USER MOD reduce.3.24.130724 H: found=0, std=0, add=573, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 574 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 163 ASN : amide:sc= -1.4! K(o=-1.4!,f=-0.32) USER MOD Single : A 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 165 GLN : amide:sc= -3.93! K(o=-3.9!,f=-1) USER MOD Single : A 167 THR OG1 : rot 180:sc= 0 USER MOD Single : A 173 CYS SG : rot 42:sc=-0.000188 USER MOD Single : A 176 THR OG1 : rot 180:sc= 0.0339 USER MOD Single : A 180 SER OG : rot -48:sc= -0.0299 USER MOD Single : A 182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 MET CE :methyl -176:sc= 0 (180deg=-0.0207) USER MOD Single : A 187 MET CE :methyl -154:sc= -0.515 (180deg=-1.39) USER MOD Single : A 194 CYS SG : rot 7:sc= 0.452 USER MOD Single : A 195 CYS SG : rot 98:sc= 1.11 USER MOD Single : A 198 TYR OH : rot 180:sc= 0 USER MOD Single : A 205 LYS NZ :NH3+ 180:sc= 1.18 (180deg=1.18) USER MOD Single : A 206 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 212 THR OG1 : rot 180:sc= 0 USER MOD Single : A 215 SER OG : rot 67:sc= -2.36! USER MOD Single : A 218 THR OG1 : rot 104:sc= 0.234 USER MOD Single : A 223 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 65 N PRO A 155 14.405 1.745 -2.177 1.00 0.00 N ATOM 66 CA PRO A 155 13.488 0.844 -2.860 1.00 0.00 C ATOM 67 C PRO A 155 12.054 1.349 -2.767 1.00 0.00 C ATOM 68 O PRO A 155 11.696 2.044 -1.820 1.00 0.00 O ATOM 69 CB PRO A 155 13.639 -0.488 -2.107 1.00 0.00 C ATOM 70 CG PRO A 155 14.731 -0.277 -1.106 1.00 0.00 C ATOM 71 CD PRO A 155 14.816 1.204 -0.879 1.00 0.00 C ATOM 0 HA PRO A 155 13.710 0.756 -3.923 1.00 0.00 H new ATOM 0 HB2 PRO A 155 12.707 -0.765 -1.614 1.00 0.00 H new ATOM 0 HB3 PRO A 155 13.890 -1.297 -2.793 1.00 0.00 H new ATOM 0 HG2 PRO A 155 14.512 -0.801 -0.176 1.00 0.00 H new ATOM 0 HG3 PRO A 155 15.679 -0.668 -1.476 1.00 0.00 H new ATOM 0 HD2 PRO A 155 14.156 1.530 -0.075 1.00 0.00 H new ATOM 0 HD3 PRO A 155 15.825 1.517 -0.610 1.00 0.00 H new ATOM 79 N ILE A 156 11.247 1.017 -3.754 1.00 0.00 N ATOM 80 CA ILE A 156 9.852 1.422 -3.767 1.00 0.00 C ATOM 81 C ILE A 156 8.939 0.199 -3.823 1.00 0.00 C ATOM 82 O ILE A 156 9.377 -0.888 -4.195 1.00 0.00 O ATOM 83 CB ILE A 156 9.556 2.378 -4.953 1.00 0.00 C ATOM 84 CG1 ILE A 156 10.293 1.955 -6.232 1.00 0.00 C ATOM 85 CG2 ILE A 156 9.906 3.811 -4.595 1.00 0.00 C ATOM 86 CD1 ILE A 156 9.726 0.718 -6.888 1.00 0.00 C ATOM 0 H ILE A 156 11.533 0.465 -4.563 1.00 0.00 H new ATOM 0 HA ILE A 156 9.651 1.963 -2.842 1.00 0.00 H new ATOM 0 HB ILE A 156 8.486 2.316 -5.151 1.00 0.00 H new ATOM 0 HG12 ILE A 156 10.263 2.778 -6.946 1.00 0.00 H new ATOM 0 HG13 ILE A 156 11.342 1.779 -5.993 1.00 0.00 H new ATOM 0 HG21 ILE A 156 9.689 4.461 -5.443 1.00 0.00 H new ATOM 0 HG22 ILE A 156 9.314 4.126 -3.736 1.00 0.00 H new ATOM 0 HG23 ILE A 156 10.966 3.876 -4.349 1.00 0.00 H new ATOM 0 HD11 ILE A 156 10.301 0.485 -7.784 1.00 0.00 H new ATOM 0 HD12 ILE A 156 9.781 -0.120 -6.193 1.00 0.00 H new ATOM 0 HD13 ILE A 156 8.686 0.895 -7.161 1.00 0.00 H new ATOM 98 N VAL A 157 7.683 0.375 -3.438 1.00 0.00 N ATOM 99 CA VAL A 157 6.712 -0.713 -3.451 1.00 0.00 C ATOM 100 C VAL A 157 5.470 -0.276 -4.245 1.00 0.00 C ATOM 101 O VAL A 157 4.980 0.844 -4.069 1.00 0.00 O ATOM 102 CB VAL A 157 6.327 -1.182 -2.011 1.00 0.00 C ATOM 103 CG1 VAL A 157 7.013 -0.350 -0.938 1.00 0.00 C ATOM 104 CG2 VAL A 157 4.823 -1.185 -1.792 1.00 0.00 C ATOM 0 H VAL A 157 7.310 1.266 -3.111 1.00 0.00 H new ATOM 0 HA VAL A 157 7.170 -1.574 -3.939 1.00 0.00 H new ATOM 0 HB VAL A 157 6.682 -2.209 -1.923 1.00 0.00 H new ATOM 0 HG11 VAL A 157 6.717 -0.711 0.047 1.00 0.00 H new ATOM 0 HG12 VAL A 157 8.094 -0.437 -1.046 1.00 0.00 H new ATOM 0 HG13 VAL A 157 6.720 0.695 -1.045 1.00 0.00 H new ATOM 0 HG21 VAL A 157 4.604 -1.518 -0.778 1.00 0.00 H new ATOM 0 HG22 VAL A 157 4.432 -0.178 -1.936 1.00 0.00 H new ATOM 0 HG23 VAL A 157 4.353 -1.862 -2.505 1.00 0.00 H new ATOM 114 N ARG A 158 4.977 -1.149 -5.122 1.00 0.00 N ATOM 115 CA ARG A 158 3.959 -0.766 -6.107 1.00 0.00 C ATOM 116 C ARG A 158 2.557 -1.110 -5.650 1.00 0.00 C ATOM 117 O ARG A 158 2.121 -2.250 -5.753 1.00 0.00 O ATOM 118 CB ARG A 158 4.256 -1.439 -7.447 1.00 0.00 C ATOM 119 CG ARG A 158 5.580 -0.993 -8.013 1.00 0.00 C ATOM 120 CD ARG A 158 5.948 -1.686 -9.309 1.00 0.00 C ATOM 121 NE ARG A 158 6.228 -3.109 -9.125 1.00 0.00 N ATOM 122 CZ ARG A 158 6.884 -3.864 -10.005 1.00 0.00 C ATOM 123 NH1 ARG A 158 7.313 -3.347 -11.149 1.00 0.00 N ATOM 124 NH2 ARG A 158 7.119 -5.138 -9.731 1.00 0.00 N ATOM 0 H ARG A 158 5.264 -2.126 -5.173 1.00 0.00 H new ATOM 0 HA ARG A 158 4.003 0.317 -6.220 1.00 0.00 H new ATOM 0 HB2 ARG A 158 4.262 -2.521 -7.317 1.00 0.00 H new ATOM 0 HB3 ARG A 158 3.461 -1.207 -8.155 1.00 0.00 H new ATOM 0 HG2 ARG A 158 5.550 0.083 -8.182 1.00 0.00 H new ATOM 0 HG3 ARG A 158 6.362 -1.178 -7.276 1.00 0.00 H new ATOM 0 HD2 ARG A 158 5.133 -1.569 -10.023 1.00 0.00 H new ATOM 0 HD3 ARG A 158 6.823 -1.200 -9.741 1.00 0.00 H new ATOM 0 HE ARG A 158 5.900 -3.553 -8.267 1.00 0.00 H new ATOM 0 HH11 ARG A 158 7.141 -2.364 -11.361 1.00 0.00 H new ATOM 0 HH12 ARG A 158 7.814 -3.932 -11.817 1.00 0.00 H new ATOM 0 HH21 ARG A 158 6.798 -5.538 -8.849 1.00 0.00 H new ATOM 0 HH22 ARG A 158 7.621 -5.720 -10.402 1.00 0.00 H new ATOM 138 N VAL A 159 1.845 -0.109 -5.165 1.00 0.00 N ATOM 139 CA VAL A 159 0.502 -0.303 -4.679 1.00 0.00 C ATOM 140 C VAL A 159 -0.531 -0.043 -5.759 1.00 0.00 C ATOM 141 O VAL A 159 -0.276 0.643 -6.748 1.00 0.00 O ATOM 142 CB VAL A 159 0.179 0.613 -3.492 1.00 0.00 C ATOM 143 CG1 VAL A 159 -1.009 0.080 -2.726 1.00 0.00 C ATOM 144 CG2 VAL A 159 1.355 0.752 -2.569 1.00 0.00 C ATOM 0 H VAL A 159 2.183 0.851 -5.099 1.00 0.00 H new ATOM 0 HA VAL A 159 0.456 -1.345 -4.362 1.00 0.00 H new ATOM 0 HB VAL A 159 -0.059 1.599 -3.892 1.00 0.00 H new ATOM 0 HG11 VAL A 159 -1.227 0.740 -1.886 1.00 0.00 H new ATOM 0 HG12 VAL A 159 -1.876 0.033 -3.385 1.00 0.00 H new ATOM 0 HG13 VAL A 159 -0.783 -0.919 -2.353 1.00 0.00 H new ATOM 0 HG21 VAL A 159 1.091 1.408 -1.739 1.00 0.00 H new ATOM 0 HG22 VAL A 159 1.632 -0.229 -2.182 1.00 0.00 H new ATOM 0 HG23 VAL A 159 2.197 1.178 -3.114 1.00 0.00 H new ATOM 154 N PHE A 160 -1.705 -0.584 -5.522 1.00 0.00 N ATOM 155 CA PHE A 160 -2.844 -0.431 -6.401 1.00 0.00 C ATOM 156 C PHE A 160 -4.015 0.129 -5.607 1.00 0.00 C ATOM 157 O PHE A 160 -4.630 -0.577 -4.819 1.00 0.00 O ATOM 158 CB PHE A 160 -3.214 -1.773 -7.036 1.00 0.00 C ATOM 159 CG PHE A 160 -2.240 -2.231 -8.089 1.00 0.00 C ATOM 160 CD1 PHE A 160 -0.990 -2.721 -7.740 1.00 0.00 C ATOM 161 CD2 PHE A 160 -2.580 -2.176 -9.430 1.00 0.00 C ATOM 162 CE1 PHE A 160 -0.100 -3.145 -8.709 1.00 0.00 C ATOM 163 CE2 PHE A 160 -1.695 -2.597 -10.402 1.00 0.00 C ATOM 164 CZ PHE A 160 -0.454 -3.082 -10.041 1.00 0.00 C ATOM 0 H PHE A 160 -1.899 -1.153 -4.698 1.00 0.00 H new ATOM 0 HA PHE A 160 -2.592 0.261 -7.205 1.00 0.00 H new ATOM 0 HB2 PHE A 160 -3.274 -2.531 -6.255 1.00 0.00 H new ATOM 0 HB3 PHE A 160 -4.206 -1.694 -7.481 1.00 0.00 H new ATOM 0 HD1 PHE A 160 -0.709 -2.772 -6.699 1.00 0.00 H new ATOM 0 HD2 PHE A 160 -3.550 -1.799 -9.719 1.00 0.00 H new ATOM 0 HE1 PHE A 160 0.870 -3.525 -8.424 1.00 0.00 H new ATOM 0 HE2 PHE A 160 -1.973 -2.547 -11.444 1.00 0.00 H new ATOM 0 HZ PHE A 160 0.239 -3.412 -10.801 1.00 0.00 H new ATOM 174 N LEU A 161 -4.310 1.399 -5.819 1.00 0.00 N ATOM 175 CA LEU A 161 -5.298 2.103 -5.015 1.00 0.00 C ATOM 176 C LEU A 161 -6.700 1.873 -5.590 1.00 0.00 C ATOM 177 O LEU A 161 -6.831 1.247 -6.645 1.00 0.00 O ATOM 178 CB LEU A 161 -4.968 3.605 -4.968 1.00 0.00 C ATOM 179 CG LEU A 161 -3.532 3.961 -4.580 1.00 0.00 C ATOM 180 CD1 LEU A 161 -2.640 3.992 -5.807 1.00 0.00 C ATOM 181 CD2 LEU A 161 -3.494 5.292 -3.850 1.00 0.00 C ATOM 0 H LEU A 161 -3.877 1.969 -6.546 1.00 0.00 H new ATOM 0 HA LEU A 161 -5.274 1.714 -3.997 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -5.176 4.034 -5.948 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -5.645 4.084 -4.260 1.00 0.00 H new ATOM 0 HG LEU A 161 -3.154 3.192 -3.906 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -1.622 4.247 -5.511 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -2.644 3.012 -6.285 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -3.012 4.739 -6.508 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -2.465 5.530 -3.581 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -3.890 6.074 -4.498 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -4.100 5.229 -2.946 1.00 0.00 H new ATOM 193 N PRO A 162 -7.764 2.358 -4.913 1.00 0.00 N ATOM 194 CA PRO A 162 -9.144 2.233 -5.405 1.00 0.00 C ATOM 195 C PRO A 162 -9.314 2.752 -6.830 1.00 0.00 C ATOM 196 O PRO A 162 -8.490 3.528 -7.315 1.00 0.00 O ATOM 197 CB PRO A 162 -9.938 3.106 -4.437 1.00 0.00 C ATOM 198 CG PRO A 162 -9.159 3.042 -3.180 1.00 0.00 C ATOM 199 CD PRO A 162 -7.723 3.054 -3.614 1.00 0.00 C ATOM 0 HA PRO A 162 -9.464 1.192 -5.442 1.00 0.00 H new ATOM 0 HB2 PRO A 162 -10.025 4.130 -4.801 1.00 0.00 H new ATOM 0 HB3 PRO A 162 -10.952 2.730 -4.299 1.00 0.00 H new ATOM 0 HG2 PRO A 162 -9.383 3.890 -2.533 1.00 0.00 H new ATOM 0 HG3 PRO A 162 -9.393 2.140 -2.616 1.00 0.00 H new ATOM 0 HD2 PRO A 162 -7.339 4.070 -3.712 1.00 0.00 H new ATOM 0 HD3 PRO A 162 -7.081 2.538 -2.900 1.00 0.00 H new ATOM 207 N ASN A 163 -10.385 2.316 -7.487 1.00 0.00 N ATOM 208 CA ASN A 163 -10.703 2.735 -8.855 1.00 0.00 C ATOM 209 C ASN A 163 -9.618 2.256 -9.822 1.00 0.00 C ATOM 210 O ASN A 163 -9.324 2.909 -10.822 1.00 0.00 O ATOM 211 CB ASN A 163 -10.872 4.263 -8.931 1.00 0.00 C ATOM 212 CG ASN A 163 -11.477 4.741 -10.245 1.00 0.00 C ATOM 213 OD1 ASN A 163 -11.144 5.820 -10.736 1.00 0.00 O ATOM 214 ND2 ASN A 163 -12.378 3.957 -10.814 1.00 0.00 N ATOM 0 H ASN A 163 -11.059 1.662 -7.089 1.00 0.00 H new ATOM 0 HA ASN A 163 -11.649 2.279 -9.147 1.00 0.00 H new ATOM 0 HB2 ASN A 163 -11.505 4.592 -8.107 1.00 0.00 H new ATOM 0 HB3 ASN A 163 -9.899 4.736 -8.794 1.00 0.00 H new ATOM 0 HD21 ASN A 163 -12.821 4.240 -11.688 1.00 0.00 H new ATOM 0 HD22 ASN A 163 -12.629 3.069 -10.379 1.00 0.00 H new ATOM 221 N LYS A 164 -9.031 1.105 -9.496 1.00 0.00 N ATOM 222 CA LYS A 164 -7.992 0.485 -10.319 1.00 0.00 C ATOM 223 C LYS A 164 -6.825 1.439 -10.552 1.00 0.00 C ATOM 224 O LYS A 164 -6.365 1.617 -11.685 1.00 0.00 O ATOM 225 CB LYS A 164 -8.574 0.020 -11.654 1.00 0.00 C ATOM 226 CG LYS A 164 -9.653 -1.039 -11.504 1.00 0.00 C ATOM 227 CD LYS A 164 -9.091 -2.360 -10.997 1.00 0.00 C ATOM 228 CE LYS A 164 -8.167 -3.010 -12.015 1.00 0.00 C ATOM 229 NZ LYS A 164 -7.570 -4.268 -11.497 1.00 0.00 N ATOM 0 H LYS A 164 -9.262 0.576 -8.655 1.00 0.00 H new ATOM 0 HA LYS A 164 -7.613 -0.383 -9.779 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -8.989 0.879 -12.180 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -7.770 -0.376 -12.275 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -10.418 -0.682 -10.814 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -10.141 -1.198 -12.466 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -8.546 -2.190 -10.068 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -9.912 -3.039 -10.766 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -8.724 -3.221 -12.928 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -7.372 -2.313 -12.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -6.947 -4.680 -12.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -7.017 -4.063 -10.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -8.327 -4.943 -11.267 1.00 0.00 H new ATOM 243 N GLN A 165 -6.359 2.055 -9.478 1.00 0.00 N ATOM 244 CA GLN A 165 -5.262 2.995 -9.548 1.00 0.00 C ATOM 245 C GLN A 165 -3.973 2.336 -9.080 1.00 0.00 C ATOM 246 O GLN A 165 -4.002 1.245 -8.528 1.00 0.00 O ATOM 247 CB GLN A 165 -5.594 4.225 -8.705 1.00 0.00 C ATOM 248 CG GLN A 165 -6.733 5.048 -9.290 1.00 0.00 C ATOM 249 CD GLN A 165 -7.073 6.275 -8.468 1.00 0.00 C ATOM 250 OE1 GLN A 165 -7.484 7.297 -9.010 1.00 0.00 O ATOM 251 NE2 GLN A 165 -6.931 6.179 -7.158 1.00 0.00 N ATOM 0 H GLN A 165 -6.731 1.916 -8.539 1.00 0.00 H new ATOM 0 HA GLN A 165 -5.116 3.311 -10.581 1.00 0.00 H new ATOM 0 HB2 GLN A 165 -5.861 3.908 -7.697 1.00 0.00 H new ATOM 0 HB3 GLN A 165 -4.706 4.851 -8.618 1.00 0.00 H new ATOM 0 HG2 GLN A 165 -6.465 5.359 -10.300 1.00 0.00 H new ATOM 0 HG3 GLN A 165 -7.619 4.419 -9.375 1.00 0.00 H new ATOM 0 HE21 GLN A 165 -6.586 5.313 -6.745 1.00 0.00 H new ATOM 0 HE22 GLN A 165 -7.166 6.971 -6.560 1.00 0.00 H new ATOM 260 N ARG A 166 -2.846 2.975 -9.337 1.00 0.00 N ATOM 261 CA ARG A 166 -1.555 2.438 -8.933 1.00 0.00 C ATOM 262 C ARG A 166 -0.582 3.560 -8.598 1.00 0.00 C ATOM 263 O ARG A 166 -0.617 4.624 -9.216 1.00 0.00 O ATOM 264 CB ARG A 166 -1.003 1.548 -10.038 1.00 0.00 C ATOM 265 CG ARG A 166 0.412 1.065 -9.807 1.00 0.00 C ATOM 266 CD ARG A 166 0.779 0.033 -10.843 1.00 0.00 C ATOM 267 NE ARG A 166 2.220 -0.042 -11.074 1.00 0.00 N ATOM 268 CZ ARG A 166 2.827 -1.056 -11.686 1.00 0.00 C ATOM 269 NH1 ARG A 166 2.126 -2.109 -12.093 1.00 0.00 N ATOM 270 NH2 ARG A 166 4.134 -1.010 -11.904 1.00 0.00 N ATOM 0 H ARG A 166 -2.797 3.869 -9.825 1.00 0.00 H new ATOM 0 HA ARG A 166 -1.687 1.839 -8.032 1.00 0.00 H new ATOM 0 HB2 ARG A 166 -1.655 0.682 -10.149 1.00 0.00 H new ATOM 0 HB3 ARG A 166 -1.037 2.096 -10.980 1.00 0.00 H new ATOM 0 HG2 ARG A 166 1.105 1.905 -9.857 1.00 0.00 H new ATOM 0 HG3 ARG A 166 0.501 0.638 -8.808 1.00 0.00 H new ATOM 0 HD2 ARG A 166 0.415 -0.943 -10.523 1.00 0.00 H new ATOM 0 HD3 ARG A 166 0.276 0.270 -11.781 1.00 0.00 H new ATOM 0 HE ARG A 166 2.797 0.732 -10.745 1.00 0.00 H new ATOM 0 HH11 ARG A 166 1.119 -2.142 -11.937 1.00 0.00 H new ATOM 0 HH12 ARG A 166 2.595 -2.884 -12.562 1.00 0.00 H new ATOM 0 HH21 ARG A 166 4.673 -0.198 -11.603 1.00 0.00 H new ATOM 0 HH22 ARG A 166 4.600 -1.786 -12.373 1.00 0.00 H new ATOM 284 N THR A 167 0.263 3.332 -7.603 1.00 0.00 N ATOM 285 CA THR A 167 1.296 4.293 -7.247 1.00 0.00 C ATOM 286 C THR A 167 2.443 3.567 -6.552 1.00 0.00 C ATOM 287 O THR A 167 2.232 2.514 -5.950 1.00 0.00 O ATOM 288 CB THR A 167 0.738 5.414 -6.332 1.00 0.00 C ATOM 289 OG1 THR A 167 1.530 6.599 -6.469 1.00 0.00 O ATOM 290 CG2 THR A 167 0.722 4.995 -4.868 1.00 0.00 C ATOM 0 H THR A 167 0.253 2.490 -7.028 1.00 0.00 H new ATOM 0 HA THR A 167 1.658 4.765 -8.160 1.00 0.00 H new ATOM 0 HB THR A 167 -0.288 5.608 -6.645 1.00 0.00 H new ATOM 0 HG1 THR A 167 1.170 7.302 -5.889 1.00 0.00 H new ATOM 0 HG21 THR A 167 0.324 5.808 -4.261 1.00 0.00 H new ATOM 0 HG22 THR A 167 0.093 4.112 -4.749 1.00 0.00 H new ATOM 0 HG23 THR A 167 1.737 4.764 -4.545 1.00 0.00 H new ATOM 298 N VAL A 168 3.653 4.099 -6.645 1.00 0.00 N ATOM 299 CA VAL A 168 4.775 3.471 -5.974 1.00 0.00 C ATOM 300 C VAL A 168 5.302 4.373 -4.878 1.00 0.00 C ATOM 301 O VAL A 168 5.579 5.554 -5.096 1.00 0.00 O ATOM 302 CB VAL A 168 5.927 3.089 -6.932 1.00 0.00 C ATOM 303 CG1 VAL A 168 6.454 1.740 -6.561 1.00 0.00 C ATOM 304 CG2 VAL A 168 5.479 3.081 -8.380 1.00 0.00 C ATOM 0 H VAL A 168 3.878 4.946 -7.167 1.00 0.00 H new ATOM 0 HA VAL A 168 4.395 2.542 -5.548 1.00 0.00 H new ATOM 0 HB VAL A 168 6.710 3.841 -6.832 1.00 0.00 H new ATOM 0 HG11 VAL A 168 7.266 1.469 -7.235 1.00 0.00 H new ATOM 0 HG12 VAL A 168 6.825 1.764 -5.536 1.00 0.00 H new ATOM 0 HG13 VAL A 168 5.655 1.003 -6.640 1.00 0.00 H new ATOM 0 HG21 VAL A 168 6.319 2.808 -9.019 1.00 0.00 H new ATOM 0 HG22 VAL A 168 4.675 2.357 -8.508 1.00 0.00 H new ATOM 0 HG23 VAL A 168 5.121 4.073 -8.656 1.00 0.00 H new ATOM 314 N VAL A 169 5.434 3.803 -3.701 1.00 0.00 N ATOM 315 CA VAL A 169 5.875 4.536 -2.534 1.00 0.00 C ATOM 316 C VAL A 169 7.204 3.970 -2.048 1.00 0.00 C ATOM 317 O VAL A 169 7.398 2.756 -2.047 1.00 0.00 O ATOM 318 CB VAL A 169 4.807 4.455 -1.415 1.00 0.00 C ATOM 319 CG1 VAL A 169 4.482 3.007 -1.079 1.00 0.00 C ATOM 320 CG2 VAL A 169 5.250 5.210 -0.172 1.00 0.00 C ATOM 0 H VAL A 169 5.239 2.817 -3.525 1.00 0.00 H new ATOM 0 HA VAL A 169 6.013 5.584 -2.799 1.00 0.00 H new ATOM 0 HB VAL A 169 3.900 4.931 -1.788 1.00 0.00 H new ATOM 0 HG11 VAL A 169 3.730 2.976 -0.291 1.00 0.00 H new ATOM 0 HG12 VAL A 169 4.098 2.505 -1.967 1.00 0.00 H new ATOM 0 HG13 VAL A 169 5.385 2.501 -0.738 1.00 0.00 H new ATOM 0 HG21 VAL A 169 4.479 5.134 0.594 1.00 0.00 H new ATOM 0 HG22 VAL A 169 6.178 4.780 0.204 1.00 0.00 H new ATOM 0 HG23 VAL A 169 5.411 6.259 -0.421 1.00 0.00 H new ATOM 330 N PRO A 170 8.157 4.840 -1.680 1.00 0.00 N ATOM 331 CA PRO A 170 9.448 4.404 -1.162 1.00 0.00 C ATOM 332 C PRO A 170 9.296 3.591 0.112 1.00 0.00 C ATOM 333 O PRO A 170 8.518 3.950 1.002 1.00 0.00 O ATOM 334 CB PRO A 170 10.196 5.711 -0.884 1.00 0.00 C ATOM 335 CG PRO A 170 9.140 6.754 -0.811 1.00 0.00 C ATOM 336 CD PRO A 170 8.061 6.304 -1.743 1.00 0.00 C ATOM 0 HA PRO A 170 9.972 3.754 -1.863 1.00 0.00 H new ATOM 0 HB2 PRO A 170 10.758 5.653 0.048 1.00 0.00 H new ATOM 0 HB3 PRO A 170 10.913 5.931 -1.675 1.00 0.00 H new ATOM 0 HG2 PRO A 170 8.761 6.857 0.206 1.00 0.00 H new ATOM 0 HG3 PRO A 170 9.531 7.728 -1.106 1.00 0.00 H new ATOM 0 HD2 PRO A 170 7.080 6.658 -1.425 1.00 0.00 H new ATOM 0 HD3 PRO A 170 8.221 6.676 -2.755 1.00 0.00 H new ATOM 344 N ALA A 171 10.028 2.492 0.178 1.00 0.00 N ATOM 345 CA ALA A 171 10.006 1.609 1.328 1.00 0.00 C ATOM 346 C ALA A 171 10.733 2.255 2.497 1.00 0.00 C ATOM 347 O ALA A 171 11.890 1.946 2.785 1.00 0.00 O ATOM 348 CB ALA A 171 10.626 0.274 0.960 1.00 0.00 C ATOM 0 H ALA A 171 10.655 2.188 -0.567 1.00 0.00 H new ATOM 0 HA ALA A 171 8.975 1.433 1.633 1.00 0.00 H new ATOM 0 HB1 ALA A 171 10.608 -0.387 1.827 1.00 0.00 H new ATOM 0 HB2 ALA A 171 10.059 -0.179 0.146 1.00 0.00 H new ATOM 0 HB3 ALA A 171 11.657 0.427 0.642 1.00 0.00 H new ATOM 354 N ARG A 172 10.040 3.174 3.144 1.00 0.00 N ATOM 355 CA ARG A 172 10.595 3.954 4.231 1.00 0.00 C ATOM 356 C ARG A 172 10.833 3.100 5.469 1.00 0.00 C ATOM 357 O ARG A 172 9.884 2.648 6.113 1.00 0.00 O ATOM 358 CB ARG A 172 9.644 5.087 4.563 1.00 0.00 C ATOM 359 CG ARG A 172 9.482 6.090 3.443 1.00 0.00 C ATOM 360 CD ARG A 172 8.640 7.256 3.898 1.00 0.00 C ATOM 361 NE ARG A 172 8.411 8.226 2.831 1.00 0.00 N ATOM 362 CZ ARG A 172 7.359 9.040 2.779 1.00 0.00 C ATOM 363 NH1 ARG A 172 6.415 8.971 3.710 1.00 0.00 N ATOM 364 NH2 ARG A 172 7.245 9.914 1.788 1.00 0.00 N ATOM 0 H ARG A 172 9.069 3.401 2.927 1.00 0.00 H new ATOM 0 HA ARG A 172 11.559 4.351 3.913 1.00 0.00 H new ATOM 0 HB2 ARG A 172 8.668 4.670 4.810 1.00 0.00 H new ATOM 0 HB3 ARG A 172 10.004 5.604 5.453 1.00 0.00 H new ATOM 0 HG2 ARG A 172 10.461 6.444 3.120 1.00 0.00 H new ATOM 0 HG3 ARG A 172 9.016 5.611 2.582 1.00 0.00 H new ATOM 0 HD2 ARG A 172 7.681 6.888 4.263 1.00 0.00 H new ATOM 0 HD3 ARG A 172 9.131 7.751 4.736 1.00 0.00 H new ATOM 0 HE ARG A 172 9.099 8.283 2.080 1.00 0.00 H new ATOM 0 HH11 ARG A 172 6.495 8.293 4.468 1.00 0.00 H new ATOM 0 HH12 ARG A 172 5.610 9.596 3.667 1.00 0.00 H new ATOM 0 HH21 ARG A 172 7.963 9.962 1.066 1.00 0.00 H new ATOM 0 HH22 ARG A 172 6.439 10.538 1.748 1.00 0.00 H new ATOM 378 N CYS A 173 12.098 2.893 5.811 1.00 0.00 N ATOM 379 CA CYS A 173 12.441 2.122 6.993 1.00 0.00 C ATOM 380 C CYS A 173 12.232 2.970 8.244 1.00 0.00 C ATOM 381 O CYS A 173 12.960 3.938 8.485 1.00 0.00 O ATOM 382 CB CYS A 173 13.886 1.618 6.907 1.00 0.00 C ATOM 383 SG CYS A 173 15.104 2.898 6.515 1.00 0.00 S ATOM 0 H CYS A 173 12.899 3.248 5.288 1.00 0.00 H new ATOM 0 HA CYS A 173 11.787 1.252 7.050 1.00 0.00 H new ATOM 0 HB2 CYS A 173 14.154 1.158 7.858 1.00 0.00 H new ATOM 0 HB3 CYS A 173 13.941 0.837 6.148 1.00 0.00 H new ATOM 0 HG CYS A 173 14.831 3.977 7.186 1.00 0.00 H new ATOM 389 N GLY A 174 11.222 2.621 9.025 1.00 0.00 N ATOM 390 CA GLY A 174 10.897 3.399 10.201 1.00 0.00 C ATOM 391 C GLY A 174 9.605 4.164 10.022 1.00 0.00 C ATOM 392 O GLY A 174 9.252 5.014 10.842 1.00 0.00 O ATOM 0 H GLY A 174 10.621 1.812 8.865 1.00 0.00 H new ATOM 0 HA2 GLY A 174 10.813 2.738 11.064 1.00 0.00 H new ATOM 0 HA3 GLY A 174 11.707 4.097 10.412 1.00 0.00 H new ATOM 396 N VAL A 175 8.905 3.863 8.943 1.00 0.00 N ATOM 397 CA VAL A 175 7.630 4.492 8.647 1.00 0.00 C ATOM 398 C VAL A 175 6.543 3.430 8.552 1.00 0.00 C ATOM 399 O VAL A 175 6.759 2.353 7.990 1.00 0.00 O ATOM 400 CB VAL A 175 7.709 5.312 7.330 1.00 0.00 C ATOM 401 CG1 VAL A 175 6.511 5.068 6.432 1.00 0.00 C ATOM 402 CG2 VAL A 175 7.801 6.795 7.619 1.00 0.00 C ATOM 0 H VAL A 175 9.203 3.178 8.249 1.00 0.00 H new ATOM 0 HA VAL A 175 7.384 5.181 9.455 1.00 0.00 H new ATOM 0 HB VAL A 175 8.609 4.976 6.815 1.00 0.00 H new ATOM 0 HG11 VAL A 175 6.610 5.662 5.524 1.00 0.00 H new ATOM 0 HG12 VAL A 175 6.462 4.011 6.171 1.00 0.00 H new ATOM 0 HG13 VAL A 175 5.599 5.355 6.956 1.00 0.00 H new ATOM 0 HG21 VAL A 175 7.855 7.346 6.680 1.00 0.00 H new ATOM 0 HG22 VAL A 175 6.919 7.113 8.176 1.00 0.00 H new ATOM 0 HG23 VAL A 175 8.695 6.996 8.210 1.00 0.00 H new ATOM 412 N THR A 176 5.386 3.721 9.120 1.00 0.00 N ATOM 413 CA THR A 176 4.274 2.801 9.051 1.00 0.00 C ATOM 414 C THR A 176 3.575 2.894 7.707 1.00 0.00 C ATOM 415 O THR A 176 3.651 3.930 7.035 1.00 0.00 O ATOM 416 CB THR A 176 3.257 3.049 10.179 1.00 0.00 C ATOM 417 OG1 THR A 176 3.103 4.459 10.407 1.00 0.00 O ATOM 418 CG2 THR A 176 3.694 2.356 11.461 1.00 0.00 C ATOM 0 H THR A 176 5.196 4.583 9.631 1.00 0.00 H new ATOM 0 HA THR A 176 4.684 1.799 9.173 1.00 0.00 H new ATOM 0 HB THR A 176 2.297 2.633 9.873 1.00 0.00 H new ATOM 0 HG1 THR A 176 2.453 4.605 11.125 1.00 0.00 H new ATOM 0 HG21 THR A 176 2.960 2.545 12.245 1.00 0.00 H new ATOM 0 HG22 THR A 176 3.771 1.283 11.287 1.00 0.00 H new ATOM 0 HG23 THR A 176 4.664 2.743 11.771 1.00 0.00 H new ATOM 426 N VAL A 177 2.921 1.811 7.310 1.00 0.00 N ATOM 427 CA VAL A 177 2.126 1.795 6.091 1.00 0.00 C ATOM 428 C VAL A 177 1.240 3.029 6.041 1.00 0.00 C ATOM 429 O VAL A 177 1.111 3.664 5.004 1.00 0.00 O ATOM 430 CB VAL A 177 1.244 0.531 6.023 1.00 0.00 C ATOM 431 CG1 VAL A 177 0.395 0.516 4.767 1.00 0.00 C ATOM 432 CG2 VAL A 177 2.103 -0.715 6.096 1.00 0.00 C ATOM 0 H VAL A 177 2.926 0.927 7.819 1.00 0.00 H new ATOM 0 HA VAL A 177 2.807 1.791 5.240 1.00 0.00 H new ATOM 0 HB VAL A 177 0.570 0.546 6.880 1.00 0.00 H new ATOM 0 HG11 VAL A 177 -0.214 -0.388 4.750 1.00 0.00 H new ATOM 0 HG12 VAL A 177 -0.254 1.392 4.756 1.00 0.00 H new ATOM 0 HG13 VAL A 177 1.042 0.533 3.890 1.00 0.00 H new ATOM 0 HG21 VAL A 177 1.467 -1.599 6.047 1.00 0.00 H new ATOM 0 HG22 VAL A 177 2.802 -0.724 5.260 1.00 0.00 H new ATOM 0 HG23 VAL A 177 2.659 -0.719 7.034 1.00 0.00 H new ATOM 442 N ARG A 178 0.674 3.376 7.193 1.00 0.00 N ATOM 443 CA ARG A 178 -0.165 4.561 7.322 1.00 0.00 C ATOM 444 C ARG A 178 0.475 5.792 6.717 1.00 0.00 C ATOM 445 O ARG A 178 -0.139 6.456 5.906 1.00 0.00 O ATOM 446 CB ARG A 178 -0.489 4.859 8.784 1.00 0.00 C ATOM 447 CG ARG A 178 -1.457 3.895 9.416 1.00 0.00 C ATOM 448 CD ARG A 178 -1.873 4.349 10.805 1.00 0.00 C ATOM 449 NE ARG A 178 -2.659 3.330 11.498 1.00 0.00 N ATOM 450 CZ ARG A 178 -3.982 3.217 11.419 1.00 0.00 C ATOM 451 NH1 ARG A 178 -4.686 4.049 10.662 1.00 0.00 N ATOM 452 NH2 ARG A 178 -4.597 2.258 12.096 1.00 0.00 N ATOM 0 H ARG A 178 0.783 2.847 8.058 1.00 0.00 H new ATOM 0 HA ARG A 178 -1.080 4.333 6.776 1.00 0.00 H new ATOM 0 HB2 ARG A 178 0.438 4.852 9.357 1.00 0.00 H new ATOM 0 HB3 ARG A 178 -0.900 5.866 8.854 1.00 0.00 H new ATOM 0 HG2 ARG A 178 -2.340 3.799 8.784 1.00 0.00 H new ATOM 0 HG3 ARG A 178 -1.000 2.907 9.477 1.00 0.00 H new ATOM 0 HD2 ARG A 178 -0.985 4.584 11.392 1.00 0.00 H new ATOM 0 HD3 ARG A 178 -2.456 5.267 10.728 1.00 0.00 H new ATOM 0 HE ARG A 178 -2.159 2.660 12.082 1.00 0.00 H new ATOM 0 HH11 ARG A 178 -4.213 4.783 10.135 1.00 0.00 H new ATOM 0 HH12 ARG A 178 -5.700 3.955 10.608 1.00 0.00 H new ATOM 0 HH21 ARG A 178 -4.056 1.613 12.672 1.00 0.00 H new ATOM 0 HH22 ARG A 178 -5.611 2.165 12.041 1.00 0.00 H new ATOM 466 N ASP A 179 1.704 6.093 7.108 1.00 0.00 N ATOM 467 CA ASP A 179 2.340 7.351 6.699 1.00 0.00 C ATOM 468 C ASP A 179 2.761 7.309 5.237 1.00 0.00 C ATOM 469 O ASP A 179 2.517 8.248 4.476 1.00 0.00 O ATOM 470 CB ASP A 179 3.555 7.650 7.579 1.00 0.00 C ATOM 471 CG ASP A 179 4.154 9.016 7.300 1.00 0.00 C ATOM 472 OD1 ASP A 179 4.948 9.141 6.344 1.00 0.00 O ATOM 473 OD2 ASP A 179 3.836 9.973 8.043 1.00 0.00 O ATOM 0 H ASP A 179 2.281 5.496 7.701 1.00 0.00 H new ATOM 0 HA ASP A 179 1.605 8.146 6.822 1.00 0.00 H new ATOM 0 HB2 ASP A 179 3.263 7.593 8.628 1.00 0.00 H new ATOM 0 HB3 ASP A 179 4.314 6.884 7.417 1.00 0.00 H new ATOM 478 N SER A 180 3.377 6.210 4.851 1.00 0.00 N ATOM 479 CA SER A 180 3.879 6.050 3.493 1.00 0.00 C ATOM 480 C SER A 180 2.720 5.968 2.486 1.00 0.00 C ATOM 481 O SER A 180 2.742 6.608 1.426 1.00 0.00 O ATOM 482 CB SER A 180 4.790 4.814 3.441 1.00 0.00 C ATOM 483 OG SER A 180 6.120 5.177 3.103 1.00 0.00 O ATOM 0 H SER A 180 3.545 5.408 5.459 1.00 0.00 H new ATOM 0 HA SER A 180 4.468 6.922 3.209 1.00 0.00 H new ATOM 0 HB2 SER A 180 4.781 4.310 4.408 1.00 0.00 H new ATOM 0 HB3 SER A 180 4.405 4.105 2.708 1.00 0.00 H new ATOM 0 HG SER A 180 6.109 5.772 2.324 1.00 0.00 H new ATOM 489 N LEU A 181 1.689 5.218 2.843 1.00 0.00 N ATOM 490 CA LEU A 181 0.497 5.099 2.010 1.00 0.00 C ATOM 491 C LEU A 181 -0.361 6.346 2.143 1.00 0.00 C ATOM 492 O LEU A 181 -1.182 6.633 1.278 1.00 0.00 O ATOM 493 CB LEU A 181 -0.320 3.868 2.414 1.00 0.00 C ATOM 494 CG LEU A 181 0.140 2.519 1.845 1.00 0.00 C ATOM 495 CD1 LEU A 181 -0.624 2.196 0.574 1.00 0.00 C ATOM 496 CD2 LEU A 181 1.637 2.515 1.575 1.00 0.00 C ATOM 0 H LEU A 181 1.652 4.679 3.708 1.00 0.00 H new ATOM 0 HA LEU A 181 0.813 4.988 0.973 1.00 0.00 H new ATOM 0 HB2 LEU A 181 -0.315 3.798 3.502 1.00 0.00 H new ATOM 0 HB3 LEU A 181 -1.354 4.031 2.110 1.00 0.00 H new ATOM 0 HG LEU A 181 -0.069 1.751 2.590 1.00 0.00 H new ATOM 0 HD11 LEU A 181 -0.288 1.237 0.181 1.00 0.00 H new ATOM 0 HD12 LEU A 181 -1.690 2.144 0.794 1.00 0.00 H new ATOM 0 HD13 LEU A 181 -0.443 2.975 -0.167 1.00 0.00 H new ATOM 0 HD21 LEU A 181 1.932 1.546 1.173 1.00 0.00 H new ATOM 0 HD22 LEU A 181 1.879 3.296 0.854 1.00 0.00 H new ATOM 0 HD23 LEU A 181 2.175 2.701 2.505 1.00 0.00 H new ATOM 508 N LYS A 182 -0.171 7.084 3.235 1.00 0.00 N ATOM 509 CA LYS A 182 -0.882 8.344 3.426 1.00 0.00 C ATOM 510 C LYS A 182 -0.549 9.270 2.291 1.00 0.00 C ATOM 511 O LYS A 182 -1.433 9.844 1.684 1.00 0.00 O ATOM 512 CB LYS A 182 -0.526 9.029 4.747 1.00 0.00 C ATOM 513 CG LYS A 182 -1.734 9.310 5.624 1.00 0.00 C ATOM 514 CD LYS A 182 -1.346 9.977 6.932 1.00 0.00 C ATOM 515 CE LYS A 182 -0.793 8.963 7.913 1.00 0.00 C ATOM 516 NZ LYS A 182 -0.286 9.596 9.157 1.00 0.00 N ATOM 0 H LYS A 182 0.463 6.834 3.994 1.00 0.00 H new ATOM 0 HA LYS A 182 -1.948 8.117 3.452 1.00 0.00 H new ATOM 0 HB2 LYS A 182 0.175 8.401 5.297 1.00 0.00 H new ATOM 0 HB3 LYS A 182 -0.014 9.967 4.535 1.00 0.00 H new ATOM 0 HG2 LYS A 182 -2.433 9.950 5.084 1.00 0.00 H new ATOM 0 HG3 LYS A 182 -2.254 8.376 5.834 1.00 0.00 H new ATOM 0 HD2 LYS A 182 -0.601 10.750 6.744 1.00 0.00 H new ATOM 0 HD3 LYS A 182 -2.216 10.471 7.365 1.00 0.00 H new ATOM 0 HE2 LYS A 182 -1.572 8.244 8.166 1.00 0.00 H new ATOM 0 HE3 LYS A 182 0.014 8.405 7.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 182 0.081 8.862 9.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 182 0.476 10.263 8.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 182 -1.060 10.107 9.627 1.00 0.00 H new ATOM 530 N LYS A 183 0.737 9.393 1.995 1.00 0.00 N ATOM 531 CA LYS A 183 1.168 10.190 0.863 1.00 0.00 C ATOM 532 C LYS A 183 0.576 9.623 -0.423 1.00 0.00 C ATOM 533 O LYS A 183 0.036 10.363 -1.239 1.00 0.00 O ATOM 534 CB LYS A 183 2.698 10.231 0.773 1.00 0.00 C ATOM 535 CG LYS A 183 3.220 11.060 -0.394 1.00 0.00 C ATOM 536 CD LYS A 183 3.384 12.541 -0.052 1.00 0.00 C ATOM 537 CE LYS A 183 2.094 13.187 0.430 1.00 0.00 C ATOM 538 NZ LYS A 183 2.243 14.656 0.610 1.00 0.00 N ATOM 0 H LYS A 183 1.493 8.953 2.520 1.00 0.00 H new ATOM 0 HA LYS A 183 0.812 11.211 1.001 1.00 0.00 H new ATOM 0 HB2 LYS A 183 3.097 10.636 1.703 1.00 0.00 H new ATOM 0 HB3 LYS A 183 3.075 9.213 0.681 1.00 0.00 H new ATOM 0 HG2 LYS A 183 4.181 10.659 -0.715 1.00 0.00 H new ATOM 0 HG3 LYS A 183 2.536 10.962 -1.237 1.00 0.00 H new ATOM 0 HD2 LYS A 183 4.147 12.648 0.719 1.00 0.00 H new ATOM 0 HD3 LYS A 183 3.744 13.074 -0.932 1.00 0.00 H new ATOM 0 HE2 LYS A 183 1.298 12.988 -0.288 1.00 0.00 H new ATOM 0 HE3 LYS A 183 1.792 12.734 1.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 1.342 15.059 0.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 2.985 14.846 1.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 2.506 15.092 -0.297 1.00 0.00 H new ATOM 552 N ALA A 184 0.662 8.305 -0.577 1.00 0.00 N ATOM 553 CA ALA A 184 0.125 7.621 -1.755 1.00 0.00 C ATOM 554 C ALA A 184 -1.339 8.001 -2.023 1.00 0.00 C ATOM 555 O ALA A 184 -1.681 8.473 -3.107 1.00 0.00 O ATOM 556 CB ALA A 184 0.255 6.114 -1.574 1.00 0.00 C ATOM 0 H ALA A 184 1.101 7.684 0.102 1.00 0.00 H new ATOM 0 HA ALA A 184 0.705 7.939 -2.622 1.00 0.00 H new ATOM 0 HB1 ALA A 184 -0.145 5.606 -2.452 1.00 0.00 H new ATOM 0 HB2 ALA A 184 1.306 5.852 -1.451 1.00 0.00 H new ATOM 0 HB3 ALA A 184 -0.302 5.804 -0.690 1.00 0.00 H new ATOM 562 N LEU A 185 -2.190 7.802 -1.026 1.00 0.00 N ATOM 563 CA LEU A 185 -3.615 8.082 -1.139 1.00 0.00 C ATOM 564 C LEU A 185 -3.898 9.581 -1.149 1.00 0.00 C ATOM 565 O LEU A 185 -4.703 10.057 -1.942 1.00 0.00 O ATOM 566 CB LEU A 185 -4.367 7.421 0.021 1.00 0.00 C ATOM 567 CG LEU A 185 -4.391 5.893 -0.005 1.00 0.00 C ATOM 568 CD1 LEU A 185 -4.039 5.319 1.354 1.00 0.00 C ATOM 569 CD2 LEU A 185 -5.753 5.409 -0.431 1.00 0.00 C ATOM 0 H LEU A 185 -1.911 7.441 -0.114 1.00 0.00 H new ATOM 0 HA LEU A 185 -3.961 7.671 -2.087 1.00 0.00 H new ATOM 0 HB2 LEU A 185 -3.914 7.745 0.958 1.00 0.00 H new ATOM 0 HB3 LEU A 185 -5.395 7.785 0.021 1.00 0.00 H new ATOM 0 HG LEU A 185 -3.645 5.552 -0.722 1.00 0.00 H new ATOM 0 HD11 LEU A 185 -4.064 4.230 1.307 1.00 0.00 H new ATOM 0 HD12 LEU A 185 -3.040 5.647 1.640 1.00 0.00 H new ATOM 0 HD13 LEU A 185 -4.760 5.666 2.094 1.00 0.00 H new ATOM 0 HD21 LEU A 185 -5.763 4.319 -0.447 1.00 0.00 H new ATOM 0 HD22 LEU A 185 -6.503 5.768 0.273 1.00 0.00 H new ATOM 0 HD23 LEU A 185 -5.979 5.789 -1.427 1.00 0.00 H new ATOM 581 N MET A 186 -3.229 10.319 -0.277 1.00 0.00 N ATOM 582 CA MET A 186 -3.467 11.757 -0.141 1.00 0.00 C ATOM 583 C MET A 186 -3.055 12.529 -1.393 1.00 0.00 C ATOM 584 O MET A 186 -3.599 13.601 -1.670 1.00 0.00 O ATOM 585 CB MET A 186 -2.757 12.322 1.094 1.00 0.00 C ATOM 586 CG MET A 186 -3.670 12.448 2.299 1.00 0.00 C ATOM 587 SD MET A 186 -5.052 13.570 2.003 1.00 0.00 S ATOM 588 CE MET A 186 -5.966 13.386 3.530 1.00 0.00 C ATOM 0 H MET A 186 -2.515 9.950 0.351 1.00 0.00 H new ATOM 0 HA MET A 186 -4.542 11.887 -0.013 1.00 0.00 H new ATOM 0 HB2 MET A 186 -1.916 11.677 1.349 1.00 0.00 H new ATOM 0 HB3 MET A 186 -2.346 13.302 0.853 1.00 0.00 H new ATOM 0 HG2 MET A 186 -4.056 11.463 2.563 1.00 0.00 H new ATOM 0 HG3 MET A 186 -3.093 12.804 3.152 1.00 0.00 H new ATOM 0 HE1 MET A 186 -6.889 13.964 3.474 1.00 0.00 H new ATOM 0 HE2 MET A 186 -6.205 12.334 3.686 1.00 0.00 H new ATOM 0 HE3 MET A 186 -5.362 13.748 4.362 1.00 0.00 H new ATOM 598 N MET A 187 -2.104 11.995 -2.153 1.00 0.00 N ATOM 599 CA MET A 187 -1.743 12.590 -3.440 1.00 0.00 C ATOM 600 C MET A 187 -2.786 12.226 -4.484 1.00 0.00 C ATOM 601 O MET A 187 -2.923 12.890 -5.511 1.00 0.00 O ATOM 602 CB MET A 187 -0.369 12.110 -3.923 1.00 0.00 C ATOM 603 CG MET A 187 0.799 12.567 -3.065 1.00 0.00 C ATOM 604 SD MET A 187 2.399 12.103 -3.763 1.00 0.00 S ATOM 605 CE MET A 187 2.226 10.322 -3.889 1.00 0.00 C ATOM 0 H MET A 187 -1.573 11.160 -1.906 1.00 0.00 H new ATOM 0 HA MET A 187 -1.701 13.670 -3.302 1.00 0.00 H new ATOM 0 HB2 MET A 187 -0.372 11.021 -3.959 1.00 0.00 H new ATOM 0 HB3 MET A 187 -0.213 12.463 -4.943 1.00 0.00 H new ATOM 0 HG2 MET A 187 0.758 13.650 -2.949 1.00 0.00 H new ATOM 0 HG3 MET A 187 0.703 12.136 -2.068 1.00 0.00 H new ATOM 0 HE1 MET A 187 3.211 9.857 -3.850 1.00 0.00 H new ATOM 0 HE2 MET A 187 1.619 9.956 -3.061 1.00 0.00 H new ATOM 0 HE3 MET A 187 1.743 10.069 -4.833 1.00 0.00 H new ATOM 615 N ARG A 188 -3.529 11.169 -4.201 1.00 0.00 N ATOM 616 CA ARG A 188 -4.489 10.621 -5.137 1.00 0.00 C ATOM 617 C ARG A 188 -5.925 10.936 -4.719 1.00 0.00 C ATOM 618 O ARG A 188 -6.868 10.303 -5.191 1.00 0.00 O ATOM 619 CB ARG A 188 -4.268 9.111 -5.254 1.00 0.00 C ATOM 620 CG ARG A 188 -2.999 8.760 -6.010 1.00 0.00 C ATOM 621 CD ARG A 188 -3.208 7.582 -6.942 1.00 0.00 C ATOM 622 NE ARG A 188 -4.064 7.922 -8.078 1.00 0.00 N ATOM 623 CZ ARG A 188 -3.867 7.480 -9.321 1.00 0.00 C ATOM 624 NH1 ARG A 188 -2.805 6.734 -9.611 1.00 0.00 N ATOM 625 NH2 ARG A 188 -4.724 7.805 -10.279 1.00 0.00 N ATOM 0 H ARG A 188 -3.481 10.668 -3.314 1.00 0.00 H new ATOM 0 HA ARG A 188 -4.336 11.086 -6.111 1.00 0.00 H new ATOM 0 HB2 ARG A 188 -4.223 8.676 -4.255 1.00 0.00 H new ATOM 0 HB3 ARG A 188 -5.123 8.661 -5.759 1.00 0.00 H new ATOM 0 HG2 ARG A 188 -2.667 9.624 -6.585 1.00 0.00 H new ATOM 0 HG3 ARG A 188 -2.206 8.526 -5.300 1.00 0.00 H new ATOM 0 HD2 ARG A 188 -2.242 7.235 -7.308 1.00 0.00 H new ATOM 0 HD3 ARG A 188 -3.654 6.757 -6.387 1.00 0.00 H new ATOM 0 HE ARG A 188 -4.861 8.535 -7.909 1.00 0.00 H new ATOM 0 HH11 ARG A 188 -2.134 6.496 -8.880 1.00 0.00 H new ATOM 0 HH12 ARG A 188 -2.661 6.400 -10.564 1.00 0.00 H new ATOM 0 HH21 ARG A 188 -5.531 8.391 -10.064 1.00 0.00 H new ATOM 0 HH22 ARG A 188 -4.577 7.469 -11.231 1.00 0.00 H new ATOM 639 N GLY A 189 -6.078 11.919 -3.835 1.00 0.00 N ATOM 640 CA GLY A 189 -7.399 12.335 -3.389 1.00 0.00 C ATOM 641 C GLY A 189 -8.144 11.233 -2.660 1.00 0.00 C ATOM 642 O GLY A 189 -9.367 11.117 -2.768 1.00 0.00 O ATOM 0 H GLY A 189 -5.306 12.438 -3.417 1.00 0.00 H new ATOM 0 HA2 GLY A 189 -7.301 13.198 -2.731 1.00 0.00 H new ATOM 0 HA3 GLY A 189 -7.985 12.656 -4.251 1.00 0.00 H new ATOM 646 N LEU A 190 -7.405 10.435 -1.914 1.00 0.00 N ATOM 647 CA LEU A 190 -7.955 9.290 -1.216 1.00 0.00 C ATOM 648 C LEU A 190 -7.556 9.329 0.252 1.00 0.00 C ATOM 649 O LEU A 190 -6.716 10.138 0.649 1.00 0.00 O ATOM 650 CB LEU A 190 -7.435 8.015 -1.872 1.00 0.00 C ATOM 651 CG LEU A 190 -7.989 7.735 -3.268 1.00 0.00 C ATOM 652 CD1 LEU A 190 -7.045 6.844 -4.045 1.00 0.00 C ATOM 653 CD2 LEU A 190 -9.370 7.104 -3.182 1.00 0.00 C ATOM 0 H LEU A 190 -6.403 10.563 -1.775 1.00 0.00 H new ATOM 0 HA LEU A 190 -9.043 9.313 -1.275 1.00 0.00 H new ATOM 0 HB2 LEU A 190 -6.348 8.073 -1.934 1.00 0.00 H new ATOM 0 HB3 LEU A 190 -7.673 7.169 -1.227 1.00 0.00 H new ATOM 0 HG LEU A 190 -8.080 8.684 -3.796 1.00 0.00 H new ATOM 0 HD11 LEU A 190 -7.456 6.655 -5.037 1.00 0.00 H new ATOM 0 HD12 LEU A 190 -6.077 7.336 -4.141 1.00 0.00 H new ATOM 0 HD13 LEU A 190 -6.921 5.898 -3.518 1.00 0.00 H new ATOM 0 HD21 LEU A 190 -9.746 6.913 -4.187 1.00 0.00 H new ATOM 0 HD22 LEU A 190 -9.307 6.164 -2.633 1.00 0.00 H new ATOM 0 HD23 LEU A 190 -10.048 7.782 -2.664 1.00 0.00 H new ATOM 665 N ILE A 191 -8.162 8.469 1.057 1.00 0.00 N ATOM 666 CA ILE A 191 -7.839 8.405 2.474 1.00 0.00 C ATOM 667 C ILE A 191 -7.601 6.968 2.930 1.00 0.00 C ATOM 668 O ILE A 191 -8.359 6.058 2.587 1.00 0.00 O ATOM 669 CB ILE A 191 -8.937 9.042 3.358 1.00 0.00 C ATOM 670 CG1 ILE A 191 -10.289 8.350 3.149 1.00 0.00 C ATOM 671 CG2 ILE A 191 -9.045 10.528 3.064 1.00 0.00 C ATOM 672 CD1 ILE A 191 -11.352 8.785 4.135 1.00 0.00 C ATOM 0 H ILE A 191 -8.878 7.808 0.754 1.00 0.00 H new ATOM 0 HA ILE A 191 -6.921 8.980 2.597 1.00 0.00 H new ATOM 0 HB ILE A 191 -8.655 8.908 4.402 1.00 0.00 H new ATOM 0 HG12 ILE A 191 -10.639 8.553 2.137 1.00 0.00 H new ATOM 0 HG13 ILE A 191 -10.152 7.272 3.228 1.00 0.00 H new ATOM 0 HG21 ILE A 191 -9.821 10.968 3.691 1.00 0.00 H new ATOM 0 HG22 ILE A 191 -8.091 11.011 3.275 1.00 0.00 H new ATOM 0 HG23 ILE A 191 -9.301 10.674 2.015 1.00 0.00 H new ATOM 0 HD11 ILE A 191 -12.281 8.254 3.926 1.00 0.00 H new ATOM 0 HD12 ILE A 191 -11.023 8.556 5.149 1.00 0.00 H new ATOM 0 HD13 ILE A 191 -11.518 9.858 4.041 1.00 0.00 H new ATOM 684 N PRO A 192 -6.532 6.751 3.721 1.00 0.00 N ATOM 685 CA PRO A 192 -6.157 5.419 4.216 1.00 0.00 C ATOM 686 C PRO A 192 -7.178 4.847 5.193 1.00 0.00 C ATOM 687 O PRO A 192 -7.260 3.634 5.382 1.00 0.00 O ATOM 688 CB PRO A 192 -4.824 5.653 4.942 1.00 0.00 C ATOM 689 CG PRO A 192 -4.357 6.995 4.495 1.00 0.00 C ATOM 690 CD PRO A 192 -5.591 7.784 4.183 1.00 0.00 C ATOM 0 HA PRO A 192 -6.097 4.700 3.399 1.00 0.00 H new ATOM 0 HB2 PRO A 192 -4.956 5.624 6.024 1.00 0.00 H new ATOM 0 HB3 PRO A 192 -4.098 4.880 4.688 1.00 0.00 H new ATOM 0 HG2 PRO A 192 -3.770 7.482 5.274 1.00 0.00 H new ATOM 0 HG3 PRO A 192 -3.716 6.912 3.617 1.00 0.00 H new ATOM 0 HD2 PRO A 192 -5.967 8.310 5.060 1.00 0.00 H new ATOM 0 HD3 PRO A 192 -5.407 8.536 3.415 1.00 0.00 H new ATOM 698 N GLU A 193 -7.960 5.727 5.802 1.00 0.00 N ATOM 699 CA GLU A 193 -8.929 5.325 6.813 1.00 0.00 C ATOM 700 C GLU A 193 -10.096 4.565 6.196 1.00 0.00 C ATOM 701 O GLU A 193 -10.801 3.830 6.883 1.00 0.00 O ATOM 702 CB GLU A 193 -9.434 6.546 7.572 1.00 0.00 C ATOM 703 CG GLU A 193 -8.333 7.267 8.327 1.00 0.00 C ATOM 704 CD GLU A 193 -7.597 6.359 9.292 1.00 0.00 C ATOM 705 OE1 GLU A 193 -6.707 5.605 8.850 1.00 0.00 O ATOM 706 OE2 GLU A 193 -7.903 6.393 10.503 1.00 0.00 O ATOM 0 H GLU A 193 -7.942 6.729 5.613 1.00 0.00 H new ATOM 0 HA GLU A 193 -8.427 4.654 7.510 1.00 0.00 H new ATOM 0 HB2 GLU A 193 -9.899 7.238 6.870 1.00 0.00 H new ATOM 0 HB3 GLU A 193 -10.208 6.237 8.275 1.00 0.00 H new ATOM 0 HG2 GLU A 193 -7.623 7.686 7.614 1.00 0.00 H new ATOM 0 HG3 GLU A 193 -8.763 8.104 8.877 1.00 0.00 H new ATOM 713 N CYS A 194 -10.286 4.731 4.899 1.00 0.00 N ATOM 714 CA CYS A 194 -11.360 4.050 4.195 1.00 0.00 C ATOM 715 C CYS A 194 -10.765 3.023 3.236 1.00 0.00 C ATOM 716 O CYS A 194 -11.375 2.657 2.233 1.00 0.00 O ATOM 717 CB CYS A 194 -12.217 5.071 3.437 1.00 0.00 C ATOM 718 SG CYS A 194 -13.814 4.446 2.856 1.00 0.00 S ATOM 0 H CYS A 194 -9.710 5.333 4.310 1.00 0.00 H new ATOM 0 HA CYS A 194 -11.999 3.533 4.911 1.00 0.00 H new ATOM 0 HB2 CYS A 194 -12.394 5.928 4.086 1.00 0.00 H new ATOM 0 HB3 CYS A 194 -11.651 5.432 2.579 1.00 0.00 H new ATOM 0 HG CYS A 194 -14.004 3.245 3.317 1.00 0.00 H new ATOM 724 N CYS A 195 -9.570 2.554 3.566 1.00 0.00 N ATOM 725 CA CYS A 195 -8.835 1.646 2.699 1.00 0.00 C ATOM 726 C CYS A 195 -8.120 0.567 3.512 1.00 0.00 C ATOM 727 O CYS A 195 -8.014 0.665 4.737 1.00 0.00 O ATOM 728 CB CYS A 195 -7.820 2.436 1.874 1.00 0.00 C ATOM 729 SG CYS A 195 -8.556 3.676 0.779 1.00 0.00 S ATOM 0 H CYS A 195 -9.087 2.789 4.433 1.00 0.00 H new ATOM 0 HA CYS A 195 -9.544 1.154 2.034 1.00 0.00 H new ATOM 0 HB2 CYS A 195 -7.126 2.933 2.552 1.00 0.00 H new ATOM 0 HB3 CYS A 195 -7.235 1.739 1.274 1.00 0.00 H new ATOM 0 HG CYS A 195 -8.499 4.844 1.346 1.00 0.00 H new ATOM 735 N ALA A 196 -7.649 -0.465 2.824 1.00 0.00 N ATOM 736 CA ALA A 196 -6.866 -1.526 3.452 1.00 0.00 C ATOM 737 C ALA A 196 -5.826 -2.059 2.474 1.00 0.00 C ATOM 738 O ALA A 196 -6.013 -1.966 1.265 1.00 0.00 O ATOM 739 CB ALA A 196 -7.774 -2.649 3.924 1.00 0.00 C ATOM 0 H ALA A 196 -7.796 -0.592 1.823 1.00 0.00 H new ATOM 0 HA ALA A 196 -6.352 -1.113 4.320 1.00 0.00 H new ATOM 0 HB1 ALA A 196 -7.174 -3.431 4.389 1.00 0.00 H new ATOM 0 HB2 ALA A 196 -8.488 -2.259 4.650 1.00 0.00 H new ATOM 0 HB3 ALA A 196 -8.313 -3.064 3.072 1.00 0.00 H new ATOM 745 N VAL A 197 -4.738 -2.611 2.998 1.00 0.00 N ATOM 746 CA VAL A 197 -3.638 -3.084 2.162 1.00 0.00 C ATOM 747 C VAL A 197 -3.578 -4.611 2.158 1.00 0.00 C ATOM 748 O VAL A 197 -3.635 -5.242 3.211 1.00 0.00 O ATOM 749 CB VAL A 197 -2.283 -2.519 2.650 1.00 0.00 C ATOM 750 CG1 VAL A 197 -1.186 -2.788 1.637 1.00 0.00 C ATOM 751 CG2 VAL A 197 -2.402 -1.029 2.931 1.00 0.00 C ATOM 0 H VAL A 197 -4.593 -2.743 3.999 1.00 0.00 H new ATOM 0 HA VAL A 197 -3.823 -2.729 1.148 1.00 0.00 H new ATOM 0 HB VAL A 197 -2.015 -3.026 3.577 1.00 0.00 H new ATOM 0 HG11 VAL A 197 -0.244 -2.381 2.004 1.00 0.00 H new ATOM 0 HG12 VAL A 197 -1.083 -3.863 1.489 1.00 0.00 H new ATOM 0 HG13 VAL A 197 -1.442 -2.314 0.689 1.00 0.00 H new ATOM 0 HG21 VAL A 197 -1.441 -0.645 3.274 1.00 0.00 H new ATOM 0 HG22 VAL A 197 -2.696 -0.509 2.019 1.00 0.00 H new ATOM 0 HG23 VAL A 197 -3.154 -0.863 3.702 1.00 0.00 H new ATOM 761 N TYR A 198 -3.494 -5.198 0.968 1.00 0.00 N ATOM 762 CA TYR A 198 -3.391 -6.648 0.821 1.00 0.00 C ATOM 763 C TYR A 198 -2.252 -7.017 -0.132 1.00 0.00 C ATOM 764 O TYR A 198 -1.900 -6.239 -1.021 1.00 0.00 O ATOM 765 CB TYR A 198 -4.679 -7.237 0.240 1.00 0.00 C ATOM 766 CG TYR A 198 -5.922 -7.060 1.076 1.00 0.00 C ATOM 767 CD1 TYR A 198 -6.460 -8.135 1.758 1.00 0.00 C ATOM 768 CD2 TYR A 198 -6.573 -5.837 1.158 1.00 0.00 C ATOM 769 CE1 TYR A 198 -7.613 -8.005 2.501 1.00 0.00 C ATOM 770 CE2 TYR A 198 -7.724 -5.694 1.906 1.00 0.00 C ATOM 771 CZ TYR A 198 -8.242 -6.781 2.575 1.00 0.00 C ATOM 772 OH TYR A 198 -9.399 -6.646 3.306 1.00 0.00 O ATOM 0 H TYR A 198 -3.495 -4.688 0.085 1.00 0.00 H new ATOM 0 HA TYR A 198 -3.206 -7.053 1.816 1.00 0.00 H new ATOM 0 HB2 TYR A 198 -4.854 -6.785 -0.736 1.00 0.00 H new ATOM 0 HB3 TYR A 198 -4.525 -8.303 0.074 1.00 0.00 H new ATOM 0 HD1 TYR A 198 -5.967 -9.095 1.708 1.00 0.00 H new ATOM 0 HD2 TYR A 198 -6.173 -4.985 0.629 1.00 0.00 H new ATOM 0 HE1 TYR A 198 -8.022 -8.858 3.023 1.00 0.00 H new ATOM 0 HE2 TYR A 198 -8.216 -4.735 1.967 1.00 0.00 H new ATOM 0 HH TYR A 198 -9.712 -5.719 3.255 1.00 0.00 H new ATOM 782 N ARG A 199 -1.689 -8.204 0.056 1.00 0.00 N ATOM 783 CA ARG A 199 -0.773 -8.795 -0.919 1.00 0.00 C ATOM 784 C ARG A 199 -1.403 -10.046 -1.499 1.00 0.00 C ATOM 785 O ARG A 199 -1.579 -11.035 -0.794 1.00 0.00 O ATOM 786 CB ARG A 199 0.564 -9.146 -0.274 1.00 0.00 C ATOM 787 CG ARG A 199 1.319 -7.927 0.156 1.00 0.00 C ATOM 788 CD ARG A 199 2.507 -8.244 1.058 1.00 0.00 C ATOM 789 NE ARG A 199 3.513 -9.072 0.392 1.00 0.00 N ATOM 790 CZ ARG A 199 4.294 -9.950 1.024 1.00 0.00 C ATOM 791 NH1 ARG A 199 4.164 -10.143 2.332 1.00 0.00 N ATOM 792 NH2 ARG A 199 5.210 -10.626 0.344 1.00 0.00 N ATOM 0 H ARG A 199 -1.851 -8.782 0.881 1.00 0.00 H new ATOM 0 HA ARG A 199 -0.588 -8.067 -1.709 1.00 0.00 H new ATOM 0 HB2 ARG A 199 0.392 -9.789 0.589 1.00 0.00 H new ATOM 0 HB3 ARG A 199 1.168 -9.716 -0.980 1.00 0.00 H new ATOM 0 HG2 ARG A 199 1.673 -7.396 -0.728 1.00 0.00 H new ATOM 0 HG3 ARG A 199 0.641 -7.254 0.681 1.00 0.00 H new ATOM 0 HD2 ARG A 199 2.968 -7.312 1.387 1.00 0.00 H new ATOM 0 HD3 ARG A 199 2.153 -8.757 1.952 1.00 0.00 H new ATOM 0 HE ARG A 199 3.624 -8.972 -0.617 1.00 0.00 H new ATOM 0 HH11 ARG A 199 3.465 -9.619 2.858 1.00 0.00 H new ATOM 0 HH12 ARG A 199 4.764 -10.815 2.810 1.00 0.00 H new ATOM 0 HH21 ARG A 199 5.316 -10.474 -0.659 1.00 0.00 H new ATOM 0 HH22 ARG A 199 5.809 -11.298 0.824 1.00 0.00 H new ATOM 876 N LYS A 205 -5.268 -13.267 -0.504 1.00 0.00 N ATOM 877 CA LYS A 205 -5.008 -11.887 -0.147 1.00 0.00 C ATOM 878 C LYS A 205 -4.397 -11.822 1.248 1.00 0.00 C ATOM 879 O LYS A 205 -4.964 -12.372 2.190 1.00 0.00 O ATOM 880 CB LYS A 205 -6.322 -11.103 -0.172 1.00 0.00 C ATOM 881 CG LYS A 205 -7.204 -11.412 -1.367 1.00 0.00 C ATOM 882 CD LYS A 205 -8.535 -10.678 -1.301 1.00 0.00 C ATOM 883 CE LYS A 205 -8.384 -9.182 -1.540 1.00 0.00 C ATOM 884 NZ LYS A 205 -9.701 -8.489 -1.554 1.00 0.00 N ATOM 0 HA LYS A 205 -4.310 -11.452 -0.862 1.00 0.00 H new ATOM 0 HB2 LYS A 205 -6.878 -11.316 0.741 1.00 0.00 H new ATOM 0 HB3 LYS A 205 -6.097 -10.037 -0.166 1.00 0.00 H new ATOM 0 HG2 LYS A 205 -6.683 -11.135 -2.283 1.00 0.00 H new ATOM 0 HG3 LYS A 205 -7.385 -12.486 -1.416 1.00 0.00 H new ATOM 0 HD2 LYS A 205 -9.214 -11.095 -2.044 1.00 0.00 H new ATOM 0 HD3 LYS A 205 -8.990 -10.843 -0.324 1.00 0.00 H new ATOM 0 HE2 LYS A 205 -7.755 -8.751 -0.761 1.00 0.00 H new ATOM 0 HE3 LYS A 205 -7.875 -9.015 -2.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 205 -9.557 -7.472 -1.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 205 -10.292 -8.883 -2.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 205 -10.176 -8.627 -0.639 1.00 0.00 H new ATOM 898 N LYS A 206 -3.249 -11.164 1.395 1.00 0.00 N ATOM 899 CA LYS A 206 -2.634 -11.032 2.695 1.00 0.00 C ATOM 900 C LYS A 206 -2.916 -9.643 3.237 1.00 0.00 C ATOM 901 O LYS A 206 -2.277 -8.682 2.818 1.00 0.00 O ATOM 902 CB LYS A 206 -1.126 -11.249 2.593 1.00 0.00 C ATOM 903 CG LYS A 206 -0.722 -12.537 1.889 1.00 0.00 C ATOM 904 CD LYS A 206 -1.223 -13.773 2.619 1.00 0.00 C ATOM 905 CE LYS A 206 -0.833 -15.040 1.876 1.00 0.00 C ATOM 906 NZ LYS A 206 -1.353 -16.265 2.536 1.00 0.00 N ATOM 0 H LYS A 206 -2.737 -10.721 0.632 1.00 0.00 H new ATOM 0 HA LYS A 206 -3.048 -11.784 3.367 1.00 0.00 H new ATOM 0 HB2 LYS A 206 -0.685 -10.405 2.062 1.00 0.00 H new ATOM 0 HB3 LYS A 206 -0.703 -11.250 3.597 1.00 0.00 H new ATOM 0 HG2 LYS A 206 -1.116 -12.533 0.873 1.00 0.00 H new ATOM 0 HG3 LYS A 206 0.364 -12.580 1.809 1.00 0.00 H new ATOM 0 HD2 LYS A 206 -0.810 -13.797 3.627 1.00 0.00 H new ATOM 0 HD3 LYS A 206 -2.307 -13.726 2.720 1.00 0.00 H new ATOM 0 HE2 LYS A 206 -1.213 -14.991 0.855 1.00 0.00 H new ATOM 0 HE3 LYS A 206 0.253 -15.099 1.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 206 -1.061 -17.102 1.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 206 -0.971 -16.328 3.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 206 -2.391 -16.223 2.577 1.00 0.00 H new ATOM 920 N PRO A 207 -3.895 -9.504 4.141 1.00 0.00 N ATOM 921 CA PRO A 207 -4.243 -8.211 4.701 1.00 0.00 C ATOM 922 C PRO A 207 -3.170 -7.714 5.647 1.00 0.00 C ATOM 923 O PRO A 207 -2.751 -8.417 6.572 1.00 0.00 O ATOM 924 CB PRO A 207 -5.560 -8.446 5.439 1.00 0.00 C ATOM 925 CG PRO A 207 -5.973 -9.842 5.110 1.00 0.00 C ATOM 926 CD PRO A 207 -4.729 -10.573 4.695 1.00 0.00 C ATOM 0 HA PRO A 207 -4.335 -7.446 3.930 1.00 0.00 H new ATOM 0 HB2 PRO A 207 -5.433 -8.320 6.514 1.00 0.00 H new ATOM 0 HB3 PRO A 207 -6.318 -7.730 5.122 1.00 0.00 H new ATOM 0 HG2 PRO A 207 -6.435 -10.323 5.973 1.00 0.00 H new ATOM 0 HG3 PRO A 207 -6.711 -9.848 4.308 1.00 0.00 H new ATOM 0 HD2 PRO A 207 -4.248 -11.065 5.540 1.00 0.00 H new ATOM 0 HD3 PRO A 207 -4.941 -11.345 3.955 1.00 0.00 H new ATOM 934 N ILE A 208 -2.721 -6.511 5.385 1.00 0.00 N ATOM 935 CA ILE A 208 -1.609 -5.928 6.094 1.00 0.00 C ATOM 936 C ILE A 208 -2.084 -4.832 7.034 1.00 0.00 C ATOM 937 O ILE A 208 -3.088 -4.166 6.773 1.00 0.00 O ATOM 938 CB ILE A 208 -0.606 -5.357 5.084 1.00 0.00 C ATOM 939 CG1 ILE A 208 -0.133 -6.474 4.161 1.00 0.00 C ATOM 940 CG2 ILE A 208 0.571 -4.713 5.789 1.00 0.00 C ATOM 941 CD1 ILE A 208 -0.144 -6.099 2.703 1.00 0.00 C ATOM 0 H ILE A 208 -3.120 -5.905 4.668 1.00 0.00 H new ATOM 0 HA ILE A 208 -1.126 -6.702 6.691 1.00 0.00 H new ATOM 0 HB ILE A 208 -1.098 -4.583 4.495 1.00 0.00 H new ATOM 0 HG12 ILE A 208 0.879 -6.764 4.445 1.00 0.00 H new ATOM 0 HG13 ILE A 208 -0.768 -7.348 4.307 1.00 0.00 H new ATOM 0 HG21 ILE A 208 1.266 -4.317 5.049 1.00 0.00 H new ATOM 0 HG22 ILE A 208 0.215 -3.901 6.424 1.00 0.00 H new ATOM 0 HG23 ILE A 208 1.079 -5.457 6.402 1.00 0.00 H new ATOM 0 HD11 ILE A 208 0.205 -6.943 2.108 1.00 0.00 H new ATOM 0 HD12 ILE A 208 -1.159 -5.837 2.402 1.00 0.00 H new ATOM 0 HD13 ILE A 208 0.514 -5.245 2.542 1.00 0.00 H new ATOM 953 N GLY A 209 -1.362 -4.660 8.127 1.00 0.00 N ATOM 954 CA GLY A 209 -1.729 -3.672 9.109 1.00 0.00 C ATOM 955 C GLY A 209 -1.192 -2.310 8.748 1.00 0.00 C ATOM 956 O GLY A 209 -0.039 -2.181 8.346 1.00 0.00 O ATOM 0 H GLY A 209 -0.522 -5.193 8.351 1.00 0.00 H new ATOM 0 HA2 GLY A 209 -2.815 -3.626 9.193 1.00 0.00 H new ATOM 0 HA3 GLY A 209 -1.346 -3.968 10.086 1.00 0.00 H new ATOM 960 N TRP A 210 -2.023 -1.295 8.892 1.00 0.00 N ATOM 961 CA TRP A 210 -1.624 0.064 8.571 1.00 0.00 C ATOM 962 C TRP A 210 -0.515 0.543 9.508 1.00 0.00 C ATOM 963 O TRP A 210 0.307 1.378 9.133 1.00 0.00 O ATOM 964 CB TRP A 210 -2.832 0.999 8.633 1.00 0.00 C ATOM 965 CG TRP A 210 -3.762 0.842 7.475 1.00 0.00 C ATOM 966 CD1 TRP A 210 -4.909 0.107 7.433 1.00 0.00 C ATOM 967 CD2 TRP A 210 -3.616 1.437 6.185 1.00 0.00 C ATOM 968 NE1 TRP A 210 -5.487 0.212 6.193 1.00 0.00 N ATOM 969 CE2 TRP A 210 -4.710 1.023 5.406 1.00 0.00 C ATOM 970 CE3 TRP A 210 -2.665 2.281 5.616 1.00 0.00 C ATOM 971 CZ2 TRP A 210 -4.876 1.425 4.080 1.00 0.00 C ATOM 972 CZ3 TRP A 210 -2.830 2.680 4.302 1.00 0.00 C ATOM 973 CH2 TRP A 210 -3.928 2.251 3.547 1.00 0.00 C ATOM 0 H TRP A 210 -2.981 -1.385 9.230 1.00 0.00 H new ATOM 0 HA TRP A 210 -1.230 0.077 7.555 1.00 0.00 H new ATOM 0 HB2 TRP A 210 -3.379 0.813 9.557 1.00 0.00 H new ATOM 0 HB3 TRP A 210 -2.482 2.031 8.672 1.00 0.00 H new ATOM 0 HD1 TRP A 210 -5.304 -0.472 8.254 1.00 0.00 H new ATOM 0 HE1 TRP A 210 -6.354 -0.240 5.903 1.00 0.00 H new ATOM 0 HE3 TRP A 210 -1.815 2.618 6.190 1.00 0.00 H new ATOM 0 HZ2 TRP A 210 -5.723 1.095 3.497 1.00 0.00 H new ATOM 0 HZ3 TRP A 210 -2.099 3.334 3.850 1.00 0.00 H new ATOM 0 HH2 TRP A 210 -4.027 2.580 2.523 1.00 0.00 H new ATOM 984 N ASP A 211 -0.480 -0.001 10.720 1.00 0.00 N ATOM 985 CA ASP A 211 0.574 0.347 11.670 1.00 0.00 C ATOM 986 C ASP A 211 1.763 -0.592 11.542 1.00 0.00 C ATOM 987 O ASP A 211 2.640 -0.621 12.406 1.00 0.00 O ATOM 988 CB ASP A 211 0.072 0.333 13.111 1.00 0.00 C ATOM 989 CG ASP A 211 -0.899 1.454 13.404 1.00 0.00 C ATOM 990 OD1 ASP A 211 -0.444 2.561 13.758 1.00 0.00 O ATOM 991 OD2 ASP A 211 -2.123 1.245 13.279 1.00 0.00 O ATOM 0 H ASP A 211 -1.160 -0.677 11.066 1.00 0.00 H new ATOM 0 HA ASP A 211 0.889 1.361 11.424 1.00 0.00 H new ATOM 0 HB2 ASP A 211 -0.412 -0.623 13.313 1.00 0.00 H new ATOM 0 HB3 ASP A 211 0.923 0.409 13.788 1.00 0.00 H new ATOM 996 N THR A 212 1.784 -1.364 10.474 1.00 0.00 N ATOM 997 CA THR A 212 2.940 -2.179 10.159 1.00 0.00 C ATOM 998 C THR A 212 3.928 -1.331 9.367 1.00 0.00 C ATOM 999 O THR A 212 3.533 -0.356 8.733 1.00 0.00 O ATOM 1000 CB THR A 212 2.528 -3.422 9.344 1.00 0.00 C ATOM 1001 OG1 THR A 212 1.514 -4.146 10.055 1.00 0.00 O ATOM 1002 CG2 THR A 212 3.720 -4.333 9.086 1.00 0.00 C ATOM 0 H THR A 212 1.014 -1.444 9.810 1.00 0.00 H new ATOM 0 HA THR A 212 3.403 -2.527 11.082 1.00 0.00 H new ATOM 0 HB THR A 212 2.141 -3.087 8.381 1.00 0.00 H new ATOM 0 HG1 THR A 212 1.251 -4.935 9.536 1.00 0.00 H new ATOM 0 HG21 THR A 212 3.397 -5.200 8.510 1.00 0.00 H new ATOM 0 HG22 THR A 212 4.480 -3.788 8.527 1.00 0.00 H new ATOM 0 HG23 THR A 212 4.137 -4.664 10.037 1.00 0.00 H new ATOM 1010 N ASP A 213 5.203 -1.668 9.429 1.00 0.00 N ATOM 1011 CA ASP A 213 6.209 -0.920 8.692 1.00 0.00 C ATOM 1012 C ASP A 213 6.189 -1.337 7.225 1.00 0.00 C ATOM 1013 O ASP A 213 6.194 -2.527 6.910 1.00 0.00 O ATOM 1014 CB ASP A 213 7.599 -1.170 9.281 1.00 0.00 C ATOM 1015 CG ASP A 213 8.612 -0.125 8.854 1.00 0.00 C ATOM 1016 OD1 ASP A 213 9.174 0.561 9.737 1.00 0.00 O ATOM 1017 OD2 ASP A 213 8.859 0.012 7.644 1.00 0.00 O ATOM 0 H ASP A 213 5.566 -2.448 9.977 1.00 0.00 H new ATOM 0 HA ASP A 213 5.982 0.143 8.770 1.00 0.00 H new ATOM 0 HB2 ASP A 213 7.531 -1.182 10.369 1.00 0.00 H new ATOM 0 HB3 ASP A 213 7.948 -2.156 8.973 1.00 0.00 H new ATOM 1022 N ILE A 214 6.179 -0.353 6.334 1.00 0.00 N ATOM 1023 CA ILE A 214 6.117 -0.611 4.896 1.00 0.00 C ATOM 1024 C ILE A 214 7.432 -1.216 4.389 1.00 0.00 C ATOM 1025 O ILE A 214 7.496 -1.759 3.287 1.00 0.00 O ATOM 1026 CB ILE A 214 5.718 0.671 4.098 1.00 0.00 C ATOM 1027 CG1 ILE A 214 6.164 0.609 2.624 1.00 0.00 C ATOM 1028 CG2 ILE A 214 6.233 1.933 4.771 1.00 0.00 C ATOM 1029 CD1 ILE A 214 6.040 1.928 1.897 1.00 0.00 C ATOM 0 H ILE A 214 6.213 0.636 6.581 1.00 0.00 H new ATOM 0 HA ILE A 214 5.331 -1.346 4.723 1.00 0.00 H new ATOM 0 HB ILE A 214 4.629 0.709 4.101 1.00 0.00 H new ATOM 0 HG12 ILE A 214 7.201 0.276 2.581 1.00 0.00 H new ATOM 0 HG13 ILE A 214 5.567 -0.140 2.104 1.00 0.00 H new ATOM 0 HG21 ILE A 214 5.936 2.804 4.187 1.00 0.00 H new ATOM 0 HG22 ILE A 214 5.813 2.008 5.774 1.00 0.00 H new ATOM 0 HG23 ILE A 214 7.320 1.893 4.835 1.00 0.00 H new ATOM 0 HD11 ILE A 214 6.372 1.808 0.866 1.00 0.00 H new ATOM 0 HD12 ILE A 214 5.000 2.253 1.908 1.00 0.00 H new ATOM 0 HD13 ILE A 214 6.659 2.676 2.392 1.00 0.00 H new ATOM 1041 N SER A 215 8.466 -1.183 5.222 1.00 0.00 N ATOM 1042 CA SER A 215 9.722 -1.844 4.891 1.00 0.00 C ATOM 1043 C SER A 215 9.529 -3.362 4.845 1.00 0.00 C ATOM 1044 O SER A 215 10.337 -4.086 4.264 1.00 0.00 O ATOM 1045 CB SER A 215 10.806 -1.473 5.905 1.00 0.00 C ATOM 1046 OG SER A 215 10.901 -0.073 6.036 1.00 0.00 O ATOM 0 H SER A 215 8.460 -0.709 6.125 1.00 0.00 H new ATOM 0 HA SER A 215 10.042 -1.505 3.906 1.00 0.00 H new ATOM 0 HB2 SER A 215 10.576 -1.920 6.872 1.00 0.00 H new ATOM 0 HB3 SER A 215 11.765 -1.880 5.586 1.00 0.00 H new ATOM 0 HG SER A 215 10.079 0.274 6.441 1.00 0.00 H new ATOM 1052 N TRP A 216 8.445 -3.840 5.452 1.00 0.00 N ATOM 1053 CA TRP A 216 8.094 -5.256 5.382 1.00 0.00 C ATOM 1054 C TRP A 216 7.439 -5.563 4.037 1.00 0.00 C ATOM 1055 O TRP A 216 7.305 -6.719 3.637 1.00 0.00 O ATOM 1056 CB TRP A 216 7.142 -5.640 6.519 1.00 0.00 C ATOM 1057 CG TRP A 216 7.768 -5.586 7.881 1.00 0.00 C ATOM 1058 CD1 TRP A 216 8.862 -4.862 8.254 1.00 0.00 C ATOM 1059 CD2 TRP A 216 7.330 -6.283 9.051 1.00 0.00 C ATOM 1060 NE1 TRP A 216 9.131 -5.065 9.584 1.00 0.00 N ATOM 1061 CE2 TRP A 216 8.204 -5.933 10.097 1.00 0.00 C ATOM 1062 CE3 TRP A 216 6.282 -7.168 9.317 1.00 0.00 C ATOM 1063 CZ2 TRP A 216 8.062 -6.439 11.388 1.00 0.00 C ATOM 1064 CZ3 TRP A 216 6.141 -7.668 10.597 1.00 0.00 C ATOM 1065 CH2 TRP A 216 7.027 -7.302 11.618 1.00 0.00 C ATOM 0 H TRP A 216 7.797 -3.270 5.996 1.00 0.00 H new ATOM 0 HA TRP A 216 9.008 -5.840 5.484 1.00 0.00 H new ATOM 0 HB2 TRP A 216 6.281 -4.973 6.499 1.00 0.00 H new ATOM 0 HB3 TRP A 216 6.768 -6.648 6.342 1.00 0.00 H new ATOM 0 HD1 TRP A 216 9.433 -4.222 7.598 1.00 0.00 H new ATOM 0 HE1 TRP A 216 9.897 -4.639 10.106 1.00 0.00 H new ATOM 0 HE3 TRP A 216 5.594 -7.456 8.536 1.00 0.00 H new ATOM 0 HZ2 TRP A 216 8.744 -6.160 12.177 1.00 0.00 H new ATOM 0 HZ3 TRP A 216 5.334 -8.352 10.814 1.00 0.00 H new ATOM 0 HH2 TRP A 216 6.890 -7.710 12.608 1.00 0.00 H new ATOM 1076 N LEU A 217 7.039 -4.503 3.350 1.00 0.00 N ATOM 1077 CA LEU A 217 6.348 -4.608 2.074 1.00 0.00 C ATOM 1078 C LEU A 217 7.230 -4.049 0.961 1.00 0.00 C ATOM 1079 O LEU A 217 6.749 -3.733 -0.126 1.00 0.00 O ATOM 1080 CB LEU A 217 5.034 -3.825 2.149 1.00 0.00 C ATOM 1081 CG LEU A 217 4.192 -4.106 3.394 1.00 0.00 C ATOM 1082 CD1 LEU A 217 3.076 -3.087 3.520 1.00 0.00 C ATOM 1083 CD2 LEU A 217 3.622 -5.515 3.345 1.00 0.00 C ATOM 0 H LEU A 217 7.185 -3.543 3.663 1.00 0.00 H new ATOM 0 HA LEU A 217 6.133 -5.654 1.857 1.00 0.00 H new ATOM 0 HB2 LEU A 217 5.260 -2.759 2.113 1.00 0.00 H new ATOM 0 HB3 LEU A 217 4.439 -4.055 1.265 1.00 0.00 H new ATOM 0 HG LEU A 217 4.835 -4.025 4.270 1.00 0.00 H new ATOM 0 HD11 LEU A 217 2.486 -3.302 4.411 1.00 0.00 H new ATOM 0 HD12 LEU A 217 3.503 -2.087 3.600 1.00 0.00 H new ATOM 0 HD13 LEU A 217 2.435 -3.139 2.640 1.00 0.00 H new ATOM 0 HD21 LEU A 217 3.026 -5.698 4.239 1.00 0.00 H new ATOM 0 HD22 LEU A 217 2.993 -5.623 2.461 1.00 0.00 H new ATOM 0 HD23 LEU A 217 4.438 -6.236 3.300 1.00 0.00 H new ATOM 1095 N THR A 218 8.521 -3.924 1.255 1.00 0.00 N ATOM 1096 CA THR A 218 9.486 -3.362 0.322 1.00 0.00 C ATOM 1097 C THR A 218 9.459 -4.056 -1.024 1.00 0.00 C ATOM 1098 O THR A 218 9.717 -5.255 -1.141 1.00 0.00 O ATOM 1099 CB THR A 218 10.918 -3.426 0.886 1.00 0.00 C ATOM 1100 OG1 THR A 218 11.015 -2.648 2.084 1.00 0.00 O ATOM 1101 CG2 THR A 218 11.930 -2.932 -0.136 1.00 0.00 C ATOM 0 H THR A 218 8.925 -4.210 2.147 1.00 0.00 H new ATOM 0 HA THR A 218 9.194 -2.321 0.183 1.00 0.00 H new ATOM 0 HB THR A 218 11.143 -4.467 1.117 1.00 0.00 H new ATOM 0 HG1 THR A 218 11.030 -3.245 2.861 1.00 0.00 H new ATOM 0 HG21 THR A 218 12.932 -2.988 0.288 1.00 0.00 H new ATOM 0 HG22 THR A 218 11.879 -3.555 -1.029 1.00 0.00 H new ATOM 0 HG23 THR A 218 11.705 -1.899 -0.401 1.00 0.00 H new ATOM 1109 N GLY A 219 9.119 -3.274 -2.027 1.00 0.00 N ATOM 1110 CA GLY A 219 9.175 -3.728 -3.388 1.00 0.00 C ATOM 1111 C GLY A 219 8.061 -4.687 -3.740 1.00 0.00 C ATOM 1112 O GLY A 219 8.062 -5.280 -4.815 1.00 0.00 O ATOM 0 H GLY A 219 8.799 -2.312 -1.916 1.00 0.00 H new ATOM 0 HA2 GLY A 219 9.129 -2.867 -4.054 1.00 0.00 H new ATOM 0 HA3 GLY A 219 10.134 -4.215 -3.563 1.00 0.00 H new ATOM 1116 N GLU A 220 7.115 -4.844 -2.832 1.00 0.00 N ATOM 1117 CA GLU A 220 5.965 -5.695 -3.073 1.00 0.00 C ATOM 1118 C GLU A 220 4.900 -4.925 -3.825 1.00 0.00 C ATOM 1119 O GLU A 220 4.786 -3.708 -3.678 1.00 0.00 O ATOM 1120 CB GLU A 220 5.387 -6.196 -1.750 1.00 0.00 C ATOM 1121 CG GLU A 220 6.275 -7.197 -1.028 1.00 0.00 C ATOM 1122 CD GLU A 220 6.503 -8.456 -1.839 1.00 0.00 C ATOM 1123 OE1 GLU A 220 5.555 -9.258 -1.987 1.00 0.00 O ATOM 1124 OE2 GLU A 220 7.631 -8.655 -2.330 1.00 0.00 O ATOM 0 H GLU A 220 7.121 -4.391 -1.918 1.00 0.00 H new ATOM 0 HA GLU A 220 6.287 -6.549 -3.669 1.00 0.00 H new ATOM 0 HB2 GLU A 220 5.212 -5.342 -1.095 1.00 0.00 H new ATOM 0 HB3 GLU A 220 4.417 -6.656 -1.940 1.00 0.00 H new ATOM 0 HG2 GLU A 220 7.236 -6.732 -0.806 1.00 0.00 H new ATOM 0 HG3 GLU A 220 5.820 -7.460 -0.073 1.00 0.00 H new ATOM 1131 N GLU A 221 4.139 -5.619 -4.644 1.00 0.00 N ATOM 1132 CA GLU A 221 2.984 -5.012 -5.262 1.00 0.00 C ATOM 1133 C GLU A 221 1.812 -5.127 -4.299 1.00 0.00 C ATOM 1134 O GLU A 221 1.290 -6.218 -4.066 1.00 0.00 O ATOM 1135 CB GLU A 221 2.638 -5.690 -6.591 1.00 0.00 C ATOM 1136 CG GLU A 221 3.579 -5.342 -7.735 1.00 0.00 C ATOM 1137 CD GLU A 221 5.004 -5.795 -7.498 1.00 0.00 C ATOM 1138 OE1 GLU A 221 5.861 -4.948 -7.177 1.00 0.00 O ATOM 1139 OE2 GLU A 221 5.280 -7.006 -7.645 1.00 0.00 O ATOM 0 H GLU A 221 4.298 -6.595 -4.895 1.00 0.00 H new ATOM 0 HA GLU A 221 3.203 -3.966 -5.477 1.00 0.00 H new ATOM 0 HB2 GLU A 221 2.644 -6.770 -6.447 1.00 0.00 H new ATOM 0 HB3 GLU A 221 1.623 -5.412 -6.874 1.00 0.00 H new ATOM 0 HG2 GLU A 221 3.208 -5.798 -8.653 1.00 0.00 H new ATOM 0 HG3 GLU A 221 3.569 -4.263 -7.889 1.00 0.00 H new ATOM 1146 N LEU A 222 1.406 -4.009 -3.740 1.00 0.00 N ATOM 1147 CA LEU A 222 0.354 -3.996 -2.746 1.00 0.00 C ATOM 1148 C LEU A 222 -0.961 -3.620 -3.390 1.00 0.00 C ATOM 1149 O LEU A 222 -0.992 -2.904 -4.382 1.00 0.00 O ATOM 1150 CB LEU A 222 0.700 -3.028 -1.613 1.00 0.00 C ATOM 1151 CG LEU A 222 1.996 -3.349 -0.869 1.00 0.00 C ATOM 1152 CD1 LEU A 222 2.309 -2.270 0.153 1.00 0.00 C ATOM 1153 CD2 LEU A 222 1.888 -4.698 -0.182 1.00 0.00 C ATOM 0 H LEU A 222 1.791 -3.090 -3.958 1.00 0.00 H new ATOM 0 HA LEU A 222 0.259 -4.995 -2.320 1.00 0.00 H new ATOM 0 HB2 LEU A 222 0.773 -2.021 -2.024 1.00 0.00 H new ATOM 0 HB3 LEU A 222 -0.121 -3.021 -0.897 1.00 0.00 H new ATOM 0 HG LEU A 222 2.807 -3.385 -1.596 1.00 0.00 H new ATOM 0 HD11 LEU A 222 3.235 -2.518 0.671 1.00 0.00 H new ATOM 0 HD12 LEU A 222 2.422 -1.311 -0.353 1.00 0.00 H new ATOM 0 HD13 LEU A 222 1.495 -2.206 0.875 1.00 0.00 H new ATOM 0 HD21 LEU A 222 2.818 -4.914 0.344 1.00 0.00 H new ATOM 0 HD22 LEU A 222 1.064 -4.678 0.531 1.00 0.00 H new ATOM 0 HD23 LEU A 222 1.704 -5.472 -0.927 1.00 0.00 H new ATOM 1165 N HIS A 223 -2.044 -4.125 -2.847 1.00 0.00 N ATOM 1166 CA HIS A 223 -3.357 -3.838 -3.390 1.00 0.00 C ATOM 1167 C HIS A 223 -4.230 -3.249 -2.304 1.00 0.00 C ATOM 1168 O HIS A 223 -4.419 -3.859 -1.255 1.00 0.00 O ATOM 1169 CB HIS A 223 -4.000 -5.110 -3.955 1.00 0.00 C ATOM 1170 CG HIS A 223 -3.105 -5.873 -4.885 1.00 0.00 C ATOM 1171 ND1 HIS A 223 -3.022 -5.625 -6.238 1.00 0.00 N ATOM 1172 CD2 HIS A 223 -2.237 -6.879 -4.636 1.00 0.00 C ATOM 1173 CE1 HIS A 223 -2.137 -6.443 -6.778 1.00 0.00 C ATOM 1174 NE2 HIS A 223 -1.647 -7.211 -5.827 1.00 0.00 N ATOM 0 H HIS A 223 -2.045 -4.736 -2.030 1.00 0.00 H new ATOM 0 HA HIS A 223 -3.255 -3.120 -4.204 1.00 0.00 H new ATOM 0 HB2 HIS A 223 -4.289 -5.759 -3.128 1.00 0.00 H new ATOM 0 HB3 HIS A 223 -4.914 -4.841 -4.484 1.00 0.00 H new ATOM 0 HD2 HIS A 223 -2.044 -7.336 -3.677 1.00 0.00 H new ATOM 0 HE1 HIS A 223 -1.862 -6.476 -7.822 1.00 0.00 H new ATOM 0 HE2 HIS A 223 -0.942 -7.936 -5.956 1.00 0.00 H new ATOM 1183 N VAL A 224 -4.745 -2.063 -2.547 1.00 0.00 N ATOM 1184 CA VAL A 224 -5.601 -1.407 -1.589 1.00 0.00 C ATOM 1185 C VAL A 224 -7.057 -1.582 -1.982 1.00 0.00 C ATOM 1186 O VAL A 224 -7.401 -1.573 -3.164 1.00 0.00 O ATOM 1187 CB VAL A 224 -5.281 0.097 -1.451 1.00 0.00 C ATOM 1188 CG1 VAL A 224 -6.402 0.804 -0.713 1.00 0.00 C ATOM 1189 CG2 VAL A 224 -3.963 0.309 -0.725 1.00 0.00 C ATOM 0 H VAL A 224 -4.584 -1.534 -3.404 1.00 0.00 H new ATOM 0 HA VAL A 224 -5.417 -1.876 -0.622 1.00 0.00 H new ATOM 0 HB VAL A 224 -5.191 0.519 -2.452 1.00 0.00 H new ATOM 0 HG11 VAL A 224 -6.166 1.864 -0.621 1.00 0.00 H new ATOM 0 HG12 VAL A 224 -7.333 0.686 -1.267 1.00 0.00 H new ATOM 0 HG13 VAL A 224 -6.514 0.370 0.281 1.00 0.00 H new ATOM 0 HG21 VAL A 224 -3.761 1.377 -0.641 1.00 0.00 H new ATOM 0 HG22 VAL A 224 -4.022 -0.128 0.272 1.00 0.00 H new ATOM 0 HG23 VAL A 224 -3.159 -0.169 -1.284 1.00 0.00 H new ATOM 1199 N GLU A 225 -7.898 -1.730 -0.980 1.00 0.00 N ATOM 1200 CA GLU A 225 -9.314 -1.976 -1.180 1.00 0.00 C ATOM 1201 C GLU A 225 -10.111 -0.870 -0.519 1.00 0.00 C ATOM 1202 O GLU A 225 -9.658 -0.278 0.463 1.00 0.00 O ATOM 1203 CB GLU A 225 -9.703 -3.327 -0.580 1.00 0.00 C ATOM 1204 CG GLU A 225 -8.951 -4.506 -1.179 1.00 0.00 C ATOM 1205 CD GLU A 225 -9.497 -4.941 -2.523 1.00 0.00 C ATOM 1206 OE1 GLU A 225 -9.544 -6.163 -2.774 1.00 0.00 O ATOM 1207 OE2 GLU A 225 -9.896 -4.075 -3.327 1.00 0.00 O ATOM 0 H GLU A 225 -7.620 -1.683 0.000 1.00 0.00 H new ATOM 0 HA GLU A 225 -9.530 -1.993 -2.248 1.00 0.00 H new ATOM 0 HB2 GLU A 225 -9.523 -3.302 0.495 1.00 0.00 H new ATOM 0 HB3 GLU A 225 -10.773 -3.482 -0.720 1.00 0.00 H new ATOM 0 HG2 GLU A 225 -7.900 -4.240 -1.290 1.00 0.00 H new ATOM 0 HG3 GLU A 225 -8.995 -5.347 -0.487 1.00 0.00 H new ATOM 1214 N VAL A 226 -11.289 -0.588 -1.049 1.00 0.00 N ATOM 1215 CA VAL A 226 -12.115 0.479 -0.517 1.00 0.00 C ATOM 1216 C VAL A 226 -13.029 -0.068 0.565 1.00 0.00 C ATOM 1217 O VAL A 226 -13.878 -0.919 0.294 1.00 0.00 O ATOM 1218 CB VAL A 226 -12.983 1.143 -1.603 1.00 0.00 C ATOM 1219 CG1 VAL A 226 -13.239 2.601 -1.258 1.00 0.00 C ATOM 1220 CG2 VAL A 226 -12.345 1.004 -2.975 1.00 0.00 C ATOM 0 H VAL A 226 -11.693 -1.082 -1.845 1.00 0.00 H new ATOM 0 HA VAL A 226 -11.440 1.232 -0.110 1.00 0.00 H new ATOM 0 HB VAL A 226 -13.943 0.628 -1.637 1.00 0.00 H new ATOM 0 HG11 VAL A 226 -13.853 3.056 -2.035 1.00 0.00 H new ATOM 0 HG12 VAL A 226 -13.758 2.663 -0.302 1.00 0.00 H new ATOM 0 HG13 VAL A 226 -12.289 3.131 -1.190 1.00 0.00 H new ATOM 0 HG21 VAL A 226 -12.980 1.482 -3.721 1.00 0.00 H new ATOM 0 HG22 VAL A 226 -11.366 1.483 -2.971 1.00 0.00 H new ATOM 0 HG23 VAL A 226 -12.231 -0.052 -3.218 1.00 0.00 H new ATOM 1230 N LEU A 227 -12.849 0.407 1.787 1.00 0.00 N ATOM 1231 CA LEU A 227 -13.681 -0.029 2.895 1.00 0.00 C ATOM 1232 C LEU A 227 -15.049 0.631 2.805 1.00 0.00 C ATOM 1233 O LEU A 227 -15.263 1.715 3.351 1.00 0.00 O ATOM 1234 CB LEU A 227 -13.028 0.302 4.241 1.00 0.00 C ATOM 1235 CG LEU A 227 -11.607 -0.234 4.441 1.00 0.00 C ATOM 1236 CD1 LEU A 227 -11.152 -0.016 5.874 1.00 0.00 C ATOM 1237 CD2 LEU A 227 -11.526 -1.707 4.067 1.00 0.00 C ATOM 0 H LEU A 227 -12.136 1.093 2.036 1.00 0.00 H new ATOM 0 HA LEU A 227 -13.795 -1.111 2.831 1.00 0.00 H new ATOM 0 HB2 LEU A 227 -13.007 1.386 4.357 1.00 0.00 H new ATOM 0 HB3 LEU A 227 -13.660 -0.092 5.037 1.00 0.00 H new ATOM 0 HG LEU A 227 -10.938 0.318 3.781 1.00 0.00 H new ATOM 0 HD11 LEU A 227 -10.141 -0.403 5.997 1.00 0.00 H new ATOM 0 HD12 LEU A 227 -11.163 1.050 6.101 1.00 0.00 H new ATOM 0 HD13 LEU A 227 -11.826 -0.538 6.553 1.00 0.00 H new ATOM 0 HD21 LEU A 227 -10.508 -2.065 4.217 1.00 0.00 H new ATOM 0 HD22 LEU A 227 -12.208 -2.280 4.695 1.00 0.00 H new ATOM 0 HD23 LEU A 227 -11.804 -1.833 3.021 1.00 0.00 H new