2 LEU B 171 0.313 -10.460 -0.351 1.00 0.50 C ATOM 0 H LEU B 171 1.964 -7.381 -1.127 1.00 0.24 H new ATOM 0 HA LEU B 171 -0.740 -8.065 -0.932 1.00 0.26 H new ATOM 0 HB2 LEU B 171 1.317 -7.586 1.254 1.00 0.32 H new ATOM 0 HB3 LEU B 171 -0.193 -8.453 1.455 1.00 0.32 H new ATOM 0 HG LEU B 171 2.097 -9.289 -0.351 1.00 0.38 H new ATOM 0 HD11 LEU B 171 2.389 -11.124 1.265 1.00 0.47 H new ATOM 0 HD12 LEU B 171 2.629 -9.532 2.023 1.00 0.47 H new ATOM 0 HD13 LEU B 171 1.111 -10.422 2.286 1.00 0.47 H new ATOM 0 HD21 LEU B 171 0.824 -11.383 -0.626 1.00 0.50 H new ATOM 0 HD22 LEU B 171 -0.513 -10.689 0.323 1.00 0.50 H new ATOM 0 HD23 LEU B 171 -0.074 -9.978 -1.249 1.00 0.50 H new ATOM 857 N SER B 172 0.054 -5.151 0.383 1.00 0.18 N ATOM 858 CA SER B 172 -0.497 -3.901 0.892 1.00 0.19 C ATOM 859 C SER B 172 -1.582 -3.362 -0.034 1.00 0.14 C ATOM 860 O SER B 172 -2.690 -3.058 0.406 1.00 0.18 O ATOM 861 CB SER B 172 0.613 -2.861 1.055 1.00 0.23 C ATOM 862 OG SER B 172 1.529 -3.246 2.066 1.00 0.31 O ATOM 0 H SER B 172 1.067 -5.148 0.266 1.00 0.18 H new ATOM 0 HA SER B 172 -0.946 -4.102 1.865 1.00 0.19 H new ATOM 0 HB2 SER B 172 1.141 -2.737 0.110 1.00 0.23 H new ATOM 0 HB3 SER B 172 0.176 -1.894 1.305 1.00 0.23 H new ATOM 0 HG SER B 172 2.021 -4.042 1.775 1.00 0.31 H new ATOM 868 N HIS B 173 -1.259 -3.242 -1.318 1.00 0.12 N ATOM 869 CA HIS B 173 -2.211 -2.734 -2.301 1.00 0.15 C ATOM 870 C HIS B 173 -3.449 -3.621 -2.377 1.00 0.20 C ATOM 871 O HIS B 173 -4.574 -3.140 -2.260 1.00 0.25 O ATOM 872 CB HIS B 173 -1.556 -2.642 -3.681 1.00 0.19 C ATOM 873 CG HIS B 173 -0.456 -1.629 -3.760 1.00 0.21 C ATOM 874 ND1 HIS B 173 0.879 -1.957 -3.645 1.00 0.26 N ATOM 875 CD2 HIS B 173 -0.497 -0.289 -3.951 1.00 0.25 C ATOM 876 CE1 HIS B 173 1.610 -0.862 -3.762 1.00 0.30 C ATOM 877 NE2 HIS B 173 0.799 0.162 -3.949 1.00 0.28 N ATOM 0 H HIS B 173 -0.347 -3.489 -1.702 1.00 0.12 H new ATOM 0 HA HIS B 173 -2.518 -1.738 -1.982 1.00 0.15 H new ATOM 0 HB2 HIS B 173 -1.157 -3.620 -3.950 1.00 0.19 H new ATOM 0 HB3 HIS B 173 -2.319 -2.395 -4.419 1.00 0.19 H new ATOM 0 HD1 HIS B 173 1.245 -2.897 -3.493 1.00 0.26 H new ATOM 0 HD2 HIS B 173 -1.384 0.313 -4.081 1.00 0.25 H new ATOM 0 HE1 HIS B 173 2.688 -0.814 -3.713 1.00 0.30 H new ATOM 0 HE2 HIS B 173 1.089 1.132 -4.072 1.00 0.28 H new ATOM 886 N LEU B 174 -3.234 -4.918 -2.568 1.00 0.21 N ATOM 887 CA LEU B 174 -4.340 -5.865 -2.663 1.00 0.28 C ATOM 888 C LEU B 174 -5.175 -5.860 -1.388 1.00 0.28 C ATOM 889 O LEU B 174 -6.395 -5.706 -1.432 1.00 0.31 O ATOM 890 CB LEU B 174 -3.810 -7.275 -2.933 1.00 0.32 C ATOM 891 CG LEU B 174 -2.999 -7.424 -4.222 1.00 0.34 C ATOM 892 CD1 LEU B 174 -2.504 -8.854 -4.378 1.00 0.40 C ATOM 893 CD2 LEU B 174 -3.833 -7.012 -5.425 1.00 0.44 C ATOM 0 H LEU B 174 -2.308 -5.337 -2.660 1.00 0.21 H new ATOM 0 HA LEU B 174 -4.977 -5.557 -3.493 1.00 0.28 H new ATOM 0 HB2 LEU B 174 -3.187 -7.580 -2.092 1.00 0.32 H new ATOM 0 HB3 LEU B 174 -4.654 -7.963 -2.971 1.00 0.32 H new ATOM 0 HG LEU B 174 -2.132 -6.766 -4.163 1.00 0.34 H new ATOM 0 HD11 LEU B 174 -1.929 -8.942 -5.300 1.00 0.40 H new ATOM 0 HD12 LEU B 174 -1.871 -9.114 -3.530 1.00 0.40 H new ATOM 0 HD13 LEU B 174 -3.357 -9.532 -4.416 1.00 0.40 H new ATOM 0 HD21 LEU B 174 -3.241 -7.124 -6.334 1.00 0.44 H new ATOM 0 HD22 LEU B 174 -4.718 -7.645 -5.488 1.00 0.44 H new ATOM 0 HD23 LEU B 174 -4.138 -5.971 -5.317 1.00 0.44 H new ATOM 905 N LEU B 175 -4.509 -6.031 -0.252 1.00 0.27 N ATOM 906 CA LEU B 175 -5.188 -6.043 1.038 1.00 0.30 C ATOM 907 C LEU B 175 -5.856 -4.701 1.317 1.00 0.27 C ATOM 908 O LEU B 175 -6.991 -4.648 1.791 1.00 0.28 O ATOM 909 CB LEU B 175 -4.198 -6.377 2.156 1.00 0.33 C ATOM 910 CG LEU B 175 -3.562 -7.766 2.064 1.00 0.38 C ATOM 911 CD1 LEU B 175 -2.522 -7.950 3.158 1.00 0.43 C ATOM 912 CD2 LEU B 175 -4.630 -8.845 2.153 1.00 0.46 C ATOM 0 H LEU B 175 -3.499 -6.163 -0.198 1.00 0.27 H new ATOM 0 HA LEU B 175 -5.961 -6.811 1.005 1.00 0.30 H new ATOM 0 HB2 LEU B 175 -3.404 -5.630 2.153 1.00 0.33 H new ATOM 0 HB3 LEU B 175 -4.712 -6.292 3.113 1.00 0.33 H new ATOM 0 HG LEU B 175 -3.063 -7.855 1.099 1.00 0.38 H new ATOM 0 HD11 LEU B 175 -2.080 -8.943 3.077 1.00 0.43 H new ATOM 0 HD12 LEU B 175 -1.742 -7.196 3.049 1.00 0.43 H new ATOM 0 HD13 LEU B 175 -2.997 -7.843 4.133 1.00 0.43 H new ATOM 0 HD21 LEU B 175 -4.162 -9.827 2.086 1.00 0.46 H new ATOM 0 HD22 LEU B 175 -5.157 -8.758 3.103 1.00 0.46 H new ATOM 0 HD23 LEU B 175 -5.338 -8.724 1.333 1.00 0.46 H new ATOM 924 N ALA B 176 -5.146 -3.618 1.017 1.00 0.25 N ATOM 925 CA ALA B 176 -5.666 -2.275 1.244 1.00 0.23 C ATOM 926 C ALA B 176 -7.035 -2.089 0.596 1.00 0.20 C ATOM 927 O ALA B 176 -7.990 -1.672 1.253 1.00 0.20 O ATOM 928 CB ALA B 176 -4.688 -1.237 0.717 1.00 0.24 C ATOM 0 H ALA B 176 -4.209 -3.645 0.616 1.00 0.25 H new ATOM 0 HA ALA B 176 -5.785 -2.140 2.319 1.00 0.23 H new ATOM 0 HB1 ALA B 176 -5.088 -0.238 0.892 1.00 0.24 H new ATOM 0 HB2 ALA B 176 -3.733 -1.342 1.233 1.00 0.24 H new ATOM 0 HB3 ALA B 176 -4.541 -1.386 -0.353 1.00 0.24 H new ATOM 934 N ILE B 177 -7.129 -2.402 -0.692 1.00 0.20 N ATOM 935 CA ILE B 177 -8.387 -2.265 -1.416 1.00 0.20 C ATOM 936 C ILE B 177 -9.457 -3.175 -0.824 1.00 0.20 C ATOM 937 O ILE B 177 -10.613 -2.776 -0.673 1.00 0.20 O ATOM 938 CB ILE B 177 -8.219 -2.591 -2.912 1.00 0.24 C ATOM 939 CG1 ILE B 177 -7.122 -1.720 -3.527 1.00 0.25 C ATOM 940 CG2 ILE B 177 -9.535 -2.388 -3.647 1.00 0.26 C ATOM 941 CD1 ILE B 177 -6.890 -1.989 -4.997 1.00 0.31 C ATOM 0 H ILE B 177 -6.352 -2.751 -1.254 1.00 0.20 H new ATOM 0 HA ILE B 177 -8.698 -1.225 -1.317 1.00 0.20 H new ATOM 0 HB ILE B 177 -7.925 -3.636 -3.010 1.00 0.24 H new ATOM 0 HG12 ILE B 177 -7.386 -0.671 -3.395 1.00 0.25 H new ATOM 0 HG13 ILE B 177 -6.191 -1.885 -2.984 1.00 0.25 H new ATOM 0 HG21 ILE B 177 -9.402 -2.622 -4.703 1.00 0.26 H new ATOM 0 HG22 ILE B 177 -10.294 -3.045 -3.223 1.00 0.26 H new ATOM 0 HG23 ILE B 177 -9.854 -1.351 -3.543 1.00 0.26 H new ATOM 0 HD11 ILE B 177 -6.099 -1.336 -5.366 1.00 0.31 H new ATOM 0 HD12 ILE B 177 -6.595 -3.029 -5.134 1.00 0.31 H new ATOM 0 HD13 ILE B 177 -7.808 -1.796 -5.552 1.00 0.31 H new ATOM 953 N GLY B 178 -9.066 -4.400 -0.487 1.00 0.23 N ATOM 954 CA GLY B 178 -10.005 -5.346 0.088 1.00 0.26 C ATOM 955 C GLY B 178 -10.658 -4.817 1.349 1.00 0.24 C ATOM 956 O GLY B 178 -11.882 -4.856 1.486 1.00 0.26 O ATOM 0 H GLY B 178 -8.116 -4.754 -0.602 1.00 0.23 H new ATOM 0 HA2 GLY B 178 -10.776 -5.581 -0.646 1.00 0.26 H new ATOM 0 HA3 GLY B 178 -9.486 -6.277 0.314 1.00 0.26 H new ATOM 960 N LEU B 179 -9.841 -4.322 2.274 1.00 0.25 N ATOM 961 CA LEU B 179 -10.348 -3.779 3.528 1.00 0.28 C ATOM 962 C LEU B 179 -11.319 -2.635 3.265 1.00 0.25 C ATOM 963 O LEU B 179 -12.365 -2.535 3.906 1.00 0.29 O ATOM 964 CB LEU B 179 -9.190 -3.291 4.401 1.00 0.33 C ATOM 965 CG LEU B 179 -8.151 -4.357 4.750 1.00 0.39 C ATOM 966 CD1 LEU B 179 -6.996 -3.743 5.527 1.00 0.47 C ATOM 967 CD2 LEU B 179 -8.793 -5.483 5.546 1.00 0.43 C ATOM 0 H LEU B 179 -8.826 -4.286 2.178 1.00 0.25 H new ATOM 0 HA LEU B 179 -10.879 -4.572 4.054 1.00 0.28 H new ATOM 0 HB2 LEU B 179 -8.689 -2.470 3.888 1.00 0.33 H new ATOM 0 HB3 LEU B 179 -9.598 -2.886 5.327 1.00 0.33 H new ATOM 0 HG LEU B 179 -7.757 -4.772 3.822 1.00 0.39 H new ATOM 0 HD11 LEU B 179 -6.267 -4.517 5.767 1.00 0.47 H new ATOM 0 HD12 LEU B 179 -6.521 -2.971 4.922 1.00 0.47 H new ATOM 0 HD13 LEU B 179 -7.372 -3.301 6.450 1.00 0.47 H new ATOM 0 HD21 LEU B 179 -8.040 -6.234 5.787 1.00 0.43 H new ATOM 0 HD22 LEU B 179 -9.214 -5.083 6.468 1.00 0.43 H new ATOM 0 HD23 LEU B 179 -9.586 -5.941 4.954 1.00 0.43 H new ATOM 979 N GLY B 180 -10.966 -1.774 2.317 1.00 0.22 N ATOM 980 CA GLY B 180 -11.819 -0.650 1.982 1.00 0.23 C ATOM 981 C GLY B 180 -13.222 -1.083 1.605 1.00 0.22 C ATOM 982 O GLY B 180 -14.203 -0.555 2.125 1.00 0.27 O ATOM 0 H GLY B 180 -10.104 -1.835 1.775 1.00 0.22 H new ATOM 0 HA2 GLY B 180 -11.868 0.032 2.831 1.00 0.23 H new ATOM 0 HA3 GLY B 180 -11.377 -0.096 1.154 1.00 0.23 H new ATOM 986 N ILE B 181 -13.316 -2.052 0.699 1.00 0.21 N ATOM 987 CA ILE B 181 -14.610 -2.555 0.255 1.00 0.27 C ATOM 988 C ILE B 181 -15.423 -3.083 1.432 1.00 0.29 C ATOM 989 O ILE B 181 -16.615 -2.798 1.555 1.00 0.35 O ATOM 990 CB ILE B 181 -14.450 -3.678 -0.789 1.00 0.34 C ATOM 991 CG1 ILE B 181 -13.637 -3.181 -1.985 1.00 0.38 C ATOM 992 CG2 ILE B 181 -15.813 -4.180 -1.242 1.00 0.44 C ATOM 993 CD1 ILE B 181 -13.450 -4.227 -3.063 1.00 0.93 C ATOM 0 H ILE B 181 -12.513 -2.503 0.260 1.00 0.21 H new ATOM 0 HA ILE B 181 -15.136 -1.718 -0.203 1.00 0.27 H new ATOM 0 HB ILE B 181 -13.914 -4.507 -0.328 1.00 0.34 H new ATOM 0 HG12 ILE B 181 -14.133 -2.311 -2.416 1.00 0.38 H new ATOM 0 HG13 ILE B 181 -12.659 -2.850 -1.637 1.00 0.38 H new ATOM 0 HG21 ILE B 181 -15.682 -4.972 -1.979 1.00 0.44 H new ATOM 0 HG22 ILE B 181 -16.361 -4.569 -0.384 1.00 0.44 H new ATOM 0 HG23 ILE B 181 -16.373 -3.358 -1.688 1.00 0.44 H new ATOM 0 HD11 ILE B 181 -12.865 -3.806 -3.881 1.00 0.93 H new ATOM 0 HD12 ILE B 181 -12.927 -5.088 -2.648 1.00 0.93 H new ATOM 0 HD13 ILE B 181 -14.424 -4.541 -3.438 1.00 0.93 H new ATOM 1005 N TYR B 182 -14.770 -3.854 2.295 1.00 0.31 N ATOM 1006 CA TYR B 182 -15.429 -4.424 3.464 1.00 0.40 C ATOM 1007 C TYR B 182 -16.119 -3.334 4.279 1.00 0.44 C ATOM 1008 O TYR B 182 -17.298 -3.446 4.616 1.00 0.52 O ATOM 1009 CB TYR B 182 -14.410 -5.162 4.335 1.00 0.44 C ATOM 1010 CG TYR B 182 -15.030 -5.983 5.443 1.00 0.56 C ATOM 1011 CD1 TYR B 182 -15.529 -5.378 6.589 1.00 1.25 C ATOM 1012 CD2 TYR B 182 -15.109 -7.367 5.345 1.00 1.42 C ATOM 1013 CE1 TYR B 182 -16.091 -6.126 7.605 1.00 1.30 C ATOM 1014 CE2 TYR B 182 -15.670 -8.123 6.356 1.00 1.52 C ATOM 1015 CZ TYR B 182 -16.159 -7.498 7.484 1.00 0.84 C ATOM 1016 OH TYR B 182 -16.717 -8.248 8.495 1.00 0.99 O ATOM 0 H TYR B 182 -13.784 -4.099 2.207 1.00 0.31 H new ATOM 0 HA TYR B 182 -16.185 -5.131 3.122 1.00 0.40 H new ATOM 0 HB2 TYR B 182 -13.813 -5.818 3.701 1.00 0.44 H new ATOM 0 HB3 TYR B 182 -13.727 -4.434 4.774 1.00 0.44 H new ATOM 0 HD1 TYR B 182 -15.477 -4.304 6.688 1.00 1.25 H new ATOM 0 HD2 TYR B 182 -14.725 -7.860 4.464 1.00 1.42 H new ATOM 0 HE1 TYR B 182 -16.475 -5.639 8.489 1.00 1.30 H new ATOM 0 HE2 TYR B 182 -15.725 -9.198 6.264 1.00 1.52 H new ATOM 0 HH TYR B 182 -16.688 -9.197 8.252 1.00 0.99 H new ATOM 1026 N ILE B 183 -15.373 -2.279 4.592 1.00 0.44 N ATOM 1027 CA ILE B 183 -15.907 -1.164 5.366 1.00 0.55 C ATOM 1028 C ILE B 183 -17.052 -0.479 4.626 1.00 0.56 C ATOM 1029 O ILE B 183 -18.068 -0.124 5.224 1.00 0.67 O ATOM 1030 CB ILE B 183 -14.814 -0.122 5.675 1.00 0.60 C ATOM 1031 CG1 ILE B 183 -13.633 -0.787 6.384 1.00 0.63 C ATOM 1032 CG2 ILE B 183 -15.382 1.006 6.522 1.00 0.74 C ATOM 1033 CD1 ILE B 183 -12.462 0.143 6.611 1.00 1.10 C ATOM 0 H ILE B 183 -14.395 -2.173 4.321 1.00 0.44 H new ATOM 0 HA ILE B 183 -16.280 -1.578 6.303 1.00 0.55 H new ATOM 0 HB ILE B 183 -14.458 0.301 4.735 1.00 0.60 H new ATOM 0 HG12 ILE B 183 -13.969 -1.176 7.345 1.00 0.63 H new ATOM 0 HG13 ILE B 183 -13.299 -1.641 5.794 1.00 0.63 H new ATOM 0 HG21 ILE B 183 -14.598 1.734 6.732 1.00 0.74 H new ATOM 0 HG22 ILE B 183 -16.194 1.493 5.982 1.00 0.74 H new ATOM 0 HG23 ILE B 183 -15.762 0.601 7.460 1.00 0.74 H new ATOM 0 HD11 ILE B 183 -11.662 -0.396 7.118 1.00 1.10 H new ATOM 0 HD12 ILE B 183 -12.099 0.512 5.652 1.00 1.10 H new ATOM 0 HD13 ILE B 183 -12.780 0.984 7.227 1.00 1.10 H new ATOM 1045 N GLY B 184 -16.879 -0.297 3.321 1.00 0.49 N ATOM 1046 CA GLY B 184 -17.899 0.351 2.517 1.00 0.55 C ATOM 1047 C GLY B 184 -19.211 -0.411 2.504 1.00 0.61 C ATOM 1048 O GLY B 184 -20.274 0.169 2.728 1.00 0.72 O ATOM 0 H GLY B 184 -16.049 -0.587 2.805 1.00 0.49 H new ATOM 0 HA2 GLY B 184 -18.072 1.357 2.900 1.00 0.55 H new ATOM 0 HA3 GLY B 184 -17.536 0.457 1.495 1.00 0.55 H new ATOM 1052 N ARG B 185 -19.138 -1.712 2.244 1.00 0.58 N ATOM 1053 CA ARG B 185 -20.331 -2.550 2.195 1.00 0.70 C ATOM 1054 C ARG B 185 -21.059 -2.560 3.536 1.00 0.81 C ATOM 1055 O ARG B 185 -22.276 -2.734 3.589 1.00 0.96 O ATOM 1056 CB ARG B 185 -19.964 -3.979 1.792 1.00 0.71 C ATOM 1057 CG ARG B 185 -18.957 -4.632 2.717 1.00 0.66 C ATOM 1058 CD ARG B 185 -18.981 -6.146 2.585 1.00 0.80 C ATOM 1059 NE ARG B 185 -18.811 -6.576 1.200 1.00 1.20 N ATOM 1060 CZ ARG B 185 -18.866 -7.847 0.811 1.00 1.57 C ATOM 1061 NH1 ARG B 185 -19.077 -8.805 1.703 1.00 1.68 N ATOM 1062 NH2 ARG B 185 -18.711 -8.159 -0.468 1.00 2.16 N ATOM 0 H ARG B 185 -18.266 -2.209 2.064 1.00 0.58 H new ATOM 0 HA ARG B 185 -21.001 -2.127 1.446 1.00 0.70 H new ATOM 0 HB2 ARG B 185 -20.870 -4.585 1.769 1.00 0.71 H new ATOM 0 HB3 ARG B 185 -19.561 -3.970 0.779 1.00 0.71 H new ATOM 0 HG2 ARG B 185 -17.958 -4.261 2.489 1.00 0.66 H new ATOM 0 HG3 ARG B 185 -19.173 -4.352 3.748 1.00 0.66 H new ATOM 0 HD2 ARG B 185 -18.189 -6.576 3.198 1.00 0.80 H new ATOM 0 HD3 ARG B 185 -19.926 -6.529 2.970 1.00 0.80 H new ATOM 0 HE ARG B 185 -18.641 -5.862 0.491 1.00 1.20 H new ATOM 0 HH11 ARG B 185 -19.197 -8.568 2.688 1.00 1.68 H new ATOM 0 HH12 ARG B 185 -19.119 -9.779 1.405 1.00 1.68 H new ATOM 0 HH21 ARG B 185 -18.549 -7.424 -1.156 1.00 2.16 H new ATOM 0 HH22 ARG B 185 -18.754 -9.134 -0.764 1.00 2.16 H new ATOM 1076 N ARG B 186 -20.309 -2.375 4.618 1.00 0.81 N ATOM 1077 CA ARG B 186 -20.893 -2.366 5.955 1.00 0.96 C ATOM 1078 C ARG B 186 -21.193 -0.941 6.406 1.00 1.01 C ATOM 1079 O ARG B 186 -21.180 -0.640 7.600 1.00 1.13 O ATOM 1080 CB ARG B 186 -19.953 -3.043 6.953 1.00 1.01 C ATOM 1081 CG ARG B 186 -18.698 -2.241 7.248 1.00 1.69 C ATOM 1082 CD ARG B 186 -17.816 -2.944 8.269 1.00 1.93 C ATOM 1083 NE ARG B 186 -18.561 -3.319 9.467 1.00 2.51 N ATOM 1084 CZ ARG B 186 -18.794 -2.493 10.482 1.00 3.04 C ATOM 1085 NH1 ARG B 186 -18.351 -1.244 10.441 1.00 3.17 N ATOM 1086 NH2 ARG B 186 -19.475 -2.914 11.538 1.00 3.82 N ATOM 0 H ARG B 186 -19.300 -2.230 4.596 1.00 0.81 H new ATOM 0 HA ARG B 186 -21.830 -2.922 5.918 1.00 0.96 H new ATOM 0 HB2 ARG B 186 -20.491 -3.216 7.885 1.00 1.01 H new ATOM 0 HB3 ARG B 186 -19.666 -4.020 6.564 1.00 1.01 H new ATOM 0 HG2 ARG B 186 -18.138 -2.087 6.326 1.00 1.69 H new ATOM 0 HG3 ARG B 186 -18.974 -1.255 7.621 1.00 1.69 H new ATOM 0 HD2 ARG B 186 -17.380 -3.836 7.819 1.00 1.93 H new ATOM 0 HD3 ARG B 186 -16.989 -2.290 8.546 1.00 1.93 H new ATOM 0 HE ARG B 186 -18.924 -4.270 9.529 1.00 2.51 H new ATOM 0 HH11 ARG B 186 -17.830 -0.914 9.629 1.00 3.17 H new ATOM 0 HH12 ARG B 186 -18.532 -0.613 11.222 1.00 3.17 H new ATOM 0 HH21 ARG B 186 -19.821 -3.873 11.573 1.00 3.82 H new ATOM 0 HH22 ARG B 186 -19.653 -2.279 12.316 1.00 3.82 H new ATOM 1100 N LEU B 187 -21.466 -0.066 5.442 1.00 1.01 N ATOM 1101 CA LEU B 187 -21.769 1.329 5.735 1.00 1.13 C ATOM 1102 C LEU B 187 -23.244 1.515 6.076 1.00 1.19 C ATOM 1103 O LEU B 187 -23.627 1.526 7.246 1.00 1.41 O ATOM 1104 CB LEU B 187 -21.401 2.213 4.543 1.00 1.19 C ATOM 1105 CG LEU B 187 -19.916 2.524 4.397 1.00 1.31 C ATOM 1106 CD1 LEU B 187 -19.664 3.300 3.114 1.00 1.51 C ATOM 1107 CD2 LEU B 187 -19.428 3.305 5.603 1.00 1.63 C ATOM 0 H LEU B 187 -21.483 -0.301 4.449 1.00 1.01 H new ATOM 0 HA LEU B 187 -21.176 1.623 6.601 1.00 1.13 H new ATOM 0 HB2 LEU B 187 -21.745 1.726 3.631 1.00 1.19 H new ATOM 0 HB3 LEU B 187 -21.946 3.153 4.627 1.00 1.19 H new ATOM 0 HG LEU B 187 -19.361 1.588 4.344 1.00 1.31 H new ATOM 0 HD11 LEU B 187 -18.599 3.516 3.022 1.00 1.51 H new ATOM 0 HD12 LEU B 187 -19.989 2.706 2.260 1.00 1.51 H new ATOM 0 HD13 LEU B 187 -20.223 4.236 3.139 1.00 1.51 H new ATOM 0 HD21 LEU B 187 -18.366 3.523 5.490 1.00 1.63 H new ATOM 0 HD22 LEU B 187 -19.984 4.239 5.681 1.00 1.63 H new ATOM 0 HD23 LEU B 187 -19.583 2.715 6.506 1.00 1.63 H new ATOM 1119 N THR B 188 -24.065 1.658 5.042 1.00 1.18 N ATOM 1120 CA THR B 188 -25.498 1.852 5.218 1.00 1.42 C ATOM 1121 C THR B 188 -26.219 0.518 5.372 1.00 1.73 C ATOM 1122 O THR B 188 -26.656 -0.038 4.343 1.00 2.31 O ATOM 1123 CB THR B 188 -26.098 2.620 4.026 1.00 1.57 C ATOM 1124 OG1 THR B 188 -26.085 1.795 2.854 1.00 2.12 O ATOM 1125 CG2 THR B 188 -25.310 3.895 3.758 1.00 1.44 C ATOM 1126 OXT THR B 188 -26.340 0.040 6.519 1.00 2.10 O ATOM 0 H THR B 188 -23.760 1.643 4.069 1.00 1.18 H new ATOM 0 HA THR B 188 -25.637 2.436 6.128 1.00 1.42 H new ATOM 0 HB THR B 188 -27.126 2.886 4.272 1.00 1.57 H new ATOM 0 HG1 THR B 188 -26.551 0.953 3.041 1.00 2.12 H new ATOM 0 HG21 THR B 188 -25.750 4.423 2.912 1.00 1.44 H new ATOM 0 HG22 THR B 188 -25.341 4.534 4.641 1.00 1.44 H new ATOM 0 HG23 THR B 188 -24.275 3.642 3.529 1.00 1.44 H new TER 1134 THR B 188