USER MOD reduce.3.24.130724 H: found=0, std=0, add=588, rem=0, adj=13 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 Single : A 158 SER OG : rot -34:sc= 0.421 USER MOD Single : A 163 LYS NZ :NH3+ -132:sc= 0.803 (180deg=-2.36) USER MOD Single : A 168 SER OG : rot -16:sc= -1.96 USER MOD Single : A 172 SER OG : rot 66:sc= 1.14 USER MOD Single : A 173 HIS : no HE2:sc= -1.15 K(o=-1.1,f=-3.1!) USER MOD Single : A 182 TYR OH : rot 180:sc= 0.0174 USER MOD Single : A 188 THR OG1 : rot -63:sc= 0.32 USER MOD Single : B 158 SER OG : rot 180:sc= 0.0769 USER MOD Single : B 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 168 SER OG : rot -42:sc= 0.933 USER MOD Single : B 172 SER OG : rot 64:sc= 1.22 USER MOD Single : B 173 HIS : no HE2:sc= -0.136 K(o=-0.14,f=-2.9!) 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 -18.625 9.760 -8.788 1.00 7.13 N ATOM 2 CA GLY A 154 -17.151 9.854 -8.604 1.00 6.87 C ATOM 3 C GLY A 154 -16.553 8.576 -8.050 1.00 6.46 C ATOM 4 O GLY A 154 -15.919 7.814 -8.779 1.00 6.66 O ATOM 0 HA2 GLY A 154 -16.683 10.086 -9.561 1.00 6.87 H new ATOM 0 HA3 GLY A 154 -16.924 10.680 -7.930 1.00 6.87 H new ATOM 10 N GLY A 155 -16.755 8.341 -6.758 1.00 6.07 N ATOM 11 CA GLY A 155 -16.223 7.146 -6.130 1.00 5.79 C ATOM 12 C GLY A 155 -17.289 6.109 -5.868 1.00 5.77 C ATOM 13 O GLY A 155 -18.430 6.251 -6.309 1.00 5.89 O ATOM 0 H GLY A 155 -17.277 8.957 -6.135 1.00 6.07 H new ATOM 0 HA2 GLY A 155 -15.451 6.716 -6.769 1.00 5.79 H new ATOM 0 HA3 GLY A 155 -15.744 7.416 -5.189 1.00 5.79 H new ATOM 17 N ILE A 156 -16.914 5.063 -5.150 1.00 5.76 N ATOM 18 CA ILE A 156 -17.849 3.999 -4.815 1.00 5.93 C ATOM 19 C ILE A 156 -18.947 4.544 -3.915 1.00 5.47 C ATOM 20 O ILE A 156 -20.123 4.215 -4.073 1.00 5.66 O ATOM 21 CB ILE A 156 -17.143 2.839 -4.090 1.00 6.19 C ATOM 22 CG1 ILE A 156 -15.964 2.329 -4.918 1.00 6.65 C ATOM 23 CG2 ILE A 156 -18.128 1.713 -3.808 1.00 6.57 C ATOM 24 CD1 ILE A 156 -15.046 1.409 -4.149 1.00 7.47 C ATOM 0 H ILE A 156 -15.970 4.927 -4.788 1.00 5.76 H new ATOM 0 HA ILE A 156 -18.273 3.623 -5.746 1.00 5.93 H new ATOM 0 HB ILE A 156 -16.759 3.207 -3.139 1.00 6.19 H new ATOM 0 HG12 ILE A 156 -16.345 1.802 -5.793 1.00 6.65 H new ATOM 0 HG13 ILE A 156 -15.390 3.181 -5.283 1.00 6.65 H new ATOM 0 HG21 ILE A 156 -17.614 0.900 -3.295 1.00 6.57 H new ATOM 0 HG22 ILE A 156 -18.936 2.086 -3.179 1.00 6.57 H new ATOM 0 HG23 ILE A 156 -18.540 1.346 -4.748 1.00 6.57 H new ATOM 0 HD11 ILE A 156 -14.231 1.084 -4.796 1.00 7.47 H new ATOM 0 HD12 ILE A 156 -14.637 1.939 -3.289 1.00 7.47 H new ATOM 0 HD13 ILE A 156 -15.606 0.539 -3.807 1.00 7.47 H new ATOM 36 N PHE A 157 -18.546 5.383 -2.969 1.00 4.98 N ATOM 37 CA PHE A 157 -19.482 6.002 -2.043 1.00 4.58 C ATOM 38 C PHE A 157 -20.219 7.154 -2.719 1.00 4.34 C ATOM 39 O PHE A 157 -21.449 7.208 -2.713 1.00 4.45 O ATOM 40 CB PHE A 157 -18.738 6.506 -0.804 1.00 4.32 C ATOM 41 CG PHE A 157 -19.596 7.304 0.134 1.00 4.64 C ATOM 42 CD1 PHE A 157 -20.688 6.724 0.759 1.00 4.83 C ATOM 43 CD2 PHE A 157 -19.308 8.633 0.394 1.00 5.07 C ATOM 44 CE1 PHE A 157 -21.476 7.455 1.627 1.00 5.16 C ATOM 45 CE2 PHE A 157 -20.093 9.371 1.260 1.00 5.44 C ATOM 46 CZ PHE A 157 -21.178 8.781 1.877 1.00 5.37 C ATOM 0 H PHE A 157 -17.573 5.651 -2.823 1.00 4.98 H new ATOM 0 HA PHE A 157 -20.215 5.255 -1.737 1.00 4.58 H new ATOM 0 HB2 PHE A 157 -18.325 5.652 -0.267 1.00 4.32 H new ATOM 0 HB3 PHE A 157 -17.895 7.120 -1.122 1.00 4.32 H new ATOM 0 HD1 PHE A 157 -20.926 5.688 0.565 1.00 4.83 H new ATOM 0 HD2 PHE A 157 -18.460 9.099 -0.086 1.00 5.07 H new ATOM 0 HE1 PHE A 157 -22.324 6.991 2.109 1.00 5.16 H new ATOM 0 HE2 PHE A 157 -19.858 10.407 1.454 1.00 5.44 H new ATOM 0 HZ PHE A 157 -21.793 9.355 2.554 1.00 5.37 H new ATOM 56 N SER A 158 -19.456 8.072 -3.304 1.00 4.12 N ATOM 57 CA SER A 158 -20.030 9.225 -3.987 1.00 4.02 C ATOM 58 C SER A 158 -18.975 9.946 -4.815 1.00 3.76 C ATOM 59 O SER A 158 -19.074 10.028 -6.040 1.00 3.52 O ATOM 60 CB SER A 158 -20.613 10.200 -2.973 1.00 4.46 C ATOM 61 OG SER A 158 -21.396 9.527 -2.003 1.00 4.61 O ATOM 0 H SER A 158 -18.437 8.039 -3.318 1.00 4.12 H new ATOM 0 HA SER A 158 -20.818 8.864 -4.648 1.00 4.02 H new ATOM 0 HB2 SER A 158 -19.806 10.741 -2.480 1.00 4.46 H new ATOM 0 HB3 SER A 158 -21.225 10.940 -3.488 1.00 4.46 H new ATOM 0 HG SER A 158 -21.842 8.759 -2.418 1.00 4.61 H new ATOM 67 N ALA A 159 -17.963 10.465 -4.129 1.00 3.90 N ATOM 68 CA ALA A 159 -16.877 11.188 -4.778 1.00 3.72 C ATOM 69 C ALA A 159 -15.874 11.689 -3.747 1.00 3.49 C ATOM 70 O ALA A 159 -14.676 11.426 -3.854 1.00 3.16 O ATOM 71 CB ALA A 159 -17.429 12.351 -5.591 1.00 4.05 C ATOM 0 H ALA A 159 -17.873 10.397 -3.115 1.00 3.90 H new ATOM 0 HA ALA A 159 -16.362 10.504 -5.452 1.00 3.72 H new ATOM 0 HB1 ALA A 159 -16.607 12.882 -6.070 1.00 4.05 H new ATOM 0 HB2 ALA A 159 -18.109 11.971 -6.353 1.00 4.05 H new ATOM 0 HB3 ALA A 159 -17.967 13.033 -4.932 1.00 4.05 H new ATOM 77 N GLU A 160 -16.372 12.405 -2.743 1.00 3.73 N ATOM 78 CA GLU A 160 -15.522 12.941 -1.685 1.00 3.65 C ATOM 79 C GLU A 160 -14.710 11.829 -1.030 1.00 3.31 C ATOM 80 O GLU A 160 -13.629 12.070 -0.493 1.00 3.18 O ATOM 81 CB GLU A 160 -16.374 13.653 -0.634 1.00 4.04 C ATOM 82 CG GLU A 160 -17.147 14.840 -1.182 1.00 4.66 C ATOM 83 CD GLU A 160 -18.021 15.497 -0.132 1.00 5.01 C ATOM 84 OE1 GLU A 160 -17.511 16.368 0.604 1.00 5.46 O ATOM 85 OE2 GLU A 160 -19.214 15.142 -0.046 1.00 5.23 O ATOM 0 H GLU A 160 -17.362 12.628 -2.640 1.00 3.73 H new ATOM 0 HA GLU A 160 -14.832 13.658 -2.130 1.00 3.65 H new ATOM 0 HB2 GLU A 160 -17.077 12.940 -0.204 1.00 4.04 H new ATOM 0 HB3 GLU A 160 -15.728 13.993 0.176 1.00 4.04 H new ATOM 0 HG2 GLU A 160 -16.446 15.575 -1.578 1.00 4.66 H new ATOM 0 HG3 GLU A 160 -17.769 14.512 -2.015 1.00 4.66 H new ATOM 92 N PHE A 161 -15.238 10.608 -1.079 1.00 3.23 N ATOM 93 CA PHE A 161 -14.558 9.458 -0.494 1.00 2.95 C ATOM 94 C PHE A 161 -13.200 9.244 -1.153 1.00 2.57 C ATOM 95 O PHE A 161 -12.229 8.872 -0.494 1.00 2.28 O ATOM 96 CB PHE A 161 -15.413 8.198 -0.642 1.00 3.11 C ATOM 97 CG PHE A 161 -14.724 6.947 -0.177 1.00 2.87 C ATOM 98 CD1 PHE A 161 -14.677 6.627 1.171 1.00 3.09 C ATOM 99 CD2 PHE A 161 -14.123 6.090 -1.087 1.00 2.82 C ATOM 100 CE1 PHE A 161 -14.043 5.476 1.602 1.00 2.88 C ATOM 101 CE2 PHE A 161 -13.488 4.940 -0.661 1.00 2.72 C ATOM 102 CZ PHE A 161 -13.449 4.633 0.685 1.00 2.54 C ATOM 0 H PHE A 161 -16.133 10.391 -1.517 1.00 3.23 H new ATOM 0 HA PHE A 161 -14.405 9.658 0.566 1.00 2.95 H new ATOM 0 HB2 PHE A 161 -16.336 8.326 -0.076 1.00 3.11 H new ATOM 0 HB3 PHE A 161 -15.694 8.081 -1.688 1.00 3.11 H new ATOM 0 HD1 PHE A 161 -15.140 7.284 1.892 1.00 3.09 H new ATOM 0 HD2 PHE A 161 -14.152 6.325 -2.141 1.00 2.82 H new ATOM 0 HE1 PHE A 161 -14.013 5.237 2.655 1.00 2.88 H new ATOM 0 HE2 PHE A 161 -13.023 4.282 -1.379 1.00 2.72 H new ATOM 0 HZ PHE A 161 -12.954 3.733 1.020 1.00 2.54 H new ATOM 112 N LEU A 162 -13.142 9.483 -2.459 1.00 2.64 N ATOM 113 CA LEU A 162 -11.908 9.319 -3.216 1.00 2.41 C ATOM 114 C LEU A 162 -10.838 10.288 -2.724 1.00 2.23 C ATOM 115 O LEU A 162 -9.661 9.939 -2.634 1.00 1.96 O ATOM 116 CB LEU A 162 -12.174 9.540 -4.705 1.00 2.72 C ATOM 117 CG LEU A 162 -13.224 8.611 -5.318 1.00 2.97 C ATOM 118 CD1 LEU A 162 -13.574 9.057 -6.729 1.00 3.35 C ATOM 119 CD2 LEU A 162 -12.724 7.174 -5.320 1.00 2.73 C ATOM 0 H LEU A 162 -13.939 9.792 -3.016 1.00 2.64 H new ATOM 0 HA LEU A 162 -11.544 8.303 -3.066 1.00 2.41 H new ATOM 0 HB2 LEU A 162 -12.493 10.572 -4.853 1.00 2.72 H new ATOM 0 HB3 LEU A 162 -11.238 9.415 -5.249 1.00 2.72 H new ATOM 0 HG LEU A 162 -14.127 8.662 -4.710 1.00 2.97 H new ATOM 0 HD11 LEU A 162 -14.322 8.384 -7.148 1.00 3.35 H new ATOM 0 HD12 LEU A 162 -13.973 10.071 -6.702 1.00 3.35 H new ATOM 0 HD13 LEU A 162 -12.678 9.036 -7.350 1.00 3.35 H new ATOM 0 HD21 LEU A 162 -13.482 6.526 -5.759 1.00 2.73 H new ATOM 0 HD22 LEU A 162 -11.807 7.109 -5.906 1.00 2.73 H new ATOM 0 HD23 LEU A 162 -12.524 6.857 -4.296 1.00 2.73 H new ATOM 131 N LYS A 163 -11.259 11.507 -2.408 1.00 2.45 N ATOM 132 CA LYS A 163 -10.353 12.531 -1.917 1.00 2.39 C ATOM 133 C LYS A 163 -9.575 12.035 -0.701 1.00 2.08 C ATOM 134 O LYS A 163 -8.447 12.465 -0.454 1.00 1.99 O ATOM 135 CB LYS A 163 -11.143 13.791 -1.565 1.00 2.73 C ATOM 136 CG LYS A 163 -11.259 14.777 -2.715 1.00 3.30 C ATOM 137 CD LYS A 163 -11.720 14.108 -4.000 1.00 3.60 C ATOM 138 CE LYS A 163 -13.208 13.808 -3.973 1.00 3.55 C ATOM 139 NZ LYS A 163 -13.697 13.305 -5.286 1.00 3.93 N ATOM 0 H LYS A 163 -12.230 11.809 -2.485 1.00 2.45 H new ATOM 0 HA LYS A 163 -9.634 12.765 -2.702 1.00 2.39 H new ATOM 0 HB2 LYS A 163 -12.143 13.504 -1.241 1.00 2.73 H new ATOM 0 HB3 LYS A 163 -10.664 14.286 -0.720 1.00 2.73 H new ATOM 0 HG2 LYS A 163 -11.961 15.566 -2.446 1.00 3.30 H new ATOM 0 HG3 LYS A 163 -10.293 15.254 -2.882 1.00 3.30 H new ATOM 0 HD2 LYS A 163 -11.494 14.754 -4.848 1.00 3.60 H new ATOM 0 HD3 LYS A 163 -11.164 13.182 -4.148 1.00 3.60 H new ATOM 0 HE2 LYS A 163 -13.415 13.067 -3.201 1.00 3.55 H new ATOM 0 HE3 LYS A 163 -13.756 14.711 -3.703 1.00 3.55 H new ATOM 0 HZ1 LYS A 163 -14.559 13.821 -5.556 1.00 3.93 H new ATOM 0 HZ2 LYS A 163 -12.964 13.453 -6.009 1.00 3.93 H new ATOM 0 HZ3 LYS A 163 -13.910 12.290 -5.211 1.00 3.93 H new ATOM 153 N VAL A 164 -10.184 11.127 0.055 1.00 2.04 N ATOM 154 CA VAL A 164 -9.543 10.563 1.237 1.00 1.90 C ATOM 155 C VAL A 164 -9.209 9.092 1.019 1.00 1.69 C ATOM 156 O VAL A 164 -9.228 8.291 1.954 1.00 1.85 O ATOM 157 CB VAL A 164 -10.435 10.701 2.487 1.00 2.27 C ATOM 158 CG1 VAL A 164 -10.583 12.162 2.880 1.00 2.48 C ATOM 159 CG2 VAL A 164 -11.797 10.067 2.246 1.00 2.51 C ATOM 0 H VAL A 164 -11.120 10.766 -0.130 1.00 2.04 H new ATOM 0 HA VAL A 164 -8.624 11.125 1.401 1.00 1.90 H new ATOM 0 HB VAL A 164 -9.955 10.173 3.311 1.00 2.27 H new ATOM 0 HG11 VAL A 164 -11.216 12.239 3.764 1.00 2.48 H new ATOM 0 HG12 VAL A 164 -9.601 12.581 3.099 1.00 2.48 H new ATOM 0 HG13 VAL A 164 -11.038 12.715 2.059 1.00 2.48 H new ATOM 0 HG21 VAL A 164 -12.412 10.175 3.140 1.00 2.51 H new ATOM 0 HG22 VAL A 164 -12.286 10.563 1.407 1.00 2.51 H new ATOM 0 HG23 VAL A 164 -11.670 9.009 2.018 1.00 2.51 H new ATOM 169 N PHE A 165 -8.902 8.746 -0.228 1.00 1.49 N ATOM 170 CA PHE A 165 -8.564 7.374 -0.587 1.00 1.32 C ATOM 171 C PHE A 165 -7.382 7.349 -1.553 1.00 1.13 C ATOM 172 O PHE A 165 -6.302 6.864 -1.218 1.00 0.96 O ATOM 173 CB PHE A 165 -9.775 6.687 -1.223 1.00 1.48 C ATOM 174 CG PHE A 165 -9.587 5.216 -1.463 1.00 1.40 C ATOM 175 CD1 PHE A 165 -9.885 4.296 -0.469 1.00 1.57 C ATOM 176 CD2 PHE A 165 -9.123 4.751 -2.683 1.00 2.06 C ATOM 177 CE1 PHE A 165 -9.719 2.942 -0.686 1.00 1.61 C ATOM 178 CE2 PHE A 165 -8.954 3.397 -2.906 1.00 2.08 C ATOM 179 CZ PHE A 165 -9.253 2.491 -1.907 1.00 1.47 C ATOM 0 H PHE A 165 -8.881 9.401 -1.010 1.00 1.49 H new ATOM 0 HA PHE A 165 -8.283 6.837 0.319 1.00 1.32 H new ATOM 0 HB2 PHE A 165 -10.642 6.832 -0.578 1.00 1.48 H new ATOM 0 HB3 PHE A 165 -9.999 7.174 -2.172 1.00 1.48 H new ATOM 0 HD1 PHE A 165 -10.251 4.642 0.486 1.00 1.57 H new ATOM 0 HD2 PHE A 165 -8.891 5.454 -3.469 1.00 2.06 H new ATOM 0 HE1 PHE A 165 -9.953 2.236 0.097 1.00 1.61 H new ATOM 0 HE2 PHE A 165 -8.589 3.048 -3.860 1.00 2.08 H new ATOM 0 HZ PHE A 165 -9.123 1.433 -2.079 1.00 1.47 H new ATOM 189 N LEU A 166 -7.594 7.885 -2.749 1.00 1.25 N ATOM 190 CA LEU A 166 -6.551 7.926 -3.766 1.00 1.22 C ATOM 191 C LEU A 166 -5.251 8.528 -3.223 1.00 1.03 C ATOM 192 O LEU A 166 -4.185 7.931 -3.366 1.00 0.95 O ATOM 193 CB LEU A 166 -7.026 8.714 -4.991 1.00 1.49 C ATOM 194 CG LEU A 166 -8.279 8.163 -5.673 1.00 1.76 C ATOM 195 CD1 LEU A 166 -8.637 9.007 -6.886 1.00 2.04 C ATOM 196 CD2 LEU A 166 -8.073 6.710 -6.074 1.00 1.79 C ATOM 0 H LEU A 166 -8.481 8.298 -3.038 1.00 1.25 H new ATOM 0 HA LEU A 166 -6.344 6.898 -4.062 1.00 1.22 H new ATOM 0 HB2 LEU A 166 -7.219 9.743 -4.689 1.00 1.49 H new ATOM 0 HB3 LEU A 166 -6.217 8.743 -5.721 1.00 1.49 H new ATOM 0 HG LEU A 166 -9.107 8.209 -4.965 1.00 1.76 H new ATOM 0 HD11 LEU A 166 -9.531 8.602 -7.360 1.00 2.04 H new ATOM 0 HD12 LEU A 166 -8.826 10.033 -6.572 1.00 2.04 H new ATOM 0 HD13 LEU A 166 -7.811 8.992 -7.597 1.00 2.04 H new ATOM 0 HD21 LEU A 166 -8.975 6.335 -6.558 1.00 1.79 H new ATOM 0 HD22 LEU A 166 -7.234 6.639 -6.766 1.00 1.79 H new ATOM 0 HD23 LEU A 166 -7.863 6.114 -5.186 1.00 1.79 H new ATOM 208 N PRO A 167 -5.306 9.717 -2.592 1.00 1.04 N ATOM 209 CA PRO A 167 -4.105 10.366 -2.051 1.00 0.94 C ATOM 210 C PRO A 167 -3.534 9.643 -0.833 1.00 0.80 C ATOM 211 O PRO A 167 -2.413 9.922 -0.409 1.00 0.85 O ATOM 212 CB PRO A 167 -4.596 11.761 -1.663 1.00 1.03 C ATOM 213 CG PRO A 167 -6.051 11.589 -1.401 1.00 1.28 C ATOM 214 CD PRO A 167 -6.522 10.522 -2.351 1.00 1.26 C ATOM 0 HA PRO A 167 -3.292 10.369 -2.777 1.00 0.94 H new ATOM 0 HB2 PRO A 167 -4.076 12.133 -0.780 1.00 1.03 H new ATOM 0 HB3 PRO A 167 -4.420 12.480 -2.463 1.00 1.03 H new ATOM 0 HG2 PRO A 167 -6.229 11.296 -0.366 1.00 1.28 H new ATOM 0 HG3 PRO A 167 -6.590 12.522 -1.565 1.00 1.28 H new ATOM 0 HD2 PRO A 167 -7.322 9.922 -1.917 1.00 1.26 H new ATOM 0 HD3 PRO A 167 -6.910 10.950 -3.275 1.00 1.26 H new ATOM 222 N SER A 168 -4.302 8.715 -0.270 1.00 0.76 N ATOM 223 CA SER A 168 -3.853 7.970 0.901 1.00 0.70 C ATOM 224 C SER A 168 -3.216 6.642 0.499 1.00 0.57 C ATOM 225 O SER A 168 -2.094 6.335 0.903 1.00 0.51 O ATOM 226 CB SER A 168 -5.024 7.724 1.854 1.00 0.82 C ATOM 227 OG SER A 168 -6.092 7.067 1.193 1.00 1.39 O ATOM 0 H SER A 168 -5.232 8.462 -0.603 1.00 0.76 H new ATOM 0 HA SER A 168 -3.098 8.568 1.411 1.00 0.70 H new ATOM 0 HB2 SER A 168 -4.689 7.121 2.698 1.00 0.82 H new ATOM 0 HB3 SER A 168 -5.373 8.674 2.259 1.00 0.82 H new ATOM 0 HG SER A 168 -5.965 7.131 0.223 1.00 1.39 H new ATOM 233 N LEU A 169 -3.935 5.858 -0.297 1.00 0.58 N ATOM 234 CA LEU A 169 -3.436 4.564 -0.750 1.00 0.51 C ATOM 235 C LEU A 169 -2.179 4.719 -1.603 1.00 0.41 C ATOM 236 O LEU A 169 -1.166 4.064 -1.356 1.00 0.36 O ATOM 237 CB LEU A 169 -4.515 3.820 -1.529 1.00 0.64 C ATOM 238 CG LEU A 169 -5.659 3.280 -0.672 1.00 0.77 C ATOM 239 CD1 LEU A 169 -6.713 4.348 -0.432 1.00 1.07 C ATOM 240 CD2 LEU A 169 -6.270 2.056 -1.323 1.00 0.81 C ATOM 0 H LEU A 169 -4.865 6.096 -0.642 1.00 0.58 H new ATOM 0 HA LEU A 169 -3.172 3.982 0.133 1.00 0.51 H new ATOM 0 HB2 LEU A 169 -4.928 4.490 -2.283 1.00 0.64 H new ATOM 0 HB3 LEU A 169 -4.053 2.988 -2.061 1.00 0.64 H new ATOM 0 HG LEU A 169 -5.254 2.991 0.298 1.00 0.77 H new ATOM 0 HD11 LEU A 169 -7.515 3.936 0.180 1.00 1.07 H new ATOM 0 HD12 LEU A 169 -6.261 5.196 0.083 1.00 1.07 H new ATOM 0 HD13 LEU A 169 -7.120 4.679 -1.388 1.00 1.07 H new ATOM 0 HD21 LEU A 169 -7.084 1.682 -0.702 1.00 0.81 H new ATOM 0 HD22 LEU A 169 -6.657 2.322 -2.307 1.00 0.81 H new ATOM 0 HD23 LEU A 169 -5.509 1.283 -1.429 1.00 0.81 H new ATOM 252 N LEU A 170 -2.251 5.588 -2.606 1.00 0.46 N ATOM 253 CA LEU A 170 -1.117 5.828 -3.493 1.00 0.47 C ATOM 254 C LEU A 170 0.116 6.265 -2.708 1.00 0.38 C ATOM 255 O LEU A 170 1.194 5.688 -2.858 1.00 0.39 O ATOM 256 CB LEU A 170 -1.475 6.884 -4.543 1.00 0.60 C ATOM 257 CG LEU A 170 -2.423 6.417 -5.656 1.00 0.73 C ATOM 258 CD1 LEU A 170 -3.513 5.506 -5.109 1.00 0.88 C ATOM 259 CD2 LEU A 170 -3.037 7.615 -6.365 1.00 1.12 C ATOM 0 H LEU A 170 -3.082 6.138 -2.825 1.00 0.46 H new ATOM 0 HA LEU A 170 -0.883 4.891 -3.998 1.00 0.47 H new ATOM 0 HB2 LEU A 170 -1.930 7.735 -4.036 1.00 0.60 H new ATOM 0 HB3 LEU A 170 -0.553 7.242 -5.002 1.00 0.60 H new ATOM 0 HG LEU A 170 -1.839 5.843 -6.376 1.00 0.73 H new ATOM 0 HD11 LEU A 170 -4.168 5.193 -5.922 1.00 0.88 H new ATOM 0 HD12 LEU A 170 -3.057 4.628 -4.651 1.00 0.88 H new ATOM 0 HD13 LEU A 170 -4.096 6.044 -4.361 1.00 0.88 H new ATOM 0 HD21 LEU A 170 -3.707 7.268 -7.152 1.00 1.12 H new ATOM 0 HD22 LEU A 170 -3.599 8.214 -5.648 1.00 1.12 H new ATOM 0 HD23 LEU A 170 -2.246 8.223 -6.804 1.00 1.12 H new ATOM 271 N LEU A 171 -0.044 7.284 -1.871 1.00 0.36 N ATOM 272 CA LEU A 171 1.064 7.789 -1.068 1.00 0.37 C ATOM 273 C LEU A 171 1.621 6.696 -0.160 1.00 0.32 C ATOM 274 O LEU A 171 2.835 6.544 -0.029 1.00 0.35 O ATOM 275 CB LEU A 171 0.617 8.988 -0.227 1.00 0.44 C ATOM 276 CG LEU A 171 0.268 10.247 -1.022 1.00 0.54 C ATOM 277 CD1 LEU A 171 -0.069 11.394 -0.081 1.00 0.64 C ATOM 278 CD2 LEU A 171 1.418 10.635 -1.940 1.00 0.62 C ATOM 0 H LEU A 171 -0.927 7.775 -1.731 1.00 0.36 H new ATOM 0 HA LEU A 171 1.852 8.110 -1.749 1.00 0.37 H new ATOM 0 HB2 LEU A 171 -0.254 8.695 0.360 1.00 0.44 H new ATOM 0 HB3 LEU A 171 1.410 9.232 0.479 1.00 0.44 H new ATOM 0 HG LEU A 171 -0.607 10.034 -1.636 1.00 0.54 H new ATOM 0 HD11 LEU A 171 -0.315 12.282 -0.663 1.00 0.64 H new ATOM 0 HD12 LEU A 171 -0.923 11.118 0.538 1.00 0.64 H new ATOM 0 HD13 LEU A 171 0.789 11.605 0.557 1.00 0.64 H new ATOM 0 HD21 LEU A 171 1.151 11.533 -2.498 1.00 0.62 H new ATOM 0 HD22 LEU A 171 2.310 10.829 -1.344 1.00 0.62 H new ATOM 0 HD23 LEU A 171 1.618 9.821 -2.637 1.00 0.62 H new ATOM 290 N SER A 172 0.725 5.937 0.463 1.00 0.28 N ATOM 291 CA SER A 172 1.128 4.859 1.359 1.00 0.29 C ATOM 292 C SER A 172 2.020 3.852 0.640 1.00 0.25 C ATOM 293 O SER A 172 3.110 3.526 1.112 1.00 0.27 O ATOM 294 CB SER A 172 -0.105 4.152 1.923 1.00 0.35 C ATOM 295 OG SER A 172 -0.904 5.044 2.680 1.00 0.42 O ATOM 0 H SER A 172 -0.284 6.048 0.364 1.00 0.28 H new ATOM 0 HA SER A 172 1.697 5.297 2.179 1.00 0.29 H new ATOM 0 HB2 SER A 172 -0.694 3.735 1.106 1.00 0.35 H new ATOM 0 HB3 SER A 172 0.206 3.317 2.550 1.00 0.35 H new ATOM 0 HG SER A 172 -1.274 5.733 2.090 1.00 0.42 H new ATOM 301 N HIS A 173 1.550 3.362 -0.503 1.00 0.23 N ATOM 302 CA HIS A 173 2.306 2.389 -1.285 1.00 0.24 C ATOM 303 C HIS A 173 3.633 2.979 -1.753 1.00 0.22 C ATOM 304 O HIS A 173 4.692 2.387 -1.549 1.00 0.24 O ATOM 305 CB HIS A 173 1.486 1.926 -2.490 1.00 0.31 C ATOM 306 CG HIS A 173 0.214 1.229 -2.114 1.00 0.37 C ATOM 307 ND1 HIS A 173 -1.035 1.730 -2.414 1.00 0.42 N ATOM 308 CD2 HIS A 173 0.003 0.060 -1.465 1.00 0.52 C ATOM 309 CE1 HIS A 173 -1.959 0.901 -1.962 1.00 0.48 C ATOM 310 NE2 HIS A 173 -1.355 -0.120 -1.384 1.00 0.53 N ATOM 0 H HIS A 173 0.651 3.622 -0.908 1.00 0.23 H new ATOM 0 HA HIS A 173 2.517 1.531 -0.646 1.00 0.24 H new ATOM 0 HB2 HIS A 173 1.248 2.789 -3.111 1.00 0.31 H new ATOM 0 HB3 HIS A 173 2.094 1.255 -3.097 1.00 0.31 H new ATOM 0 HD1 HIS A 173 -1.217 2.604 -2.908 1.00 0.42 H new ATOM 0 HD2 HIS A 173 0.762 -0.607 -1.082 1.00 0.52 H new ATOM 0 HE1 HIS A 173 -3.027 1.036 -2.050 1.00 0.48 H new ATOM 319 N LEU A 174 3.565 4.147 -2.383 1.00 0.22 N ATOM 320 CA LEU A 174 4.762 4.818 -2.875 1.00 0.26 C ATOM 321 C LEU A 174 5.766 5.024 -1.746 1.00 0.24 C ATOM 322 O LEU A 174 6.942 4.687 -1.880 1.00 0.29 O ATOM 323 CB LEU A 174 4.395 6.164 -3.502 1.00 0.31 C ATOM 324 CG LEU A 174 3.550 6.077 -4.774 1.00 0.36 C ATOM 325 CD1 LEU A 174 3.125 7.464 -5.231 1.00 0.42 C ATOM 326 CD2 LEU A 174 4.323 5.366 -5.875 1.00 0.42 C ATOM 0 H LEU A 174 2.695 4.648 -2.565 1.00 0.22 H new ATOM 0 HA LEU A 174 5.221 4.186 -3.636 1.00 0.26 H new ATOM 0 HB2 LEU A 174 3.853 6.756 -2.764 1.00 0.31 H new ATOM 0 HB3 LEU A 174 5.314 6.704 -3.731 1.00 0.31 H new ATOM 0 HG LEU A 174 2.652 5.500 -4.553 1.00 0.36 H new ATOM 0 HD11 LEU A 174 2.525 7.381 -6.137 1.00 0.42 H new ATOM 0 HD12 LEU A 174 2.535 7.940 -4.448 1.00 0.42 H new ATOM 0 HD13 LEU A 174 4.010 8.067 -5.436 1.00 0.42 H new ATOM 0 HD21 LEU A 174 3.709 5.312 -6.774 1.00 0.42 H new ATOM 0 HD22 LEU A 174 5.237 5.918 -6.093 1.00 0.42 H new ATOM 0 HD23 LEU A 174 4.578 4.358 -5.548 1.00 0.42 H new ATOM 338 N LEU A 175 5.294 5.580 -0.635 1.00 0.23 N ATOM 339 CA LEU A 175 6.151 5.826 0.516 1.00 0.27 C ATOM 340 C LEU A 175 6.771 4.526 1.017 1.00 0.24 C ATOM 341 O LEU A 175 7.952 4.486 1.359 1.00 0.27 O ATOM 342 CB LEU A 175 5.359 6.499 1.639 1.00 0.32 C ATOM 343 CG LEU A 175 4.977 7.956 1.377 1.00 0.37 C ATOM 344 CD1 LEU A 175 4.158 8.511 2.531 1.00 0.46 C ATOM 345 CD2 LEU A 175 6.224 8.800 1.154 1.00 0.46 C ATOM 0 H LEU A 175 4.324 5.868 -0.509 1.00 0.23 H new ATOM 0 HA LEU A 175 6.954 6.494 0.204 1.00 0.27 H new ATOM 0 HB2 LEU A 175 4.448 5.926 1.815 1.00 0.32 H new ATOM 0 HB3 LEU A 175 5.947 6.452 2.556 1.00 0.32 H new ATOM 0 HG LEU A 175 4.367 7.994 0.475 1.00 0.37 H new ATOM 0 HD11 LEU A 175 3.896 9.549 2.325 1.00 0.46 H new ATOM 0 HD12 LEU A 175 3.247 7.923 2.647 1.00 0.46 H new ATOM 0 HD13 LEU A 175 4.742 8.460 3.450 1.00 0.46 H new ATOM 0 HD21 LEU A 175 5.935 9.835 0.969 1.00 0.46 H new ATOM 0 HD22 LEU A 175 6.858 8.753 2.039 1.00 0.46 H new ATOM 0 HD23 LEU A 175 6.773 8.417 0.294 1.00 0.46 H new ATOM 357 N ALA A 176 5.970 3.463 1.058 1.00 0.21 N ATOM 358 CA ALA A 176 6.456 2.165 1.512 1.00 0.21 C ATOM 359 C ALA A 176 7.724 1.779 0.757 1.00 0.19 C ATOM 360 O ALA A 176 8.750 1.450 1.361 1.00 0.21 O ATOM 361 CB ALA A 176 5.383 1.102 1.329 1.00 0.21 C ATOM 0 H ALA A 176 4.988 3.476 0.784 1.00 0.21 H new ATOM 0 HA ALA A 176 6.693 2.236 2.573 1.00 0.21 H new ATOM 0 HB1 ALA A 176 5.762 0.140 1.673 1.00 0.21 H new ATOM 0 HB2 ALA A 176 4.500 1.372 1.909 1.00 0.21 H new ATOM 0 HB3 ALA A 176 5.117 1.031 0.274 1.00 0.21 H new ATOM 367 N ILE A 177 7.647 1.829 -0.568 1.00 0.18 N ATOM 368 CA ILE A 177 8.790 1.505 -1.408 1.00 0.20 C ATOM 369 C ILE A 177 9.970 2.393 -1.045 1.00 0.21 C ATOM 370 O ILE A 177 11.110 1.935 -0.973 1.00 0.23 O ATOM 371 CB ILE A 177 8.462 1.678 -2.904 1.00 0.23 C ATOM 372 CG1 ILE A 177 7.273 0.797 -3.293 1.00 0.25 C ATOM 373 CG2 ILE A 177 9.679 1.345 -3.756 1.00 0.27 C ATOM 374 CD1 ILE A 177 6.909 0.884 -4.759 1.00 0.47 C ATOM 0 H ILE A 177 6.805 2.091 -1.082 1.00 0.18 H new ATOM 0 HA ILE A 177 9.043 0.459 -1.232 1.00 0.20 H new ATOM 0 HB ILE A 177 8.192 2.719 -3.084 1.00 0.23 H new ATOM 0 HG12 ILE A 177 7.503 -0.239 -3.045 1.00 0.25 H new ATOM 0 HG13 ILE A 177 6.408 1.084 -2.695 1.00 0.25 H new ATOM 0 HG21 ILE A 177 9.431 1.472 -4.810 1.00 0.27 H new ATOM 0 HG22 ILE A 177 10.500 2.012 -3.493 1.00 0.27 H new ATOM 0 HG23 ILE A 177 9.978 0.312 -3.576 1.00 0.27 H new ATOM 0 HD11 ILE A 177 6.058 0.234 -4.962 1.00 0.47 H new ATOM 0 HD12 ILE A 177 6.647 1.912 -5.009 1.00 0.47 H new ATOM 0 HD13 ILE A 177 7.759 0.569 -5.364 1.00 0.47 H new ATOM 386 N GLY A 178 9.684 3.673 -0.817 1.00 0.20 N ATOM 387 CA GLY A 178 10.725 4.608 -0.444 1.00 0.23 C ATOM 388 C GLY A 178 11.434 4.174 0.820 1.00 0.22 C ATOM 389 O GLY A 178 12.657 4.267 0.917 1.00 0.23 O ATOM 0 H GLY A 178 8.750 4.076 -0.885 1.00 0.20 H new ATOM 0 HA2 GLY A 178 11.447 4.693 -1.256 1.00 0.23 H new ATOM 0 HA3 GLY A 178 10.291 5.597 -0.298 1.00 0.23 H new ATOM 393 N LEU A 179 10.661 3.699 1.793 1.00 0.21 N ATOM 394 CA LEU A 179 11.229 3.232 3.050 1.00 0.23 C ATOM 395 C LEU A 179 12.275 2.164 2.771 1.00 0.21 C ATOM 396 O LEU A 179 13.399 2.235 3.265 1.00 0.24 O ATOM 397 CB LEU A 179 10.141 2.668 3.964 1.00 0.27 C ATOM 398 CG LEU A 179 8.987 3.624 4.263 1.00 0.30 C ATOM 399 CD1 LEU A 179 8.075 3.043 5.332 1.00 0.36 C ATOM 400 CD2 LEU A 179 9.519 4.982 4.691 1.00 0.36 C ATOM 0 H LEU A 179 9.645 3.628 1.734 1.00 0.21 H new ATOM 0 HA LEU A 179 11.695 4.078 3.556 1.00 0.23 H new ATOM 0 HB2 LEU A 179 9.736 1.765 3.507 1.00 0.27 H new ATOM 0 HB3 LEU A 179 10.599 2.369 4.907 1.00 0.27 H new ATOM 0 HG LEU A 179 8.403 3.756 3.352 1.00 0.30 H new ATOM 0 HD11 LEU A 179 7.259 3.738 5.531 1.00 0.36 H new ATOM 0 HD12 LEU A 179 7.666 2.094 4.985 1.00 0.36 H new ATOM 0 HD13 LEU A 179 8.645 2.880 6.247 1.00 0.36 H new ATOM 0 HD21 LEU A 179 8.684 5.651 4.900 1.00 0.36 H new ATOM 0 HD22 LEU A 179 10.126 4.868 5.589 1.00 0.36 H new ATOM 0 HD23 LEU A 179 10.129 5.402 3.891 1.00 0.36 H new ATOM 412 N GLY A 180 11.895 1.174 1.968 1.00 0.20 N ATOM 413 CA GLY A 180 12.822 0.114 1.623 1.00 0.23 C ATOM 414 C GLY A 180 14.123 0.669 1.081 1.00 0.24 C ATOM 415 O GLY A 180 15.207 0.268 1.507 1.00 0.28 O ATOM 0 H GLY A 180 10.967 1.088 1.553 1.00 0.20 H new ATOM 0 HA2 GLY A 180 13.024 -0.495 2.504 1.00 0.23 H new ATOM 0 HA3 GLY A 180 12.367 -0.541 0.880 1.00 0.23 H new ATOM 419 N ILE A 181 14.010 1.603 0.140 1.00 0.26 N ATOM 420 CA ILE A 181 15.177 2.235 -0.459 1.00 0.32 C ATOM 421 C ILE A 181 15.974 2.999 0.593 1.00 0.33 C ATOM 422 O ILE A 181 17.201 2.923 0.638 1.00 0.34 O ATOM 423 CB ILE A 181 14.773 3.208 -1.584 1.00 0.41 C ATOM 424 CG1 ILE A 181 13.918 2.490 -2.628 1.00 0.47 C ATOM 425 CG2 ILE A 181 16.010 3.811 -2.233 1.00 0.52 C ATOM 426 CD1 ILE A 181 14.634 1.345 -3.311 1.00 0.90 C ATOM 0 H ILE A 181 13.118 1.938 -0.224 1.00 0.26 H new ATOM 0 HA ILE A 181 15.792 1.441 -0.881 1.00 0.32 H new ATOM 0 HB ILE A 181 14.183 4.015 -1.149 1.00 0.41 H new ATOM 0 HG12 ILE A 181 13.016 2.110 -2.148 1.00 0.47 H new ATOM 0 HG13 ILE A 181 13.599 3.210 -3.382 1.00 0.47 H new ATOM 0 HG21 ILE A 181 15.708 4.496 -3.025 1.00 0.52 H new ATOM 0 HG22 ILE A 181 16.586 4.354 -1.484 1.00 0.52 H new ATOM 0 HG23 ILE A 181 16.624 3.015 -2.655 1.00 0.52 H new ATOM 0 HD11 ILE A 181 13.968 0.882 -4.039 1.00 0.90 H new ATOM 0 HD12 ILE A 181 15.521 1.722 -3.820 1.00 0.90 H new ATOM 0 HD13 ILE A 181 14.930 0.605 -2.567 1.00 0.90 H new ATOM 438 N TYR A 182 15.260 3.736 1.439 1.00 0.35 N ATOM 439 CA TYR A 182 15.889 4.515 2.499 1.00 0.42 C ATOM 440 C TYR A 182 16.800 3.633 3.346 1.00 0.40 C ATOM 441 O TYR A 182 17.939 3.997 3.640 1.00 0.46 O ATOM 442 CB TYR A 182 14.819 5.164 3.382 1.00 0.49 C ATOM 443 CG TYR A 182 15.379 6.069 4.457 1.00 0.62 C ATOM 444 CD1 TYR A 182 15.845 5.548 5.658 1.00 1.16 C ATOM 445 CD2 TYR A 182 15.435 7.444 4.271 1.00 1.34 C ATOM 446 CE1 TYR A 182 16.352 6.374 6.644 1.00 1.25 C ATOM 447 CE2 TYR A 182 15.940 8.275 5.252 1.00 1.44 C ATOM 448 CZ TYR A 182 16.397 7.736 6.436 1.00 0.93 C ATOM 449 OH TYR A 182 16.900 8.561 7.415 1.00 1.09 O ATOM 0 H TYR A 182 14.243 3.810 1.410 1.00 0.35 H new ATOM 0 HA TYR A 182 16.493 5.297 2.039 1.00 0.42 H new ATOM 0 HB2 TYR A 182 14.142 5.741 2.752 1.00 0.49 H new ATOM 0 HB3 TYR A 182 14.226 4.380 3.853 1.00 0.49 H new ATOM 0 HD1 TYR A 182 15.811 4.481 5.824 1.00 1.16 H new ATOM 0 HD2 TYR A 182 15.078 7.870 3.345 1.00 1.34 H new ATOM 0 HE1 TYR A 182 16.711 5.954 7.572 1.00 1.25 H new ATOM 0 HE2 TYR A 182 15.977 9.342 5.092 1.00 1.44 H new ATOM 0 HH TYR A 182 16.862 9.492 7.110 1.00 1.09 H new ATOM 459 N ILE A 183 16.288 2.471 3.738 1.00 0.36 N ATOM 460 CA ILE A 183 17.051 1.530 4.548 1.00 0.42 C ATOM 461 C ILE A 183 18.293 1.049 3.803 1.00 0.41 C ATOM 462 O ILE A 183 19.383 0.980 4.372 1.00 0.46 O ATOM 463 CB ILE A 183 16.194 0.312 4.943 1.00 0.47 C ATOM 464 CG1 ILE A 183 14.925 0.773 5.666 1.00 0.56 C ATOM 465 CG2 ILE A 183 16.994 -0.640 5.820 1.00 0.58 C ATOM 466 CD1 ILE A 183 13.954 -0.350 5.960 1.00 0.80 C ATOM 0 H ILE A 183 15.345 2.158 3.507 1.00 0.36 H new ATOM 0 HA ILE A 183 17.356 2.058 5.452 1.00 0.42 H new ATOM 0 HB ILE A 183 15.904 -0.221 4.037 1.00 0.47 H new ATOM 0 HG12 ILE A 183 15.205 1.255 6.603 1.00 0.56 H new ATOM 0 HG13 ILE A 183 14.424 1.526 5.058 1.00 0.56 H new ATOM 0 HG21 ILE A 183 16.373 -1.495 6.090 1.00 0.58 H new ATOM 0 HG22 ILE A 183 17.872 -0.987 5.274 1.00 0.58 H new ATOM 0 HG23 ILE A 183 17.311 -0.122 6.725 1.00 0.58 H new ATOM 0 HD11 ILE A 183 13.079 0.050 6.473 1.00 0.80 H new ATOM 0 HD12 ILE A 183 13.644 -0.817 5.025 1.00 0.80 H new ATOM 0 HD13 ILE A 183 14.438 -1.093 6.594 1.00 0.80 H new ATOM 478 N GLY A 184 18.121 0.717 2.527 1.00 0.39 N ATOM 479 CA GLY A 184 19.235 0.249 1.723 1.00 0.46 C ATOM 480 C GLY A 184 20.326 1.293 1.579 1.00 0.50 C ATOM 481 O GLY A 184 21.497 1.016 1.840 1.00 0.55 O ATOM 0 H GLY A 184 17.229 0.764 2.035 1.00 0.39 H new ATOM 0 HA2 GLY A 184 19.654 -0.650 2.176 1.00 0.46 H new ATOM 0 HA3 GLY A 184 18.873 -0.032 0.734 1.00 0.46 H new ATOM 485 N ARG A 185 19.943 2.495 1.160 1.00 0.53 N ATOM 486 CA ARG A 185 20.897 3.584 0.984 1.00 0.65 C ATOM 487 C ARG A 185 21.710 3.799 2.255 1.00 0.67 C ATOM 488 O ARG A 185 22.876 4.194 2.201 1.00 0.76 O ATOM 489 CB ARG A 185 20.164 4.874 0.618 1.00 0.76 C ATOM 490 CG ARG A 185 19.197 5.336 1.686 1.00 0.72 C ATOM 491 CD ARG A 185 18.822 6.797 1.511 1.00 0.81 C ATOM 492 NE ARG A 185 18.081 7.026 0.273 1.00 1.27 N ATOM 493 CZ ARG A 185 17.987 8.211 -0.323 1.00 1.59 C ATOM 494 NH1 ARG A 185 18.584 9.272 0.204 1.00 1.66 N ATOM 495 NH2 ARG A 185 17.295 8.336 -1.447 1.00 2.24 N ATOM 0 H ARG A 185 18.978 2.739 0.936 1.00 0.53 H new ATOM 0 HA ARG A 185 21.576 3.314 0.175 1.00 0.65 H new ATOM 0 HB2 ARG A 185 20.896 5.661 0.436 1.00 0.76 H new ATOM 0 HB3 ARG A 185 19.620 4.723 -0.314 1.00 0.76 H new ATOM 0 HG2 ARG A 185 18.297 4.723 1.651 1.00 0.72 H new ATOM 0 HG3 ARG A 185 19.644 5.190 2.669 1.00 0.72 H new ATOM 0 HD2 ARG A 185 18.220 7.121 2.360 1.00 0.81 H new ATOM 0 HD3 ARG A 185 19.726 7.406 1.511 1.00 0.81 H new ATOM 0 HE ARG A 185 17.609 6.232 -0.159 1.00 1.27 H new ATOM 0 HH11 ARG A 185 19.117 9.180 1.069 1.00 1.66 H new ATOM 0 HH12 ARG A 185 18.510 10.180 -0.256 1.00 1.66 H new ATOM 0 HH21 ARG A 185 16.834 7.523 -1.855 1.00 2.24 H new ATOM 0 HH22 ARG A 185 17.223 9.245 -1.903 1.00 2.24 H new ATOM 509 N ARG A 186 21.086 3.537 3.397 1.00 0.63 N ATOM 510 CA ARG A 186 21.744 3.702 4.687 1.00 0.73 C ATOM 511 C ARG A 186 22.391 2.399 5.149 1.00 0.74 C ATOM 512 O ARG A 186 22.368 2.070 6.335 1.00 0.86 O ATOM 513 CB ARG A 186 20.740 4.188 5.732 1.00 0.81 C ATOM 514 CG ARG A 186 20.702 5.698 5.885 1.00 1.80 C ATOM 515 CD ARG A 186 19.767 6.115 7.009 1.00 2.20 C ATOM 516 NE ARG A 186 20.177 5.557 8.294 1.00 2.90 N ATOM 517 CZ ARG A 186 19.519 5.758 9.431 1.00 3.61 C ATOM 518 NH1 ARG A 186 18.421 6.504 9.442 1.00 3.86 N ATOM 519 NH2 ARG A 186 19.958 5.215 10.557 1.00 4.48 N ATOM 0 H ARG A 186 20.122 3.208 3.456 1.00 0.63 H new ATOM 0 HA ARG A 186 22.530 4.448 4.571 1.00 0.73 H new ATOM 0 HB2 ARG A 186 19.746 3.834 5.460 1.00 0.81 H new ATOM 0 HB3 ARG A 186 20.985 3.740 6.695 1.00 0.81 H new ATOM 0 HG2 ARG A 186 21.706 6.071 6.087 1.00 1.80 H new ATOM 0 HG3 ARG A 186 20.375 6.153 4.950 1.00 1.80 H new ATOM 0 HD2 ARG A 186 19.743 7.203 7.077 1.00 2.20 H new ATOM 0 HD3 ARG A 186 18.753 5.788 6.778 1.00 2.20 H new ATOM 0 HE ARG A 186 21.017 4.979 8.321 1.00 2.90 H new ATOM 0 HH11 ARG A 186 18.081 6.924 8.577 1.00 3.86 H new ATOM 0 HH12 ARG A 186 17.917 6.657 10.316 1.00 3.86 H new ATOM 0 HH21 ARG A 186 20.802 4.642 10.552 1.00 4.48 H new ATOM 0 HH22 ARG A 186 19.452 5.370 11.429 1.00 4.48 H new ATOM 533 N LEU A 187 22.967 1.663 4.206 1.00 0.73 N ATOM 534 CA LEU A 187 23.629 0.401 4.517 1.00 0.84 C ATOM 535 C LEU A 187 25.150 0.541 4.444 1.00 1.03 C ATOM 536 O LEU A 187 25.881 -0.328 4.919 1.00 1.21 O ATOM 537 CB LEU A 187 23.161 -0.698 3.561 1.00 0.83 C ATOM 538 CG LEU A 187 21.707 -1.141 3.740 1.00 0.78 C ATOM 539 CD1 LEU A 187 21.371 -2.267 2.774 1.00 0.90 C ATOM 540 CD2 LEU A 187 21.457 -1.579 5.176 1.00 0.98 C ATOM 0 H LEU A 187 22.989 1.918 3.219 1.00 0.73 H new ATOM 0 HA LEU A 187 23.359 0.127 5.537 1.00 0.84 H new ATOM 0 HB2 LEU A 187 23.294 -0.348 2.537 1.00 0.83 H new ATOM 0 HB3 LEU A 187 23.807 -1.567 3.687 1.00 0.83 H new ATOM 0 HG LEU A 187 21.058 -0.293 3.520 1.00 0.78 H new ATOM 0 HD11 LEU A 187 20.333 -2.570 2.915 1.00 0.90 H new ATOM 0 HD12 LEU A 187 21.512 -1.922 1.750 1.00 0.90 H new ATOM 0 HD13 LEU A 187 22.026 -3.117 2.964 1.00 0.90 H new ATOM 0 HD21 LEU A 187 20.418 -1.891 5.286 1.00 0.98 H new ATOM 0 HD22 LEU A 187 22.114 -2.413 5.422 1.00 0.98 H new ATOM 0 HD23 LEU A 187 21.659 -0.747 5.851 1.00 0.98 H new ATOM 552 N THR A 188 25.625 1.635 3.848 1.00 1.13 N ATOM 553 CA THR A 188 27.057 1.875 3.723 1.00 1.36 C ATOM 554 C THR A 188 27.460 3.182 4.398 1.00 1.79 C ATOM 555 O THR A 188 27.588 4.200 3.688 1.00 2.52 O ATOM 556 CB THR A 188 27.492 1.915 2.245 1.00 2.06 C ATOM 557 OG1 THR A 188 28.841 2.385 2.144 1.00 2.72 O ATOM 558 CG2 THR A 188 26.571 2.812 1.429 1.00 2.69 C ATOM 559 OXT THR A 188 27.642 3.176 5.634 1.00 2.28 O ATOM 0 H THR A 188 25.038 2.366 3.446 1.00 1.13 H new ATOM 0 HA THR A 188 27.560 1.046 4.220 1.00 1.36 H new ATOM 0 HB THR A 188 27.430 0.903 1.845 1.00 2.06 H new ATOM 0 HG1 THR A 188 28.894 3.303 2.483 1.00 2.72 H new ATOM 0 HG21 THR A 188 26.900 2.822 0.390 1.00 2.69 H new ATOM 0 HG22 THR A 188 25.551 2.431 1.483 1.00 2.69 H new ATOM 0 HG23 THR A 188 26.602 3.825 1.829 1.00 2.69 H new TER 567 THR A 188 ATOM 568 N GLY B 154 -27.512 -1.691 0.878 1.00 7.87 N ATOM 569 CA GLY B 154 -26.193 -2.055 0.294 1.00 7.57 C ATOM 570 C GLY B 154 -26.327 -2.903 -0.956 1.00 7.43 C ATOM 571 O GLY B 154 -27.418 -3.368 -1.285 1.00 7.85 O ATOM 0 HA2 GLY B 154 -25.641 -1.146 0.055 1.00 7.57 H new ATOM 0 HA3 GLY B 154 -25.607 -2.597 1.036 1.00 7.57 H new ATOM 577 N GLY B 155 -25.215 -3.104 -1.654 1.00 6.96 N ATOM 578 CA GLY B 155 -25.235 -3.902 -2.865 1.00 6.89 C ATOM 579 C GLY B 155 -25.348 -5.387 -2.580 1.00 6.80 C ATOM 580 O GLY B 155 -25.436 -5.799 -1.423 1.00 6.83 O ATOM 0 H GLY B 155 -24.300 -2.729 -1.403 1.00 6.96 H new ATOM 0 HA2 GLY B 155 -26.073 -3.590 -3.488 1.00 6.89 H new ATOM 0 HA3 GLY B 155 -24.326 -3.713 -3.436 1.00 6.89 H new ATOM 584 N ILE B 156 -25.347 -6.192 -3.637 1.00 6.79 N ATOM 585 CA ILE B 156 -25.450 -7.635 -3.499 1.00 6.85 C ATOM 586 C ILE B 156 -24.183 -8.219 -2.885 1.00 6.34 C ATOM 587 O ILE B 156 -24.238 -9.178 -2.114 1.00 6.39 O ATOM 588 CB ILE B 156 -25.697 -8.297 -4.865 1.00 7.07 C ATOM 589 CG1 ILE B 156 -26.732 -7.496 -5.654 1.00 7.61 C ATOM 590 CG2 ILE B 156 -26.155 -9.737 -4.686 1.00 7.32 C ATOM 591 CD1 ILE B 156 -27.998 -7.220 -4.874 1.00 7.93 C ATOM 0 H ILE B 156 -25.276 -5.865 -4.601 1.00 6.79 H new ATOM 0 HA ILE B 156 -26.293 -7.839 -2.839 1.00 6.85 H new ATOM 0 HB ILE B 156 -24.762 -8.306 -5.425 1.00 7.07 H new ATOM 0 HG12 ILE B 156 -26.290 -6.549 -5.962 1.00 7.61 H new ATOM 0 HG13 ILE B 156 -26.986 -8.040 -6.564 1.00 7.61 H new ATOM 0 HG21 ILE B 156 -26.325 -10.189 -5.663 1.00 7.32 H new ATOM 0 HG22 ILE B 156 -25.387 -10.300 -4.154 1.00 7.32 H new ATOM 0 HG23 ILE B 156 -27.081 -9.755 -4.112 1.00 7.32 H new ATOM 0 HD11 ILE B 156 -28.689 -6.648 -5.493 1.00 7.93 H new ATOM 0 HD12 ILE B 156 -28.463 -8.164 -4.588 1.00 7.93 H new ATOM 0 HD13 ILE B 156 -27.756 -6.649 -3.978 1.00 7.93 H new ATOM 603 N PHE B 157 -23.043 -7.633 -3.232 1.00 5.93 N ATOM 604 CA PHE B 157 -21.758 -8.094 -2.717 1.00 5.51 C ATOM 605 C PHE B 157 -21.547 -7.628 -1.281 1.00 5.28 C ATOM 606 O PHE B 157 -21.606 -8.424 -0.347 1.00 5.42 O ATOM 607 CB PHE B 157 -20.617 -7.586 -3.597 1.00 5.15 C ATOM 608 CG PHE B 157 -20.755 -7.966 -5.044 1.00 5.59 C ATOM 609 CD1 PHE B 157 -21.461 -7.160 -5.922 1.00 5.84 C ATOM 610 CD2 PHE B 157 -20.178 -9.131 -5.523 1.00 6.06 C ATOM 611 CE1 PHE B 157 -21.588 -7.509 -7.254 1.00 6.39 C ATOM 612 CE2 PHE B 157 -20.302 -9.484 -6.853 1.00 6.59 C ATOM 613 CZ PHE B 157 -21.007 -8.673 -7.720 1.00 6.69 C ATOM 0 H PHE B 157 -22.982 -6.838 -3.868 1.00 5.93 H new ATOM 0 HA PHE B 157 -21.763 -9.184 -2.732 1.00 5.51 H new ATOM 0 HB2 PHE B 157 -20.566 -6.500 -3.519 1.00 5.15 H new ATOM 0 HB3 PHE B 157 -19.674 -7.978 -3.216 1.00 5.15 H new ATOM 0 HD1 PHE B 157 -21.917 -6.249 -5.562 1.00 5.84 H new ATOM 0 HD2 PHE B 157 -19.626 -9.770 -4.850 1.00 6.06 H new ATOM 0 HE1 PHE B 157 -22.141 -6.873 -7.929 1.00 6.39 H new ATOM 0 HE2 PHE B 157 -19.847 -10.394 -7.215 1.00 6.59 H new ATOM 0 HZ PHE B 157 -21.104 -8.948 -8.760 1.00 6.69 H new ATOM 623 N SER B 158 -21.307 -6.328 -1.116 1.00 5.07 N ATOM 624 CA SER B 158 -21.074 -5.740 0.203 1.00 4.99 C ATOM 625 C SER B 158 -20.118 -6.597 1.036 1.00 4.62 C ATOM 626 O SER B 158 -18.903 -6.410 0.980 1.00 4.34 O ATOM 627 CB SER B 158 -22.401 -5.547 0.940 1.00 5.53 C ATOM 628 OG SER B 158 -23.080 -6.781 1.098 1.00 6.01 O ATOM 0 H SER B 158 -21.269 -5.658 -1.884 1.00 5.07 H new ATOM 0 HA SER B 158 -20.606 -4.766 0.058 1.00 4.99 H new ATOM 0 HB2 SER B 158 -22.216 -5.102 1.918 1.00 5.53 H new ATOM 0 HB3 SER B 158 -23.030 -4.850 0.386 1.00 5.53 H new ATOM 0 HG SER B 158 -23.924 -6.631 1.573 1.00 6.01 H new ATOM 634 N ALA B 159 -20.663 -7.537 1.804 1.00 4.76 N ATOM 635 CA ALA B 159 -19.842 -8.407 2.635 1.00 4.49 C ATOM 636 C ALA B 159 -18.828 -9.173 1.790 1.00 4.07 C ATOM 637 O ALA B 159 -17.635 -9.183 2.092 1.00 3.63 O ATOM 638 CB ALA B 159 -20.718 -9.372 3.418 1.00 4.95 C ATOM 0 H ALA B 159 -21.666 -7.714 1.867 1.00 4.76 H new ATOM 0 HA ALA B 159 -19.292 -7.783 3.340 1.00 4.49 H new ATOM 0 HB1 ALA B 159 -20.090 -10.015 4.034 1.00 4.95 H new ATOM 0 HB2 ALA B 159 -21.398 -8.809 4.057 1.00 4.95 H new ATOM 0 HB3 ALA B 159 -21.295 -9.984 2.725 1.00 4.95 H new ATOM 644 N GLU B 160 -19.314 -9.811 0.730 1.00 4.30 N ATOM 645 CA GLU B 160 -18.454 -10.581 -0.162 1.00 4.07 C ATOM 646 C GLU B 160 -17.348 -9.707 -0.746 1.00 3.64 C ATOM 647 O GLU B 160 -16.164 -9.966 -0.537 1.00 3.34 O ATOM 648 CB GLU B 160 -19.279 -11.197 -1.293 1.00 4.52 C ATOM 649 CG GLU B 160 -20.342 -12.170 -0.811 1.00 4.52 C ATOM 650 CD GLU B 160 -21.111 -12.803 -1.954 1.00 4.76 C ATOM 651 OE1 GLU B 160 -20.672 -13.863 -2.451 1.00 5.04 O ATOM 652 OE2 GLU B 160 -22.152 -12.240 -2.354 1.00 5.11 O ATOM 0 H GLU B 160 -20.300 -9.810 0.468 1.00 4.30 H new ATOM 0 HA GLU B 160 -17.993 -11.378 0.421 1.00 4.07 H new ATOM 0 HB2 GLU B 160 -19.759 -10.398 -1.858 1.00 4.52 H new ATOM 0 HB3 GLU B 160 -18.609 -11.715 -1.980 1.00 4.52 H new ATOM 0 HG2 GLU B 160 -19.871 -12.953 -0.217 1.00 4.52 H new ATOM 0 HG3 GLU B 160 -21.038 -11.647 -0.155 1.00 4.52 H new ATOM 659 N PHE B 161 -17.745 -8.668 -1.476 1.00 3.68 N ATOM 660 CA PHE B 161 -16.788 -7.752 -2.094 1.00 3.33 C ATOM 661 C PHE B 161 -15.716 -7.319 -1.097 1.00 2.89 C ATOM 662 O PHE B 161 -14.520 -7.432 -1.368 1.00 2.55 O ATOM 663 CB PHE B 161 -17.514 -6.523 -2.647 1.00 3.51 C ATOM 664 CG PHE B 161 -16.590 -5.461 -3.171 1.00 3.26 C ATOM 665 CD1 PHE B 161 -16.045 -5.563 -4.441 1.00 3.50 C ATOM 666 CD2 PHE B 161 -16.265 -4.362 -2.392 1.00 3.25 C ATOM 667 CE1 PHE B 161 -15.194 -4.587 -4.924 1.00 3.37 C ATOM 668 CE2 PHE B 161 -15.415 -3.384 -2.869 1.00 3.09 C ATOM 669 CZ PHE B 161 -14.878 -3.497 -4.138 1.00 2.95 C ATOM 0 H PHE B 161 -18.723 -8.439 -1.655 1.00 3.68 H new ATOM 0 HA PHE B 161 -16.299 -8.279 -2.913 1.00 3.33 H new ATOM 0 HB2 PHE B 161 -18.183 -6.837 -3.448 1.00 3.51 H new ATOM 0 HB3 PHE B 161 -18.136 -6.095 -1.861 1.00 3.51 H new ATOM 0 HD1 PHE B 161 -16.288 -6.414 -5.060 1.00 3.50 H new ATOM 0 HD2 PHE B 161 -16.682 -4.269 -1.400 1.00 3.25 H new ATOM 0 HE1 PHE B 161 -14.776 -4.677 -5.916 1.00 3.37 H new ATOM 0 HE2 PHE B 161 -15.170 -2.532 -2.252 1.00 3.09 H new ATOM 0 HZ PHE B 161 -14.212 -2.734 -4.514 1.00 2.95 H new ATOM 679 N LEU B 162 -16.153 -6.825 0.054 1.00 2.97 N ATOM 680 CA LEU B 162 -15.234 -6.375 1.092 1.00 2.68 C ATOM 681 C LEU B 162 -14.369 -7.529 1.589 1.00 2.45 C ATOM 682 O LEU B 162 -13.195 -7.344 1.911 1.00 2.10 O ATOM 683 CB LEU B 162 -16.017 -5.761 2.254 1.00 3.01 C ATOM 684 CG LEU B 162 -16.868 -4.546 1.884 1.00 3.29 C ATOM 685 CD1 LEU B 162 -17.828 -4.199 3.011 1.00 3.64 C ATOM 686 CD2 LEU B 162 -15.981 -3.356 1.554 1.00 3.06 C ATOM 0 H LEU B 162 -17.140 -6.726 0.293 1.00 2.97 H new ATOM 0 HA LEU B 162 -14.577 -5.617 0.666 1.00 2.68 H new ATOM 0 HB2 LEU B 162 -16.667 -6.526 2.680 1.00 3.01 H new ATOM 0 HB3 LEU B 162 -15.313 -5.470 3.034 1.00 3.01 H new ATOM 0 HG LEU B 162 -17.455 -4.795 1.000 1.00 3.29 H new ATOM 0 HD11 LEU B 162 -18.424 -3.332 2.727 1.00 3.64 H new ATOM 0 HD12 LEU B 162 -18.487 -5.046 3.201 1.00 3.64 H new ATOM 0 HD13 LEU B 162 -17.262 -3.970 3.914 1.00 3.64 H new ATOM 0 HD21 LEU B 162 -16.603 -2.500 1.293 1.00 3.06 H new ATOM 0 HD22 LEU B 162 -15.368 -3.108 2.420 1.00 3.06 H new ATOM 0 HD23 LEU B 162 -15.336 -3.606 0.712 1.00 3.06 H new ATOM 698 N LYS B 163 -14.958 -8.718 1.649 1.00 2.70 N ATOM 699 CA LYS B 163 -14.247 -9.906 2.099 1.00 2.58 C ATOM 700 C LYS B 163 -13.001 -10.146 1.252 1.00 2.20 C ATOM 701 O LYS B 163 -12.031 -10.749 1.711 1.00 2.01 O ATOM 702 CB LYS B 163 -15.170 -11.121 2.028 1.00 2.98 C ATOM 703 CG LYS B 163 -14.758 -12.248 2.951 1.00 3.10 C ATOM 704 CD LYS B 163 -15.681 -13.442 2.806 1.00 3.46 C ATOM 705 CE LYS B 163 -17.111 -13.089 3.177 1.00 3.83 C ATOM 706 NZ LYS B 163 -18.025 -14.258 3.051 1.00 4.17 N ATOM 0 H LYS B 163 -15.931 -8.884 1.390 1.00 2.70 H new ATOM 0 HA LYS B 163 -13.934 -9.751 3.132 1.00 2.58 H new ATOM 0 HB2 LYS B 163 -16.185 -10.811 2.277 1.00 2.98 H new ATOM 0 HB3 LYS B 163 -15.192 -11.491 1.003 1.00 2.98 H new ATOM 0 HG2 LYS B 163 -13.734 -12.548 2.728 1.00 3.10 H new ATOM 0 HG3 LYS B 163 -14.771 -11.899 3.983 1.00 3.10 H new ATOM 0 HD2 LYS B 163 -15.650 -13.805 1.779 1.00 3.46 H new ATOM 0 HD3 LYS B 163 -15.329 -14.254 3.442 1.00 3.46 H new ATOM 0 HE2 LYS B 163 -17.138 -12.716 4.201 1.00 3.83 H new ATOM 0 HE3 LYS B 163 -17.464 -12.282 2.534 1.00 3.83 H new ATOM 0 HZ1 LYS B 163 -18.990 -13.974 3.313 1.00 4.17 H new ATOM 0 HZ2 LYS B 163 -18.019 -14.599 2.068 1.00 4.17 H new ATOM 0 HZ3 LYS B 163 -17.704 -15.019 3.683 1.00 4.17 H new ATOM 720 N VAL B 164 -13.037 -9.669 0.012 1.00 2.21 N ATOM 721 CA VAL B 164 -11.914 -9.825 -0.903 1.00 2.03 C ATOM 722 C VAL B 164 -11.381 -8.467 -1.345 1.00 1.85 C ATOM 723 O VAL B 164 -11.032 -8.272 -2.509 1.00 2.01 O ATOM 724 CB VAL B 164 -12.313 -10.638 -2.150 1.00 2.40 C ATOM 725 CG1 VAL B 164 -12.723 -12.050 -1.758 1.00 2.37 C ATOM 726 CG2 VAL B 164 -13.433 -9.941 -2.908 1.00 2.98 C ATOM 0 H VAL B 164 -13.834 -9.170 -0.382 1.00 2.21 H new ATOM 0 HA VAL B 164 -11.135 -10.364 -0.363 1.00 2.03 H new ATOM 0 HB VAL B 164 -11.447 -10.705 -2.809 1.00 2.40 H new ATOM 0 HG11 VAL B 164 -13.001 -12.609 -2.651 1.00 2.37 H new ATOM 0 HG12 VAL B 164 -11.888 -12.547 -1.264 1.00 2.37 H new ATOM 0 HG13 VAL B 164 -13.573 -12.006 -1.078 1.00 2.37 H new ATOM 0 HG21 VAL B 164 -13.701 -10.530 -3.785 1.00 2.98 H new ATOM 0 HG22 VAL B 164 -14.303 -9.840 -2.259 1.00 2.98 H new ATOM 0 HG23 VAL B 164 -13.099 -8.953 -3.223 1.00 2.98 H new ATOM 736 N PHE B 165 -11.325 -7.530 -0.404 1.00 1.65 N ATOM 737 CA PHE B 165 -10.839 -6.184 -0.692 1.00 1.50 C ATOM 738 C PHE B 165 -10.044 -5.623 0.485 1.00 1.26 C ATOM 739 O PHE B 165 -8.995 -5.003 0.299 1.00 1.09 O ATOM 740 CB PHE B 165 -12.015 -5.259 -1.013 1.00 1.69 C ATOM 741 CG PHE B 165 -11.596 -3.883 -1.446 1.00 1.63 C ATOM 742 CD1 PHE B 165 -11.420 -2.873 -0.514 1.00 2.23 C ATOM 743 CD2 PHE B 165 -11.381 -3.600 -2.785 1.00 1.70 C ATOM 744 CE1 PHE B 165 -11.035 -1.606 -0.910 1.00 2.32 C ATOM 745 CE2 PHE B 165 -10.998 -2.336 -3.186 1.00 1.66 C ATOM 746 CZ PHE B 165 -10.824 -1.337 -2.248 1.00 1.70 C ATOM 0 H PHE B 165 -11.610 -7.677 0.564 1.00 1.65 H new ATOM 0 HA PHE B 165 -10.177 -6.241 -1.556 1.00 1.50 H new ATOM 0 HB2 PHE B 165 -12.618 -5.711 -1.801 1.00 1.69 H new ATOM 0 HB3 PHE B 165 -12.652 -5.176 -0.132 1.00 1.69 H new ATOM 0 HD1 PHE B 165 -11.585 -3.078 0.533 1.00 2.23 H new ATOM 0 HD2 PHE B 165 -11.515 -4.377 -3.523 1.00 1.70 H new ATOM 0 HE1 PHE B 165 -10.899 -0.827 -0.174 1.00 2.32 H new ATOM 0 HE2 PHE B 165 -10.834 -2.128 -4.233 1.00 1.66 H new ATOM 0 HZ PHE B 165 -10.524 -0.348 -2.560 1.00 1.70 H new ATOM 756 N LEU B 166 -10.550 -5.838 1.695 1.00 1.37 N ATOM 757 CA LEU B 166 -9.889 -5.356 2.901 1.00 1.30 C ATOM 758 C LEU B 166 -8.451 -5.877 3.011 1.00 1.09 C ATOM 759 O LEU B 166 -7.513 -5.086 3.112 1.00 1.00 O ATOM 760 CB LEU B 166 -10.692 -5.753 4.143 1.00 1.59 C ATOM 761 CG LEU B 166 -12.098 -5.156 4.221 1.00 1.88 C ATOM 762 CD1 LEU B 166 -12.797 -5.595 5.499 1.00 2.18 C ATOM 763 CD2 LEU B 166 -12.038 -3.638 4.139 1.00 1.87 C ATOM 0 H LEU B 166 -11.419 -6.345 1.866 1.00 1.37 H new ATOM 0 HA LEU B 166 -9.842 -4.269 2.836 1.00 1.30 H new ATOM 0 HB2 LEU B 166 -10.773 -6.840 4.173 1.00 1.59 H new ATOM 0 HB3 LEU B 166 -10.135 -5.450 5.030 1.00 1.59 H new ATOM 0 HG LEU B 166 -12.674 -5.524 3.372 1.00 1.88 H new ATOM 0 HD11 LEU B 166 -13.796 -5.160 5.535 1.00 2.18 H new ATOM 0 HD12 LEU B 166 -12.874 -6.682 5.516 1.00 2.18 H new ATOM 0 HD13 LEU B 166 -12.223 -5.258 6.362 1.00 2.18 H new ATOM 0 HD21 LEU B 166 -13.047 -3.230 4.196 1.00 1.87 H new ATOM 0 HD22 LEU B 166 -11.443 -3.252 4.967 1.00 1.87 H new ATOM 0 HD23 LEU B 166 -11.580 -3.342 3.195 1.00 1.87 H new ATOM 775 N PRO B 167 -8.251 -7.210 2.991 1.00 1.11 N ATOM 776 CA PRO B 167 -6.911 -7.807 3.102 1.00 1.01 C ATOM 777 C PRO B 167 -5.972 -7.391 1.972 1.00 0.85 C ATOM 778 O PRO B 167 -4.800 -7.096 2.207 1.00 0.92 O ATOM 779 CB PRO B 167 -7.175 -9.316 3.046 1.00 1.14 C ATOM 780 CG PRO B 167 -8.522 -9.451 2.426 1.00 1.25 C ATOM 781 CD PRO B 167 -9.296 -8.243 2.864 1.00 1.36 C ATOM 0 HA PRO B 167 -6.410 -7.480 4.013 1.00 1.01 H new ATOM 0 HB2 PRO B 167 -6.416 -9.827 2.454 1.00 1.14 H new ATOM 0 HB3 PRO B 167 -7.154 -9.757 4.042 1.00 1.14 H new ATOM 0 HG2 PRO B 167 -8.450 -9.496 1.339 1.00 1.25 H new ATOM 0 HG3 PRO B 167 -9.012 -10.369 2.751 1.00 1.25 H new ATOM 0 HD2 PRO B 167 -10.055 -7.962 2.133 1.00 1.36 H new ATOM 0 HD3 PRO B 167 -9.812 -8.414 3.809 1.00 1.36 H new ATOM 789 N SER B 168 -6.488 -7.367 0.746 1.00 0.84 N ATOM 790 CA SER B 168 -5.682 -6.996 -0.417 1.00 0.77 C ATOM 791 C SER B 168 -4.875 -5.725 -0.152 1.00 0.60 C ATOM 792 O SER B 168 -3.687 -5.659 -0.464 1.00 0.54 O ATOM 793 CB SER B 168 -6.575 -6.802 -1.645 1.00 0.90 C ATOM 794 OG SER B 168 -7.493 -5.742 -1.448 1.00 1.54 O ATOM 0 H SER B 168 -7.458 -7.599 0.531 1.00 0.84 H new ATOM 0 HA SER B 168 -4.982 -7.809 -0.609 1.00 0.77 H new ATOM 0 HB2 SER B 168 -5.957 -6.594 -2.518 1.00 0.90 H new ATOM 0 HB3 SER B 168 -7.119 -7.724 -1.852 1.00 0.90 H new ATOM 0 HG SER B 168 -7.857 -5.789 -0.539 1.00 1.54 H new ATOM 800 N LEU B 169 -5.527 -4.721 0.425 1.00 0.60 N ATOM 801 CA LEU B 169 -4.867 -3.454 0.727 1.00 0.52 C ATOM 802 C LEU B 169 -3.678 -3.662 1.661 1.00 0.44 C ATOM 803 O LEU B 169 -2.574 -3.184 1.394 1.00 0.37 O ATOM 804 CB LEU B 169 -5.860 -2.478 1.362 1.00 0.63 C ATOM 805 CG LEU B 169 -7.081 -2.145 0.500 1.00 0.72 C ATOM 806 CD1 LEU B 169 -8.037 -1.237 1.257 1.00 0.86 C ATOM 807 CD2 LEU B 169 -6.648 -1.496 -0.805 1.00 0.76 C ATOM 0 H LEU B 169 -6.510 -4.759 0.693 1.00 0.60 H new ATOM 0 HA LEU B 169 -4.499 -3.036 -0.210 1.00 0.52 H new ATOM 0 HB2 LEU B 169 -6.205 -2.897 2.307 1.00 0.63 H new ATOM 0 HB3 LEU B 169 -5.336 -1.551 1.597 1.00 0.63 H new ATOM 0 HG LEU B 169 -7.603 -3.073 0.267 1.00 0.72 H new ATOM 0 HD11 LEU B 169 -8.899 -1.011 0.629 1.00 0.86 H new ATOM 0 HD12 LEU B 169 -8.372 -1.738 2.166 1.00 0.86 H new ATOM 0 HD13 LEU B 169 -7.527 -0.310 1.520 1.00 0.86 H new ATOM 0 HD21 LEU B 169 -7.528 -1.266 -1.406 1.00 0.76 H new ATOM 0 HD22 LEU B 169 -6.104 -0.576 -0.591 1.00 0.76 H new ATOM 0 HD23 LEU B 169 -6.002 -2.180 -1.355 1.00 0.76 H new ATOM 819 N LEU B 170 -3.909 -4.382 2.753 1.00 0.51 N ATOM 820 CA LEU B 170 -2.859 -4.648 3.730 1.00 0.52 C ATOM 821 C LEU B 170 -1.700 -5.410 3.094 1.00 0.44 C ATOM 822 O LEU B 170 -0.540 -5.021 3.230 1.00 0.40 O ATOM 823 CB LEU B 170 -3.416 -5.440 4.916 1.00 0.67 C ATOM 824 CG LEU B 170 -4.340 -4.654 5.852 1.00 0.80 C ATOM 825 CD1 LEU B 170 -5.659 -4.331 5.166 1.00 0.86 C ATOM 826 CD2 LEU B 170 -4.583 -5.434 7.136 1.00 0.93 C ATOM 0 H LEU B 170 -4.814 -4.792 2.984 1.00 0.51 H new ATOM 0 HA LEU B 170 -2.486 -3.689 4.089 1.00 0.52 H new ATOM 0 HB2 LEU B 170 -3.962 -6.301 4.532 1.00 0.67 H new ATOM 0 HB3 LEU B 170 -2.580 -5.827 5.498 1.00 0.67 H new ATOM 0 HG LEU B 170 -3.850 -3.714 6.104 1.00 0.80 H new ATOM 0 HD11 LEU B 170 -6.298 -3.773 5.850 1.00 0.86 H new ATOM 0 HD12 LEU B 170 -5.469 -3.731 4.276 1.00 0.86 H new ATOM 0 HD13 LEU B 170 -6.156 -5.258 4.879 1.00 0.86 H new ATOM 0 HD21 LEU B 170 -5.241 -4.862 7.790 1.00 0.93 H new ATOM 0 HD22 LEU B 170 -5.049 -6.390 6.898 1.00 0.93 H new ATOM 0 HD23 LEU B 170 -3.633 -5.609 7.641 1.00 0.93 H new ATOM 838 N LEU B 171 -2.022 -6.497 2.401 1.00 0.45 N ATOM 839 CA LEU B 171 -1.007 -7.313 1.747 1.00 0.45 C ATOM 840 C LEU B 171 -0.160 -6.472 0.797 1.00 0.37 C ATOM 841 O LEU B 171 1.062 -6.613 0.749 1.00 0.38 O ATOM 842 CB LEU B 171 -1.663 -8.465 0.983 1.00 0.54 C ATOM 843 CG LEU B 171 -2.430 -9.461 1.853 1.00 0.65 C ATOM 844 CD1 LEU B 171 -3.049 -10.554 0.995 1.00 0.74 C ATOM 845 CD2 LEU B 171 -1.513 -10.062 2.906 1.00 0.74 C ATOM 0 H LEU B 171 -2.977 -6.833 2.278 1.00 0.45 H new ATOM 0 HA LEU B 171 -0.354 -7.723 2.518 1.00 0.45 H new ATOM 0 HB2 LEU B 171 -2.347 -8.048 0.244 1.00 0.54 H new ATOM 0 HB3 LEU B 171 -0.891 -9.004 0.434 1.00 0.54 H new ATOM 0 HG LEU B 171 -3.234 -8.928 2.360 1.00 0.65 H new ATOM 0 HD11 LEU B 171 -3.591 -11.253 1.632 1.00 0.74 H new ATOM 0 HD12 LEU B 171 -3.738 -10.107 0.278 1.00 0.74 H new ATOM 0 HD13 LEU B 171 -2.262 -11.085 0.459 1.00 0.74 H new ATOM 0 HD21 LEU B 171 -2.075 -10.769 3.517 1.00 0.74 H new ATOM 0 HD22 LEU B 171 -0.688 -10.580 2.417 1.00 0.74 H new ATOM 0 HD23 LEU B 171 -1.118 -9.268 3.540 1.00 0.74 H new ATOM 857 N SER B 172 -0.817 -5.599 0.041 1.00 0.32 N ATOM 858 CA SER B 172 -0.122 -4.735 -0.904 1.00 0.31 C ATOM 859 C SER B 172 0.959 -3.921 -0.203 1.00 0.26 C ATOM 860 O SER B 172 2.112 -3.900 -0.633 1.00 0.30 O ATOM 861 CB SER B 172 -1.113 -3.799 -1.597 1.00 0.33 C ATOM 862 OG SER B 172 -2.086 -4.531 -2.323 1.00 0.40 O ATOM 0 H SER B 172 -1.829 -5.472 0.065 1.00 0.32 H new ATOM 0 HA SER B 172 0.353 -5.368 -1.654 1.00 0.31 H new ATOM 0 HB2 SER B 172 -1.605 -3.172 -0.854 1.00 0.33 H new ATOM 0 HB3 SER B 172 -0.577 -3.132 -2.272 1.00 0.33 H new ATOM 0 HG SER B 172 -2.621 -5.069 -1.703 1.00 0.40 H new ATOM 868 N HIS B 173 0.581 -3.251 0.883 1.00 0.22 N ATOM 869 CA HIS B 173 1.525 -2.438 1.641 1.00 0.23 C ATOM 870 C HIS B 173 2.751 -3.252 2.040 1.00 0.23 C ATOM 871 O HIS B 173 3.886 -2.840 1.797 1.00 0.25 O ATOM 872 CB HIS B 173 0.852 -1.859 2.886 1.00 0.28 C ATOM 873 CG HIS B 173 -0.171 -0.812 2.576 1.00 0.28 C ATOM 874 ND1 HIS B 173 -1.530 -1.049 2.619 1.00 0.34 N ATOM 875 CD2 HIS B 173 -0.029 0.487 2.219 1.00 0.36 C ATOM 876 CE1 HIS B 173 -2.177 0.058 2.299 1.00 0.35 C ATOM 877 NE2 HIS B 173 -1.290 1.004 2.053 1.00 0.36 N ATOM 0 H HIS B 173 -0.368 -3.255 1.256 1.00 0.22 H new ATOM 0 HA HIS B 173 1.851 -1.618 1.001 1.00 0.23 H new ATOM 0 HB2 HIS B 173 0.377 -2.667 3.442 1.00 0.28 H new ATOM 0 HB3 HIS B 173 1.615 -1.430 3.536 1.00 0.28 H new ATOM 0 HD1 HIS B 173 -1.966 -1.939 2.860 1.00 0.34 H new ATOM 0 HD2 HIS B 173 0.903 1.017 2.089 1.00 0.36 H new ATOM 0 HE1 HIS B 173 -3.250 0.170 2.247 1.00 0.35 H new ATOM 886 N LEU B 174 2.520 -4.408 2.654 1.00 0.24 N ATOM 887 CA LEU B 174 3.613 -5.275 3.081 1.00 0.27 C ATOM 888 C LEU B 174 4.564 -5.555 1.922 1.00 0.23 C ATOM 889 O LEU B 174 5.775 -5.362 2.037 1.00 0.24 O ATOM 890 CB LEU B 174 3.065 -6.592 3.636 1.00 0.33 C ATOM 891 CG LEU B 174 2.296 -6.473 4.954 1.00 0.40 C ATOM 892 CD1 LEU B 174 1.725 -7.822 5.364 1.00 0.48 C ATOM 893 CD2 LEU B 174 3.199 -5.922 6.048 1.00 0.47 C ATOM 0 H LEU B 174 1.589 -4.766 2.867 1.00 0.24 H new ATOM 0 HA LEU B 174 4.165 -4.762 3.868 1.00 0.27 H new ATOM 0 HB2 LEU B 174 2.408 -7.037 2.889 1.00 0.33 H new ATOM 0 HB3 LEU B 174 3.897 -7.281 3.780 1.00 0.33 H new ATOM 0 HG LEU B 174 1.467 -5.780 4.808 1.00 0.40 H new ATOM 0 HD11 LEU B 174 1.182 -7.717 6.303 1.00 0.48 H new ATOM 0 HD12 LEU B 174 1.046 -8.180 4.590 1.00 0.48 H new ATOM 0 HD13 LEU B 174 2.538 -8.537 5.493 1.00 0.48 H new ATOM 0 HD21 LEU B 174 2.637 -5.844 6.979 1.00 0.47 H new ATOM 0 HD22 LEU B 174 4.047 -6.592 6.192 1.00 0.47 H new ATOM 0 HD23 LEU B 174 3.561 -4.935 5.759 1.00 0.47 H new ATOM 905 N LEU B 175 4.006 -6.007 0.803 1.00 0.22 N ATOM 906 CA LEU B 175 4.801 -6.311 -0.380 1.00 0.23 C ATOM 907 C LEU B 175 5.546 -5.071 -0.866 1.00 0.21 C ATOM 908 O LEU B 175 6.713 -5.147 -1.248 1.00 0.23 O ATOM 909 CB LEU B 175 3.906 -6.853 -1.496 1.00 0.27 C ATOM 910 CG LEU B 175 3.171 -8.152 -1.163 1.00 0.32 C ATOM 911 CD1 LEU B 175 2.200 -8.517 -2.275 1.00 0.38 C ATOM 912 CD2 LEU B 175 4.166 -9.281 -0.934 1.00 0.38 C ATOM 0 H LEU B 175 3.005 -6.171 0.692 1.00 0.22 H new ATOM 0 HA LEU B 175 5.534 -7.072 -0.111 1.00 0.23 H new ATOM 0 HB2 LEU B 175 3.169 -6.092 -1.752 1.00 0.27 H new ATOM 0 HB3 LEU B 175 4.517 -7.016 -2.384 1.00 0.27 H new ATOM 0 HG LEU B 175 2.602 -8.000 -0.246 1.00 0.32 H new ATOM 0 HD11 LEU B 175 1.687 -9.444 -2.020 1.00 0.38 H new ATOM 0 HD12 LEU B 175 1.468 -7.718 -2.396 1.00 0.38 H new ATOM 0 HD13 LEU B 175 2.748 -8.651 -3.207 1.00 0.38 H new ATOM 0 HD21 LEU B 175 3.627 -10.199 -0.698 1.00 0.38 H new ATOM 0 HD22 LEU B 175 4.760 -9.431 -1.835 1.00 0.38 H new ATOM 0 HD23 LEU B 175 4.824 -9.023 -0.104 1.00 0.38 H new ATOM 924 N ALA B 176 4.861 -3.933 -0.847 1.00 0.21 N ATOM 925 CA ALA B 176 5.454 -2.676 -1.287 1.00 0.23 C ATOM 926 C ALA B 176 6.786 -2.420 -0.587 1.00 0.22 C ATOM 927 O ALA B 176 7.798 -2.154 -1.236 1.00 0.24 O ATOM 928 CB ALA B 176 4.493 -1.523 -1.033 1.00 0.26 C ATOM 0 H ALA B 176 3.894 -3.855 -0.531 1.00 0.21 H new ATOM 0 HA ALA B 176 5.645 -2.749 -2.358 1.00 0.23 H new ATOM 0 HB1 ALA B 176 4.948 -0.590 -1.366 1.00 0.26 H new ATOM 0 HB2 ALA B 176 3.568 -1.692 -1.584 1.00 0.26 H new ATOM 0 HB3 ALA B 176 4.274 -1.460 0.033 1.00 0.26 H new ATOM 934 N ILE B 177 6.779 -2.501 0.739 1.00 0.20 N ATOM 935 CA ILE B 177 7.987 -2.276 1.522 1.00 0.21 C ATOM 936 C ILE B 177 9.071 -3.283 1.156 1.00 0.21 C ATOM 937 O ILE B 177 10.233 -2.920 0.965 1.00 0.22 O ATOM 938 CB ILE B 177 7.703 -2.369 3.034 1.00 0.22 C ATOM 939 CG1 ILE B 177 6.557 -1.433 3.420 1.00 0.24 C ATOM 940 CG2 ILE B 177 8.956 -2.031 3.828 1.00 0.25 C ATOM 941 CD1 ILE B 177 6.169 -1.528 4.880 1.00 0.29 C ATOM 0 H ILE B 177 5.951 -2.721 1.293 1.00 0.20 H new ATOM 0 HA ILE B 177 8.334 -1.270 1.288 1.00 0.21 H new ATOM 0 HB ILE B 177 7.408 -3.391 3.270 1.00 0.22 H new ATOM 0 HG12 ILE B 177 6.845 -0.406 3.194 1.00 0.24 H new ATOM 0 HG13 ILE B 177 5.687 -1.663 2.805 1.00 0.24 H new ATOM 0 HG21 ILE B 177 8.741 -2.101 4.894 1.00 0.25 H new ATOM 0 HG22 ILE B 177 9.750 -2.733 3.571 1.00 0.25 H new ATOM 0 HG23 ILE B 177 9.276 -1.017 3.588 1.00 0.25 H new ATOM 0 HD11 ILE B 177 5.351 -0.838 5.085 1.00 0.29 H new ATOM 0 HD12 ILE B 177 5.851 -2.546 5.106 1.00 0.29 H new ATOM 0 HD13 ILE B 177 7.026 -1.269 5.502 1.00 0.29 H new ATOM 953 N GLY B 178 8.683 -4.551 1.055 1.00 0.21 N ATOM 954 CA GLY B 178 9.633 -5.590 0.706 1.00 0.23 C ATOM 955 C GLY B 178 10.375 -5.280 -0.577 1.00 0.23 C ATOM 956 O GLY B 178 11.590 -5.456 -0.660 1.00 0.26 O ATOM 0 H GLY B 178 7.729 -4.876 1.209 1.00 0.21 H new ATOM 0 HA2 GLY B 178 10.350 -5.712 1.518 1.00 0.23 H new ATOM 0 HA3 GLY B 178 9.108 -6.539 0.600 1.00 0.23 H new ATOM 960 N LEU B 179 9.641 -4.814 -1.582 1.00 0.21 N ATOM 961 CA LEU B 179 10.234 -4.473 -2.869 1.00 0.23 C ATOM 962 C LEU B 179 11.249 -3.348 -2.714 1.00 0.24 C ATOM 963 O LEU B 179 12.348 -3.407 -3.267 1.00 0.28 O ATOM 964 CB LEU B 179 9.146 -4.064 -3.863 1.00 0.25 C ATOM 965 CG LEU B 179 8.138 -5.161 -4.207 1.00 0.27 C ATOM 966 CD1 LEU B 179 7.092 -4.641 -5.181 1.00 0.34 C ATOM 967 CD2 LEU B 179 8.851 -6.375 -4.785 1.00 0.33 C ATOM 0 H LEU B 179 8.633 -4.664 -1.529 1.00 0.21 H new ATOM 0 HA LEU B 179 10.750 -5.354 -3.251 1.00 0.23 H new ATOM 0 HB2 LEU B 179 8.605 -3.210 -3.455 1.00 0.25 H new ATOM 0 HB3 LEU B 179 9.624 -3.729 -4.784 1.00 0.25 H new ATOM 0 HG LEU B 179 7.631 -5.463 -3.291 1.00 0.27 H new ATOM 0 HD11 LEU B 179 6.384 -5.436 -5.413 1.00 0.34 H new ATOM 0 HD12 LEU B 179 6.561 -3.802 -4.731 1.00 0.34 H new ATOM 0 HD13 LEU B 179 7.581 -4.311 -6.098 1.00 0.34 H new ATOM 0 HD21 LEU B 179 8.119 -7.147 -5.025 1.00 0.33 H new ATOM 0 HD22 LEU B 179 9.384 -6.087 -5.691 1.00 0.33 H new ATOM 0 HD23 LEU B 179 9.561 -6.762 -4.054 1.00 0.33 H new ATOM 979 N GLY B 180 10.873 -2.321 -1.959 1.00 0.23 N ATOM 980 CA GLY B 180 11.764 -1.198 -1.743 1.00 0.27 C ATOM 981 C GLY B 180 13.135 -1.632 -1.265 1.00 0.29 C ATOM 982 O GLY B 180 14.152 -1.246 -1.840 1.00 0.34 O ATOM 0 H GLY B 180 9.968 -2.247 -1.494 1.00 0.23 H new ATOM 0 HA2 GLY B 180 11.867 -0.636 -2.671 1.00 0.27 H new ATOM 0 HA3 GLY B 180 11.323 -0.524 -1.009 1.00 0.27 H new ATOM 986 N ILE B 181 13.164 -2.440 -0.210 1.00 0.27 N ATOM 987 CA ILE B 181 14.421 -2.928 0.344 1.00 0.32 C ATOM 988 C ILE B 181 15.214 -3.715 -0.696 1.00 0.37 C ATOM 989 O ILE B 181 16.406 -3.478 -0.893 1.00 0.44 O ATOM 990 CB ILE B 181 14.184 -3.824 1.575 1.00 0.34 C ATOM 991 CG1 ILE B 181 13.366 -3.077 2.629 1.00 0.32 C ATOM 992 CG2 ILE B 181 15.512 -4.285 2.157 1.00 0.42 C ATOM 993 CD1 ILE B 181 13.109 -3.888 3.881 1.00 0.67 C ATOM 0 H ILE B 181 12.331 -2.770 0.278 1.00 0.27 H new ATOM 0 HA ILE B 181 14.993 -2.050 0.646 1.00 0.32 H new ATOM 0 HB ILE B 181 13.620 -4.703 1.262 1.00 0.34 H new ATOM 0 HG12 ILE B 181 13.889 -2.160 2.901 1.00 0.32 H new ATOM 0 HG13 ILE B 181 12.411 -2.782 2.194 1.00 0.32 H new ATOM 0 HG21 ILE B 181 15.329 -4.917 3.026 1.00 0.42 H new ATOM 0 HG22 ILE B 181 16.061 -4.852 1.405 1.00 0.42 H new ATOM 0 HG23 ILE B 181 16.099 -3.417 2.457 1.00 0.42 H new ATOM 0 HD11 ILE B 181 12.524 -3.296 4.584 1.00 0.67 H new ATOM 0 HD12 ILE B 181 12.558 -4.792 3.622 1.00 0.67 H new ATOM 0 HD13 ILE B 181 14.060 -4.161 4.339 1.00 0.67 H new ATOM 1005 N TYR B 182 14.542 -4.649 -1.360 1.00 0.36 N ATOM 1006 CA TYR B 182 15.180 -5.477 -2.379 1.00 0.42 C ATOM 1007 C TYR B 182 15.862 -4.617 -3.440 1.00 0.45 C ATOM 1008 O TYR B 182 17.027 -4.832 -3.772 1.00 0.51 O ATOM 1009 CB TYR B 182 14.146 -6.393 -3.036 1.00 0.46 C ATOM 1010 CG TYR B 182 14.740 -7.365 -4.033 1.00 0.58 C ATOM 1011 CD1 TYR B 182 14.958 -6.990 -5.353 1.00 1.20 C ATOM 1012 CD2 TYR B 182 15.080 -8.657 -3.653 1.00 1.48 C ATOM 1013 CE1 TYR B 182 15.497 -7.876 -6.267 1.00 1.25 C ATOM 1014 CE2 TYR B 182 15.620 -9.548 -4.560 1.00 1.56 C ATOM 1015 CZ TYR B 182 15.827 -9.153 -5.865 1.00 0.83 C ATOM 1016 OH TYR B 182 16.362 -10.039 -6.772 1.00 0.97 O ATOM 0 H TYR B 182 13.554 -4.853 -1.211 1.00 0.36 H new ATOM 0 HA TYR B 182 15.942 -6.085 -1.891 1.00 0.42 H new ATOM 0 HB2 TYR B 182 13.626 -6.955 -2.260 1.00 0.46 H new ATOM 0 HB3 TYR B 182 13.399 -5.780 -3.540 1.00 0.46 H new ATOM 0 HD1 TYR B 182 14.702 -5.990 -5.670 1.00 1.20 H new ATOM 0 HD2 TYR B 182 14.920 -8.970 -2.632 1.00 1.48 H new ATOM 0 HE1 TYR B 182 15.659 -7.570 -7.290 1.00 1.25 H new ATOM 0 HE2 TYR B 182 15.879 -10.549 -4.249 1.00 1.56 H new ATOM 0 HH TYR B 182 16.539 -10.895 -6.328 1.00 0.97 H new ATOM 1026 N ILE B 183 15.129 -3.648 -3.975 1.00 0.44 N ATOM 1027 CA ILE B 183 15.669 -2.759 -4.997 1.00 0.50 C ATOM 1028 C ILE B 183 16.844 -1.948 -4.456 1.00 0.52 C ATOM 1029 O ILE B 183 17.894 -1.858 -5.091 1.00 0.59 O ATOM 1030 CB ILE B 183 14.588 -1.794 -5.528 1.00 0.55 C ATOM 1031 CG1 ILE B 183 13.418 -2.583 -6.120 1.00 0.59 C ATOM 1032 CG2 ILE B 183 15.174 -0.850 -6.569 1.00 0.64 C ATOM 1033 CD1 ILE B 183 12.310 -1.707 -6.662 1.00 0.83 C ATOM 0 H ILE B 183 14.160 -3.458 -3.719 1.00 0.44 H new ATOM 0 HA ILE B 183 16.016 -3.389 -5.816 1.00 0.50 H new ATOM 0 HB ILE B 183 14.220 -1.196 -4.694 1.00 0.55 H new ATOM 0 HG12 ILE B 183 13.790 -3.222 -6.921 1.00 0.59 H new ATOM 0 HG13 ILE B 183 13.008 -3.240 -5.353 1.00 0.59 H new ATOM 0 HG21 ILE B 183 14.395 -0.178 -6.930 1.00 0.64 H new ATOM 0 HG22 ILE B 183 15.977 -0.266 -6.120 1.00 0.64 H new ATOM 0 HG23 ILE B 183 15.570 -1.429 -7.403 1.00 0.64 H new ATOM 0 HD11 ILE B 183 11.515 -2.334 -7.065 1.00 0.83 H new ATOM 0 HD12 ILE B 183 11.911 -1.087 -5.859 1.00 0.83 H new ATOM 0 HD13 ILE B 183 12.705 -1.068 -7.452 1.00 0.83 H new ATOM 1045 N GLY B 184 16.658 -1.361 -3.277 1.00 0.50 N ATOM 1046 CA GLY B 184 17.705 -0.556 -2.673 1.00 0.57 C ATOM 1047 C GLY B 184 18.965 -1.346 -2.367 1.00 0.62 C ATOM 1048 O GLY B 184 20.061 -0.950 -2.762 1.00 0.69 O ATOM 0 H GLY B 184 15.800 -1.429 -2.729 1.00 0.50 H new ATOM 0 HA2 GLY B 184 17.954 0.267 -3.343 1.00 0.57 H new ATOM 0 HA3 GLY B 184 17.328 -0.114 -1.751 1.00 0.57 H new ATOM 1052 N ARG B 185 18.811 -2.463 -1.663 1.00 0.62 N ATOM 1053 CA ARG B 185 19.951 -3.298 -1.296 1.00 0.72 C ATOM 1054 C ARG B 185 20.664 -3.838 -2.533 1.00 0.79 C ATOM 1055 O ARG B 185 21.856 -4.141 -2.489 1.00 0.88 O ATOM 1056 CB ARG B 185 19.502 -4.456 -0.401 1.00 0.77 C ATOM 1057 CG ARG B 185 18.565 -5.437 -1.082 1.00 0.72 C ATOM 1058 CD ARG B 185 19.327 -6.564 -1.765 1.00 1.02 C ATOM 1059 NE ARG B 185 20.189 -7.282 -0.829 1.00 1.43 N ATOM 1060 CZ ARG B 185 21.012 -8.262 -1.186 1.00 2.03 C ATOM 1061 NH1 ARG B 185 21.086 -8.640 -2.454 1.00 2.27 N ATOM 1062 NH2 ARG B 185 21.763 -8.864 -0.274 1.00 2.56 N ATOM 0 H ARG B 185 17.910 -2.811 -1.335 1.00 0.62 H new ATOM 0 HA ARG B 185 20.654 -2.675 -0.743 1.00 0.72 H new ATOM 0 HB2 ARG B 185 20.383 -4.994 -0.052 1.00 0.77 H new ATOM 0 HB3 ARG B 185 19.007 -4.049 0.481 1.00 0.77 H new ATOM 0 HG2 ARG B 185 17.879 -5.856 -0.346 1.00 0.72 H new ATOM 0 HG3 ARG B 185 17.959 -4.909 -1.818 1.00 0.72 H new ATOM 0 HD2 ARG B 185 18.619 -7.261 -2.215 1.00 1.02 H new ATOM 0 HD3 ARG B 185 19.931 -6.155 -2.575 1.00 1.02 H new ATOM 0 HE ARG B 185 20.157 -7.016 0.155 1.00 1.43 H new ATOM 0 HH11 ARG B 185 20.510 -8.178 -3.158 1.00 2.27 H new ATOM 0 HH12 ARG B 185 21.719 -9.393 -2.726 1.00 2.27 H new ATOM 0 HH21 ARG B 185 21.709 -8.575 0.703 1.00 2.56 H new ATOM 0 HH22 ARG B 185 22.394 -9.616 -0.549 1.00 2.56 H new ATOM 1076 N ARG B 186 19.931 -3.958 -3.635 1.00 0.79 N ATOM 1077 CA ARG B 186 20.501 -4.465 -4.878 1.00 0.88 C ATOM 1078 C ARG B 186 21.349 -3.403 -5.572 1.00 0.95 C ATOM 1079 O ARG B 186 22.378 -3.714 -6.172 1.00 1.08 O ATOM 1080 CB ARG B 186 19.394 -4.947 -5.817 1.00 0.90 C ATOM 1081 CG ARG B 186 18.853 -6.324 -5.462 1.00 1.29 C ATOM 1082 CD ARG B 186 19.926 -7.393 -5.588 1.00 1.64 C ATOM 1083 NE ARG B 186 19.405 -8.732 -5.327 1.00 2.30 N ATOM 1084 CZ ARG B 186 20.178 -9.797 -5.142 1.00 2.97 C ATOM 1085 NH1 ARG B 186 21.498 -9.676 -5.180 1.00 3.23 N ATOM 1086 NH2 ARG B 186 19.632 -10.985 -4.919 1.00 3.82 N ATOM 0 H ARG B 186 18.943 -3.712 -3.693 1.00 0.79 H new ATOM 0 HA ARG B 186 21.147 -5.307 -4.628 1.00 0.88 H new ATOM 0 HB2 ARG B 186 18.575 -4.228 -5.799 1.00 0.90 H new ATOM 0 HB3 ARG B 186 19.778 -4.968 -6.837 1.00 0.90 H new ATOM 0 HG2 ARG B 186 18.467 -6.313 -4.443 1.00 1.29 H new ATOM 0 HG3 ARG B 186 18.017 -6.568 -6.117 1.00 1.29 H new ATOM 0 HD2 ARG B 186 20.353 -7.360 -6.590 1.00 1.64 H new ATOM 0 HD3 ARG B 186 20.735 -7.177 -4.890 1.00 1.64 H new ATOM 0 HE ARG B 186 18.394 -8.857 -5.284 1.00 2.30 H new ATOM 0 HH11 ARG B 186 21.922 -8.764 -5.351 1.00 3.23 H new ATOM 0 HH12 ARG B 186 22.089 -10.495 -5.038 1.00 3.23 H new ATOM 0 HH21 ARG B 186 18.617 -11.082 -4.889 1.00 3.82 H new ATOM 0 HH22 ARG B 186 20.227 -11.801 -4.777 1.00 3.82 H new ATOM 1100 N LEU B 187 20.915 -2.150 -5.488 1.00 0.93 N ATOM 1101 CA LEU B 187 21.643 -1.052 -6.114 1.00 1.07 C ATOM 1102 C LEU B 187 22.997 -0.845 -5.443 1.00 1.13 C ATOM 1103 O LEU B 187 24.041 -0.926 -6.089 1.00 1.37 O ATOM 1104 CB LEU B 187 20.826 0.238 -6.052 1.00 1.20 C ATOM 1105 CG LEU B 187 19.550 0.236 -6.894 1.00 1.42 C ATOM 1106 CD1 LEU B 187 18.854 1.586 -6.814 1.00 1.72 C ATOM 1107 CD2 LEU B 187 19.868 -0.117 -8.339 1.00 1.60 C ATOM 0 H LEU B 187 20.067 -1.870 -4.995 1.00 0.93 H new ATOM 0 HA LEU B 187 21.811 -1.313 -7.159 1.00 1.07 H new ATOM 0 HB2 LEU B 187 20.558 0.431 -5.013 1.00 1.20 H new ATOM 0 HB3 LEU B 187 21.457 1.066 -6.377 1.00 1.20 H new ATOM 0 HG LEU B 187 18.875 -0.521 -6.495 1.00 1.42 H new ATOM 0 HD11 LEU B 187 17.948 1.565 -7.420 1.00 1.72 H new ATOM 0 HD12 LEU B 187 18.593 1.800 -5.778 1.00 1.72 H new ATOM 0 HD13 LEU B 187 19.522 2.362 -7.187 1.00 1.72 H new ATOM 0 HD21 LEU B 187 18.949 -0.114 -8.925 1.00 1.60 H new ATOM 0 HD22 LEU B 187 20.562 0.617 -8.749 1.00 1.60 H new ATOM 0 HD23 LEU B 187 20.321 -1.107 -8.380 1.00 1.60 H new ATOM 1119 N THR B 188 22.969 -0.580 -4.143 1.00 1.14 N ATOM 1120 CA THR B 188 24.192 -0.359 -3.381 1.00 1.37 C ATOM 1121 C THR B 188 24.508 -1.553 -2.487 1.00 1.56 C ATOM 1122 O THR B 188 23.984 -1.600 -1.354 1.00 1.97 O ATOM 1123 CB THR B 188 24.100 0.914 -2.517 1.00 1.53 C ATOM 1124 OG1 THR B 188 25.177 0.946 -1.573 1.00 2.17 O ATOM 1125 CG2 THR B 188 22.770 0.980 -1.778 1.00 1.63 C ATOM 1126 OXT THR B 188 25.277 -2.432 -2.926 1.00 2.16 O ATOM 0 H THR B 188 22.112 -0.513 -3.594 1.00 1.14 H new ATOM 0 HA THR B 188 24.996 -0.233 -4.107 1.00 1.37 H new ATOM 0 HB THR B 188 24.170 1.777 -3.179 1.00 1.53 H new ATOM 0 HG1 THR B 188 25.112 1.759 -1.029 1.00 2.17 H new ATOM 0 HG21 THR B 188 22.733 1.888 -1.176 1.00 1.63 H new ATOM 0 HG22 THR B 188 21.953 0.989 -2.499 1.00 1.63 H new ATOM 0 HG23 THR B 188 22.671 0.110 -1.128 1.00 1.63 H new TER 1134 THR B 188