USER MOD reduce.3.24.130724 H: found=0, std=0, add=626, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 627 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 156 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 227 LYS NZ :NH3+ -177:sc= -0.135 (180deg=-0.164) USER MOD Single : A 155 CYS SG : rot -122:sc= -3.22! USER MOD Single : A 157 MET CE :methyl -114:sc= -10.6! (180deg=-20.4!) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 159 LYS NZ :NH3+ 151:sc= 0.0751 (180deg=-0.104) USER MOD Single : A 162 SER OG : rot 180:sc= 0 USER MOD Single : A 164 TYR OH : rot -39:sc= -1.69! USER MOD Single : A 167 ASN : amide:sc= -2.59 X(o=-2.6,f=-3!) USER MOD Single : A 169 HIS : no HE2:sc= -6.11 K(o=-6.1,f=-9.3!) USER MOD Single : A 170 SER OG : rot -96:sc= 0.678 USER MOD Single : A 172 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 173 SER OG : rot 180:sc= 0 USER MOD Single : A 174 LYS NZ :NH3+ -169:sc= -0.0311 (180deg=-0.238) USER MOD Single : A 177 GLN : amide:sc= -2.04 K(o=-2,f=-0.3) USER MOD Single : A 181 SER OG : rot 180:sc= 0 USER MOD Single : A 186 SER OG : rot -139:sc= -1.75 USER MOD Single : A 191 SER OG : rot 117:sc= 1.14 USER MOD Single : A 196 GLN : amide:sc= 0.64 K(o=0.64,f=-6.4!) USER MOD Single : A 203 ASN : amide:sc= -0.165 X(o=-0.17,f=-0.5) USER MOD Single : A 206 CYS SG : rot 180:sc= -1.5 USER MOD Single : A 207 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 210 LYS NZ :NH3+ 160:sc= -0.0959 (180deg=-0.532) USER MOD Single : A 211 GLN : amide:sc= -2.31 K(o=-2.3,f=-0.012) USER MOD Single : A 212 HIS : no HD1:sc= -1.37 K(o=-1.4,f=-0.11) USER MOD Single : A 217 SER OG : rot 80:sc= 0.697 USER MOD Single : A 226 THR OG1 : rot -150:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 125 N ARG A 151 12.633 -1.726 3.943 1.00 0.00 N ATOM 126 CA ARG A 151 12.015 -0.879 4.972 1.00 0.00 C ATOM 127 C ARG A 151 10.520 -0.655 4.721 1.00 0.00 C ATOM 128 O ARG A 151 10.128 -0.105 3.693 1.00 0.00 O ATOM 129 CB ARG A 151 12.729 0.474 5.030 1.00 0.00 C ATOM 130 CG ARG A 151 12.757 1.207 3.696 1.00 0.00 C ATOM 131 CD ARG A 151 13.013 2.696 3.877 1.00 0.00 C ATOM 132 NE ARG A 151 11.920 3.509 3.351 1.00 0.00 N ATOM 133 CZ ARG A 151 11.756 3.784 2.059 1.00 0.00 C ATOM 134 NH1 ARG A 151 12.608 3.309 1.159 1.00 0.00 N ATOM 135 NH2 ARG A 151 10.737 4.537 1.667 1.00 0.00 N ATOM 0 HA ARG A 151 12.117 -1.401 5.923 1.00 0.00 H new ATOM 0 HB2 ARG A 151 12.236 1.104 5.771 1.00 0.00 H new ATOM 0 HB3 ARG A 151 13.752 0.321 5.372 1.00 0.00 H new ATOM 0 HG2 ARG A 151 13.533 0.779 3.062 1.00 0.00 H new ATOM 0 HG3 ARG A 151 11.808 1.061 3.181 1.00 0.00 H new ATOM 0 HD2 ARG A 151 13.149 2.914 4.936 1.00 0.00 H new ATOM 0 HD3 ARG A 151 13.941 2.968 3.374 1.00 0.00 H new ATOM 0 HE ARG A 151 11.242 3.888 4.012 1.00 0.00 H new ATOM 0 HH11 ARG A 151 13.393 2.730 1.456 1.00 0.00 H new ATOM 0 HH12 ARG A 151 12.477 3.523 0.170 1.00 0.00 H new ATOM 0 HH21 ARG A 151 10.080 4.905 2.355 1.00 0.00 H new ATOM 0 HH22 ARG A 151 10.610 4.748 0.677 1.00 0.00 H new ATOM 149 N PRO A 152 9.660 -1.081 5.665 1.00 0.00 N ATOM 150 CA PRO A 152 8.214 -0.921 5.539 1.00 0.00 C ATOM 151 C PRO A 152 7.749 0.481 5.918 1.00 0.00 C ATOM 152 O PRO A 152 8.273 1.088 6.852 1.00 0.00 O ATOM 153 CB PRO A 152 7.669 -1.952 6.521 1.00 0.00 C ATOM 154 CG PRO A 152 8.703 -2.029 7.592 1.00 0.00 C ATOM 155 CD PRO A 152 10.029 -1.753 6.928 1.00 0.00 C ATOM 0 HA PRO A 152 7.871 -1.061 4.514 1.00 0.00 H new ATOM 0 HB2 PRO A 152 6.703 -1.646 6.923 1.00 0.00 H new ATOM 0 HB3 PRO A 152 7.522 -2.919 6.040 1.00 0.00 H new ATOM 0 HG2 PRO A 152 8.503 -1.300 8.377 1.00 0.00 H new ATOM 0 HG3 PRO A 152 8.702 -3.012 8.062 1.00 0.00 H new ATOM 0 HD2 PRO A 152 10.662 -1.118 7.548 1.00 0.00 H new ATOM 0 HD3 PRO A 152 10.583 -2.673 6.744 1.00 0.00 H new ATOM 163 N ARG A 153 6.760 0.987 5.191 1.00 0.00 N ATOM 164 CA ARG A 153 6.218 2.314 5.451 1.00 0.00 C ATOM 165 C ARG A 153 4.804 2.218 6.017 1.00 0.00 C ATOM 166 O ARG A 153 4.094 1.242 5.773 1.00 0.00 O ATOM 167 CB ARG A 153 6.214 3.145 4.167 1.00 0.00 C ATOM 168 CG ARG A 153 7.588 3.288 3.531 1.00 0.00 C ATOM 169 CD ARG A 153 7.557 4.212 2.322 1.00 0.00 C ATOM 170 NE ARG A 153 6.363 4.010 1.503 1.00 0.00 N ATOM 171 CZ ARG A 153 5.211 4.649 1.695 1.00 0.00 C ATOM 172 NH1 ARG A 153 5.086 5.536 2.675 1.00 0.00 N ATOM 173 NH2 ARG A 153 4.179 4.402 0.900 1.00 0.00 N ATOM 0 H ARG A 153 6.316 0.496 4.415 1.00 0.00 H new ATOM 0 HA ARG A 153 6.853 2.805 6.189 1.00 0.00 H new ATOM 0 HB2 ARG A 153 5.536 2.685 3.448 1.00 0.00 H new ATOM 0 HB3 ARG A 153 5.820 4.137 4.387 1.00 0.00 H new ATOM 0 HG2 ARG A 153 8.291 3.677 4.268 1.00 0.00 H new ATOM 0 HG3 ARG A 153 7.953 2.306 3.229 1.00 0.00 H new ATOM 0 HD2 ARG A 153 7.594 5.248 2.658 1.00 0.00 H new ATOM 0 HD3 ARG A 153 8.446 4.042 1.714 1.00 0.00 H new ATOM 0 HE ARG A 153 6.416 3.338 0.737 1.00 0.00 H new ATOM 0 HH11 ARG A 153 5.877 5.733 3.289 1.00 0.00 H new ATOM 0 HH12 ARG A 153 4.199 6.021 2.814 1.00 0.00 H new ATOM 0 HH21 ARG A 153 4.269 3.724 0.143 1.00 0.00 H new ATOM 0 HH22 ARG A 153 3.295 4.890 1.045 1.00 0.00 H new ATOM 187 N LEU A 154 4.400 3.232 6.776 1.00 0.00 N ATOM 188 CA LEU A 154 3.071 3.253 7.378 1.00 0.00 C ATOM 189 C LEU A 154 2.145 4.208 6.632 1.00 0.00 C ATOM 190 O LEU A 154 2.513 5.344 6.332 1.00 0.00 O ATOM 191 CB LEU A 154 3.162 3.658 8.851 1.00 0.00 C ATOM 192 CG LEU A 154 1.818 3.808 9.567 1.00 0.00 C ATOM 193 CD1 LEU A 154 1.207 2.444 9.847 1.00 0.00 C ATOM 194 CD2 LEU A 154 1.987 4.593 10.859 1.00 0.00 C ATOM 0 H LEU A 154 4.973 4.049 6.989 1.00 0.00 H new ATOM 0 HA LEU A 154 2.655 2.248 7.308 1.00 0.00 H new ATOM 0 HB2 LEU A 154 3.757 2.914 9.380 1.00 0.00 H new ATOM 0 HB3 LEU A 154 3.700 4.604 8.919 1.00 0.00 H new ATOM 0 HG LEU A 154 1.141 4.360 8.915 1.00 0.00 H new ATOM 0 HD11 LEU A 154 0.252 2.571 10.357 1.00 0.00 H new ATOM 0 HD12 LEU A 154 1.049 1.916 8.907 1.00 0.00 H new ATOM 0 HD13 LEU A 154 1.881 1.866 10.479 1.00 0.00 H new ATOM 0 HD21 LEU A 154 1.021 4.690 11.355 1.00 0.00 H new ATOM 0 HD22 LEU A 154 2.681 4.068 11.516 1.00 0.00 H new ATOM 0 HD23 LEU A 154 2.380 5.584 10.634 1.00 0.00 H new ATOM 206 N CYS A 155 0.939 3.734 6.339 1.00 0.00 N ATOM 207 CA CYS A 155 -0.053 4.534 5.632 1.00 0.00 C ATOM 208 C CYS A 155 -1.392 4.505 6.364 1.00 0.00 C ATOM 209 O CYS A 155 -1.821 3.459 6.849 1.00 0.00 O ATOM 210 CB CYS A 155 -0.226 4.014 4.201 1.00 0.00 C ATOM 211 SG CYS A 155 -1.537 4.835 3.263 1.00 0.00 S ATOM 0 H CYS A 155 0.624 2.795 6.582 1.00 0.00 H new ATOM 0 HA CYS A 155 0.299 5.565 5.597 1.00 0.00 H new ATOM 0 HB2 CYS A 155 0.717 4.134 3.667 1.00 0.00 H new ATOM 0 HB3 CYS A 155 -0.437 2.945 4.238 1.00 0.00 H new ATOM 0 HG CYS A 155 -2.402 3.951 2.862 1.00 0.00 H new ATOM 217 N THR A 156 -2.047 5.657 6.438 1.00 0.00 N ATOM 218 CA THR A 156 -3.339 5.759 7.107 1.00 0.00 C ATOM 219 C THR A 156 -4.280 6.674 6.330 1.00 0.00 C ATOM 220 O THR A 156 -4.177 7.897 6.411 1.00 0.00 O ATOM 221 CB THR A 156 -3.159 6.283 8.533 1.00 0.00 C ATOM 222 OG1 THR A 156 -2.165 5.540 9.217 1.00 0.00 O ATOM 223 CG2 THR A 156 -4.426 6.223 9.358 1.00 0.00 C ATOM 0 H THR A 156 -1.706 6.533 6.043 1.00 0.00 H new ATOM 0 HA THR A 156 -3.780 4.763 7.148 1.00 0.00 H new ATOM 0 HB THR A 156 -2.867 7.327 8.423 1.00 0.00 H new ATOM 0 HG1 THR A 156 -2.063 5.890 10.127 1.00 0.00 H new ATOM 0 HG21 THR A 156 -4.228 6.609 10.358 1.00 0.00 H new ATOM 0 HG22 THR A 156 -5.199 6.827 8.882 1.00 0.00 H new ATOM 0 HG23 THR A 156 -4.765 5.190 9.429 1.00 0.00 H new ATOM 231 N MET A 157 -5.197 6.074 5.578 1.00 0.00 N ATOM 232 CA MET A 157 -6.153 6.840 4.787 1.00 0.00 C ATOM 233 C MET A 157 -7.559 6.719 5.364 1.00 0.00 C ATOM 234 O MET A 157 -7.999 5.631 5.734 1.00 0.00 O ATOM 235 CB MET A 157 -6.142 6.368 3.331 1.00 0.00 C ATOM 236 CG MET A 157 -6.137 4.856 3.177 1.00 0.00 C ATOM 237 SD MET A 157 -6.115 4.335 1.451 1.00 0.00 S ATOM 238 CE MET A 157 -7.130 2.861 1.527 1.00 0.00 C ATOM 0 H MET A 157 -5.298 5.062 5.500 1.00 0.00 H new ATOM 0 HA MET A 157 -5.855 7.888 4.822 1.00 0.00 H new ATOM 0 HB2 MET A 157 -7.016 6.773 2.821 1.00 0.00 H new ATOM 0 HB3 MET A 157 -5.263 6.778 2.833 1.00 0.00 H new ATOM 0 HG2 MET A 157 -5.266 4.445 3.688 1.00 0.00 H new ATOM 0 HG3 MET A 157 -7.018 4.442 3.667 1.00 0.00 H new ATOM 0 HE1 MET A 157 -6.520 1.987 1.298 1.00 0.00 H new ATOM 0 HE2 MET A 157 -7.549 2.759 2.528 1.00 0.00 H new ATOM 0 HE3 MET A 157 -7.940 2.939 0.801 1.00 0.00 H new ATOM 248 N LYS A 158 -8.258 7.848 5.442 1.00 0.00 N ATOM 249 CA LYS A 158 -9.613 7.874 5.978 1.00 0.00 C ATOM 250 C LYS A 158 -10.645 7.778 4.860 1.00 0.00 C ATOM 251 O LYS A 158 -10.527 8.443 3.831 1.00 0.00 O ATOM 252 CB LYS A 158 -9.837 9.154 6.786 1.00 0.00 C ATOM 253 CG LYS A 158 -8.747 9.423 7.810 1.00 0.00 C ATOM 254 CD LYS A 158 -8.976 10.739 8.535 1.00 0.00 C ATOM 255 CE LYS A 158 -7.949 10.954 9.635 1.00 0.00 C ATOM 256 NZ LYS A 158 -7.547 12.384 9.749 1.00 0.00 N ATOM 0 H LYS A 158 -7.907 8.757 5.140 1.00 0.00 H new ATOM 0 HA LYS A 158 -9.735 7.011 6.633 1.00 0.00 H new ATOM 0 HB2 LYS A 158 -9.898 10.000 6.102 1.00 0.00 H new ATOM 0 HB3 LYS A 158 -10.797 9.088 7.298 1.00 0.00 H new ATOM 0 HG2 LYS A 158 -8.717 8.608 8.534 1.00 0.00 H new ATOM 0 HG3 LYS A 158 -7.777 9.444 7.313 1.00 0.00 H new ATOM 0 HD2 LYS A 158 -8.925 11.562 7.822 1.00 0.00 H new ATOM 0 HD3 LYS A 158 -9.978 10.750 8.964 1.00 0.00 H new ATOM 0 HE2 LYS A 158 -8.360 10.616 10.586 1.00 0.00 H new ATOM 0 HE3 LYS A 158 -7.068 10.344 9.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 -6.846 12.488 10.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 -7.131 12.701 8.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 -8.383 12.963 9.967 1.00 0.00 H new ATOM 270 N LYS A 159 -11.657 6.946 5.073 1.00 0.00 N ATOM 271 CA LYS A 159 -12.717 6.757 4.090 1.00 0.00 C ATOM 272 C LYS A 159 -13.651 7.963 4.061 1.00 0.00 C ATOM 273 O LYS A 159 -13.566 8.804 3.167 1.00 0.00 O ATOM 274 CB LYS A 159 -13.496 5.472 4.403 1.00 0.00 C ATOM 275 CG LYS A 159 -14.885 5.399 3.781 1.00 0.00 C ATOM 276 CD LYS A 159 -14.851 5.690 2.291 1.00 0.00 C ATOM 277 CE LYS A 159 -15.998 5.006 1.564 1.00 0.00 C ATOM 278 NZ LYS A 159 -17.321 5.388 2.130 1.00 0.00 N ATOM 0 H LYS A 159 -11.766 6.389 5.921 1.00 0.00 H new ATOM 0 HA LYS A 159 -12.266 6.662 3.102 1.00 0.00 H new ATOM 0 HB2 LYS A 159 -12.914 4.618 4.058 1.00 0.00 H new ATOM 0 HB3 LYS A 159 -13.592 5.377 5.485 1.00 0.00 H new ATOM 0 HG2 LYS A 159 -15.307 4.408 3.948 1.00 0.00 H new ATOM 0 HG3 LYS A 159 -15.543 6.113 4.276 1.00 0.00 H new ATOM 0 HD2 LYS A 159 -14.906 6.766 2.128 1.00 0.00 H new ATOM 0 HD3 LYS A 159 -13.902 5.352 1.875 1.00 0.00 H new ATOM 0 HE2 LYS A 159 -15.966 5.269 0.507 1.00 0.00 H new ATOM 0 HE3 LYS A 159 -15.875 3.925 1.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 -18.045 5.337 1.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 -17.571 4.735 2.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 -17.273 6.359 2.501 1.00 0.00 H new ATOM 292 N GLY A 160 -14.545 8.040 5.042 1.00 0.00 N ATOM 293 CA GLY A 160 -15.482 9.145 5.103 1.00 0.00 C ATOM 294 C GLY A 160 -16.278 9.293 3.820 1.00 0.00 C ATOM 295 O GLY A 160 -16.373 8.349 3.036 1.00 0.00 O ATOM 0 H GLY A 160 -14.637 7.357 5.794 1.00 0.00 H new ATOM 0 HA2 GLY A 160 -16.166 8.993 5.938 1.00 0.00 H new ATOM 0 HA3 GLY A 160 -14.939 10.069 5.300 1.00 0.00 H new ATOM 299 N PRO A 161 -16.863 10.476 3.573 1.00 0.00 N ATOM 300 CA PRO A 161 -17.649 10.730 2.366 1.00 0.00 C ATOM 301 C PRO A 161 -16.774 11.033 1.151 1.00 0.00 C ATOM 302 O PRO A 161 -17.283 11.280 0.057 1.00 0.00 O ATOM 303 CB PRO A 161 -18.470 11.957 2.750 1.00 0.00 C ATOM 304 CG PRO A 161 -17.603 12.701 3.708 1.00 0.00 C ATOM 305 CD PRO A 161 -16.801 11.662 4.451 1.00 0.00 C ATOM 0 HA PRO A 161 -18.245 9.866 2.072 1.00 0.00 H new ATOM 0 HB2 PRO A 161 -18.709 12.564 1.877 1.00 0.00 H new ATOM 0 HB3 PRO A 161 -19.417 11.673 3.209 1.00 0.00 H new ATOM 0 HG2 PRO A 161 -16.947 13.394 3.181 1.00 0.00 H new ATOM 0 HG3 PRO A 161 -18.205 13.293 4.397 1.00 0.00 H new ATOM 0 HD2 PRO A 161 -15.773 11.988 4.611 1.00 0.00 H new ATOM 0 HD3 PRO A 161 -17.226 11.455 5.433 1.00 0.00 H new ATOM 313 N SER A 162 -15.457 11.022 1.347 1.00 0.00 N ATOM 314 CA SER A 162 -14.523 11.306 0.264 1.00 0.00 C ATOM 315 C SER A 162 -13.880 10.029 -0.273 1.00 0.00 C ATOM 316 O SER A 162 -13.529 9.953 -1.451 1.00 0.00 O ATOM 317 CB SER A 162 -13.437 12.270 0.744 1.00 0.00 C ATOM 318 OG SER A 162 -12.637 11.677 1.752 1.00 0.00 O ATOM 0 H SER A 162 -15.015 10.820 2.244 1.00 0.00 H new ATOM 0 HA SER A 162 -15.087 11.767 -0.547 1.00 0.00 H new ATOM 0 HB2 SER A 162 -12.809 12.563 -0.097 1.00 0.00 H new ATOM 0 HB3 SER A 162 -13.898 13.179 1.130 1.00 0.00 H new ATOM 0 HG SER A 162 -11.950 12.313 2.041 1.00 0.00 H new ATOM 324 N GLY A 163 -13.722 9.028 0.590 1.00 0.00 N ATOM 325 CA GLY A 163 -13.116 7.781 0.165 1.00 0.00 C ATOM 326 C GLY A 163 -11.631 7.730 0.462 1.00 0.00 C ATOM 327 O GLY A 163 -11.166 8.319 1.439 1.00 0.00 O ATOM 0 H GLY A 163 -14.002 9.059 1.570 1.00 0.00 H new ATOM 0 HA2 GLY A 163 -13.613 6.950 0.665 1.00 0.00 H new ATOM 0 HA3 GLY A 163 -13.274 7.649 -0.905 1.00 0.00 H new ATOM 331 N TYR A 164 -10.884 7.028 -0.382 1.00 0.00 N ATOM 332 CA TYR A 164 -9.442 6.905 -0.205 1.00 0.00 C ATOM 333 C TYR A 164 -8.702 7.906 -1.085 1.00 0.00 C ATOM 334 O TYR A 164 -7.760 8.562 -0.642 1.00 0.00 O ATOM 335 CB TYR A 164 -8.987 5.482 -0.530 1.00 0.00 C ATOM 336 CG TYR A 164 -9.809 4.415 0.157 1.00 0.00 C ATOM 337 CD1 TYR A 164 -9.854 4.331 1.543 1.00 0.00 C ATOM 338 CD2 TYR A 164 -10.540 3.492 -0.580 1.00 0.00 C ATOM 339 CE1 TYR A 164 -10.604 3.359 2.176 1.00 0.00 C ATOM 340 CE2 TYR A 164 -11.294 2.517 0.045 1.00 0.00 C ATOM 341 CZ TYR A 164 -11.322 2.454 1.422 1.00 0.00 C ATOM 342 OH TYR A 164 -12.071 1.484 2.048 1.00 0.00 O ATOM 0 H TYR A 164 -11.253 6.535 -1.195 1.00 0.00 H new ATOM 0 HA TYR A 164 -9.206 7.122 0.837 1.00 0.00 H new ATOM 0 HB2 TYR A 164 -9.037 5.330 -1.608 1.00 0.00 H new ATOM 0 HB3 TYR A 164 -7.942 5.368 -0.240 1.00 0.00 H new ATOM 0 HD1 TYR A 164 -9.293 5.038 2.136 1.00 0.00 H new ATOM 0 HD2 TYR A 164 -10.519 3.537 -1.659 1.00 0.00 H new ATOM 0 HE1 TYR A 164 -10.628 3.308 3.255 1.00 0.00 H new ATOM 0 HE2 TYR A 164 -11.859 1.808 -0.542 1.00 0.00 H new ATOM 0 HH TYR A 164 -11.584 1.148 2.829 1.00 0.00 H new ATOM 352 N GLY A 165 -9.139 8.020 -2.335 1.00 0.00 N ATOM 353 CA GLY A 165 -8.511 8.945 -3.258 1.00 0.00 C ATOM 354 C GLY A 165 -7.349 8.330 -4.012 1.00 0.00 C ATOM 355 O GLY A 165 -6.552 9.043 -4.617 1.00 0.00 O ATOM 0 H GLY A 165 -9.917 7.488 -2.725 1.00 0.00 H new ATOM 0 HA2 GLY A 165 -9.255 9.298 -3.972 1.00 0.00 H new ATOM 0 HA3 GLY A 165 -8.159 9.817 -2.707 1.00 0.00 H new ATOM 359 N PHE A 166 -7.244 7.006 -3.980 1.00 0.00 N ATOM 360 CA PHE A 166 -6.159 6.319 -4.675 1.00 0.00 C ATOM 361 C PHE A 166 -6.682 5.266 -5.643 1.00 0.00 C ATOM 362 O PHE A 166 -7.891 5.095 -5.806 1.00 0.00 O ATOM 363 CB PHE A 166 -5.189 5.677 -3.675 1.00 0.00 C ATOM 364 CG PHE A 166 -5.742 4.503 -2.898 1.00 0.00 C ATOM 365 CD1 PHE A 166 -7.085 4.146 -2.966 1.00 0.00 C ATOM 366 CD2 PHE A 166 -4.901 3.752 -2.091 1.00 0.00 C ATOM 367 CE1 PHE A 166 -7.569 3.070 -2.247 1.00 0.00 C ATOM 368 CE2 PHE A 166 -5.382 2.675 -1.370 1.00 0.00 C ATOM 369 CZ PHE A 166 -6.717 2.334 -1.448 1.00 0.00 C ATOM 0 H PHE A 166 -7.890 6.391 -3.485 1.00 0.00 H new ATOM 0 HA PHE A 166 -5.624 7.072 -5.254 1.00 0.00 H new ATOM 0 HB2 PHE A 166 -4.302 5.348 -4.216 1.00 0.00 H new ATOM 0 HB3 PHE A 166 -4.866 6.440 -2.967 1.00 0.00 H new ATOM 0 HD1 PHE A 166 -7.758 4.717 -3.589 1.00 0.00 H new ATOM 0 HD2 PHE A 166 -3.855 4.012 -2.025 1.00 0.00 H new ATOM 0 HE1 PHE A 166 -8.614 2.805 -2.310 1.00 0.00 H new ATOM 0 HE2 PHE A 166 -4.713 2.101 -0.746 1.00 0.00 H new ATOM 0 HZ PHE A 166 -7.094 1.493 -0.885 1.00 0.00 H new ATOM 379 N ASN A 167 -5.755 4.560 -6.276 1.00 0.00 N ATOM 380 CA ASN A 167 -6.097 3.511 -7.227 1.00 0.00 C ATOM 381 C ASN A 167 -5.334 2.236 -6.889 1.00 0.00 C ATOM 382 O ASN A 167 -4.347 2.275 -6.155 1.00 0.00 O ATOM 383 CB ASN A 167 -5.773 3.959 -8.655 1.00 0.00 C ATOM 384 CG ASN A 167 -6.590 5.152 -9.122 1.00 0.00 C ATOM 385 OD1 ASN A 167 -6.211 5.838 -10.071 1.00 0.00 O ATOM 386 ND2 ASN A 167 -7.714 5.410 -8.467 1.00 0.00 N ATOM 0 H ASN A 167 -4.753 4.696 -6.146 1.00 0.00 H new ATOM 0 HA ASN A 167 -7.167 3.312 -7.162 1.00 0.00 H new ATOM 0 HB2 ASN A 167 -4.714 4.209 -8.716 1.00 0.00 H new ATOM 0 HB3 ASN A 167 -5.943 3.125 -9.335 1.00 0.00 H new ATOM 0 HD21 ASN A 167 -8.297 6.200 -8.745 1.00 0.00 H new ATOM 0 HD22 ASN A 167 -7.996 4.819 -7.685 1.00 0.00 H new ATOM 393 N LEU A 168 -5.797 1.104 -7.408 1.00 0.00 N ATOM 394 CA LEU A 168 -5.145 -0.167 -7.126 1.00 0.00 C ATOM 395 C LEU A 168 -4.984 -1.025 -8.378 1.00 0.00 C ATOM 396 O LEU A 168 -5.920 -1.194 -9.161 1.00 0.00 O ATOM 397 CB LEU A 168 -5.938 -0.945 -6.072 1.00 0.00 C ATOM 398 CG LEU A 168 -6.012 -0.290 -4.690 1.00 0.00 C ATOM 399 CD1 LEU A 168 -4.622 0.075 -4.192 1.00 0.00 C ATOM 400 CD2 LEU A 168 -6.912 0.938 -4.728 1.00 0.00 C ATOM 0 H LEU A 168 -6.611 1.041 -8.019 1.00 0.00 H new ATOM 0 HA LEU A 168 -4.148 0.062 -6.749 1.00 0.00 H new ATOM 0 HB2 LEU A 168 -6.953 -1.092 -6.441 1.00 0.00 H new ATOM 0 HB3 LEU A 168 -5.492 -1.934 -5.963 1.00 0.00 H new ATOM 0 HG LEU A 168 -6.443 -1.008 -3.993 1.00 0.00 H new ATOM 0 HD11 LEU A 168 -4.698 0.539 -3.209 1.00 0.00 H new ATOM 0 HD12 LEU A 168 -4.012 -0.826 -4.122 1.00 0.00 H new ATOM 0 HD13 LEU A 168 -4.158 0.774 -4.888 1.00 0.00 H new ATOM 0 HD21 LEU A 168 -6.952 1.390 -3.737 1.00 0.00 H new ATOM 0 HD22 LEU A 168 -6.513 1.660 -5.440 1.00 0.00 H new ATOM 0 HD23 LEU A 168 -7.916 0.644 -5.034 1.00 0.00 H new ATOM 412 N HIS A 169 -3.791 -1.588 -8.532 1.00 0.00 N ATOM 413 CA HIS A 169 -3.479 -2.465 -9.652 1.00 0.00 C ATOM 414 C HIS A 169 -2.741 -3.690 -9.126 1.00 0.00 C ATOM 415 O HIS A 169 -2.282 -3.693 -7.984 1.00 0.00 O ATOM 416 CB HIS A 169 -2.629 -1.746 -10.706 1.00 0.00 C ATOM 417 CG HIS A 169 -1.219 -1.467 -10.274 1.00 0.00 C ATOM 418 ND1 HIS A 169 -0.893 -0.888 -9.065 1.00 0.00 N ATOM 419 CD2 HIS A 169 -0.042 -1.707 -10.901 1.00 0.00 C ATOM 420 CE1 HIS A 169 0.421 -0.785 -8.969 1.00 0.00 C ATOM 421 NE2 HIS A 169 0.960 -1.275 -10.069 1.00 0.00 N ATOM 0 H HIS A 169 -3.015 -1.449 -7.885 1.00 0.00 H new ATOM 0 HA HIS A 169 -4.409 -2.767 -10.133 1.00 0.00 H new ATOM 0 HB2 HIS A 169 -2.606 -2.351 -11.612 1.00 0.00 H new ATOM 0 HB3 HIS A 169 -3.111 -0.803 -10.964 1.00 0.00 H new ATOM 0 HD1 HIS A 169 -1.562 -0.587 -8.356 1.00 0.00 H new ATOM 0 HD2 HIS A 169 0.084 -2.155 -11.875 1.00 0.00 H new ATOM 0 HE1 HIS A 169 0.962 -0.370 -8.132 1.00 0.00 H new ATOM 430 N SER A 170 -2.635 -4.735 -9.934 1.00 0.00 N ATOM 431 CA SER A 170 -1.956 -5.943 -9.485 1.00 0.00 C ATOM 432 C SER A 170 -0.884 -6.404 -10.459 1.00 0.00 C ATOM 433 O SER A 170 -1.055 -6.350 -11.677 1.00 0.00 O ATOM 434 CB SER A 170 -2.962 -7.070 -9.266 1.00 0.00 C ATOM 435 OG SER A 170 -2.366 -8.160 -8.584 1.00 0.00 O ATOM 0 H SER A 170 -3.002 -4.773 -10.885 1.00 0.00 H new ATOM 0 HA SER A 170 -1.465 -5.695 -8.544 1.00 0.00 H new ATOM 0 HB2 SER A 170 -3.811 -6.698 -8.692 1.00 0.00 H new ATOM 0 HB3 SER A 170 -3.351 -7.407 -10.227 1.00 0.00 H new ATOM 0 HG SER A 170 -2.076 -8.833 -9.234 1.00 0.00 H new ATOM 441 N ASP A 171 0.209 -6.893 -9.892 1.00 0.00 N ATOM 442 CA ASP A 171 1.323 -7.417 -10.669 1.00 0.00 C ATOM 443 C ASP A 171 1.303 -8.934 -10.573 1.00 0.00 C ATOM 444 O ASP A 171 1.510 -9.641 -11.559 1.00 0.00 O ATOM 445 CB ASP A 171 2.654 -6.867 -10.152 1.00 0.00 C ATOM 446 CG ASP A 171 3.762 -6.974 -11.182 1.00 0.00 C ATOM 447 OD1 ASP A 171 3.491 -6.722 -12.375 1.00 0.00 O ATOM 448 OD2 ASP A 171 4.901 -7.310 -10.795 1.00 0.00 O ATOM 0 H ASP A 171 0.349 -6.938 -8.883 1.00 0.00 H new ATOM 0 HA ASP A 171 1.221 -7.107 -11.709 1.00 0.00 H new ATOM 0 HB2 ASP A 171 2.526 -5.823 -9.867 1.00 0.00 H new ATOM 0 HB3 ASP A 171 2.944 -7.410 -9.253 1.00 0.00 H new ATOM 453 N LYS A 172 1.005 -9.418 -9.371 1.00 0.00 N ATOM 454 CA LYS A 172 0.898 -10.845 -9.116 1.00 0.00 C ATOM 455 C LYS A 172 -0.488 -11.314 -9.524 1.00 0.00 C ATOM 456 O LYS A 172 -1.330 -10.503 -9.909 1.00 0.00 O ATOM 457 CB LYS A 172 1.148 -11.147 -7.638 1.00 0.00 C ATOM 458 CG LYS A 172 2.599 -10.973 -7.220 1.00 0.00 C ATOM 459 CD LYS A 172 3.491 -12.033 -7.849 1.00 0.00 C ATOM 460 CE LYS A 172 4.811 -12.168 -7.105 1.00 0.00 C ATOM 461 NZ LYS A 172 5.968 -11.756 -7.947 1.00 0.00 N ATOM 0 H LYS A 172 0.832 -8.834 -8.553 1.00 0.00 H new ATOM 0 HA LYS A 172 1.651 -11.375 -9.699 1.00 0.00 H new ATOM 0 HB2 LYS A 172 0.522 -10.493 -7.031 1.00 0.00 H new ATOM 0 HB3 LYS A 172 0.838 -12.170 -7.427 1.00 0.00 H new ATOM 0 HG2 LYS A 172 2.947 -9.982 -7.513 1.00 0.00 H new ATOM 0 HG3 LYS A 172 2.675 -11.029 -6.134 1.00 0.00 H new ATOM 0 HD2 LYS A 172 2.973 -12.992 -7.849 1.00 0.00 H new ATOM 0 HD3 LYS A 172 3.684 -11.775 -8.890 1.00 0.00 H new ATOM 0 HE2 LYS A 172 4.783 -11.557 -6.203 1.00 0.00 H new ATOM 0 HE3 LYS A 172 4.944 -13.202 -6.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 172 6.848 -11.863 -7.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 172 6.010 -12.355 -8.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 172 5.855 -10.762 -8.230 1.00 0.00 H new ATOM 475 N SER A 173 -0.729 -12.612 -9.455 1.00 0.00 N ATOM 476 CA SER A 173 -2.027 -13.142 -9.840 1.00 0.00 C ATOM 477 C SER A 173 -2.862 -13.521 -8.636 1.00 0.00 C ATOM 478 O SER A 173 -4.092 -13.526 -8.694 1.00 0.00 O ATOM 479 CB SER A 173 -1.862 -14.347 -10.766 1.00 0.00 C ATOM 480 OG SER A 173 -1.380 -13.952 -12.038 1.00 0.00 O ATOM 0 H SER A 173 -0.055 -13.310 -9.141 1.00 0.00 H new ATOM 0 HA SER A 173 -2.554 -12.351 -10.373 1.00 0.00 H new ATOM 0 HB2 SER A 173 -1.171 -15.062 -10.318 1.00 0.00 H new ATOM 0 HB3 SER A 173 -2.819 -14.856 -10.879 1.00 0.00 H new ATOM 0 HG SER A 173 -1.282 -14.742 -12.610 1.00 0.00 H new ATOM 486 N LYS A 174 -2.192 -13.851 -7.557 1.00 0.00 N ATOM 487 CA LYS A 174 -2.888 -14.252 -6.337 1.00 0.00 C ATOM 488 C LYS A 174 -2.550 -13.389 -5.113 1.00 0.00 C ATOM 489 O LYS A 174 -3.450 -12.846 -4.473 1.00 0.00 O ATOM 490 CB LYS A 174 -2.631 -15.733 -6.029 1.00 0.00 C ATOM 491 CG LYS A 174 -2.867 -16.651 -7.218 1.00 0.00 C ATOM 492 CD LYS A 174 -2.716 -18.114 -6.832 1.00 0.00 C ATOM 493 CE LYS A 174 -1.327 -18.407 -6.286 1.00 0.00 C ATOM 494 NZ LYS A 174 -0.258 -18.034 -7.253 1.00 0.00 N ATOM 0 H LYS A 174 -1.174 -13.853 -7.489 1.00 0.00 H new ATOM 0 HA LYS A 174 -3.948 -14.094 -6.537 1.00 0.00 H new ATOM 0 HB2 LYS A 174 -1.603 -15.851 -5.687 1.00 0.00 H new ATOM 0 HB3 LYS A 174 -3.277 -16.042 -5.208 1.00 0.00 H new ATOM 0 HG2 LYS A 174 -3.867 -16.481 -7.618 1.00 0.00 H new ATOM 0 HG3 LYS A 174 -2.161 -16.408 -8.012 1.00 0.00 H new ATOM 0 HD2 LYS A 174 -3.464 -18.373 -6.083 1.00 0.00 H new ATOM 0 HD3 LYS A 174 -2.906 -18.742 -7.702 1.00 0.00 H new ATOM 0 HE2 LYS A 174 -1.181 -17.860 -5.355 1.00 0.00 H new ATOM 0 HE3 LYS A 174 -1.247 -19.468 -6.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 174 0.653 -18.416 -6.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 174 -0.484 -18.427 -8.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 174 -0.195 -16.998 -7.319 1.00 0.00 H new ATOM 508 N PRO A 175 -1.263 -13.312 -4.715 1.00 0.00 N ATOM 509 CA PRO A 175 -0.844 -12.587 -3.505 1.00 0.00 C ATOM 510 C PRO A 175 -0.694 -11.068 -3.658 1.00 0.00 C ATOM 511 O PRO A 175 -1.469 -10.298 -3.090 1.00 0.00 O ATOM 512 CB PRO A 175 0.534 -13.209 -3.186 1.00 0.00 C ATOM 513 CG PRO A 175 0.675 -14.366 -4.121 1.00 0.00 C ATOM 514 CD PRO A 175 -0.118 -13.984 -5.332 1.00 0.00 C ATOM 0 HA PRO A 175 -1.606 -12.690 -2.732 1.00 0.00 H new ATOM 0 HB2 PRO A 175 1.335 -12.485 -3.334 1.00 0.00 H new ATOM 0 HB3 PRO A 175 0.587 -13.535 -2.147 1.00 0.00 H new ATOM 0 HG2 PRO A 175 1.720 -14.544 -4.374 1.00 0.00 H new ATOM 0 HG3 PRO A 175 0.294 -15.284 -3.673 1.00 0.00 H new ATOM 0 HD2 PRO A 175 0.438 -13.324 -5.998 1.00 0.00 H new ATOM 0 HD3 PRO A 175 -0.417 -14.852 -5.920 1.00 0.00 H new ATOM 522 N GLY A 176 0.349 -10.653 -4.368 1.00 0.00 N ATOM 523 CA GLY A 176 0.656 -9.242 -4.528 1.00 0.00 C ATOM 524 C GLY A 176 -0.523 -8.310 -4.713 1.00 0.00 C ATOM 525 O GLY A 176 -1.515 -8.626 -5.369 1.00 0.00 O ATOM 0 H GLY A 176 0.998 -11.280 -4.843 1.00 0.00 H new ATOM 0 HA2 GLY A 176 1.216 -8.914 -3.653 1.00 0.00 H new ATOM 0 HA3 GLY A 176 1.316 -9.132 -5.389 1.00 0.00 H new ATOM 529 N GLN A 177 -0.339 -7.129 -4.145 1.00 0.00 N ATOM 530 CA GLN A 177 -1.283 -6.025 -4.209 1.00 0.00 C ATOM 531 C GLN A 177 -0.473 -4.753 -4.434 1.00 0.00 C ATOM 532 O GLN A 177 0.498 -4.507 -3.718 1.00 0.00 O ATOM 533 CB GLN A 177 -2.078 -5.924 -2.911 1.00 0.00 C ATOM 534 CG GLN A 177 -2.849 -4.616 -2.765 1.00 0.00 C ATOM 535 CD GLN A 177 -4.016 -4.470 -3.737 1.00 0.00 C ATOM 536 OE1 GLN A 177 -4.650 -3.417 -3.791 1.00 0.00 O ATOM 537 NE2 GLN A 177 -4.313 -5.514 -4.510 1.00 0.00 N ATOM 0 H GLN A 177 0.499 -6.905 -3.609 1.00 0.00 H new ATOM 0 HA GLN A 177 -1.997 -6.178 -5.018 1.00 0.00 H new ATOM 0 HB2 GLN A 177 -2.779 -6.757 -2.859 1.00 0.00 H new ATOM 0 HB3 GLN A 177 -1.395 -6.029 -2.068 1.00 0.00 H new ATOM 0 HG2 GLN A 177 -3.228 -4.541 -1.746 1.00 0.00 H new ATOM 0 HG3 GLN A 177 -2.161 -3.783 -2.911 1.00 0.00 H new ATOM 0 HE21 GLN A 177 -3.767 -6.372 -4.440 1.00 0.00 H new ATOM 0 HE22 GLN A 177 -5.087 -5.455 -5.172 1.00 0.00 H new ATOM 546 N PHE A 178 -0.818 -3.976 -5.451 1.00 0.00 N ATOM 547 CA PHE A 178 -0.040 -2.782 -5.756 1.00 0.00 C ATOM 548 C PHE A 178 -0.905 -1.557 -6.036 1.00 0.00 C ATOM 549 O PHE A 178 -1.877 -1.626 -6.786 1.00 0.00 O ATOM 550 CB PHE A 178 0.864 -3.059 -6.970 1.00 0.00 C ATOM 551 CG PHE A 178 1.586 -4.390 -6.932 1.00 0.00 C ATOM 552 CD1 PHE A 178 0.888 -5.590 -6.858 1.00 0.00 C ATOM 553 CD2 PHE A 178 2.971 -4.437 -6.979 1.00 0.00 C ATOM 554 CE1 PHE A 178 1.557 -6.799 -6.828 1.00 0.00 C ATOM 555 CE2 PHE A 178 3.644 -5.644 -6.951 1.00 0.00 C ATOM 556 CZ PHE A 178 2.935 -6.826 -6.874 1.00 0.00 C ATOM 0 H PHE A 178 -1.613 -4.144 -6.067 1.00 0.00 H new ATOM 0 HA PHE A 178 0.555 -2.555 -4.871 1.00 0.00 H new ATOM 0 HB2 PHE A 178 0.257 -3.016 -7.875 1.00 0.00 H new ATOM 0 HB3 PHE A 178 1.604 -2.262 -7.044 1.00 0.00 H new ATOM 0 HD1 PHE A 178 -0.191 -5.577 -6.823 1.00 0.00 H new ATOM 0 HD2 PHE A 178 3.533 -3.516 -7.038 1.00 0.00 H new ATOM 0 HE1 PHE A 178 1.001 -7.723 -6.769 1.00 0.00 H new ATOM 0 HE2 PHE A 178 4.723 -5.662 -6.989 1.00 0.00 H new ATOM 0 HZ PHE A 178 3.459 -7.770 -6.850 1.00 0.00 H new ATOM 566 N ILE A 179 -0.513 -0.421 -5.456 1.00 0.00 N ATOM 567 CA ILE A 179 -1.231 0.833 -5.684 1.00 0.00 C ATOM 568 C ILE A 179 -0.780 1.427 -7.012 1.00 0.00 C ATOM 569 O ILE A 179 0.416 1.519 -7.282 1.00 0.00 O ATOM 570 CB ILE A 179 -1.002 1.856 -4.551 1.00 0.00 C ATOM 571 CG1 ILE A 179 -1.422 1.254 -3.208 1.00 0.00 C ATOM 572 CG2 ILE A 179 -1.778 3.140 -4.826 1.00 0.00 C ATOM 573 CD1 ILE A 179 -1.288 2.213 -2.044 1.00 0.00 C ATOM 0 H ILE A 179 0.290 -0.344 -4.831 1.00 0.00 H new ATOM 0 HA ILE A 179 -2.298 0.610 -5.704 1.00 0.00 H new ATOM 0 HB ILE A 179 0.059 2.100 -4.509 1.00 0.00 H new ATOM 0 HG12 ILE A 179 -2.458 0.922 -3.277 1.00 0.00 H new ATOM 0 HG13 ILE A 179 -0.816 0.370 -3.011 1.00 0.00 H new ATOM 0 HG21 ILE A 179 -1.605 3.850 -4.017 1.00 0.00 H new ATOM 0 HG22 ILE A 179 -1.442 3.574 -5.768 1.00 0.00 H new ATOM 0 HG23 ILE A 179 -2.843 2.915 -4.890 1.00 0.00 H new ATOM 0 HD11 ILE A 179 -1.603 1.717 -1.126 1.00 0.00 H new ATOM 0 HD12 ILE A 179 -0.248 2.526 -1.948 1.00 0.00 H new ATOM 0 HD13 ILE A 179 -1.916 3.087 -2.218 1.00 0.00 H new ATOM 585 N ARG A 180 -1.735 1.791 -7.857 1.00 0.00 N ATOM 586 CA ARG A 180 -1.406 2.324 -9.172 1.00 0.00 C ATOM 587 C ARG A 180 -1.390 3.851 -9.211 1.00 0.00 C ATOM 588 O ARG A 180 -0.607 4.440 -9.958 1.00 0.00 O ATOM 589 CB ARG A 180 -2.381 1.768 -10.212 1.00 0.00 C ATOM 590 CG ARG A 180 -3.759 2.406 -10.178 1.00 0.00 C ATOM 591 CD ARG A 180 -4.603 1.964 -11.363 1.00 0.00 C ATOM 592 NE ARG A 180 -5.726 2.867 -11.608 1.00 0.00 N ATOM 593 CZ ARG A 180 -6.804 2.533 -12.315 1.00 0.00 C ATOM 594 NH1 ARG A 180 -6.897 1.330 -12.867 1.00 0.00 N ATOM 595 NH2 ARG A 180 -7.789 3.406 -12.475 1.00 0.00 N ATOM 0 H ARG A 180 -2.734 1.728 -7.659 1.00 0.00 H new ATOM 0 HA ARG A 180 -0.391 2.002 -9.407 1.00 0.00 H new ATOM 0 HB2 ARG A 180 -1.953 1.907 -11.205 1.00 0.00 H new ATOM 0 HB3 ARG A 180 -2.486 0.694 -10.057 1.00 0.00 H new ATOM 0 HG2 ARG A 180 -4.263 2.138 -9.250 1.00 0.00 H new ATOM 0 HG3 ARG A 180 -3.660 3.491 -10.185 1.00 0.00 H new ATOM 0 HD2 ARG A 180 -3.977 1.915 -12.254 1.00 0.00 H new ATOM 0 HD3 ARG A 180 -4.981 0.958 -11.183 1.00 0.00 H new ATOM 0 HE ARG A 180 -5.681 3.807 -11.215 1.00 0.00 H new ATOM 0 HH11 ARG A 180 -6.141 0.656 -12.751 1.00 0.00 H new ATOM 0 HH12 ARG A 180 -7.725 1.080 -13.407 1.00 0.00 H new ATOM 0 HH21 ARG A 180 -7.721 4.334 -12.057 1.00 0.00 H new ATOM 0 HH22 ARG A 180 -8.615 3.150 -13.017 1.00 0.00 H new ATOM 609 N SER A 181 -2.247 4.499 -8.428 1.00 0.00 N ATOM 610 CA SER A 181 -2.287 5.960 -8.431 1.00 0.00 C ATOM 611 C SER A 181 -2.823 6.534 -7.123 1.00 0.00 C ATOM 612 O SER A 181 -3.538 5.866 -6.378 1.00 0.00 O ATOM 613 CB SER A 181 -3.141 6.457 -9.598 1.00 0.00 C ATOM 614 OG SER A 181 -2.846 7.809 -9.907 1.00 0.00 O ATOM 0 H SER A 181 -2.910 4.050 -7.796 1.00 0.00 H new ATOM 0 HA SER A 181 -1.260 6.307 -8.543 1.00 0.00 H new ATOM 0 HB2 SER A 181 -2.963 5.833 -10.474 1.00 0.00 H new ATOM 0 HB3 SER A 181 -4.197 6.360 -9.347 1.00 0.00 H new ATOM 0 HG SER A 181 -3.404 8.102 -10.657 1.00 0.00 H new ATOM 620 N VAL A 182 -2.469 7.792 -6.865 1.00 0.00 N ATOM 621 CA VAL A 182 -2.904 8.495 -5.665 1.00 0.00 C ATOM 622 C VAL A 182 -3.399 9.897 -6.016 1.00 0.00 C ATOM 623 O VAL A 182 -2.808 10.580 -6.852 1.00 0.00 O ATOM 624 CB VAL A 182 -1.764 8.610 -4.638 1.00 0.00 C ATOM 625 CG1 VAL A 182 -2.281 9.178 -3.325 1.00 0.00 C ATOM 626 CG2 VAL A 182 -1.103 7.258 -4.420 1.00 0.00 C ATOM 0 H VAL A 182 -1.875 8.348 -7.480 1.00 0.00 H new ATOM 0 HA VAL A 182 -3.717 7.916 -5.227 1.00 0.00 H new ATOM 0 HB VAL A 182 -1.014 9.296 -5.032 1.00 0.00 H new ATOM 0 HG11 VAL A 182 -1.460 9.251 -2.612 1.00 0.00 H new ATOM 0 HG12 VAL A 182 -2.701 10.169 -3.498 1.00 0.00 H new ATOM 0 HG13 VAL A 182 -3.053 8.521 -2.923 1.00 0.00 H new ATOM 0 HG21 VAL A 182 -0.299 7.359 -3.691 1.00 0.00 H new ATOM 0 HG22 VAL A 182 -1.842 6.547 -4.050 1.00 0.00 H new ATOM 0 HG23 VAL A 182 -0.693 6.897 -5.363 1.00 0.00 H new ATOM 636 N ASP A 183 -4.488 10.318 -5.380 1.00 0.00 N ATOM 637 CA ASP A 183 -5.060 11.637 -5.636 1.00 0.00 C ATOM 638 C ASP A 183 -4.414 12.701 -4.748 1.00 0.00 C ATOM 639 O ASP A 183 -4.442 12.594 -3.524 1.00 0.00 O ATOM 640 CB ASP A 183 -6.570 11.614 -5.392 1.00 0.00 C ATOM 641 CG ASP A 183 -7.250 12.895 -5.834 1.00 0.00 C ATOM 642 OD1 ASP A 183 -6.660 13.629 -6.653 1.00 0.00 O ATOM 643 OD2 ASP A 183 -8.375 13.163 -5.361 1.00 0.00 O ATOM 0 H ASP A 183 -4.992 9.767 -4.685 1.00 0.00 H new ATOM 0 HA ASP A 183 -4.863 11.890 -6.678 1.00 0.00 H new ATOM 0 HB2 ASP A 183 -7.008 10.771 -5.926 1.00 0.00 H new ATOM 0 HB3 ASP A 183 -6.761 11.453 -4.331 1.00 0.00 H new ATOM 648 N PRO A 184 -3.824 13.751 -5.350 1.00 0.00 N ATOM 649 CA PRO A 184 -3.181 14.828 -4.592 1.00 0.00 C ATOM 650 C PRO A 184 -4.170 15.559 -3.687 1.00 0.00 C ATOM 651 O PRO A 184 -5.270 15.912 -4.111 1.00 0.00 O ATOM 652 CB PRO A 184 -2.649 15.777 -5.674 1.00 0.00 C ATOM 653 CG PRO A 184 -2.612 14.964 -6.923 1.00 0.00 C ATOM 654 CD PRO A 184 -3.734 13.974 -6.803 1.00 0.00 C ATOM 0 HA PRO A 184 -2.403 14.447 -3.930 1.00 0.00 H new ATOM 0 HB2 PRO A 184 -3.297 16.646 -5.789 1.00 0.00 H new ATOM 0 HB3 PRO A 184 -1.658 16.150 -5.418 1.00 0.00 H new ATOM 0 HG2 PRO A 184 -2.740 15.594 -7.803 1.00 0.00 H new ATOM 0 HG3 PRO A 184 -1.653 14.457 -7.031 1.00 0.00 H new ATOM 0 HD2 PRO A 184 -4.665 14.368 -7.209 1.00 0.00 H new ATOM 0 HD3 PRO A 184 -3.517 13.051 -7.340 1.00 0.00 H new ATOM 662 N ASP A 185 -3.769 15.784 -2.439 1.00 0.00 N ATOM 663 CA ASP A 185 -4.613 16.476 -1.466 1.00 0.00 C ATOM 664 C ASP A 185 -5.735 15.574 -0.951 1.00 0.00 C ATOM 665 O ASP A 185 -6.690 16.052 -0.339 1.00 0.00 O ATOM 666 CB ASP A 185 -5.209 17.748 -2.078 1.00 0.00 C ATOM 667 CG ASP A 185 -5.675 18.733 -1.023 1.00 0.00 C ATOM 668 OD1 ASP A 185 -6.780 18.537 -0.475 1.00 0.00 O ATOM 669 OD2 ASP A 185 -4.934 19.699 -0.745 1.00 0.00 O ATOM 0 H ASP A 185 -2.861 15.496 -2.075 1.00 0.00 H new ATOM 0 HA ASP A 185 -3.980 16.746 -0.621 1.00 0.00 H new ATOM 0 HB2 ASP A 185 -4.464 18.226 -2.714 1.00 0.00 H new ATOM 0 HB3 ASP A 185 -6.050 17.481 -2.718 1.00 0.00 H new ATOM 674 N SER A 186 -5.616 14.270 -1.192 1.00 0.00 N ATOM 675 CA SER A 186 -6.624 13.318 -0.737 1.00 0.00 C ATOM 676 C SER A 186 -6.158 12.611 0.534 1.00 0.00 C ATOM 677 O SER A 186 -4.973 12.634 0.866 1.00 0.00 O ATOM 678 CB SER A 186 -6.921 12.291 -1.831 1.00 0.00 C ATOM 679 OG SER A 186 -7.630 12.884 -2.905 1.00 0.00 O ATOM 0 H SER A 186 -4.835 13.851 -1.697 1.00 0.00 H new ATOM 0 HA SER A 186 -7.539 13.868 -0.515 1.00 0.00 H new ATOM 0 HB2 SER A 186 -5.987 11.865 -2.198 1.00 0.00 H new ATOM 0 HB3 SER A 186 -7.504 11.470 -1.415 1.00 0.00 H new ATOM 0 HG SER A 186 -8.328 12.270 -3.215 1.00 0.00 H new ATOM 685 N PRO A 187 -7.086 11.975 1.272 1.00 0.00 N ATOM 686 CA PRO A 187 -6.756 11.270 2.514 1.00 0.00 C ATOM 687 C PRO A 187 -5.519 10.388 2.382 1.00 0.00 C ATOM 688 O PRO A 187 -4.689 10.332 3.290 1.00 0.00 O ATOM 689 CB PRO A 187 -8.000 10.422 2.771 1.00 0.00 C ATOM 690 CG PRO A 187 -9.114 11.201 2.161 1.00 0.00 C ATOM 691 CD PRO A 187 -8.529 11.899 0.961 1.00 0.00 C ATOM 0 HA PRO A 187 -6.515 11.960 3.323 1.00 0.00 H new ATOM 0 HB2 PRO A 187 -7.909 9.436 2.316 1.00 0.00 H new ATOM 0 HB3 PRO A 187 -8.161 10.267 3.838 1.00 0.00 H new ATOM 0 HG2 PRO A 187 -9.934 10.545 1.869 1.00 0.00 H new ATOM 0 HG3 PRO A 187 -9.520 11.921 2.871 1.00 0.00 H new ATOM 0 HD2 PRO A 187 -8.712 11.340 0.043 1.00 0.00 H new ATOM 0 HD3 PRO A 187 -8.962 12.890 0.823 1.00 0.00 H new ATOM 699 N ALA A 188 -5.391 9.709 1.248 1.00 0.00 N ATOM 700 CA ALA A 188 -4.243 8.844 1.012 1.00 0.00 C ATOM 701 C ALA A 188 -2.961 9.666 0.944 1.00 0.00 C ATOM 702 O ALA A 188 -1.931 9.284 1.500 1.00 0.00 O ATOM 703 CB ALA A 188 -4.433 8.046 -0.269 1.00 0.00 C ATOM 0 H ALA A 188 -6.064 9.741 0.482 1.00 0.00 H new ATOM 0 HA ALA A 188 -4.160 8.145 1.844 1.00 0.00 H new ATOM 0 HB1 ALA A 188 -3.566 7.405 -0.430 1.00 0.00 H new ATOM 0 HB2 ALA A 188 -5.329 7.431 -0.185 1.00 0.00 H new ATOM 0 HB3 ALA A 188 -4.540 8.730 -1.111 1.00 0.00 H new ATOM 709 N GLU A 189 -3.039 10.801 0.258 1.00 0.00 N ATOM 710 CA GLU A 189 -1.894 11.692 0.110 1.00 0.00 C ATOM 711 C GLU A 189 -1.560 12.377 1.430 1.00 0.00 C ATOM 712 O GLU A 189 -0.414 12.360 1.880 1.00 0.00 O ATOM 713 CB GLU A 189 -2.183 12.745 -0.959 1.00 0.00 C ATOM 714 CG GLU A 189 -0.933 13.393 -1.530 1.00 0.00 C ATOM 715 CD GLU A 189 -0.031 12.398 -2.233 1.00 0.00 C ATOM 716 OE1 GLU A 189 0.687 11.651 -1.535 1.00 0.00 O ATOM 717 OE2 GLU A 189 -0.043 12.365 -3.481 1.00 0.00 O ATOM 0 H GLU A 189 -3.887 11.127 -0.206 1.00 0.00 H new ATOM 0 HA GLU A 189 -1.036 11.093 -0.194 1.00 0.00 H new ATOM 0 HB2 GLU A 189 -2.745 12.282 -1.770 1.00 0.00 H new ATOM 0 HB3 GLU A 189 -2.820 13.519 -0.531 1.00 0.00 H new ATOM 0 HG2 GLU A 189 -1.222 14.175 -2.232 1.00 0.00 H new ATOM 0 HG3 GLU A 189 -0.378 13.876 -0.725 1.00 0.00 H new ATOM 724 N ALA A 190 -2.571 12.985 2.042 1.00 0.00 N ATOM 725 CA ALA A 190 -2.394 13.687 3.310 1.00 0.00 C ATOM 726 C ALA A 190 -1.736 12.793 4.357 1.00 0.00 C ATOM 727 O ALA A 190 -1.104 13.283 5.293 1.00 0.00 O ATOM 728 CB ALA A 190 -3.732 14.200 3.819 1.00 0.00 C ATOM 0 H ALA A 190 -3.524 13.006 1.680 1.00 0.00 H new ATOM 0 HA ALA A 190 -1.732 14.534 3.133 1.00 0.00 H new ATOM 0 HB1 ALA A 190 -3.586 14.721 4.765 1.00 0.00 H new ATOM 0 HB2 ALA A 190 -4.160 14.887 3.089 1.00 0.00 H new ATOM 0 HB3 ALA A 190 -4.411 13.360 3.969 1.00 0.00 H new ATOM 734 N SER A 191 -1.887 11.483 4.196 1.00 0.00 N ATOM 735 CA SER A 191 -1.304 10.529 5.131 1.00 0.00 C ATOM 736 C SER A 191 0.144 10.224 4.767 1.00 0.00 C ATOM 737 O SER A 191 0.960 9.906 5.632 1.00 0.00 O ATOM 738 CB SER A 191 -2.121 9.237 5.145 1.00 0.00 C ATOM 739 OG SER A 191 -1.734 8.399 6.220 1.00 0.00 O ATOM 0 H SER A 191 -2.407 11.058 3.428 1.00 0.00 H new ATOM 0 HA SER A 191 -1.322 10.975 6.125 1.00 0.00 H new ATOM 0 HB2 SER A 191 -3.181 9.475 5.229 1.00 0.00 H new ATOM 0 HB3 SER A 191 -1.987 8.708 4.201 1.00 0.00 H new ATOM 0 HG SER A 191 -2.491 8.279 6.830 1.00 0.00 H new ATOM 745 N GLY A 192 0.455 10.319 3.479 1.00 0.00 N ATOM 746 CA GLY A 192 1.803 10.046 3.017 1.00 0.00 C ATOM 747 C GLY A 192 1.864 8.861 2.071 1.00 0.00 C ATOM 748 O GLY A 192 2.947 8.401 1.712 1.00 0.00 O ATOM 0 H GLY A 192 -0.204 10.581 2.746 1.00 0.00 H new ATOM 0 HA2 GLY A 192 2.197 10.929 2.514 1.00 0.00 H new ATOM 0 HA3 GLY A 192 2.446 9.855 3.876 1.00 0.00 H new ATOM 752 N LEU A 193 0.697 8.368 1.663 1.00 0.00 N ATOM 753 CA LEU A 193 0.622 7.234 0.752 1.00 0.00 C ATOM 754 C LEU A 193 1.308 7.562 -0.568 1.00 0.00 C ATOM 755 O LEU A 193 1.351 8.720 -0.983 1.00 0.00 O ATOM 756 CB LEU A 193 -0.840 6.856 0.508 1.00 0.00 C ATOM 757 CG LEU A 193 -1.059 5.561 -0.278 1.00 0.00 C ATOM 758 CD1 LEU A 193 -2.463 5.027 -0.040 1.00 0.00 C ATOM 759 CD2 LEU A 193 -0.818 5.788 -1.764 1.00 0.00 C ATOM 0 H LEU A 193 -0.209 8.738 1.950 1.00 0.00 H new ATOM 0 HA LEU A 193 1.137 6.387 1.206 1.00 0.00 H new ATOM 0 HB2 LEU A 193 -1.340 6.765 1.472 1.00 0.00 H new ATOM 0 HB3 LEU A 193 -1.325 7.673 -0.027 1.00 0.00 H new ATOM 0 HG LEU A 193 -0.343 4.819 0.075 1.00 0.00 H new ATOM 0 HD11 LEU A 193 -2.603 4.106 -0.606 1.00 0.00 H new ATOM 0 HD12 LEU A 193 -2.600 4.825 1.022 1.00 0.00 H new ATOM 0 HD13 LEU A 193 -3.194 5.767 -0.366 1.00 0.00 H new ATOM 0 HD21 LEU A 193 -0.979 4.856 -2.305 1.00 0.00 H new ATOM 0 HD22 LEU A 193 -1.509 6.546 -2.133 1.00 0.00 H new ATOM 0 HD23 LEU A 193 0.207 6.125 -1.919 1.00 0.00 H new ATOM 771 N ARG A 194 1.843 6.540 -1.228 1.00 0.00 N ATOM 772 CA ARG A 194 2.521 6.737 -2.499 1.00 0.00 C ATOM 773 C ARG A 194 2.243 5.576 -3.443 1.00 0.00 C ATOM 774 O ARG A 194 2.400 4.412 -3.075 1.00 0.00 O ATOM 775 CB ARG A 194 4.029 6.886 -2.280 1.00 0.00 C ATOM 776 CG ARG A 194 4.388 7.809 -1.127 1.00 0.00 C ATOM 777 CD ARG A 194 5.881 8.091 -1.081 1.00 0.00 C ATOM 778 NE ARG A 194 6.315 8.530 0.244 1.00 0.00 N ATOM 779 CZ ARG A 194 7.471 9.147 0.479 1.00 0.00 C ATOM 780 NH1 ARG A 194 8.311 9.401 -0.517 1.00 0.00 N ATOM 781 NH2 ARG A 194 7.788 9.512 1.714 1.00 0.00 N ATOM 0 H ARG A 194 1.819 5.573 -0.904 1.00 0.00 H new ATOM 0 HA ARG A 194 2.138 7.651 -2.952 1.00 0.00 H new ATOM 0 HB2 ARG A 194 4.460 5.902 -2.094 1.00 0.00 H new ATOM 0 HB3 ARG A 194 4.485 7.266 -3.194 1.00 0.00 H new ATOM 0 HG2 ARG A 194 3.843 8.747 -1.228 1.00 0.00 H new ATOM 0 HG3 ARG A 194 4.073 7.357 -0.186 1.00 0.00 H new ATOM 0 HD2 ARG A 194 6.429 7.191 -1.362 1.00 0.00 H new ATOM 0 HD3 ARG A 194 6.128 8.857 -1.816 1.00 0.00 H new ATOM 0 HE ARG A 194 5.696 8.353 1.035 1.00 0.00 H new ATOM 0 HH11 ARG A 194 8.072 9.123 -1.469 1.00 0.00 H new ATOM 0 HH12 ARG A 194 9.195 9.874 -0.330 1.00 0.00 H new ATOM 0 HH21 ARG A 194 7.146 9.320 2.483 1.00 0.00 H new ATOM 0 HH22 ARG A 194 8.674 9.985 1.895 1.00 0.00 H new ATOM 795 N ALA A 195 1.832 5.900 -4.663 1.00 0.00 N ATOM 796 CA ALA A 195 1.536 4.886 -5.661 1.00 0.00 C ATOM 797 C ALA A 195 2.730 3.961 -5.864 1.00 0.00 C ATOM 798 O ALA A 195 3.875 4.361 -5.661 1.00 0.00 O ATOM 799 CB ALA A 195 1.142 5.540 -6.977 1.00 0.00 C ATOM 0 H ALA A 195 1.697 6.859 -4.983 1.00 0.00 H new ATOM 0 HA ALA A 195 0.699 4.287 -5.303 1.00 0.00 H new ATOM 0 HB1 ALA A 195 0.923 4.769 -7.715 1.00 0.00 H new ATOM 0 HB2 ALA A 195 0.258 6.159 -6.825 1.00 0.00 H new ATOM 0 HB3 ALA A 195 1.963 6.162 -7.334 1.00 0.00 H new ATOM 805 N GLN A 196 2.450 2.726 -6.266 1.00 0.00 N ATOM 806 CA GLN A 196 3.491 1.729 -6.506 1.00 0.00 C ATOM 807 C GLN A 196 4.009 1.122 -5.202 1.00 0.00 C ATOM 808 O GLN A 196 4.968 0.355 -5.215 1.00 0.00 O ATOM 809 CB GLN A 196 4.659 2.334 -7.294 1.00 0.00 C ATOM 810 CG GLN A 196 4.225 3.095 -8.536 1.00 0.00 C ATOM 811 CD GLN A 196 5.396 3.525 -9.395 1.00 0.00 C ATOM 812 OE1 GLN A 196 5.877 2.764 -10.235 1.00 0.00 O ATOM 813 NE2 GLN A 196 5.861 4.750 -9.189 1.00 0.00 N ATOM 0 H GLN A 196 1.502 2.388 -6.434 1.00 0.00 H new ATOM 0 HA GLN A 196 3.036 0.933 -7.095 1.00 0.00 H new ATOM 0 HB2 GLN A 196 5.217 3.007 -6.642 1.00 0.00 H new ATOM 0 HB3 GLN A 196 5.341 1.536 -7.587 1.00 0.00 H new ATOM 0 HG2 GLN A 196 3.557 2.468 -9.127 1.00 0.00 H new ATOM 0 HG3 GLN A 196 3.656 3.975 -8.238 1.00 0.00 H new ATOM 0 HE21 GLN A 196 5.431 5.346 -8.482 1.00 0.00 H new ATOM 0 HE22 GLN A 196 6.648 5.096 -9.738 1.00 0.00 H new ATOM 822 N ASP A 197 3.378 1.456 -4.076 1.00 0.00 N ATOM 823 CA ASP A 197 3.803 0.914 -2.789 1.00 0.00 C ATOM 824 C ASP A 197 3.301 -0.522 -2.616 1.00 0.00 C ATOM 825 O ASP A 197 2.284 -0.905 -3.194 1.00 0.00 O ATOM 826 CB ASP A 197 3.302 1.799 -1.646 1.00 0.00 C ATOM 827 CG ASP A 197 1.789 1.886 -1.595 1.00 0.00 C ATOM 828 OD1 ASP A 197 1.123 0.999 -2.166 1.00 0.00 O ATOM 829 OD2 ASP A 197 1.270 2.843 -0.982 1.00 0.00 O ATOM 0 H ASP A 197 2.581 2.091 -4.030 1.00 0.00 H new ATOM 0 HA ASP A 197 4.893 0.900 -2.764 1.00 0.00 H new ATOM 0 HB2 ASP A 197 3.672 1.406 -0.699 1.00 0.00 H new ATOM 0 HB3 ASP A 197 3.716 2.801 -1.759 1.00 0.00 H new ATOM 834 N ARG A 198 4.024 -1.315 -1.829 1.00 0.00 N ATOM 835 CA ARG A 198 3.651 -2.712 -1.597 1.00 0.00 C ATOM 836 C ARG A 198 2.647 -2.844 -0.460 1.00 0.00 C ATOM 837 O ARG A 198 2.996 -2.673 0.703 1.00 0.00 O ATOM 838 CB ARG A 198 4.889 -3.560 -1.265 1.00 0.00 C ATOM 839 CG ARG A 198 5.989 -3.521 -2.317 1.00 0.00 C ATOM 840 CD ARG A 198 5.676 -4.451 -3.476 1.00 0.00 C ATOM 841 NE ARG A 198 4.369 -4.156 -4.038 1.00 0.00 N ATOM 842 CZ ARG A 198 4.073 -2.999 -4.615 1.00 0.00 C ATOM 843 NH1 ARG A 198 5.027 -2.121 -4.871 1.00 0.00 N ATOM 844 NH2 ARG A 198 2.826 -2.732 -4.950 1.00 0.00 N ATOM 0 H ARG A 198 4.869 -1.017 -1.342 1.00 0.00 H new ATOM 0 HA ARG A 198 3.192 -3.073 -2.518 1.00 0.00 H new ATOM 0 HB2 ARG A 198 5.301 -3.220 -0.315 1.00 0.00 H new ATOM 0 HB3 ARG A 198 4.576 -4.595 -1.124 1.00 0.00 H new ATOM 0 HG2 ARG A 198 6.106 -2.502 -2.687 1.00 0.00 H new ATOM 0 HG3 ARG A 198 6.939 -3.807 -1.864 1.00 0.00 H new ATOM 0 HD2 ARG A 198 6.440 -4.348 -4.247 1.00 0.00 H new ATOM 0 HD3 ARG A 198 5.705 -5.486 -3.135 1.00 0.00 H new ATOM 0 HE ARG A 198 3.645 -4.873 -3.986 1.00 0.00 H new ATOM 0 HH11 ARG A 198 5.994 -2.332 -4.625 1.00 0.00 H new ATOM 0 HH12 ARG A 198 4.796 -1.232 -5.315 1.00 0.00 H new ATOM 0 HH21 ARG A 198 2.091 -3.415 -4.765 1.00 0.00 H new ATOM 0 HH22 ARG A 198 2.596 -1.843 -5.394 1.00 0.00 H new ATOM 858 N ILE A 199 1.404 -3.178 -0.797 1.00 0.00 N ATOM 859 CA ILE A 199 0.369 -3.355 0.220 1.00 0.00 C ATOM 860 C ILE A 199 0.657 -4.595 1.064 1.00 0.00 C ATOM 861 O ILE A 199 0.620 -5.720 0.565 1.00 0.00 O ATOM 862 CB ILE A 199 -1.033 -3.477 -0.415 1.00 0.00 C ATOM 863 CG1 ILE A 199 -1.379 -2.202 -1.188 1.00 0.00 C ATOM 864 CG2 ILE A 199 -2.085 -3.753 0.652 1.00 0.00 C ATOM 865 CD1 ILE A 199 -1.520 -0.980 -0.307 1.00 0.00 C ATOM 0 H ILE A 199 1.090 -3.330 -1.755 1.00 0.00 H new ATOM 0 HA ILE A 199 0.382 -2.471 0.857 1.00 0.00 H new ATOM 0 HB ILE A 199 -1.023 -4.316 -1.111 1.00 0.00 H new ATOM 0 HG12 ILE A 199 -0.604 -2.016 -1.932 1.00 0.00 H new ATOM 0 HG13 ILE A 199 -2.311 -2.358 -1.731 1.00 0.00 H new ATOM 0 HG21 ILE A 199 -3.066 -3.835 0.183 1.00 0.00 H new ATOM 0 HG22 ILE A 199 -1.848 -4.686 1.164 1.00 0.00 H new ATOM 0 HG23 ILE A 199 -2.095 -2.936 1.373 1.00 0.00 H new ATOM 0 HD11 ILE A 199 -1.766 -0.114 -0.922 1.00 0.00 H new ATOM 0 HD12 ILE A 199 -2.315 -1.146 0.420 1.00 0.00 H new ATOM 0 HD13 ILE A 199 -0.581 -0.799 0.216 1.00 0.00 H new ATOM 877 N VAL A 200 0.964 -4.380 2.342 1.00 0.00 N ATOM 878 CA VAL A 200 1.281 -5.479 3.251 1.00 0.00 C ATOM 879 C VAL A 200 0.147 -5.771 4.231 1.00 0.00 C ATOM 880 O VAL A 200 -0.207 -6.931 4.450 1.00 0.00 O ATOM 881 CB VAL A 200 2.562 -5.183 4.054 1.00 0.00 C ATOM 882 CG1 VAL A 200 3.000 -6.410 4.838 1.00 0.00 C ATOM 883 CG2 VAL A 200 3.674 -4.707 3.132 1.00 0.00 C ATOM 0 H VAL A 200 1.000 -3.455 2.771 1.00 0.00 H new ATOM 0 HA VAL A 200 1.430 -6.356 2.621 1.00 0.00 H new ATOM 0 HB VAL A 200 2.344 -4.386 4.765 1.00 0.00 H new ATOM 0 HG11 VAL A 200 3.906 -6.180 5.398 1.00 0.00 H new ATOM 0 HG12 VAL A 200 2.210 -6.701 5.530 1.00 0.00 H new ATOM 0 HG13 VAL A 200 3.198 -7.231 4.149 1.00 0.00 H new ATOM 0 HG21 VAL A 200 4.570 -4.503 3.718 1.00 0.00 H new ATOM 0 HG22 VAL A 200 3.891 -5.480 2.394 1.00 0.00 H new ATOM 0 HG23 VAL A 200 3.359 -3.797 2.622 1.00 0.00 H new ATOM 893 N GLU A 201 -0.410 -4.727 4.837 1.00 0.00 N ATOM 894 CA GLU A 201 -1.488 -4.909 5.806 1.00 0.00 C ATOM 895 C GLU A 201 -2.610 -3.894 5.607 1.00 0.00 C ATOM 896 O GLU A 201 -2.485 -2.954 4.822 1.00 0.00 O ATOM 897 CB GLU A 201 -0.938 -4.816 7.235 1.00 0.00 C ATOM 898 CG GLU A 201 -0.698 -3.394 7.718 1.00 0.00 C ATOM 899 CD GLU A 201 0.270 -3.329 8.883 1.00 0.00 C ATOM 900 OE1 GLU A 201 1.291 -4.047 8.847 1.00 0.00 O ATOM 901 OE2 GLU A 201 0.007 -2.559 9.831 1.00 0.00 O ATOM 0 H GLU A 201 -0.138 -3.757 4.678 1.00 0.00 H new ATOM 0 HA GLU A 201 -1.909 -5.901 5.645 1.00 0.00 H new ATOM 0 HB2 GLU A 201 -1.636 -5.306 7.914 1.00 0.00 H new ATOM 0 HB3 GLU A 201 -0.000 -5.369 7.288 1.00 0.00 H new ATOM 0 HG2 GLU A 201 -0.310 -2.795 6.894 1.00 0.00 H new ATOM 0 HG3 GLU A 201 -1.648 -2.950 8.015 1.00 0.00 H new ATOM 908 N VAL A 202 -3.704 -4.100 6.335 1.00 0.00 N ATOM 909 CA VAL A 202 -4.861 -3.218 6.258 1.00 0.00 C ATOM 910 C VAL A 202 -5.568 -3.144 7.606 1.00 0.00 C ATOM 911 O VAL A 202 -6.134 -4.129 8.076 1.00 0.00 O ATOM 912 CB VAL A 202 -5.863 -3.698 5.191 1.00 0.00 C ATOM 913 CG1 VAL A 202 -6.945 -2.652 4.958 1.00 0.00 C ATOM 914 CG2 VAL A 202 -5.142 -4.030 3.893 1.00 0.00 C ATOM 0 H VAL A 202 -3.812 -4.876 6.988 1.00 0.00 H new ATOM 0 HA VAL A 202 -4.496 -2.229 5.979 1.00 0.00 H new ATOM 0 HB VAL A 202 -6.344 -4.605 5.556 1.00 0.00 H new ATOM 0 HG11 VAL A 202 -7.642 -3.012 4.201 1.00 0.00 H new ATOM 0 HG12 VAL A 202 -7.482 -2.471 5.889 1.00 0.00 H new ATOM 0 HG13 VAL A 202 -6.486 -1.724 4.617 1.00 0.00 H new ATOM 0 HG21 VAL A 202 -5.866 -4.367 3.151 1.00 0.00 H new ATOM 0 HG22 VAL A 202 -4.631 -3.141 3.523 1.00 0.00 H new ATOM 0 HG23 VAL A 202 -4.413 -4.820 4.074 1.00 0.00 H new ATOM 924 N ASN A 203 -5.527 -1.973 8.229 1.00 0.00 N ATOM 925 CA ASN A 203 -6.155 -1.776 9.530 1.00 0.00 C ATOM 926 C ASN A 203 -5.397 -2.528 10.621 1.00 0.00 C ATOM 927 O ASN A 203 -5.939 -2.798 11.693 1.00 0.00 O ATOM 928 CB ASN A 203 -7.617 -2.230 9.500 1.00 0.00 C ATOM 929 CG ASN A 203 -8.429 -1.637 10.635 1.00 0.00 C ATOM 930 OD1 ASN A 203 -8.355 -0.438 10.906 1.00 0.00 O ATOM 931 ND2 ASN A 203 -9.211 -2.475 11.305 1.00 0.00 N ATOM 0 H ASN A 203 -5.065 -1.144 7.854 1.00 0.00 H new ATOM 0 HA ASN A 203 -6.123 -0.710 9.757 1.00 0.00 H new ATOM 0 HB2 ASN A 203 -8.064 -1.943 8.548 1.00 0.00 H new ATOM 0 HB3 ASN A 203 -7.658 -3.318 9.557 1.00 0.00 H new ATOM 0 HD21 ASN A 203 -9.781 -2.133 12.078 1.00 0.00 H new ATOM 0 HD22 ASN A 203 -9.242 -3.461 11.046 1.00 0.00 H new ATOM 938 N GLY A 204 -4.136 -2.852 10.347 1.00 0.00 N ATOM 939 CA GLY A 204 -3.324 -3.555 11.322 1.00 0.00 C ATOM 940 C GLY A 204 -3.168 -5.036 11.027 1.00 0.00 C ATOM 941 O GLY A 204 -2.297 -5.693 11.597 1.00 0.00 O ATOM 0 H GLY A 204 -3.664 -2.640 9.468 1.00 0.00 H new ATOM 0 HA2 GLY A 204 -2.337 -3.095 11.360 1.00 0.00 H new ATOM 0 HA3 GLY A 204 -3.770 -3.435 12.309 1.00 0.00 H new ATOM 945 N VAL A 205 -4.008 -5.573 10.146 1.00 0.00 N ATOM 946 CA VAL A 205 -3.937 -6.992 9.807 1.00 0.00 C ATOM 947 C VAL A 205 -2.884 -7.260 8.735 1.00 0.00 C ATOM 948 O VAL A 205 -3.170 -7.211 7.539 1.00 0.00 O ATOM 949 CB VAL A 205 -5.298 -7.536 9.326 1.00 0.00 C ATOM 950 CG1 VAL A 205 -6.329 -7.458 10.442 1.00 0.00 C ATOM 951 CG2 VAL A 205 -5.778 -6.787 8.091 1.00 0.00 C ATOM 0 H VAL A 205 -4.738 -5.054 9.658 1.00 0.00 H new ATOM 0 HA VAL A 205 -3.655 -7.511 10.723 1.00 0.00 H new ATOM 0 HB VAL A 205 -5.169 -8.583 9.053 1.00 0.00 H new ATOM 0 HG11 VAL A 205 -7.283 -7.846 10.084 1.00 0.00 H new ATOM 0 HG12 VAL A 205 -5.991 -8.052 11.291 1.00 0.00 H new ATOM 0 HG13 VAL A 205 -6.453 -6.420 10.751 1.00 0.00 H new ATOM 0 HG21 VAL A 205 -6.739 -7.190 7.772 1.00 0.00 H new ATOM 0 HG22 VAL A 205 -5.888 -5.729 8.327 1.00 0.00 H new ATOM 0 HG23 VAL A 205 -5.051 -6.906 7.288 1.00 0.00 H new ATOM 961 N CYS A 206 -1.663 -7.551 9.175 1.00 0.00 N ATOM 962 CA CYS A 206 -0.565 -7.835 8.257 1.00 0.00 C ATOM 963 C CYS A 206 -0.603 -9.289 7.804 1.00 0.00 C ATOM 964 O CYS A 206 -0.333 -10.201 8.586 1.00 0.00 O ATOM 965 CB CYS A 206 0.778 -7.530 8.922 1.00 0.00 C ATOM 966 SG CYS A 206 2.210 -7.802 7.852 1.00 0.00 S ATOM 0 H CYS A 206 -1.409 -7.596 10.162 1.00 0.00 H new ATOM 0 HA CYS A 206 -0.680 -7.195 7.382 1.00 0.00 H new ATOM 0 HB2 CYS A 206 0.779 -6.492 9.255 1.00 0.00 H new ATOM 0 HB3 CYS A 206 0.880 -8.151 9.812 1.00 0.00 H new ATOM 0 HG CYS A 206 3.298 -7.515 8.502 1.00 0.00 H new ATOM 972 N MET A 207 -0.944 -9.501 6.537 1.00 0.00 N ATOM 973 CA MET A 207 -1.020 -10.849 5.986 1.00 0.00 C ATOM 974 C MET A 207 -0.257 -10.949 4.670 1.00 0.00 C ATOM 975 O MET A 207 -0.761 -10.558 3.616 1.00 0.00 O ATOM 976 CB MET A 207 -2.481 -11.253 5.781 1.00 0.00 C ATOM 977 CG MET A 207 -3.227 -11.520 7.078 1.00 0.00 C ATOM 978 SD MET A 207 -2.463 -12.819 8.067 1.00 0.00 S ATOM 979 CE MET A 207 -3.254 -12.548 9.651 1.00 0.00 C ATOM 0 H MET A 207 -1.171 -8.759 5.875 1.00 0.00 H new ATOM 0 HA MET A 207 -0.557 -11.533 6.698 1.00 0.00 H new ATOM 0 HB2 MET A 207 -2.994 -10.463 5.233 1.00 0.00 H new ATOM 0 HB3 MET A 207 -2.518 -12.148 5.160 1.00 0.00 H new ATOM 0 HG2 MET A 207 -3.270 -10.601 7.663 1.00 0.00 H new ATOM 0 HG3 MET A 207 -4.255 -11.800 6.850 1.00 0.00 H new ATOM 0 HE1 MET A 207 -2.884 -13.277 10.372 1.00 0.00 H new ATOM 0 HE2 MET A 207 -3.027 -11.542 10.003 1.00 0.00 H new ATOM 0 HE3 MET A 207 -4.333 -12.660 9.543 1.00 0.00 H new ATOM 989 N GLU A 208 0.959 -11.480 4.736 1.00 0.00 N ATOM 990 CA GLU A 208 1.790 -11.635 3.549 1.00 0.00 C ATOM 991 C GLU A 208 1.295 -12.793 2.690 1.00 0.00 C ATOM 992 O GLU A 208 1.522 -13.959 3.012 1.00 0.00 O ATOM 993 CB GLU A 208 3.249 -11.866 3.946 1.00 0.00 C ATOM 994 CG GLU A 208 4.229 -11.653 2.804 1.00 0.00 C ATOM 995 CD GLU A 208 5.644 -11.406 3.290 1.00 0.00 C ATOM 996 OE1 GLU A 208 5.892 -10.331 3.876 1.00 0.00 O ATOM 997 OE2 GLU A 208 6.505 -12.287 3.085 1.00 0.00 O ATOM 0 H GLU A 208 1.391 -11.810 5.599 1.00 0.00 H new ATOM 0 HA GLU A 208 1.723 -10.717 2.966 1.00 0.00 H new ATOM 0 HB2 GLU A 208 3.505 -11.193 4.765 1.00 0.00 H new ATOM 0 HB3 GLU A 208 3.358 -12.883 4.323 1.00 0.00 H new ATOM 0 HG2 GLU A 208 4.219 -12.528 2.154 1.00 0.00 H new ATOM 0 HG3 GLU A 208 3.902 -10.805 2.202 1.00 0.00 H new ATOM 1004 N GLY A 209 0.617 -12.464 1.596 1.00 0.00 N ATOM 1005 CA GLY A 209 0.101 -13.488 0.707 1.00 0.00 C ATOM 1006 C GLY A 209 -1.404 -13.406 0.520 1.00 0.00 C ATOM 1007 O GLY A 209 -2.012 -14.314 -0.047 1.00 0.00 O ATOM 0 H GLY A 209 0.416 -11.506 1.309 1.00 0.00 H new ATOM 0 HA2 GLY A 209 0.588 -13.398 -0.264 1.00 0.00 H new ATOM 0 HA3 GLY A 209 0.360 -14.470 1.103 1.00 0.00 H new ATOM 1011 N LYS A 210 -2.009 -12.320 0.996 1.00 0.00 N ATOM 1012 CA LYS A 210 -3.452 -12.135 0.875 1.00 0.00 C ATOM 1013 C LYS A 210 -3.898 -12.203 -0.582 1.00 0.00 C ATOM 1014 O LYS A 210 -3.164 -11.806 -1.487 1.00 0.00 O ATOM 1015 CB LYS A 210 -3.868 -10.793 1.480 1.00 0.00 C ATOM 1016 CG LYS A 210 -3.962 -10.815 2.995 1.00 0.00 C ATOM 1017 CD LYS A 210 -5.014 -11.803 3.475 1.00 0.00 C ATOM 1018 CE LYS A 210 -5.904 -11.194 4.546 1.00 0.00 C ATOM 1019 NZ LYS A 210 -6.444 -12.227 5.472 1.00 0.00 N ATOM 0 H LYS A 210 -1.523 -11.557 1.468 1.00 0.00 H new ATOM 0 HA LYS A 210 -3.938 -12.944 1.421 1.00 0.00 H new ATOM 0 HB2 LYS A 210 -3.150 -10.030 1.179 1.00 0.00 H new ATOM 0 HB3 LYS A 210 -4.834 -10.502 1.068 1.00 0.00 H new ATOM 0 HG2 LYS A 210 -2.993 -11.081 3.417 1.00 0.00 H new ATOM 0 HG3 LYS A 210 -4.205 -9.817 3.360 1.00 0.00 H new ATOM 0 HD2 LYS A 210 -5.625 -12.123 2.631 1.00 0.00 H new ATOM 0 HD3 LYS A 210 -4.525 -12.693 3.870 1.00 0.00 H new ATOM 0 HE2 LYS A 210 -5.336 -10.458 5.115 1.00 0.00 H new ATOM 0 HE3 LYS A 210 -6.730 -10.663 4.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 210 -6.750 -11.774 6.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 210 -7.255 -12.702 5.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 210 -5.704 -12.928 5.680 1.00 0.00 H new ATOM 1033 N GLN A 211 -5.109 -12.706 -0.798 1.00 0.00 N ATOM 1034 CA GLN A 211 -5.662 -12.823 -2.143 1.00 0.00 C ATOM 1035 C GLN A 211 -6.202 -11.483 -2.621 1.00 0.00 C ATOM 1036 O GLN A 211 -6.476 -10.591 -1.819 1.00 0.00 O ATOM 1037 CB GLN A 211 -6.779 -13.868 -2.174 1.00 0.00 C ATOM 1038 CG GLN A 211 -6.285 -15.300 -2.027 1.00 0.00 C ATOM 1039 CD GLN A 211 -5.750 -15.904 -3.313 1.00 0.00 C ATOM 1040 OE1 GLN A 211 -5.562 -17.117 -3.402 1.00 0.00 O ATOM 1041 NE2 GLN A 211 -5.499 -15.074 -4.318 1.00 0.00 N ATOM 0 H GLN A 211 -5.727 -13.040 -0.058 1.00 0.00 H new ATOM 0 HA GLN A 211 -4.860 -13.139 -2.810 1.00 0.00 H new ATOM 0 HB2 GLN A 211 -7.487 -13.654 -1.373 1.00 0.00 H new ATOM 0 HB3 GLN A 211 -7.324 -13.776 -3.114 1.00 0.00 H new ATOM 0 HG2 GLN A 211 -5.500 -15.327 -1.271 1.00 0.00 H new ATOM 0 HG3 GLN A 211 -7.103 -15.920 -1.659 1.00 0.00 H new ATOM 0 HE21 GLN A 211 -5.667 -14.074 -4.208 1.00 0.00 H new ATOM 0 HE22 GLN A 211 -5.138 -15.436 -5.201 1.00 0.00 H new ATOM 1050 N HIS A 212 -6.359 -11.348 -3.934 1.00 0.00 N ATOM 1051 CA HIS A 212 -6.874 -10.113 -4.521 1.00 0.00 C ATOM 1052 C HIS A 212 -8.126 -9.647 -3.783 1.00 0.00 C ATOM 1053 O HIS A 212 -8.192 -8.514 -3.307 1.00 0.00 O ATOM 1054 CB HIS A 212 -7.187 -10.318 -6.004 1.00 0.00 C ATOM 1055 CG HIS A 212 -7.483 -9.044 -6.733 1.00 0.00 C ATOM 1056 ND1 HIS A 212 -7.577 -8.966 -8.106 1.00 0.00 N ATOM 1057 CD2 HIS A 212 -7.707 -7.791 -6.270 1.00 0.00 C ATOM 1058 CE1 HIS A 212 -7.845 -7.720 -8.457 1.00 0.00 C ATOM 1059 NE2 HIS A 212 -7.930 -6.989 -7.362 1.00 0.00 N ATOM 0 H HIS A 212 -6.138 -12.077 -4.612 1.00 0.00 H new ATOM 0 HA HIS A 212 -6.107 -9.344 -4.425 1.00 0.00 H new ATOM 0 HB2 HIS A 212 -6.341 -10.812 -6.481 1.00 0.00 H new ATOM 0 HB3 HIS A 212 -8.042 -10.988 -6.098 1.00 0.00 H new ATOM 0 HD2 HIS A 212 -7.710 -7.481 -5.236 1.00 0.00 H new ATOM 0 HE1 HIS A 212 -7.973 -7.362 -9.468 1.00 0.00 H new ATOM 0 HE2 HIS A 212 -8.129 -5.989 -7.332 1.00 0.00 H new ATOM 1068 N GLY A 213 -9.110 -10.534 -3.680 1.00 0.00 N ATOM 1069 CA GLY A 213 -10.336 -10.199 -2.987 1.00 0.00 C ATOM 1070 C GLY A 213 -10.100 -9.959 -1.511 1.00 0.00 C ATOM 1071 O GLY A 213 -10.766 -9.129 -0.892 1.00 0.00 O ATOM 0 H GLY A 213 -9.079 -11.478 -4.065 1.00 0.00 H new ATOM 0 HA2 GLY A 213 -10.775 -9.307 -3.435 1.00 0.00 H new ATOM 0 HA3 GLY A 213 -11.057 -11.007 -3.113 1.00 0.00 H new ATOM 1075 N ASP A 214 -9.137 -10.685 -0.949 1.00 0.00 N ATOM 1076 CA ASP A 214 -8.799 -10.545 0.461 1.00 0.00 C ATOM 1077 C ASP A 214 -8.273 -9.144 0.741 1.00 0.00 C ATOM 1078 O ASP A 214 -8.701 -8.487 1.690 1.00 0.00 O ATOM 1079 CB ASP A 214 -7.755 -11.589 0.860 1.00 0.00 C ATOM 1080 CG ASP A 214 -8.340 -12.984 0.956 1.00 0.00 C ATOM 1081 OD1 ASP A 214 -9.171 -13.340 0.094 1.00 0.00 O ATOM 1082 OD2 ASP A 214 -7.966 -13.722 1.892 1.00 0.00 O ATOM 0 H ASP A 214 -8.578 -11.376 -1.450 1.00 0.00 H new ATOM 0 HA ASP A 214 -9.700 -10.705 1.053 1.00 0.00 H new ATOM 0 HB2 ASP A 214 -6.946 -11.587 0.130 1.00 0.00 H new ATOM 0 HB3 ASP A 214 -7.319 -11.314 1.820 1.00 0.00 H new ATOM 1087 N VAL A 215 -7.352 -8.685 -0.102 1.00 0.00 N ATOM 1088 CA VAL A 215 -6.784 -7.354 0.049 1.00 0.00 C ATOM 1089 C VAL A 215 -7.850 -6.296 -0.204 1.00 0.00 C ATOM 1090 O VAL A 215 -7.900 -5.272 0.476 1.00 0.00 O ATOM 1091 CB VAL A 215 -5.604 -7.120 -0.916 1.00 0.00 C ATOM 1092 CG1 VAL A 215 -4.937 -5.785 -0.626 1.00 0.00 C ATOM 1093 CG2 VAL A 215 -4.595 -8.256 -0.825 1.00 0.00 C ATOM 0 H VAL A 215 -6.986 -9.215 -0.893 1.00 0.00 H new ATOM 0 HA VAL A 215 -6.413 -7.276 1.071 1.00 0.00 H new ATOM 0 HB VAL A 215 -5.995 -7.097 -1.933 1.00 0.00 H new ATOM 0 HG11 VAL A 215 -4.106 -5.636 -1.316 1.00 0.00 H new ATOM 0 HG12 VAL A 215 -5.662 -4.981 -0.752 1.00 0.00 H new ATOM 0 HG13 VAL A 215 -4.563 -5.780 0.398 1.00 0.00 H new ATOM 0 HG21 VAL A 215 -3.772 -8.068 -1.515 1.00 0.00 H new ATOM 0 HG22 VAL A 215 -4.208 -8.319 0.192 1.00 0.00 H new ATOM 0 HG23 VAL A 215 -5.081 -9.196 -1.087 1.00 0.00 H new ATOM 1103 N VAL A 216 -8.709 -6.562 -1.183 1.00 0.00 N ATOM 1104 CA VAL A 216 -9.786 -5.645 -1.525 1.00 0.00 C ATOM 1105 C VAL A 216 -10.817 -5.591 -0.404 1.00 0.00 C ATOM 1106 O VAL A 216 -11.288 -4.518 -0.028 1.00 0.00 O ATOM 1107 CB VAL A 216 -10.483 -6.061 -2.836 1.00 0.00 C ATOM 1108 CG1 VAL A 216 -11.576 -5.069 -3.206 1.00 0.00 C ATOM 1109 CG2 VAL A 216 -9.467 -6.186 -3.962 1.00 0.00 C ATOM 0 H VAL A 216 -8.678 -7.407 -1.753 1.00 0.00 H new ATOM 0 HA VAL A 216 -9.343 -4.659 -1.662 1.00 0.00 H new ATOM 0 HB VAL A 216 -10.948 -7.035 -2.682 1.00 0.00 H new ATOM 0 HG11 VAL A 216 -12.054 -5.383 -4.134 1.00 0.00 H new ATOM 0 HG12 VAL A 216 -12.319 -5.033 -2.410 1.00 0.00 H new ATOM 0 HG13 VAL A 216 -11.139 -4.079 -3.340 1.00 0.00 H new ATOM 0 HG21 VAL A 216 -9.976 -6.480 -4.880 1.00 0.00 H new ATOM 0 HG22 VAL A 216 -8.972 -5.227 -4.113 1.00 0.00 H new ATOM 0 HG23 VAL A 216 -8.725 -6.940 -3.700 1.00 0.00 H new ATOM 1119 N SER A 217 -11.156 -6.760 0.131 1.00 0.00 N ATOM 1120 CA SER A 217 -12.124 -6.848 1.217 1.00 0.00 C ATOM 1121 C SER A 217 -11.589 -6.154 2.463 1.00 0.00 C ATOM 1122 O SER A 217 -12.337 -5.504 3.194 1.00 0.00 O ATOM 1123 CB SER A 217 -12.443 -8.310 1.529 1.00 0.00 C ATOM 1124 OG SER A 217 -13.195 -8.903 0.484 1.00 0.00 O ATOM 0 H SER A 217 -10.775 -7.657 -0.170 1.00 0.00 H new ATOM 0 HA SER A 217 -13.040 -6.348 0.903 1.00 0.00 H new ATOM 0 HB2 SER A 217 -11.516 -8.865 1.674 1.00 0.00 H new ATOM 0 HB3 SER A 217 -13.001 -8.372 2.463 1.00 0.00 H new ATOM 0 HG SER A 217 -12.595 -9.152 -0.250 1.00 0.00 H new ATOM 1130 N ALA A 218 -10.287 -6.293 2.696 1.00 0.00 N ATOM 1131 CA ALA A 218 -9.646 -5.676 3.850 1.00 0.00 C ATOM 1132 C ALA A 218 -9.889 -4.171 3.867 1.00 0.00 C ATOM 1133 O ALA A 218 -10.206 -3.594 4.907 1.00 0.00 O ATOM 1134 CB ALA A 218 -8.153 -5.972 3.846 1.00 0.00 C ATOM 0 H ALA A 218 -9.656 -6.828 2.100 1.00 0.00 H new ATOM 0 HA ALA A 218 -10.086 -6.101 4.752 1.00 0.00 H new ATOM 0 HB1 ALA A 218 -7.687 -5.505 4.714 1.00 0.00 H new ATOM 0 HB2 ALA A 218 -7.996 -7.050 3.886 1.00 0.00 H new ATOM 0 HB3 ALA A 218 -7.706 -5.574 2.935 1.00 0.00 H new ATOM 1140 N ILE A 219 -9.743 -3.542 2.705 1.00 0.00 N ATOM 1141 CA ILE A 219 -9.953 -2.104 2.583 1.00 0.00 C ATOM 1142 C ILE A 219 -11.389 -1.737 2.940 1.00 0.00 C ATOM 1143 O ILE A 219 -11.646 -0.692 3.537 1.00 0.00 O ATOM 1144 CB ILE A 219 -9.645 -1.607 1.156 1.00 0.00 C ATOM 1145 CG1 ILE A 219 -8.233 -2.025 0.739 1.00 0.00 C ATOM 1146 CG2 ILE A 219 -9.801 -0.095 1.072 1.00 0.00 C ATOM 1147 CD1 ILE A 219 -7.143 -1.369 1.557 1.00 0.00 C ATOM 0 H ILE A 219 -9.480 -4.005 1.835 1.00 0.00 H new ATOM 0 HA ILE A 219 -9.268 -1.620 3.279 1.00 0.00 H new ATOM 0 HB ILE A 219 -10.358 -2.064 0.469 1.00 0.00 H new ATOM 0 HG12 ILE A 219 -8.142 -3.107 0.829 1.00 0.00 H new ATOM 0 HG13 ILE A 219 -8.085 -1.779 -0.312 1.00 0.00 H new ATOM 0 HG21 ILE A 219 -9.580 0.238 0.058 1.00 0.00 H new ATOM 0 HG22 ILE A 219 -10.824 0.180 1.329 1.00 0.00 H new ATOM 0 HG23 ILE A 219 -9.111 0.381 1.769 1.00 0.00 H new ATOM 0 HD11 ILE A 219 -6.169 -1.711 1.207 1.00 0.00 H new ATOM 0 HD12 ILE A 219 -7.208 -0.286 1.448 1.00 0.00 H new ATOM 0 HD13 ILE A 219 -7.265 -1.636 2.607 1.00 0.00 H new ATOM 1159 N ARG A 220 -12.321 -2.609 2.571 1.00 0.00 N ATOM 1160 CA ARG A 220 -13.734 -2.384 2.852 1.00 0.00 C ATOM 1161 C ARG A 220 -14.025 -2.573 4.337 1.00 0.00 C ATOM 1162 O ARG A 220 -14.879 -1.893 4.905 1.00 0.00 O ATOM 1163 CB ARG A 220 -14.596 -3.340 2.024 1.00 0.00 C ATOM 1164 CG ARG A 220 -16.068 -2.965 1.999 1.00 0.00 C ATOM 1165 CD ARG A 220 -16.930 -4.126 1.528 1.00 0.00 C ATOM 1166 NE ARG A 220 -16.734 -5.320 2.348 1.00 0.00 N ATOM 1167 CZ ARG A 220 -17.180 -5.443 3.596 1.00 0.00 C ATOM 1168 NH1 ARG A 220 -17.846 -4.449 4.171 1.00 0.00 N ATOM 1169 NH2 ARG A 220 -16.959 -6.563 4.271 1.00 0.00 N ATOM 0 H ARG A 220 -12.123 -3.479 2.076 1.00 0.00 H new ATOM 0 HA ARG A 220 -13.978 -1.357 2.579 1.00 0.00 H new ATOM 0 HB2 ARG A 220 -14.218 -3.364 1.002 1.00 0.00 H new ATOM 0 HB3 ARG A 220 -14.493 -4.348 2.425 1.00 0.00 H new ATOM 0 HG2 ARG A 220 -16.383 -2.657 2.996 1.00 0.00 H new ATOM 0 HG3 ARG A 220 -16.216 -2.110 1.340 1.00 0.00 H new ATOM 0 HD2 ARG A 220 -17.980 -3.834 1.558 1.00 0.00 H new ATOM 0 HD3 ARG A 220 -16.692 -4.356 0.489 1.00 0.00 H new ATOM 0 HE ARG A 220 -16.226 -6.105 1.940 1.00 0.00 H new ATOM 0 HH11 ARG A 220 -18.018 -3.585 3.656 1.00 0.00 H new ATOM 0 HH12 ARG A 220 -18.186 -4.549 5.128 1.00 0.00 H new ATOM 0 HH21 ARG A 220 -16.447 -7.330 3.834 1.00 0.00 H new ATOM 0 HH22 ARG A 220 -17.301 -6.658 5.227 1.00 0.00 H new ATOM 1183 N ALA A 221 -13.306 -3.502 4.958 1.00 0.00 N ATOM 1184 CA ALA A 221 -13.482 -3.786 6.378 1.00 0.00 C ATOM 1185 C ALA A 221 -12.656 -2.839 7.250 1.00 0.00 C ATOM 1186 O ALA A 221 -12.602 -3.000 8.470 1.00 0.00 O ATOM 1187 CB ALA A 221 -13.113 -5.232 6.673 1.00 0.00 C ATOM 0 H ALA A 221 -12.595 -4.072 4.500 1.00 0.00 H new ATOM 0 HA ALA A 221 -14.532 -3.627 6.622 1.00 0.00 H new ATOM 0 HB1 ALA A 221 -13.248 -5.432 7.736 1.00 0.00 H new ATOM 0 HB2 ALA A 221 -13.754 -5.897 6.094 1.00 0.00 H new ATOM 0 HB3 ALA A 221 -12.072 -5.405 6.401 1.00 0.00 H new ATOM 1193 N GLY A 222 -12.010 -1.857 6.625 1.00 0.00 N ATOM 1194 CA GLY A 222 -11.197 -0.912 7.371 1.00 0.00 C ATOM 1195 C GLY A 222 -11.999 0.242 7.948 1.00 0.00 C ATOM 1196 O GLY A 222 -11.426 1.232 8.403 1.00 0.00 O ATOM 0 H GLY A 222 -12.035 -1.699 5.618 1.00 0.00 H new ATOM 0 HA2 GLY A 222 -10.693 -1.437 8.182 1.00 0.00 H new ATOM 0 HA3 GLY A 222 -10.420 -0.515 6.717 1.00 0.00 H new ATOM 1200 N GLY A 223 -13.325 0.121 7.935 1.00 0.00 N ATOM 1201 CA GLY A 223 -14.174 1.173 8.469 1.00 0.00 C ATOM 1202 C GLY A 223 -13.825 2.546 7.925 1.00 0.00 C ATOM 1203 O GLY A 223 -13.512 2.692 6.743 1.00 0.00 O ATOM 0 H GLY A 223 -13.826 -0.686 7.564 1.00 0.00 H new ATOM 0 HA2 GLY A 223 -15.214 0.948 8.234 1.00 0.00 H new ATOM 0 HA3 GLY A 223 -14.089 1.186 9.556 1.00 0.00 H new ATOM 1207 N ASP A 224 -13.880 3.555 8.790 1.00 0.00 N ATOM 1208 CA ASP A 224 -13.569 4.923 8.390 1.00 0.00 C ATOM 1209 C ASP A 224 -12.062 5.163 8.374 1.00 0.00 C ATOM 1210 O ASP A 224 -11.572 6.038 7.660 1.00 0.00 O ATOM 1211 CB ASP A 224 -14.244 5.919 9.335 1.00 0.00 C ATOM 1212 CG ASP A 224 -15.724 6.078 9.047 1.00 0.00 C ATOM 1213 OD1 ASP A 224 -16.465 5.081 9.177 1.00 0.00 O ATOM 1214 OD2 ASP A 224 -16.142 7.200 8.693 1.00 0.00 O ATOM 0 H ASP A 224 -14.137 3.451 9.772 1.00 0.00 H new ATOM 0 HA ASP A 224 -13.951 5.071 7.380 1.00 0.00 H new ATOM 0 HB2 ASP A 224 -14.111 5.586 10.364 1.00 0.00 H new ATOM 0 HB3 ASP A 224 -13.753 6.888 9.247 1.00 0.00 H new ATOM 1219 N GLU A 225 -11.331 4.384 9.165 1.00 0.00 N ATOM 1220 CA GLU A 225 -9.880 4.517 9.237 1.00 0.00 C ATOM 1221 C GLU A 225 -9.194 3.257 8.721 1.00 0.00 C ATOM 1222 O GLU A 225 -9.319 2.184 9.311 1.00 0.00 O ATOM 1223 CB GLU A 225 -9.444 4.795 10.677 1.00 0.00 C ATOM 1224 CG GLU A 225 -7.995 5.241 10.797 1.00 0.00 C ATOM 1225 CD GLU A 225 -7.458 5.102 12.208 1.00 0.00 C ATOM 1226 OE1 GLU A 225 -7.559 3.994 12.776 1.00 0.00 O ATOM 1227 OE2 GLU A 225 -6.938 6.102 12.746 1.00 0.00 O ATOM 0 H GLU A 225 -11.719 3.655 9.764 1.00 0.00 H new ATOM 0 HA GLU A 225 -9.584 5.355 8.607 1.00 0.00 H new ATOM 0 HB2 GLU A 225 -10.089 5.564 11.101 1.00 0.00 H new ATOM 0 HB3 GLU A 225 -9.589 3.894 11.272 1.00 0.00 H new ATOM 0 HG2 GLU A 225 -7.380 4.651 10.118 1.00 0.00 H new ATOM 0 HG3 GLU A 225 -7.911 6.281 10.481 1.00 0.00 H new ATOM 1234 N THR A 226 -8.471 3.394 7.615 1.00 0.00 N ATOM 1235 CA THR A 226 -7.768 2.264 7.018 1.00 0.00 C ATOM 1236 C THR A 226 -6.261 2.381 7.226 1.00 0.00 C ATOM 1237 O THR A 226 -5.567 3.034 6.447 1.00 0.00 O ATOM 1238 CB THR A 226 -8.080 2.175 5.523 1.00 0.00 C ATOM 1239 OG1 THR A 226 -9.454 2.422 5.281 1.00 0.00 O ATOM 1240 CG2 THR A 226 -7.743 0.828 4.920 1.00 0.00 C ATOM 0 H THR A 226 -8.356 4.275 7.114 1.00 0.00 H new ATOM 0 HA THR A 226 -8.113 1.356 7.512 1.00 0.00 H new ATOM 0 HB THR A 226 -7.454 2.933 5.052 1.00 0.00 H new ATOM 0 HG1 THR A 226 -9.740 1.927 4.485 1.00 0.00 H new ATOM 0 HG21 THR A 226 -7.989 0.833 3.858 1.00 0.00 H new ATOM 0 HG22 THR A 226 -6.679 0.629 5.045 1.00 0.00 H new ATOM 0 HG23 THR A 226 -8.319 0.050 5.422 1.00 0.00 H new ATOM 1248 N LYS A 227 -5.759 1.739 8.277 1.00 0.00 N ATOM 1249 CA LYS A 227 -4.332 1.767 8.578 1.00 0.00 C ATOM 1250 C LYS A 227 -3.587 0.752 7.721 1.00 0.00 C ATOM 1251 O LYS A 227 -3.505 -0.426 8.067 1.00 0.00 O ATOM 1252 CB LYS A 227 -4.092 1.473 10.060 1.00 0.00 C ATOM 1253 CG LYS A 227 -5.060 2.189 10.986 1.00 0.00 C ATOM 1254 CD LYS A 227 -4.513 2.278 12.402 1.00 0.00 C ATOM 1255 CE LYS A 227 -3.425 3.334 12.514 1.00 0.00 C ATOM 1256 NZ LYS A 227 -3.984 4.713 12.472 1.00 0.00 N ATOM 0 H LYS A 227 -6.318 1.194 8.933 1.00 0.00 H new ATOM 0 HA LYS A 227 -3.955 2.764 8.351 1.00 0.00 H new ATOM 0 HB2 LYS A 227 -4.171 0.399 10.226 1.00 0.00 H new ATOM 0 HB3 LYS A 227 -3.073 1.762 10.319 1.00 0.00 H new ATOM 0 HG2 LYS A 227 -5.254 3.192 10.606 1.00 0.00 H new ATOM 0 HG3 LYS A 227 -6.014 1.661 10.996 1.00 0.00 H new ATOM 0 HD2 LYS A 227 -5.323 2.514 13.092 1.00 0.00 H new ATOM 0 HD3 LYS A 227 -4.113 1.309 12.700 1.00 0.00 H new ATOM 0 HE2 LYS A 227 -2.876 3.193 13.445 1.00 0.00 H new ATOM 0 HE3 LYS A 227 -2.710 3.207 11.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 227 -3.207 5.404 12.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 227 -4.529 4.840 11.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 227 -4.607 4.860 13.291 1.00 0.00 H new ATOM 1270 N LEU A 228 -3.055 1.212 6.597 1.00 0.00 N ATOM 1271 CA LEU A 228 -2.331 0.338 5.685 1.00 0.00 C ATOM 1272 C LEU A 228 -0.823 0.492 5.837 1.00 0.00 C ATOM 1273 O LEU A 228 -0.314 1.597 6.008 1.00 0.00 O ATOM 1274 CB LEU A 228 -2.730 0.637 4.240 1.00 0.00 C ATOM 1275 CG LEU A 228 -4.235 0.756 3.991 1.00 0.00 C ATOM 1276 CD1 LEU A 228 -4.504 1.283 2.589 1.00 0.00 C ATOM 1277 CD2 LEU A 228 -4.917 -0.588 4.200 1.00 0.00 C ATOM 0 H LEU A 228 -3.111 2.185 6.295 1.00 0.00 H new ATOM 0 HA LEU A 228 -2.596 -0.689 5.936 1.00 0.00 H new ATOM 0 HB2 LEU A 228 -2.252 1.568 3.933 1.00 0.00 H new ATOM 0 HB3 LEU A 228 -2.333 -0.151 3.600 1.00 0.00 H new ATOM 0 HG LEU A 228 -4.649 1.465 4.708 1.00 0.00 H new ATOM 0 HD11 LEU A 228 -5.579 1.361 2.430 1.00 0.00 H new ATOM 0 HD12 LEU A 228 -4.048 2.267 2.476 1.00 0.00 H new ATOM 0 HD13 LEU A 228 -4.077 0.599 1.855 1.00 0.00 H new ATOM 0 HD21 LEU A 228 -5.987 -0.485 4.019 1.00 0.00 H new ATOM 0 HD22 LEU A 228 -4.500 -1.319 3.507 1.00 0.00 H new ATOM 0 HD23 LEU A 228 -4.753 -0.924 5.224 1.00 0.00 H new ATOM 1289 N LEU A 229 -0.116 -0.627 5.743 1.00 0.00 N ATOM 1290 CA LEU A 229 1.339 -0.633 5.837 1.00 0.00 C ATOM 1291 C LEU A 229 1.921 -1.128 4.522 1.00 0.00 C ATOM 1292 O LEU A 229 1.785 -2.302 4.179 1.00 0.00 O ATOM 1293 CB LEU A 229 1.805 -1.527 6.989 1.00 0.00 C ATOM 1294 CG LEU A 229 3.292 -1.423 7.331 1.00 0.00 C ATOM 1295 CD1 LEU A 229 3.560 -0.192 8.183 1.00 0.00 C ATOM 1296 CD2 LEU A 229 3.762 -2.681 8.046 1.00 0.00 C ATOM 0 H LEU A 229 -0.530 -1.548 5.601 1.00 0.00 H new ATOM 0 HA LEU A 229 1.687 0.381 6.035 1.00 0.00 H new ATOM 0 HB2 LEU A 229 1.225 -1.279 7.878 1.00 0.00 H new ATOM 0 HB3 LEU A 229 1.577 -2.563 6.739 1.00 0.00 H new ATOM 0 HG LEU A 229 3.853 -1.325 6.402 1.00 0.00 H new ATOM 0 HD11 LEU A 229 4.623 -0.135 8.416 1.00 0.00 H new ATOM 0 HD12 LEU A 229 3.260 0.702 7.636 1.00 0.00 H new ATOM 0 HD13 LEU A 229 2.989 -0.259 9.109 1.00 0.00 H new ATOM 0 HD21 LEU A 229 4.822 -2.591 8.282 1.00 0.00 H new ATOM 0 HD22 LEU A 229 3.195 -2.809 8.968 1.00 0.00 H new ATOM 0 HD23 LEU A 229 3.606 -3.546 7.401 1.00 0.00 H new ATOM 1308 N VAL A 230 2.546 -0.229 3.773 1.00 0.00 N ATOM 1309 CA VAL A 230 3.112 -0.595 2.483 1.00 0.00 C ATOM 1310 C VAL A 230 4.625 -0.431 2.444 1.00 0.00 C ATOM 1311 O VAL A 230 5.243 0.001 3.414 1.00 0.00 O ATOM 1312 CB VAL A 230 2.494 0.238 1.344 1.00 0.00 C ATOM 1313 CG1 VAL A 230 1.005 -0.047 1.218 1.00 0.00 C ATOM 1314 CG2 VAL A 230 2.746 1.723 1.569 1.00 0.00 C ATOM 0 H VAL A 230 2.673 0.749 4.033 1.00 0.00 H new ATOM 0 HA VAL A 230 2.873 -1.649 2.341 1.00 0.00 H new ATOM 0 HB VAL A 230 2.974 -0.049 0.408 1.00 0.00 H new ATOM 0 HG11 VAL A 230 0.587 0.551 0.408 1.00 0.00 H new ATOM 0 HG12 VAL A 230 0.854 -1.105 1.003 1.00 0.00 H new ATOM 0 HG13 VAL A 230 0.505 0.208 2.152 1.00 0.00 H new ATOM 0 HG21 VAL A 230 2.302 2.295 0.754 1.00 0.00 H new ATOM 0 HG22 VAL A 230 2.297 2.029 2.514 1.00 0.00 H new ATOM 0 HG23 VAL A 230 3.820 1.909 1.600 1.00 0.00 H new ATOM 1324 N VAL A 231 5.209 -0.782 1.302 1.00 0.00 N ATOM 1325 CA VAL A 231 6.651 -0.680 1.104 1.00 0.00 C ATOM 1326 C VAL A 231 6.966 0.263 -0.054 1.00 0.00 C ATOM 1327 O VAL A 231 6.080 0.621 -0.831 1.00 0.00 O ATOM 1328 CB VAL A 231 7.281 -2.059 0.822 1.00 0.00 C ATOM 1329 CG1 VAL A 231 8.791 -2.005 0.994 1.00 0.00 C ATOM 1330 CG2 VAL A 231 6.676 -3.123 1.728 1.00 0.00 C ATOM 0 H VAL A 231 4.701 -1.142 0.494 1.00 0.00 H new ATOM 0 HA VAL A 231 7.078 -0.284 2.025 1.00 0.00 H new ATOM 0 HB VAL A 231 7.064 -2.327 -0.212 1.00 0.00 H new ATOM 0 HG11 VAL A 231 9.216 -2.988 0.790 1.00 0.00 H new ATOM 0 HG12 VAL A 231 9.211 -1.277 0.299 1.00 0.00 H new ATOM 0 HG13 VAL A 231 9.031 -1.711 2.016 1.00 0.00 H new ATOM 0 HG21 VAL A 231 7.135 -4.088 1.512 1.00 0.00 H new ATOM 0 HG22 VAL A 231 6.858 -2.860 2.770 1.00 0.00 H new ATOM 0 HG23 VAL A 231 5.602 -3.184 1.551 1.00 0.00 H new ATOM 1340 N ASP A 232 8.225 0.676 -0.160 1.00 0.00 N ATOM 1341 CA ASP A 232 8.639 1.594 -1.219 1.00 0.00 C ATOM 1342 C ASP A 232 9.180 0.855 -2.436 1.00 0.00 C ATOM 1343 O ASP A 232 10.278 0.300 -2.404 1.00 0.00 O ATOM 1344 CB ASP A 232 9.699 2.559 -0.688 1.00 0.00 C ATOM 1345 CG ASP A 232 10.113 3.596 -1.716 1.00 0.00 C ATOM 1346 OD1 ASP A 232 9.578 3.562 -2.844 1.00 0.00 O ATOM 1347 OD2 ASP A 232 10.974 4.441 -1.392 1.00 0.00 O ATOM 0 H ASP A 232 8.975 0.392 0.471 1.00 0.00 H new ATOM 0 HA ASP A 232 7.756 2.150 -1.534 1.00 0.00 H new ATOM 0 HB2 ASP A 232 9.314 3.065 0.197 1.00 0.00 H new ATOM 0 HB3 ASP A 232 10.576 1.993 -0.375 1.00 0.00 H new ATOM 1352 N ARG A 233 8.409 0.880 -3.520 1.00 0.00 N ATOM 1353 CA ARG A 233 8.819 0.242 -4.765 1.00 0.00 C ATOM 1354 C ARG A 233 9.351 1.281 -5.745 1.00 0.00 C ATOM 1355 O ARG A 233 10.087 0.949 -6.674 1.00 0.00 O ATOM 1356 CB ARG A 233 7.657 -0.518 -5.401 1.00 0.00 C ATOM 1357 CG ARG A 233 8.108 -1.580 -6.394 1.00 0.00 C ATOM 1358 CD ARG A 233 6.993 -1.972 -7.353 1.00 0.00 C ATOM 1359 NE ARG A 233 6.497 -0.832 -8.120 1.00 0.00 N ATOM 1360 CZ ARG A 233 5.591 -0.931 -9.091 1.00 0.00 C ATOM 1361 NH1 ARG A 233 5.079 -2.112 -9.414 1.00 0.00 N ATOM 1362 NH2 ARG A 233 5.197 0.155 -9.743 1.00 0.00 N ATOM 0 H ARG A 233 7.497 1.335 -3.560 1.00 0.00 H new ATOM 0 HA ARG A 233 9.611 -0.469 -4.530 1.00 0.00 H new ATOM 0 HB2 ARG A 233 7.067 -0.991 -4.616 1.00 0.00 H new ATOM 0 HB3 ARG A 233 7.002 0.190 -5.909 1.00 0.00 H new ATOM 0 HG2 ARG A 233 8.960 -1.207 -6.962 1.00 0.00 H new ATOM 0 HG3 ARG A 233 8.447 -2.463 -5.852 1.00 0.00 H new ATOM 0 HD2 ARG A 233 7.358 -2.737 -8.038 1.00 0.00 H new ATOM 0 HD3 ARG A 233 6.171 -2.414 -6.790 1.00 0.00 H new ATOM 0 HE ARG A 233 6.866 0.093 -7.899 1.00 0.00 H new ATOM 0 HH11 ARG A 233 5.379 -2.951 -8.917 1.00 0.00 H new ATOM 0 HH12 ARG A 233 4.385 -2.181 -10.159 1.00 0.00 H new ATOM 0 HH21 ARG A 233 5.588 1.065 -9.501 1.00 0.00 H new ATOM 0 HH22 ARG A 233 4.503 0.080 -10.487 1.00 0.00 H new