USER MOD reduce.3.24.130724 H: found=0, std=0, add=593, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 594 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 220 SER OG : rot 120:sc= -0.863 USER MOD Single : A 221 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 222 THR OG1 : rot 180:sc= 0 USER MOD Single : A 227 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 228 ASN :FLIP amide:sc= -0.968 F(o=-1.9!,f=-0.97) USER MOD Single : A 233 THR OG1 : rot -66:sc= 0.404 USER MOD Single : A 239 GLN : amide:sc= -1.21 K(o=-1.2,f=-4.8!) USER MOD Single : A 241 THR OG1 : rot 72:sc= 0.597 USER MOD Single : A 243 SER OG : rot 180:sc= 0 USER MOD Single : A 247 SER OG : rot 180:sc= 0 USER MOD Single : A 259 THR OG1 : rot 180:sc= 0 USER MOD Single : A 272 LYS NZ :NH3+ -156:sc= 1.28 (180deg=1.17) USER MOD Single : A 276 HIS : no HE2:sc= -3.22! C(o=-3.2!,f=-4.5!) USER MOD Single : A 279 TYR OH : rot 180:sc= 0 USER MOD Single : A 280 SER OG : rot 18:sc= 0.00259 USER MOD Single : A 281 LYS NZ :NH3+ 149:sc= -0.329 (180deg=-0.998) USER MOD Single : A 283 HIS : no HD1:sc= -9.11! C(o=-9.1!,f=-10!) USER MOD Single : A 284 HIS : no HD1:sc= -4.33! C(o=-4.3!,f=-5.6!) USER MOD Single : A 288 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 90 N SER A 220 -8.786 15.162 0.091 1.00 0.00 N ATOM 91 CA SER A 220 -7.587 15.013 -0.725 1.00 0.00 C ATOM 92 C SER A 220 -7.903 14.287 -2.029 1.00 0.00 C ATOM 93 O SER A 220 -8.820 13.468 -2.091 1.00 0.00 O ATOM 94 CB SER A 220 -6.509 14.250 0.048 1.00 0.00 C ATOM 95 OG SER A 220 -5.243 14.387 -0.573 1.00 0.00 O ATOM 0 HA SER A 220 -7.216 16.009 -0.965 1.00 0.00 H new ATOM 0 HB2 SER A 220 -6.458 14.623 1.071 1.00 0.00 H new ATOM 0 HB3 SER A 220 -6.777 13.195 0.106 1.00 0.00 H new ATOM 0 HG SER A 220 -4.616 14.808 0.052 1.00 0.00 H new ATOM 101 N LYS A 221 -7.137 14.595 -3.070 1.00 0.00 N ATOM 102 CA LYS A 221 -7.333 13.972 -4.374 1.00 0.00 C ATOM 103 C LYS A 221 -6.215 12.980 -4.677 1.00 0.00 C ATOM 104 O LYS A 221 -6.458 11.901 -5.219 1.00 0.00 O ATOM 105 CB LYS A 221 -7.391 15.041 -5.469 1.00 0.00 C ATOM 106 CG LYS A 221 -8.723 15.766 -5.541 1.00 0.00 C ATOM 107 CD LYS A 221 -8.564 17.173 -6.092 1.00 0.00 C ATOM 108 CE LYS A 221 -8.045 18.131 -5.031 1.00 0.00 C ATOM 109 NZ LYS A 221 -9.155 18.773 -4.274 1.00 0.00 N ATOM 0 H LYS A 221 -6.375 15.272 -3.036 1.00 0.00 H new ATOM 0 HA LYS A 221 -8.279 13.431 -4.352 1.00 0.00 H new ATOM 0 HB2 LYS A 221 -6.599 15.770 -5.296 1.00 0.00 H new ATOM 0 HB3 LYS A 221 -7.189 14.573 -6.433 1.00 0.00 H new ATOM 0 HG2 LYS A 221 -9.411 15.203 -6.172 1.00 0.00 H new ATOM 0 HG3 LYS A 221 -9.167 15.812 -4.547 1.00 0.00 H new ATOM 0 HD2 LYS A 221 -7.877 17.158 -6.938 1.00 0.00 H new ATOM 0 HD3 LYS A 221 -9.524 17.529 -6.467 1.00 0.00 H new ATOM 0 HE2 LYS A 221 -7.398 17.591 -4.339 1.00 0.00 H new ATOM 0 HE3 LYS A 221 -7.435 18.901 -5.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 221 -8.761 19.419 -3.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 221 -9.758 19.309 -4.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 221 -9.723 18.040 -3.802 1.00 0.00 H new ATOM 123 N THR A 222 -4.988 13.350 -4.322 1.00 0.00 N ATOM 124 CA THR A 222 -3.833 12.493 -4.555 1.00 0.00 C ATOM 125 C THR A 222 -3.495 11.676 -3.313 1.00 0.00 C ATOM 126 O THR A 222 -2.351 11.265 -3.120 1.00 0.00 O ATOM 127 CB THR A 222 -2.598 13.314 -4.967 1.00 0.00 C ATOM 128 OG1 THR A 222 -2.294 14.284 -3.958 1.00 0.00 O ATOM 129 CG2 THR A 222 -2.833 14.016 -6.296 1.00 0.00 C ATOM 0 H THR A 222 -4.769 14.239 -3.872 1.00 0.00 H new ATOM 0 HA THR A 222 -4.099 11.819 -5.369 1.00 0.00 H new ATOM 0 HB THR A 222 -1.757 12.630 -5.078 1.00 0.00 H new ATOM 0 HG1 THR A 222 -1.506 14.801 -4.228 1.00 0.00 H new ATOM 0 HG21 THR A 222 -1.946 14.590 -6.566 1.00 0.00 H new ATOM 0 HG22 THR A 222 -3.035 13.274 -7.069 1.00 0.00 H new ATOM 0 HG23 THR A 222 -3.687 14.688 -6.207 1.00 0.00 H new ATOM 137 N VAL A 223 -4.498 11.444 -2.472 1.00 0.00 N ATOM 138 CA VAL A 223 -4.307 10.675 -1.248 1.00 0.00 C ATOM 139 C VAL A 223 -5.476 9.727 -1.007 1.00 0.00 C ATOM 140 O VAL A 223 -6.632 10.150 -0.962 1.00 0.00 O ATOM 141 CB VAL A 223 -4.147 11.597 -0.024 1.00 0.00 C ATOM 142 CG1 VAL A 223 -3.952 10.776 1.241 1.00 0.00 C ATOM 143 CG2 VAL A 223 -2.985 12.558 -0.230 1.00 0.00 C ATOM 0 H VAL A 223 -5.451 11.778 -2.616 1.00 0.00 H new ATOM 0 HA VAL A 223 -3.393 10.095 -1.378 1.00 0.00 H new ATOM 0 HB VAL A 223 -5.059 12.184 0.089 1.00 0.00 H new ATOM 0 HG11 VAL A 223 -3.841 11.444 2.095 1.00 0.00 H new ATOM 0 HG12 VAL A 223 -4.818 10.132 1.394 1.00 0.00 H new ATOM 0 HG13 VAL A 223 -3.057 10.162 1.142 1.00 0.00 H new ATOM 0 HG21 VAL A 223 -2.886 13.202 0.644 1.00 0.00 H new ATOM 0 HG22 VAL A 223 -2.064 11.991 -0.369 1.00 0.00 H new ATOM 0 HG23 VAL A 223 -3.171 13.170 -1.112 1.00 0.00 H new ATOM 153 N ILE A 224 -5.168 8.444 -0.851 1.00 0.00 N ATOM 154 CA ILE A 224 -6.194 7.436 -0.613 1.00 0.00 C ATOM 155 C ILE A 224 -5.852 6.581 0.603 1.00 0.00 C ATOM 156 O ILE A 224 -4.688 6.260 0.843 1.00 0.00 O ATOM 157 CB ILE A 224 -6.377 6.519 -1.836 1.00 0.00 C ATOM 158 CG1 ILE A 224 -6.730 7.346 -3.074 1.00 0.00 C ATOM 159 CG2 ILE A 224 -7.454 5.479 -1.562 1.00 0.00 C ATOM 160 CD1 ILE A 224 -6.412 6.649 -4.378 1.00 0.00 C ATOM 0 H ILE A 224 -4.217 8.078 -0.885 1.00 0.00 H new ATOM 0 HA ILE A 224 -7.125 7.971 -0.428 1.00 0.00 H new ATOM 0 HB ILE A 224 -5.438 6.000 -2.026 1.00 0.00 H new ATOM 0 HG12 ILE A 224 -7.793 7.586 -3.050 1.00 0.00 H new ATOM 0 HG13 ILE A 224 -6.189 8.291 -3.036 1.00 0.00 H new ATOM 0 HG21 ILE A 224 -7.572 4.838 -2.436 1.00 0.00 H new ATOM 0 HG22 ILE A 224 -7.164 4.873 -0.704 1.00 0.00 H new ATOM 0 HG23 ILE A 224 -8.398 5.980 -1.350 1.00 0.00 H new ATOM 0 HD11 ILE A 224 -6.688 7.294 -5.212 1.00 0.00 H new ATOM 0 HD12 ILE A 224 -5.345 6.433 -4.424 1.00 0.00 H new ATOM 0 HD13 ILE A 224 -6.974 5.717 -4.439 1.00 0.00 H new ATOM 172 N LEU A 225 -6.875 6.214 1.367 1.00 0.00 N ATOM 173 CA LEU A 225 -6.685 5.394 2.558 1.00 0.00 C ATOM 174 C LEU A 225 -7.251 3.993 2.351 1.00 0.00 C ATOM 175 O LEU A 225 -8.438 3.827 2.072 1.00 0.00 O ATOM 176 CB LEU A 225 -7.352 6.052 3.767 1.00 0.00 C ATOM 177 CG LEU A 225 -6.899 7.476 4.091 1.00 0.00 C ATOM 178 CD1 LEU A 225 -7.880 8.146 5.040 1.00 0.00 C ATOM 179 CD2 LEU A 225 -5.499 7.468 4.687 1.00 0.00 C ATOM 0 H LEU A 225 -7.845 6.471 1.183 1.00 0.00 H new ATOM 0 HA LEU A 225 -5.614 5.310 2.743 1.00 0.00 H new ATOM 0 HB2 LEU A 225 -8.429 6.064 3.601 1.00 0.00 H new ATOM 0 HB3 LEU A 225 -7.171 5.427 4.641 1.00 0.00 H new ATOM 0 HG LEU A 225 -6.874 8.048 3.164 1.00 0.00 H new ATOM 0 HD11 LEU A 225 -7.541 9.158 5.259 1.00 0.00 H new ATOM 0 HD12 LEU A 225 -8.866 8.186 4.576 1.00 0.00 H new ATOM 0 HD13 LEU A 225 -7.938 7.575 5.966 1.00 0.00 H new ATOM 0 HD21 LEU A 225 -5.193 8.490 4.911 1.00 0.00 H new ATOM 0 HD22 LEU A 225 -5.497 6.879 5.604 1.00 0.00 H new ATOM 0 HD23 LEU A 225 -4.802 7.029 3.973 1.00 0.00 H new ATOM 191 N ALA A 226 -6.393 2.987 2.492 1.00 0.00 N ATOM 192 CA ALA A 226 -6.809 1.600 2.324 1.00 0.00 C ATOM 193 C ALA A 226 -7.228 0.988 3.656 1.00 0.00 C ATOM 194 O ALA A 226 -6.490 1.050 4.640 1.00 0.00 O ATOM 195 CB ALA A 226 -5.688 0.785 1.697 1.00 0.00 C ATOM 0 H ALA A 226 -5.407 3.107 2.722 1.00 0.00 H new ATOM 0 HA ALA A 226 -7.672 1.584 1.658 1.00 0.00 H new ATOM 0 HB1 ALA A 226 -6.013 -0.249 1.577 1.00 0.00 H new ATOM 0 HB2 ALA A 226 -5.437 1.202 0.722 1.00 0.00 H new ATOM 0 HB3 ALA A 226 -4.810 0.817 2.342 1.00 0.00 H new ATOM 201 N LYS A 227 -8.418 0.398 3.682 1.00 0.00 N ATOM 202 CA LYS A 227 -8.937 -0.227 4.893 1.00 0.00 C ATOM 203 C LYS A 227 -9.167 -1.720 4.681 1.00 0.00 C ATOM 204 O LYS A 227 -9.400 -2.167 3.559 1.00 0.00 O ATOM 205 CB LYS A 227 -10.245 0.445 5.319 1.00 0.00 C ATOM 206 CG LYS A 227 -10.050 1.825 5.923 1.00 0.00 C ATOM 207 CD LYS A 227 -9.894 1.756 7.433 1.00 0.00 C ATOM 208 CE LYS A 227 -9.892 3.143 8.058 1.00 0.00 C ATOM 209 NZ LYS A 227 -11.271 3.679 8.223 1.00 0.00 N ATOM 0 H LYS A 227 -9.042 0.339 2.877 1.00 0.00 H new ATOM 0 HA LYS A 227 -8.196 -0.100 5.682 1.00 0.00 H new ATOM 0 HB2 LYS A 227 -10.901 0.526 4.452 1.00 0.00 H new ATOM 0 HB3 LYS A 227 -10.752 -0.192 6.044 1.00 0.00 H new ATOM 0 HG2 LYS A 227 -9.168 2.293 5.486 1.00 0.00 H new ATOM 0 HG3 LYS A 227 -10.903 2.456 5.673 1.00 0.00 H new ATOM 0 HD2 LYS A 227 -10.707 1.166 7.857 1.00 0.00 H new ATOM 0 HD3 LYS A 227 -8.965 1.243 7.681 1.00 0.00 H new ATOM 0 HE2 LYS A 227 -9.399 3.103 9.030 1.00 0.00 H new ATOM 0 HE3 LYS A 227 -9.311 3.822 7.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 227 -11.227 4.625 8.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 227 -11.733 3.742 7.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 227 -11.818 3.045 8.839 1.00 0.00 H new ATOM 223 N ASN A 228 -9.100 -2.485 5.765 1.00 0.00 N ATOM 224 CA ASN A 228 -9.302 -3.927 5.697 1.00 0.00 C ATOM 225 C ASN A 228 -8.082 -4.619 5.095 1.00 0.00 C ATOM 226 O ASN A 228 -8.194 -5.361 4.119 1.00 0.00 O ATOM 227 CB ASN A 228 -10.546 -4.251 4.867 1.00 0.00 C ATOM 228 CG ASN A 228 -11.235 -5.521 5.328 1.00 0.00 C ATOM 229 OD1 ASN A 228 -10.522 -6.639 5.256 1.00 0.00 O flip ATOM 230 ND2 ASN A 228 -12.393 -5.496 5.744 1.00 0.00 N flip ATOM 0 H ASN A 228 -8.907 -2.130 6.702 1.00 0.00 H new ATOM 0 HA ASN A 228 -9.444 -4.297 6.712 1.00 0.00 H new ATOM 0 HB2 ASN A 228 -11.247 -3.418 4.928 1.00 0.00 H new ATOM 0 HB3 ASN A 228 -10.264 -4.354 3.819 1.00 0.00 H new ATOM 0 HD21 ASN A 228 -12.902 -4.613 5.781 1.00 0.00 H new ATOM 0 HD22 ASN A 228 -12.843 -6.358 6.051 1.00 0.00 H new ATOM 237 N LEU A 229 -6.918 -4.372 5.685 1.00 0.00 N ATOM 238 CA LEU A 229 -5.676 -4.971 5.209 1.00 0.00 C ATOM 239 C LEU A 229 -5.175 -6.032 6.183 1.00 0.00 C ATOM 240 O LEU A 229 -5.163 -5.838 7.399 1.00 0.00 O ATOM 241 CB LEU A 229 -4.608 -3.893 5.017 1.00 0.00 C ATOM 242 CG LEU A 229 -4.813 -2.949 3.832 1.00 0.00 C ATOM 243 CD1 LEU A 229 -3.830 -1.790 3.896 1.00 0.00 C ATOM 244 CD2 LEU A 229 -4.667 -3.702 2.518 1.00 0.00 C ATOM 0 H LEU A 229 -6.808 -3.761 6.494 1.00 0.00 H new ATOM 0 HA LEU A 229 -5.876 -5.450 4.251 1.00 0.00 H new ATOM 0 HB2 LEU A 229 -4.556 -3.295 5.927 1.00 0.00 H new ATOM 0 HB3 LEU A 229 -3.642 -4.384 4.902 1.00 0.00 H new ATOM 0 HG LEU A 229 -5.824 -2.545 3.886 1.00 0.00 H new ATOM 0 HD11 LEU A 229 -3.991 -1.129 3.045 1.00 0.00 H new ATOM 0 HD12 LEU A 229 -3.983 -1.234 4.821 1.00 0.00 H new ATOM 0 HD13 LEU A 229 -2.811 -2.175 3.868 1.00 0.00 H new ATOM 0 HD21 LEU A 229 -4.816 -3.014 1.686 1.00 0.00 H new ATOM 0 HD22 LEU A 229 -3.669 -4.135 2.456 1.00 0.00 H new ATOM 0 HD23 LEU A 229 -5.411 -4.497 2.469 1.00 0.00 H new ATOM 256 N PRO A 230 -4.748 -7.181 5.639 1.00 0.00 N ATOM 257 CA PRO A 230 -4.235 -8.295 6.442 1.00 0.00 C ATOM 258 C PRO A 230 -2.884 -7.979 7.075 1.00 0.00 C ATOM 259 O PRO A 230 -1.973 -7.492 6.406 1.00 0.00 O ATOM 260 CB PRO A 230 -4.097 -9.431 5.426 1.00 0.00 C ATOM 261 CG PRO A 230 -3.925 -8.747 4.114 1.00 0.00 C ATOM 262 CD PRO A 230 -4.733 -7.482 4.197 1.00 0.00 C ATOM 0 HA PRO A 230 -4.893 -8.531 7.279 1.00 0.00 H new ATOM 0 HB2 PRO A 230 -3.242 -10.066 5.656 1.00 0.00 H new ATOM 0 HB3 PRO A 230 -4.979 -10.071 5.426 1.00 0.00 H new ATOM 0 HG2 PRO A 230 -2.875 -8.527 3.923 1.00 0.00 H new ATOM 0 HG3 PRO A 230 -4.272 -9.379 3.296 1.00 0.00 H new ATOM 0 HD2 PRO A 230 -4.277 -6.675 3.623 1.00 0.00 H new ATOM 0 HD3 PRO A 230 -5.740 -7.622 3.805 1.00 0.00 H new ATOM 270 N ALA A 231 -2.761 -8.260 8.368 1.00 0.00 N ATOM 271 CA ALA A 231 -1.520 -8.008 9.090 1.00 0.00 C ATOM 272 C ALA A 231 -0.309 -8.420 8.260 1.00 0.00 C ATOM 273 O ALA A 231 0.765 -7.830 8.376 1.00 0.00 O ATOM 274 CB ALA A 231 -1.525 -8.745 10.421 1.00 0.00 C ATOM 0 H ALA A 231 -3.506 -8.662 8.937 1.00 0.00 H new ATOM 0 HA ALA A 231 -1.450 -6.937 9.280 1.00 0.00 H new ATOM 0 HB1 ALA A 231 -0.592 -8.548 10.950 1.00 0.00 H new ATOM 0 HB2 ALA A 231 -2.364 -8.400 11.025 1.00 0.00 H new ATOM 0 HB3 ALA A 231 -1.622 -9.816 10.243 1.00 0.00 H new ATOM 280 N GLY A 232 -0.489 -9.436 7.422 1.00 0.00 N ATOM 281 CA GLY A 232 0.599 -9.909 6.586 1.00 0.00 C ATOM 282 C GLY A 232 1.173 -8.815 5.708 1.00 0.00 C ATOM 283 O GLY A 232 2.388 -8.728 5.526 1.00 0.00 O ATOM 0 H GLY A 232 -1.368 -9.940 7.307 1.00 0.00 H new ATOM 0 HA2 GLY A 232 1.389 -10.315 7.218 1.00 0.00 H new ATOM 0 HA3 GLY A 232 0.242 -10.725 5.958 1.00 0.00 H new ATOM 287 N THR A 233 0.299 -7.978 5.160 1.00 0.00 N ATOM 288 CA THR A 233 0.725 -6.886 4.294 1.00 0.00 C ATOM 289 C THR A 233 1.862 -6.093 4.928 1.00 0.00 C ATOM 290 O THR A 233 2.106 -6.192 6.132 1.00 0.00 O ATOM 291 CB THR A 233 -0.441 -5.929 3.981 1.00 0.00 C ATOM 292 OG1 THR A 233 -1.625 -6.678 3.687 1.00 0.00 O ATOM 293 CG2 THR A 233 -0.100 -5.028 2.804 1.00 0.00 C ATOM 0 H THR A 233 -0.710 -8.035 5.301 1.00 0.00 H new ATOM 0 HA THR A 233 1.074 -7.337 3.365 1.00 0.00 H new ATOM 0 HB THR A 233 -0.615 -5.305 4.858 1.00 0.00 H new ATOM 0 HG1 THR A 233 -1.498 -7.176 2.852 1.00 0.00 H new ATOM 0 HG21 THR A 233 -0.938 -4.361 2.602 1.00 0.00 H new ATOM 0 HG22 THR A 233 0.784 -4.437 3.042 1.00 0.00 H new ATOM 0 HG23 THR A 233 0.098 -5.639 1.923 1.00 0.00 H new ATOM 301 N LEU A 234 2.555 -5.306 4.113 1.00 0.00 N ATOM 302 CA LEU A 234 3.667 -4.494 4.595 1.00 0.00 C ATOM 303 C LEU A 234 3.836 -3.240 3.743 1.00 0.00 C ATOM 304 O LEU A 234 3.510 -3.236 2.557 1.00 0.00 O ATOM 305 CB LEU A 234 4.961 -5.309 4.585 1.00 0.00 C ATOM 306 CG LEU A 234 4.968 -6.569 5.452 1.00 0.00 C ATOM 307 CD1 LEU A 234 6.181 -7.430 5.134 1.00 0.00 C ATOM 308 CD2 LEU A 234 4.947 -6.199 6.928 1.00 0.00 C ATOM 0 H LEU A 234 2.367 -5.213 3.115 1.00 0.00 H new ATOM 0 HA LEU A 234 3.445 -4.189 5.617 1.00 0.00 H new ATOM 0 HB2 LEU A 234 5.176 -5.599 3.557 1.00 0.00 H new ATOM 0 HB3 LEU A 234 5.776 -4.663 4.911 1.00 0.00 H new ATOM 0 HG LEU A 234 4.071 -7.146 5.229 1.00 0.00 H new ATOM 0 HD11 LEU A 234 6.169 -8.322 5.761 1.00 0.00 H new ATOM 0 HD12 LEU A 234 6.154 -7.724 4.085 1.00 0.00 H new ATOM 0 HD13 LEU A 234 7.091 -6.863 5.328 1.00 0.00 H new ATOM 0 HD21 LEU A 234 4.952 -7.107 7.531 1.00 0.00 H new ATOM 0 HD22 LEU A 234 5.826 -5.601 7.166 1.00 0.00 H new ATOM 0 HD23 LEU A 234 4.047 -5.624 7.146 1.00 0.00 H new ATOM 320 N ALA A 235 4.349 -2.179 4.357 1.00 0.00 N ATOM 321 CA ALA A 235 4.565 -0.920 3.654 1.00 0.00 C ATOM 322 C ALA A 235 5.081 -1.163 2.240 1.00 0.00 C ATOM 323 O ALA A 235 4.541 -0.629 1.271 1.00 0.00 O ATOM 324 CB ALA A 235 5.537 -0.043 4.429 1.00 0.00 C ATOM 0 H ALA A 235 4.623 -2.166 5.339 1.00 0.00 H new ATOM 0 HA ALA A 235 3.607 -0.405 3.580 1.00 0.00 H new ATOM 0 HB1 ALA A 235 5.689 0.894 3.893 1.00 0.00 H new ATOM 0 HB2 ALA A 235 5.129 0.167 5.418 1.00 0.00 H new ATOM 0 HB3 ALA A 235 6.491 -0.561 4.533 1.00 0.00 H new ATOM 330 N ALA A 236 6.130 -1.972 2.128 1.00 0.00 N ATOM 331 CA ALA A 236 6.718 -2.286 0.832 1.00 0.00 C ATOM 332 C ALA A 236 5.693 -2.934 -0.093 1.00 0.00 C ATOM 333 O ALA A 236 5.506 -2.498 -1.228 1.00 0.00 O ATOM 334 CB ALA A 236 7.924 -3.197 1.006 1.00 0.00 C ATOM 0 H ALA A 236 6.590 -2.422 2.920 1.00 0.00 H new ATOM 0 HA ALA A 236 7.045 -1.353 0.373 1.00 0.00 H new ATOM 0 HB1 ALA A 236 8.353 -3.423 0.030 1.00 0.00 H new ATOM 0 HB2 ALA A 236 8.671 -2.698 1.624 1.00 0.00 H new ATOM 0 HB3 ALA A 236 7.614 -4.123 1.489 1.00 0.00 H new ATOM 340 N GLU A 237 5.033 -3.977 0.400 1.00 0.00 N ATOM 341 CA GLU A 237 4.028 -4.686 -0.384 1.00 0.00 C ATOM 342 C GLU A 237 3.040 -3.708 -1.013 1.00 0.00 C ATOM 343 O GLU A 237 2.879 -3.671 -2.233 1.00 0.00 O ATOM 344 CB GLU A 237 3.280 -5.691 0.493 1.00 0.00 C ATOM 345 CG GLU A 237 4.149 -6.836 0.985 1.00 0.00 C ATOM 346 CD GLU A 237 3.341 -7.948 1.625 1.00 0.00 C ATOM 347 OE1 GLU A 237 2.483 -8.533 0.932 1.00 0.00 O ATOM 348 OE2 GLU A 237 3.569 -8.234 2.820 1.00 0.00 O ATOM 0 H GLU A 237 5.176 -4.350 1.339 1.00 0.00 H new ATOM 0 HA GLU A 237 4.540 -5.223 -1.183 1.00 0.00 H new ATOM 0 HB2 GLU A 237 2.861 -5.169 1.353 1.00 0.00 H new ATOM 0 HB3 GLU A 237 2.441 -6.099 -0.071 1.00 0.00 H new ATOM 0 HG2 GLU A 237 4.718 -7.241 0.148 1.00 0.00 H new ATOM 0 HG3 GLU A 237 4.871 -6.455 1.707 1.00 0.00 H new ATOM 355 N ILE A 238 2.382 -2.918 -0.171 1.00 0.00 N ATOM 356 CA ILE A 238 1.410 -1.940 -0.644 1.00 0.00 C ATOM 357 C ILE A 238 2.017 -1.032 -1.709 1.00 0.00 C ATOM 358 O ILE A 238 1.598 -1.051 -2.865 1.00 0.00 O ATOM 359 CB ILE A 238 0.877 -1.072 0.511 1.00 0.00 C ATOM 360 CG1 ILE A 238 0.044 -1.921 1.473 1.00 0.00 C ATOM 361 CG2 ILE A 238 0.053 0.086 -0.032 1.00 0.00 C ATOM 362 CD1 ILE A 238 -1.177 -2.541 0.830 1.00 0.00 C ATOM 0 H ILE A 238 2.504 -2.936 0.841 1.00 0.00 H new ATOM 0 HA ILE A 238 0.583 -2.502 -1.077 1.00 0.00 H new ATOM 0 HB ILE A 238 1.725 -0.662 1.059 1.00 0.00 H new ATOM 0 HG12 ILE A 238 0.671 -2.713 1.882 1.00 0.00 H new ATOM 0 HG13 ILE A 238 -0.272 -1.301 2.311 1.00 0.00 H new ATOM 0 HG21 ILE A 238 -0.316 0.690 0.797 1.00 0.00 H new ATOM 0 HG22 ILE A 238 0.675 0.702 -0.681 1.00 0.00 H new ATOM 0 HG23 ILE A 238 -0.791 -0.303 -0.601 1.00 0.00 H new ATOM 0 HD11 ILE A 238 -1.719 -3.129 1.571 1.00 0.00 H new ATOM 0 HD12 ILE A 238 -1.825 -1.754 0.446 1.00 0.00 H new ATOM 0 HD13 ILE A 238 -0.867 -3.188 0.010 1.00 0.00 H new ATOM 374 N GLN A 239 3.007 -0.241 -1.309 1.00 0.00 N ATOM 375 CA GLN A 239 3.673 0.673 -2.230 1.00 0.00 C ATOM 376 C GLN A 239 3.847 0.032 -3.603 1.00 0.00 C ATOM 377 O GLN A 239 3.497 0.624 -4.623 1.00 0.00 O ATOM 378 CB GLN A 239 5.035 1.090 -1.672 1.00 0.00 C ATOM 379 CG GLN A 239 5.611 2.330 -2.337 1.00 0.00 C ATOM 380 CD GLN A 239 6.674 3.004 -1.493 1.00 0.00 C ATOM 381 OE1 GLN A 239 6.606 4.205 -1.231 1.00 0.00 O ATOM 382 NE2 GLN A 239 7.665 2.233 -1.061 1.00 0.00 N ATOM 0 H GLN A 239 3.366 -0.214 -0.354 1.00 0.00 H new ATOM 0 HA GLN A 239 3.047 1.558 -2.340 1.00 0.00 H new ATOM 0 HB2 GLN A 239 4.939 1.273 -0.602 1.00 0.00 H new ATOM 0 HB3 GLN A 239 5.736 0.264 -1.793 1.00 0.00 H new ATOM 0 HG2 GLN A 239 6.038 2.055 -3.301 1.00 0.00 H new ATOM 0 HG3 GLN A 239 4.807 3.038 -2.535 1.00 0.00 H new ATOM 0 HE21 GLN A 239 7.682 1.242 -1.302 1.00 0.00 H new ATOM 0 HE22 GLN A 239 8.409 2.632 -0.488 1.00 0.00 H new ATOM 391 N GLU A 240 4.389 -1.181 -3.619 1.00 0.00 N ATOM 392 CA GLU A 240 4.610 -1.902 -4.868 1.00 0.00 C ATOM 393 C GLU A 240 3.286 -2.204 -5.563 1.00 0.00 C ATOM 394 O GLU A 240 3.079 -1.834 -6.719 1.00 0.00 O ATOM 395 CB GLU A 240 5.370 -3.204 -4.604 1.00 0.00 C ATOM 396 CG GLU A 240 6.138 -3.715 -5.811 1.00 0.00 C ATOM 397 CD GLU A 240 7.466 -3.009 -5.999 1.00 0.00 C ATOM 398 OE1 GLU A 240 8.225 -2.897 -5.013 1.00 0.00 O ATOM 399 OE2 GLU A 240 7.748 -2.568 -7.133 1.00 0.00 O ATOM 0 H GLU A 240 4.683 -1.685 -2.783 1.00 0.00 H new ATOM 0 HA GLU A 240 5.208 -1.268 -5.523 1.00 0.00 H new ATOM 0 HB2 GLU A 240 6.066 -3.048 -3.780 1.00 0.00 H new ATOM 0 HB3 GLU A 240 4.663 -3.969 -4.283 1.00 0.00 H new ATOM 0 HG2 GLU A 240 6.312 -4.785 -5.700 1.00 0.00 H new ATOM 0 HG3 GLU A 240 5.530 -3.583 -6.706 1.00 0.00 H new ATOM 406 N THR A 241 2.391 -2.881 -4.850 1.00 0.00 N ATOM 407 CA THR A 241 1.088 -3.235 -5.397 1.00 0.00 C ATOM 408 C THR A 241 0.463 -2.058 -6.136 1.00 0.00 C ATOM 409 O THR A 241 0.058 -2.181 -7.292 1.00 0.00 O ATOM 410 CB THR A 241 0.123 -3.704 -4.292 1.00 0.00 C ATOM 411 OG1 THR A 241 0.633 -4.885 -3.664 1.00 0.00 O ATOM 412 CG2 THR A 241 -1.260 -3.983 -4.862 1.00 0.00 C ATOM 0 H THR A 241 2.545 -3.195 -3.892 1.00 0.00 H new ATOM 0 HA THR A 241 1.252 -4.054 -6.097 1.00 0.00 H new ATOM 0 HB THR A 241 0.039 -2.907 -3.553 1.00 0.00 H new ATOM 0 HG1 THR A 241 1.409 -4.653 -3.112 1.00 0.00 H new ATOM 0 HG21 THR A 241 -1.923 -4.313 -4.062 1.00 0.00 H new ATOM 0 HG22 THR A 241 -1.658 -3.074 -5.312 1.00 0.00 H new ATOM 0 HG23 THR A 241 -1.190 -4.763 -5.620 1.00 0.00 H new ATOM 420 N PHE A 242 0.388 -0.915 -5.462 1.00 0.00 N ATOM 421 CA PHE A 242 -0.189 0.286 -6.055 1.00 0.00 C ATOM 422 C PHE A 242 0.737 0.864 -7.122 1.00 0.00 C ATOM 423 O PHE A 242 0.284 1.318 -8.172 1.00 0.00 O ATOM 424 CB PHE A 242 -0.458 1.336 -4.975 1.00 0.00 C ATOM 425 CG PHE A 242 -1.659 1.027 -4.126 1.00 0.00 C ATOM 426 CD1 PHE A 242 -1.758 -0.181 -3.456 1.00 0.00 C ATOM 427 CD2 PHE A 242 -2.688 1.946 -3.999 1.00 0.00 C ATOM 428 CE1 PHE A 242 -2.861 -0.468 -2.674 1.00 0.00 C ATOM 429 CE2 PHE A 242 -3.793 1.665 -3.219 1.00 0.00 C ATOM 430 CZ PHE A 242 -3.880 0.456 -2.556 1.00 0.00 C ATOM 0 H PHE A 242 0.720 -0.795 -4.505 1.00 0.00 H new ATOM 0 HA PHE A 242 -1.132 0.011 -6.527 1.00 0.00 H new ATOM 0 HB2 PHE A 242 0.419 1.419 -4.333 1.00 0.00 H new ATOM 0 HB3 PHE A 242 -0.599 2.307 -5.450 1.00 0.00 H new ATOM 0 HD1 PHE A 242 -0.964 -0.907 -3.546 1.00 0.00 H new ATOM 0 HD2 PHE A 242 -2.626 2.892 -4.515 1.00 0.00 H new ATOM 0 HE1 PHE A 242 -2.926 -1.414 -2.156 1.00 0.00 H new ATOM 0 HE2 PHE A 242 -4.588 2.390 -3.128 1.00 0.00 H new ATOM 0 HZ PHE A 242 -4.744 0.234 -1.947 1.00 0.00 H new ATOM 440 N SER A 243 2.037 0.844 -6.843 1.00 0.00 N ATOM 441 CA SER A 243 3.027 1.370 -7.775 1.00 0.00 C ATOM 442 C SER A 243 2.809 0.804 -9.175 1.00 0.00 C ATOM 443 O SER A 243 2.909 1.523 -10.169 1.00 0.00 O ATOM 444 CB SER A 243 4.440 1.037 -7.292 1.00 0.00 C ATOM 445 OG SER A 243 5.407 1.380 -8.270 1.00 0.00 O ATOM 0 H SER A 243 2.429 0.469 -5.979 1.00 0.00 H new ATOM 0 HA SER A 243 2.911 2.453 -7.818 1.00 0.00 H new ATOM 0 HB2 SER A 243 4.648 1.574 -6.367 1.00 0.00 H new ATOM 0 HB3 SER A 243 4.509 -0.027 -7.065 1.00 0.00 H new ATOM 0 HG SER A 243 6.302 1.159 -7.937 1.00 0.00 H new ATOM 451 N ARG A 244 2.511 -0.489 -9.244 1.00 0.00 N ATOM 452 CA ARG A 244 2.279 -1.153 -10.521 1.00 0.00 C ATOM 453 C ARG A 244 1.504 -0.246 -11.473 1.00 0.00 C ATOM 454 O ARG A 244 1.801 -0.181 -12.665 1.00 0.00 O ATOM 455 CB ARG A 244 1.515 -2.461 -10.310 1.00 0.00 C ATOM 456 CG ARG A 244 2.258 -3.467 -9.446 1.00 0.00 C ATOM 457 CD ARG A 244 3.416 -4.102 -10.200 1.00 0.00 C ATOM 458 NE ARG A 244 2.962 -5.117 -11.147 1.00 0.00 N ATOM 459 CZ ARG A 244 3.656 -5.486 -12.217 1.00 0.00 C ATOM 460 NH1 ARG A 244 4.831 -4.927 -12.475 1.00 0.00 N ATOM 461 NH2 ARG A 244 3.176 -6.417 -13.032 1.00 0.00 N ATOM 0 H ARG A 244 2.424 -1.098 -8.430 1.00 0.00 H new ATOM 0 HA ARG A 244 3.248 -1.375 -10.967 1.00 0.00 H new ATOM 0 HB2 ARG A 244 0.552 -2.240 -9.849 1.00 0.00 H new ATOM 0 HB3 ARG A 244 1.307 -2.911 -11.281 1.00 0.00 H new ATOM 0 HG2 ARG A 244 2.634 -2.972 -8.551 1.00 0.00 H new ATOM 0 HG3 ARG A 244 1.568 -4.244 -9.115 1.00 0.00 H new ATOM 0 HD2 ARG A 244 3.968 -3.329 -10.734 1.00 0.00 H new ATOM 0 HD3 ARG A 244 4.108 -4.553 -9.489 1.00 0.00 H new ATOM 0 HE ARG A 244 2.063 -5.567 -10.977 1.00 0.00 H new ATOM 0 HH11 ARG A 244 5.204 -4.212 -11.851 1.00 0.00 H new ATOM 0 HH12 ARG A 244 5.362 -5.213 -13.298 1.00 0.00 H new ATOM 0 HH21 ARG A 244 2.273 -6.850 -12.837 1.00 0.00 H new ATOM 0 HH22 ARG A 244 3.710 -6.700 -13.854 1.00 0.00 H new ATOM 475 N PHE A 245 0.507 0.451 -10.936 1.00 0.00 N ATOM 476 CA PHE A 245 -0.312 1.353 -11.737 1.00 0.00 C ATOM 477 C PHE A 245 0.471 2.605 -12.120 1.00 0.00 C ATOM 478 O PHE A 245 0.496 3.004 -13.283 1.00 0.00 O ATOM 479 CB PHE A 245 -1.577 1.744 -10.970 1.00 0.00 C ATOM 480 CG PHE A 245 -2.543 0.608 -10.788 1.00 0.00 C ATOM 481 CD1 PHE A 245 -2.312 -0.369 -9.833 1.00 0.00 C ATOM 482 CD2 PHE A 245 -3.682 0.518 -11.572 1.00 0.00 C ATOM 483 CE1 PHE A 245 -3.199 -1.415 -9.665 1.00 0.00 C ATOM 484 CE2 PHE A 245 -4.573 -0.526 -11.407 1.00 0.00 C ATOM 485 CZ PHE A 245 -4.331 -1.493 -10.452 1.00 0.00 C ATOM 0 H PHE A 245 0.247 0.408 -9.951 1.00 0.00 H new ATOM 0 HA PHE A 245 -0.596 0.830 -12.650 1.00 0.00 H new ATOM 0 HB2 PHE A 245 -1.294 2.130 -9.991 1.00 0.00 H new ATOM 0 HB3 PHE A 245 -2.077 2.555 -11.500 1.00 0.00 H new ATOM 0 HD1 PHE A 245 -1.429 -0.312 -9.213 1.00 0.00 H new ATOM 0 HD2 PHE A 245 -3.876 1.272 -12.320 1.00 0.00 H new ATOM 0 HE1 PHE A 245 -3.007 -2.171 -8.918 1.00 0.00 H new ATOM 0 HE2 PHE A 245 -5.457 -0.585 -12.024 1.00 0.00 H new ATOM 0 HZ PHE A 245 -5.026 -2.309 -10.321 1.00 0.00 H new ATOM 495 N GLY A 246 1.110 3.222 -11.130 1.00 0.00 N ATOM 496 CA GLY A 246 1.885 4.423 -11.382 1.00 0.00 C ATOM 497 C GLY A 246 2.741 4.820 -10.196 1.00 0.00 C ATOM 498 O GLY A 246 2.557 4.310 -9.090 1.00 0.00 O ATOM 0 H GLY A 246 1.105 2.911 -10.158 1.00 0.00 H new ATOM 0 HA2 GLY A 246 2.524 4.264 -12.250 1.00 0.00 H new ATOM 0 HA3 GLY A 246 1.210 5.242 -11.629 1.00 0.00 H new ATOM 502 N SER A 247 3.681 5.731 -10.425 1.00 0.00 N ATOM 503 CA SER A 247 4.572 6.193 -9.367 1.00 0.00 C ATOM 504 C SER A 247 3.777 6.738 -8.185 1.00 0.00 C ATOM 505 O SER A 247 2.762 7.413 -8.363 1.00 0.00 O ATOM 506 CB SER A 247 5.517 7.271 -9.901 1.00 0.00 C ATOM 507 OG SER A 247 6.530 6.704 -10.714 1.00 0.00 O ATOM 0 H SER A 247 3.845 6.164 -11.334 1.00 0.00 H new ATOM 0 HA SER A 247 5.160 5.341 -9.025 1.00 0.00 H new ATOM 0 HB2 SER A 247 4.951 8.002 -10.477 1.00 0.00 H new ATOM 0 HB3 SER A 247 5.972 7.806 -9.067 1.00 0.00 H new ATOM 0 HG SER A 247 7.120 7.414 -11.044 1.00 0.00 H new ATOM 513 N LEU A 248 4.244 6.440 -6.978 1.00 0.00 N ATOM 514 CA LEU A 248 3.577 6.900 -5.765 1.00 0.00 C ATOM 515 C LEU A 248 4.411 7.961 -5.054 1.00 0.00 C ATOM 516 O LEU A 248 5.606 8.100 -5.308 1.00 0.00 O ATOM 517 CB LEU A 248 3.320 5.722 -4.823 1.00 0.00 C ATOM 518 CG LEU A 248 2.334 4.666 -5.323 1.00 0.00 C ATOM 519 CD1 LEU A 248 2.594 3.329 -4.646 1.00 0.00 C ATOM 520 CD2 LEU A 248 0.901 5.118 -5.081 1.00 0.00 C ATOM 0 H LEU A 248 5.082 5.882 -6.813 1.00 0.00 H new ATOM 0 HA LEU A 248 2.624 7.344 -6.050 1.00 0.00 H new ATOM 0 HB2 LEU A 248 4.272 5.233 -4.617 1.00 0.00 H new ATOM 0 HB3 LEU A 248 2.952 6.114 -3.875 1.00 0.00 H new ATOM 0 HG LEU A 248 2.479 4.541 -6.396 1.00 0.00 H new ATOM 0 HD11 LEU A 248 1.882 2.590 -5.015 1.00 0.00 H new ATOM 0 HD12 LEU A 248 3.608 2.999 -4.870 1.00 0.00 H new ATOM 0 HD13 LEU A 248 2.478 3.438 -3.568 1.00 0.00 H new ATOM 0 HD21 LEU A 248 0.213 4.354 -5.443 1.00 0.00 H new ATOM 0 HD22 LEU A 248 0.743 5.272 -4.014 1.00 0.00 H new ATOM 0 HD23 LEU A 248 0.719 6.052 -5.613 1.00 0.00 H new ATOM 532 N GLY A 249 3.771 8.708 -4.159 1.00 0.00 N ATOM 533 CA GLY A 249 4.469 9.746 -3.423 1.00 0.00 C ATOM 534 C GLY A 249 4.756 9.347 -1.990 1.00 0.00 C ATOM 535 O GLY A 249 5.736 8.655 -1.716 1.00 0.00 O ATOM 0 H GLY A 249 2.781 8.613 -3.931 1.00 0.00 H new ATOM 0 HA2 GLY A 249 5.407 9.977 -3.928 1.00 0.00 H new ATOM 0 HA3 GLY A 249 3.871 10.657 -3.430 1.00 0.00 H new ATOM 539 N ARG A 250 3.901 9.787 -1.072 1.00 0.00 N ATOM 540 CA ARG A 250 4.070 9.474 0.342 1.00 0.00 C ATOM 541 C ARG A 250 3.379 8.159 0.694 1.00 0.00 C ATOM 542 O ARG A 250 2.172 8.009 0.501 1.00 0.00 O ATOM 543 CB ARG A 250 3.510 10.604 1.207 1.00 0.00 C ATOM 544 CG ARG A 250 4.243 10.782 2.526 1.00 0.00 C ATOM 545 CD ARG A 250 5.637 11.350 2.317 1.00 0.00 C ATOM 546 NE ARG A 250 6.645 10.299 2.202 1.00 0.00 N ATOM 547 CZ ARG A 250 7.946 10.506 2.369 1.00 0.00 C ATOM 548 NH1 ARG A 250 8.396 11.720 2.656 1.00 0.00 N ATOM 549 NH2 ARG A 250 8.801 9.499 2.248 1.00 0.00 N ATOM 0 H ARG A 250 3.085 10.361 -1.282 1.00 0.00 H new ATOM 0 HA ARG A 250 5.137 9.369 0.540 1.00 0.00 H new ATOM 0 HB2 ARG A 250 3.558 11.537 0.646 1.00 0.00 H new ATOM 0 HB3 ARG A 250 2.457 10.407 1.410 1.00 0.00 H new ATOM 0 HG2 ARG A 250 3.672 11.447 3.174 1.00 0.00 H new ATOM 0 HG3 ARG A 250 4.313 9.822 3.037 1.00 0.00 H new ATOM 0 HD2 ARG A 250 5.647 11.962 1.415 1.00 0.00 H new ATOM 0 HD3 ARG A 250 5.890 12.005 3.150 1.00 0.00 H new ATOM 0 HE ARG A 250 6.332 9.354 1.981 1.00 0.00 H new ATOM 0 HH11 ARG A 250 7.742 12.497 2.749 1.00 0.00 H new ATOM 0 HH12 ARG A 250 9.396 11.876 2.784 1.00 0.00 H new ATOM 0 HH21 ARG A 250 8.459 8.564 2.026 1.00 0.00 H new ATOM 0 HH22 ARG A 250 9.800 9.660 2.377 1.00 0.00 H new ATOM 563 N VAL A 251 4.152 7.210 1.211 1.00 0.00 N ATOM 564 CA VAL A 251 3.615 5.909 1.590 1.00 0.00 C ATOM 565 C VAL A 251 3.895 5.606 3.058 1.00 0.00 C ATOM 566 O VAL A 251 5.035 5.342 3.443 1.00 0.00 O ATOM 567 CB VAL A 251 4.208 4.782 0.723 1.00 0.00 C ATOM 568 CG1 VAL A 251 3.696 3.427 1.186 1.00 0.00 C ATOM 569 CG2 VAL A 251 3.881 5.012 -0.745 1.00 0.00 C ATOM 0 H VAL A 251 5.153 7.318 1.377 1.00 0.00 H new ATOM 0 HA VAL A 251 2.538 5.952 1.429 1.00 0.00 H new ATOM 0 HB VAL A 251 5.292 4.792 0.836 1.00 0.00 H new ATOM 0 HG11 VAL A 251 4.125 2.643 0.562 1.00 0.00 H new ATOM 0 HG12 VAL A 251 3.986 3.264 2.224 1.00 0.00 H new ATOM 0 HG13 VAL A 251 2.609 3.401 1.104 1.00 0.00 H new ATOM 0 HG21 VAL A 251 4.307 4.207 -1.343 1.00 0.00 H new ATOM 0 HG22 VAL A 251 2.799 5.030 -0.878 1.00 0.00 H new ATOM 0 HG23 VAL A 251 4.302 5.965 -1.067 1.00 0.00 H new ATOM 579 N LEU A 252 2.847 5.644 3.874 1.00 0.00 N ATOM 580 CA LEU A 252 2.979 5.373 5.301 1.00 0.00 C ATOM 581 C LEU A 252 1.977 4.313 5.749 1.00 0.00 C ATOM 582 O LEU A 252 0.765 4.506 5.645 1.00 0.00 O ATOM 583 CB LEU A 252 2.774 6.658 6.106 1.00 0.00 C ATOM 584 CG LEU A 252 3.633 7.853 5.692 1.00 0.00 C ATOM 585 CD1 LEU A 252 3.051 9.145 6.244 1.00 0.00 C ATOM 586 CD2 LEU A 252 5.067 7.668 6.164 1.00 0.00 C ATOM 0 H LEU A 252 1.897 5.860 3.572 1.00 0.00 H new ATOM 0 HA LEU A 252 3.985 4.995 5.482 1.00 0.00 H new ATOM 0 HB2 LEU A 252 1.726 6.946 6.031 1.00 0.00 H new ATOM 0 HB3 LEU A 252 2.971 6.441 7.156 1.00 0.00 H new ATOM 0 HG LEU A 252 3.635 7.915 4.604 1.00 0.00 H new ATOM 0 HD11 LEU A 252 3.676 9.985 5.939 1.00 0.00 H new ATOM 0 HD12 LEU A 252 2.042 9.284 5.857 1.00 0.00 H new ATOM 0 HD13 LEU A 252 3.018 9.093 7.332 1.00 0.00 H new ATOM 0 HD21 LEU A 252 5.664 8.528 5.860 1.00 0.00 H new ATOM 0 HD22 LEU A 252 5.084 7.580 7.250 1.00 0.00 H new ATOM 0 HD23 LEU A 252 5.482 6.763 5.720 1.00 0.00 H new ATOM 598 N LEU A 253 2.491 3.195 6.249 1.00 0.00 N ATOM 599 CA LEU A 253 1.641 2.105 6.716 1.00 0.00 C ATOM 600 C LEU A 253 2.127 1.572 8.060 1.00 0.00 C ATOM 601 O LEU A 253 3.055 0.766 8.137 1.00 0.00 O ATOM 602 CB LEU A 253 1.616 0.975 5.686 1.00 0.00 C ATOM 603 CG LEU A 253 1.142 -0.387 6.194 1.00 0.00 C ATOM 604 CD1 LEU A 253 -0.260 -0.282 6.775 1.00 0.00 C ATOM 605 CD2 LEU A 253 1.182 -1.418 5.076 1.00 0.00 C ATOM 0 H LEU A 253 3.491 3.019 6.342 1.00 0.00 H new ATOM 0 HA LEU A 253 0.631 2.495 6.844 1.00 0.00 H new ATOM 0 HB2 LEU A 253 0.971 1.277 4.861 1.00 0.00 H new ATOM 0 HB3 LEU A 253 2.621 0.859 5.279 1.00 0.00 H new ATOM 0 HG LEU A 253 1.818 -0.713 6.985 1.00 0.00 H new ATOM 0 HD11 LEU A 253 -0.580 -1.261 7.131 1.00 0.00 H new ATOM 0 HD12 LEU A 253 -0.258 0.424 7.606 1.00 0.00 H new ATOM 0 HD13 LEU A 253 -0.948 0.067 6.005 1.00 0.00 H new ATOM 0 HD21 LEU A 253 0.841 -2.381 5.457 1.00 0.00 H new ATOM 0 HD22 LEU A 253 0.531 -1.098 4.263 1.00 0.00 H new ATOM 0 HD23 LEU A 253 2.203 -1.515 4.707 1.00 0.00 H new ATOM 617 N PRO A 254 1.487 2.031 9.145 1.00 0.00 N ATOM 618 CA PRO A 254 1.835 1.612 10.506 1.00 0.00 C ATOM 619 C PRO A 254 1.461 0.159 10.779 1.00 0.00 C ATOM 620 O PRO A 254 0.484 -0.352 10.235 1.00 0.00 O ATOM 621 CB PRO A 254 1.009 2.551 11.389 1.00 0.00 C ATOM 622 CG PRO A 254 -0.147 2.951 10.538 1.00 0.00 C ATOM 623 CD PRO A 254 0.372 2.993 9.128 1.00 0.00 C ATOM 0 HA PRO A 254 2.908 1.668 10.687 1.00 0.00 H new ATOM 0 HB2 PRO A 254 0.677 2.050 12.298 1.00 0.00 H new ATOM 0 HB3 PRO A 254 1.592 3.419 11.698 1.00 0.00 H new ATOM 0 HG2 PRO A 254 -0.966 2.237 10.631 1.00 0.00 H new ATOM 0 HG3 PRO A 254 -0.536 3.924 10.840 1.00 0.00 H new ATOM 0 HD2 PRO A 254 -0.395 2.706 8.409 1.00 0.00 H new ATOM 0 HD3 PRO A 254 0.708 3.993 8.853 1.00 0.00 H new ATOM 631 N GLU A 255 2.246 -0.500 11.626 1.00 0.00 N ATOM 632 CA GLU A 255 1.997 -1.895 11.969 1.00 0.00 C ATOM 633 C GLU A 255 0.793 -2.020 12.899 1.00 0.00 C ATOM 634 O GLU A 255 -0.061 -2.885 12.714 1.00 0.00 O ATOM 635 CB GLU A 255 3.232 -2.510 12.631 1.00 0.00 C ATOM 636 CG GLU A 255 4.328 -2.882 11.647 1.00 0.00 C ATOM 637 CD GLU A 255 3.806 -3.675 10.465 1.00 0.00 C ATOM 638 OE1 GLU A 255 3.162 -4.721 10.692 1.00 0.00 O ATOM 639 OE2 GLU A 255 4.042 -3.252 9.314 1.00 0.00 O ATOM 0 H GLU A 255 3.059 -0.091 12.087 1.00 0.00 H new ATOM 0 HA GLU A 255 1.781 -2.435 11.047 1.00 0.00 H new ATOM 0 HB2 GLU A 255 3.633 -1.805 13.359 1.00 0.00 H new ATOM 0 HB3 GLU A 255 2.932 -3.401 13.182 1.00 0.00 H new ATOM 0 HG2 GLU A 255 4.810 -1.974 11.286 1.00 0.00 H new ATOM 0 HG3 GLU A 255 5.091 -3.465 12.162 1.00 0.00 H new ATOM 646 N GLY A 256 0.734 -1.147 13.901 1.00 0.00 N ATOM 647 CA GLY A 256 -0.367 -1.176 14.846 1.00 0.00 C ATOM 648 C GLY A 256 -1.719 -1.140 14.161 1.00 0.00 C ATOM 649 O GLY A 256 -2.668 -1.779 14.612 1.00 0.00 O ATOM 0 H GLY A 256 1.429 -0.421 14.075 1.00 0.00 H new ATOM 0 HA2 GLY A 256 -0.295 -2.077 15.455 1.00 0.00 H new ATOM 0 HA3 GLY A 256 -0.283 -0.326 15.523 1.00 0.00 H new ATOM 653 N GLY A 257 -1.808 -0.387 13.069 1.00 0.00 N ATOM 654 CA GLY A 257 -3.058 -0.282 12.340 1.00 0.00 C ATOM 655 C GLY A 257 -2.931 -0.742 10.901 1.00 0.00 C ATOM 656 O GLY A 257 -2.107 -0.223 10.147 1.00 0.00 O ATOM 0 H GLY A 257 -1.036 0.152 12.676 1.00 0.00 H new ATOM 0 HA2 GLY A 257 -3.819 -0.878 12.843 1.00 0.00 H new ATOM 0 HA3 GLY A 257 -3.400 0.753 12.358 1.00 0.00 H new ATOM 660 N ILE A 258 -3.747 -1.719 10.520 1.00 0.00 N ATOM 661 CA ILE A 258 -3.721 -2.249 9.162 1.00 0.00 C ATOM 662 C ILE A 258 -3.847 -1.130 8.133 1.00 0.00 C ATOM 663 O ILE A 258 -3.239 -1.184 7.063 1.00 0.00 O ATOM 664 CB ILE A 258 -4.851 -3.270 8.935 1.00 0.00 C ATOM 665 CG1 ILE A 258 -6.181 -2.713 9.445 1.00 0.00 C ATOM 666 CG2 ILE A 258 -4.522 -4.586 9.624 1.00 0.00 C ATOM 667 CD1 ILE A 258 -7.378 -3.549 9.048 1.00 0.00 C ATOM 0 H ILE A 258 -4.434 -2.159 11.132 1.00 0.00 H new ATOM 0 HA ILE A 258 -2.760 -2.749 9.036 1.00 0.00 H new ATOM 0 HB ILE A 258 -4.943 -3.456 7.865 1.00 0.00 H new ATOM 0 HG12 ILE A 258 -6.143 -2.641 10.532 1.00 0.00 H new ATOM 0 HG13 ILE A 258 -6.312 -1.701 9.063 1.00 0.00 H new ATOM 0 HG21 ILE A 258 -5.330 -5.297 9.454 1.00 0.00 H new ATOM 0 HG22 ILE A 258 -3.594 -4.988 9.217 1.00 0.00 H new ATOM 0 HG23 ILE A 258 -4.406 -4.417 10.695 1.00 0.00 H new ATOM 0 HD11 ILE A 258 -8.286 -3.095 9.444 1.00 0.00 H new ATOM 0 HD12 ILE A 258 -7.442 -3.600 7.961 1.00 0.00 H new ATOM 0 HD13 ILE A 258 -7.269 -4.555 9.453 1.00 0.00 H new ATOM 679 N THR A 259 -4.639 -0.115 8.464 1.00 0.00 N ATOM 680 CA THR A 259 -4.845 1.017 7.570 1.00 0.00 C ATOM 681 C THR A 259 -3.534 1.456 6.928 1.00 0.00 C ATOM 682 O THR A 259 -2.501 1.530 7.593 1.00 0.00 O ATOM 683 CB THR A 259 -5.466 2.214 8.313 1.00 0.00 C ATOM 684 OG1 THR A 259 -4.687 2.529 9.472 1.00 0.00 O ATOM 685 CG2 THR A 259 -6.899 1.911 8.726 1.00 0.00 C ATOM 0 H THR A 259 -5.149 -0.054 9.346 1.00 0.00 H new ATOM 0 HA THR A 259 -5.533 0.685 6.793 1.00 0.00 H new ATOM 0 HB THR A 259 -5.473 3.069 7.637 1.00 0.00 H new ATOM 0 HG1 THR A 259 -5.088 3.292 9.938 1.00 0.00 H new ATOM 0 HG21 THR A 259 -7.317 2.771 9.249 1.00 0.00 H new ATOM 0 HG22 THR A 259 -7.497 1.701 7.839 1.00 0.00 H new ATOM 0 HG23 THR A 259 -6.912 1.044 9.386 1.00 0.00 H new ATOM 693 N ALA A 260 -3.582 1.747 5.633 1.00 0.00 N ATOM 694 CA ALA A 260 -2.398 2.182 4.902 1.00 0.00 C ATOM 695 C ALA A 260 -2.648 3.508 4.192 1.00 0.00 C ATOM 696 O ALA A 260 -3.616 3.649 3.443 1.00 0.00 O ATOM 697 CB ALA A 260 -1.974 1.117 3.902 1.00 0.00 C ATOM 0 H ALA A 260 -4.429 1.689 5.067 1.00 0.00 H new ATOM 0 HA ALA A 260 -1.592 2.331 5.620 1.00 0.00 H new ATOM 0 HB1 ALA A 260 -1.089 1.455 3.363 1.00 0.00 H new ATOM 0 HB2 ALA A 260 -1.745 0.192 4.431 1.00 0.00 H new ATOM 0 HB3 ALA A 260 -2.784 0.940 3.194 1.00 0.00 H new ATOM 703 N ILE A 261 -1.770 4.476 4.431 1.00 0.00 N ATOM 704 CA ILE A 261 -1.896 5.791 3.813 1.00 0.00 C ATOM 705 C ILE A 261 -0.970 5.923 2.609 1.00 0.00 C ATOM 706 O ILE A 261 0.253 5.875 2.744 1.00 0.00 O ATOM 707 CB ILE A 261 -1.580 6.917 4.815 1.00 0.00 C ATOM 708 CG1 ILE A 261 -2.474 6.795 6.051 1.00 0.00 C ATOM 709 CG2 ILE A 261 -1.759 8.277 4.157 1.00 0.00 C ATOM 710 CD1 ILE A 261 -1.873 7.409 7.295 1.00 0.00 C ATOM 0 H ILE A 261 -0.964 4.375 5.048 1.00 0.00 H new ATOM 0 HA ILE A 261 -2.931 5.888 3.485 1.00 0.00 H new ATOM 0 HB ILE A 261 -0.541 6.822 5.131 1.00 0.00 H new ATOM 0 HG12 ILE A 261 -3.431 7.274 5.846 1.00 0.00 H new ATOM 0 HG13 ILE A 261 -2.679 5.741 6.239 1.00 0.00 H new ATOM 0 HG21 ILE A 261 -1.532 9.063 4.878 1.00 0.00 H new ATOM 0 HG22 ILE A 261 -1.085 8.360 3.305 1.00 0.00 H new ATOM 0 HG23 ILE A 261 -2.789 8.384 3.816 1.00 0.00 H new ATOM 0 HD11 ILE A 261 -2.562 7.285 8.131 1.00 0.00 H new ATOM 0 HD12 ILE A 261 -0.930 6.914 7.526 1.00 0.00 H new ATOM 0 HD13 ILE A 261 -1.694 8.471 7.127 1.00 0.00 H new ATOM 722 N VAL A 262 -1.562 6.091 1.430 1.00 0.00 N ATOM 723 CA VAL A 262 -0.790 6.234 0.201 1.00 0.00 C ATOM 724 C VAL A 262 -1.110 7.549 -0.499 1.00 0.00 C ATOM 725 O VAL A 262 -2.276 7.894 -0.691 1.00 0.00 O ATOM 726 CB VAL A 262 -1.061 5.069 -0.770 1.00 0.00 C ATOM 727 CG1 VAL A 262 -0.248 5.236 -2.045 1.00 0.00 C ATOM 728 CG2 VAL A 262 -0.753 3.737 -0.102 1.00 0.00 C ATOM 0 H VAL A 262 -2.573 6.131 1.300 1.00 0.00 H new ATOM 0 HA VAL A 262 0.262 6.224 0.485 1.00 0.00 H new ATOM 0 HB VAL A 262 -2.118 5.080 -1.038 1.00 0.00 H new ATOM 0 HG11 VAL A 262 -0.453 4.404 -2.719 1.00 0.00 H new ATOM 0 HG12 VAL A 262 -0.522 6.172 -2.531 1.00 0.00 H new ATOM 0 HG13 VAL A 262 0.814 5.252 -1.800 1.00 0.00 H new ATOM 0 HG21 VAL A 262 -0.950 2.925 -0.802 1.00 0.00 H new ATOM 0 HG22 VAL A 262 0.295 3.713 0.196 1.00 0.00 H new ATOM 0 HG23 VAL A 262 -1.383 3.617 0.779 1.00 0.00 H new ATOM 738 N GLU A 263 -0.067 8.280 -0.880 1.00 0.00 N ATOM 739 CA GLU A 263 -0.237 9.559 -1.559 1.00 0.00 C ATOM 740 C GLU A 263 0.402 9.529 -2.945 1.00 0.00 C ATOM 741 O GLU A 263 1.620 9.638 -3.081 1.00 0.00 O ATOM 742 CB GLU A 263 0.374 10.689 -0.728 1.00 0.00 C ATOM 743 CG GLU A 263 0.366 12.035 -1.432 1.00 0.00 C ATOM 744 CD GLU A 263 0.997 13.133 -0.598 1.00 0.00 C ATOM 745 OE1 GLU A 263 0.892 13.070 0.644 1.00 0.00 O ATOM 746 OE2 GLU A 263 1.596 14.056 -1.189 1.00 0.00 O ATOM 0 H GLU A 263 0.905 8.008 -0.730 1.00 0.00 H new ATOM 0 HA GLU A 263 -1.306 9.740 -1.674 1.00 0.00 H new ATOM 0 HB2 GLU A 263 -0.174 10.776 0.210 1.00 0.00 H new ATOM 0 HB3 GLU A 263 1.401 10.427 -0.474 1.00 0.00 H new ATOM 0 HG2 GLU A 263 0.901 11.949 -2.378 1.00 0.00 H new ATOM 0 HG3 GLU A 263 -0.661 12.310 -1.671 1.00 0.00 H new ATOM 753 N PHE A 264 -0.430 9.379 -3.970 1.00 0.00 N ATOM 754 CA PHE A 264 0.052 9.332 -5.346 1.00 0.00 C ATOM 755 C PHE A 264 0.587 10.693 -5.780 1.00 0.00 C ATOM 756 O PHE A 264 0.247 11.723 -5.196 1.00 0.00 O ATOM 757 CB PHE A 264 -1.069 8.888 -6.287 1.00 0.00 C ATOM 758 CG PHE A 264 -1.306 7.405 -6.280 1.00 0.00 C ATOM 759 CD1 PHE A 264 -1.742 6.765 -5.131 1.00 0.00 C ATOM 760 CD2 PHE A 264 -1.092 6.650 -7.422 1.00 0.00 C ATOM 761 CE1 PHE A 264 -1.959 5.400 -5.121 1.00 0.00 C ATOM 762 CE2 PHE A 264 -1.309 5.285 -7.418 1.00 0.00 C ATOM 763 CZ PHE A 264 -1.744 4.660 -6.267 1.00 0.00 C ATOM 0 H PHE A 264 -1.441 9.288 -3.874 1.00 0.00 H new ATOM 0 HA PHE A 264 0.865 8.608 -5.396 1.00 0.00 H new ATOM 0 HB2 PHE A 264 -1.991 9.396 -6.006 1.00 0.00 H new ATOM 0 HB3 PHE A 264 -0.827 9.204 -7.302 1.00 0.00 H new ATOM 0 HD1 PHE A 264 -1.914 7.339 -4.233 1.00 0.00 H new ATOM 0 HD2 PHE A 264 -0.752 7.134 -8.326 1.00 0.00 H new ATOM 0 HE1 PHE A 264 -2.296 4.913 -4.218 1.00 0.00 H new ATOM 0 HE2 PHE A 264 -1.138 4.708 -8.315 1.00 0.00 H new ATOM 0 HZ PHE A 264 -1.916 3.594 -6.263 1.00 0.00 H new ATOM 773 N LEU A 265 1.428 10.691 -6.809 1.00 0.00 N ATOM 774 CA LEU A 265 2.012 11.924 -7.324 1.00 0.00 C ATOM 775 C LEU A 265 1.087 12.580 -8.344 1.00 0.00 C ATOM 776 O LEU A 265 1.061 13.804 -8.475 1.00 0.00 O ATOM 777 CB LEU A 265 3.374 11.641 -7.960 1.00 0.00 C ATOM 778 CG LEU A 265 4.422 11.006 -7.046 1.00 0.00 C ATOM 779 CD1 LEU A 265 5.615 10.523 -7.857 1.00 0.00 C ATOM 780 CD2 LEU A 265 4.867 11.995 -5.978 1.00 0.00 C ATOM 0 H LEU A 265 1.721 9.848 -7.303 1.00 0.00 H new ATOM 0 HA LEU A 265 2.145 12.610 -6.488 1.00 0.00 H new ATOM 0 HB2 LEU A 265 3.223 10.985 -8.817 1.00 0.00 H new ATOM 0 HB3 LEU A 265 3.776 12.579 -8.343 1.00 0.00 H new ATOM 0 HG LEU A 265 3.972 10.145 -6.552 1.00 0.00 H new ATOM 0 HD11 LEU A 265 6.351 10.074 -7.190 1.00 0.00 H new ATOM 0 HD12 LEU A 265 5.284 9.782 -8.584 1.00 0.00 H new ATOM 0 HD13 LEU A 265 6.066 11.367 -8.379 1.00 0.00 H new ATOM 0 HD21 LEU A 265 5.613 11.526 -5.336 1.00 0.00 H new ATOM 0 HD22 LEU A 265 5.299 12.875 -6.454 1.00 0.00 H new ATOM 0 HD23 LEU A 265 4.008 12.293 -5.377 1.00 0.00 H new ATOM 792 N GLU A 266 0.330 11.758 -9.064 1.00 0.00 N ATOM 793 CA GLU A 266 -0.597 12.259 -10.071 1.00 0.00 C ATOM 794 C GLU A 266 -2.041 11.956 -9.682 1.00 0.00 C ATOM 795 O GLU A 266 -2.380 10.845 -9.274 1.00 0.00 O ATOM 796 CB GLU A 266 -0.285 11.641 -11.436 1.00 0.00 C ATOM 797 CG GLU A 266 -0.869 12.417 -12.604 1.00 0.00 C ATOM 798 CD GLU A 266 -0.117 13.704 -12.884 1.00 0.00 C ATOM 799 OE1 GLU A 266 1.120 13.644 -13.046 1.00 0.00 O ATOM 800 OE2 GLU A 266 -0.765 14.770 -12.942 1.00 0.00 O ATOM 0 H GLU A 266 0.341 10.743 -8.968 1.00 0.00 H new ATOM 0 HA GLU A 266 -0.475 13.340 -10.133 1.00 0.00 H new ATOM 0 HB2 GLU A 266 0.796 11.577 -11.558 1.00 0.00 H new ATOM 0 HB3 GLU A 266 -0.669 10.621 -11.460 1.00 0.00 H new ATOM 0 HG2 GLU A 266 -0.854 11.790 -13.496 1.00 0.00 H new ATOM 0 HG3 GLU A 266 -1.913 12.649 -12.395 1.00 0.00 H new ATOM 807 N PRO A 267 -2.913 12.967 -9.810 1.00 0.00 N ATOM 808 CA PRO A 267 -4.334 12.834 -9.477 1.00 0.00 C ATOM 809 C PRO A 267 -5.079 11.938 -10.460 1.00 0.00 C ATOM 810 O PRO A 267 -5.983 11.195 -10.077 1.00 0.00 O ATOM 811 CB PRO A 267 -4.855 14.271 -9.563 1.00 0.00 C ATOM 812 CG PRO A 267 -3.924 14.955 -10.503 1.00 0.00 C ATOM 813 CD PRO A 267 -2.578 14.318 -10.291 1.00 0.00 C ATOM 0 HA PRO A 267 -4.482 12.370 -8.502 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -5.881 14.299 -9.931 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -4.854 14.752 -8.585 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -4.254 14.835 -11.535 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -3.885 16.026 -10.303 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -1.999 14.284 -11.214 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -1.983 14.868 -9.562 1.00 0.00 H new ATOM 821 N LEU A 268 -4.692 12.011 -11.729 1.00 0.00 N ATOM 822 CA LEU A 268 -5.324 11.206 -12.769 1.00 0.00 C ATOM 823 C LEU A 268 -5.062 9.720 -12.541 1.00 0.00 C ATOM 824 O LEU A 268 -5.985 8.908 -12.563 1.00 0.00 O ATOM 825 CB LEU A 268 -4.806 11.621 -14.148 1.00 0.00 C ATOM 826 CG LEU A 268 -5.322 12.957 -14.684 1.00 0.00 C ATOM 827 CD1 LEU A 268 -4.444 13.450 -15.823 1.00 0.00 C ATOM 828 CD2 LEU A 268 -6.768 12.825 -15.141 1.00 0.00 C ATOM 0 H LEU A 268 -3.944 12.619 -12.063 1.00 0.00 H new ATOM 0 HA LEU A 268 -6.399 11.378 -12.725 1.00 0.00 H new ATOM 0 HB2 LEU A 268 -3.718 11.665 -14.107 1.00 0.00 H new ATOM 0 HB3 LEU A 268 -5.067 10.840 -14.862 1.00 0.00 H new ATOM 0 HG LEU A 268 -5.282 13.690 -13.878 1.00 0.00 H new ATOM 0 HD11 LEU A 268 -4.827 14.402 -16.192 1.00 0.00 H new ATOM 0 HD12 LEU A 268 -3.423 13.584 -15.464 1.00 0.00 H new ATOM 0 HD13 LEU A 268 -4.452 12.718 -16.631 1.00 0.00 H new ATOM 0 HD21 LEU A 268 -7.119 13.785 -15.519 1.00 0.00 H new ATOM 0 HD22 LEU A 268 -6.833 12.078 -15.932 1.00 0.00 H new ATOM 0 HD23 LEU A 268 -7.389 12.518 -14.299 1.00 0.00 H new ATOM 840 N GLU A 269 -3.797 9.375 -12.321 1.00 0.00 N ATOM 841 CA GLU A 269 -3.415 7.987 -12.088 1.00 0.00 C ATOM 842 C GLU A 269 -4.027 7.465 -10.791 1.00 0.00 C ATOM 843 O GLU A 269 -4.520 6.338 -10.735 1.00 0.00 O ATOM 844 CB GLU A 269 -1.891 7.856 -12.034 1.00 0.00 C ATOM 845 CG GLU A 269 -1.232 7.854 -13.403 1.00 0.00 C ATOM 846 CD GLU A 269 -1.097 6.460 -13.983 1.00 0.00 C ATOM 847 OE1 GLU A 269 -2.128 5.880 -14.384 1.00 0.00 O ATOM 848 OE2 GLU A 269 0.042 5.948 -14.037 1.00 0.00 O ATOM 0 H GLU A 269 -3.021 10.036 -12.299 1.00 0.00 H new ATOM 0 HA GLU A 269 -3.795 7.389 -12.916 1.00 0.00 H new ATOM 0 HB2 GLU A 269 -1.485 8.679 -11.446 1.00 0.00 H new ATOM 0 HB3 GLU A 269 -1.632 6.934 -11.514 1.00 0.00 H new ATOM 0 HG2 GLU A 269 -1.817 8.472 -14.084 1.00 0.00 H new ATOM 0 HG3 GLU A 269 -0.245 8.309 -13.327 1.00 0.00 H new ATOM 855 N ALA A 270 -3.992 8.292 -9.752 1.00 0.00 N ATOM 856 CA ALA A 270 -4.544 7.915 -8.456 1.00 0.00 C ATOM 857 C ALA A 270 -5.993 7.460 -8.589 1.00 0.00 C ATOM 858 O ALA A 270 -6.377 6.418 -8.057 1.00 0.00 O ATOM 859 CB ALA A 270 -4.441 9.078 -7.481 1.00 0.00 C ATOM 0 H ALA A 270 -3.587 9.228 -9.782 1.00 0.00 H new ATOM 0 HA ALA A 270 -3.962 7.078 -8.069 1.00 0.00 H new ATOM 0 HB1 ALA A 270 -4.857 8.783 -6.518 1.00 0.00 H new ATOM 0 HB2 ALA A 270 -3.394 9.356 -7.355 1.00 0.00 H new ATOM 0 HB3 ALA A 270 -4.998 9.930 -7.871 1.00 0.00 H new ATOM 865 N ARG A 271 -6.793 8.247 -9.300 1.00 0.00 N ATOM 866 CA ARG A 271 -8.201 7.926 -9.500 1.00 0.00 C ATOM 867 C ARG A 271 -8.356 6.610 -10.257 1.00 0.00 C ATOM 868 O ARG A 271 -9.135 5.742 -9.863 1.00 0.00 O ATOM 869 CB ARG A 271 -8.900 9.052 -10.264 1.00 0.00 C ATOM 870 CG ARG A 271 -9.350 10.202 -9.378 1.00 0.00 C ATOM 871 CD ARG A 271 -10.227 11.182 -10.140 1.00 0.00 C ATOM 872 NE ARG A 271 -10.920 12.106 -9.246 1.00 0.00 N ATOM 873 CZ ARG A 271 -12.068 11.822 -8.642 1.00 0.00 C ATOM 874 NH1 ARG A 271 -12.649 10.646 -8.834 1.00 0.00 N ATOM 875 NH2 ARG A 271 -12.637 12.716 -7.843 1.00 0.00 N ATOM 0 H ARG A 271 -6.490 9.112 -9.748 1.00 0.00 H new ATOM 0 HA ARG A 271 -8.666 7.819 -8.520 1.00 0.00 H new ATOM 0 HB2 ARG A 271 -8.223 9.436 -11.027 1.00 0.00 H new ATOM 0 HB3 ARG A 271 -9.767 8.644 -10.783 1.00 0.00 H new ATOM 0 HG2 ARG A 271 -9.899 9.810 -8.522 1.00 0.00 H new ATOM 0 HG3 ARG A 271 -8.477 10.723 -8.985 1.00 0.00 H new ATOM 0 HD2 ARG A 271 -9.614 11.748 -10.841 1.00 0.00 H new ATOM 0 HD3 ARG A 271 -10.959 10.630 -10.730 1.00 0.00 H new ATOM 0 HE ARG A 271 -10.499 13.019 -9.076 1.00 0.00 H new ATOM 0 HH11 ARG A 271 -12.214 9.956 -9.447 1.00 0.00 H new ATOM 0 HH12 ARG A 271 -13.531 10.431 -8.369 1.00 0.00 H new ATOM 0 HH21 ARG A 271 -12.193 13.622 -7.693 1.00 0.00 H new ATOM 0 HH22 ARG A 271 -13.519 12.497 -7.379 1.00 0.00 H new ATOM 889 N LYS A 272 -7.609 6.469 -11.347 1.00 0.00 N ATOM 890 CA LYS A 272 -7.661 5.260 -12.160 1.00 0.00 C ATOM 891 C LYS A 272 -7.457 4.017 -11.300 1.00 0.00 C ATOM 892 O LYS A 272 -8.321 3.143 -11.242 1.00 0.00 O ATOM 893 CB LYS A 272 -6.597 5.313 -13.259 1.00 0.00 C ATOM 894 CG LYS A 272 -6.552 4.065 -14.123 1.00 0.00 C ATOM 895 CD LYS A 272 -5.223 3.936 -14.847 1.00 0.00 C ATOM 896 CE LYS A 272 -4.214 3.148 -14.025 1.00 0.00 C ATOM 897 NZ LYS A 272 -2.837 3.264 -14.578 1.00 0.00 N ATOM 0 H LYS A 272 -6.960 7.178 -11.688 1.00 0.00 H new ATOM 0 HA LYS A 272 -8.647 5.204 -12.620 1.00 0.00 H new ATOM 0 HB2 LYS A 272 -6.786 6.178 -13.895 1.00 0.00 H new ATOM 0 HB3 LYS A 272 -5.620 5.462 -12.800 1.00 0.00 H new ATOM 0 HG2 LYS A 272 -6.716 3.185 -13.501 1.00 0.00 H new ATOM 0 HG3 LYS A 272 -7.363 4.096 -14.851 1.00 0.00 H new ATOM 0 HD2 LYS A 272 -5.377 3.442 -15.807 1.00 0.00 H new ATOM 0 HD3 LYS A 272 -4.825 4.928 -15.059 1.00 0.00 H new ATOM 0 HE2 LYS A 272 -4.224 3.508 -12.996 1.00 0.00 H new ATOM 0 HE3 LYS A 272 -4.508 2.099 -13.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 272 -2.273 2.443 -14.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 272 -2.881 3.295 -15.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 272 -2.393 4.135 -14.224 1.00 0.00 H new ATOM 911 N ALA A 273 -6.310 3.946 -10.634 1.00 0.00 N ATOM 912 CA ALA A 273 -5.994 2.812 -9.774 1.00 0.00 C ATOM 913 C ALA A 273 -7.114 2.555 -8.771 1.00 0.00 C ATOM 914 O ALA A 273 -7.534 1.414 -8.573 1.00 0.00 O ATOM 915 CB ALA A 273 -4.678 3.049 -9.049 1.00 0.00 C ATOM 0 H ALA A 273 -5.583 4.661 -10.673 1.00 0.00 H new ATOM 0 HA ALA A 273 -5.895 1.928 -10.403 1.00 0.00 H new ATOM 0 HB1 ALA A 273 -4.455 2.194 -8.411 1.00 0.00 H new ATOM 0 HB2 ALA A 273 -3.878 3.175 -9.779 1.00 0.00 H new ATOM 0 HB3 ALA A 273 -4.756 3.948 -8.437 1.00 0.00 H new ATOM 921 N PHE A 274 -7.594 3.622 -8.141 1.00 0.00 N ATOM 922 CA PHE A 274 -8.664 3.511 -7.157 1.00 0.00 C ATOM 923 C PHE A 274 -9.822 2.683 -7.704 1.00 0.00 C ATOM 924 O PHE A 274 -10.259 1.717 -7.077 1.00 0.00 O ATOM 925 CB PHE A 274 -9.161 4.901 -6.755 1.00 0.00 C ATOM 926 CG PHE A 274 -10.247 4.873 -5.718 1.00 0.00 C ATOM 927 CD1 PHE A 274 -11.579 4.798 -6.092 1.00 0.00 C ATOM 928 CD2 PHE A 274 -9.936 4.921 -4.368 1.00 0.00 C ATOM 929 CE1 PHE A 274 -12.581 4.771 -5.140 1.00 0.00 C ATOM 930 CE2 PHE A 274 -10.934 4.894 -3.412 1.00 0.00 C ATOM 931 CZ PHE A 274 -12.258 4.820 -3.798 1.00 0.00 C ATOM 0 H PHE A 274 -7.259 4.573 -8.294 1.00 0.00 H new ATOM 0 HA PHE A 274 -8.264 3.007 -6.277 1.00 0.00 H new ATOM 0 HB2 PHE A 274 -8.321 5.482 -6.374 1.00 0.00 H new ATOM 0 HB3 PHE A 274 -9.530 5.417 -7.642 1.00 0.00 H new ATOM 0 HD1 PHE A 274 -11.838 4.760 -7.140 1.00 0.00 H new ATOM 0 HD2 PHE A 274 -8.903 4.980 -4.060 1.00 0.00 H new ATOM 0 HE1 PHE A 274 -13.615 4.712 -5.445 1.00 0.00 H new ATOM 0 HE2 PHE A 274 -10.678 4.931 -2.363 1.00 0.00 H new ATOM 0 HZ PHE A 274 -13.039 4.800 -3.052 1.00 0.00 H new ATOM 941 N ARG A 275 -10.316 3.068 -8.876 1.00 0.00 N ATOM 942 CA ARG A 275 -11.425 2.363 -9.508 1.00 0.00 C ATOM 943 C ARG A 275 -11.108 0.878 -9.660 1.00 0.00 C ATOM 944 O ARG A 275 -11.913 0.020 -9.295 1.00 0.00 O ATOM 945 CB ARG A 275 -11.732 2.973 -10.877 1.00 0.00 C ATOM 946 CG ARG A 275 -12.378 4.346 -10.800 1.00 0.00 C ATOM 947 CD ARG A 275 -12.854 4.815 -12.166 1.00 0.00 C ATOM 948 NE ARG A 275 -11.740 5.088 -13.070 1.00 0.00 N ATOM 949 CZ ARG A 275 -11.084 6.242 -13.100 1.00 0.00 C ATOM 950 NH1 ARG A 275 -11.428 7.226 -12.279 1.00 0.00 N ATOM 951 NH2 ARG A 275 -10.080 6.415 -13.951 1.00 0.00 N ATOM 0 H ARG A 275 -9.966 3.865 -9.408 1.00 0.00 H new ATOM 0 HA ARG A 275 -12.301 2.467 -8.868 1.00 0.00 H new ATOM 0 HB2 ARG A 275 -10.807 3.048 -11.448 1.00 0.00 H new ATOM 0 HB3 ARG A 275 -12.392 2.301 -11.425 1.00 0.00 H new ATOM 0 HG2 ARG A 275 -13.222 4.314 -10.111 1.00 0.00 H new ATOM 0 HG3 ARG A 275 -11.663 5.063 -10.396 1.00 0.00 H new ATOM 0 HD2 ARG A 275 -13.500 4.055 -12.606 1.00 0.00 H new ATOM 0 HD3 ARG A 275 -13.456 5.716 -12.050 1.00 0.00 H new ATOM 0 HE ARG A 275 -11.450 4.352 -13.714 1.00 0.00 H new ATOM 0 HH11 ARG A 275 -12.198 7.097 -11.623 1.00 0.00 H new ATOM 0 HH12 ARG A 275 -10.922 8.111 -12.304 1.00 0.00 H new ATOM 0 HH21 ARG A 275 -9.812 5.661 -14.583 1.00 0.00 H new ATOM 0 HH22 ARG A 275 -9.577 7.302 -13.973 1.00 0.00 H new ATOM 965 N HIS A 276 -9.931 0.581 -10.202 1.00 0.00 N ATOM 966 CA HIS A 276 -9.508 -0.800 -10.403 1.00 0.00 C ATOM 967 C HIS A 276 -9.415 -1.539 -9.071 1.00 0.00 C ATOM 968 O HIS A 276 -10.161 -2.486 -8.822 1.00 0.00 O ATOM 969 CB HIS A 276 -8.157 -0.843 -11.119 1.00 0.00 C ATOM 970 CG HIS A 276 -8.139 -0.082 -12.408 1.00 0.00 C ATOM 971 ND1 HIS A 276 -9.075 -0.265 -13.404 1.00 0.00 N ATOM 972 CD2 HIS A 276 -7.290 0.870 -12.863 1.00 0.00 C ATOM 973 CE1 HIS A 276 -8.803 0.540 -14.415 1.00 0.00 C ATOM 974 NE2 HIS A 276 -7.724 1.240 -14.112 1.00 0.00 N ATOM 0 H HIS A 276 -9.253 1.278 -10.510 1.00 0.00 H new ATOM 0 HA HIS A 276 -10.255 -1.296 -11.023 1.00 0.00 H new ATOM 0 HB2 HIS A 276 -7.391 -0.439 -10.457 1.00 0.00 H new ATOM 0 HB3 HIS A 276 -7.892 -1.882 -11.316 1.00 0.00 H new ATOM 0 HD1 HIS A 276 -9.856 -0.920 -13.366 1.00 0.00 H new ATOM 0 HD2 HIS A 276 -6.431 1.265 -12.341 1.00 0.00 H new ATOM 0 HE1 HIS A 276 -9.367 0.614 -15.333 1.00 0.00 H new ATOM 983 N LEU A 277 -8.495 -1.100 -8.220 1.00 0.00 N ATOM 984 CA LEU A 277 -8.303 -1.720 -6.913 1.00 0.00 C ATOM 985 C LEU A 277 -9.628 -1.836 -6.166 1.00 0.00 C ATOM 986 O LEU A 277 -9.806 -2.722 -5.331 1.00 0.00 O ATOM 987 CB LEU A 277 -7.306 -0.910 -6.083 1.00 0.00 C ATOM 988 CG LEU A 277 -5.963 -0.613 -6.751 1.00 0.00 C ATOM 989 CD1 LEU A 277 -5.035 0.110 -5.786 1.00 0.00 C ATOM 990 CD2 LEU A 277 -5.319 -1.898 -7.251 1.00 0.00 C ATOM 0 H LEU A 277 -7.870 -0.317 -8.411 1.00 0.00 H new ATOM 0 HA LEU A 277 -7.905 -2.723 -7.069 1.00 0.00 H new ATOM 0 HB2 LEU A 277 -7.773 0.037 -5.814 1.00 0.00 H new ATOM 0 HB3 LEU A 277 -7.116 -1.447 -5.154 1.00 0.00 H new ATOM 0 HG LEU A 277 -6.142 0.037 -7.608 1.00 0.00 H new ATOM 0 HD11 LEU A 277 -4.084 0.313 -6.279 1.00 0.00 H new ATOM 0 HD12 LEU A 277 -5.492 1.050 -5.477 1.00 0.00 H new ATOM 0 HD13 LEU A 277 -4.863 -0.515 -4.909 1.00 0.00 H new ATOM 0 HD21 LEU A 277 -4.364 -1.667 -7.723 1.00 0.00 H new ATOM 0 HD22 LEU A 277 -5.154 -2.573 -6.411 1.00 0.00 H new ATOM 0 HD23 LEU A 277 -5.977 -2.376 -7.977 1.00 0.00 H new ATOM 1002 N ALA A 278 -10.556 -0.935 -6.474 1.00 0.00 N ATOM 1003 CA ALA A 278 -11.866 -0.939 -5.835 1.00 0.00 C ATOM 1004 C ALA A 278 -12.642 -2.205 -6.182 1.00 0.00 C ATOM 1005 O ALA A 278 -12.603 -2.677 -7.318 1.00 0.00 O ATOM 1006 CB ALA A 278 -12.656 0.296 -6.244 1.00 0.00 C ATOM 0 H ALA A 278 -10.424 -0.193 -7.162 1.00 0.00 H new ATOM 0 HA ALA A 278 -11.717 -0.920 -4.755 1.00 0.00 H new ATOM 0 HB1 ALA A 278 -13.632 0.280 -5.760 1.00 0.00 H new ATOM 0 HB2 ALA A 278 -12.114 1.192 -5.940 1.00 0.00 H new ATOM 0 HB3 ALA A 278 -12.788 0.302 -7.326 1.00 0.00 H new ATOM 1012 N TYR A 279 -13.346 -2.750 -5.196 1.00 0.00 N ATOM 1013 CA TYR A 279 -14.129 -3.964 -5.396 1.00 0.00 C ATOM 1014 C TYR A 279 -13.228 -5.139 -5.763 1.00 0.00 C ATOM 1015 O TYR A 279 -13.537 -5.915 -6.667 1.00 0.00 O ATOM 1016 CB TYR A 279 -15.174 -3.747 -6.492 1.00 0.00 C ATOM 1017 CG TYR A 279 -16.230 -2.728 -6.128 1.00 0.00 C ATOM 1018 CD1 TYR A 279 -17.264 -3.050 -5.258 1.00 0.00 C ATOM 1019 CD2 TYR A 279 -16.194 -1.442 -6.654 1.00 0.00 C ATOM 1020 CE1 TYR A 279 -18.231 -2.123 -4.923 1.00 0.00 C ATOM 1021 CE2 TYR A 279 -17.157 -0.508 -6.324 1.00 0.00 C ATOM 1022 CZ TYR A 279 -18.173 -0.853 -5.459 1.00 0.00 C ATOM 1023 OH TYR A 279 -19.135 0.074 -5.127 1.00 0.00 O ATOM 0 H TYR A 279 -13.391 -2.370 -4.250 1.00 0.00 H new ATOM 0 HA TYR A 279 -14.636 -4.197 -4.460 1.00 0.00 H new ATOM 0 HB2 TYR A 279 -14.671 -3.426 -7.404 1.00 0.00 H new ATOM 0 HB3 TYR A 279 -15.659 -4.698 -6.713 1.00 0.00 H new ATOM 0 HD1 TYR A 279 -17.312 -4.043 -4.836 1.00 0.00 H new ATOM 0 HD2 TYR A 279 -15.400 -1.168 -7.332 1.00 0.00 H new ATOM 0 HE1 TYR A 279 -19.028 -2.391 -4.245 1.00 0.00 H new ATOM 0 HE2 TYR A 279 -17.114 0.487 -6.742 1.00 0.00 H new ATOM 0 HH TYR A 279 -18.949 0.918 -5.588 1.00 0.00 H new ATOM 1033 N SER A 280 -12.111 -5.264 -5.053 1.00 0.00 N ATOM 1034 CA SER A 280 -11.162 -6.342 -5.304 1.00 0.00 C ATOM 1035 C SER A 280 -10.611 -6.898 -3.994 1.00 0.00 C ATOM 1036 O SER A 280 -10.983 -6.447 -2.910 1.00 0.00 O ATOM 1037 CB SER A 280 -10.013 -5.845 -6.183 1.00 0.00 C ATOM 1038 OG SER A 280 -10.391 -5.818 -7.549 1.00 0.00 O ATOM 0 H SER A 280 -11.841 -4.632 -4.299 1.00 0.00 H new ATOM 0 HA SER A 280 -11.689 -7.142 -5.825 1.00 0.00 H new ATOM 0 HB2 SER A 280 -9.714 -4.846 -5.865 1.00 0.00 H new ATOM 0 HB3 SER A 280 -9.146 -6.493 -6.055 1.00 0.00 H new ATOM 0 HG SER A 280 -11.368 -5.841 -7.619 1.00 0.00 H new ATOM 1044 N LYS A 281 -9.722 -7.879 -4.102 1.00 0.00 N ATOM 1045 CA LYS A 281 -9.118 -8.497 -2.928 1.00 0.00 C ATOM 1046 C LYS A 281 -7.596 -8.482 -3.028 1.00 0.00 C ATOM 1047 O LYS A 281 -7.034 -8.636 -4.113 1.00 0.00 O ATOM 1048 CB LYS A 281 -9.615 -9.936 -2.770 1.00 0.00 C ATOM 1049 CG LYS A 281 -10.984 -10.038 -2.119 1.00 0.00 C ATOM 1050 CD LYS A 281 -11.721 -11.289 -2.566 1.00 0.00 C ATOM 1051 CE LYS A 281 -12.558 -11.029 -3.809 1.00 0.00 C ATOM 1052 NZ LYS A 281 -11.732 -11.047 -5.048 1.00 0.00 N ATOM 0 H LYS A 281 -9.404 -8.264 -4.991 1.00 0.00 H new ATOM 0 HA LYS A 281 -9.413 -7.919 -2.052 1.00 0.00 H new ATOM 0 HB2 LYS A 281 -9.652 -10.409 -3.752 1.00 0.00 H new ATOM 0 HB3 LYS A 281 -8.895 -10.497 -2.173 1.00 0.00 H new ATOM 0 HG2 LYS A 281 -10.873 -10.048 -1.035 1.00 0.00 H new ATOM 0 HG3 LYS A 281 -11.574 -9.157 -2.371 1.00 0.00 H new ATOM 0 HD2 LYS A 281 -11.002 -12.083 -2.770 1.00 0.00 H new ATOM 0 HD3 LYS A 281 -12.365 -11.641 -1.760 1.00 0.00 H new ATOM 0 HE2 LYS A 281 -13.341 -11.783 -3.884 1.00 0.00 H new ATOM 0 HE3 LYS A 281 -13.054 -10.063 -3.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 -12.308 -11.388 -5.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 -11.393 -10.086 -5.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 -10.918 -11.680 -4.913 1.00 0.00 H new ATOM 1066 N PHE A 282 -6.934 -8.299 -1.891 1.00 0.00 N ATOM 1067 CA PHE A 282 -5.476 -8.265 -1.851 1.00 0.00 C ATOM 1068 C PHE A 282 -4.906 -9.663 -1.635 1.00 0.00 C ATOM 1069 O PHE A 282 -4.234 -10.214 -2.507 1.00 0.00 O ATOM 1070 CB PHE A 282 -4.997 -7.328 -0.740 1.00 0.00 C ATOM 1071 CG PHE A 282 -3.586 -7.593 -0.300 1.00 0.00 C ATOM 1072 CD1 PHE A 282 -2.514 -7.143 -1.055 1.00 0.00 C ATOM 1073 CD2 PHE A 282 -3.330 -8.293 0.868 1.00 0.00 C ATOM 1074 CE1 PHE A 282 -1.214 -7.385 -0.653 1.00 0.00 C ATOM 1075 CE2 PHE A 282 -2.032 -8.538 1.275 1.00 0.00 C ATOM 1076 CZ PHE A 282 -0.973 -8.084 0.514 1.00 0.00 C ATOM 0 H PHE A 282 -7.384 -8.172 -0.984 1.00 0.00 H new ATOM 0 HA PHE A 282 -5.119 -7.891 -2.811 1.00 0.00 H new ATOM 0 HB2 PHE A 282 -5.074 -6.297 -1.087 1.00 0.00 H new ATOM 0 HB3 PHE A 282 -5.661 -7.426 0.119 1.00 0.00 H new ATOM 0 HD1 PHE A 282 -2.697 -6.597 -1.968 1.00 0.00 H new ATOM 0 HD2 PHE A 282 -4.154 -8.651 1.467 1.00 0.00 H new ATOM 0 HE1 PHE A 282 -0.388 -7.028 -1.250 1.00 0.00 H new ATOM 0 HE2 PHE A 282 -1.846 -9.084 2.188 1.00 0.00 H new ATOM 0 HZ PHE A 282 0.042 -8.275 0.831 1.00 0.00 H new ATOM 1086 N HIS A 283 -5.178 -10.232 -0.464 1.00 0.00 N ATOM 1087 CA HIS A 283 -4.692 -11.567 -0.132 1.00 0.00 C ATOM 1088 C HIS A 283 -5.853 -12.504 0.185 1.00 0.00 C ATOM 1089 O HIS A 283 -6.186 -13.386 -0.607 1.00 0.00 O ATOM 1090 CB HIS A 283 -3.733 -11.502 1.058 1.00 0.00 C ATOM 1091 CG HIS A 283 -2.306 -11.272 0.666 1.00 0.00 C ATOM 1092 ND1 HIS A 283 -1.260 -11.341 1.561 1.00 0.00 N ATOM 1093 CD2 HIS A 283 -1.755 -10.975 -0.534 1.00 0.00 C ATOM 1094 CE1 HIS A 283 -0.126 -11.094 0.929 1.00 0.00 C ATOM 1095 NE2 HIS A 283 -0.399 -10.870 -0.344 1.00 0.00 N ATOM 0 H HIS A 283 -5.732 -9.790 0.270 1.00 0.00 H new ATOM 0 HA HIS A 283 -4.158 -11.959 -0.998 1.00 0.00 H new ATOM 0 HB2 HIS A 283 -4.051 -10.702 1.727 1.00 0.00 H new ATOM 0 HB3 HIS A 283 -3.801 -12.433 1.620 1.00 0.00 H new ATOM 0 HD2 HIS A 283 -2.283 -10.845 -1.467 1.00 0.00 H new ATOM 0 HE1 HIS A 283 0.857 -11.078 1.377 1.00 0.00 H new ATOM 0 HE2 HIS A 283 0.286 -10.654 -1.068 1.00 0.00 H new ATOM 1104 N HIS A 284 -6.464 -12.308 1.349 1.00 0.00 N ATOM 1105 CA HIS A 284 -7.588 -13.137 1.771 1.00 0.00 C ATOM 1106 C HIS A 284 -8.783 -12.273 2.162 1.00 0.00 C ATOM 1107 O HIS A 284 -9.903 -12.767 2.294 1.00 0.00 O ATOM 1108 CB HIS A 284 -7.180 -14.026 2.947 1.00 0.00 C ATOM 1109 CG HIS A 284 -6.327 -13.326 3.959 1.00 0.00 C ATOM 1110 ND1 HIS A 284 -6.841 -12.725 5.089 1.00 0.00 N ATOM 1111 CD2 HIS A 284 -4.988 -13.135 4.009 1.00 0.00 C ATOM 1112 CE1 HIS A 284 -5.854 -12.192 5.789 1.00 0.00 C ATOM 1113 NE2 HIS A 284 -4.720 -12.428 5.155 1.00 0.00 N ATOM 0 H HIS A 284 -6.200 -11.583 2.016 1.00 0.00 H new ATOM 0 HA HIS A 284 -7.878 -13.769 0.931 1.00 0.00 H new ATOM 0 HB2 HIS A 284 -8.078 -14.400 3.438 1.00 0.00 H new ATOM 0 HB3 HIS A 284 -6.640 -14.893 2.566 1.00 0.00 H new ATOM 0 HD2 HIS A 284 -4.265 -13.475 3.283 1.00 0.00 H new ATOM 0 HE1 HIS A 284 -5.958 -11.655 6.720 1.00 0.00 H new ATOM 0 HE2 HIS A 284 -3.795 -12.133 5.466 1.00 0.00 H new ATOM 1122 N VAL A 285 -8.537 -10.980 2.346 1.00 0.00 N ATOM 1123 CA VAL A 285 -9.593 -10.047 2.722 1.00 0.00 C ATOM 1124 C VAL A 285 -9.822 -9.007 1.630 1.00 0.00 C ATOM 1125 O VAL A 285 -8.930 -8.694 0.841 1.00 0.00 O ATOM 1126 CB VAL A 285 -9.262 -9.325 4.041 1.00 0.00 C ATOM 1127 CG1 VAL A 285 -9.316 -10.297 5.210 1.00 0.00 C ATOM 1128 CG2 VAL A 285 -7.897 -8.658 3.955 1.00 0.00 C ATOM 0 H VAL A 285 -7.616 -10.555 2.241 1.00 0.00 H new ATOM 0 HA VAL A 285 -10.501 -10.635 2.857 1.00 0.00 H new ATOM 0 HB VAL A 285 -10.010 -8.550 4.209 1.00 0.00 H new ATOM 0 HG11 VAL A 285 -9.079 -9.769 6.134 1.00 0.00 H new ATOM 0 HG12 VAL A 285 -10.316 -10.724 5.282 1.00 0.00 H new ATOM 0 HG13 VAL A 285 -8.591 -11.096 5.053 1.00 0.00 H new ATOM 0 HG21 VAL A 285 -7.679 -8.152 4.896 1.00 0.00 H new ATOM 0 HG22 VAL A 285 -7.134 -9.413 3.764 1.00 0.00 H new ATOM 0 HG23 VAL A 285 -7.898 -7.930 3.144 1.00 0.00 H new ATOM 1138 N PRO A 286 -11.044 -8.458 1.583 1.00 0.00 N ATOM 1139 CA PRO A 286 -11.419 -7.444 0.593 1.00 0.00 C ATOM 1140 C PRO A 286 -10.722 -6.110 0.837 1.00 0.00 C ATOM 1141 O PRO A 286 -10.419 -5.756 1.978 1.00 0.00 O ATOM 1142 CB PRO A 286 -12.931 -7.301 0.785 1.00 0.00 C ATOM 1143 CG PRO A 286 -13.174 -7.719 2.195 1.00 0.00 C ATOM 1144 CD PRO A 286 -12.156 -8.784 2.492 1.00 0.00 C ATOM 0 HA PRO A 286 -11.130 -7.735 -0.417 1.00 0.00 H new ATOM 0 HB2 PRO A 286 -13.257 -6.275 0.614 1.00 0.00 H new ATOM 0 HB3 PRO A 286 -13.480 -7.930 0.085 1.00 0.00 H new ATOM 0 HG2 PRO A 286 -13.066 -6.875 2.876 1.00 0.00 H new ATOM 0 HG3 PRO A 286 -14.187 -8.102 2.320 1.00 0.00 H new ATOM 0 HD2 PRO A 286 -11.842 -8.760 3.536 1.00 0.00 H new ATOM 0 HD3 PRO A 286 -12.551 -9.782 2.301 1.00 0.00 H new ATOM 1152 N LEU A 287 -10.471 -5.373 -0.239 1.00 0.00 N ATOM 1153 CA LEU A 287 -9.810 -4.076 -0.141 1.00 0.00 C ATOM 1154 C LEU A 287 -10.829 -2.942 -0.171 1.00 0.00 C ATOM 1155 O LEU A 287 -11.553 -2.770 -1.152 1.00 0.00 O ATOM 1156 CB LEU A 287 -8.806 -3.906 -1.283 1.00 0.00 C ATOM 1157 CG LEU A 287 -7.456 -4.600 -1.099 1.00 0.00 C ATOM 1158 CD1 LEU A 287 -6.644 -4.537 -2.383 1.00 0.00 C ATOM 1159 CD2 LEU A 287 -6.685 -3.970 0.053 1.00 0.00 C ATOM 0 H LEU A 287 -10.715 -5.651 -1.190 1.00 0.00 H new ATOM 0 HA LEU A 287 -9.279 -4.037 0.810 1.00 0.00 H new ATOM 0 HB2 LEU A 287 -9.262 -4.280 -2.200 1.00 0.00 H new ATOM 0 HB3 LEU A 287 -8.627 -2.840 -1.427 1.00 0.00 H new ATOM 0 HG LEU A 287 -7.637 -5.648 -0.859 1.00 0.00 H new ATOM 0 HD11 LEU A 287 -5.687 -5.036 -2.233 1.00 0.00 H new ATOM 0 HD12 LEU A 287 -7.191 -5.034 -3.184 1.00 0.00 H new ATOM 0 HD13 LEU A 287 -6.472 -3.495 -2.654 1.00 0.00 H new ATOM 0 HD21 LEU A 287 -5.727 -4.476 0.170 1.00 0.00 H new ATOM 0 HD22 LEU A 287 -6.514 -2.914 -0.158 1.00 0.00 H new ATOM 0 HD23 LEU A 287 -7.261 -4.068 0.973 1.00 0.00 H new ATOM 1171 N TYR A 288 -10.878 -2.169 0.908 1.00 0.00 N ATOM 1172 CA TYR A 288 -11.809 -1.050 1.005 1.00 0.00 C ATOM 1173 C TYR A 288 -11.063 0.280 1.005 1.00 0.00 C ATOM 1174 O TYR A 288 -10.520 0.702 2.028 1.00 0.00 O ATOM 1175 CB TYR A 288 -12.656 -1.173 2.273 1.00 0.00 C ATOM 1176 CG TYR A 288 -13.580 -2.370 2.270 1.00 0.00 C ATOM 1177 CD1 TYR A 288 -14.315 -2.701 1.138 1.00 0.00 C ATOM 1178 CD2 TYR A 288 -13.720 -3.168 3.398 1.00 0.00 C ATOM 1179 CE1 TYR A 288 -15.162 -3.793 1.130 1.00 0.00 C ATOM 1180 CE2 TYR A 288 -14.563 -4.262 3.399 1.00 0.00 C ATOM 1181 CZ TYR A 288 -15.282 -4.570 2.263 1.00 0.00 C ATOM 1182 OH TYR A 288 -16.124 -5.659 2.261 1.00 0.00 O ATOM 0 H TYR A 288 -10.284 -2.296 1.728 1.00 0.00 H new ATOM 0 HA TYR A 288 -12.464 -1.078 0.134 1.00 0.00 H new ATOM 0 HB2 TYR A 288 -11.994 -1.237 3.137 1.00 0.00 H new ATOM 0 HB3 TYR A 288 -13.250 -0.267 2.393 1.00 0.00 H new ATOM 0 HD1 TYR A 288 -14.223 -2.094 0.249 1.00 0.00 H new ATOM 0 HD2 TYR A 288 -13.160 -2.929 4.290 1.00 0.00 H new ATOM 0 HE1 TYR A 288 -15.726 -4.036 0.242 1.00 0.00 H new ATOM 0 HE2 TYR A 288 -14.659 -4.873 4.284 1.00 0.00 H new ATOM 0 HH TYR A 288 -16.092 -6.099 3.136 1.00 0.00 H new ATOM 1192 N LEU A 289 -11.040 0.939 -0.148 1.00 0.00 N ATOM 1193 CA LEU A 289 -10.362 2.223 -0.283 1.00 0.00 C ATOM 1194 C LEU A 289 -11.263 3.366 0.173 1.00 0.00 C ATOM 1195 O LEU A 289 -12.478 3.325 -0.021 1.00 0.00 O ATOM 1196 CB LEU A 289 -9.932 2.445 -1.735 1.00 0.00 C ATOM 1197 CG LEU A 289 -8.928 1.439 -2.299 1.00 0.00 C ATOM 1198 CD1 LEU A 289 -8.658 1.722 -3.769 1.00 0.00 C ATOM 1199 CD2 LEU A 289 -7.633 1.473 -1.500 1.00 0.00 C ATOM 0 H LEU A 289 -11.484 0.605 -1.004 1.00 0.00 H new ATOM 0 HA LEU A 289 -9.477 2.207 0.353 1.00 0.00 H new ATOM 0 HB2 LEU A 289 -10.823 2.430 -2.363 1.00 0.00 H new ATOM 0 HB3 LEU A 289 -9.501 3.443 -1.817 1.00 0.00 H new ATOM 0 HG LEU A 289 -9.357 0.440 -2.215 1.00 0.00 H new ATOM 0 HD11 LEU A 289 -7.941 0.996 -4.154 1.00 0.00 H new ATOM 0 HD12 LEU A 289 -9.589 1.646 -4.331 1.00 0.00 H new ATOM 0 HD13 LEU A 289 -8.250 2.727 -3.877 1.00 0.00 H new ATOM 0 HD21 LEU A 289 -6.930 0.751 -1.915 1.00 0.00 H new ATOM 0 HD22 LEU A 289 -7.200 2.472 -1.552 1.00 0.00 H new ATOM 0 HD23 LEU A 289 -7.840 1.221 -0.460 1.00 0.00 H new ATOM 1211 N GLU A 290 -10.660 4.384 0.778 1.00 0.00 N ATOM 1212 CA GLU A 290 -11.409 5.538 1.260 1.00 0.00 C ATOM 1213 C GLU A 290 -10.570 6.809 1.166 1.00 0.00 C ATOM 1214 O GLU A 290 -9.658 7.024 1.964 1.00 0.00 O ATOM 1215 CB GLU A 290 -11.857 5.316 2.706 1.00 0.00 C ATOM 1216 CG GLU A 290 -13.033 4.362 2.838 1.00 0.00 C ATOM 1217 CD GLU A 290 -14.192 4.735 1.935 1.00 0.00 C ATOM 1218 OE1 GLU A 290 -14.413 5.945 1.721 1.00 0.00 O ATOM 1219 OE2 GLU A 290 -14.878 3.816 1.441 1.00 0.00 O ATOM 0 H GLU A 290 -9.655 4.433 0.946 1.00 0.00 H new ATOM 0 HA GLU A 290 -12.290 5.657 0.629 1.00 0.00 H new ATOM 0 HB2 GLU A 290 -11.018 4.927 3.282 1.00 0.00 H new ATOM 0 HB3 GLU A 290 -12.127 6.276 3.145 1.00 0.00 H new ATOM 0 HG2 GLU A 290 -12.704 3.350 2.601 1.00 0.00 H new ATOM 0 HG3 GLU A 290 -13.373 4.352 3.874 1.00 0.00 H new ATOM 1226 N TRP A 291 -10.884 7.647 0.185 1.00 0.00 N ATOM 1227 CA TRP A 291 -10.159 8.897 -0.015 1.00 0.00 C ATOM 1228 C TRP A 291 -9.814 9.545 1.322 1.00 0.00 C ATOM 1229 O TRP A 291 -10.498 9.330 2.322 1.00 0.00 O ATOM 1230 CB TRP A 291 -10.989 9.862 -0.864 1.00 0.00 C ATOM 1231 CG TRP A 291 -11.154 9.412 -2.284 1.00 0.00 C ATOM 1232 CD1 TRP A 291 -12.294 8.933 -2.864 1.00 0.00 C ATOM 1233 CD2 TRP A 291 -10.147 9.397 -3.301 1.00 0.00 C ATOM 1234 NE1 TRP A 291 -12.055 8.621 -4.181 1.00 0.00 N ATOM 1235 CE2 TRP A 291 -10.746 8.897 -4.474 1.00 0.00 C ATOM 1236 CE3 TRP A 291 -8.797 9.759 -3.336 1.00 0.00 C ATOM 1237 CZ2 TRP A 291 -10.041 8.750 -5.665 1.00 0.00 C ATOM 1238 CZ3 TRP A 291 -8.099 9.612 -4.519 1.00 0.00 C ATOM 1239 CH2 TRP A 291 -8.721 9.112 -5.671 1.00 0.00 C ATOM 0 H TRP A 291 -11.636 7.484 -0.485 1.00 0.00 H new ATOM 0 HA TRP A 291 -9.230 8.670 -0.539 1.00 0.00 H new ATOM 0 HB2 TRP A 291 -11.973 9.979 -0.411 1.00 0.00 H new ATOM 0 HB3 TRP A 291 -10.515 10.843 -0.854 1.00 0.00 H new ATOM 0 HD1 TRP A 291 -13.243 8.817 -2.362 1.00 0.00 H new ATOM 0 HE1 TRP A 291 -12.742 8.245 -4.835 1.00 0.00 H new ATOM 0 HE3 TRP A 291 -8.309 10.147 -2.454 1.00 0.00 H new ATOM 0 HZ2 TRP A 291 -10.519 8.364 -6.553 1.00 0.00 H new ATOM 0 HZ3 TRP A 291 -7.055 9.887 -4.557 1.00 0.00 H new ATOM 0 HH2 TRP A 291 -8.148 9.010 -6.581 1.00 0.00 H new ATOM 1250 N ALA A 292 -8.748 10.339 1.331 1.00 0.00 N ATOM 1251 CA ALA A 292 -8.314 11.020 2.545 1.00 0.00 C ATOM 1252 C ALA A 292 -8.755 12.480 2.544 1.00 0.00 C ATOM 1253 O ALA A 292 -8.773 13.147 1.509 1.00 0.00 O ATOM 1254 CB ALA A 292 -6.802 10.924 2.692 1.00 0.00 C ATOM 0 H ALA A 292 -8.170 10.526 0.512 1.00 0.00 H new ATOM 0 HA ALA A 292 -8.784 10.527 3.396 1.00 0.00 H new ATOM 0 HB1 ALA A 292 -6.492 11.437 3.602 1.00 0.00 H new ATOM 0 HB2 ALA A 292 -6.508 9.876 2.747 1.00 0.00 H new ATOM 0 HB3 ALA A 292 -6.322 11.391 1.832 1.00 0.00 H new