USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 590 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 162 TYR OH : rot -118:sc= 0.225 USER MOD Set 1.2: A 209 SER OG : rot 139:sc= 1.87 USER MOD Set 2.1: A 179 THR OG1 : rot 111:sc= -0.0133 USER MOD Set 2.2: A 181 SER OG : rot -80:sc= 0.182 USER MOD Single : A 161 SER OG : rot 180:sc= -0.0381 USER MOD Single : A 167 THR OG1 : rot 78:sc= 0.808 USER MOD Single : A 168 LYS NZ :NH3+ -118:sc=-0.00947 (180deg=-0.661) USER MOD Single : A 172 SER OG : rot 180:sc= 0 USER MOD Single : A 173 SER OG : rot -79:sc= 1.33 USER MOD Single : A 176 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0322) USER MOD Single : A 182 GLN : amide:sc= -0.0611 X(o=-0.061,f=-0.24) USER MOD Single : A 184 TYR OH : rot 60:sc= -0.0617 USER MOD Single : A 187 MET CE :methyl -148:sc= 0 (180deg=-0.331) USER MOD Single : A 189 LYS NZ :NH3+ -165:sc= -0.485 (180deg=-0.864) USER MOD Single : A 190 SER OG : rot 82:sc= 0.467 USER MOD Single : A 193 TYR OH : rot 180:sc= 0 USER MOD Single : A 195 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 200 SER OG : rot 180:sc= 0 USER MOD Single : A 201 ASN : amide:sc=-0.00612 K(o=-0.0061,f=-0.72) USER MOD Single : A 202 SER OG : rot 68:sc= 0.459 USER MOD Single : A 203 SER OG : rot 180:sc= 0 USER MOD Single : A 207 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 208 ASN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 212 HIS : no HD1:sc= -0.676 K(o=-0.68,f=-0.003) USER MOD Single : A 213 ASN : amide:sc= 0.787 K(o=0.79,f=-1.4) USER MOD Single : A 215 SER OG : rot -31:sc= 0.271 USER MOD Single : A 217 HIS : no HE2:sc= 0.385 K(o=0.38,f=-1.3) USER MOD Single : A 218 SER OG : rot 180:sc= 0.162 USER MOD Single : A 219 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0035) USER MOD Single : A 224 GLN : amide:sc= 0 K(o=0,f=-0.98) USER MOD Single : A 232 SER OG : rot 23:sc= 0.227 USER MOD Single : A 235 MET CE :methyl -176:sc= -0.181 (180deg=-0.205) USER MOD Single : A 237 ASN : amide:sc= -0.414 K(o=-0.41,f=-5.3!) USER MOD ----------------------------------------------------------------- ATOM 116 N LEU A 160 -13.055 14.828 -1.805 1.00 0.00 N ATOM 117 CA LEU A 160 -13.818 15.504 -2.863 1.00 0.00 C ATOM 118 C LEU A 160 -15.301 15.170 -2.786 1.00 0.00 C ATOM 119 O LEU A 160 -15.686 14.014 -2.625 1.00 0.00 O ATOM 120 CB LEU A 160 -13.316 15.069 -4.249 1.00 0.00 C ATOM 121 CG LEU A 160 -12.338 16.006 -4.954 1.00 0.00 C ATOM 122 CD1 LEU A 160 -10.979 15.918 -4.360 1.00 0.00 C ATOM 123 CD2 LEU A 160 -12.284 15.656 -6.432 1.00 0.00 C ATOM 0 HA LEU A 160 -13.675 16.575 -2.717 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -12.838 14.095 -4.147 1.00 0.00 H new ATOM 0 HB3 LEU A 160 -14.182 14.933 -4.896 1.00 0.00 H new ATOM 0 HG LEU A 160 -12.689 17.030 -4.828 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -10.308 16.598 -4.885 1.00 0.00 H new ATOM 0 HD12 LEU A 160 -11.024 16.194 -3.307 1.00 0.00 H new ATOM 0 HD13 LEU A 160 -10.607 14.898 -4.452 1.00 0.00 H new ATOM 0 HD21 LEU A 160 -11.587 16.323 -6.939 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -11.950 14.625 -6.550 1.00 0.00 H new ATOM 0 HD23 LEU A 160 -13.276 15.769 -6.869 1.00 0.00 H new ATOM 135 N SER A 161 -16.132 16.188 -2.939 1.00 0.00 N ATOM 136 CA SER A 161 -17.584 16.002 -2.983 1.00 0.00 C ATOM 137 C SER A 161 -17.967 15.628 -4.417 1.00 0.00 C ATOM 138 O SER A 161 -17.153 15.733 -5.330 1.00 0.00 O ATOM 139 CB SER A 161 -18.277 17.301 -2.562 1.00 0.00 C ATOM 140 OG SER A 161 -19.693 17.162 -2.527 1.00 0.00 O ATOM 0 H SER A 161 -15.830 17.158 -3.036 1.00 0.00 H new ATOM 0 HA SER A 161 -17.896 15.212 -2.300 1.00 0.00 H new ATOM 0 HB2 SER A 161 -17.918 17.601 -1.578 1.00 0.00 H new ATOM 0 HB3 SER A 161 -18.008 18.097 -3.256 1.00 0.00 H new ATOM 0 HG SER A 161 -20.098 18.011 -2.253 1.00 0.00 H new ATOM 146 N TYR A 162 -19.218 15.220 -4.614 1.00 0.00 N ATOM 147 CA TYR A 162 -19.716 14.900 -5.952 1.00 0.00 C ATOM 148 C TYR A 162 -19.501 16.068 -6.910 1.00 0.00 C ATOM 149 O TYR A 162 -19.074 15.870 -8.022 1.00 0.00 O ATOM 150 CB TYR A 162 -21.209 14.577 -5.918 1.00 0.00 C ATOM 151 CG TYR A 162 -21.513 13.097 -5.798 1.00 0.00 C ATOM 152 CD1 TYR A 162 -21.741 12.490 -4.541 1.00 0.00 C ATOM 153 CD2 TYR A 162 -21.582 12.298 -6.956 1.00 0.00 C ATOM 154 CE1 TYR A 162 -22.058 11.102 -4.451 1.00 0.00 C ATOM 155 CE2 TYR A 162 -21.899 10.916 -6.866 1.00 0.00 C ATOM 156 CZ TYR A 162 -22.126 10.334 -5.619 1.00 0.00 C ATOM 157 OH TYR A 162 -22.408 8.997 -5.543 1.00 0.00 O ATOM 0 H TYR A 162 -19.904 15.103 -3.868 1.00 0.00 H new ATOM 0 HA TYR A 162 -19.158 14.031 -6.300 1.00 0.00 H new ATOM 0 HB2 TYR A 162 -21.665 15.101 -5.078 1.00 0.00 H new ATOM 0 HB3 TYR A 162 -21.675 14.962 -6.825 1.00 0.00 H new ATOM 0 HD1 TYR A 162 -21.674 13.083 -3.641 1.00 0.00 H new ATOM 0 HD2 TYR A 162 -21.392 12.741 -7.923 1.00 0.00 H new ATOM 0 HE1 TYR A 162 -22.244 10.647 -3.489 1.00 0.00 H new ATOM 0 HE2 TYR A 162 -21.964 10.317 -7.762 1.00 0.00 H new ATOM 0 HH TYR A 162 -21.651 8.483 -5.893 1.00 0.00 H new ATOM 167 N ALA A 163 -19.793 17.287 -6.476 1.00 0.00 N ATOM 168 CA ALA A 163 -19.636 18.469 -7.327 1.00 0.00 C ATOM 169 C ALA A 163 -18.188 18.616 -7.822 1.00 0.00 C ATOM 170 O ALA A 163 -17.942 18.964 -8.972 1.00 0.00 O ATOM 171 CB ALA A 163 -20.048 19.719 -6.552 1.00 0.00 C ATOM 0 H ALA A 163 -20.141 17.488 -5.538 1.00 0.00 H new ATOM 0 HA ALA A 163 -20.279 18.347 -8.199 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -19.930 20.597 -7.188 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -21.090 19.630 -6.246 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -19.418 19.824 -5.669 1.00 0.00 H new ATOM 177 N ASP A 164 -17.233 18.354 -6.947 1.00 0.00 N ATOM 178 CA ASP A 164 -15.822 18.512 -7.276 1.00 0.00 C ATOM 179 C ASP A 164 -15.387 17.477 -8.307 1.00 0.00 C ATOM 180 O ASP A 164 -14.613 17.764 -9.210 1.00 0.00 O ATOM 181 CB ASP A 164 -14.968 18.362 -6.023 1.00 0.00 C ATOM 182 CG ASP A 164 -15.371 19.310 -4.930 1.00 0.00 C ATOM 183 OD1 ASP A 164 -15.437 18.851 -3.770 1.00 0.00 O ATOM 184 OD2 ASP A 164 -15.636 20.494 -5.206 1.00 0.00 O ATOM 0 H ASP A 164 -17.408 18.029 -5.996 1.00 0.00 H new ATOM 0 HA ASP A 164 -15.684 19.509 -7.694 1.00 0.00 H new ATOM 0 HB2 ASP A 164 -15.044 17.338 -5.657 1.00 0.00 H new ATOM 0 HB3 ASP A 164 -13.922 18.532 -6.279 1.00 0.00 H new ATOM 189 N LEU A 165 -15.896 16.267 -8.170 1.00 0.00 N ATOM 190 CA LEU A 165 -15.587 15.189 -9.111 1.00 0.00 C ATOM 191 C LEU A 165 -16.197 15.480 -10.482 1.00 0.00 C ATOM 192 O LEU A 165 -15.553 15.277 -11.512 1.00 0.00 O ATOM 193 CB LEU A 165 -16.144 13.865 -8.585 1.00 0.00 C ATOM 194 CG LEU A 165 -15.491 13.291 -7.328 1.00 0.00 C ATOM 195 CD1 LEU A 165 -16.369 12.203 -6.764 1.00 0.00 C ATOM 196 CD2 LEU A 165 -14.119 12.723 -7.642 1.00 0.00 C ATOM 0 H LEU A 165 -16.528 15.998 -7.416 1.00 0.00 H new ATOM 0 HA LEU A 165 -14.504 15.121 -9.211 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -17.207 14.000 -8.384 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -16.062 13.123 -9.379 1.00 0.00 H new ATOM 0 HG LEU A 165 -15.373 14.093 -6.599 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -15.907 11.791 -5.867 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -17.345 12.617 -6.512 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -16.491 11.413 -7.505 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -13.675 12.321 -6.732 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -14.215 11.928 -8.381 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -13.481 13.512 -8.039 1.00 0.00 H new ATOM 208 N ILE A 166 -17.426 15.970 -10.489 1.00 0.00 N ATOM 209 CA ILE A 166 -18.098 16.340 -11.739 1.00 0.00 C ATOM 210 C ILE A 166 -17.273 17.446 -12.398 1.00 0.00 C ATOM 211 O ILE A 166 -16.995 17.391 -13.594 1.00 0.00 O ATOM 212 CB ILE A 166 -19.549 16.860 -11.482 1.00 0.00 C ATOM 213 CG1 ILE A 166 -20.430 15.760 -10.871 1.00 0.00 C ATOM 214 CG2 ILE A 166 -20.222 17.317 -12.791 1.00 0.00 C ATOM 215 CD1 ILE A 166 -21.663 16.303 -10.145 1.00 0.00 C ATOM 0 H ILE A 166 -17.984 16.123 -9.649 1.00 0.00 H new ATOM 0 HA ILE A 166 -18.174 15.461 -12.379 1.00 0.00 H new ATOM 0 HB ILE A 166 -19.458 17.700 -10.794 1.00 0.00 H new ATOM 0 HG12 ILE A 166 -20.752 15.082 -11.661 1.00 0.00 H new ATOM 0 HG13 ILE A 166 -19.834 15.174 -10.171 1.00 0.00 H new ATOM 0 HG21 ILE A 166 -21.230 17.673 -12.577 1.00 0.00 H new ATOM 0 HG22 ILE A 166 -19.640 18.123 -13.237 1.00 0.00 H new ATOM 0 HG23 ILE A 166 -20.273 16.479 -13.486 1.00 0.00 H new ATOM 0 HD11 ILE A 166 -22.240 15.473 -9.738 1.00 0.00 H new ATOM 0 HD12 ILE A 166 -21.348 16.959 -9.333 1.00 0.00 H new ATOM 0 HD13 ILE A 166 -22.280 16.865 -10.846 1.00 0.00 H new ATOM 227 N THR A 167 -16.876 18.434 -11.613 1.00 0.00 N ATOM 228 CA THR A 167 -16.078 19.542 -12.126 1.00 0.00 C ATOM 229 C THR A 167 -14.774 19.035 -12.694 1.00 0.00 C ATOM 230 O THR A 167 -14.402 19.407 -13.803 1.00 0.00 O ATOM 231 CB THR A 167 -15.798 20.567 -11.011 1.00 0.00 C ATOM 232 OG1 THR A 167 -17.024 21.144 -10.569 1.00 0.00 O ATOM 233 CG2 THR A 167 -14.878 21.667 -11.462 1.00 0.00 C ATOM 0 H THR A 167 -17.092 18.494 -10.618 1.00 0.00 H new ATOM 0 HA THR A 167 -16.644 20.030 -12.920 1.00 0.00 H new ATOM 0 HB THR A 167 -15.308 20.031 -10.198 1.00 0.00 H new ATOM 0 HG1 THR A 167 -17.486 20.516 -9.975 1.00 0.00 H new ATOM 0 HG21 THR A 167 -14.712 22.363 -10.640 1.00 0.00 H new ATOM 0 HG22 THR A 167 -13.925 21.239 -11.773 1.00 0.00 H new ATOM 0 HG23 THR A 167 -15.329 22.197 -12.301 1.00 0.00 H new ATOM 241 N LYS A 168 -14.087 18.166 -11.967 1.00 0.00 N ATOM 242 CA LYS A 168 -12.798 17.647 -12.419 1.00 0.00 C ATOM 243 C LYS A 168 -12.919 16.954 -13.772 1.00 0.00 C ATOM 244 O LYS A 168 -12.050 17.102 -14.612 1.00 0.00 O ATOM 245 CB LYS A 168 -12.232 16.636 -11.426 1.00 0.00 C ATOM 246 CG LYS A 168 -11.180 17.209 -10.509 1.00 0.00 C ATOM 247 CD LYS A 168 -10.392 16.094 -9.822 1.00 0.00 C ATOM 248 CE LYS A 168 -9.106 16.601 -9.152 1.00 0.00 C ATOM 249 NZ LYS A 168 -9.389 17.638 -8.091 1.00 0.00 N ATOM 0 H LYS A 168 -14.396 17.805 -11.065 1.00 0.00 H new ATOM 0 HA LYS A 168 -12.132 18.506 -12.501 1.00 0.00 H new ATOM 0 HB2 LYS A 168 -13.048 16.236 -10.823 1.00 0.00 H new ATOM 0 HB3 LYS A 168 -11.804 15.799 -11.978 1.00 0.00 H new ATOM 0 HG2 LYS A 168 -10.500 17.842 -11.079 1.00 0.00 H new ATOM 0 HG3 LYS A 168 -11.652 17.843 -9.758 1.00 0.00 H new ATOM 0 HD2 LYS A 168 -11.024 15.618 -9.072 1.00 0.00 H new ATOM 0 HD3 LYS A 168 -10.137 15.330 -10.556 1.00 0.00 H new ATOM 0 HE2 LYS A 168 -8.575 15.761 -8.705 1.00 0.00 H new ATOM 0 HE3 LYS A 168 -8.447 17.027 -9.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 -8.940 18.538 -8.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 -10.416 17.776 -8.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 -9.006 17.316 -7.180 1.00 0.00 H new ATOM 263 N ALA A 169 -13.995 16.215 -13.978 1.00 0.00 N ATOM 264 CA ALA A 169 -14.215 15.531 -15.241 1.00 0.00 C ATOM 265 C ALA A 169 -14.303 16.556 -16.384 1.00 0.00 C ATOM 266 O ALA A 169 -13.734 16.374 -17.456 1.00 0.00 O ATOM 267 CB ALA A 169 -15.501 14.707 -15.164 1.00 0.00 C ATOM 0 H ALA A 169 -14.731 16.073 -13.286 1.00 0.00 H new ATOM 0 HA ALA A 169 -13.379 14.861 -15.438 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -15.663 14.196 -16.113 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -15.414 13.971 -14.365 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -16.344 15.367 -14.959 1.00 0.00 H new ATOM 273 N ILE A 170 -15.020 17.641 -16.143 1.00 0.00 N ATOM 274 CA ILE A 170 -15.208 18.678 -17.158 1.00 0.00 C ATOM 275 C ILE A 170 -13.891 19.399 -17.445 1.00 0.00 C ATOM 276 O ILE A 170 -13.568 19.681 -18.599 1.00 0.00 O ATOM 277 CB ILE A 170 -16.273 19.724 -16.713 1.00 0.00 C ATOM 278 CG1 ILE A 170 -17.641 19.040 -16.524 1.00 0.00 C ATOM 279 CG2 ILE A 170 -16.379 20.864 -17.732 1.00 0.00 C ATOM 280 CD1 ILE A 170 -18.625 19.817 -15.631 1.00 0.00 C ATOM 0 H ILE A 170 -15.484 17.832 -15.255 1.00 0.00 H new ATOM 0 HA ILE A 170 -15.558 18.181 -18.063 1.00 0.00 H new ATOM 0 HB ILE A 170 -15.959 20.151 -15.761 1.00 0.00 H new ATOM 0 HG12 ILE A 170 -18.097 18.892 -17.503 1.00 0.00 H new ATOM 0 HG13 ILE A 170 -17.482 18.051 -16.094 1.00 0.00 H new ATOM 0 HG21 ILE A 170 -17.129 21.581 -17.399 1.00 0.00 H new ATOM 0 HG22 ILE A 170 -15.414 21.363 -17.821 1.00 0.00 H new ATOM 0 HG23 ILE A 170 -16.669 20.459 -18.702 1.00 0.00 H new ATOM 0 HD11 ILE A 170 -19.561 19.263 -15.553 1.00 0.00 H new ATOM 0 HD12 ILE A 170 -18.194 19.943 -14.638 1.00 0.00 H new ATOM 0 HD13 ILE A 170 -18.818 20.796 -16.069 1.00 0.00 H new ATOM 292 N GLU A 171 -13.118 19.688 -16.406 1.00 0.00 N ATOM 293 CA GLU A 171 -11.838 20.390 -16.572 1.00 0.00 C ATOM 294 C GLU A 171 -10.842 19.505 -17.296 1.00 0.00 C ATOM 295 O GLU A 171 -9.964 19.987 -18.012 1.00 0.00 O ATOM 296 CB GLU A 171 -11.245 20.791 -15.216 1.00 0.00 C ATOM 297 CG GLU A 171 -12.125 21.711 -14.426 1.00 0.00 C ATOM 298 CD GLU A 171 -11.334 22.651 -13.556 1.00 0.00 C ATOM 299 OE1 GLU A 171 -10.659 22.178 -12.620 1.00 0.00 O ATOM 300 OE2 GLU A 171 -11.384 23.879 -13.807 1.00 0.00 O ATOM 0 H GLU A 171 -13.348 19.451 -15.441 1.00 0.00 H new ATOM 0 HA GLU A 171 -12.032 21.289 -17.157 1.00 0.00 H new ATOM 0 HB2 GLU A 171 -11.056 19.891 -14.631 1.00 0.00 H new ATOM 0 HB3 GLU A 171 -10.281 21.274 -15.379 1.00 0.00 H new ATOM 0 HG2 GLU A 171 -12.748 22.289 -15.108 1.00 0.00 H new ATOM 0 HG3 GLU A 171 -12.797 21.121 -13.803 1.00 0.00 H new ATOM 307 N SER A 172 -10.998 18.200 -17.116 1.00 0.00 N ATOM 308 CA SER A 172 -10.124 17.208 -17.731 1.00 0.00 C ATOM 309 C SER A 172 -10.420 17.120 -19.217 1.00 0.00 C ATOM 310 O SER A 172 -9.566 16.709 -20.003 1.00 0.00 O ATOM 311 CB SER A 172 -10.329 15.829 -17.084 1.00 0.00 C ATOM 312 OG SER A 172 -9.461 14.865 -17.641 1.00 0.00 O ATOM 0 H SER A 172 -11.736 17.798 -16.538 1.00 0.00 H new ATOM 0 HA SER A 172 -9.089 17.515 -17.579 1.00 0.00 H new ATOM 0 HB2 SER A 172 -10.156 15.900 -16.010 1.00 0.00 H new ATOM 0 HB3 SER A 172 -11.363 15.512 -17.220 1.00 0.00 H new ATOM 0 HG SER A 172 -9.613 13.999 -17.209 1.00 0.00 H new ATOM 318 N SER A 173 -11.623 17.484 -19.617 1.00 0.00 N ATOM 319 CA SER A 173 -11.985 17.417 -21.020 1.00 0.00 C ATOM 320 C SER A 173 -11.362 18.607 -21.758 1.00 0.00 C ATOM 321 O SER A 173 -11.394 19.736 -21.277 1.00 0.00 O ATOM 322 CB SER A 173 -13.498 17.421 -21.176 1.00 0.00 C ATOM 323 OG SER A 173 -14.030 18.713 -21.032 1.00 0.00 O ATOM 0 H SER A 173 -12.359 17.825 -18.999 1.00 0.00 H new ATOM 0 HA SER A 173 -11.605 16.490 -21.450 1.00 0.00 H new ATOM 0 HB2 SER A 173 -13.764 17.025 -22.156 1.00 0.00 H new ATOM 0 HB3 SER A 173 -13.943 16.759 -20.433 1.00 0.00 H new ATOM 0 HG SER A 173 -14.078 18.943 -20.081 1.00 0.00 H new ATOM 329 N ALA A 174 -10.790 18.354 -22.924 1.00 0.00 N ATOM 330 CA ALA A 174 -10.132 19.413 -23.690 1.00 0.00 C ATOM 331 C ALA A 174 -11.151 20.481 -24.129 1.00 0.00 C ATOM 332 O ALA A 174 -10.848 21.674 -24.174 1.00 0.00 O ATOM 333 CB ALA A 174 -9.436 18.798 -24.917 1.00 0.00 C ATOM 0 H ALA A 174 -10.765 17.433 -23.363 1.00 0.00 H new ATOM 0 HA ALA A 174 -9.388 19.898 -23.059 1.00 0.00 H new ATOM 0 HB1 ALA A 174 -8.945 19.585 -25.489 1.00 0.00 H new ATOM 0 HB2 ALA A 174 -8.693 18.071 -24.588 1.00 0.00 H new ATOM 0 HB3 ALA A 174 -10.176 18.301 -25.544 1.00 0.00 H new ATOM 339 N GLU A 175 -12.363 20.038 -24.438 1.00 0.00 N ATOM 340 CA GLU A 175 -13.426 20.946 -24.876 1.00 0.00 C ATOM 341 C GLU A 175 -14.124 21.667 -23.708 1.00 0.00 C ATOM 342 O GLU A 175 -15.006 22.500 -23.931 1.00 0.00 O ATOM 343 CB GLU A 175 -14.476 20.164 -25.678 1.00 0.00 C ATOM 344 CG GLU A 175 -13.922 19.449 -26.921 1.00 0.00 C ATOM 345 CD GLU A 175 -15.025 18.779 -27.716 1.00 0.00 C ATOM 346 OE1 GLU A 175 -15.586 17.771 -27.237 1.00 0.00 O ATOM 347 OE2 GLU A 175 -15.364 19.277 -28.810 1.00 0.00 O ATOM 0 H GLU A 175 -12.639 19.057 -24.395 1.00 0.00 H new ATOM 0 HA GLU A 175 -12.951 21.709 -25.493 1.00 0.00 H new ATOM 0 HB2 GLU A 175 -14.938 19.424 -25.024 1.00 0.00 H new ATOM 0 HB3 GLU A 175 -15.263 20.851 -25.989 1.00 0.00 H new ATOM 0 HG2 GLU A 175 -13.402 20.168 -27.554 1.00 0.00 H new ATOM 0 HG3 GLU A 175 -13.188 18.703 -26.616 1.00 0.00 H new ATOM 354 N LYS A 176 -13.721 21.328 -22.479 1.00 0.00 N ATOM 355 CA LYS A 176 -14.295 21.902 -21.242 1.00 0.00 C ATOM 356 C LYS A 176 -15.802 21.682 -21.128 1.00 0.00 C ATOM 357 O LYS A 176 -16.522 22.523 -20.602 1.00 0.00 O ATOM 358 CB LYS A 176 -13.957 23.394 -21.096 1.00 0.00 C ATOM 359 CG LYS A 176 -12.456 23.728 -21.095 1.00 0.00 C ATOM 360 CD LYS A 176 -11.736 23.000 -19.979 1.00 0.00 C ATOM 361 CE LYS A 176 -10.455 23.712 -19.573 1.00 0.00 C ATOM 362 NZ LYS A 176 -9.489 23.766 -20.723 1.00 0.00 N ATOM 0 H LYS A 176 -12.984 20.645 -22.306 1.00 0.00 H new ATOM 0 HA LYS A 176 -13.827 21.360 -20.420 1.00 0.00 H new ATOM 0 HB2 LYS A 176 -14.434 23.940 -21.910 1.00 0.00 H new ATOM 0 HB3 LYS A 176 -14.395 23.760 -20.168 1.00 0.00 H new ATOM 0 HG2 LYS A 176 -12.018 23.453 -22.055 1.00 0.00 H new ATOM 0 HG3 LYS A 176 -12.320 24.803 -20.979 1.00 0.00 H new ATOM 0 HD2 LYS A 176 -12.395 22.917 -19.115 1.00 0.00 H new ATOM 0 HD3 LYS A 176 -11.501 21.985 -20.299 1.00 0.00 H new ATOM 0 HE2 LYS A 176 -10.686 24.723 -19.238 1.00 0.00 H new ATOM 0 HE3 LYS A 176 -9.997 23.194 -18.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 176 -8.585 24.164 -20.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 176 -9.333 22.806 -21.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 176 -9.880 24.366 -21.477 1.00 0.00 H new ATOM 376 N ARG A 177 -16.264 20.534 -21.604 1.00 0.00 N ATOM 377 CA ARG A 177 -17.670 20.138 -21.516 1.00 0.00 C ATOM 378 C ARG A 177 -17.746 18.627 -21.655 1.00 0.00 C ATOM 379 O ARG A 177 -16.993 18.044 -22.424 1.00 0.00 O ATOM 380 CB ARG A 177 -18.514 20.812 -22.615 1.00 0.00 C ATOM 381 CG ARG A 177 -17.988 20.645 -24.039 1.00 0.00 C ATOM 382 CD ARG A 177 -18.851 21.374 -25.054 1.00 0.00 C ATOM 383 NE ARG A 177 -18.060 21.838 -26.213 1.00 0.00 N ATOM 384 CZ ARG A 177 -17.634 21.076 -27.212 1.00 0.00 C ATOM 385 NH1 ARG A 177 -17.873 19.794 -27.272 1.00 0.00 N ATOM 386 NH2 ARG A 177 -16.921 21.615 -28.157 1.00 0.00 N ATOM 0 H ARG A 177 -15.672 19.844 -22.066 1.00 0.00 H new ATOM 0 HA ARG A 177 -18.074 20.456 -20.555 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -19.526 20.410 -22.570 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -18.584 21.877 -22.394 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -16.967 21.022 -24.095 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -17.951 19.585 -24.290 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -19.646 20.712 -25.398 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -19.332 22.228 -24.576 1.00 0.00 H new ATOM 0 HE ARG A 177 -17.821 22.829 -26.248 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -18.407 19.340 -26.531 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -17.526 19.247 -28.060 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -16.697 22.610 -28.123 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -16.586 21.043 -28.932 1.00 0.00 H new ATOM 400 N LEU A 178 -18.651 18.006 -20.910 1.00 0.00 N ATOM 401 CA LEU A 178 -18.859 16.554 -20.970 1.00 0.00 C ATOM 402 C LEU A 178 -20.347 16.234 -20.897 1.00 0.00 C ATOM 403 O LEU A 178 -21.138 17.004 -20.355 1.00 0.00 O ATOM 404 CB LEU A 178 -18.141 15.847 -19.807 1.00 0.00 C ATOM 405 CG LEU A 178 -16.606 15.688 -19.869 1.00 0.00 C ATOM 406 CD1 LEU A 178 -16.195 14.766 -18.739 1.00 0.00 C ATOM 407 CD2 LEU A 178 -16.120 15.073 -21.197 1.00 0.00 C ATOM 0 H LEU A 178 -19.262 18.486 -20.249 1.00 0.00 H new ATOM 0 HA LEU A 178 -18.447 16.197 -21.914 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -18.380 16.390 -18.892 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -18.573 14.851 -19.709 1.00 0.00 H new ATOM 0 HG LEU A 178 -16.160 16.679 -19.787 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -15.113 14.632 -18.754 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -16.493 15.203 -17.786 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -16.682 13.799 -18.863 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -15.034 14.986 -21.182 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -16.561 14.084 -21.323 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -16.421 15.713 -22.026 1.00 0.00 H new ATOM 419 N THR A 179 -20.737 15.090 -21.432 1.00 0.00 N ATOM 420 CA THR A 179 -22.125 14.634 -21.361 1.00 0.00 C ATOM 421 C THR A 179 -22.266 13.825 -20.082 1.00 0.00 C ATOM 422 O THR A 179 -21.265 13.471 -19.474 1.00 0.00 O ATOM 423 CB THR A 179 -22.487 13.746 -22.565 1.00 0.00 C ATOM 424 OG1 THR A 179 -21.614 12.615 -22.605 1.00 0.00 O ATOM 425 CG2 THR A 179 -22.341 14.512 -23.869 1.00 0.00 C ATOM 0 H THR A 179 -20.112 14.452 -21.925 1.00 0.00 H new ATOM 0 HA THR A 179 -22.795 15.494 -21.373 1.00 0.00 H new ATOM 0 HB THR A 179 -23.523 13.427 -22.451 1.00 0.00 H new ATOM 0 HG1 THR A 179 -22.120 11.804 -22.390 1.00 0.00 H new ATOM 0 HG21 THR A 179 -22.603 13.862 -24.704 1.00 0.00 H new ATOM 0 HG22 THR A 179 -23.005 15.376 -23.860 1.00 0.00 H new ATOM 0 HG23 THR A 179 -21.310 14.848 -23.980 1.00 0.00 H new ATOM 433 N LEU A 180 -23.488 13.513 -19.666 1.00 0.00 N ATOM 434 CA LEU A 180 -23.674 12.737 -18.427 1.00 0.00 C ATOM 435 C LEU A 180 -22.960 11.386 -18.481 1.00 0.00 C ATOM 436 O LEU A 180 -22.371 10.960 -17.500 1.00 0.00 O ATOM 437 CB LEU A 180 -25.165 12.538 -18.140 1.00 0.00 C ATOM 438 CG LEU A 180 -25.749 13.476 -17.069 1.00 0.00 C ATOM 439 CD1 LEU A 180 -27.264 13.297 -17.010 1.00 0.00 C ATOM 440 CD2 LEU A 180 -25.156 13.206 -15.686 1.00 0.00 C ATOM 0 H LEU A 180 -24.349 13.773 -20.147 1.00 0.00 H new ATOM 0 HA LEU A 180 -23.226 13.311 -17.616 1.00 0.00 H new ATOM 0 HB2 LEU A 180 -25.721 12.678 -19.067 1.00 0.00 H new ATOM 0 HB3 LEU A 180 -25.325 11.507 -17.825 1.00 0.00 H new ATOM 0 HG LEU A 180 -25.494 14.498 -17.349 1.00 0.00 H new ATOM 0 HD11 LEU A 180 -27.680 13.961 -16.252 1.00 0.00 H new ATOM 0 HD12 LEU A 180 -27.697 13.539 -17.981 1.00 0.00 H new ATOM 0 HD13 LEU A 180 -27.499 12.263 -16.755 1.00 0.00 H new ATOM 0 HD21 LEU A 180 -25.597 13.891 -14.961 1.00 0.00 H new ATOM 0 HD22 LEU A 180 -25.371 12.179 -15.392 1.00 0.00 H new ATOM 0 HD23 LEU A 180 -24.077 13.356 -15.717 1.00 0.00 H new ATOM 452 N SER A 181 -22.991 10.726 -19.626 1.00 0.00 N ATOM 453 CA SER A 181 -22.329 9.434 -19.785 1.00 0.00 C ATOM 454 C SER A 181 -20.810 9.552 -19.615 1.00 0.00 C ATOM 455 O SER A 181 -20.179 8.695 -19.010 1.00 0.00 O ATOM 456 CB SER A 181 -22.628 8.886 -21.176 1.00 0.00 C ATOM 457 OG SER A 181 -23.317 9.864 -21.940 1.00 0.00 O ATOM 0 H SER A 181 -23.468 11.061 -20.463 1.00 0.00 H new ATOM 0 HA SER A 181 -22.709 8.764 -19.014 1.00 0.00 H new ATOM 0 HB2 SER A 181 -21.699 8.609 -21.675 1.00 0.00 H new ATOM 0 HB3 SER A 181 -23.230 7.981 -21.099 1.00 0.00 H new ATOM 0 HG SER A 181 -24.266 9.863 -21.694 1.00 0.00 H new ATOM 463 N GLN A 182 -20.232 10.616 -20.153 1.00 0.00 N ATOM 464 CA GLN A 182 -18.789 10.832 -20.057 1.00 0.00 C ATOM 465 C GLN A 182 -18.364 11.064 -18.615 1.00 0.00 C ATOM 466 O GLN A 182 -17.312 10.606 -18.185 1.00 0.00 O ATOM 467 CB GLN A 182 -18.374 12.051 -20.871 1.00 0.00 C ATOM 468 CG GLN A 182 -18.376 11.857 -22.383 1.00 0.00 C ATOM 469 CD GLN A 182 -17.319 10.875 -22.841 1.00 0.00 C ATOM 470 OE1 GLN A 182 -17.556 9.693 -22.903 1.00 0.00 O ATOM 471 NE2 GLN A 182 -16.159 11.373 -23.177 1.00 0.00 N ATOM 0 H GLN A 182 -20.735 11.344 -20.660 1.00 0.00 H new ATOM 0 HA GLN A 182 -18.305 9.936 -20.444 1.00 0.00 H new ATOM 0 HB2 GLN A 182 -19.043 12.876 -20.626 1.00 0.00 H new ATOM 0 HB3 GLN A 182 -17.373 12.350 -20.561 1.00 0.00 H new ATOM 0 HG2 GLN A 182 -19.357 11.504 -22.700 1.00 0.00 H new ATOM 0 HG3 GLN A 182 -18.210 12.818 -22.870 1.00 0.00 H new ATOM 0 HE21 GLN A 182 -15.997 12.378 -23.111 1.00 0.00 H new ATOM 0 HE22 GLN A 182 -15.415 10.757 -23.506 1.00 0.00 H new ATOM 480 N ILE A 183 -19.185 11.778 -17.870 1.00 0.00 N ATOM 481 CA ILE A 183 -18.880 12.065 -16.474 1.00 0.00 C ATOM 482 C ILE A 183 -18.881 10.761 -15.685 1.00 0.00 C ATOM 483 O ILE A 183 -18.025 10.554 -14.814 1.00 0.00 O ATOM 484 CB ILE A 183 -19.909 13.082 -15.902 1.00 0.00 C ATOM 485 CG1 ILE A 183 -19.753 14.425 -16.637 1.00 0.00 C ATOM 486 CG2 ILE A 183 -19.691 13.292 -14.380 1.00 0.00 C ATOM 487 CD1 ILE A 183 -20.988 15.280 -16.635 1.00 0.00 C ATOM 0 H ILE A 183 -20.066 12.171 -18.202 1.00 0.00 H new ATOM 0 HA ILE A 183 -17.892 12.517 -16.392 1.00 0.00 H new ATOM 0 HB ILE A 183 -20.914 12.688 -16.053 1.00 0.00 H new ATOM 0 HG12 ILE A 183 -18.938 14.984 -16.178 1.00 0.00 H new ATOM 0 HG13 ILE A 183 -19.463 14.229 -17.669 1.00 0.00 H new ATOM 0 HG21 ILE A 183 -20.422 14.007 -14.003 1.00 0.00 H new ATOM 0 HG22 ILE A 183 -19.812 12.341 -13.861 1.00 0.00 H new ATOM 0 HG23 ILE A 183 -18.686 13.675 -14.206 1.00 0.00 H new ATOM 0 HD11 ILE A 183 -20.790 16.207 -17.174 1.00 0.00 H new ATOM 0 HD12 ILE A 183 -21.802 14.744 -17.122 1.00 0.00 H new ATOM 0 HD13 ILE A 183 -21.269 15.511 -15.607 1.00 0.00 H new ATOM 499 N TYR A 184 -19.809 9.860 -16.000 1.00 0.00 N ATOM 500 CA TYR A 184 -19.820 8.559 -15.339 1.00 0.00 C ATOM 501 C TYR A 184 -18.536 7.821 -15.641 1.00 0.00 C ATOM 502 O TYR A 184 -17.876 7.315 -14.733 1.00 0.00 O ATOM 503 CB TYR A 184 -20.989 7.669 -15.779 1.00 0.00 C ATOM 504 CG TYR A 184 -22.375 8.287 -15.715 1.00 0.00 C ATOM 505 CD1 TYR A 184 -23.358 7.899 -16.653 1.00 0.00 C ATOM 506 CD2 TYR A 184 -22.723 9.243 -14.739 1.00 0.00 C ATOM 507 CE1 TYR A 184 -24.665 8.445 -16.620 1.00 0.00 C ATOM 508 CE2 TYR A 184 -24.049 9.785 -14.697 1.00 0.00 C ATOM 509 CZ TYR A 184 -24.996 9.373 -15.642 1.00 0.00 C ATOM 510 OH TYR A 184 -26.282 9.873 -15.621 1.00 0.00 O ATOM 0 H TYR A 184 -20.546 10.001 -16.691 1.00 0.00 H new ATOM 0 HA TYR A 184 -19.928 8.760 -14.273 1.00 0.00 H new ATOM 0 HB2 TYR A 184 -20.806 7.348 -16.805 1.00 0.00 H new ATOM 0 HB3 TYR A 184 -20.987 6.772 -15.159 1.00 0.00 H new ATOM 0 HD1 TYR A 184 -23.108 7.171 -17.411 1.00 0.00 H new ATOM 0 HD2 TYR A 184 -21.987 9.569 -14.019 1.00 0.00 H new ATOM 0 HE1 TYR A 184 -25.399 8.141 -17.351 1.00 0.00 H new ATOM 0 HE2 TYR A 184 -24.316 10.508 -13.940 1.00 0.00 H new ATOM 0 HH TYR A 184 -26.917 9.137 -15.495 1.00 0.00 H new ATOM 520 N GLU A 185 -18.168 7.761 -16.915 1.00 0.00 N ATOM 521 CA GLU A 185 -16.957 7.055 -17.314 1.00 0.00 C ATOM 522 C GLU A 185 -15.723 7.635 -16.625 1.00 0.00 C ATOM 523 O GLU A 185 -14.857 6.894 -16.163 1.00 0.00 O ATOM 524 CB GLU A 185 -16.753 7.146 -18.823 1.00 0.00 C ATOM 525 CG GLU A 185 -17.642 6.210 -19.639 1.00 0.00 C ATOM 526 CD GLU A 185 -16.827 5.214 -20.448 1.00 0.00 C ATOM 527 OE1 GLU A 185 -15.865 5.624 -21.135 1.00 0.00 O ATOM 528 OE2 GLU A 185 -17.122 4.000 -20.378 1.00 0.00 O ATOM 0 H GLU A 185 -18.685 8.188 -17.683 1.00 0.00 H new ATOM 0 HA GLU A 185 -17.082 6.014 -17.016 1.00 0.00 H new ATOM 0 HB2 GLU A 185 -16.939 8.172 -19.141 1.00 0.00 H new ATOM 0 HB3 GLU A 185 -15.710 6.926 -19.050 1.00 0.00 H new ATOM 0 HG2 GLU A 185 -18.312 5.671 -18.969 1.00 0.00 H new ATOM 0 HG3 GLU A 185 -18.267 6.798 -20.311 1.00 0.00 H new ATOM 535 N TRP A 186 -15.643 8.953 -16.535 1.00 0.00 N ATOM 536 CA TRP A 186 -14.505 9.599 -15.914 1.00 0.00 C ATOM 537 C TRP A 186 -14.385 9.178 -14.462 1.00 0.00 C ATOM 538 O TRP A 186 -13.300 8.909 -13.996 1.00 0.00 O ATOM 539 CB TRP A 186 -14.626 11.121 -16.020 1.00 0.00 C ATOM 540 CG TRP A 186 -13.452 11.835 -15.413 1.00 0.00 C ATOM 541 CD1 TRP A 186 -12.327 12.255 -16.047 1.00 0.00 C ATOM 542 CD2 TRP A 186 -13.268 12.198 -14.030 1.00 0.00 C ATOM 543 NE1 TRP A 186 -11.454 12.844 -15.181 1.00 0.00 N ATOM 544 CE2 TRP A 186 -11.994 12.821 -13.921 1.00 0.00 C ATOM 545 CE3 TRP A 186 -14.064 12.053 -12.875 1.00 0.00 C ATOM 546 CZ2 TRP A 186 -11.488 13.293 -12.694 1.00 0.00 C ATOM 547 CZ3 TRP A 186 -13.572 12.527 -11.640 1.00 0.00 C ATOM 548 CH2 TRP A 186 -12.281 13.138 -11.559 1.00 0.00 C ATOM 0 H TRP A 186 -16.355 9.594 -16.885 1.00 0.00 H new ATOM 0 HA TRP A 186 -13.603 9.288 -16.441 1.00 0.00 H new ATOM 0 HB2 TRP A 186 -14.716 11.403 -17.069 1.00 0.00 H new ATOM 0 HB3 TRP A 186 -15.541 11.445 -15.523 1.00 0.00 H new ATOM 0 HD1 TRP A 186 -12.146 12.137 -17.105 1.00 0.00 H new ATOM 0 HE1 TRP A 186 -10.547 13.238 -15.430 1.00 0.00 H new ATOM 0 HE3 TRP A 186 -15.036 11.586 -12.935 1.00 0.00 H new ATOM 0 HZ2 TRP A 186 -10.516 13.760 -12.635 1.00 0.00 H new ATOM 0 HZ3 TRP A 186 -14.175 12.428 -10.749 1.00 0.00 H new ATOM 0 HH2 TRP A 186 -11.916 13.484 -10.604 1.00 0.00 H new ATOM 559 N MET A 187 -15.496 9.101 -13.738 1.00 0.00 N ATOM 560 CA MET A 187 -15.429 8.726 -12.323 1.00 0.00 C ATOM 561 C MET A 187 -15.049 7.262 -12.154 1.00 0.00 C ATOM 562 O MET A 187 -14.310 6.921 -11.241 1.00 0.00 O ATOM 563 CB MET A 187 -16.766 8.971 -11.632 1.00 0.00 C ATOM 564 CG MET A 187 -17.121 10.425 -11.461 1.00 0.00 C ATOM 565 SD MET A 187 -18.678 10.586 -10.571 1.00 0.00 S ATOM 566 CE MET A 187 -18.956 12.331 -10.664 1.00 0.00 C ATOM 0 H MET A 187 -16.434 9.287 -14.092 1.00 0.00 H new ATOM 0 HA MET A 187 -14.661 9.349 -11.865 1.00 0.00 H new ATOM 0 HB2 MET A 187 -17.553 8.483 -12.207 1.00 0.00 H new ATOM 0 HB3 MET A 187 -16.746 8.497 -10.651 1.00 0.00 H new ATOM 0 HG2 MET A 187 -16.328 10.939 -10.917 1.00 0.00 H new ATOM 0 HG3 MET A 187 -17.200 10.904 -12.437 1.00 0.00 H new ATOM 0 HE1 MET A 187 -19.481 12.664 -9.769 1.00 0.00 H new ATOM 0 HE2 MET A 187 -17.999 12.848 -10.738 1.00 0.00 H new ATOM 0 HE3 MET A 187 -19.559 12.557 -11.543 1.00 0.00 H new ATOM 576 N VAL A 188 -15.539 6.397 -13.032 1.00 0.00 N ATOM 577 CA VAL A 188 -15.196 4.965 -12.975 1.00 0.00 C ATOM 578 C VAL A 188 -13.697 4.785 -13.214 1.00 0.00 C ATOM 579 O VAL A 188 -13.032 4.025 -12.515 1.00 0.00 O ATOM 580 CB VAL A 188 -16.013 4.150 -14.042 1.00 0.00 C ATOM 581 CG1 VAL A 188 -15.528 2.697 -14.133 1.00 0.00 C ATOM 582 CG2 VAL A 188 -17.493 4.129 -13.677 1.00 0.00 C ATOM 0 H VAL A 188 -16.172 6.650 -13.791 1.00 0.00 H new ATOM 0 HA VAL A 188 -15.454 4.585 -11.986 1.00 0.00 H new ATOM 0 HB VAL A 188 -15.862 4.644 -15.002 1.00 0.00 H new ATOM 0 HG11 VAL A 188 -16.115 2.164 -14.880 1.00 0.00 H new ATOM 0 HG12 VAL A 188 -14.476 2.682 -14.419 1.00 0.00 H new ATOM 0 HG13 VAL A 188 -15.647 2.212 -13.164 1.00 0.00 H new ATOM 0 HG21 VAL A 188 -18.044 3.561 -14.426 1.00 0.00 H new ATOM 0 HG22 VAL A 188 -17.620 3.662 -12.701 1.00 0.00 H new ATOM 0 HG23 VAL A 188 -17.874 5.150 -13.643 1.00 0.00 H new ATOM 592 N LYS A 189 -13.154 5.479 -14.193 1.00 0.00 N ATOM 593 CA LYS A 189 -11.745 5.353 -14.513 1.00 0.00 C ATOM 594 C LYS A 189 -10.820 6.062 -13.523 1.00 0.00 C ATOM 595 O LYS A 189 -9.762 5.533 -13.191 1.00 0.00 O ATOM 596 CB LYS A 189 -11.485 5.912 -15.919 1.00 0.00 C ATOM 597 CG LYS A 189 -11.657 4.897 -17.046 1.00 0.00 C ATOM 598 CD LYS A 189 -13.042 4.888 -17.662 1.00 0.00 C ATOM 599 CE LYS A 189 -13.077 3.877 -18.778 1.00 0.00 C ATOM 600 NZ LYS A 189 -14.384 3.860 -19.472 1.00 0.00 N ATOM 0 H LYS A 189 -13.666 6.136 -14.781 1.00 0.00 H new ATOM 0 HA LYS A 189 -11.516 4.289 -14.457 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -12.161 6.749 -16.094 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -10.471 6.309 -15.956 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -10.925 5.108 -17.826 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -11.435 3.902 -16.661 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -13.788 4.641 -16.907 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -13.291 5.878 -18.043 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -12.289 4.103 -19.496 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -12.868 2.886 -18.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -14.459 2.998 -20.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -15.150 3.874 -18.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -14.462 4.696 -20.086 1.00 0.00 H new ATOM 614 N SER A 190 -11.196 7.253 -13.081 1.00 0.00 N ATOM 615 CA SER A 190 -10.334 8.071 -12.228 1.00 0.00 C ATOM 616 C SER A 190 -10.504 7.890 -10.725 1.00 0.00 C ATOM 617 O SER A 190 -9.687 8.391 -9.950 1.00 0.00 O ATOM 618 CB SER A 190 -10.557 9.551 -12.546 1.00 0.00 C ATOM 619 OG SER A 190 -10.532 9.776 -13.949 1.00 0.00 O ATOM 0 H SER A 190 -12.097 7.680 -13.298 1.00 0.00 H new ATOM 0 HA SER A 190 -9.326 7.727 -12.461 1.00 0.00 H new ATOM 0 HB2 SER A 190 -11.515 9.875 -12.138 1.00 0.00 H new ATOM 0 HB3 SER A 190 -9.786 10.151 -12.063 1.00 0.00 H new ATOM 0 HG SER A 190 -11.407 9.557 -14.331 1.00 0.00 H new ATOM 625 N VAL A 191 -11.555 7.196 -10.295 1.00 0.00 N ATOM 626 CA VAL A 191 -11.786 6.982 -8.862 1.00 0.00 C ATOM 627 C VAL A 191 -12.109 5.511 -8.600 1.00 0.00 C ATOM 628 O VAL A 191 -13.136 4.994 -9.055 1.00 0.00 O ATOM 629 CB VAL A 191 -12.947 7.870 -8.328 1.00 0.00 C ATOM 630 CG1 VAL A 191 -12.992 7.811 -6.779 1.00 0.00 C ATOM 631 CG2 VAL A 191 -12.766 9.325 -8.763 1.00 0.00 C ATOM 0 H VAL A 191 -12.254 6.775 -10.907 1.00 0.00 H new ATOM 0 HA VAL A 191 -10.874 7.262 -8.335 1.00 0.00 H new ATOM 0 HB VAL A 191 -13.880 7.487 -8.743 1.00 0.00 H new ATOM 0 HG11 VAL A 191 -13.808 8.436 -6.415 1.00 0.00 H new ATOM 0 HG12 VAL A 191 -13.152 6.782 -6.459 1.00 0.00 H new ATOM 0 HG13 VAL A 191 -12.048 8.174 -6.373 1.00 0.00 H new ATOM 0 HG21 VAL A 191 -13.590 9.925 -8.377 1.00 0.00 H new ATOM 0 HG22 VAL A 191 -11.824 9.708 -8.371 1.00 0.00 H new ATOM 0 HG23 VAL A 191 -12.755 9.381 -9.852 1.00 0.00 H new ATOM 641 N PRO A 192 -11.243 4.805 -7.848 1.00 0.00 N ATOM 642 CA PRO A 192 -11.555 3.383 -7.662 1.00 0.00 C ATOM 643 C PRO A 192 -12.823 3.144 -6.838 1.00 0.00 C ATOM 644 O PRO A 192 -13.443 2.100 -6.939 1.00 0.00 O ATOM 645 CB PRO A 192 -10.295 2.850 -6.969 1.00 0.00 C ATOM 646 CG PRO A 192 -9.742 4.027 -6.239 1.00 0.00 C ATOM 647 CD PRO A 192 -9.993 5.188 -7.168 1.00 0.00 C ATOM 0 HA PRO A 192 -11.779 2.877 -8.601 1.00 0.00 H new ATOM 0 HB2 PRO A 192 -10.533 2.035 -6.285 1.00 0.00 H new ATOM 0 HB3 PRO A 192 -9.579 2.460 -7.693 1.00 0.00 H new ATOM 0 HG2 PRO A 192 -10.239 4.170 -5.279 1.00 0.00 H new ATOM 0 HG3 PRO A 192 -8.679 3.904 -6.033 1.00 0.00 H new ATOM 0 HD2 PRO A 192 -10.101 6.125 -6.622 1.00 0.00 H new ATOM 0 HD3 PRO A 192 -9.174 5.324 -7.875 1.00 0.00 H new ATOM 655 N TYR A 193 -13.228 4.126 -6.051 1.00 0.00 N ATOM 656 CA TYR A 193 -14.479 4.048 -5.296 1.00 0.00 C ATOM 657 C TYR A 193 -15.672 3.908 -6.244 1.00 0.00 C ATOM 658 O TYR A 193 -16.572 3.117 -6.009 1.00 0.00 O ATOM 659 CB TYR A 193 -14.669 5.320 -4.468 1.00 0.00 C ATOM 660 CG TYR A 193 -15.885 5.279 -3.569 1.00 0.00 C ATOM 661 CD1 TYR A 193 -17.116 5.847 -3.983 1.00 0.00 C ATOM 662 CD2 TYR A 193 -15.813 4.688 -2.301 1.00 0.00 C ATOM 663 CE1 TYR A 193 -18.252 5.808 -3.139 1.00 0.00 C ATOM 664 CE2 TYR A 193 -16.949 4.650 -1.454 1.00 0.00 C ATOM 665 CZ TYR A 193 -18.156 5.215 -1.887 1.00 0.00 C ATOM 666 OH TYR A 193 -19.234 5.173 -1.053 1.00 0.00 O ATOM 0 H TYR A 193 -12.709 4.994 -5.914 1.00 0.00 H new ATOM 0 HA TYR A 193 -14.425 3.177 -4.643 1.00 0.00 H new ATOM 0 HB2 TYR A 193 -13.781 5.483 -3.857 1.00 0.00 H new ATOM 0 HB3 TYR A 193 -14.753 6.173 -5.141 1.00 0.00 H new ATOM 0 HD1 TYR A 193 -17.188 6.315 -4.954 1.00 0.00 H new ATOM 0 HD2 TYR A 193 -14.882 4.257 -1.965 1.00 0.00 H new ATOM 0 HE1 TYR A 193 -19.187 6.237 -3.467 1.00 0.00 H new ATOM 0 HE2 TYR A 193 -16.885 4.188 -0.480 1.00 0.00 H new ATOM 0 HH TYR A 193 -18.986 4.720 -0.220 1.00 0.00 H new ATOM 676 N PHE A 194 -15.683 4.676 -7.322 1.00 0.00 N ATOM 677 CA PHE A 194 -16.814 4.632 -8.248 1.00 0.00 C ATOM 678 C PHE A 194 -16.713 3.468 -9.205 1.00 0.00 C ATOM 679 O PHE A 194 -17.731 3.005 -9.730 1.00 0.00 O ATOM 680 CB PHE A 194 -16.924 5.959 -8.980 1.00 0.00 C ATOM 681 CG PHE A 194 -17.681 6.988 -8.187 1.00 0.00 C ATOM 682 CD1 PHE A 194 -17.002 7.954 -7.419 1.00 0.00 C ATOM 683 CD2 PHE A 194 -19.080 6.985 -8.191 1.00 0.00 C ATOM 684 CE1 PHE A 194 -17.717 8.895 -6.649 1.00 0.00 C ATOM 685 CE2 PHE A 194 -19.812 7.918 -7.443 1.00 0.00 C ATOM 686 CZ PHE A 194 -19.129 8.879 -6.655 1.00 0.00 C ATOM 0 H PHE A 194 -14.940 5.326 -7.578 1.00 0.00 H new ATOM 0 HA PHE A 194 -17.727 4.474 -7.674 1.00 0.00 H new ATOM 0 HB2 PHE A 194 -15.924 6.335 -9.198 1.00 0.00 H new ATOM 0 HB3 PHE A 194 -17.422 5.803 -9.937 1.00 0.00 H new ATOM 0 HD1 PHE A 194 -15.922 7.974 -7.420 1.00 0.00 H new ATOM 0 HD2 PHE A 194 -19.606 6.250 -8.782 1.00 0.00 H new ATOM 0 HE1 PHE A 194 -17.186 9.626 -6.057 1.00 0.00 H new ATOM 0 HE2 PHE A 194 -20.892 7.905 -7.467 1.00 0.00 H new ATOM 0 HZ PHE A 194 -19.684 9.593 -6.064 1.00 0.00 H new ATOM 696 N LYS A 195 -15.511 2.947 -9.401 1.00 0.00 N ATOM 697 CA LYS A 195 -15.355 1.709 -10.156 1.00 0.00 C ATOM 698 C LYS A 195 -16.042 0.605 -9.375 1.00 0.00 C ATOM 699 O LYS A 195 -16.750 -0.231 -9.944 1.00 0.00 O ATOM 700 CB LYS A 195 -13.867 1.390 -10.362 1.00 0.00 C ATOM 701 CG LYS A 195 -13.593 0.105 -11.127 1.00 0.00 C ATOM 702 CD LYS A 195 -13.400 -1.080 -10.156 1.00 0.00 C ATOM 703 CE LYS A 195 -13.168 -2.383 -10.878 1.00 0.00 C ATOM 704 NZ LYS A 195 -13.151 -3.496 -9.863 1.00 0.00 N ATOM 0 H LYS A 195 -14.641 3.353 -9.055 1.00 0.00 H new ATOM 0 HA LYS A 195 -15.805 1.804 -11.144 1.00 0.00 H new ATOM 0 HB2 LYS A 195 -13.402 2.220 -10.894 1.00 0.00 H new ATOM 0 HB3 LYS A 195 -13.385 1.326 -9.387 1.00 0.00 H new ATOM 0 HG2 LYS A 195 -14.421 -0.105 -11.804 1.00 0.00 H new ATOM 0 HG3 LYS A 195 -12.702 0.226 -11.742 1.00 0.00 H new ATOM 0 HD2 LYS A 195 -12.553 -0.875 -9.501 1.00 0.00 H new ATOM 0 HD3 LYS A 195 -14.280 -1.172 -9.520 1.00 0.00 H new ATOM 0 HE2 LYS A 195 -13.954 -2.553 -11.614 1.00 0.00 H new ATOM 0 HE3 LYS A 195 -12.224 -2.352 -11.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 195 -12.992 -4.403 -10.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 195 -12.387 -3.329 -9.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 195 -14.063 -3.525 -9.364 1.00 0.00 H new ATOM 718 N ASP A 196 -15.819 0.600 -8.074 1.00 0.00 N ATOM 719 CA ASP A 196 -16.365 -0.430 -7.200 1.00 0.00 C ATOM 720 C ASP A 196 -17.881 -0.298 -7.049 1.00 0.00 C ATOM 721 O ASP A 196 -18.608 -1.283 -6.912 1.00 0.00 O ATOM 722 CB ASP A 196 -15.710 -0.297 -5.833 1.00 0.00 C ATOM 723 CG ASP A 196 -15.621 -1.605 -5.116 1.00 0.00 C ATOM 724 OD1 ASP A 196 -16.190 -1.705 -4.006 1.00 0.00 O ATOM 725 OD2 ASP A 196 -14.958 -2.523 -5.650 1.00 0.00 O ATOM 0 H ASP A 196 -15.259 1.303 -7.593 1.00 0.00 H new ATOM 0 HA ASP A 196 -16.159 -1.406 -7.640 1.00 0.00 H new ATOM 0 HB2 ASP A 196 -14.709 0.119 -5.951 1.00 0.00 H new ATOM 0 HB3 ASP A 196 -16.279 0.409 -5.227 1.00 0.00 H new ATOM 730 N LYS A 197 -18.369 0.930 -7.086 1.00 0.00 N ATOM 731 CA LYS A 197 -19.805 1.193 -6.936 1.00 0.00 C ATOM 732 C LYS A 197 -20.527 1.130 -8.278 1.00 0.00 C ATOM 733 O LYS A 197 -21.624 1.662 -8.427 1.00 0.00 O ATOM 734 CB LYS A 197 -20.003 2.554 -6.239 1.00 0.00 C ATOM 735 CG LYS A 197 -20.184 2.434 -4.710 1.00 0.00 C ATOM 736 CD LYS A 197 -18.917 1.943 -4.007 1.00 0.00 C ATOM 737 CE LYS A 197 -19.189 1.631 -2.553 1.00 0.00 C ATOM 738 NZ LYS A 197 -17.992 0.942 -1.956 1.00 0.00 N ATOM 0 H LYS A 197 -17.799 1.766 -7.218 1.00 0.00 H new ATOM 0 HA LYS A 197 -20.247 0.415 -6.313 1.00 0.00 H new ATOM 0 HB2 LYS A 197 -19.143 3.190 -6.448 1.00 0.00 H new ATOM 0 HB3 LYS A 197 -20.876 3.049 -6.664 1.00 0.00 H new ATOM 0 HG2 LYS A 197 -20.468 3.405 -4.304 1.00 0.00 H new ATOM 0 HG3 LYS A 197 -21.003 1.747 -4.497 1.00 0.00 H new ATOM 0 HD2 LYS A 197 -18.540 1.052 -4.509 1.00 0.00 H new ATOM 0 HD3 LYS A 197 -18.139 2.703 -4.080 1.00 0.00 H new ATOM 0 HE2 LYS A 197 -19.403 2.550 -2.007 1.00 0.00 H new ATOM 0 HE3 LYS A 197 -20.070 0.995 -2.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 -18.178 0.727 -0.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 -17.807 0.058 -2.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 -17.162 1.564 -2.028 1.00 0.00 H new ATOM 752 N GLY A 198 -19.922 0.470 -9.249 1.00 0.00 N ATOM 753 CA GLY A 198 -20.504 0.342 -10.581 1.00 0.00 C ATOM 754 C GLY A 198 -21.652 -0.653 -10.669 1.00 0.00 C ATOM 755 O GLY A 198 -22.151 -0.935 -11.752 1.00 0.00 O ATOM 0 H GLY A 198 -19.019 0.009 -9.142 1.00 0.00 H new ATOM 0 HA2 GLY A 198 -20.860 1.320 -10.905 1.00 0.00 H new ATOM 0 HA3 GLY A 198 -19.723 0.040 -11.279 1.00 0.00 H new ATOM 759 N ASP A 199 -22.066 -1.176 -9.521 1.00 0.00 N ATOM 760 CA ASP A 199 -23.165 -2.139 -9.439 1.00 0.00 C ATOM 761 C ASP A 199 -24.454 -1.614 -10.087 1.00 0.00 C ATOM 762 O ASP A 199 -24.792 -0.427 -9.998 1.00 0.00 O ATOM 763 CB ASP A 199 -23.437 -2.484 -7.974 1.00 0.00 C ATOM 764 CG ASP A 199 -24.774 -3.147 -7.786 1.00 0.00 C ATOM 765 OD1 ASP A 199 -25.696 -2.477 -7.281 1.00 0.00 O ATOM 766 OD2 ASP A 199 -24.924 -4.318 -8.176 1.00 0.00 O ATOM 0 H ASP A 199 -21.651 -0.946 -8.618 1.00 0.00 H new ATOM 0 HA ASP A 199 -22.859 -3.028 -9.990 1.00 0.00 H new ATOM 0 HB2 ASP A 199 -22.651 -3.144 -7.606 1.00 0.00 H new ATOM 0 HB3 ASP A 199 -23.397 -1.574 -7.375 1.00 0.00 H new ATOM 771 N SER A 200 -25.172 -2.512 -10.752 1.00 0.00 N ATOM 772 CA SER A 200 -26.357 -2.152 -11.525 1.00 0.00 C ATOM 773 C SER A 200 -27.488 -1.532 -10.699 1.00 0.00 C ATOM 774 O SER A 200 -28.177 -0.634 -11.181 1.00 0.00 O ATOM 775 CB SER A 200 -26.861 -3.399 -12.256 1.00 0.00 C ATOM 776 OG SER A 200 -25.788 -4.007 -12.942 1.00 0.00 O ATOM 0 H SER A 200 -24.951 -3.508 -10.771 1.00 0.00 H new ATOM 0 HA SER A 200 -26.054 -1.374 -12.226 1.00 0.00 H new ATOM 0 HB2 SER A 200 -27.296 -4.100 -11.544 1.00 0.00 H new ATOM 0 HB3 SER A 200 -27.649 -3.128 -12.958 1.00 0.00 H new ATOM 0 HG SER A 200 -26.109 -4.806 -13.409 1.00 0.00 H new ATOM 782 N ASN A 201 -27.688 -1.976 -9.464 1.00 0.00 N ATOM 783 CA ASN A 201 -28.745 -1.379 -8.629 1.00 0.00 C ATOM 784 C ASN A 201 -28.238 -0.051 -8.084 1.00 0.00 C ATOM 785 O ASN A 201 -28.991 0.918 -7.970 1.00 0.00 O ATOM 786 CB ASN A 201 -29.123 -2.314 -7.477 1.00 0.00 C ATOM 787 CG ASN A 201 -30.363 -1.858 -6.752 1.00 0.00 C ATOM 788 OD1 ASN A 201 -31.315 -1.395 -7.361 1.00 0.00 O ATOM 789 ND2 ASN A 201 -30.365 -1.993 -5.451 1.00 0.00 N ATOM 0 H ASN A 201 -27.155 -2.724 -9.021 1.00 0.00 H new ATOM 0 HA ASN A 201 -29.638 -1.219 -9.233 1.00 0.00 H new ATOM 0 HB2 ASN A 201 -29.282 -3.320 -7.866 1.00 0.00 H new ATOM 0 HB3 ASN A 201 -28.294 -2.372 -6.772 1.00 0.00 H new ATOM 0 HD21 ASN A 201 -31.181 -1.707 -4.910 1.00 0.00 H new ATOM 0 HD22 ASN A 201 -29.551 -2.384 -4.978 1.00 0.00 H new ATOM 796 N SER A 202 -26.951 0.005 -7.768 1.00 0.00 N ATOM 797 CA SER A 202 -26.316 1.229 -7.272 1.00 0.00 C ATOM 798 C SER A 202 -26.345 2.326 -8.340 1.00 0.00 C ATOM 799 O SER A 202 -26.288 3.513 -8.011 1.00 0.00 O ATOM 800 CB SER A 202 -24.873 0.957 -6.837 1.00 0.00 C ATOM 801 OG SER A 202 -24.845 -0.016 -5.805 1.00 0.00 O ATOM 0 H SER A 202 -26.317 -0.790 -7.846 1.00 0.00 H new ATOM 0 HA SER A 202 -26.881 1.571 -6.405 1.00 0.00 H new ATOM 0 HB2 SER A 202 -24.288 0.610 -7.689 1.00 0.00 H new ATOM 0 HB3 SER A 202 -24.411 1.880 -6.488 1.00 0.00 H new ATOM 0 HG SER A 202 -25.127 -0.883 -6.165 1.00 0.00 H new ATOM 807 N SER A 203 -26.465 1.933 -9.602 1.00 0.00 N ATOM 808 CA SER A 203 -26.550 2.882 -10.717 1.00 0.00 C ATOM 809 C SER A 203 -27.672 3.905 -10.514 1.00 0.00 C ATOM 810 O SER A 203 -27.569 5.060 -10.961 1.00 0.00 O ATOM 811 CB SER A 203 -26.775 2.137 -12.034 1.00 0.00 C ATOM 812 OG SER A 203 -26.724 3.018 -13.156 1.00 0.00 O ATOM 0 H SER A 203 -26.506 0.954 -9.886 1.00 0.00 H new ATOM 0 HA SER A 203 -25.603 3.420 -10.754 1.00 0.00 H new ATOM 0 HB2 SER A 203 -26.018 1.361 -12.147 1.00 0.00 H new ATOM 0 HB3 SER A 203 -27.743 1.637 -12.008 1.00 0.00 H new ATOM 0 HG SER A 203 -26.870 2.508 -13.980 1.00 0.00 H new ATOM 818 N ALA A 204 -28.736 3.499 -9.835 1.00 0.00 N ATOM 819 CA ALA A 204 -29.869 4.389 -9.561 1.00 0.00 C ATOM 820 C ALA A 204 -29.413 5.619 -8.755 1.00 0.00 C ATOM 821 O ALA A 204 -29.728 6.755 -9.110 1.00 0.00 O ATOM 822 CB ALA A 204 -30.950 3.621 -8.791 1.00 0.00 C ATOM 0 H ALA A 204 -28.844 2.556 -9.460 1.00 0.00 H new ATOM 0 HA ALA A 204 -30.280 4.738 -10.508 1.00 0.00 H new ATOM 0 HB1 ALA A 204 -31.792 4.283 -8.588 1.00 0.00 H new ATOM 0 HB2 ALA A 204 -31.290 2.775 -9.388 1.00 0.00 H new ATOM 0 HB3 ALA A 204 -30.538 3.259 -7.849 1.00 0.00 H new ATOM 828 N GLY A 205 -28.660 5.391 -7.685 1.00 0.00 N ATOM 829 CA GLY A 205 -28.194 6.505 -6.862 1.00 0.00 C ATOM 830 C GLY A 205 -26.995 7.210 -7.470 1.00 0.00 C ATOM 831 O GLY A 205 -26.814 8.415 -7.288 1.00 0.00 O ATOM 0 H GLY A 205 -28.363 4.467 -7.370 1.00 0.00 H new ATOM 0 HA2 GLY A 205 -29.005 7.221 -6.731 1.00 0.00 H new ATOM 0 HA3 GLY A 205 -27.931 6.136 -5.871 1.00 0.00 H new ATOM 835 N TRP A 206 -26.195 6.459 -8.221 1.00 0.00 N ATOM 836 CA TRP A 206 -25.013 6.957 -8.937 1.00 0.00 C ATOM 837 C TRP A 206 -25.392 8.175 -9.777 1.00 0.00 C ATOM 838 O TRP A 206 -24.829 9.252 -9.648 1.00 0.00 O ATOM 839 CB TRP A 206 -24.597 5.831 -9.884 1.00 0.00 C ATOM 840 CG TRP A 206 -23.189 5.440 -9.980 1.00 0.00 C ATOM 841 CD1 TRP A 206 -22.632 4.312 -9.485 1.00 0.00 C ATOM 842 CD2 TRP A 206 -22.133 6.098 -10.700 1.00 0.00 C ATOM 843 NE1 TRP A 206 -21.325 4.199 -9.838 1.00 0.00 N ATOM 844 CE2 TRP A 206 -20.984 5.264 -10.613 1.00 0.00 C ATOM 845 CE3 TRP A 206 -22.040 7.308 -11.417 1.00 0.00 C ATOM 846 CZ2 TRP A 206 -19.782 5.572 -11.256 1.00 0.00 C ATOM 847 CZ3 TRP A 206 -20.818 7.644 -12.033 1.00 0.00 C ATOM 848 CH2 TRP A 206 -19.705 6.755 -11.952 1.00 0.00 C ATOM 0 H TRP A 206 -26.350 5.460 -8.355 1.00 0.00 H new ATOM 0 HA TRP A 206 -24.220 7.239 -8.244 1.00 0.00 H new ATOM 0 HB2 TRP A 206 -25.162 4.943 -9.600 1.00 0.00 H new ATOM 0 HB3 TRP A 206 -24.925 6.111 -10.885 1.00 0.00 H new ATOM 0 HD1 TRP A 206 -23.161 3.589 -8.882 1.00 0.00 H new ATOM 0 HE1 TRP A 206 -20.701 3.439 -9.566 1.00 0.00 H new ATOM 0 HE3 TRP A 206 -22.892 7.967 -11.493 1.00 0.00 H new ATOM 0 HZ2 TRP A 206 -18.938 4.900 -11.208 1.00 0.00 H new ATOM 0 HZ3 TRP A 206 -20.724 8.577 -12.568 1.00 0.00 H new ATOM 0 HH2 TRP A 206 -18.782 7.017 -12.448 1.00 0.00 H new ATOM 859 N LYS A 207 -26.380 7.997 -10.646 1.00 0.00 N ATOM 860 CA LYS A 207 -26.791 9.067 -11.542 1.00 0.00 C ATOM 861 C LYS A 207 -27.622 10.130 -10.834 1.00 0.00 C ATOM 862 O LYS A 207 -27.570 11.297 -11.199 1.00 0.00 O ATOM 863 CB LYS A 207 -27.528 8.485 -12.759 1.00 0.00 C ATOM 864 CG LYS A 207 -28.843 7.777 -12.449 1.00 0.00 C ATOM 865 CD LYS A 207 -29.226 6.827 -13.573 1.00 0.00 C ATOM 866 CE LYS A 207 -30.505 6.061 -13.240 1.00 0.00 C ATOM 867 NZ LYS A 207 -30.830 5.028 -14.303 1.00 0.00 N ATOM 0 H LYS A 207 -26.906 7.129 -10.748 1.00 0.00 H new ATOM 0 HA LYS A 207 -25.891 9.572 -11.892 1.00 0.00 H new ATOM 0 HB2 LYS A 207 -27.727 9.293 -13.463 1.00 0.00 H new ATOM 0 HB3 LYS A 207 -26.865 7.781 -13.261 1.00 0.00 H new ATOM 0 HG2 LYS A 207 -28.751 7.223 -11.515 1.00 0.00 H new ATOM 0 HG3 LYS A 207 -29.633 8.514 -12.306 1.00 0.00 H new ATOM 0 HD2 LYS A 207 -29.366 7.390 -14.496 1.00 0.00 H new ATOM 0 HD3 LYS A 207 -28.413 6.123 -13.750 1.00 0.00 H new ATOM 0 HE2 LYS A 207 -30.393 5.568 -12.274 1.00 0.00 H new ATOM 0 HE3 LYS A 207 -31.335 6.761 -13.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 -31.704 4.527 -14.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 -30.961 5.502 -15.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 -30.048 4.346 -14.375 1.00 0.00 H new ATOM 881 N ASN A 208 -28.398 9.745 -9.827 1.00 0.00 N ATOM 882 CA ASN A 208 -29.266 10.700 -9.153 1.00 0.00 C ATOM 883 C ASN A 208 -28.472 11.726 -8.364 1.00 0.00 C ATOM 884 O ASN A 208 -28.820 12.896 -8.355 1.00 0.00 O ATOM 885 CB ASN A 208 -30.247 9.977 -8.229 1.00 0.00 C ATOM 886 CG ASN A 208 -31.410 10.871 -7.825 1.00 0.00 C ATOM 887 OD1 ASN A 208 -32.034 11.493 -8.673 1.00 0.00 O ATOM 888 ND2 ASN A 208 -31.690 10.940 -6.543 1.00 0.00 N ATOM 0 H ASN A 208 -28.444 8.793 -9.464 1.00 0.00 H new ATOM 0 HA ASN A 208 -29.824 11.229 -9.925 1.00 0.00 H new ATOM 0 HB2 ASN A 208 -30.630 9.088 -8.730 1.00 0.00 H new ATOM 0 HB3 ASN A 208 -29.722 9.638 -7.336 1.00 0.00 H new ATOM 0 HD21 ASN A 208 -32.456 11.531 -6.219 1.00 0.00 H new ATOM 0 HD22 ASN A 208 -31.142 10.403 -5.872 1.00 0.00 H new ATOM 895 N SER A 209 -27.410 11.309 -7.706 1.00 0.00 N ATOM 896 CA SER A 209 -26.585 12.232 -6.930 1.00 0.00 C ATOM 897 C SER A 209 -25.860 13.232 -7.839 1.00 0.00 C ATOM 898 O SER A 209 -25.748 14.417 -7.521 1.00 0.00 O ATOM 899 CB SER A 209 -25.572 11.438 -6.120 1.00 0.00 C ATOM 900 OG SER A 209 -24.967 10.456 -6.938 1.00 0.00 O ATOM 0 H SER A 209 -27.092 10.340 -7.689 1.00 0.00 H new ATOM 0 HA SER A 209 -27.234 12.799 -6.262 1.00 0.00 H new ATOM 0 HB2 SER A 209 -24.812 12.106 -5.716 1.00 0.00 H new ATOM 0 HB3 SER A 209 -26.064 10.964 -5.270 1.00 0.00 H new ATOM 0 HG SER A 209 -24.009 10.407 -6.737 1.00 0.00 H new ATOM 906 N ILE A 210 -25.388 12.764 -8.983 1.00 0.00 N ATOM 907 CA ILE A 210 -24.746 13.654 -9.953 1.00 0.00 C ATOM 908 C ILE A 210 -25.800 14.642 -10.478 1.00 0.00 C ATOM 909 O ILE A 210 -25.533 15.843 -10.594 1.00 0.00 O ATOM 910 CB ILE A 210 -24.101 12.860 -11.124 1.00 0.00 C ATOM 911 CG1 ILE A 210 -22.936 12.016 -10.573 1.00 0.00 C ATOM 912 CG2 ILE A 210 -23.617 13.812 -12.255 1.00 0.00 C ATOM 913 CD1 ILE A 210 -22.379 10.988 -11.532 1.00 0.00 C ATOM 0 H ILE A 210 -25.433 11.785 -9.266 1.00 0.00 H new ATOM 0 HA ILE A 210 -23.938 14.196 -9.461 1.00 0.00 H new ATOM 0 HB ILE A 210 -24.849 12.201 -11.564 1.00 0.00 H new ATOM 0 HG12 ILE A 210 -22.130 12.687 -10.276 1.00 0.00 H new ATOM 0 HG13 ILE A 210 -23.273 11.504 -9.672 1.00 0.00 H new ATOM 0 HG21 ILE A 210 -23.171 13.225 -13.058 1.00 0.00 H new ATOM 0 HG22 ILE A 210 -24.465 14.375 -12.644 1.00 0.00 H new ATOM 0 HG23 ILE A 210 -22.875 14.504 -11.856 1.00 0.00 H new ATOM 0 HD11 ILE A 210 -21.564 10.446 -11.052 1.00 0.00 H new ATOM 0 HD12 ILE A 210 -23.166 10.287 -11.811 1.00 0.00 H new ATOM 0 HD13 ILE A 210 -22.005 11.489 -12.425 1.00 0.00 H new ATOM 925 N ARG A 211 -27.001 14.149 -10.769 1.00 0.00 N ATOM 926 CA ARG A 211 -28.077 15.002 -11.286 1.00 0.00 C ATOM 927 C ARG A 211 -28.469 16.063 -10.277 1.00 0.00 C ATOM 928 O ARG A 211 -28.746 17.188 -10.667 1.00 0.00 O ATOM 929 CB ARG A 211 -29.303 14.183 -11.642 1.00 0.00 C ATOM 930 CG ARG A 211 -29.187 13.526 -13.001 1.00 0.00 C ATOM 931 CD ARG A 211 -30.280 12.497 -13.181 1.00 0.00 C ATOM 932 NE ARG A 211 -31.626 13.112 -13.131 1.00 0.00 N ATOM 933 CZ ARG A 211 -32.284 13.628 -14.169 1.00 0.00 C ATOM 934 NH1 ARG A 211 -31.781 13.638 -15.379 1.00 0.00 N ATOM 935 NH2 ARG A 211 -33.466 14.145 -13.990 1.00 0.00 N ATOM 0 H ARG A 211 -27.257 13.168 -10.658 1.00 0.00 H new ATOM 0 HA ARG A 211 -27.694 15.485 -12.185 1.00 0.00 H new ATOM 0 HB2 ARG A 211 -29.456 13.416 -10.883 1.00 0.00 H new ATOM 0 HB3 ARG A 211 -30.183 14.826 -11.627 1.00 0.00 H new ATOM 0 HG2 ARG A 211 -29.256 14.281 -13.784 1.00 0.00 H new ATOM 0 HG3 ARG A 211 -28.211 13.051 -13.101 1.00 0.00 H new ATOM 0 HD2 ARG A 211 -30.148 11.989 -14.136 1.00 0.00 H new ATOM 0 HD3 ARG A 211 -30.197 11.739 -12.402 1.00 0.00 H new ATOM 0 HE ARG A 211 -32.090 13.144 -12.223 1.00 0.00 H new ATOM 0 HH11 ARG A 211 -30.857 13.242 -15.550 1.00 0.00 H new ATOM 0 HH12 ARG A 211 -32.314 14.042 -16.149 1.00 0.00 H new ATOM 0 HH21 ARG A 211 -33.883 14.154 -13.059 1.00 0.00 H new ATOM 0 HH22 ARG A 211 -33.974 14.541 -14.781 1.00 0.00 H new ATOM 949 N HIS A 212 -28.479 15.718 -9.000 1.00 0.00 N ATOM 950 CA HIS A 212 -28.809 16.686 -7.953 1.00 0.00 C ATOM 951 C HIS A 212 -27.795 17.829 -7.985 1.00 0.00 C ATOM 952 O HIS A 212 -28.173 18.983 -8.021 1.00 0.00 O ATOM 953 CB HIS A 212 -28.794 15.994 -6.575 1.00 0.00 C ATOM 954 CG HIS A 212 -29.345 16.827 -5.454 1.00 0.00 C ATOM 955 ND1 HIS A 212 -29.798 16.311 -4.263 1.00 0.00 N ATOM 956 CD2 HIS A 212 -29.522 18.180 -5.341 1.00 0.00 C ATOM 957 CE1 HIS A 212 -30.218 17.322 -3.505 1.00 0.00 C ATOM 958 NE2 HIS A 212 -30.069 18.477 -4.114 1.00 0.00 N ATOM 0 H HIS A 212 -28.264 14.781 -8.659 1.00 0.00 H new ATOM 0 HA HIS A 212 -29.807 17.088 -8.128 1.00 0.00 H new ATOM 0 HB2 HIS A 212 -29.368 15.070 -6.640 1.00 0.00 H new ATOM 0 HB3 HIS A 212 -27.768 15.715 -6.334 1.00 0.00 H new ATOM 0 HD2 HIS A 212 -29.270 18.905 -6.101 1.00 0.00 H new ATOM 0 HE1 HIS A 212 -30.630 17.207 -2.513 1.00 0.00 H new ATOM 0 HE2 HIS A 212 -30.309 19.400 -3.753 1.00 0.00 H new ATOM 966 N ASN A 213 -26.512 17.496 -7.983 1.00 0.00 N ATOM 967 CA ASN A 213 -25.457 18.510 -8.001 1.00 0.00 C ATOM 968 C ASN A 213 -25.509 19.383 -9.266 1.00 0.00 C ATOM 969 O ASN A 213 -25.305 20.591 -9.195 1.00 0.00 O ATOM 970 CB ASN A 213 -24.090 17.831 -7.889 1.00 0.00 C ATOM 971 CG ASN A 213 -23.731 17.473 -6.457 1.00 0.00 C ATOM 972 OD1 ASN A 213 -23.089 18.240 -5.761 1.00 0.00 O ATOM 973 ND2 ASN A 213 -24.148 16.315 -6.019 1.00 0.00 N ATOM 0 H ASN A 213 -26.173 16.534 -7.969 1.00 0.00 H new ATOM 0 HA ASN A 213 -25.617 19.169 -7.148 1.00 0.00 H new ATOM 0 HB2 ASN A 213 -24.087 16.927 -8.497 1.00 0.00 H new ATOM 0 HB3 ASN A 213 -23.325 18.492 -8.297 1.00 0.00 H new ATOM 0 HD21 ASN A 213 -23.938 16.026 -5.064 1.00 0.00 H new ATOM 0 HD22 ASN A 213 -24.683 15.700 -6.632 1.00 0.00 H new ATOM 980 N LEU A 214 -25.806 18.779 -10.412 1.00 0.00 N ATOM 981 CA LEU A 214 -25.939 19.527 -11.667 1.00 0.00 C ATOM 982 C LEU A 214 -27.155 20.451 -11.652 1.00 0.00 C ATOM 983 O LEU A 214 -27.097 21.566 -12.167 1.00 0.00 O ATOM 984 CB LEU A 214 -26.069 18.550 -12.842 1.00 0.00 C ATOM 985 CG LEU A 214 -24.804 17.775 -13.254 1.00 0.00 C ATOM 986 CD1 LEU A 214 -25.184 16.734 -14.308 1.00 0.00 C ATOM 987 CD2 LEU A 214 -23.737 18.707 -13.812 1.00 0.00 C ATOM 0 H LEU A 214 -25.960 17.775 -10.502 1.00 0.00 H new ATOM 0 HA LEU A 214 -25.045 20.140 -11.779 1.00 0.00 H new ATOM 0 HB2 LEU A 214 -26.844 17.825 -12.595 1.00 0.00 H new ATOM 0 HB3 LEU A 214 -26.421 19.109 -13.709 1.00 0.00 H new ATOM 0 HG LEU A 214 -24.390 17.288 -12.371 1.00 0.00 H new ATOM 0 HD11 LEU A 214 -24.295 16.179 -14.608 1.00 0.00 H new ATOM 0 HD12 LEU A 214 -25.919 16.045 -13.891 1.00 0.00 H new ATOM 0 HD13 LEU A 214 -25.609 17.235 -15.178 1.00 0.00 H new ATOM 0 HD21 LEU A 214 -22.858 18.127 -14.093 1.00 0.00 H new ATOM 0 HD22 LEU A 214 -24.127 19.223 -14.690 1.00 0.00 H new ATOM 0 HD23 LEU A 214 -23.461 19.440 -13.054 1.00 0.00 H new ATOM 999 N SER A 215 -28.252 19.991 -11.062 1.00 0.00 N ATOM 1000 CA SER A 215 -29.501 20.749 -11.011 1.00 0.00 C ATOM 1001 C SER A 215 -29.397 22.044 -10.214 1.00 0.00 C ATOM 1002 O SER A 215 -30.274 22.894 -10.320 1.00 0.00 O ATOM 1003 CB SER A 215 -30.611 19.883 -10.412 1.00 0.00 C ATOM 1004 OG SER A 215 -31.864 20.517 -10.558 1.00 0.00 O ATOM 0 H SER A 215 -28.303 19.081 -10.604 1.00 0.00 H new ATOM 0 HA SER A 215 -29.732 21.024 -12.040 1.00 0.00 H new ATOM 0 HB2 SER A 215 -30.629 18.911 -10.905 1.00 0.00 H new ATOM 0 HB3 SER A 215 -30.409 19.701 -9.356 1.00 0.00 H new ATOM 0 HG SER A 215 -31.744 21.489 -10.525 1.00 0.00 H new ATOM 1010 N LEU A 216 -28.336 22.196 -9.431 1.00 0.00 N ATOM 1011 CA LEU A 216 -28.133 23.426 -8.669 1.00 0.00 C ATOM 1012 C LEU A 216 -27.792 24.571 -9.607 1.00 0.00 C ATOM 1013 O LEU A 216 -28.103 25.713 -9.317 1.00 0.00 O ATOM 1014 CB LEU A 216 -26.997 23.250 -7.650 1.00 0.00 C ATOM 1015 CG LEU A 216 -27.196 22.140 -6.603 1.00 0.00 C ATOM 1016 CD1 LEU A 216 -25.912 21.974 -5.768 1.00 0.00 C ATOM 1017 CD2 LEU A 216 -28.381 22.437 -5.675 1.00 0.00 C ATOM 0 H LEU A 216 -27.609 21.492 -9.306 1.00 0.00 H new ATOM 0 HA LEU A 216 -29.057 23.653 -8.136 1.00 0.00 H new ATOM 0 HB2 LEU A 216 -26.075 23.047 -8.195 1.00 0.00 H new ATOM 0 HB3 LEU A 216 -26.856 24.195 -7.126 1.00 0.00 H new ATOM 0 HG LEU A 216 -27.414 21.215 -7.137 1.00 0.00 H new ATOM 0 HD11 LEU A 216 -26.058 21.187 -5.028 1.00 0.00 H new ATOM 0 HD12 LEU A 216 -25.084 21.706 -6.424 1.00 0.00 H new ATOM 0 HD13 LEU A 216 -25.684 22.911 -5.260 1.00 0.00 H new ATOM 0 HD21 LEU A 216 -28.487 21.629 -4.951 1.00 0.00 H new ATOM 0 HD22 LEU A 216 -28.205 23.375 -5.149 1.00 0.00 H new ATOM 0 HD23 LEU A 216 -29.294 22.518 -6.265 1.00 0.00 H new ATOM 1029 N HIS A 217 -27.166 24.235 -10.729 1.00 0.00 N ATOM 1030 CA HIS A 217 -26.774 25.186 -11.798 1.00 0.00 C ATOM 1031 C HIS A 217 -25.877 26.372 -11.389 1.00 0.00 C ATOM 1032 O HIS A 217 -25.635 27.280 -12.171 1.00 0.00 O ATOM 1033 CB HIS A 217 -28.017 25.678 -12.564 1.00 0.00 C ATOM 1034 CG HIS A 217 -28.630 24.630 -13.439 1.00 0.00 C ATOM 1035 ND1 HIS A 217 -29.667 23.808 -13.066 1.00 0.00 N ATOM 1036 CD2 HIS A 217 -28.333 24.258 -14.716 1.00 0.00 C ATOM 1037 CE1 HIS A 217 -29.961 23.012 -14.095 1.00 0.00 C ATOM 1038 NE2 HIS A 217 -29.175 23.243 -15.131 1.00 0.00 N ATOM 0 H HIS A 217 -26.904 23.272 -10.939 1.00 0.00 H new ATOM 0 HA HIS A 217 -26.126 24.594 -12.445 1.00 0.00 H new ATOM 0 HB2 HIS A 217 -28.762 26.024 -11.848 1.00 0.00 H new ATOM 0 HB3 HIS A 217 -27.741 26.536 -13.177 1.00 0.00 H new ATOM 0 HD1 HIS A 217 -30.132 23.807 -12.158 1.00 0.00 H new ATOM 0 HD2 HIS A 217 -27.550 24.694 -15.319 1.00 0.00 H new ATOM 0 HE1 HIS A 217 -30.745 22.270 -14.083 1.00 0.00 H new ATOM 1046 N SER A 218 -25.377 26.359 -10.165 1.00 0.00 N ATOM 1047 CA SER A 218 -24.523 27.441 -9.677 1.00 0.00 C ATOM 1048 C SER A 218 -23.149 27.398 -10.345 1.00 0.00 C ATOM 1049 O SER A 218 -22.616 28.412 -10.798 1.00 0.00 O ATOM 1050 CB SER A 218 -24.364 27.282 -8.171 1.00 0.00 C ATOM 1051 OG SER A 218 -24.638 25.934 -7.812 1.00 0.00 O ATOM 0 H SER A 218 -25.544 25.615 -9.488 1.00 0.00 H new ATOM 0 HA SER A 218 -24.984 28.399 -9.917 1.00 0.00 H new ATOM 0 HB2 SER A 218 -23.352 27.553 -7.869 1.00 0.00 H new ATOM 0 HB3 SER A 218 -25.043 27.955 -7.648 1.00 0.00 H new ATOM 0 HG SER A 218 -24.535 25.826 -6.843 1.00 0.00 H new ATOM 1057 N LYS A 219 -22.573 26.202 -10.397 1.00 0.00 N ATOM 1058 CA LYS A 219 -21.258 26.012 -11.024 1.00 0.00 C ATOM 1059 C LYS A 219 -21.356 25.363 -12.378 1.00 0.00 C ATOM 1060 O LYS A 219 -20.422 25.446 -13.168 1.00 0.00 O ATOM 1061 CB LYS A 219 -20.363 25.139 -10.127 1.00 0.00 C ATOM 1062 CG LYS A 219 -19.144 25.887 -9.556 1.00 0.00 C ATOM 1063 CD LYS A 219 -17.848 25.533 -10.309 1.00 0.00 C ATOM 1064 CE LYS A 219 -17.579 26.468 -11.498 1.00 0.00 C ATOM 1065 NZ LYS A 219 -17.139 27.862 -11.082 1.00 0.00 N ATOM 0 H LYS A 219 -22.988 25.351 -10.017 1.00 0.00 H new ATOM 0 HA LYS A 219 -20.826 27.005 -11.149 1.00 0.00 H new ATOM 0 HB2 LYS A 219 -20.959 24.750 -9.302 1.00 0.00 H new ATOM 0 HB3 LYS A 219 -20.015 24.280 -10.701 1.00 0.00 H new ATOM 0 HG2 LYS A 219 -19.317 26.962 -9.616 1.00 0.00 H new ATOM 0 HG3 LYS A 219 -19.029 25.641 -8.500 1.00 0.00 H new ATOM 0 HD2 LYS A 219 -17.007 25.580 -9.618 1.00 0.00 H new ATOM 0 HD3 LYS A 219 -17.910 24.505 -10.667 1.00 0.00 H new ATOM 0 HE2 LYS A 219 -16.810 26.026 -12.131 1.00 0.00 H new ATOM 0 HE3 LYS A 219 -18.483 26.545 -12.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 219 -16.925 28.426 -11.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 219 -17.902 28.321 -10.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 219 -16.288 27.795 -10.488 1.00 0.00 H new ATOM 1079 N PHE A 220 -22.474 24.707 -12.645 1.00 0.00 N ATOM 1080 CA PHE A 220 -22.650 23.952 -13.876 1.00 0.00 C ATOM 1081 C PHE A 220 -23.734 24.565 -14.727 1.00 0.00 C ATOM 1082 O PHE A 220 -24.722 25.056 -14.211 1.00 0.00 O ATOM 1083 CB PHE A 220 -23.051 22.516 -13.540 1.00 0.00 C ATOM 1084 CG PHE A 220 -22.125 21.829 -12.579 1.00 0.00 C ATOM 1085 CD1 PHE A 220 -22.545 21.531 -11.260 1.00 0.00 C ATOM 1086 CD2 PHE A 220 -20.818 21.481 -12.975 1.00 0.00 C ATOM 1087 CE1 PHE A 220 -21.669 20.906 -10.341 1.00 0.00 C ATOM 1088 CE2 PHE A 220 -19.938 20.861 -12.054 1.00 0.00 C ATOM 1089 CZ PHE A 220 -20.366 20.581 -10.741 1.00 0.00 C ATOM 0 H PHE A 220 -23.280 24.682 -12.020 1.00 0.00 H new ATOM 0 HA PHE A 220 -21.709 23.968 -14.425 1.00 0.00 H new ATOM 0 HB2 PHE A 220 -24.056 22.520 -13.119 1.00 0.00 H new ATOM 0 HB3 PHE A 220 -23.094 21.937 -14.463 1.00 0.00 H new ATOM 0 HD1 PHE A 220 -23.548 21.784 -10.951 1.00 0.00 H new ATOM 0 HD2 PHE A 220 -20.487 21.687 -13.982 1.00 0.00 H new ATOM 0 HE1 PHE A 220 -22.002 20.681 -9.339 1.00 0.00 H new ATOM 0 HE2 PHE A 220 -18.935 20.602 -12.359 1.00 0.00 H new ATOM 0 HZ PHE A 220 -19.688 20.115 -10.041 1.00 0.00 H new ATOM 1099 N ILE A 221 -23.549 24.528 -16.031 1.00 0.00 N ATOM 1100 CA ILE A 221 -24.526 25.043 -16.976 1.00 0.00 C ATOM 1101 C ILE A 221 -24.754 23.910 -17.964 1.00 0.00 C ATOM 1102 O ILE A 221 -23.969 22.953 -18.007 1.00 0.00 O ATOM 1103 CB ILE A 221 -24.028 26.364 -17.648 1.00 0.00 C ATOM 1104 CG1 ILE A 221 -22.854 26.087 -18.598 1.00 0.00 C ATOM 1105 CG2 ILE A 221 -23.615 27.382 -16.556 1.00 0.00 C ATOM 1106 CD1 ILE A 221 -22.546 27.232 -19.558 1.00 0.00 C ATOM 0 H ILE A 221 -22.714 24.139 -16.469 1.00 0.00 H new ATOM 0 HA ILE A 221 -25.463 25.327 -16.497 1.00 0.00 H new ATOM 0 HB ILE A 221 -24.842 26.785 -18.238 1.00 0.00 H new ATOM 0 HG12 ILE A 221 -21.964 25.874 -18.006 1.00 0.00 H new ATOM 0 HG13 ILE A 221 -23.073 25.190 -19.178 1.00 0.00 H new ATOM 0 HG21 ILE A 221 -23.268 28.301 -17.028 1.00 0.00 H new ATOM 0 HG22 ILE A 221 -24.473 27.602 -15.920 1.00 0.00 H new ATOM 0 HG23 ILE A 221 -22.813 26.960 -15.950 1.00 0.00 H new ATOM 0 HD11 ILE A 221 -21.705 26.957 -20.194 1.00 0.00 H new ATOM 0 HD12 ILE A 221 -23.420 27.432 -20.178 1.00 0.00 H new ATOM 0 HD13 ILE A 221 -22.293 28.126 -18.988 1.00 0.00 H new ATOM 1118 N ARG A 222 -25.816 23.999 -18.752 1.00 0.00 N ATOM 1119 CA ARG A 222 -26.168 22.944 -19.723 1.00 0.00 C ATOM 1120 C ARG A 222 -26.111 23.537 -21.125 1.00 0.00 C ATOM 1121 O ARG A 222 -26.566 24.658 -21.334 1.00 0.00 O ATOM 1122 CB ARG A 222 -27.574 22.422 -19.421 1.00 0.00 C ATOM 1123 CG ARG A 222 -27.957 21.149 -20.178 1.00 0.00 C ATOM 1124 CD ARG A 222 -29.387 20.755 -19.823 1.00 0.00 C ATOM 1125 NE ARG A 222 -30.346 21.784 -20.261 1.00 0.00 N ATOM 1126 CZ ARG A 222 -31.641 21.827 -19.939 1.00 0.00 C ATOM 1127 NH1 ARG A 222 -32.198 20.927 -19.163 1.00 0.00 N ATOM 1128 NH2 ARG A 222 -32.382 22.795 -20.410 1.00 0.00 N ATOM 0 H ARG A 222 -26.459 24.791 -18.746 1.00 0.00 H new ATOM 0 HA ARG A 222 -25.467 22.113 -19.652 1.00 0.00 H new ATOM 0 HB2 ARG A 222 -27.654 22.231 -18.351 1.00 0.00 H new ATOM 0 HB3 ARG A 222 -28.296 23.202 -19.660 1.00 0.00 H new ATOM 0 HG2 ARG A 222 -27.870 21.312 -21.252 1.00 0.00 H new ATOM 0 HG3 ARG A 222 -27.272 20.341 -19.922 1.00 0.00 H new ATOM 0 HD2 ARG A 222 -29.632 19.802 -20.292 1.00 0.00 H new ATOM 0 HD3 ARG A 222 -29.471 20.611 -18.746 1.00 0.00 H new ATOM 0 HE ARG A 222 -29.990 22.527 -20.862 1.00 0.00 H new ATOM 0 HH11 ARG A 222 -31.638 20.163 -18.785 1.00 0.00 H new ATOM 0 HH12 ARG A 222 -33.191 20.992 -18.938 1.00 0.00 H new ATOM 0 HH21 ARG A 222 -31.969 23.505 -21.015 1.00 0.00 H new ATOM 0 HH22 ARG A 222 -33.373 22.841 -20.172 1.00 0.00 H new ATOM 1142 N VAL A 223 -25.556 22.799 -22.082 1.00 0.00 N ATOM 1143 CA VAL A 223 -25.400 23.295 -23.459 1.00 0.00 C ATOM 1144 C VAL A 223 -26.007 22.346 -24.478 1.00 0.00 C ATOM 1145 O VAL A 223 -25.928 21.123 -24.337 1.00 0.00 O ATOM 1146 CB VAL A 223 -23.889 23.454 -23.873 1.00 0.00 C ATOM 1147 CG1 VAL A 223 -23.712 24.584 -24.888 1.00 0.00 C ATOM 1148 CG2 VAL A 223 -23.003 23.690 -22.668 1.00 0.00 C ATOM 0 H VAL A 223 -25.204 21.853 -21.936 1.00 0.00 H new ATOM 0 HA VAL A 223 -25.908 24.259 -23.461 1.00 0.00 H new ATOM 0 HB VAL A 223 -23.584 22.517 -24.339 1.00 0.00 H new ATOM 0 HG11 VAL A 223 -22.659 24.671 -25.156 1.00 0.00 H new ATOM 0 HG12 VAL A 223 -24.297 24.365 -25.782 1.00 0.00 H new ATOM 0 HG13 VAL A 223 -24.054 25.522 -24.451 1.00 0.00 H new ATOM 0 HG21 VAL A 223 -21.968 23.795 -22.993 1.00 0.00 H new ATOM 0 HG22 VAL A 223 -23.317 24.601 -22.158 1.00 0.00 H new ATOM 0 HG23 VAL A 223 -23.085 22.845 -21.985 1.00 0.00 H new ATOM 1158 N GLN A 224 -26.596 22.931 -25.511 1.00 0.00 N ATOM 1159 CA GLN A 224 -27.122 22.180 -26.643 1.00 0.00 C ATOM 1160 C GLN A 224 -25.917 21.763 -27.476 1.00 0.00 C ATOM 1161 O GLN A 224 -24.794 22.208 -27.227 1.00 0.00 O ATOM 1162 CB GLN A 224 -28.050 23.055 -27.485 1.00 0.00 C ATOM 1163 CG GLN A 224 -29.479 22.505 -27.616 1.00 0.00 C ATOM 1164 CD GLN A 224 -29.602 21.351 -28.614 1.00 0.00 C ATOM 1165 OE1 GLN A 224 -28.884 20.359 -28.537 1.00 0.00 O ATOM 1166 NE2 GLN A 224 -30.525 21.480 -29.546 1.00 0.00 N ATOM 0 H GLN A 224 -26.723 23.940 -25.589 1.00 0.00 H new ATOM 0 HA GLN A 224 -27.698 21.319 -26.304 1.00 0.00 H new ATOM 0 HB2 GLN A 224 -28.094 24.050 -27.043 1.00 0.00 H new ATOM 0 HB3 GLN A 224 -27.622 23.167 -28.481 1.00 0.00 H new ATOM 0 HG2 GLN A 224 -29.820 22.166 -26.638 1.00 0.00 H new ATOM 0 HG3 GLN A 224 -30.143 23.313 -27.923 1.00 0.00 H new ATOM 0 HE21 GLN A 224 -31.103 22.320 -29.578 1.00 0.00 H new ATOM 0 HE22 GLN A 224 -30.661 20.740 -30.235 1.00 0.00 H new ATOM 1265 N SER A 232 -27.139 16.120 -24.006 1.00 0.00 N ATOM 1266 CA SER A 232 -26.761 17.500 -23.705 1.00 0.00 C ATOM 1267 C SER A 232 -25.420 17.595 -22.974 1.00 0.00 C ATOM 1268 O SER A 232 -25.051 16.701 -22.197 1.00 0.00 O ATOM 1269 CB SER A 232 -27.840 18.148 -22.835 1.00 0.00 C ATOM 1270 OG SER A 232 -29.128 17.951 -23.391 1.00 0.00 O ATOM 0 HA SER A 232 -26.662 18.020 -24.658 1.00 0.00 H new ATOM 0 HB2 SER A 232 -27.805 17.725 -21.831 1.00 0.00 H new ATOM 0 HB3 SER A 232 -27.641 19.215 -22.738 1.00 0.00 H new ATOM 0 HG SER A 232 -29.112 17.172 -23.986 1.00 0.00 H new ATOM 1276 N TRP A 233 -24.709 18.685 -23.216 1.00 0.00 N ATOM 1277 CA TRP A 233 -23.439 18.927 -22.546 1.00 0.00 C ATOM 1278 C TRP A 233 -23.712 19.542 -21.201 1.00 0.00 C ATOM 1279 O TRP A 233 -24.703 20.259 -21.024 1.00 0.00 O ATOM 1280 CB TRP A 233 -22.608 19.950 -23.301 1.00 0.00 C ATOM 1281 CG TRP A 233 -22.116 19.519 -24.607 1.00 0.00 C ATOM 1282 CD1 TRP A 233 -22.476 20.007 -25.817 1.00 0.00 C ATOM 1283 CD2 TRP A 233 -21.121 18.515 -24.878 1.00 0.00 C ATOM 1284 NE1 TRP A 233 -21.790 19.417 -26.819 1.00 0.00 N ATOM 1285 CE2 TRP A 233 -20.950 18.476 -26.297 1.00 0.00 C ATOM 1286 CE3 TRP A 233 -20.348 17.656 -24.075 1.00 0.00 C ATOM 1287 CZ2 TRP A 233 -20.049 17.602 -26.922 1.00 0.00 C ATOM 1288 CZ3 TRP A 233 -19.425 16.780 -24.698 1.00 0.00 C ATOM 1289 CH2 TRP A 233 -19.286 16.765 -26.123 1.00 0.00 C ATOM 0 H TRP A 233 -24.988 19.416 -23.870 1.00 0.00 H new ATOM 0 HA TRP A 233 -22.913 17.975 -22.481 1.00 0.00 H new ATOM 0 HB2 TRP A 233 -23.207 20.850 -23.437 1.00 0.00 H new ATOM 0 HB3 TRP A 233 -21.754 20.226 -22.683 1.00 0.00 H new ATOM 0 HD1 TRP A 233 -23.221 20.775 -25.963 1.00 0.00 H new ATOM 0 HE1 TRP A 233 -21.884 19.639 -27.810 1.00 0.00 H new ATOM 0 HE3 TRP A 233 -20.457 17.664 -23.001 1.00 0.00 H new ATOM 0 HZ2 TRP A 233 -19.952 17.582 -27.997 1.00 0.00 H new ATOM 0 HZ3 TRP A 233 -18.822 16.119 -24.094 1.00 0.00 H new ATOM 0 HH2 TRP A 233 -18.577 16.092 -26.582 1.00 0.00 H new ATOM 1300 N TRP A 234 -22.800 19.290 -20.282 1.00 0.00 N ATOM 1301 CA TRP A 234 -22.789 19.897 -18.976 1.00 0.00 C ATOM 1302 C TRP A 234 -21.375 20.437 -18.864 1.00 0.00 C ATOM 1303 O TRP A 234 -20.402 19.751 -19.213 1.00 0.00 O ATOM 1304 CB TRP A 234 -23.074 18.858 -17.901 1.00 0.00 C ATOM 1305 CG TRP A 234 -24.422 18.235 -18.050 1.00 0.00 C ATOM 1306 CD1 TRP A 234 -24.723 17.126 -18.768 1.00 0.00 C ATOM 1307 CD2 TRP A 234 -25.678 18.699 -17.504 1.00 0.00 C ATOM 1308 NE1 TRP A 234 -26.055 16.842 -18.714 1.00 0.00 N ATOM 1309 CE2 TRP A 234 -26.682 17.777 -17.937 1.00 0.00 C ATOM 1310 CE3 TRP A 234 -26.066 19.792 -16.700 1.00 0.00 C ATOM 1311 CZ2 TRP A 234 -28.037 17.903 -17.579 1.00 0.00 C ATOM 1312 CZ3 TRP A 234 -27.431 19.932 -16.341 1.00 0.00 C ATOM 1313 CH2 TRP A 234 -28.402 18.971 -16.779 1.00 0.00 C ATOM 0 H TRP A 234 -22.029 18.640 -20.432 1.00 0.00 H new ATOM 0 HA TRP A 234 -23.548 20.668 -18.845 1.00 0.00 H new ATOM 0 HB2 TRP A 234 -22.312 18.080 -17.941 1.00 0.00 H new ATOM 0 HB3 TRP A 234 -23.000 19.326 -16.919 1.00 0.00 H new ATOM 0 HD1 TRP A 234 -23.998 16.541 -19.314 1.00 0.00 H new ATOM 0 HE1 TRP A 234 -26.512 16.057 -19.179 1.00 0.00 H new ATOM 0 HE3 TRP A 234 -25.334 20.511 -16.363 1.00 0.00 H new ATOM 0 HZ2 TRP A 234 -28.771 17.187 -17.919 1.00 0.00 H new ATOM 0 HZ3 TRP A 234 -27.742 20.769 -15.733 1.00 0.00 H new ATOM 0 HH2 TRP A 234 -29.434 19.083 -16.480 1.00 0.00 H new ATOM 1324 N MET A 235 -21.256 21.669 -18.420 1.00 0.00 N ATOM 1325 CA MET A 235 -19.950 22.292 -18.321 1.00 0.00 C ATOM 1326 C MET A 235 -19.968 23.331 -17.232 1.00 0.00 C ATOM 1327 O MET A 235 -21.022 23.617 -16.685 1.00 0.00 O ATOM 1328 CB MET A 235 -19.541 22.946 -19.643 1.00 0.00 C ATOM 1329 CG MET A 235 -20.406 24.104 -20.094 1.00 0.00 C ATOM 1330 SD MET A 235 -19.741 24.890 -21.593 1.00 0.00 S ATOM 1331 CE MET A 235 -18.364 25.826 -20.875 1.00 0.00 C ATOM 0 H MET A 235 -22.036 22.255 -18.124 1.00 0.00 H new ATOM 0 HA MET A 235 -19.222 21.516 -18.086 1.00 0.00 H new ATOM 0 HB2 MET A 235 -18.513 23.297 -19.551 1.00 0.00 H new ATOM 0 HB3 MET A 235 -19.549 22.184 -20.423 1.00 0.00 H new ATOM 0 HG2 MET A 235 -21.419 23.749 -20.287 1.00 0.00 H new ATOM 0 HG3 MET A 235 -20.473 24.842 -19.295 1.00 0.00 H new ATOM 0 HE1 MET A 235 -17.888 26.426 -21.651 1.00 0.00 H new ATOM 0 HE2 MET A 235 -18.740 26.481 -20.089 1.00 0.00 H new ATOM 0 HE3 MET A 235 -17.635 25.134 -20.453 1.00 0.00 H new ATOM 1341 N LEU A 236 -18.815 23.886 -16.897 1.00 0.00 N ATOM 1342 CA LEU A 236 -18.729 24.889 -15.852 1.00 0.00 C ATOM 1343 C LEU A 236 -19.182 26.219 -16.433 1.00 0.00 C ATOM 1344 O LEU A 236 -19.039 26.448 -17.629 1.00 0.00 O ATOM 1345 CB LEU A 236 -17.287 24.992 -15.344 1.00 0.00 C ATOM 1346 CG LEU A 236 -16.654 23.648 -14.928 1.00 0.00 C ATOM 1347 CD1 LEU A 236 -15.211 23.858 -14.526 1.00 0.00 C ATOM 1348 CD2 LEU A 236 -17.399 22.939 -13.799 1.00 0.00 C ATOM 0 H LEU A 236 -17.923 23.657 -17.336 1.00 0.00 H new ATOM 0 HA LEU A 236 -19.366 24.615 -15.011 1.00 0.00 H new ATOM 0 HB2 LEU A 236 -16.672 25.442 -16.124 1.00 0.00 H new ATOM 0 HB3 LEU A 236 -17.264 25.669 -14.490 1.00 0.00 H new ATOM 0 HG LEU A 236 -16.720 23.000 -15.802 1.00 0.00 H new ATOM 0 HD11 LEU A 236 -14.772 22.904 -14.234 1.00 0.00 H new ATOM 0 HD12 LEU A 236 -14.655 24.270 -15.368 1.00 0.00 H new ATOM 0 HD13 LEU A 236 -15.164 24.551 -13.686 1.00 0.00 H new ATOM 0 HD21 LEU A 236 -16.895 22.002 -13.562 1.00 0.00 H new ATOM 0 HD22 LEU A 236 -17.413 23.577 -12.915 1.00 0.00 H new ATOM 0 HD23 LEU A 236 -18.422 22.731 -14.112 1.00 0.00 H new ATOM 1360 N ASN A 237 -19.717 27.090 -15.594 1.00 0.00 N ATOM 1361 CA ASN A 237 -20.136 28.407 -16.065 1.00 0.00 C ATOM 1362 C ASN A 237 -18.862 29.161 -16.523 1.00 0.00 C ATOM 1363 O ASN A 237 -17.923 29.324 -15.728 1.00 0.00 O ATOM 1364 CB ASN A 237 -20.875 29.162 -14.948 1.00 0.00 C ATOM 1365 CG ASN A 237 -21.470 30.480 -15.421 1.00 0.00 C ATOM 1366 OD1 ASN A 237 -20.933 31.124 -16.302 1.00 0.00 O ATOM 1367 ND2 ASN A 237 -22.575 30.871 -14.847 1.00 0.00 N ATOM 0 H ASN A 237 -19.871 26.918 -14.601 1.00 0.00 H new ATOM 0 HA ASN A 237 -20.832 28.323 -16.900 1.00 0.00 H new ATOM 0 HB2 ASN A 237 -21.671 28.530 -14.554 1.00 0.00 H new ATOM 0 HB3 ASN A 237 -20.184 29.354 -14.127 1.00 0.00 H new ATOM 0 HD21 ASN A 237 -23.018 31.744 -15.134 1.00 0.00 H new ATOM 0 HD22 ASN A 237 -22.996 30.304 -14.111 1.00 0.00 H new ATOM 1374 N PRO A 238 -18.810 29.616 -17.799 1.00 0.00 N ATOM 1375 CA PRO A 238 -17.602 30.287 -18.310 1.00 0.00 C ATOM 1376 C PRO A 238 -17.233 31.604 -17.637 1.00 0.00 C ATOM 1377 O PRO A 238 -16.071 31.960 -17.579 1.00 0.00 O ATOM 1378 CB PRO A 238 -17.942 30.555 -19.774 1.00 0.00 C ATOM 1379 CG PRO A 238 -19.420 30.575 -19.829 1.00 0.00 C ATOM 1380 CD PRO A 238 -19.841 29.527 -18.855 1.00 0.00 C ATOM 0 HA PRO A 238 -16.734 29.654 -18.125 1.00 0.00 H new ATOM 0 HB2 PRO A 238 -17.522 31.504 -20.109 1.00 0.00 H new ATOM 0 HB3 PRO A 238 -17.534 29.779 -20.422 1.00 0.00 H new ATOM 0 HG2 PRO A 238 -19.815 31.553 -19.555 1.00 0.00 H new ATOM 0 HG3 PRO A 238 -19.783 30.354 -20.833 1.00 0.00 H new ATOM 0 HD2 PRO A 238 -20.839 29.720 -18.461 1.00 0.00 H new ATOM 0 HD3 PRO A 238 -19.865 28.538 -19.312 1.00 0.00 H new