USER MOD reduce.3.24.130724 H: found=0, std=0, add=573, rem=0, adj=13 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 Set 1.1: A 194 CYS SG : rot 19:sc= -2.38! USER MOD Set 1.2: A 195 CYS SG : rot 105:sc= 1.68 USER MOD Single : A 163 ASN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 164 LYS NZ :NH3+ 168:sc= -0.0185 (180deg=-0.174) USER MOD Single : A 165 GLN : amide:sc= -0.381 X(o=-0.38,f=-0.17) USER MOD Single : A 167 THR OG1 : rot 180:sc= 0.172 USER MOD Single : A 173 CYS SG : rot 180:sc= 0.165 USER MOD Single : A 176 THR OG1 : rot 180:sc= 0.0245 USER MOD Single : A 180 SER OG : rot -90:sc= -2.35! 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 180:sc= 0 (180deg=0) USER MOD Single : A 187 MET CE :methyl -149:sc= -0.2 (180deg=-1.23) USER MOD Single : A 198 TYR OH : rot 180:sc= 0 USER MOD Single : A 205 LYS NZ :NH3+ -172:sc= 1.08 (180deg=1.05) 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 79:sc= -2.51! USER MOD Single : A 218 THR OG1 : rot 180:sc= -1.54 USER MOD Single : A 223 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 65 N PRO A 155 14.325 1.657 -2.686 1.00 0.00 N ATOM 66 CA PRO A 155 13.308 0.772 -3.249 1.00 0.00 C ATOM 67 C PRO A 155 11.888 1.276 -3.009 1.00 0.00 C ATOM 68 O PRO A 155 11.642 2.087 -2.114 1.00 0.00 O ATOM 69 CB PRO A 155 13.521 -0.564 -2.519 1.00 0.00 C ATOM 70 CG PRO A 155 14.764 -0.403 -1.708 1.00 0.00 C ATOM 71 CD PRO A 155 14.945 1.072 -1.491 1.00 0.00 C ATOM 0 HA PRO A 155 13.410 0.701 -4.332 1.00 0.00 H new ATOM 0 HB2 PRO A 155 12.669 -0.799 -1.882 1.00 0.00 H new ATOM 0 HB3 PRO A 155 13.624 -1.384 -3.230 1.00 0.00 H new ATOM 0 HG2 PRO A 155 14.677 -0.927 -0.756 1.00 0.00 H new ATOM 0 HG3 PRO A 155 15.623 -0.827 -2.227 1.00 0.00 H new ATOM 0 HD2 PRO A 155 14.457 1.409 -0.576 1.00 0.00 H new ATOM 0 HD3 PRO A 155 15.998 1.342 -1.409 1.00 0.00 H new ATOM 79 N ILE A 156 10.962 0.784 -3.815 1.00 0.00 N ATOM 80 CA ILE A 156 9.557 1.131 -3.695 1.00 0.00 C ATOM 81 C ILE A 156 8.717 -0.108 -3.485 1.00 0.00 C ATOM 82 O ILE A 156 9.210 -1.220 -3.596 1.00 0.00 O ATOM 83 CB ILE A 156 9.033 1.853 -4.957 1.00 0.00 C ATOM 84 CG1 ILE A 156 9.758 1.385 -6.225 1.00 0.00 C ATOM 85 CG2 ILE A 156 9.121 3.350 -4.798 1.00 0.00 C ATOM 86 CD1 ILE A 156 9.335 0.010 -6.697 1.00 0.00 C ATOM 0 H ILE A 156 11.164 0.131 -4.572 1.00 0.00 H new ATOM 0 HA ILE A 156 9.475 1.798 -2.837 1.00 0.00 H new ATOM 0 HB ILE A 156 7.982 1.587 -5.072 1.00 0.00 H new ATOM 0 HG12 ILE A 156 9.576 2.105 -7.023 1.00 0.00 H new ATOM 0 HG13 ILE A 156 10.832 1.381 -6.038 1.00 0.00 H new ATOM 0 HG21 ILE A 156 8.746 3.834 -5.700 1.00 0.00 H new ATOM 0 HG22 ILE A 156 8.521 3.661 -3.943 1.00 0.00 H new ATOM 0 HG23 ILE A 156 10.160 3.638 -4.636 1.00 0.00 H new ATOM 0 HD11 ILE A 156 9.890 -0.252 -7.598 1.00 0.00 H new ATOM 0 HD12 ILE A 156 9.542 -0.722 -5.917 1.00 0.00 H new ATOM 0 HD13 ILE A 156 8.267 0.013 -6.917 1.00 0.00 H new ATOM 98 N VAL A 157 7.452 0.101 -3.191 1.00 0.00 N ATOM 99 CA VAL A 157 6.477 -0.972 -3.160 1.00 0.00 C ATOM 100 C VAL A 157 5.253 -0.476 -3.918 1.00 0.00 C ATOM 101 O VAL A 157 4.815 0.663 -3.731 1.00 0.00 O ATOM 102 CB VAL A 157 6.128 -1.461 -1.718 1.00 0.00 C ATOM 103 CG1 VAL A 157 6.909 -0.703 -0.662 1.00 0.00 C ATOM 104 CG2 VAL A 157 4.632 -1.418 -1.428 1.00 0.00 C ATOM 0 H VAL A 157 7.069 1.019 -2.966 1.00 0.00 H new ATOM 0 HA VAL A 157 6.895 -1.859 -3.636 1.00 0.00 H new ATOM 0 HB VAL A 157 6.430 -2.507 -1.673 1.00 0.00 H new ATOM 0 HG11 VAL A 157 6.638 -1.073 0.327 1.00 0.00 H new ATOM 0 HG12 VAL A 157 7.977 -0.850 -0.824 1.00 0.00 H new ATOM 0 HG13 VAL A 157 6.675 0.359 -0.729 1.00 0.00 H new ATOM 0 HG21 VAL A 157 4.448 -1.769 -0.412 1.00 0.00 H new ATOM 0 HG22 VAL A 157 4.271 -0.395 -1.530 1.00 0.00 H new ATOM 0 HG23 VAL A 157 4.106 -2.060 -2.134 1.00 0.00 H new ATOM 114 N ARG A 158 4.737 -1.305 -4.802 1.00 0.00 N ATOM 115 CA ARG A 158 3.825 -0.841 -5.835 1.00 0.00 C ATOM 116 C ARG A 158 2.373 -1.103 -5.468 1.00 0.00 C ATOM 117 O ARG A 158 1.903 -2.235 -5.508 1.00 0.00 O ATOM 118 CB ARG A 158 4.222 -1.496 -7.154 1.00 0.00 C ATOM 119 CG ARG A 158 5.662 -1.166 -7.528 1.00 0.00 C ATOM 120 CD ARG A 158 6.102 -1.822 -8.820 1.00 0.00 C ATOM 121 NE ARG A 158 5.889 -3.273 -8.806 1.00 0.00 N ATOM 122 CZ ARG A 158 6.839 -4.180 -9.056 1.00 0.00 C ATOM 123 NH1 ARG A 158 8.081 -3.797 -9.332 1.00 0.00 N ATOM 124 NH2 ARG A 158 6.541 -5.475 -9.034 1.00 0.00 N ATOM 0 H ARG A 158 4.932 -2.306 -4.828 1.00 0.00 H new ATOM 0 HA ARG A 158 3.904 0.241 -5.937 1.00 0.00 H new ATOM 0 HB2 ARG A 158 4.104 -2.577 -7.075 1.00 0.00 H new ATOM 0 HB3 ARG A 158 3.553 -1.159 -7.945 1.00 0.00 H new ATOM 0 HG2 ARG A 158 5.769 -0.085 -7.621 1.00 0.00 H new ATOM 0 HG3 ARG A 158 6.323 -1.484 -6.722 1.00 0.00 H new ATOM 0 HD2 ARG A 158 5.552 -1.384 -9.653 1.00 0.00 H new ATOM 0 HD3 ARG A 158 7.158 -1.613 -8.990 1.00 0.00 H new ATOM 0 HE ARG A 158 4.952 -3.614 -8.591 1.00 0.00 H new ATOM 0 HH11 ARG A 158 8.316 -2.805 -9.354 1.00 0.00 H new ATOM 0 HH12 ARG A 158 8.800 -4.495 -9.522 1.00 0.00 H new ATOM 0 HH21 ARG A 158 5.589 -5.776 -8.827 1.00 0.00 H new ATOM 0 HH22 ARG A 158 7.265 -6.168 -9.225 1.00 0.00 H new ATOM 138 N VAL A 159 1.674 -0.031 -5.120 1.00 0.00 N ATOM 139 CA VAL A 159 0.322 -0.119 -4.590 1.00 0.00 C ATOM 140 C VAL A 159 -0.737 0.176 -5.638 1.00 0.00 C ATOM 141 O VAL A 159 -0.552 1.002 -6.524 1.00 0.00 O ATOM 142 CB VAL A 159 0.142 0.835 -3.387 1.00 0.00 C ATOM 143 CG1 VAL A 159 -1.324 1.049 -3.056 1.00 0.00 C ATOM 144 CG2 VAL A 159 0.841 0.248 -2.188 1.00 0.00 C ATOM 0 H VAL A 159 2.028 0.922 -5.197 1.00 0.00 H new ATOM 0 HA VAL A 159 0.185 -1.150 -4.264 1.00 0.00 H new ATOM 0 HB VAL A 159 0.572 1.801 -3.650 1.00 0.00 H new ATOM 0 HG11 VAL A 159 -1.410 1.725 -2.205 1.00 0.00 H new ATOM 0 HG12 VAL A 159 -1.832 1.483 -3.917 1.00 0.00 H new ATOM 0 HG13 VAL A 159 -1.784 0.093 -2.807 1.00 0.00 H new ATOM 0 HG21 VAL A 159 0.720 0.914 -1.334 1.00 0.00 H new ATOM 0 HG22 VAL A 159 0.408 -0.724 -1.954 1.00 0.00 H new ATOM 0 HG23 VAL A 159 1.902 0.129 -2.407 1.00 0.00 H new ATOM 154 N PHE A 160 -1.846 -0.524 -5.511 1.00 0.00 N ATOM 155 CA PHE A 160 -3.004 -0.328 -6.367 1.00 0.00 C ATOM 156 C PHE A 160 -4.136 0.325 -5.576 1.00 0.00 C ATOM 157 O PHE A 160 -4.796 -0.332 -4.787 1.00 0.00 O ATOM 158 CB PHE A 160 -3.460 -1.676 -6.931 1.00 0.00 C ATOM 159 CG PHE A 160 -2.500 -2.278 -7.924 1.00 0.00 C ATOM 160 CD1 PHE A 160 -1.314 -2.862 -7.501 1.00 0.00 C ATOM 161 CD2 PHE A 160 -2.786 -2.259 -9.278 1.00 0.00 C ATOM 162 CE1 PHE A 160 -0.434 -3.417 -8.411 1.00 0.00 C ATOM 163 CE2 PHE A 160 -1.909 -2.813 -10.192 1.00 0.00 C ATOM 164 CZ PHE A 160 -0.732 -3.391 -9.759 1.00 0.00 C ATOM 0 H PHE A 160 -1.972 -1.251 -4.807 1.00 0.00 H new ATOM 0 HA PHE A 160 -2.733 0.330 -7.193 1.00 0.00 H new ATOM 0 HB2 PHE A 160 -3.601 -2.375 -6.107 1.00 0.00 H new ATOM 0 HB3 PHE A 160 -4.431 -1.549 -7.410 1.00 0.00 H new ATOM 0 HD1 PHE A 160 -1.076 -2.883 -6.448 1.00 0.00 H new ATOM 0 HD2 PHE A 160 -3.704 -1.807 -9.624 1.00 0.00 H new ATOM 0 HE1 PHE A 160 0.485 -3.870 -8.068 1.00 0.00 H new ATOM 0 HE2 PHE A 160 -2.145 -2.794 -11.246 1.00 0.00 H new ATOM 0 HZ PHE A 160 -0.046 -3.822 -10.473 1.00 0.00 H new ATOM 174 N LEU A 161 -4.362 1.613 -5.804 1.00 0.00 N ATOM 175 CA LEU A 161 -5.338 2.379 -5.024 1.00 0.00 C ATOM 176 C LEU A 161 -6.743 2.122 -5.584 1.00 0.00 C ATOM 177 O LEU A 161 -6.879 1.477 -6.627 1.00 0.00 O ATOM 178 CB LEU A 161 -5.021 3.896 -5.067 1.00 0.00 C ATOM 179 CG LEU A 161 -3.615 4.330 -4.637 1.00 0.00 C ATOM 180 CD1 LEU A 161 -3.254 3.771 -3.276 1.00 0.00 C ATOM 181 CD2 LEU A 161 -2.595 3.950 -5.690 1.00 0.00 C ATOM 0 H LEU A 161 -3.883 2.154 -6.524 1.00 0.00 H new ATOM 0 HA LEU A 161 -5.287 2.055 -3.985 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -5.186 4.247 -6.086 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -5.742 4.410 -4.432 1.00 0.00 H new ATOM 0 HG LEU A 161 -3.609 5.416 -4.544 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -2.251 4.098 -3.003 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -3.968 4.130 -2.534 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -3.283 2.682 -3.311 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -1.603 4.266 -5.367 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -2.603 2.869 -5.831 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -2.844 4.441 -6.631 1.00 0.00 H new ATOM 193 N PRO A 162 -7.804 2.610 -4.915 1.00 0.00 N ATOM 194 CA PRO A 162 -9.180 2.476 -5.408 1.00 0.00 C ATOM 195 C PRO A 162 -9.340 3.020 -6.826 1.00 0.00 C ATOM 196 O PRO A 162 -8.515 3.809 -7.291 1.00 0.00 O ATOM 197 CB PRO A 162 -9.994 3.306 -4.418 1.00 0.00 C ATOM 198 CG PRO A 162 -9.190 3.265 -3.175 1.00 0.00 C ATOM 199 CD PRO A 162 -7.762 3.322 -3.632 1.00 0.00 C ATOM 0 HA PRO A 162 -9.495 1.434 -5.467 1.00 0.00 H new ATOM 0 HB2 PRO A 162 -10.132 4.328 -4.771 1.00 0.00 H new ATOM 0 HB3 PRO A 162 -10.988 2.885 -4.265 1.00 0.00 H new ATOM 0 HG2 PRO A 162 -9.429 4.105 -2.523 1.00 0.00 H new ATOM 0 HG3 PRO A 162 -9.387 2.355 -2.608 1.00 0.00 H new ATOM 0 HD2 PRO A 162 -7.416 4.349 -3.750 1.00 0.00 H new ATOM 0 HD3 PRO A 162 -7.090 2.839 -2.923 1.00 0.00 H new ATOM 207 N ASN A 163 -10.400 2.586 -7.508 1.00 0.00 N ATOM 208 CA ASN A 163 -10.641 2.949 -8.907 1.00 0.00 C ATOM 209 C ASN A 163 -9.562 2.349 -9.798 1.00 0.00 C ATOM 210 O ASN A 163 -9.281 2.858 -10.887 1.00 0.00 O ATOM 211 CB ASN A 163 -10.688 4.473 -9.103 1.00 0.00 C ATOM 212 CG ASN A 163 -11.834 5.140 -8.370 1.00 0.00 C ATOM 213 OD1 ASN A 163 -12.903 4.555 -8.188 1.00 0.00 O ATOM 214 ND2 ASN A 163 -11.622 6.376 -7.948 1.00 0.00 N ATOM 0 H ASN A 163 -11.114 1.976 -7.110 1.00 0.00 H new ATOM 0 HA ASN A 163 -11.614 2.545 -9.187 1.00 0.00 H new ATOM 0 HB2 ASN A 163 -9.748 4.905 -8.761 1.00 0.00 H new ATOM 0 HB3 ASN A 163 -10.771 4.692 -10.167 1.00 0.00 H new ATOM 0 HD21 ASN A 163 -12.358 6.879 -7.452 1.00 0.00 H new ATOM 0 HD22 ASN A 163 -10.723 6.826 -8.118 1.00 0.00 H new ATOM 221 N LYS A 164 -8.958 1.265 -9.311 1.00 0.00 N ATOM 222 CA LYS A 164 -7.897 0.560 -10.026 1.00 0.00 C ATOM 223 C LYS A 164 -6.748 1.496 -10.367 1.00 0.00 C ATOM 224 O LYS A 164 -6.222 1.485 -11.480 1.00 0.00 O ATOM 225 CB LYS A 164 -8.444 -0.102 -11.292 1.00 0.00 C ATOM 226 CG LYS A 164 -9.393 -1.258 -11.016 1.00 0.00 C ATOM 227 CD LYS A 164 -8.666 -2.599 -10.910 1.00 0.00 C ATOM 228 CE LYS A 164 -7.779 -2.709 -9.672 1.00 0.00 C ATOM 229 NZ LYS A 164 -8.552 -2.579 -8.407 1.00 0.00 N ATOM 0 H LYS A 164 -9.192 0.851 -8.408 1.00 0.00 H new ATOM 0 HA LYS A 164 -7.513 -0.219 -9.368 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -8.963 0.648 -11.888 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -7.609 -0.464 -11.892 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -9.933 -1.067 -10.089 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -10.135 -1.313 -11.812 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -9.402 -3.403 -10.894 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -8.055 -2.744 -11.801 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -7.263 -3.669 -9.682 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -7.013 -1.935 -9.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -7.954 -2.860 -7.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -8.854 -1.591 -8.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -9.389 -3.195 -8.447 1.00 0.00 H new ATOM 243 N GLN A 165 -6.372 2.310 -9.400 1.00 0.00 N ATOM 244 CA GLN A 165 -5.256 3.214 -9.556 1.00 0.00 C ATOM 245 C GLN A 165 -3.977 2.519 -9.115 1.00 0.00 C ATOM 246 O GLN A 165 -4.034 1.448 -8.525 1.00 0.00 O ATOM 247 CB GLN A 165 -5.512 4.482 -8.740 1.00 0.00 C ATOM 248 CG GLN A 165 -6.657 5.328 -9.274 1.00 0.00 C ATOM 249 CD GLN A 165 -6.429 5.807 -10.692 1.00 0.00 C ATOM 250 OE1 GLN A 165 -5.868 6.880 -10.914 1.00 0.00 O ATOM 251 NE2 GLN A 165 -6.871 5.020 -11.659 1.00 0.00 N ATOM 0 H GLN A 165 -6.830 2.361 -8.490 1.00 0.00 H new ATOM 0 HA GLN A 165 -5.145 3.499 -10.602 1.00 0.00 H new ATOM 0 HB2 GLN A 165 -5.728 4.203 -7.709 1.00 0.00 H new ATOM 0 HB3 GLN A 165 -4.603 5.084 -8.724 1.00 0.00 H new ATOM 0 HG2 GLN A 165 -7.579 4.747 -9.237 1.00 0.00 H new ATOM 0 HG3 GLN A 165 -6.798 6.191 -8.623 1.00 0.00 H new ATOM 0 HE21 GLN A 165 -7.330 4.139 -11.429 1.00 0.00 H new ATOM 0 HE22 GLN A 165 -6.752 5.294 -12.634 1.00 0.00 H new ATOM 260 N ARG A 166 -2.828 3.095 -9.423 1.00 0.00 N ATOM 261 CA ARG A 166 -1.572 2.521 -8.981 1.00 0.00 C ATOM 262 C ARG A 166 -0.546 3.595 -8.688 1.00 0.00 C ATOM 263 O ARG A 166 -0.291 4.477 -9.504 1.00 0.00 O ATOM 264 CB ARG A 166 -1.019 1.542 -10.004 1.00 0.00 C ATOM 265 CG ARG A 166 0.254 0.873 -9.549 1.00 0.00 C ATOM 266 CD ARG A 166 0.651 -0.235 -10.493 1.00 0.00 C ATOM 267 NE ARG A 166 1.669 0.189 -11.452 1.00 0.00 N ATOM 268 CZ ARG A 166 2.540 -0.641 -12.026 1.00 0.00 C ATOM 269 NH1 ARG A 166 2.516 -1.938 -11.737 1.00 0.00 N ATOM 270 NH2 ARG A 166 3.432 -0.173 -12.890 1.00 0.00 N ATOM 0 H ARG A 166 -2.740 3.950 -9.971 1.00 0.00 H new ATOM 0 HA ARG A 166 -1.778 1.978 -8.058 1.00 0.00 H new ATOM 0 HB2 ARG A 166 -1.770 0.780 -10.212 1.00 0.00 H new ATOM 0 HB3 ARG A 166 -0.832 2.069 -10.940 1.00 0.00 H new ATOM 0 HG2 ARG A 166 1.055 1.610 -9.490 1.00 0.00 H new ATOM 0 HG3 ARG A 166 0.118 0.469 -8.546 1.00 0.00 H new ATOM 0 HD2 ARG A 166 1.027 -1.081 -9.918 1.00 0.00 H new ATOM 0 HD3 ARG A 166 -0.230 -0.583 -11.032 1.00 0.00 H new ATOM 0 HE ARG A 166 1.716 1.178 -11.696 1.00 0.00 H new ATOM 0 HH11 ARG A 166 1.830 -2.300 -11.075 1.00 0.00 H new ATOM 0 HH12 ARG A 166 3.183 -2.571 -12.178 1.00 0.00 H new ATOM 0 HH21 ARG A 166 3.451 0.822 -13.115 1.00 0.00 H new ATOM 0 HH22 ARG A 166 4.098 -0.808 -13.329 1.00 0.00 H new ATOM 284 N THR A 167 0.044 3.487 -7.521 1.00 0.00 N ATOM 285 CA THR A 167 1.081 4.395 -7.078 1.00 0.00 C ATOM 286 C THR A 167 2.084 3.600 -6.263 1.00 0.00 C ATOM 287 O THR A 167 1.701 2.711 -5.504 1.00 0.00 O ATOM 288 CB THR A 167 0.507 5.568 -6.236 1.00 0.00 C ATOM 289 OG1 THR A 167 1.279 6.756 -6.458 1.00 0.00 O ATOM 290 CG2 THR A 167 0.494 5.262 -4.740 1.00 0.00 C ATOM 0 H THR A 167 -0.183 2.759 -6.844 1.00 0.00 H new ATOM 0 HA THR A 167 1.560 4.842 -7.949 1.00 0.00 H new ATOM 0 HB THR A 167 -0.523 5.713 -6.560 1.00 0.00 H new ATOM 0 HG1 THR A 167 0.909 7.491 -5.925 1.00 0.00 H new ATOM 0 HG21 THR A 167 0.084 6.114 -4.198 1.00 0.00 H new ATOM 0 HG22 THR A 167 -0.122 4.382 -4.554 1.00 0.00 H new ATOM 0 HG23 THR A 167 1.511 5.071 -4.399 1.00 0.00 H new ATOM 298 N VAL A 168 3.362 3.861 -6.436 1.00 0.00 N ATOM 299 CA VAL A 168 4.340 3.120 -5.676 1.00 0.00 C ATOM 300 C VAL A 168 5.115 4.045 -4.756 1.00 0.00 C ATOM 301 O VAL A 168 5.604 5.105 -5.158 1.00 0.00 O ATOM 302 CB VAL A 168 5.254 2.260 -6.584 1.00 0.00 C ATOM 303 CG1 VAL A 168 4.507 1.875 -7.853 1.00 0.00 C ATOM 304 CG2 VAL A 168 6.567 2.899 -6.941 1.00 0.00 C ATOM 0 H VAL A 168 3.739 4.560 -7.077 1.00 0.00 H new ATOM 0 HA VAL A 168 3.810 2.409 -5.042 1.00 0.00 H new ATOM 0 HB VAL A 168 5.506 1.378 -5.996 1.00 0.00 H new ATOM 0 HG11 VAL A 168 5.155 1.270 -8.487 1.00 0.00 H new ATOM 0 HG12 VAL A 168 3.617 1.302 -7.592 1.00 0.00 H new ATOM 0 HG13 VAL A 168 4.213 2.777 -8.390 1.00 0.00 H new ATOM 0 HG21 VAL A 168 7.139 2.224 -7.578 1.00 0.00 H new ATOM 0 HG22 VAL A 168 6.385 3.833 -7.473 1.00 0.00 H new ATOM 0 HG23 VAL A 168 7.131 3.104 -6.031 1.00 0.00 H new ATOM 314 N VAL A 169 5.172 3.649 -3.501 1.00 0.00 N ATOM 315 CA VAL A 169 5.752 4.468 -2.458 1.00 0.00 C ATOM 316 C VAL A 169 7.093 3.890 -2.035 1.00 0.00 C ATOM 317 O VAL A 169 7.240 2.671 -1.922 1.00 0.00 O ATOM 318 CB VAL A 169 4.791 4.566 -1.248 1.00 0.00 C ATOM 319 CG1 VAL A 169 4.441 3.187 -0.717 1.00 0.00 C ATOM 320 CG2 VAL A 169 5.375 5.437 -0.143 1.00 0.00 C ATOM 0 H VAL A 169 4.817 2.750 -3.176 1.00 0.00 H new ATOM 0 HA VAL A 169 5.911 5.475 -2.845 1.00 0.00 H new ATOM 0 HB VAL A 169 3.873 5.040 -1.596 1.00 0.00 H new ATOM 0 HG11 VAL A 169 3.765 3.285 0.132 1.00 0.00 H new ATOM 0 HG12 VAL A 169 3.956 2.607 -1.502 1.00 0.00 H new ATOM 0 HG13 VAL A 169 5.351 2.678 -0.400 1.00 0.00 H new ATOM 0 HG21 VAL A 169 4.675 5.485 0.691 1.00 0.00 H new ATOM 0 HG22 VAL A 169 6.317 5.009 0.198 1.00 0.00 H new ATOM 0 HG23 VAL A 169 5.551 6.442 -0.527 1.00 0.00 H new ATOM 330 N PRO A 170 8.104 4.755 -1.863 1.00 0.00 N ATOM 331 CA PRO A 170 9.421 4.332 -1.404 1.00 0.00 C ATOM 332 C PRO A 170 9.337 3.627 -0.063 1.00 0.00 C ATOM 333 O PRO A 170 8.712 4.131 0.872 1.00 0.00 O ATOM 334 CB PRO A 170 10.204 5.639 -1.275 1.00 0.00 C ATOM 335 CG PRO A 170 9.485 6.612 -2.139 1.00 0.00 C ATOM 336 CD PRO A 170 8.045 6.205 -2.108 1.00 0.00 C ATOM 0 HA PRO A 170 9.888 3.621 -2.086 1.00 0.00 H new ATOM 0 HB2 PRO A 170 10.234 5.979 -0.240 1.00 0.00 H new ATOM 0 HB3 PRO A 170 11.237 5.513 -1.599 1.00 0.00 H new ATOM 0 HG2 PRO A 170 9.611 7.630 -1.769 1.00 0.00 H new ATOM 0 HG3 PRO A 170 9.874 6.592 -3.157 1.00 0.00 H new ATOM 0 HD2 PRO A 170 7.498 6.723 -1.320 1.00 0.00 H new ATOM 0 HD3 PRO A 170 7.543 6.433 -3.048 1.00 0.00 H new ATOM 344 N ALA A 171 9.956 2.461 0.015 1.00 0.00 N ATOM 345 CA ALA A 171 9.931 1.656 1.221 1.00 0.00 C ATOM 346 C ALA A 171 10.696 2.350 2.340 1.00 0.00 C ATOM 347 O ALA A 171 11.911 2.196 2.474 1.00 0.00 O ATOM 348 CB ALA A 171 10.496 0.275 0.933 1.00 0.00 C ATOM 0 H ALA A 171 10.487 2.049 -0.752 1.00 0.00 H new ATOM 0 HA ALA A 171 8.899 1.538 1.552 1.00 0.00 H new ATOM 0 HB1 ALA A 171 10.474 -0.324 1.843 1.00 0.00 H new ATOM 0 HB2 ALA A 171 9.895 -0.211 0.164 1.00 0.00 H new ATOM 0 HB3 ALA A 171 11.525 0.368 0.585 1.00 0.00 H new ATOM 354 N ARG A 172 9.973 3.134 3.121 1.00 0.00 N ATOM 355 CA ARG A 172 10.558 3.919 4.190 1.00 0.00 C ATOM 356 C ARG A 172 10.873 3.049 5.397 1.00 0.00 C ATOM 357 O ARG A 172 9.969 2.553 6.072 1.00 0.00 O ATOM 358 CB ARG A 172 9.600 5.030 4.581 1.00 0.00 C ATOM 359 CG ARG A 172 9.375 6.045 3.480 1.00 0.00 C ATOM 360 CD ARG A 172 8.482 7.170 3.952 1.00 0.00 C ATOM 361 NE ARG A 172 8.227 8.143 2.892 1.00 0.00 N ATOM 362 CZ ARG A 172 7.133 8.904 2.809 1.00 0.00 C ATOM 363 NH1 ARG A 172 6.184 8.833 3.738 1.00 0.00 N ATOM 364 NH2 ARG A 172 6.995 9.742 1.790 1.00 0.00 N ATOM 0 H ARG A 172 8.963 3.243 3.030 1.00 0.00 H new ATOM 0 HA ARG A 172 11.494 4.351 3.835 1.00 0.00 H new ATOM 0 HB2 ARG A 172 8.642 4.592 4.862 1.00 0.00 H new ATOM 0 HB3 ARG A 172 9.988 5.541 5.462 1.00 0.00 H new ATOM 0 HG2 ARG A 172 10.333 6.450 3.153 1.00 0.00 H new ATOM 0 HG3 ARG A 172 8.924 5.556 2.617 1.00 0.00 H new ATOM 0 HD2 ARG A 172 7.535 6.759 4.304 1.00 0.00 H new ATOM 0 HD3 ARG A 172 8.947 7.671 4.801 1.00 0.00 H new ATOM 0 HE ARG A 172 8.934 8.248 2.165 1.00 0.00 H new ATOM 0 HH11 ARG A 172 6.287 8.192 4.525 1.00 0.00 H new ATOM 0 HH12 ARG A 172 5.353 9.419 3.664 1.00 0.00 H new ATOM 0 HH21 ARG A 172 7.722 9.802 1.077 1.00 0.00 H new ATOM 0 HH22 ARG A 172 6.162 10.327 1.720 1.00 0.00 H new ATOM 378 N CYS A 173 12.155 2.869 5.663 1.00 0.00 N ATOM 379 CA CYS A 173 12.594 2.075 6.798 1.00 0.00 C ATOM 380 C CYS A 173 12.339 2.822 8.103 1.00 0.00 C ATOM 381 O CYS A 173 12.908 3.890 8.340 1.00 0.00 O ATOM 382 CB CYS A 173 14.077 1.734 6.649 1.00 0.00 C ATOM 383 SG CYS A 173 15.100 3.131 6.121 1.00 0.00 S ATOM 0 H CYS A 173 12.913 3.264 5.106 1.00 0.00 H new ATOM 0 HA CYS A 173 12.023 1.147 6.824 1.00 0.00 H new ATOM 0 HB2 CYS A 173 14.452 1.361 7.602 1.00 0.00 H new ATOM 0 HB3 CYS A 173 14.183 0.925 5.927 1.00 0.00 H new ATOM 0 HG CYS A 173 16.339 2.749 6.024 1.00 0.00 H new ATOM 389 N GLY A 174 11.465 2.276 8.935 1.00 0.00 N ATOM 390 CA GLY A 174 11.144 2.919 10.193 1.00 0.00 C ATOM 391 C GLY A 174 9.855 3.709 10.112 1.00 0.00 C ATOM 392 O GLY A 174 9.567 4.545 10.971 1.00 0.00 O ATOM 0 H GLY A 174 10.972 1.400 8.762 1.00 0.00 H new ATOM 0 HA2 GLY A 174 11.058 2.164 10.975 1.00 0.00 H new ATOM 0 HA3 GLY A 174 11.959 3.583 10.479 1.00 0.00 H new ATOM 396 N VAL A 175 9.080 3.444 9.074 1.00 0.00 N ATOM 397 CA VAL A 175 7.813 4.122 8.871 1.00 0.00 C ATOM 398 C VAL A 175 6.720 3.092 8.604 1.00 0.00 C ATOM 399 O VAL A 175 6.981 2.024 8.049 1.00 0.00 O ATOM 400 CB VAL A 175 7.901 5.139 7.700 1.00 0.00 C ATOM 401 CG1 VAL A 175 6.962 4.774 6.569 1.00 0.00 C ATOM 402 CG2 VAL A 175 7.575 6.540 8.175 1.00 0.00 C ATOM 0 H VAL A 175 9.309 2.759 8.354 1.00 0.00 H new ATOM 0 HA VAL A 175 7.569 4.681 9.775 1.00 0.00 H new ATOM 0 HB VAL A 175 8.926 5.105 7.331 1.00 0.00 H new ATOM 0 HG11 VAL A 175 7.053 5.509 5.769 1.00 0.00 H new ATOM 0 HG12 VAL A 175 7.220 3.787 6.186 1.00 0.00 H new ATOM 0 HG13 VAL A 175 5.936 4.763 6.937 1.00 0.00 H new ATOM 0 HG21 VAL A 175 7.644 7.234 7.337 1.00 0.00 H new ATOM 0 HG22 VAL A 175 6.564 6.560 8.581 1.00 0.00 H new ATOM 0 HG23 VAL A 175 8.283 6.836 8.949 1.00 0.00 H new ATOM 412 N THR A 176 5.507 3.410 9.014 1.00 0.00 N ATOM 413 CA THR A 176 4.390 2.509 8.833 1.00 0.00 C ATOM 414 C THR A 176 3.785 2.637 7.442 1.00 0.00 C ATOM 415 O THR A 176 3.897 3.684 6.793 1.00 0.00 O ATOM 416 CB THR A 176 3.305 2.771 9.889 1.00 0.00 C ATOM 417 OG1 THR A 176 3.045 4.178 9.982 1.00 0.00 O ATOM 418 CG2 THR A 176 3.731 2.233 11.243 1.00 0.00 C ATOM 0 H THR A 176 5.272 4.289 9.476 1.00 0.00 H new ATOM 0 HA THR A 176 4.773 1.495 8.950 1.00 0.00 H new ATOM 0 HB THR A 176 2.394 2.255 9.584 1.00 0.00 H new ATOM 0 HG1 THR A 176 2.351 4.339 10.655 1.00 0.00 H new ATOM 0 HG21 THR A 176 2.948 2.429 11.975 1.00 0.00 H new ATOM 0 HG22 THR A 176 3.899 1.158 11.171 1.00 0.00 H new ATOM 0 HG23 THR A 176 4.652 2.724 11.556 1.00 0.00 H new ATOM 426 N VAL A 177 3.152 1.558 6.990 1.00 0.00 N ATOM 427 CA VAL A 177 2.384 1.561 5.753 1.00 0.00 C ATOM 428 C VAL A 177 1.364 2.693 5.805 1.00 0.00 C ATOM 429 O VAL A 177 1.009 3.274 4.787 1.00 0.00 O ATOM 430 CB VAL A 177 1.645 0.214 5.556 1.00 0.00 C ATOM 431 CG1 VAL A 177 0.836 0.203 4.270 1.00 0.00 C ATOM 432 CG2 VAL A 177 2.627 -0.943 5.570 1.00 0.00 C ATOM 0 H VAL A 177 3.158 0.659 7.472 1.00 0.00 H new ATOM 0 HA VAL A 177 3.068 1.704 4.916 1.00 0.00 H new ATOM 0 HB VAL A 177 0.951 0.097 6.388 1.00 0.00 H new ATOM 0 HG11 VAL A 177 0.332 -0.758 4.166 1.00 0.00 H new ATOM 0 HG12 VAL A 177 0.094 1.001 4.300 1.00 0.00 H new ATOM 0 HG13 VAL A 177 1.501 0.358 3.420 1.00 0.00 H new ATOM 0 HG21 VAL A 177 2.088 -1.880 5.430 1.00 0.00 H new ATOM 0 HG22 VAL A 177 3.350 -0.817 4.764 1.00 0.00 H new ATOM 0 HG23 VAL A 177 3.150 -0.965 6.526 1.00 0.00 H new ATOM 442 N ARG A 178 0.913 3.000 7.019 1.00 0.00 N ATOM 443 CA ARG A 178 0.017 4.111 7.263 1.00 0.00 C ATOM 444 C ARG A 178 0.591 5.395 6.698 1.00 0.00 C ATOM 445 O ARG A 178 -0.017 6.007 5.844 1.00 0.00 O ATOM 446 CB ARG A 178 -0.229 4.272 8.759 1.00 0.00 C ATOM 447 CG ARG A 178 -1.679 4.518 9.123 1.00 0.00 C ATOM 448 CD ARG A 178 -1.871 4.571 10.628 1.00 0.00 C ATOM 449 NE ARG A 178 -3.278 4.721 10.993 1.00 0.00 N ATOM 450 CZ ARG A 178 -3.719 4.774 12.249 1.00 0.00 C ATOM 451 NH1 ARG A 178 -2.862 4.707 13.260 1.00 0.00 N ATOM 452 NH2 ARG A 178 -5.017 4.900 12.492 1.00 0.00 N ATOM 0 H ARG A 178 1.164 2.479 7.859 1.00 0.00 H new ATOM 0 HA ARG A 178 -0.930 3.901 6.765 1.00 0.00 H new ATOM 0 HB2 ARG A 178 0.116 3.374 9.272 1.00 0.00 H new ATOM 0 HB3 ARG A 178 0.373 5.102 9.128 1.00 0.00 H new ATOM 0 HG2 ARG A 178 -2.013 5.456 8.679 1.00 0.00 H new ATOM 0 HG3 ARG A 178 -2.300 3.727 8.703 1.00 0.00 H new ATOM 0 HD2 ARG A 178 -1.475 3.660 11.077 1.00 0.00 H new ATOM 0 HD3 ARG A 178 -1.299 5.403 11.038 1.00 0.00 H new ATOM 0 HE ARG A 178 -3.964 4.789 10.241 1.00 0.00 H new ATOM 0 HH11 ARG A 178 -1.863 4.615 13.076 1.00 0.00 H new ATOM 0 HH12 ARG A 178 -3.202 4.748 14.221 1.00 0.00 H new ATOM 0 HH21 ARG A 178 -5.678 4.956 11.717 1.00 0.00 H new ATOM 0 HH22 ARG A 178 -5.354 4.941 13.454 1.00 0.00 H new ATOM 466 N ASP A 179 1.775 5.781 7.161 1.00 0.00 N ATOM 467 CA ASP A 179 2.405 7.033 6.727 1.00 0.00 C ATOM 468 C ASP A 179 2.714 7.008 5.239 1.00 0.00 C ATOM 469 O ASP A 179 2.403 7.947 4.504 1.00 0.00 O ATOM 470 CB ASP A 179 3.695 7.271 7.513 1.00 0.00 C ATOM 471 CG ASP A 179 4.528 8.396 6.930 1.00 0.00 C ATOM 472 OD1 ASP A 179 5.499 8.105 6.202 1.00 0.00 O ATOM 473 OD2 ASP A 179 4.217 9.575 7.197 1.00 0.00 O ATOM 0 H ASP A 179 2.322 5.248 7.837 1.00 0.00 H new ATOM 0 HA ASP A 179 1.703 7.845 6.919 1.00 0.00 H new ATOM 0 HB2 ASP A 179 3.448 7.504 8.549 1.00 0.00 H new ATOM 0 HB3 ASP A 179 4.285 6.354 7.525 1.00 0.00 H new ATOM 478 N SER A 180 3.320 5.920 4.810 1.00 0.00 N ATOM 479 CA SER A 180 3.717 5.739 3.430 1.00 0.00 C ATOM 480 C SER A 180 2.522 5.808 2.470 1.00 0.00 C ATOM 481 O SER A 180 2.528 6.580 1.504 1.00 0.00 O ATOM 482 CB SER A 180 4.445 4.405 3.332 1.00 0.00 C ATOM 483 OG SER A 180 5.752 4.523 3.855 1.00 0.00 O ATOM 0 H SER A 180 3.552 5.131 5.414 1.00 0.00 H new ATOM 0 HA SER A 180 4.378 6.551 3.127 1.00 0.00 H new ATOM 0 HB2 SER A 180 3.894 3.641 3.880 1.00 0.00 H new ATOM 0 HB3 SER A 180 4.489 4.082 2.292 1.00 0.00 H new ATOM 0 HG SER A 180 6.369 4.781 3.139 1.00 0.00 H new ATOM 489 N LEU A 181 1.487 5.033 2.752 1.00 0.00 N ATOM 490 CA LEU A 181 0.318 4.994 1.884 1.00 0.00 C ATOM 491 C LEU A 181 -0.562 6.210 2.125 1.00 0.00 C ATOM 492 O LEU A 181 -1.394 6.558 1.288 1.00 0.00 O ATOM 493 CB LEU A 181 -0.495 3.715 2.100 1.00 0.00 C ATOM 494 CG LEU A 181 0.165 2.404 1.666 1.00 0.00 C ATOM 495 CD1 LEU A 181 -0.798 1.573 0.843 1.00 0.00 C ATOM 496 CD2 LEU A 181 1.439 2.666 0.895 1.00 0.00 C ATOM 0 H LEU A 181 1.431 4.426 3.569 1.00 0.00 H new ATOM 0 HA LEU A 181 0.672 5.004 0.853 1.00 0.00 H new ATOM 0 HB2 LEU A 181 -0.738 3.640 3.160 1.00 0.00 H new ATOM 0 HB3 LEU A 181 -1.438 3.816 1.563 1.00 0.00 H new ATOM 0 HG LEU A 181 0.426 1.843 2.563 1.00 0.00 H new ATOM 0 HD11 LEU A 181 -0.313 0.644 0.543 1.00 0.00 H new ATOM 0 HD12 LEU A 181 -1.682 1.344 1.438 1.00 0.00 H new ATOM 0 HD13 LEU A 181 -1.093 2.132 -0.045 1.00 0.00 H new ATOM 0 HD21 LEU A 181 1.887 1.717 0.599 1.00 0.00 H new ATOM 0 HD22 LEU A 181 1.212 3.253 0.005 1.00 0.00 H new ATOM 0 HD23 LEU A 181 2.138 3.217 1.524 1.00 0.00 H new ATOM 508 N LYS A 182 -0.377 6.851 3.271 1.00 0.00 N ATOM 509 CA LYS A 182 -1.095 8.085 3.568 1.00 0.00 C ATOM 510 C LYS A 182 -0.743 9.120 2.537 1.00 0.00 C ATOM 511 O LYS A 182 -1.617 9.748 1.961 1.00 0.00 O ATOM 512 CB LYS A 182 -0.776 8.631 4.962 1.00 0.00 C ATOM 513 CG LYS A 182 -1.908 8.440 5.957 1.00 0.00 C ATOM 514 CD LYS A 182 -1.603 9.078 7.300 1.00 0.00 C ATOM 515 CE LYS A 182 -0.753 8.179 8.175 1.00 0.00 C ATOM 516 NZ LYS A 182 -0.531 8.771 9.520 1.00 0.00 N ATOM 0 H LYS A 182 0.259 6.541 4.006 1.00 0.00 H new ATOM 0 HA LYS A 182 -2.161 7.858 3.544 1.00 0.00 H new ATOM 0 HB2 LYS A 182 0.119 8.138 5.342 1.00 0.00 H new ATOM 0 HB3 LYS A 182 -0.546 9.694 4.884 1.00 0.00 H new ATOM 0 HG2 LYS A 182 -2.823 8.871 5.551 1.00 0.00 H new ATOM 0 HG3 LYS A 182 -2.092 7.375 6.096 1.00 0.00 H new ATOM 0 HD2 LYS A 182 -1.086 10.025 7.143 1.00 0.00 H new ATOM 0 HD3 LYS A 182 -2.537 9.306 7.814 1.00 0.00 H new ATOM 0 HE2 LYS A 182 -1.239 7.209 8.280 1.00 0.00 H new ATOM 0 HE3 LYS A 182 0.208 8.004 7.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 182 0.054 8.128 10.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 182 -0.045 9.685 9.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 182 -1.447 8.915 9.991 1.00 0.00 H new ATOM 530 N LYS A 183 0.547 9.274 2.290 1.00 0.00 N ATOM 531 CA LYS A 183 1.009 10.186 1.265 1.00 0.00 C ATOM 532 C LYS A 183 0.473 9.750 -0.094 1.00 0.00 C ATOM 533 O LYS A 183 0.038 10.575 -0.890 1.00 0.00 O ATOM 534 CB LYS A 183 2.542 10.250 1.245 1.00 0.00 C ATOM 535 CG LYS A 183 3.109 11.237 0.229 1.00 0.00 C ATOM 536 CD LYS A 183 3.226 12.658 0.777 1.00 0.00 C ATOM 537 CE LYS A 183 1.894 13.225 1.247 1.00 0.00 C ATOM 538 NZ LYS A 183 2.008 14.651 1.646 1.00 0.00 N ATOM 0 H LYS A 183 1.289 8.779 2.785 1.00 0.00 H new ATOM 0 HA LYS A 183 0.634 11.185 1.489 1.00 0.00 H new ATOM 0 HB2 LYS A 183 2.897 10.523 2.239 1.00 0.00 H new ATOM 0 HB3 LYS A 183 2.934 9.256 1.029 1.00 0.00 H new ATOM 0 HG2 LYS A 183 4.093 10.895 -0.091 1.00 0.00 H new ATOM 0 HG3 LYS A 183 2.472 11.246 -0.655 1.00 0.00 H new ATOM 0 HD2 LYS A 183 3.931 12.664 1.608 1.00 0.00 H new ATOM 0 HD3 LYS A 183 3.639 13.307 0.004 1.00 0.00 H new ATOM 0 HE2 LYS A 183 1.157 13.129 0.450 1.00 0.00 H new ATOM 0 HE3 LYS A 183 1.528 12.640 2.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 1.079 14.999 1.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 2.692 14.740 2.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 2.332 15.214 0.834 1.00 0.00 H new ATOM 552 N ALA A 184 0.488 8.443 -0.335 1.00 0.00 N ATOM 553 CA ALA A 184 -0.022 7.872 -1.581 1.00 0.00 C ATOM 554 C ALA A 184 -1.460 8.325 -1.868 1.00 0.00 C ATOM 555 O ALA A 184 -1.739 8.909 -2.916 1.00 0.00 O ATOM 556 CB ALA A 184 0.048 6.353 -1.512 1.00 0.00 C ATOM 0 H ALA A 184 0.851 7.752 0.322 1.00 0.00 H new ATOM 0 HA ALA A 184 0.602 8.232 -2.399 1.00 0.00 H new ATOM 0 HB1 ALA A 184 -0.332 5.929 -2.441 1.00 0.00 H new ATOM 0 HB2 ALA A 184 1.083 6.043 -1.368 1.00 0.00 H new ATOM 0 HB3 ALA A 184 -0.556 5.998 -0.677 1.00 0.00 H new ATOM 562 N LEU A 185 -2.362 8.055 -0.933 1.00 0.00 N ATOM 563 CA LEU A 185 -3.771 8.403 -1.080 1.00 0.00 C ATOM 564 C LEU A 185 -3.989 9.907 -0.968 1.00 0.00 C ATOM 565 O LEU A 185 -4.761 10.484 -1.728 1.00 0.00 O ATOM 566 CB LEU A 185 -4.608 7.682 -0.020 1.00 0.00 C ATOM 567 CG LEU A 185 -4.679 6.163 -0.165 1.00 0.00 C ATOM 568 CD1 LEU A 185 -4.323 5.470 1.137 1.00 0.00 C ATOM 569 CD2 LEU A 185 -6.064 5.754 -0.600 1.00 0.00 C ATOM 0 H LEU A 185 -2.139 7.590 -0.053 1.00 0.00 H new ATOM 0 HA LEU A 185 -4.088 8.085 -2.073 1.00 0.00 H new ATOM 0 HB2 LEU A 185 -4.200 7.918 0.963 1.00 0.00 H new ATOM 0 HB3 LEU A 185 -5.622 8.081 -0.049 1.00 0.00 H new ATOM 0 HG LEU A 185 -3.954 5.860 -0.921 1.00 0.00 H new ATOM 0 HD11 LEU A 185 -4.382 4.390 1.002 1.00 0.00 H new ATOM 0 HD12 LEU A 185 -3.309 5.744 1.430 1.00 0.00 H new ATOM 0 HD13 LEU A 185 -5.021 5.778 1.916 1.00 0.00 H new ATOM 0 HD21 LEU A 185 -6.108 4.670 -0.702 1.00 0.00 H new ATOM 0 HD22 LEU A 185 -6.790 6.078 0.145 1.00 0.00 H new ATOM 0 HD23 LEU A 185 -6.296 6.218 -1.559 1.00 0.00 H new ATOM 581 N MET A 186 -3.299 10.540 -0.029 1.00 0.00 N ATOM 582 CA MET A 186 -3.478 11.970 0.226 1.00 0.00 C ATOM 583 C MET A 186 -3.013 12.826 -0.948 1.00 0.00 C ATOM 584 O MET A 186 -3.539 13.915 -1.171 1.00 0.00 O ATOM 585 CB MET A 186 -2.767 12.397 1.514 1.00 0.00 C ATOM 586 CG MET A 186 -3.660 12.307 2.738 1.00 0.00 C ATOM 587 SD MET A 186 -5.111 13.367 2.599 1.00 0.00 S ATOM 588 CE MET A 186 -6.011 12.888 4.070 1.00 0.00 C ATOM 0 H MET A 186 -2.609 10.089 0.571 1.00 0.00 H new ATOM 0 HA MET A 186 -4.548 12.135 0.350 1.00 0.00 H new ATOM 0 HB2 MET A 186 -1.889 11.769 1.664 1.00 0.00 H new ATOM 0 HB3 MET A 186 -2.411 13.421 1.404 1.00 0.00 H new ATOM 0 HG2 MET A 186 -3.978 11.274 2.879 1.00 0.00 H new ATOM 0 HG3 MET A 186 -3.090 12.588 3.623 1.00 0.00 H new ATOM 0 HE1 MET A 186 -6.939 13.457 4.130 1.00 0.00 H new ATOM 0 HE2 MET A 186 -6.240 11.823 4.026 1.00 0.00 H new ATOM 0 HE3 MET A 186 -5.403 13.092 4.951 1.00 0.00 H new ATOM 598 N MET A 187 -2.047 12.332 -1.713 1.00 0.00 N ATOM 599 CA MET A 187 -1.615 13.037 -2.919 1.00 0.00 C ATOM 600 C MET A 187 -2.591 12.769 -4.055 1.00 0.00 C ATOM 601 O MET A 187 -2.518 13.389 -5.114 1.00 0.00 O ATOM 602 CB MET A 187 -0.205 12.617 -3.352 1.00 0.00 C ATOM 603 CG MET A 187 0.893 13.020 -2.384 1.00 0.00 C ATOM 604 SD MET A 187 2.546 12.722 -3.044 1.00 0.00 S ATOM 605 CE MET A 187 2.457 10.972 -3.424 1.00 0.00 C ATOM 0 H MET A 187 -1.553 11.460 -1.526 1.00 0.00 H new ATOM 0 HA MET A 187 -1.595 14.102 -2.686 1.00 0.00 H new ATOM 0 HB2 MET A 187 -0.184 11.534 -3.477 1.00 0.00 H new ATOM 0 HB3 MET A 187 0.008 13.055 -4.327 1.00 0.00 H new ATOM 0 HG2 MET A 187 0.788 14.078 -2.142 1.00 0.00 H new ATOM 0 HG3 MET A 187 0.772 12.466 -1.453 1.00 0.00 H new ATOM 0 HE1 MET A 187 3.443 10.523 -3.306 1.00 0.00 H new ATOM 0 HE2 MET A 187 1.755 10.488 -2.746 1.00 0.00 H new ATOM 0 HE3 MET A 187 2.119 10.840 -4.452 1.00 0.00 H new ATOM 615 N ARG A 188 -3.502 11.836 -3.820 1.00 0.00 N ATOM 616 CA ARG A 188 -4.462 11.424 -4.826 1.00 0.00 C ATOM 617 C ARG A 188 -5.872 11.890 -4.478 1.00 0.00 C ATOM 618 O ARG A 188 -6.808 11.704 -5.257 1.00 0.00 O ATOM 619 CB ARG A 188 -4.396 9.901 -4.988 1.00 0.00 C ATOM 620 CG ARG A 188 -3.161 9.479 -5.761 1.00 0.00 C ATOM 621 CD ARG A 188 -3.172 8.013 -6.149 1.00 0.00 C ATOM 622 NE ARG A 188 -1.960 7.675 -6.888 1.00 0.00 N ATOM 623 CZ ARG A 188 -1.934 7.287 -8.162 1.00 0.00 C ATOM 624 NH1 ARG A 188 -3.061 7.155 -8.856 1.00 0.00 N ATOM 625 NH2 ARG A 188 -0.768 7.053 -8.746 1.00 0.00 N ATOM 0 H ARG A 188 -3.594 11.347 -2.930 1.00 0.00 H new ATOM 0 HA ARG A 188 -4.207 11.894 -5.776 1.00 0.00 H new ATOM 0 HB2 ARG A 188 -4.391 9.429 -4.005 1.00 0.00 H new ATOM 0 HB3 ARG A 188 -5.289 9.550 -5.506 1.00 0.00 H new ATOM 0 HG2 ARG A 188 -3.079 10.086 -6.662 1.00 0.00 H new ATOM 0 HG3 ARG A 188 -2.276 9.682 -5.158 1.00 0.00 H new ATOM 0 HD2 ARG A 188 -3.245 7.394 -5.255 1.00 0.00 H new ATOM 0 HD3 ARG A 188 -4.050 7.798 -6.759 1.00 0.00 H new ATOM 0 HE ARG A 188 -1.070 7.740 -6.394 1.00 0.00 H new ATOM 0 HH11 ARG A 188 -3.959 7.352 -8.413 1.00 0.00 H new ATOM 0 HH12 ARG A 188 -3.028 6.857 -9.831 1.00 0.00 H new ATOM 0 HH21 ARG A 188 0.098 7.170 -8.220 1.00 0.00 H new ATOM 0 HH22 ARG A 188 -0.737 6.755 -9.721 1.00 0.00 H new ATOM 639 N GLY A 189 -6.012 12.519 -3.317 1.00 0.00 N ATOM 640 CA GLY A 189 -7.308 13.009 -2.884 1.00 0.00 C ATOM 641 C GLY A 189 -8.149 11.920 -2.248 1.00 0.00 C ATOM 642 O GLY A 189 -9.374 12.028 -2.178 1.00 0.00 O ATOM 0 H GLY A 189 -5.248 12.699 -2.665 1.00 0.00 H new ATOM 0 HA2 GLY A 189 -7.168 13.821 -2.170 1.00 0.00 H new ATOM 0 HA3 GLY A 189 -7.841 13.425 -3.739 1.00 0.00 H new ATOM 646 N LEU A 190 -7.485 10.871 -1.787 1.00 0.00 N ATOM 647 CA LEU A 190 -8.152 9.740 -1.169 1.00 0.00 C ATOM 648 C LEU A 190 -7.754 9.640 0.294 1.00 0.00 C ATOM 649 O LEU A 190 -6.861 10.351 0.755 1.00 0.00 O ATOM 650 CB LEU A 190 -7.794 8.439 -1.896 1.00 0.00 C ATOM 651 CG LEU A 190 -8.596 8.138 -3.170 1.00 0.00 C ATOM 652 CD1 LEU A 190 -8.311 9.147 -4.265 1.00 0.00 C ATOM 653 CD2 LEU A 190 -8.294 6.743 -3.662 1.00 0.00 C ATOM 0 H LEU A 190 -6.470 10.782 -1.832 1.00 0.00 H new ATOM 0 HA LEU A 190 -9.229 9.893 -1.240 1.00 0.00 H new ATOM 0 HB2 LEU A 190 -6.736 8.470 -2.155 1.00 0.00 H new ATOM 0 HB3 LEU A 190 -7.928 7.609 -1.202 1.00 0.00 H new ATOM 0 HG LEU A 190 -9.654 8.210 -2.916 1.00 0.00 H new ATOM 0 HD11 LEU A 190 -8.898 8.899 -5.150 1.00 0.00 H new ATOM 0 HD12 LEU A 190 -8.580 10.145 -3.919 1.00 0.00 H new ATOM 0 HD13 LEU A 190 -7.250 9.123 -4.515 1.00 0.00 H new ATOM 0 HD21 LEU A 190 -8.870 6.543 -4.566 1.00 0.00 H new ATOM 0 HD22 LEU A 190 -7.230 6.658 -3.883 1.00 0.00 H new ATOM 0 HD23 LEU A 190 -8.564 6.019 -2.893 1.00 0.00 H new ATOM 665 N ILE A 191 -8.412 8.752 1.018 1.00 0.00 N ATOM 666 CA ILE A 191 -8.147 8.582 2.436 1.00 0.00 C ATOM 667 C ILE A 191 -7.898 7.120 2.787 1.00 0.00 C ATOM 668 O ILE A 191 -8.640 6.232 2.366 1.00 0.00 O ATOM 669 CB ILE A 191 -9.304 9.121 3.306 1.00 0.00 C ATOM 670 CG1 ILE A 191 -10.642 8.526 2.853 1.00 0.00 C ATOM 671 CG2 ILE A 191 -9.341 10.639 3.232 1.00 0.00 C ATOM 672 CD1 ILE A 191 -11.771 8.722 3.843 1.00 0.00 C ATOM 0 H ILE A 191 -9.135 8.136 0.647 1.00 0.00 H new ATOM 0 HA ILE A 191 -7.248 9.160 2.650 1.00 0.00 H new ATOM 0 HB ILE A 191 -9.135 8.823 4.341 1.00 0.00 H new ATOM 0 HG12 ILE A 191 -10.925 8.977 1.902 1.00 0.00 H new ATOM 0 HG13 ILE A 191 -10.511 7.459 2.674 1.00 0.00 H new ATOM 0 HG21 ILE A 191 -10.159 11.013 3.847 1.00 0.00 H new ATOM 0 HG22 ILE A 191 -8.397 11.044 3.597 1.00 0.00 H new ATOM 0 HG23 ILE A 191 -9.493 10.949 2.198 1.00 0.00 H new ATOM 0 HD11 ILE A 191 -12.683 8.273 3.449 1.00 0.00 H new ATOM 0 HD12 ILE A 191 -11.512 8.246 4.789 1.00 0.00 H new ATOM 0 HD13 ILE A 191 -11.932 9.788 4.005 1.00 0.00 H new ATOM 684 N PRO A 192 -6.834 6.855 3.566 1.00 0.00 N ATOM 685 CA PRO A 192 -6.489 5.503 4.014 1.00 0.00 C ATOM 686 C PRO A 192 -7.500 4.954 5.016 1.00 0.00 C ATOM 687 O PRO A 192 -7.604 3.742 5.212 1.00 0.00 O ATOM 688 CB PRO A 192 -5.129 5.670 4.705 1.00 0.00 C ATOM 689 CG PRO A 192 -4.648 7.029 4.333 1.00 0.00 C ATOM 690 CD PRO A 192 -5.869 7.851 4.056 1.00 0.00 C ATOM 0 HA PRO A 192 -6.477 4.803 3.179 1.00 0.00 H new ATOM 0 HB2 PRO A 192 -5.225 5.572 5.786 1.00 0.00 H new ATOM 0 HB3 PRO A 192 -4.427 4.903 4.377 1.00 0.00 H new ATOM 0 HG2 PRO A 192 -4.060 7.467 5.140 1.00 0.00 H new ATOM 0 HG3 PRO A 192 -4.002 6.985 3.456 1.00 0.00 H new ATOM 0 HD2 PRO A 192 -6.229 8.354 4.953 1.00 0.00 H new ATOM 0 HD3 PRO A 192 -5.675 8.624 3.313 1.00 0.00 H new ATOM 698 N GLU A 193 -8.237 5.863 5.647 1.00 0.00 N ATOM 699 CA GLU A 193 -9.212 5.506 6.672 1.00 0.00 C ATOM 700 C GLU A 193 -10.259 4.539 6.141 1.00 0.00 C ATOM 701 O GLU A 193 -10.634 3.581 6.815 1.00 0.00 O ATOM 702 CB GLU A 193 -9.901 6.757 7.212 1.00 0.00 C ATOM 703 CG GLU A 193 -9.072 7.526 8.226 1.00 0.00 C ATOM 704 CD GLU A 193 -7.740 7.984 7.675 1.00 0.00 C ATOM 705 OE1 GLU A 193 -7.729 8.892 6.818 1.00 0.00 O ATOM 706 OE2 GLU A 193 -6.699 7.437 8.100 1.00 0.00 O ATOM 0 H GLU A 193 -8.176 6.864 5.463 1.00 0.00 H new ATOM 0 HA GLU A 193 -8.668 5.012 7.477 1.00 0.00 H new ATOM 0 HB2 GLU A 193 -10.141 7.417 6.378 1.00 0.00 H new ATOM 0 HB3 GLU A 193 -10.846 6.469 7.673 1.00 0.00 H new ATOM 0 HG2 GLU A 193 -9.637 8.395 8.565 1.00 0.00 H new ATOM 0 HG3 GLU A 193 -8.901 6.897 9.099 1.00 0.00 H new ATOM 713 N CYS A 194 -10.717 4.787 4.929 1.00 0.00 N ATOM 714 CA CYS A 194 -11.760 3.981 4.330 1.00 0.00 C ATOM 715 C CYS A 194 -11.156 2.923 3.425 1.00 0.00 C ATOM 716 O CYS A 194 -11.839 2.340 2.595 1.00 0.00 O ATOM 717 CB CYS A 194 -12.683 4.883 3.528 1.00 0.00 C ATOM 718 SG CYS A 194 -11.926 5.572 2.038 1.00 0.00 S ATOM 0 H CYS A 194 -10.379 5.546 4.337 1.00 0.00 H new ATOM 0 HA CYS A 194 -12.325 3.480 5.116 1.00 0.00 H new ATOM 0 HB2 CYS A 194 -13.570 4.317 3.244 1.00 0.00 H new ATOM 0 HB3 CYS A 194 -13.018 5.702 4.165 1.00 0.00 H new ATOM 0 HG CYS A 194 -10.885 4.864 1.713 1.00 0.00 H new ATOM 724 N CYS A 195 -9.875 2.681 3.591 1.00 0.00 N ATOM 725 CA CYS A 195 -9.166 1.749 2.730 1.00 0.00 C ATOM 726 C CYS A 195 -8.443 0.679 3.536 1.00 0.00 C ATOM 727 O CYS A 195 -8.310 0.781 4.758 1.00 0.00 O ATOM 728 CB CYS A 195 -8.172 2.500 1.847 1.00 0.00 C ATOM 729 SG CYS A 195 -8.928 3.739 0.771 1.00 0.00 S ATOM 0 H CYS A 195 -9.299 3.114 4.313 1.00 0.00 H new ATOM 0 HA CYS A 195 -9.904 1.251 2.101 1.00 0.00 H new ATOM 0 HB2 CYS A 195 -7.435 2.989 2.484 1.00 0.00 H new ATOM 0 HB3 CYS A 195 -7.634 1.780 1.231 1.00 0.00 H new ATOM 0 HG CYS A 195 -8.692 4.927 1.244 1.00 0.00 H new ATOM 735 N ALA A 196 -8.003 -0.357 2.840 1.00 0.00 N ATOM 736 CA ALA A 196 -7.219 -1.423 3.442 1.00 0.00 C ATOM 737 C ALA A 196 -6.211 -1.956 2.442 1.00 0.00 C ATOM 738 O ALA A 196 -6.370 -1.773 1.237 1.00 0.00 O ATOM 739 CB ALA A 196 -8.125 -2.539 3.924 1.00 0.00 C ATOM 0 H ALA A 196 -8.179 -0.482 1.843 1.00 0.00 H new ATOM 0 HA ALA A 196 -6.682 -1.020 4.301 1.00 0.00 H new ATOM 0 HB1 ALA A 196 -7.522 -3.329 4.372 1.00 0.00 H new ATOM 0 HB2 ALA A 196 -8.821 -2.148 4.667 1.00 0.00 H new ATOM 0 HB3 ALA A 196 -8.684 -2.943 3.080 1.00 0.00 H new ATOM 745 N VAL A 197 -5.178 -2.613 2.946 1.00 0.00 N ATOM 746 CA VAL A 197 -4.096 -3.080 2.099 1.00 0.00 C ATOM 747 C VAL A 197 -4.030 -4.601 2.082 1.00 0.00 C ATOM 748 O VAL A 197 -4.215 -5.248 3.108 1.00 0.00 O ATOM 749 CB VAL A 197 -2.737 -2.528 2.569 1.00 0.00 C ATOM 750 CG1 VAL A 197 -1.680 -2.785 1.520 1.00 0.00 C ATOM 751 CG2 VAL A 197 -2.834 -1.045 2.868 1.00 0.00 C ATOM 0 H VAL A 197 -5.068 -2.834 3.936 1.00 0.00 H new ATOM 0 HA VAL A 197 -4.302 -2.715 1.093 1.00 0.00 H new ATOM 0 HB VAL A 197 -2.454 -3.043 3.487 1.00 0.00 H new ATOM 0 HG11 VAL A 197 -0.724 -2.391 1.863 1.00 0.00 H new ATOM 0 HG12 VAL A 197 -1.590 -3.858 1.349 1.00 0.00 H new ATOM 0 HG13 VAL A 197 -1.963 -2.292 0.590 1.00 0.00 H new ATOM 0 HG21 VAL A 197 -1.863 -0.676 3.198 1.00 0.00 H new ATOM 0 HG22 VAL A 197 -3.138 -0.511 1.967 1.00 0.00 H new ATOM 0 HG23 VAL A 197 -3.571 -0.880 3.654 1.00 0.00 H new ATOM 761 N TYR A 198 -3.790 -5.162 0.906 1.00 0.00 N ATOM 762 CA TYR A 198 -3.579 -6.594 0.759 1.00 0.00 C ATOM 763 C TYR A 198 -2.310 -6.861 -0.043 1.00 0.00 C ATOM 764 O TYR A 198 -1.964 -6.091 -0.939 1.00 0.00 O ATOM 765 CB TYR A 198 -4.745 -7.257 0.020 1.00 0.00 C ATOM 766 CG TYR A 198 -6.079 -7.190 0.720 1.00 0.00 C ATOM 767 CD1 TYR A 198 -6.619 -8.326 1.296 1.00 0.00 C ATOM 768 CD2 TYR A 198 -6.805 -6.009 0.790 1.00 0.00 C ATOM 769 CE1 TYR A 198 -7.843 -8.295 1.926 1.00 0.00 C ATOM 770 CE2 TYR A 198 -8.031 -5.964 1.422 1.00 0.00 C ATOM 771 CZ TYR A 198 -8.547 -7.111 1.988 1.00 0.00 C ATOM 772 OH TYR A 198 -9.769 -7.071 2.617 1.00 0.00 O ATOM 0 H TYR A 198 -3.736 -4.640 0.031 1.00 0.00 H new ATOM 0 HA TYR A 198 -3.497 -7.010 1.763 1.00 0.00 H new ATOM 0 HB2 TYR A 198 -4.844 -6.789 -0.960 1.00 0.00 H new ATOM 0 HB3 TYR A 198 -4.496 -8.304 -0.150 1.00 0.00 H new ATOM 0 HD1 TYR A 198 -6.070 -9.255 1.251 1.00 0.00 H new ATOM 0 HD2 TYR A 198 -6.404 -5.111 0.343 1.00 0.00 H new ATOM 0 HE1 TYR A 198 -8.249 -9.192 2.369 1.00 0.00 H new ATOM 0 HE2 TYR A 198 -8.583 -5.037 1.473 1.00 0.00 H new ATOM 0 HH TYR A 198 -10.130 -6.161 2.572 1.00 0.00 H new ATOM 782 N ARG A 199 -1.623 -7.941 0.281 1.00 0.00 N ATOM 783 CA ARG A 199 -0.558 -8.455 -0.572 1.00 0.00 C ATOM 784 C ARG A 199 -0.957 -9.846 -1.051 1.00 0.00 C ATOM 785 O ARG A 199 -1.130 -10.762 -0.252 1.00 0.00 O ATOM 786 CB ARG A 199 0.798 -8.472 0.160 1.00 0.00 C ATOM 787 CG ARG A 199 0.780 -9.166 1.509 1.00 0.00 C ATOM 788 CD ARG A 199 2.059 -8.888 2.282 1.00 0.00 C ATOM 789 NE ARG A 199 3.225 -9.541 1.693 1.00 0.00 N ATOM 790 CZ ARG A 199 3.609 -10.787 1.971 1.00 0.00 C ATOM 791 NH1 ARG A 199 2.937 -11.519 2.852 1.00 0.00 N ATOM 792 NH2 ARG A 199 4.681 -11.292 1.377 1.00 0.00 N ATOM 0 H ARG A 199 -1.781 -8.483 1.130 1.00 0.00 H new ATOM 0 HA ARG A 199 -0.429 -7.797 -1.431 1.00 0.00 H new ATOM 0 HB2 ARG A 199 1.533 -8.964 -0.477 1.00 0.00 H new ATOM 0 HB3 ARG A 199 1.133 -7.444 0.299 1.00 0.00 H new ATOM 0 HG2 ARG A 199 -0.079 -8.825 2.086 1.00 0.00 H new ATOM 0 HG3 ARG A 199 0.663 -10.240 1.368 1.00 0.00 H new ATOM 0 HD2 ARG A 199 2.230 -7.812 2.319 1.00 0.00 H new ATOM 0 HD3 ARG A 199 1.938 -9.227 3.311 1.00 0.00 H new ATOM 0 HE ARG A 199 3.782 -9.009 1.025 1.00 0.00 H new ATOM 0 HH11 ARG A 199 2.120 -11.129 3.322 1.00 0.00 H new ATOM 0 HH12 ARG A 199 3.238 -12.471 3.059 1.00 0.00 H new ATOM 0 HH21 ARG A 199 5.208 -10.728 0.711 1.00 0.00 H new ATOM 0 HH22 ARG A 199 4.979 -12.245 1.586 1.00 0.00 H new ATOM 876 N LYS A 205 -5.219 -13.406 -0.712 1.00 0.00 N ATOM 877 CA LYS A 205 -5.233 -12.005 -0.357 1.00 0.00 C ATOM 878 C LYS A 205 -4.846 -11.850 1.105 1.00 0.00 C ATOM 879 O LYS A 205 -5.571 -12.291 1.995 1.00 0.00 O ATOM 880 CB LYS A 205 -6.610 -11.395 -0.618 1.00 0.00 C ATOM 881 CG LYS A 205 -7.122 -11.609 -2.025 1.00 0.00 C ATOM 882 CD LYS A 205 -8.370 -10.790 -2.298 1.00 0.00 C ATOM 883 CE LYS A 205 -8.069 -9.300 -2.371 1.00 0.00 C ATOM 884 NZ LYS A 205 -9.265 -8.503 -2.762 1.00 0.00 N ATOM 0 HA LYS A 205 -4.510 -11.473 -0.976 1.00 0.00 H new ATOM 0 HB2 LYS A 205 -7.324 -11.822 0.086 1.00 0.00 H new ATOM 0 HB3 LYS A 205 -6.566 -10.325 -0.418 1.00 0.00 H new ATOM 0 HG2 LYS A 205 -6.345 -11.338 -2.740 1.00 0.00 H new ATOM 0 HG3 LYS A 205 -7.340 -12.666 -2.176 1.00 0.00 H new ATOM 0 HD2 LYS A 205 -8.819 -11.116 -3.236 1.00 0.00 H new ATOM 0 HD3 LYS A 205 -9.103 -10.974 -1.513 1.00 0.00 H new ATOM 0 HE2 LYS A 205 -7.706 -8.956 -1.402 1.00 0.00 H new ATOM 0 HE3 LYS A 205 -7.268 -9.128 -3.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 205 -8.984 -7.516 -2.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 205 -9.677 -8.899 -3.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 205 -9.970 -8.537 -1.998 1.00 0.00 H new ATOM 898 N LYS A 206 -3.689 -11.253 1.347 1.00 0.00 N ATOM 899 CA LYS A 206 -3.186 -11.083 2.697 1.00 0.00 C ATOM 900 C LYS A 206 -3.420 -9.655 3.164 1.00 0.00 C ATOM 901 O LYS A 206 -2.702 -8.745 2.752 1.00 0.00 O ATOM 902 CB LYS A 206 -1.691 -11.394 2.736 1.00 0.00 C ATOM 903 CG LYS A 206 -1.323 -12.762 2.183 1.00 0.00 C ATOM 904 CD LYS A 206 -1.913 -13.890 3.013 1.00 0.00 C ATOM 905 CE LYS A 206 -1.589 -15.242 2.401 1.00 0.00 C ATOM 906 NZ LYS A 206 -2.144 -16.367 3.197 1.00 0.00 N ATOM 0 H LYS A 206 -3.080 -10.877 0.620 1.00 0.00 H new ATOM 0 HA LYS A 206 -3.716 -11.768 3.359 1.00 0.00 H new ATOM 0 HB2 LYS A 206 -1.158 -10.630 2.170 1.00 0.00 H new ATOM 0 HB3 LYS A 206 -1.344 -11.326 3.767 1.00 0.00 H new ATOM 0 HG2 LYS A 206 -1.677 -12.845 1.155 1.00 0.00 H new ATOM 0 HG3 LYS A 206 -0.238 -12.862 2.155 1.00 0.00 H new ATOM 0 HD2 LYS A 206 -1.520 -13.843 4.029 1.00 0.00 H new ATOM 0 HD3 LYS A 206 -2.994 -13.768 3.083 1.00 0.00 H new ATOM 0 HE2 LYS A 206 -1.988 -15.285 1.388 1.00 0.00 H new ATOM 0 HE3 LYS A 206 -0.508 -15.354 2.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 206 -1.898 -17.269 2.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 206 -1.744 -16.343 4.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 206 -3.179 -16.277 3.251 1.00 0.00 H new ATOM 920 N PRO A 207 -4.436 -9.429 4.009 1.00 0.00 N ATOM 921 CA PRO A 207 -4.735 -8.100 4.521 1.00 0.00 C ATOM 922 C PRO A 207 -3.663 -7.616 5.483 1.00 0.00 C ATOM 923 O PRO A 207 -3.398 -8.230 6.519 1.00 0.00 O ATOM 924 CB PRO A 207 -6.076 -8.247 5.233 1.00 0.00 C ATOM 925 CG PRO A 207 -6.572 -9.611 4.888 1.00 0.00 C ATOM 926 CD PRO A 207 -5.367 -10.433 4.528 1.00 0.00 C ATOM 0 HA PRO A 207 -4.769 -7.361 3.721 1.00 0.00 H new ATOM 0 HB2 PRO A 207 -5.961 -8.134 6.311 1.00 0.00 H new ATOM 0 HB3 PRO A 207 -6.779 -7.481 4.905 1.00 0.00 H new ATOM 0 HG2 PRO A 207 -7.104 -10.053 5.730 1.00 0.00 H new ATOM 0 HG3 PRO A 207 -7.274 -9.568 4.055 1.00 0.00 H new ATOM 0 HD2 PRO A 207 -4.959 -10.954 5.394 1.00 0.00 H new ATOM 0 HD3 PRO A 207 -5.602 -11.191 3.781 1.00 0.00 H new ATOM 934 N ILE A 208 -3.053 -6.519 5.109 1.00 0.00 N ATOM 935 CA ILE A 208 -1.932 -5.948 5.822 1.00 0.00 C ATOM 936 C ILE A 208 -2.392 -4.894 6.824 1.00 0.00 C ATOM 937 O ILE A 208 -3.467 -4.307 6.679 1.00 0.00 O ATOM 938 CB ILE A 208 -0.974 -5.319 4.797 1.00 0.00 C ATOM 939 CG1 ILE A 208 -0.432 -6.402 3.880 1.00 0.00 C ATOM 940 CG2 ILE A 208 0.169 -4.588 5.466 1.00 0.00 C ATOM 941 CD1 ILE A 208 0.085 -5.880 2.568 1.00 0.00 C ATOM 0 H ILE A 208 -3.326 -5.985 4.284 1.00 0.00 H new ATOM 0 HA ILE A 208 -1.426 -6.734 6.383 1.00 0.00 H new ATOM 0 HB ILE A 208 -1.535 -4.586 4.217 1.00 0.00 H new ATOM 0 HG12 ILE A 208 0.371 -6.931 4.392 1.00 0.00 H new ATOM 0 HG13 ILE A 208 -1.220 -7.130 3.686 1.00 0.00 H new ATOM 0 HG21 ILE A 208 0.821 -4.159 4.705 1.00 0.00 H new ATOM 0 HG22 ILE A 208 -0.227 -3.791 6.095 1.00 0.00 H new ATOM 0 HG23 ILE A 208 0.738 -5.286 6.080 1.00 0.00 H new ATOM 0 HD11 ILE A 208 0.455 -6.710 1.967 1.00 0.00 H new ATOM 0 HD12 ILE A 208 -0.721 -5.376 2.034 1.00 0.00 H new ATOM 0 HD13 ILE A 208 0.896 -5.175 2.751 1.00 0.00 H new ATOM 953 N GLY A 209 -1.576 -4.675 7.840 1.00 0.00 N ATOM 954 CA GLY A 209 -1.850 -3.652 8.819 1.00 0.00 C ATOM 955 C GLY A 209 -1.189 -2.348 8.442 1.00 0.00 C ATOM 956 O GLY A 209 -0.027 -2.333 8.039 1.00 0.00 O ATOM 0 H GLY A 209 -0.716 -5.198 8.004 1.00 0.00 H new ATOM 0 HA2 GLY A 209 -2.927 -3.506 8.905 1.00 0.00 H new ATOM 0 HA3 GLY A 209 -1.493 -3.975 9.797 1.00 0.00 H new ATOM 960 N TRP A 210 -1.919 -1.252 8.557 1.00 0.00 N ATOM 961 CA TRP A 210 -1.375 0.052 8.213 1.00 0.00 C ATOM 962 C TRP A 210 -0.231 0.423 9.152 1.00 0.00 C ATOM 963 O TRP A 210 0.788 0.963 8.727 1.00 0.00 O ATOM 964 CB TRP A 210 -2.459 1.126 8.267 1.00 0.00 C ATOM 965 CG TRP A 210 -3.532 0.968 7.240 1.00 0.00 C ATOM 966 CD1 TRP A 210 -4.651 0.199 7.338 1.00 0.00 C ATOM 967 CD2 TRP A 210 -3.599 1.613 5.966 1.00 0.00 C ATOM 968 NE1 TRP A 210 -5.406 0.317 6.201 1.00 0.00 N ATOM 969 CE2 TRP A 210 -4.782 1.180 5.340 1.00 0.00 C ATOM 970 CE3 TRP A 210 -2.772 2.511 5.292 1.00 0.00 C ATOM 971 CZ2 TRP A 210 -5.156 1.616 4.073 1.00 0.00 C ATOM 972 CZ3 TRP A 210 -3.147 2.944 4.036 1.00 0.00 C ATOM 973 CH2 TRP A 210 -4.328 2.497 3.437 1.00 0.00 C ATOM 0 H TRP A 210 -2.885 -1.238 8.884 1.00 0.00 H new ATOM 0 HA TRP A 210 -0.991 -0.005 7.194 1.00 0.00 H new ATOM 0 HB2 TRP A 210 -2.915 1.116 9.257 1.00 0.00 H new ATOM 0 HB3 TRP A 210 -1.993 2.103 8.141 1.00 0.00 H new ATOM 0 HD1 TRP A 210 -4.907 -0.415 8.189 1.00 0.00 H new ATOM 0 HE1 TRP A 210 -6.290 -0.161 6.024 1.00 0.00 H new ATOM 0 HE3 TRP A 210 -1.856 2.861 5.744 1.00 0.00 H new ATOM 0 HZ2 TRP A 210 -6.068 1.270 3.609 1.00 0.00 H new ATOM 0 HZ3 TRP A 210 -2.516 3.642 3.506 1.00 0.00 H new ATOM 0 HH2 TRP A 210 -4.591 2.855 2.453 1.00 0.00 H new ATOM 984 N ASP A 211 -0.397 0.120 10.432 1.00 0.00 N ATOM 985 CA ASP A 211 0.639 0.396 11.428 1.00 0.00 C ATOM 986 C ASP A 211 1.810 -0.581 11.323 1.00 0.00 C ATOM 987 O ASP A 211 2.713 -0.568 12.161 1.00 0.00 O ATOM 988 CB ASP A 211 0.075 0.356 12.848 1.00 0.00 C ATOM 989 CG ASP A 211 -0.383 -1.029 13.266 1.00 0.00 C ATOM 990 OD1 ASP A 211 -1.519 -1.414 12.916 1.00 0.00 O ATOM 991 OD2 ASP A 211 0.383 -1.731 13.959 1.00 0.00 O ATOM 0 H ASP A 211 -1.238 -0.317 10.809 1.00 0.00 H new ATOM 0 HA ASP A 211 1.005 1.401 11.216 1.00 0.00 H new ATOM 0 HB2 ASP A 211 0.836 0.707 13.545 1.00 0.00 H new ATOM 0 HB3 ASP A 211 -0.765 1.047 12.919 1.00 0.00 H new ATOM 996 N THR A 212 1.791 -1.427 10.309 1.00 0.00 N ATOM 997 CA THR A 212 2.925 -2.283 10.015 1.00 0.00 C ATOM 998 C THR A 212 3.968 -1.490 9.234 1.00 0.00 C ATOM 999 O THR A 212 3.620 -0.611 8.456 1.00 0.00 O ATOM 1000 CB THR A 212 2.483 -3.513 9.198 1.00 0.00 C ATOM 1001 OG1 THR A 212 1.529 -4.278 9.948 1.00 0.00 O ATOM 1002 CG2 THR A 212 3.672 -4.390 8.837 1.00 0.00 C ATOM 0 H THR A 212 1.001 -1.539 9.674 1.00 0.00 H new ATOM 0 HA THR A 212 3.355 -2.632 10.954 1.00 0.00 H new ATOM 0 HB THR A 212 2.026 -3.160 8.274 1.00 0.00 H new ATOM 0 HG1 THR A 212 1.250 -5.058 9.424 1.00 0.00 H new ATOM 0 HG21 THR A 212 3.329 -5.249 8.261 1.00 0.00 H new ATOM 0 HG22 THR A 212 4.381 -3.815 8.242 1.00 0.00 H new ATOM 0 HG23 THR A 212 4.159 -4.736 9.749 1.00 0.00 H new ATOM 1010 N ASP A 213 5.242 -1.774 9.469 1.00 0.00 N ATOM 1011 CA ASP A 213 6.315 -1.093 8.753 1.00 0.00 C ATOM 1012 C ASP A 213 6.315 -1.526 7.289 1.00 0.00 C ATOM 1013 O ASP A 213 6.274 -2.720 6.989 1.00 0.00 O ATOM 1014 CB ASP A 213 7.670 -1.415 9.393 1.00 0.00 C ATOM 1015 CG ASP A 213 8.771 -0.460 8.967 1.00 0.00 C ATOM 1016 OD1 ASP A 213 9.224 -0.537 7.807 1.00 0.00 O ATOM 1017 OD2 ASP A 213 9.212 0.354 9.806 1.00 0.00 O ATOM 0 H ASP A 213 5.558 -2.468 10.147 1.00 0.00 H new ATOM 0 HA ASP A 213 6.149 -0.017 8.810 1.00 0.00 H new ATOM 0 HB2 ASP A 213 7.569 -1.384 10.478 1.00 0.00 H new ATOM 0 HB3 ASP A 213 7.957 -2.433 9.129 1.00 0.00 H new ATOM 1022 N ILE A 214 6.370 -0.557 6.380 1.00 0.00 N ATOM 1023 CA ILE A 214 6.261 -0.843 4.948 1.00 0.00 C ATOM 1024 C ILE A 214 7.539 -1.487 4.410 1.00 0.00 C ATOM 1025 O ILE A 214 7.532 -2.109 3.348 1.00 0.00 O ATOM 1026 CB ILE A 214 5.846 0.419 4.115 1.00 0.00 C ATOM 1027 CG1 ILE A 214 6.618 0.523 2.787 1.00 0.00 C ATOM 1028 CG2 ILE A 214 6.004 1.700 4.915 1.00 0.00 C ATOM 1029 CD1 ILE A 214 6.268 1.747 1.964 1.00 0.00 C ATOM 0 H ILE A 214 6.489 0.431 6.606 1.00 0.00 H new ATOM 0 HA ILE A 214 5.454 -1.566 4.830 1.00 0.00 H new ATOM 0 HB ILE A 214 4.790 0.290 3.878 1.00 0.00 H new ATOM 0 HG12 ILE A 214 7.687 0.535 3.000 1.00 0.00 H new ATOM 0 HG13 ILE A 214 6.421 -0.370 2.193 1.00 0.00 H new ATOM 0 HG21 ILE A 214 5.706 2.551 4.302 1.00 0.00 H new ATOM 0 HG22 ILE A 214 5.374 1.654 5.803 1.00 0.00 H new ATOM 0 HG23 ILE A 214 7.046 1.816 5.215 1.00 0.00 H new ATOM 0 HD11 ILE A 214 6.854 1.747 1.045 1.00 0.00 H new ATOM 0 HD12 ILE A 214 5.206 1.728 1.718 1.00 0.00 H new ATOM 0 HD13 ILE A 214 6.492 2.647 2.537 1.00 0.00 H new ATOM 1041 N SER A 215 8.619 -1.406 5.179 1.00 0.00 N ATOM 1042 CA SER A 215 9.871 -2.044 4.791 1.00 0.00 C ATOM 1043 C SER A 215 9.751 -3.565 4.886 1.00 0.00 C ATOM 1044 O SER A 215 10.626 -4.302 4.426 1.00 0.00 O ATOM 1045 CB SER A 215 11.016 -1.543 5.664 1.00 0.00 C ATOM 1046 OG SER A 215 11.092 -0.133 5.615 1.00 0.00 O ATOM 0 H SER A 215 8.653 -0.908 6.069 1.00 0.00 H new ATOM 0 HA SER A 215 10.085 -1.781 3.755 1.00 0.00 H new ATOM 0 HB2 SER A 215 10.867 -1.870 6.693 1.00 0.00 H new ATOM 0 HB3 SER A 215 11.957 -1.976 5.325 1.00 0.00 H new ATOM 0 HG SER A 215 10.410 0.252 6.204 1.00 0.00 H new ATOM 1052 N TRP A 216 8.664 -4.032 5.489 1.00 0.00 N ATOM 1053 CA TRP A 216 8.352 -5.452 5.498 1.00 0.00 C ATOM 1054 C TRP A 216 7.834 -5.865 4.126 1.00 0.00 C ATOM 1055 O TRP A 216 7.983 -7.009 3.702 1.00 0.00 O ATOM 1056 CB TRP A 216 7.298 -5.778 6.562 1.00 0.00 C ATOM 1057 CG TRP A 216 7.782 -5.622 7.972 1.00 0.00 C ATOM 1058 CD1 TRP A 216 8.816 -4.845 8.407 1.00 0.00 C ATOM 1059 CD2 TRP A 216 7.240 -6.256 9.136 1.00 0.00 C ATOM 1060 NE1 TRP A 216 8.950 -4.959 9.769 1.00 0.00 N ATOM 1061 CE2 TRP A 216 7.995 -5.820 10.240 1.00 0.00 C ATOM 1062 CE3 TRP A 216 6.188 -7.153 9.351 1.00 0.00 C ATOM 1063 CZ2 TRP A 216 7.732 -6.248 11.537 1.00 0.00 C ATOM 1064 CZ3 TRP A 216 5.929 -7.578 10.640 1.00 0.00 C ATOM 1065 CH2 TRP A 216 6.698 -7.123 11.719 1.00 0.00 C ATOM 0 H TRP A 216 7.986 -3.447 5.977 1.00 0.00 H new ATOM 0 HA TRP A 216 9.262 -6.003 5.736 1.00 0.00 H new ATOM 0 HB2 TRP A 216 6.434 -5.131 6.412 1.00 0.00 H new ATOM 0 HB3 TRP A 216 6.957 -6.803 6.418 1.00 0.00 H new ATOM 0 HD1 TRP A 216 9.438 -4.230 7.773 1.00 0.00 H new ATOM 0 HE1 TRP A 216 9.648 -4.480 10.338 1.00 0.00 H new ATOM 0 HE3 TRP A 216 5.589 -7.507 8.525 1.00 0.00 H new ATOM 0 HZ2 TRP A 216 8.324 -5.901 12.371 1.00 0.00 H new ATOM 0 HZ3 TRP A 216 5.121 -8.272 10.819 1.00 0.00 H new ATOM 0 HH2 TRP A 216 6.469 -7.471 12.715 1.00 0.00 H new ATOM 1076 N LEU A 217 7.248 -4.898 3.433 1.00 0.00 N ATOM 1077 CA LEU A 217 6.587 -5.128 2.155 1.00 0.00 C ATOM 1078 C LEU A 217 7.384 -4.476 1.028 1.00 0.00 C ATOM 1079 O LEU A 217 6.856 -4.218 -0.054 1.00 0.00 O ATOM 1080 CB LEU A 217 5.177 -4.535 2.218 1.00 0.00 C ATOM 1081 CG LEU A 217 4.447 -4.785 3.542 1.00 0.00 C ATOM 1082 CD1 LEU A 217 3.292 -3.822 3.704 1.00 0.00 C ATOM 1083 CD2 LEU A 217 3.940 -6.214 3.615 1.00 0.00 C ATOM 0 H LEU A 217 7.218 -3.927 3.743 1.00 0.00 H new ATOM 0 HA LEU A 217 6.527 -6.198 1.957 1.00 0.00 H new ATOM 0 HB2 LEU A 217 5.240 -3.460 2.048 1.00 0.00 H new ATOM 0 HB3 LEU A 217 4.583 -4.952 1.405 1.00 0.00 H new ATOM 0 HG LEU A 217 5.158 -4.623 4.353 1.00 0.00 H new ATOM 0 HD11 LEU A 217 2.787 -4.016 4.650 1.00 0.00 H new ATOM 0 HD12 LEU A 217 3.668 -2.799 3.696 1.00 0.00 H new ATOM 0 HD13 LEU A 217 2.588 -3.956 2.883 1.00 0.00 H new ATOM 0 HD21 LEU A 217 3.425 -6.369 4.563 1.00 0.00 H new ATOM 0 HD22 LEU A 217 3.249 -6.397 2.792 1.00 0.00 H new ATOM 0 HD23 LEU A 217 4.782 -6.903 3.542 1.00 0.00 H new ATOM 1095 N THR A 218 8.654 -4.197 1.309 1.00 0.00 N ATOM 1096 CA THR A 218 9.550 -3.575 0.347 1.00 0.00 C ATOM 1097 C THR A 218 9.549 -4.297 -0.987 1.00 0.00 C ATOM 1098 O THR A 218 9.932 -5.466 -1.092 1.00 0.00 O ATOM 1099 CB THR A 218 10.994 -3.516 0.882 1.00 0.00 C ATOM 1100 OG1 THR A 218 11.048 -2.726 2.073 1.00 0.00 O ATOM 1101 CG2 THR A 218 11.941 -2.940 -0.162 1.00 0.00 C ATOM 0 H THR A 218 9.088 -4.397 2.210 1.00 0.00 H new ATOM 0 HA THR A 218 9.175 -2.563 0.196 1.00 0.00 H new ATOM 0 HB THR A 218 11.310 -4.534 1.110 1.00 0.00 H new ATOM 0 HG1 THR A 218 11.970 -2.697 2.405 1.00 0.00 H new ATOM 0 HG21 THR A 218 12.953 -2.910 0.242 1.00 0.00 H new ATOM 0 HG22 THR A 218 11.925 -3.567 -1.053 1.00 0.00 H new ATOM 0 HG23 THR A 218 11.624 -1.930 -0.423 1.00 0.00 H new ATOM 1109 N GLY A 219 9.085 -3.584 -1.990 1.00 0.00 N ATOM 1110 CA GLY A 219 9.182 -4.041 -3.346 1.00 0.00 C ATOM 1111 C GLY A 219 8.038 -4.938 -3.756 1.00 0.00 C ATOM 1112 O GLY A 219 8.018 -5.462 -4.871 1.00 0.00 O ATOM 0 H GLY A 219 8.633 -2.676 -1.882 1.00 0.00 H new ATOM 0 HA2 GLY A 219 9.215 -3.178 -4.012 1.00 0.00 H new ATOM 0 HA3 GLY A 219 10.121 -4.579 -3.475 1.00 0.00 H new ATOM 1116 N GLU A 220 7.084 -5.114 -2.860 1.00 0.00 N ATOM 1117 CA GLU A 220 5.926 -5.942 -3.139 1.00 0.00 C ATOM 1118 C GLU A 220 4.837 -5.116 -3.798 1.00 0.00 C ATOM 1119 O GLU A 220 4.830 -3.888 -3.692 1.00 0.00 O ATOM 1120 CB GLU A 220 5.393 -6.560 -1.848 1.00 0.00 C ATOM 1121 CG GLU A 220 6.424 -7.397 -1.112 1.00 0.00 C ATOM 1122 CD GLU A 220 5.806 -8.340 -0.105 1.00 0.00 C ATOM 1123 OE1 GLU A 220 5.299 -7.872 0.928 1.00 0.00 O ATOM 1124 OE2 GLU A 220 5.830 -9.566 -0.344 1.00 0.00 O ATOM 0 H GLU A 220 7.089 -4.693 -1.931 1.00 0.00 H new ATOM 0 HA GLU A 220 6.228 -6.740 -3.817 1.00 0.00 H new ATOM 0 HB2 GLU A 220 5.044 -5.764 -1.190 1.00 0.00 H new ATOM 0 HB3 GLU A 220 4.529 -7.183 -2.081 1.00 0.00 H new ATOM 0 HG2 GLU A 220 7.000 -7.973 -1.836 1.00 0.00 H new ATOM 0 HG3 GLU A 220 7.124 -6.736 -0.601 1.00 0.00 H new ATOM 1131 N GLU A 221 3.934 -5.779 -4.499 1.00 0.00 N ATOM 1132 CA GLU A 221 2.776 -5.103 -5.044 1.00 0.00 C ATOM 1133 C GLU A 221 1.629 -5.179 -4.050 1.00 0.00 C ATOM 1134 O GLU A 221 1.083 -6.253 -3.790 1.00 0.00 O ATOM 1135 CB GLU A 221 2.360 -5.706 -6.387 1.00 0.00 C ATOM 1136 CG GLU A 221 3.343 -5.419 -7.510 1.00 0.00 C ATOM 1137 CD GLU A 221 2.885 -5.967 -8.843 1.00 0.00 C ATOM 1138 OE1 GLU A 221 3.226 -7.124 -9.160 1.00 0.00 O ATOM 1139 OE2 GLU A 221 2.187 -5.243 -9.581 1.00 0.00 O ATOM 0 H GLU A 221 3.982 -6.778 -4.702 1.00 0.00 H new ATOM 0 HA GLU A 221 3.036 -4.059 -5.219 1.00 0.00 H new ATOM 0 HB2 GLU A 221 2.254 -6.785 -6.275 1.00 0.00 H new ATOM 0 HB3 GLU A 221 1.380 -5.316 -6.664 1.00 0.00 H new ATOM 0 HG2 GLU A 221 3.486 -4.342 -7.595 1.00 0.00 H new ATOM 0 HG3 GLU A 221 4.312 -5.851 -7.258 1.00 0.00 H new ATOM 1146 N LEU A 222 1.286 -4.039 -3.484 1.00 0.00 N ATOM 1147 CA LEU A 222 0.215 -3.955 -2.510 1.00 0.00 C ATOM 1148 C LEU A 222 -1.060 -3.493 -3.180 1.00 0.00 C ATOM 1149 O LEU A 222 -1.033 -2.767 -4.167 1.00 0.00 O ATOM 1150 CB LEU A 222 0.587 -3.003 -1.376 1.00 0.00 C ATOM 1151 CG LEU A 222 1.169 -3.645 -0.119 1.00 0.00 C ATOM 1152 CD1 LEU A 222 2.353 -4.524 -0.465 1.00 0.00 C ATOM 1153 CD2 LEU A 222 1.581 -2.564 0.870 1.00 0.00 C ATOM 0 H LEU A 222 1.740 -3.148 -3.685 1.00 0.00 H new ATOM 0 HA LEU A 222 0.056 -4.947 -2.087 1.00 0.00 H new ATOM 0 HB2 LEU A 222 1.309 -2.281 -1.758 1.00 0.00 H new ATOM 0 HB3 LEU A 222 -0.304 -2.443 -1.093 1.00 0.00 H new ATOM 0 HG LEU A 222 0.404 -4.272 0.339 1.00 0.00 H new ATOM 0 HD11 LEU A 222 2.752 -4.971 0.445 1.00 0.00 H new ATOM 0 HD12 LEU A 222 2.034 -5.312 -1.147 1.00 0.00 H new ATOM 0 HD13 LEU A 222 3.126 -3.922 -0.943 1.00 0.00 H new ATOM 0 HD21 LEU A 222 1.995 -3.028 1.765 1.00 0.00 H new ATOM 0 HD22 LEU A 222 2.333 -1.921 0.413 1.00 0.00 H new ATOM 0 HD23 LEU A 222 0.710 -1.968 1.141 1.00 0.00 H new ATOM 1165 N HIS A 223 -2.174 -3.926 -2.647 1.00 0.00 N ATOM 1166 CA HIS A 223 -3.468 -3.557 -3.187 1.00 0.00 C ATOM 1167 C HIS A 223 -4.274 -2.829 -2.132 1.00 0.00 C ATOM 1168 O HIS A 223 -4.506 -3.350 -1.046 1.00 0.00 O ATOM 1169 CB HIS A 223 -4.234 -4.788 -3.671 1.00 0.00 C ATOM 1170 CG HIS A 223 -3.548 -5.531 -4.773 1.00 0.00 C ATOM 1171 ND1 HIS A 223 -3.760 -5.267 -6.108 1.00 0.00 N ATOM 1172 CD2 HIS A 223 -2.645 -6.537 -4.728 1.00 0.00 C ATOM 1173 CE1 HIS A 223 -3.014 -6.077 -6.838 1.00 0.00 C ATOM 1174 NE2 HIS A 223 -2.327 -6.856 -6.024 1.00 0.00 N ATOM 0 H HIS A 223 -2.216 -4.539 -1.833 1.00 0.00 H new ATOM 0 HA HIS A 223 -3.308 -2.900 -4.042 1.00 0.00 H new ATOM 0 HB2 HIS A 223 -4.386 -5.464 -2.829 1.00 0.00 H new ATOM 0 HB3 HIS A 223 -5.221 -4.479 -4.014 1.00 0.00 H new ATOM 0 HD2 HIS A 223 -2.248 -7.002 -3.838 1.00 0.00 H new ATOM 0 HE1 HIS A 223 -2.973 -6.098 -7.917 1.00 0.00 H new ATOM 0 HE2 HIS A 223 -1.667 -7.578 -6.312 1.00 0.00 H new ATOM 1183 N VAL A 224 -4.670 -1.623 -2.455 1.00 0.00 N ATOM 1184 CA VAL A 224 -5.506 -0.826 -1.588 1.00 0.00 C ATOM 1185 C VAL A 224 -6.955 -0.891 -2.054 1.00 0.00 C ATOM 1186 O VAL A 224 -7.294 -0.477 -3.164 1.00 0.00 O ATOM 1187 CB VAL A 224 -5.013 0.639 -1.542 1.00 0.00 C ATOM 1188 CG1 VAL A 224 -6.117 1.595 -1.124 1.00 0.00 C ATOM 1189 CG2 VAL A 224 -3.843 0.756 -0.589 1.00 0.00 C ATOM 0 H VAL A 224 -4.421 -1.163 -3.331 1.00 0.00 H new ATOM 0 HA VAL A 224 -5.444 -1.232 -0.578 1.00 0.00 H new ATOM 0 HB VAL A 224 -4.699 0.916 -2.549 1.00 0.00 H new ATOM 0 HG11 VAL A 224 -5.729 2.613 -1.104 1.00 0.00 H new ATOM 0 HG12 VAL A 224 -6.940 1.534 -1.836 1.00 0.00 H new ATOM 0 HG13 VAL A 224 -6.476 1.325 -0.131 1.00 0.00 H new ATOM 0 HG21 VAL A 224 -3.499 1.790 -0.560 1.00 0.00 H new ATOM 0 HG22 VAL A 224 -4.155 0.449 0.409 1.00 0.00 H new ATOM 0 HG23 VAL A 224 -3.031 0.113 -0.929 1.00 0.00 H new ATOM 1199 N GLU A 225 -7.793 -1.434 -1.195 1.00 0.00 N ATOM 1200 CA GLU A 225 -9.205 -1.583 -1.480 1.00 0.00 C ATOM 1201 C GLU A 225 -9.978 -0.601 -0.625 1.00 0.00 C ATOM 1202 O GLU A 225 -9.675 -0.430 0.555 1.00 0.00 O ATOM 1203 CB GLU A 225 -9.663 -3.003 -1.148 1.00 0.00 C ATOM 1204 CG GLU A 225 -8.750 -4.096 -1.687 1.00 0.00 C ATOM 1205 CD GLU A 225 -9.097 -4.525 -3.097 1.00 0.00 C ATOM 1206 OE1 GLU A 225 -9.273 -3.653 -3.974 1.00 0.00 O ATOM 1207 OE2 GLU A 225 -9.184 -5.750 -3.339 1.00 0.00 O ATOM 0 H GLU A 225 -7.514 -1.785 -0.279 1.00 0.00 H new ATOM 0 HA GLU A 225 -9.383 -1.391 -2.538 1.00 0.00 H new ATOM 0 HB2 GLU A 225 -9.734 -3.106 -0.065 1.00 0.00 H new ATOM 0 HB3 GLU A 225 -10.666 -3.152 -1.549 1.00 0.00 H new ATOM 0 HG2 GLU A 225 -7.719 -3.742 -1.666 1.00 0.00 H new ATOM 0 HG3 GLU A 225 -8.803 -4.962 -1.028 1.00 0.00 H new ATOM 1214 N VAL A 226 -10.956 0.050 -1.213 1.00 0.00 N ATOM 1215 CA VAL A 226 -11.770 0.989 -0.473 1.00 0.00 C ATOM 1216 C VAL A 226 -12.989 0.282 0.113 1.00 0.00 C ATOM 1217 O VAL A 226 -13.702 -0.452 -0.574 1.00 0.00 O ATOM 1218 CB VAL A 226 -12.180 2.209 -1.329 1.00 0.00 C ATOM 1219 CG1 VAL A 226 -12.764 1.780 -2.662 1.00 0.00 C ATOM 1220 CG2 VAL A 226 -13.143 3.103 -0.564 1.00 0.00 C ATOM 0 H VAL A 226 -11.207 -0.052 -2.196 1.00 0.00 H new ATOM 0 HA VAL A 226 -11.167 1.378 0.347 1.00 0.00 H new ATOM 0 HB VAL A 226 -11.281 2.787 -1.542 1.00 0.00 H new ATOM 0 HG11 VAL A 226 -13.042 2.662 -3.239 1.00 0.00 H new ATOM 0 HG12 VAL A 226 -12.023 1.203 -3.215 1.00 0.00 H new ATOM 0 HG13 VAL A 226 -13.648 1.165 -2.491 1.00 0.00 H new ATOM 0 HG21 VAL A 226 -13.419 3.956 -1.185 1.00 0.00 H new ATOM 0 HG22 VAL A 226 -14.038 2.537 -0.306 1.00 0.00 H new ATOM 0 HG23 VAL A 226 -12.663 3.458 0.348 1.00 0.00 H new ATOM 1230 N LEU A 227 -13.174 0.478 1.404 1.00 0.00 N ATOM 1231 CA LEU A 227 -14.236 -0.156 2.168 1.00 0.00 C ATOM 1232 C LEU A 227 -15.574 0.518 1.889 1.00 0.00 C ATOM 1233 O LEU A 227 -16.018 1.383 2.647 1.00 0.00 O ATOM 1234 CB LEU A 227 -13.914 -0.067 3.666 1.00 0.00 C ATOM 1235 CG LEU A 227 -12.902 -1.084 4.214 1.00 0.00 C ATOM 1236 CD1 LEU A 227 -11.613 -1.088 3.413 1.00 0.00 C ATOM 1237 CD2 LEU A 227 -12.608 -0.771 5.669 1.00 0.00 C ATOM 0 H LEU A 227 -12.582 1.092 1.963 1.00 0.00 H new ATOM 0 HA LEU A 227 -14.306 -1.202 1.869 1.00 0.00 H new ATOM 0 HB2 LEU A 227 -13.537 0.934 3.874 1.00 0.00 H new ATOM 0 HB3 LEU A 227 -14.845 -0.180 4.222 1.00 0.00 H new ATOM 0 HG LEU A 227 -13.343 -2.077 4.129 1.00 0.00 H new ATOM 0 HD11 LEU A 227 -10.925 -1.821 3.834 1.00 0.00 H new ATOM 0 HD12 LEU A 227 -11.829 -1.347 2.377 1.00 0.00 H new ATOM 0 HD13 LEU A 227 -11.157 -0.099 3.452 1.00 0.00 H new ATOM 0 HD21 LEU A 227 -11.890 -1.493 6.058 1.00 0.00 H new ATOM 0 HD22 LEU A 227 -12.192 0.234 5.748 1.00 0.00 H new ATOM 0 HD23 LEU A 227 -13.530 -0.829 6.247 1.00 0.00 H new