USER MOD reduce.3.24.130724 H: found=0, std=0, add=593, rem=0, adj=12 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 180:sc= 0 USER MOD Single : A 221 LYS NZ :NH3+ 162:sc= -0.0332 (180deg=-0.279) USER MOD Single : A 222 THR OG1 : rot 180:sc= 0.0069 USER MOD Single : A 227 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 228 ASN : amide:sc= -1.82! C(o=-1.8!,f=-3.1!) USER MOD Single : A 233 THR OG1 : rot 92:sc= 0.277 USER MOD Single : A 239 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 241 THR OG1 : rot 95:sc= 1.22 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 276 HIS : no HE2:sc= -3.22 K(o=-3.2,f=-4.4!) USER MOD Single : A 279 TYR OH : rot 180:sc= 0 USER MOD Single : A 280 SER OG : rot -90:sc= 1.17 USER MOD Single : A 281 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 283 HIS : no HD1:sc= -13.9! C(o=-14!,f=-15!) USER MOD Single : A 284 HIS : no HD1:sc= -5.85! C(o=-5.9!,f=-8!) USER MOD Single : A 288 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 90 N SER A 220 -8.987 15.190 -0.721 1.00 0.00 N ATOM 91 CA SER A 220 -7.802 14.983 -1.545 1.00 0.00 C ATOM 92 C SER A 220 -8.063 13.930 -2.617 1.00 0.00 C ATOM 93 O SER A 220 -8.852 13.007 -2.419 1.00 0.00 O ATOM 94 CB SER A 220 -6.618 14.559 -0.674 1.00 0.00 C ATOM 95 OG SER A 220 -5.403 14.615 -1.402 1.00 0.00 O ATOM 0 HA SER A 220 -7.562 15.925 -2.038 1.00 0.00 H new ATOM 0 HB2 SER A 220 -6.553 15.209 0.198 1.00 0.00 H new ATOM 0 HB3 SER A 220 -6.778 13.546 -0.305 1.00 0.00 H new ATOM 0 HG SER A 220 -4.662 14.341 -0.823 1.00 0.00 H new ATOM 101 N LYS A 221 -7.393 14.077 -3.756 1.00 0.00 N ATOM 102 CA LYS A 221 -7.550 13.139 -4.862 1.00 0.00 C ATOM 103 C LYS A 221 -6.274 12.329 -5.073 1.00 0.00 C ATOM 104 O LYS A 221 -6.290 11.285 -5.726 1.00 0.00 O ATOM 105 CB LYS A 221 -7.909 13.889 -6.146 1.00 0.00 C ATOM 106 CG LYS A 221 -9.369 14.303 -6.221 1.00 0.00 C ATOM 107 CD LYS A 221 -9.657 15.495 -5.325 1.00 0.00 C ATOM 108 CE LYS A 221 -9.171 16.793 -5.952 1.00 0.00 C ATOM 109 NZ LYS A 221 -9.972 17.165 -7.151 1.00 0.00 N ATOM 0 H LYS A 221 -6.737 14.836 -3.937 1.00 0.00 H new ATOM 0 HA LYS A 221 -8.358 12.452 -4.612 1.00 0.00 H new ATOM 0 HB2 LYS A 221 -7.283 14.778 -6.224 1.00 0.00 H new ATOM 0 HB3 LYS A 221 -7.675 13.258 -7.003 1.00 0.00 H new ATOM 0 HG2 LYS A 221 -9.625 14.551 -7.251 1.00 0.00 H new ATOM 0 HG3 LYS A 221 -10.001 13.465 -5.928 1.00 0.00 H new ATOM 0 HD2 LYS A 221 -10.729 15.559 -5.137 1.00 0.00 H new ATOM 0 HD3 LYS A 221 -9.172 15.352 -4.360 1.00 0.00 H new ATOM 0 HE2 LYS A 221 -9.226 17.595 -5.216 1.00 0.00 H new ATOM 0 HE3 LYS A 221 -8.123 16.690 -6.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 221 -9.827 18.172 -7.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 221 -9.669 16.590 -7.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 221 -10.980 16.994 -6.962 1.00 0.00 H new ATOM 123 N THR A 222 -5.170 12.816 -4.515 1.00 0.00 N ATOM 124 CA THR A 222 -3.887 12.138 -4.642 1.00 0.00 C ATOM 125 C THR A 222 -3.643 11.198 -3.467 1.00 0.00 C ATOM 126 O THR A 222 -2.960 10.182 -3.603 1.00 0.00 O ATOM 127 CB THR A 222 -2.725 13.146 -4.729 1.00 0.00 C ATOM 128 OG1 THR A 222 -2.856 14.134 -3.701 1.00 0.00 O ATOM 129 CG2 THR A 222 -2.697 13.823 -6.091 1.00 0.00 C ATOM 0 H THR A 222 -5.139 13.678 -3.971 1.00 0.00 H new ATOM 0 HA THR A 222 -3.926 11.559 -5.565 1.00 0.00 H new ATOM 0 HB THR A 222 -1.790 12.603 -4.592 1.00 0.00 H new ATOM 0 HG1 THR A 222 -2.113 14.770 -3.762 1.00 0.00 H new ATOM 0 HG21 THR A 222 -1.868 14.530 -6.129 1.00 0.00 H new ATOM 0 HG22 THR A 222 -2.568 13.070 -6.869 1.00 0.00 H new ATOM 0 HG23 THR A 222 -3.635 14.354 -6.253 1.00 0.00 H new ATOM 137 N VAL A 223 -4.205 11.543 -2.313 1.00 0.00 N ATOM 138 CA VAL A 223 -4.050 10.729 -1.114 1.00 0.00 C ATOM 139 C VAL A 223 -5.285 9.869 -0.869 1.00 0.00 C ATOM 140 O VAL A 223 -6.404 10.379 -0.803 1.00 0.00 O ATOM 141 CB VAL A 223 -3.792 11.602 0.128 1.00 0.00 C ATOM 142 CG1 VAL A 223 -3.627 10.735 1.367 1.00 0.00 C ATOM 143 CG2 VAL A 223 -2.568 12.481 -0.084 1.00 0.00 C ATOM 0 H VAL A 223 -4.772 12.381 -2.183 1.00 0.00 H new ATOM 0 HA VAL A 223 -3.188 10.083 -1.280 1.00 0.00 H new ATOM 0 HB VAL A 223 -4.655 12.250 0.280 1.00 0.00 H new ATOM 0 HG11 VAL A 223 -3.445 11.370 2.234 1.00 0.00 H new ATOM 0 HG12 VAL A 223 -4.535 10.153 1.527 1.00 0.00 H new ATOM 0 HG13 VAL A 223 -2.783 10.060 1.229 1.00 0.00 H new ATOM 0 HG21 VAL A 223 -2.400 13.091 0.803 1.00 0.00 H new ATOM 0 HG22 VAL A 223 -1.695 11.853 -0.263 1.00 0.00 H new ATOM 0 HG23 VAL A 223 -2.730 13.129 -0.945 1.00 0.00 H new ATOM 153 N ILE A 224 -5.074 8.564 -0.736 1.00 0.00 N ATOM 154 CA ILE A 224 -6.171 7.634 -0.497 1.00 0.00 C ATOM 155 C ILE A 224 -5.944 6.833 0.781 1.00 0.00 C ATOM 156 O ILE A 224 -4.804 6.602 1.187 1.00 0.00 O ATOM 157 CB ILE A 224 -6.350 6.660 -1.676 1.00 0.00 C ATOM 158 CG1 ILE A 224 -6.573 7.434 -2.977 1.00 0.00 C ATOM 159 CG2 ILE A 224 -7.512 5.714 -1.410 1.00 0.00 C ATOM 160 CD1 ILE A 224 -6.131 6.680 -4.212 1.00 0.00 C ATOM 0 H ILE A 224 -4.154 8.127 -0.790 1.00 0.00 H new ATOM 0 HA ILE A 224 -7.076 8.233 -0.391 1.00 0.00 H new ATOM 0 HB ILE A 224 -5.441 6.068 -1.779 1.00 0.00 H new ATOM 0 HG12 ILE A 224 -7.632 7.677 -3.069 1.00 0.00 H new ATOM 0 HG13 ILE A 224 -6.032 8.379 -2.925 1.00 0.00 H new ATOM 0 HG21 ILE A 224 -7.626 5.032 -2.252 1.00 0.00 H new ATOM 0 HG22 ILE A 224 -7.315 5.142 -0.504 1.00 0.00 H new ATOM 0 HG23 ILE A 224 -8.429 6.290 -1.283 1.00 0.00 H new ATOM 0 HD11 ILE A 224 -6.319 7.289 -5.097 1.00 0.00 H new ATOM 0 HD12 ILE A 224 -5.066 6.460 -4.142 1.00 0.00 H new ATOM 0 HD13 ILE A 224 -6.690 5.747 -4.288 1.00 0.00 H new ATOM 172 N LEU A 225 -7.035 6.409 1.408 1.00 0.00 N ATOM 173 CA LEU A 225 -6.956 5.631 2.640 1.00 0.00 C ATOM 174 C LEU A 225 -7.459 4.208 2.418 1.00 0.00 C ATOM 175 O LEU A 225 -8.611 3.999 2.040 1.00 0.00 O ATOM 176 CB LEU A 225 -7.770 6.305 3.746 1.00 0.00 C ATOM 177 CG LEU A 225 -7.364 7.736 4.101 1.00 0.00 C ATOM 178 CD1 LEU A 225 -8.414 8.384 4.989 1.00 0.00 C ATOM 179 CD2 LEU A 225 -6.003 7.751 4.781 1.00 0.00 C ATOM 0 H LEU A 225 -7.985 6.590 1.084 1.00 0.00 H new ATOM 0 HA LEU A 225 -5.910 5.584 2.945 1.00 0.00 H new ATOM 0 HB2 LEU A 225 -8.818 6.310 3.447 1.00 0.00 H new ATOM 0 HB3 LEU A 225 -7.698 5.694 4.646 1.00 0.00 H new ATOM 0 HG LEU A 225 -7.293 8.313 3.179 1.00 0.00 H new ATOM 0 HD11 LEU A 225 -8.108 9.402 5.231 1.00 0.00 H new ATOM 0 HD12 LEU A 225 -9.369 8.408 4.465 1.00 0.00 H new ATOM 0 HD13 LEU A 225 -8.519 7.808 5.908 1.00 0.00 H new ATOM 0 HD21 LEU A 225 -5.730 8.777 5.026 1.00 0.00 H new ATOM 0 HD22 LEU A 225 -6.046 7.159 5.695 1.00 0.00 H new ATOM 0 HD23 LEU A 225 -5.256 7.328 4.109 1.00 0.00 H new ATOM 191 N ALA A 226 -6.588 3.234 2.657 1.00 0.00 N ATOM 192 CA ALA A 226 -6.945 1.831 2.488 1.00 0.00 C ATOM 193 C ALA A 226 -7.288 1.186 3.826 1.00 0.00 C ATOM 194 O ALA A 226 -6.589 1.386 4.821 1.00 0.00 O ATOM 195 CB ALA A 226 -5.810 1.076 1.811 1.00 0.00 C ATOM 0 H ALA A 226 -5.629 3.391 2.968 1.00 0.00 H new ATOM 0 HA ALA A 226 -7.830 1.781 1.854 1.00 0.00 H new ATOM 0 HB1 ALA A 226 -6.090 0.029 1.691 1.00 0.00 H new ATOM 0 HB2 ALA A 226 -5.615 1.514 0.832 1.00 0.00 H new ATOM 0 HB3 ALA A 226 -4.911 1.143 2.424 1.00 0.00 H new ATOM 201 N LYS A 227 -8.368 0.412 3.845 1.00 0.00 N ATOM 202 CA LYS A 227 -8.804 -0.263 5.062 1.00 0.00 C ATOM 203 C LYS A 227 -9.059 -1.744 4.800 1.00 0.00 C ATOM 204 O LYS A 227 -9.250 -2.158 3.657 1.00 0.00 O ATOM 205 CB LYS A 227 -10.073 0.396 5.608 1.00 0.00 C ATOM 206 CG LYS A 227 -9.861 1.822 6.085 1.00 0.00 C ATOM 207 CD LYS A 227 -11.024 2.304 6.936 1.00 0.00 C ATOM 208 CE LYS A 227 -10.931 3.797 7.212 1.00 0.00 C ATOM 209 NZ LYS A 227 -12.035 4.268 8.094 1.00 0.00 N ATOM 0 H LYS A 227 -8.958 0.237 3.031 1.00 0.00 H new ATOM 0 HA LYS A 227 -8.009 -0.175 5.803 1.00 0.00 H new ATOM 0 HB2 LYS A 227 -10.838 0.392 4.831 1.00 0.00 H new ATOM 0 HB3 LYS A 227 -10.456 -0.202 6.435 1.00 0.00 H new ATOM 0 HG2 LYS A 227 -8.938 1.880 6.662 1.00 0.00 H new ATOM 0 HG3 LYS A 227 -9.741 2.480 5.225 1.00 0.00 H new ATOM 0 HD2 LYS A 227 -11.963 2.084 6.428 1.00 0.00 H new ATOM 0 HD3 LYS A 227 -11.037 1.758 7.880 1.00 0.00 H new ATOM 0 HE2 LYS A 227 -9.972 4.021 7.679 1.00 0.00 H new ATOM 0 HE3 LYS A 227 -10.961 4.343 6.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 227 -11.936 5.290 8.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 227 -12.950 4.078 7.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 227 -11.991 3.765 9.003 1.00 0.00 H new ATOM 223 N ASN A 228 -9.063 -2.536 5.867 1.00 0.00 N ATOM 224 CA ASN A 228 -9.297 -3.972 5.752 1.00 0.00 C ATOM 225 C ASN A 228 -8.075 -4.676 5.170 1.00 0.00 C ATOM 226 O ASN A 228 -8.181 -5.422 4.195 1.00 0.00 O ATOM 227 CB ASN A 228 -10.521 -4.242 4.876 1.00 0.00 C ATOM 228 CG ASN A 228 -11.250 -5.510 5.275 1.00 0.00 C ATOM 229 OD1 ASN A 228 -11.225 -5.913 6.438 1.00 0.00 O ATOM 230 ND2 ASN A 228 -11.902 -6.147 4.310 1.00 0.00 N ATOM 0 H ASN A 228 -8.907 -2.209 6.820 1.00 0.00 H new ATOM 0 HA ASN A 228 -9.481 -4.367 6.751 1.00 0.00 H new ATOM 0 HB2 ASN A 228 -11.206 -3.396 4.943 1.00 0.00 H new ATOM 0 HB3 ASN A 228 -10.209 -4.318 3.834 1.00 0.00 H new ATOM 0 HD21 ASN A 228 -12.409 -7.007 4.519 1.00 0.00 H new ATOM 0 HD22 ASN A 228 -11.896 -5.777 3.360 1.00 0.00 H new ATOM 237 N LEU A 229 -6.917 -4.436 5.774 1.00 0.00 N ATOM 238 CA LEU A 229 -5.674 -5.048 5.316 1.00 0.00 C ATOM 239 C LEU A 229 -5.195 -6.109 6.301 1.00 0.00 C ATOM 240 O LEU A 229 -5.225 -5.921 7.518 1.00 0.00 O ATOM 241 CB LEU A 229 -4.594 -3.980 5.134 1.00 0.00 C ATOM 242 CG LEU A 229 -4.782 -3.030 3.951 1.00 0.00 C ATOM 243 CD1 LEU A 229 -3.966 -1.762 4.149 1.00 0.00 C ATOM 244 CD2 LEU A 229 -4.397 -3.717 2.648 1.00 0.00 C ATOM 0 H LEU A 229 -6.812 -3.822 6.582 1.00 0.00 H new ATOM 0 HA LEU A 229 -5.866 -5.529 4.357 1.00 0.00 H new ATOM 0 HB2 LEU A 229 -4.541 -3.386 6.046 1.00 0.00 H new ATOM 0 HB3 LEU A 229 -3.632 -4.480 5.023 1.00 0.00 H new ATOM 0 HG LEU A 229 -5.835 -2.754 3.895 1.00 0.00 H new ATOM 0 HD11 LEU A 229 -4.113 -1.098 3.297 1.00 0.00 H new ATOM 0 HD12 LEU A 229 -4.290 -1.260 5.060 1.00 0.00 H new ATOM 0 HD13 LEU A 229 -2.910 -2.018 4.232 1.00 0.00 H new ATOM 0 HD21 LEU A 229 -4.537 -3.026 1.817 1.00 0.00 H new ATOM 0 HD22 LEU A 229 -3.352 -4.023 2.693 1.00 0.00 H new ATOM 0 HD23 LEU A 229 -5.026 -4.595 2.500 1.00 0.00 H new ATOM 256 N PRO A 230 -4.740 -7.252 5.766 1.00 0.00 N ATOM 257 CA PRO A 230 -4.242 -8.365 6.580 1.00 0.00 C ATOM 258 C PRO A 230 -2.916 -8.040 7.258 1.00 0.00 C ATOM 259 O PRO A 230 -2.011 -7.482 6.637 1.00 0.00 O ATOM 260 CB PRO A 230 -4.061 -9.494 5.563 1.00 0.00 C ATOM 261 CG PRO A 230 -3.853 -8.802 4.260 1.00 0.00 C ATOM 262 CD PRO A 230 -4.675 -7.545 4.324 1.00 0.00 C ATOM 0 HA PRO A 230 -4.923 -8.611 7.394 1.00 0.00 H new ATOM 0 HB2 PRO A 230 -3.208 -10.123 5.818 1.00 0.00 H new ATOM 0 HB3 PRO A 230 -4.937 -10.142 5.531 1.00 0.00 H new ATOM 0 HG2 PRO A 230 -2.799 -8.572 4.104 1.00 0.00 H new ATOM 0 HG3 PRO A 230 -4.168 -9.432 3.428 1.00 0.00 H new ATOM 0 HD2 PRO A 230 -4.208 -6.731 3.769 1.00 0.00 H new ATOM 0 HD3 PRO A 230 -5.668 -7.692 3.899 1.00 0.00 H new ATOM 270 N ALA A 231 -2.807 -8.392 8.534 1.00 0.00 N ATOM 271 CA ALA A 231 -1.590 -8.140 9.295 1.00 0.00 C ATOM 272 C ALA A 231 -0.350 -8.495 8.482 1.00 0.00 C ATOM 273 O ALA A 231 0.692 -7.852 8.607 1.00 0.00 O ATOM 274 CB ALA A 231 -1.610 -8.924 10.599 1.00 0.00 C ATOM 0 H ALA A 231 -3.547 -8.853 9.063 1.00 0.00 H new ATOM 0 HA ALA A 231 -1.550 -7.075 9.524 1.00 0.00 H new ATOM 0 HB1 ALA A 231 -0.695 -8.726 11.157 1.00 0.00 H new ATOM 0 HB2 ALA A 231 -2.471 -8.619 11.194 1.00 0.00 H new ATOM 0 HB3 ALA A 231 -1.679 -9.990 10.382 1.00 0.00 H new ATOM 280 N GLY A 232 -0.470 -9.523 7.647 1.00 0.00 N ATOM 281 CA GLY A 232 0.649 -9.946 6.825 1.00 0.00 C ATOM 282 C GLY A 232 1.168 -8.834 5.935 1.00 0.00 C ATOM 283 O GLY A 232 2.374 -8.712 5.718 1.00 0.00 O ATOM 0 H GLY A 232 -1.322 -10.070 7.525 1.00 0.00 H new ATOM 0 HA2 GLY A 232 1.455 -10.299 7.468 1.00 0.00 H new ATOM 0 HA3 GLY A 232 0.343 -10.789 6.206 1.00 0.00 H new ATOM 287 N THR A 233 0.254 -8.019 5.416 1.00 0.00 N ATOM 288 CA THR A 233 0.625 -6.913 4.542 1.00 0.00 C ATOM 289 C THR A 233 1.869 -6.198 5.057 1.00 0.00 C ATOM 290 O THR A 233 2.262 -6.368 6.212 1.00 0.00 O ATOM 291 CB THR A 233 -0.521 -5.893 4.410 1.00 0.00 C ATOM 292 OG1 THR A 233 -1.757 -6.573 4.165 1.00 0.00 O ATOM 293 CG2 THR A 233 -0.244 -4.911 3.281 1.00 0.00 C ATOM 0 H THR A 233 -0.748 -8.104 5.586 1.00 0.00 H new ATOM 0 HA THR A 233 0.835 -7.342 3.562 1.00 0.00 H new ATOM 0 HB THR A 233 -0.592 -5.337 5.345 1.00 0.00 H new ATOM 0 HG1 THR A 233 -2.202 -6.761 5.018 1.00 0.00 H new ATOM 0 HG21 THR A 233 -1.067 -4.200 3.207 1.00 0.00 H new ATOM 0 HG22 THR A 233 0.682 -4.374 3.485 1.00 0.00 H new ATOM 0 HG23 THR A 233 -0.148 -5.455 2.341 1.00 0.00 H new ATOM 301 N LEU A 234 2.487 -5.399 4.194 1.00 0.00 N ATOM 302 CA LEU A 234 3.687 -4.657 4.562 1.00 0.00 C ATOM 303 C LEU A 234 3.792 -3.360 3.766 1.00 0.00 C ATOM 304 O LEU A 234 3.395 -3.301 2.603 1.00 0.00 O ATOM 305 CB LEU A 234 4.932 -5.515 4.328 1.00 0.00 C ATOM 306 CG LEU A 234 5.022 -6.805 5.144 1.00 0.00 C ATOM 307 CD1 LEU A 234 6.108 -7.713 4.588 1.00 0.00 C ATOM 308 CD2 LEU A 234 5.284 -6.492 6.610 1.00 0.00 C ATOM 0 H LEU A 234 2.176 -5.249 3.234 1.00 0.00 H new ATOM 0 HA LEU A 234 3.619 -4.406 5.621 1.00 0.00 H new ATOM 0 HB2 LEU A 234 4.976 -5.774 3.270 1.00 0.00 H new ATOM 0 HB3 LEU A 234 5.812 -4.909 4.545 1.00 0.00 H new ATOM 0 HG LEU A 234 4.068 -7.327 5.070 1.00 0.00 H new ATOM 0 HD11 LEU A 234 6.158 -8.626 5.181 1.00 0.00 H new ATOM 0 HD12 LEU A 234 5.877 -7.965 3.553 1.00 0.00 H new ATOM 0 HD13 LEU A 234 7.069 -7.200 4.631 1.00 0.00 H new ATOM 0 HD21 LEU A 234 5.345 -7.422 7.175 1.00 0.00 H new ATOM 0 HD22 LEU A 234 6.224 -5.948 6.704 1.00 0.00 H new ATOM 0 HD23 LEU A 234 4.471 -5.881 7.003 1.00 0.00 H new ATOM 320 N ALA A 235 4.331 -2.324 4.400 1.00 0.00 N ATOM 321 CA ALA A 235 4.492 -1.030 3.749 1.00 0.00 C ATOM 322 C ALA A 235 4.976 -1.194 2.313 1.00 0.00 C ATOM 323 O ALA A 235 4.452 -0.562 1.396 1.00 0.00 O ATOM 324 CB ALA A 235 5.458 -0.159 4.538 1.00 0.00 C ATOM 0 H ALA A 235 4.664 -2.356 5.364 1.00 0.00 H new ATOM 0 HA ALA A 235 3.518 -0.541 3.722 1.00 0.00 H new ATOM 0 HB1 ALA A 235 5.569 0.804 4.040 1.00 0.00 H new ATOM 0 HB2 ALA A 235 5.070 -0.005 5.545 1.00 0.00 H new ATOM 0 HB3 ALA A 235 6.429 -0.652 4.595 1.00 0.00 H new ATOM 330 N ALA A 236 5.979 -2.045 2.125 1.00 0.00 N ATOM 331 CA ALA A 236 6.533 -2.293 0.800 1.00 0.00 C ATOM 332 C ALA A 236 5.499 -2.940 -0.115 1.00 0.00 C ATOM 333 O ALA A 236 5.377 -2.576 -1.284 1.00 0.00 O ATOM 334 CB ALA A 236 7.773 -3.168 0.901 1.00 0.00 C ATOM 0 H ALA A 236 6.425 -2.575 2.874 1.00 0.00 H new ATOM 0 HA ALA A 236 6.814 -1.334 0.366 1.00 0.00 H new ATOM 0 HB1 ALA A 236 8.176 -3.345 -0.096 1.00 0.00 H new ATOM 0 HB2 ALA A 236 8.524 -2.666 1.512 1.00 0.00 H new ATOM 0 HB3 ALA A 236 7.510 -4.121 1.360 1.00 0.00 H new ATOM 340 N GLU A 237 4.757 -3.902 0.425 1.00 0.00 N ATOM 341 CA GLU A 237 3.735 -4.600 -0.345 1.00 0.00 C ATOM 342 C GLU A 237 2.792 -3.610 -1.023 1.00 0.00 C ATOM 343 O GLU A 237 2.672 -3.590 -2.248 1.00 0.00 O ATOM 344 CB GLU A 237 2.937 -5.542 0.560 1.00 0.00 C ATOM 345 CG GLU A 237 3.743 -6.727 1.066 1.00 0.00 C ATOM 346 CD GLU A 237 3.930 -7.798 0.009 1.00 0.00 C ATOM 347 OE1 GLU A 237 2.949 -8.110 -0.699 1.00 0.00 O ATOM 348 OE2 GLU A 237 5.055 -8.325 -0.110 1.00 0.00 O ATOM 0 H GLU A 237 4.845 -4.215 1.392 1.00 0.00 H new ATOM 0 HA GLU A 237 4.236 -5.185 -1.116 1.00 0.00 H new ATOM 0 HB2 GLU A 237 2.559 -4.979 1.414 1.00 0.00 H new ATOM 0 HB3 GLU A 237 2.070 -5.910 0.012 1.00 0.00 H new ATOM 0 HG2 GLU A 237 4.720 -6.380 1.403 1.00 0.00 H new ATOM 0 HG3 GLU A 237 3.242 -7.160 1.932 1.00 0.00 H new ATOM 355 N ILE A 238 2.126 -2.790 -0.217 1.00 0.00 N ATOM 356 CA ILE A 238 1.195 -1.797 -0.738 1.00 0.00 C ATOM 357 C ILE A 238 1.881 -0.872 -1.738 1.00 0.00 C ATOM 358 O ILE A 238 1.426 -0.720 -2.871 1.00 0.00 O ATOM 359 CB ILE A 238 0.584 -0.950 0.393 1.00 0.00 C ATOM 360 CG1 ILE A 238 -0.157 -1.846 1.388 1.00 0.00 C ATOM 361 CG2 ILE A 238 -0.354 0.102 -0.180 1.00 0.00 C ATOM 362 CD1 ILE A 238 -1.398 -2.491 0.812 1.00 0.00 C ATOM 0 H ILE A 238 2.214 -2.794 0.799 1.00 0.00 H new ATOM 0 HA ILE A 238 0.398 -2.345 -1.241 1.00 0.00 H new ATOM 0 HB ILE A 238 1.390 -0.441 0.921 1.00 0.00 H new ATOM 0 HG12 ILE A 238 0.520 -2.626 1.736 1.00 0.00 H new ATOM 0 HG13 ILE A 238 -0.436 -1.254 2.260 1.00 0.00 H new ATOM 0 HG21 ILE A 238 -0.778 0.693 0.632 1.00 0.00 H new ATOM 0 HG22 ILE A 238 0.200 0.756 -0.853 1.00 0.00 H new ATOM 0 HG23 ILE A 238 -1.157 -0.388 -0.730 1.00 0.00 H new ATOM 0 HD11 ILE A 238 -1.872 -3.112 1.573 1.00 0.00 H new ATOM 0 HD12 ILE A 238 -2.094 -1.717 0.490 1.00 0.00 H new ATOM 0 HD13 ILE A 238 -1.123 -3.110 -0.042 1.00 0.00 H new ATOM 374 N GLN A 239 2.979 -0.257 -1.309 1.00 0.00 N ATOM 375 CA GLN A 239 3.728 0.653 -2.167 1.00 0.00 C ATOM 376 C GLN A 239 3.870 0.082 -3.574 1.00 0.00 C ATOM 377 O GLN A 239 3.461 0.708 -4.552 1.00 0.00 O ATOM 378 CB GLN A 239 5.111 0.925 -1.573 1.00 0.00 C ATOM 379 CG GLN A 239 5.916 1.954 -2.351 1.00 0.00 C ATOM 380 CD GLN A 239 7.380 1.969 -1.957 1.00 0.00 C ATOM 381 OE1 GLN A 239 8.214 1.331 -2.600 1.00 0.00 O ATOM 382 NE2 GLN A 239 7.700 2.699 -0.895 1.00 0.00 N ATOM 0 H GLN A 239 3.369 -0.372 -0.374 1.00 0.00 H new ATOM 0 HA GLN A 239 3.176 1.591 -2.229 1.00 0.00 H new ATOM 0 HB2 GLN A 239 4.995 1.269 -0.545 1.00 0.00 H new ATOM 0 HB3 GLN A 239 5.671 -0.009 -1.535 1.00 0.00 H new ATOM 0 HG2 GLN A 239 5.833 1.744 -3.417 1.00 0.00 H new ATOM 0 HG3 GLN A 239 5.489 2.943 -2.187 1.00 0.00 H new ATOM 0 HE21 GLN A 239 6.976 3.212 -0.392 1.00 0.00 H new ATOM 0 HE22 GLN A 239 8.670 2.747 -0.582 1.00 0.00 H new ATOM 391 N GLU A 240 4.451 -1.110 -3.668 1.00 0.00 N ATOM 392 CA GLU A 240 4.647 -1.764 -4.956 1.00 0.00 C ATOM 393 C GLU A 240 3.308 -2.079 -5.616 1.00 0.00 C ATOM 394 O GLU A 240 3.069 -1.716 -6.769 1.00 0.00 O ATOM 395 CB GLU A 240 5.457 -3.051 -4.782 1.00 0.00 C ATOM 396 CG GLU A 240 6.257 -3.438 -6.015 1.00 0.00 C ATOM 397 CD GLU A 240 7.347 -4.447 -5.710 1.00 0.00 C ATOM 398 OE1 GLU A 240 7.062 -5.431 -4.995 1.00 0.00 O ATOM 399 OE2 GLU A 240 8.484 -4.253 -6.187 1.00 0.00 O ATOM 0 H GLU A 240 4.794 -1.642 -2.868 1.00 0.00 H new ATOM 0 HA GLU A 240 5.199 -1.080 -5.601 1.00 0.00 H new ATOM 0 HB2 GLU A 240 6.139 -2.930 -3.940 1.00 0.00 H new ATOM 0 HB3 GLU A 240 4.779 -3.866 -4.529 1.00 0.00 H new ATOM 0 HG2 GLU A 240 5.583 -3.852 -6.765 1.00 0.00 H new ATOM 0 HG3 GLU A 240 6.706 -2.544 -6.448 1.00 0.00 H new ATOM 406 N THR A 241 2.436 -2.758 -4.877 1.00 0.00 N ATOM 407 CA THR A 241 1.121 -3.124 -5.389 1.00 0.00 C ATOM 408 C THR A 241 0.492 -1.970 -6.162 1.00 0.00 C ATOM 409 O THR A 241 0.133 -2.116 -7.331 1.00 0.00 O ATOM 410 CB THR A 241 0.172 -3.543 -4.252 1.00 0.00 C ATOM 411 OG1 THR A 241 0.713 -4.669 -3.551 1.00 0.00 O ATOM 412 CG2 THR A 241 -1.205 -3.893 -4.797 1.00 0.00 C ATOM 0 H THR A 241 2.617 -3.066 -3.921 1.00 0.00 H new ATOM 0 HA THR A 241 1.267 -3.971 -6.060 1.00 0.00 H new ATOM 0 HB THR A 241 0.071 -2.702 -3.565 1.00 0.00 H new ATOM 0 HG1 THR A 241 1.207 -4.358 -2.764 1.00 0.00 H new ATOM 0 HG21 THR A 241 -1.858 -4.186 -3.975 1.00 0.00 H new ATOM 0 HG22 THR A 241 -1.627 -3.025 -5.304 1.00 0.00 H new ATOM 0 HG23 THR A 241 -1.118 -4.719 -5.503 1.00 0.00 H new ATOM 420 N PHE A 242 0.362 -0.824 -5.503 1.00 0.00 N ATOM 421 CA PHE A 242 -0.225 0.356 -6.129 1.00 0.00 C ATOM 422 C PHE A 242 0.702 0.920 -7.201 1.00 0.00 C ATOM 423 O PHE A 242 0.257 1.299 -8.285 1.00 0.00 O ATOM 424 CB PHE A 242 -0.517 1.426 -5.075 1.00 0.00 C ATOM 425 CG PHE A 242 -1.701 1.108 -4.209 1.00 0.00 C ATOM 426 CD1 PHE A 242 -1.652 0.059 -3.304 1.00 0.00 C ATOM 427 CD2 PHE A 242 -2.864 1.856 -4.299 1.00 0.00 C ATOM 428 CE1 PHE A 242 -2.741 -0.237 -2.505 1.00 0.00 C ATOM 429 CE2 PHE A 242 -3.955 1.565 -3.502 1.00 0.00 C ATOM 430 CZ PHE A 242 -3.893 0.517 -2.605 1.00 0.00 C ATOM 0 H PHE A 242 0.655 -0.687 -4.536 1.00 0.00 H new ATOM 0 HA PHE A 242 -1.160 0.059 -6.603 1.00 0.00 H new ATOM 0 HB2 PHE A 242 0.362 1.551 -4.443 1.00 0.00 H new ATOM 0 HB3 PHE A 242 -0.688 2.379 -5.575 1.00 0.00 H new ATOM 0 HD1 PHE A 242 -0.753 -0.534 -3.222 1.00 0.00 H new ATOM 0 HD2 PHE A 242 -2.919 2.676 -5.000 1.00 0.00 H new ATOM 0 HE1 PHE A 242 -2.690 -1.057 -1.804 1.00 0.00 H new ATOM 0 HE2 PHE A 242 -4.855 2.157 -3.581 1.00 0.00 H new ATOM 0 HZ PHE A 242 -4.745 0.287 -1.982 1.00 0.00 H new ATOM 440 N SER A 243 1.993 0.974 -6.890 1.00 0.00 N ATOM 441 CA SER A 243 2.983 1.496 -7.825 1.00 0.00 C ATOM 442 C SER A 243 2.760 0.932 -9.225 1.00 0.00 C ATOM 443 O SER A 243 2.905 1.640 -10.221 1.00 0.00 O ATOM 444 CB SER A 243 4.396 1.158 -7.346 1.00 0.00 C ATOM 445 OG SER A 243 5.374 1.799 -8.146 1.00 0.00 O ATOM 0 H SER A 243 2.378 0.663 -5.998 1.00 0.00 H new ATOM 0 HA SER A 243 2.870 2.579 -7.867 1.00 0.00 H new ATOM 0 HB2 SER A 243 4.514 1.465 -6.307 1.00 0.00 H new ATOM 0 HB3 SER A 243 4.546 0.079 -7.379 1.00 0.00 H new ATOM 0 HG SER A 243 6.268 1.568 -7.818 1.00 0.00 H new ATOM 451 N ARG A 244 2.407 -0.347 -9.291 1.00 0.00 N ATOM 452 CA ARG A 244 2.164 -1.008 -10.567 1.00 0.00 C ATOM 453 C ARG A 244 1.448 -0.072 -11.537 1.00 0.00 C ATOM 454 O ARG A 244 1.868 0.090 -12.683 1.00 0.00 O ATOM 455 CB ARG A 244 1.335 -2.277 -10.360 1.00 0.00 C ATOM 456 CG ARG A 244 1.998 -3.296 -9.448 1.00 0.00 C ATOM 457 CD ARG A 244 3.142 -4.010 -10.150 1.00 0.00 C ATOM 458 NE ARG A 244 3.628 -5.153 -9.381 1.00 0.00 N ATOM 459 CZ ARG A 244 4.857 -5.644 -9.491 1.00 0.00 C ATOM 460 NH1 ARG A 244 5.721 -5.094 -10.334 1.00 0.00 N ATOM 461 NH2 ARG A 244 5.224 -6.687 -8.757 1.00 0.00 N ATOM 0 H ARG A 244 2.283 -0.947 -8.475 1.00 0.00 H new ATOM 0 HA ARG A 244 3.129 -1.279 -10.996 1.00 0.00 H new ATOM 0 HB2 ARG A 244 0.366 -2.004 -9.942 1.00 0.00 H new ATOM 0 HB3 ARG A 244 1.145 -2.739 -11.329 1.00 0.00 H new ATOM 0 HG2 ARG A 244 2.373 -2.797 -8.554 1.00 0.00 H new ATOM 0 HG3 ARG A 244 1.259 -4.026 -9.119 1.00 0.00 H new ATOM 0 HD2 ARG A 244 2.810 -4.348 -11.132 1.00 0.00 H new ATOM 0 HD3 ARG A 244 3.960 -3.309 -10.314 1.00 0.00 H new ATOM 0 HE ARG A 244 2.988 -5.599 -8.723 1.00 0.00 H new ATOM 0 HH11 ARG A 244 5.442 -4.292 -10.899 1.00 0.00 H new ATOM 0 HH12 ARG A 244 6.664 -5.473 -10.417 1.00 0.00 H new ATOM 0 HH21 ARG A 244 4.562 -7.112 -8.108 1.00 0.00 H new ATOM 0 HH22 ARG A 244 6.168 -7.064 -8.842 1.00 0.00 H new ATOM 475 N PHE A 245 0.366 0.541 -11.069 1.00 0.00 N ATOM 476 CA PHE A 245 -0.409 1.459 -11.895 1.00 0.00 C ATOM 477 C PHE A 245 0.417 2.688 -12.264 1.00 0.00 C ATOM 478 O PHE A 245 0.435 3.114 -13.418 1.00 0.00 O ATOM 479 CB PHE A 245 -1.682 1.888 -11.161 1.00 0.00 C ATOM 480 CG PHE A 245 -2.683 0.780 -11.000 1.00 0.00 C ATOM 481 CD1 PHE A 245 -2.507 -0.194 -10.030 1.00 0.00 C ATOM 482 CD2 PHE A 245 -3.800 0.713 -11.817 1.00 0.00 C ATOM 483 CE1 PHE A 245 -3.427 -1.215 -9.881 1.00 0.00 C ATOM 484 CE2 PHE A 245 -4.723 -0.305 -11.671 1.00 0.00 C ATOM 485 CZ PHE A 245 -4.536 -1.270 -10.701 1.00 0.00 C ATOM 0 H PHE A 245 0.006 0.419 -10.122 1.00 0.00 H new ATOM 0 HA PHE A 245 -0.684 0.939 -12.813 1.00 0.00 H new ATOM 0 HB2 PHE A 245 -1.413 2.270 -10.176 1.00 0.00 H new ATOM 0 HB3 PHE A 245 -2.146 2.710 -11.706 1.00 0.00 H new ATOM 0 HD1 PHE A 245 -1.642 -0.155 -9.384 1.00 0.00 H new ATOM 0 HD2 PHE A 245 -3.951 1.465 -12.577 1.00 0.00 H new ATOM 0 HE1 PHE A 245 -3.278 -1.970 -9.123 1.00 0.00 H new ATOM 0 HE2 PHE A 245 -5.589 -0.346 -12.315 1.00 0.00 H new ATOM 0 HZ PHE A 245 -5.256 -2.066 -10.584 1.00 0.00 H new ATOM 495 N GLY A 246 1.100 3.254 -11.273 1.00 0.00 N ATOM 496 CA GLY A 246 1.919 4.428 -11.513 1.00 0.00 C ATOM 497 C GLY A 246 2.771 4.795 -10.315 1.00 0.00 C ATOM 498 O GLY A 246 2.457 4.425 -9.184 1.00 0.00 O ATOM 0 H GLY A 246 1.101 2.921 -10.309 1.00 0.00 H new ATOM 0 HA2 GLY A 246 2.565 4.247 -12.372 1.00 0.00 H new ATOM 0 HA3 GLY A 246 1.276 5.270 -11.769 1.00 0.00 H new ATOM 502 N SER A 247 3.855 5.523 -10.563 1.00 0.00 N ATOM 503 CA SER A 247 4.760 5.936 -9.496 1.00 0.00 C ATOM 504 C SER A 247 3.982 6.518 -8.319 1.00 0.00 C ATOM 505 O SER A 247 3.118 7.378 -8.496 1.00 0.00 O ATOM 506 CB SER A 247 5.763 6.965 -10.018 1.00 0.00 C ATOM 507 OG SER A 247 6.787 6.341 -10.774 1.00 0.00 O ATOM 0 H SER A 247 4.128 5.839 -11.493 1.00 0.00 H new ATOM 0 HA SER A 247 5.302 5.055 -9.151 1.00 0.00 H new ATOM 0 HB2 SER A 247 5.247 7.700 -10.636 1.00 0.00 H new ATOM 0 HB3 SER A 247 6.203 7.506 -9.180 1.00 0.00 H new ATOM 0 HG SER A 247 7.415 7.020 -11.098 1.00 0.00 H new ATOM 513 N LEU A 248 4.295 6.045 -7.119 1.00 0.00 N ATOM 514 CA LEU A 248 3.627 6.517 -5.911 1.00 0.00 C ATOM 515 C LEU A 248 4.442 7.612 -5.230 1.00 0.00 C ATOM 516 O LEU A 248 5.624 7.791 -5.521 1.00 0.00 O ATOM 517 CB LEU A 248 3.400 5.356 -4.942 1.00 0.00 C ATOM 518 CG LEU A 248 2.203 4.455 -5.242 1.00 0.00 C ATOM 519 CD1 LEU A 248 2.296 3.161 -4.448 1.00 0.00 C ATOM 520 CD2 LEU A 248 0.900 5.178 -4.936 1.00 0.00 C ATOM 0 H LEU A 248 5.008 5.334 -6.956 1.00 0.00 H new ATOM 0 HA LEU A 248 2.662 6.934 -6.199 1.00 0.00 H new ATOM 0 HB2 LEU A 248 4.299 4.739 -4.929 1.00 0.00 H new ATOM 0 HB3 LEU A 248 3.279 5.765 -3.939 1.00 0.00 H new ATOM 0 HG LEU A 248 2.217 4.208 -6.303 1.00 0.00 H new ATOM 0 HD11 LEU A 248 1.435 2.532 -4.675 1.00 0.00 H new ATOM 0 HD12 LEU A 248 3.211 2.634 -4.717 1.00 0.00 H new ATOM 0 HD13 LEU A 248 2.309 3.388 -3.382 1.00 0.00 H new ATOM 0 HD21 LEU A 248 0.059 4.521 -5.156 1.00 0.00 H new ATOM 0 HD22 LEU A 248 0.877 5.457 -3.882 1.00 0.00 H new ATOM 0 HD23 LEU A 248 0.829 6.076 -5.550 1.00 0.00 H new ATOM 532 N GLY A 249 3.803 8.340 -4.320 1.00 0.00 N ATOM 533 CA GLY A 249 4.485 9.406 -3.610 1.00 0.00 C ATOM 534 C GLY A 249 4.743 9.062 -2.156 1.00 0.00 C ATOM 535 O GLY A 249 5.671 8.316 -1.843 1.00 0.00 O ATOM 0 H GLY A 249 2.825 8.211 -4.062 1.00 0.00 H new ATOM 0 HA2 GLY A 249 5.433 9.618 -4.104 1.00 0.00 H new ATOM 0 HA3 GLY A 249 3.887 10.315 -3.664 1.00 0.00 H new ATOM 539 N ARG A 250 3.922 9.609 -1.266 1.00 0.00 N ATOM 540 CA ARG A 250 4.068 9.358 0.163 1.00 0.00 C ATOM 541 C ARG A 250 3.311 8.098 0.574 1.00 0.00 C ATOM 542 O ARG A 250 2.096 8.006 0.398 1.00 0.00 O ATOM 543 CB ARG A 250 3.560 10.556 0.967 1.00 0.00 C ATOM 544 CG ARG A 250 4.281 10.751 2.291 1.00 0.00 C ATOM 545 CD ARG A 250 5.672 11.332 2.087 1.00 0.00 C ATOM 546 NE ARG A 250 5.654 12.791 2.035 1.00 0.00 N ATOM 547 CZ ARG A 250 5.688 13.565 3.114 1.00 0.00 C ATOM 548 NH1 ARG A 250 5.743 13.022 4.322 1.00 0.00 N ATOM 549 NH2 ARG A 250 5.668 14.886 2.985 1.00 0.00 N ATOM 0 H ARG A 250 3.149 10.229 -1.509 1.00 0.00 H new ATOM 0 HA ARG A 250 5.127 9.210 0.374 1.00 0.00 H new ATOM 0 HB2 ARG A 250 3.670 11.459 0.366 1.00 0.00 H new ATOM 0 HB3 ARG A 250 2.495 10.429 1.158 1.00 0.00 H new ATOM 0 HG2 ARG A 250 3.698 11.415 2.930 1.00 0.00 H new ATOM 0 HG3 ARG A 250 4.357 9.795 2.810 1.00 0.00 H new ATOM 0 HD2 ARG A 250 6.323 11.006 2.898 1.00 0.00 H new ATOM 0 HD3 ARG A 250 6.096 10.942 1.162 1.00 0.00 H new ATOM 0 HE ARG A 250 5.613 13.240 1.120 1.00 0.00 H new ATOM 0 HH11 ARG A 250 5.759 12.007 4.425 1.00 0.00 H new ATOM 0 HH12 ARG A 250 5.769 13.619 5.149 1.00 0.00 H new ATOM 0 HH21 ARG A 250 5.626 15.307 2.057 1.00 0.00 H new ATOM 0 HH22 ARG A 250 5.694 15.480 3.814 1.00 0.00 H new ATOM 563 N VAL A 251 4.037 7.130 1.122 1.00 0.00 N ATOM 564 CA VAL A 251 3.435 5.876 1.559 1.00 0.00 C ATOM 565 C VAL A 251 3.697 5.626 3.040 1.00 0.00 C ATOM 566 O VAL A 251 4.843 5.455 3.458 1.00 0.00 O ATOM 567 CB VAL A 251 3.971 4.683 0.745 1.00 0.00 C ATOM 568 CG1 VAL A 251 3.393 3.377 1.269 1.00 0.00 C ATOM 569 CG2 VAL A 251 3.656 4.861 -0.732 1.00 0.00 C ATOM 0 H VAL A 251 5.044 7.190 1.274 1.00 0.00 H new ATOM 0 HA VAL A 251 2.361 5.966 1.394 1.00 0.00 H new ATOM 0 HB VAL A 251 5.054 4.645 0.859 1.00 0.00 H new ATOM 0 HG11 VAL A 251 3.783 2.545 0.682 1.00 0.00 H new ATOM 0 HG12 VAL A 251 3.675 3.247 2.314 1.00 0.00 H new ATOM 0 HG13 VAL A 251 2.306 3.401 1.187 1.00 0.00 H new ATOM 0 HG21 VAL A 251 4.042 4.009 -1.292 1.00 0.00 H new ATOM 0 HG22 VAL A 251 2.577 4.926 -0.869 1.00 0.00 H new ATOM 0 HG23 VAL A 251 4.123 5.776 -1.096 1.00 0.00 H new ATOM 579 N LEU A 252 2.629 5.607 3.829 1.00 0.00 N ATOM 580 CA LEU A 252 2.743 5.378 5.265 1.00 0.00 C ATOM 581 C LEU A 252 1.779 4.287 5.720 1.00 0.00 C ATOM 582 O LEU A 252 0.561 4.448 5.644 1.00 0.00 O ATOM 583 CB LEU A 252 2.464 6.672 6.031 1.00 0.00 C ATOM 584 CG LEU A 252 3.279 7.894 5.605 1.00 0.00 C ATOM 585 CD1 LEU A 252 2.665 9.167 6.166 1.00 0.00 C ATOM 586 CD2 LEU A 252 4.726 7.753 6.055 1.00 0.00 C ATOM 0 H LEU A 252 1.674 5.747 3.499 1.00 0.00 H new ATOM 0 HA LEU A 252 3.761 5.050 5.476 1.00 0.00 H new ATOM 0 HB2 LEU A 252 1.406 6.912 5.926 1.00 0.00 H new ATOM 0 HB3 LEU A 252 2.646 6.490 7.090 1.00 0.00 H new ATOM 0 HG LEU A 252 3.263 7.957 4.517 1.00 0.00 H new ATOM 0 HD11 LEU A 252 3.258 10.026 5.853 1.00 0.00 H new ATOM 0 HD12 LEU A 252 1.646 9.274 5.794 1.00 0.00 H new ATOM 0 HD13 LEU A 252 2.650 9.114 7.255 1.00 0.00 H new ATOM 0 HD21 LEU A 252 5.291 8.631 5.743 1.00 0.00 H new ATOM 0 HD22 LEU A 252 4.762 7.664 7.141 1.00 0.00 H new ATOM 0 HD23 LEU A 252 5.162 6.862 5.604 1.00 0.00 H new ATOM 598 N LEU A 253 2.333 3.176 6.195 1.00 0.00 N ATOM 599 CA LEU A 253 1.523 2.058 6.665 1.00 0.00 C ATOM 600 C LEU A 253 2.029 1.547 8.011 1.00 0.00 C ATOM 601 O LEU A 253 2.984 0.774 8.090 1.00 0.00 O ATOM 602 CB LEU A 253 1.538 0.924 5.638 1.00 0.00 C ATOM 603 CG LEU A 253 1.146 -0.459 6.159 1.00 0.00 C ATOM 604 CD1 LEU A 253 -0.220 -0.410 6.826 1.00 0.00 C ATOM 605 CD2 LEU A 253 1.154 -1.476 5.028 1.00 0.00 C ATOM 0 H LEU A 253 3.340 3.026 6.265 1.00 0.00 H new ATOM 0 HA LEU A 253 0.500 2.411 6.792 1.00 0.00 H new ATOM 0 HB2 LEU A 253 0.862 1.189 4.825 1.00 0.00 H new ATOM 0 HB3 LEU A 253 2.539 0.859 5.212 1.00 0.00 H new ATOM 0 HG LEU A 253 1.880 -0.768 6.903 1.00 0.00 H new ATOM 0 HD11 LEU A 253 -0.483 -1.403 7.191 1.00 0.00 H new ATOM 0 HD12 LEU A 253 -0.192 0.288 7.663 1.00 0.00 H new ATOM 0 HD13 LEU A 253 -0.966 -0.080 6.103 1.00 0.00 H new ATOM 0 HD21 LEU A 253 0.873 -2.455 5.417 1.00 0.00 H new ATOM 0 HD22 LEU A 253 0.442 -1.172 4.260 1.00 0.00 H new ATOM 0 HD23 LEU A 253 2.153 -1.531 4.595 1.00 0.00 H new ATOM 617 N PRO A 254 1.373 1.986 9.095 1.00 0.00 N ATOM 618 CA PRO A 254 1.737 1.584 10.457 1.00 0.00 C ATOM 619 C PRO A 254 1.415 0.120 10.735 1.00 0.00 C ATOM 620 O PRO A 254 0.458 -0.428 10.189 1.00 0.00 O ATOM 621 CB PRO A 254 0.879 2.496 11.337 1.00 0.00 C ATOM 622 CG PRO A 254 -0.290 2.853 10.487 1.00 0.00 C ATOM 623 CD PRO A 254 0.226 2.909 9.075 1.00 0.00 C ATOM 0 HA PRO A 254 2.808 1.679 10.637 1.00 0.00 H new ATOM 0 HB2 PRO A 254 0.565 1.986 12.248 1.00 0.00 H new ATOM 0 HB3 PRO A 254 1.431 3.384 11.643 1.00 0.00 H new ATOM 0 HG2 PRO A 254 -1.083 2.112 10.583 1.00 0.00 H new ATOM 0 HG3 PRO A 254 -0.712 3.812 10.787 1.00 0.00 H new ATOM 0 HD2 PRO A 254 -0.531 2.593 8.357 1.00 0.00 H new ATOM 0 HD3 PRO A 254 0.527 3.919 8.797 1.00 0.00 H new ATOM 631 N GLU A 255 2.220 -0.507 11.587 1.00 0.00 N ATOM 632 CA GLU A 255 2.019 -1.909 11.936 1.00 0.00 C ATOM 633 C GLU A 255 0.843 -2.068 12.894 1.00 0.00 C ATOM 634 O GLU A 255 0.013 -2.962 12.734 1.00 0.00 O ATOM 635 CB GLU A 255 3.288 -2.487 12.567 1.00 0.00 C ATOM 636 CG GLU A 255 4.413 -2.716 11.572 1.00 0.00 C ATOM 637 CD GLU A 255 5.782 -2.681 12.221 1.00 0.00 C ATOM 638 OE1 GLU A 255 6.128 -1.640 12.820 1.00 0.00 O ATOM 639 OE2 GLU A 255 6.509 -3.692 12.131 1.00 0.00 O ATOM 0 H GLU A 255 3.017 -0.067 12.048 1.00 0.00 H new ATOM 0 HA GLU A 255 1.795 -2.457 11.021 1.00 0.00 H new ATOM 0 HB2 GLU A 255 3.636 -1.810 13.347 1.00 0.00 H new ATOM 0 HB3 GLU A 255 3.044 -3.433 13.051 1.00 0.00 H new ATOM 0 HG2 GLU A 255 4.271 -3.680 11.084 1.00 0.00 H new ATOM 0 HG3 GLU A 255 4.365 -1.955 10.793 1.00 0.00 H new ATOM 646 N GLY A 256 0.779 -1.193 13.893 1.00 0.00 N ATOM 647 CA GLY A 256 -0.299 -1.253 14.864 1.00 0.00 C ATOM 648 C GLY A 256 -1.667 -1.255 14.212 1.00 0.00 C ATOM 649 O GLY A 256 -2.586 -1.924 14.684 1.00 0.00 O ATOM 0 H GLY A 256 1.454 -0.444 14.048 1.00 0.00 H new ATOM 0 HA2 GLY A 256 -0.188 -2.152 15.471 1.00 0.00 H new ATOM 0 HA3 GLY A 256 -0.223 -0.401 15.540 1.00 0.00 H new ATOM 653 N GLY A 257 -1.804 -0.503 13.124 1.00 0.00 N ATOM 654 CA GLY A 257 -3.074 -0.434 12.426 1.00 0.00 C ATOM 655 C GLY A 257 -2.972 -0.905 10.989 1.00 0.00 C ATOM 656 O GLY A 257 -2.198 -0.358 10.203 1.00 0.00 O ATOM 0 H GLY A 257 -1.058 0.059 12.714 1.00 0.00 H new ATOM 0 HA2 GLY A 257 -3.808 -1.043 12.953 1.00 0.00 H new ATOM 0 HA3 GLY A 257 -3.439 0.593 12.444 1.00 0.00 H new ATOM 660 N ILE A 258 -3.752 -1.924 10.645 1.00 0.00 N ATOM 661 CA ILE A 258 -3.745 -2.469 9.293 1.00 0.00 C ATOM 662 C ILE A 258 -3.893 -1.363 8.254 1.00 0.00 C ATOM 663 O ILE A 258 -3.318 -1.436 7.167 1.00 0.00 O ATOM 664 CB ILE A 258 -4.873 -3.499 9.095 1.00 0.00 C ATOM 665 CG1 ILE A 258 -6.230 -2.871 9.423 1.00 0.00 C ATOM 666 CG2 ILE A 258 -4.628 -4.726 9.960 1.00 0.00 C ATOM 667 CD1 ILE A 258 -7.406 -3.673 8.913 1.00 0.00 C ATOM 0 H ILE A 258 -4.397 -2.389 11.284 1.00 0.00 H new ATOM 0 HA ILE A 258 -2.784 -2.965 9.158 1.00 0.00 H new ATOM 0 HB ILE A 258 -4.881 -3.811 8.051 1.00 0.00 H new ATOM 0 HG12 ILE A 258 -6.318 -2.760 10.504 1.00 0.00 H new ATOM 0 HG13 ILE A 258 -6.271 -1.869 8.995 1.00 0.00 H new ATOM 0 HG21 ILE A 258 -5.434 -5.444 9.809 1.00 0.00 H new ATOM 0 HG22 ILE A 258 -3.678 -5.183 9.683 1.00 0.00 H new ATOM 0 HG23 ILE A 258 -4.597 -4.431 11.009 1.00 0.00 H new ATOM 0 HD11 ILE A 258 -8.334 -3.169 9.182 1.00 0.00 H new ATOM 0 HD12 ILE A 258 -7.342 -3.763 7.829 1.00 0.00 H new ATOM 0 HD13 ILE A 258 -7.390 -4.667 9.361 1.00 0.00 H new ATOM 679 N THR A 259 -4.667 -0.338 8.595 1.00 0.00 N ATOM 680 CA THR A 259 -4.890 0.785 7.693 1.00 0.00 C ATOM 681 C THR A 259 -3.587 1.236 7.044 1.00 0.00 C ATOM 682 O THR A 259 -2.540 1.271 7.690 1.00 0.00 O ATOM 683 CB THR A 259 -5.525 1.980 8.428 1.00 0.00 C ATOM 684 OG1 THR A 259 -4.714 2.353 9.548 1.00 0.00 O ATOM 685 CG2 THR A 259 -6.929 1.638 8.905 1.00 0.00 C ATOM 0 H THR A 259 -5.150 -0.262 9.490 1.00 0.00 H new ATOM 0 HA THR A 259 -5.576 0.438 6.921 1.00 0.00 H new ATOM 0 HB THR A 259 -5.588 2.815 7.731 1.00 0.00 H new ATOM 0 HG1 THR A 259 -5.123 3.115 10.009 1.00 0.00 H new ATOM 0 HG21 THR A 259 -7.357 2.497 9.421 1.00 0.00 H new ATOM 0 HG22 THR A 259 -7.552 1.382 8.048 1.00 0.00 H new ATOM 0 HG23 THR A 259 -6.885 0.790 9.588 1.00 0.00 H new ATOM 693 N ALA A 260 -3.658 1.583 5.763 1.00 0.00 N ATOM 694 CA ALA A 260 -2.484 2.036 5.028 1.00 0.00 C ATOM 695 C ALA A 260 -2.770 3.335 4.282 1.00 0.00 C ATOM 696 O ALA A 260 -3.793 3.463 3.610 1.00 0.00 O ATOM 697 CB ALA A 260 -2.022 0.959 4.057 1.00 0.00 C ATOM 0 H ALA A 260 -4.517 1.559 5.213 1.00 0.00 H new ATOM 0 HA ALA A 260 -1.688 2.229 5.747 1.00 0.00 H new ATOM 0 HB1 ALA A 260 -1.144 1.310 3.514 1.00 0.00 H new ATOM 0 HB2 ALA A 260 -1.769 0.055 4.610 1.00 0.00 H new ATOM 0 HB3 ALA A 260 -2.822 0.739 3.350 1.00 0.00 H new ATOM 703 N ILE A 261 -1.860 4.296 4.407 1.00 0.00 N ATOM 704 CA ILE A 261 -2.016 5.585 3.745 1.00 0.00 C ATOM 705 C ILE A 261 -1.124 5.680 2.512 1.00 0.00 C ATOM 706 O ILE A 261 0.063 5.356 2.564 1.00 0.00 O ATOM 707 CB ILE A 261 -1.684 6.750 4.696 1.00 0.00 C ATOM 708 CG1 ILE A 261 -2.566 6.685 5.944 1.00 0.00 C ATOM 709 CG2 ILE A 261 -1.863 8.082 3.983 1.00 0.00 C ATOM 710 CD1 ILE A 261 -1.982 5.837 7.053 1.00 0.00 C ATOM 0 H ILE A 261 -1.008 4.206 4.960 1.00 0.00 H new ATOM 0 HA ILE A 261 -3.060 5.661 3.442 1.00 0.00 H new ATOM 0 HB ILE A 261 -0.642 6.662 5.005 1.00 0.00 H new ATOM 0 HG12 ILE A 261 -2.728 7.696 6.318 1.00 0.00 H new ATOM 0 HG13 ILE A 261 -3.542 6.287 5.669 1.00 0.00 H new ATOM 0 HG21 ILE A 261 -1.625 8.896 4.668 1.00 0.00 H new ATOM 0 HG22 ILE A 261 -1.197 8.126 3.121 1.00 0.00 H new ATOM 0 HG23 ILE A 261 -2.896 8.180 3.649 1.00 0.00 H new ATOM 0 HD11 ILE A 261 -2.660 5.836 7.906 1.00 0.00 H new ATOM 0 HD12 ILE A 261 -1.846 4.816 6.697 1.00 0.00 H new ATOM 0 HD13 ILE A 261 -1.019 6.247 7.356 1.00 0.00 H new ATOM 722 N VAL A 262 -1.703 6.129 1.403 1.00 0.00 N ATOM 723 CA VAL A 262 -0.960 6.271 0.156 1.00 0.00 C ATOM 724 C VAL A 262 -1.191 7.642 -0.469 1.00 0.00 C ATOM 725 O VAL A 262 -2.312 8.150 -0.476 1.00 0.00 O ATOM 726 CB VAL A 262 -1.356 5.183 -0.860 1.00 0.00 C ATOM 727 CG1 VAL A 262 -0.575 5.351 -2.154 1.00 0.00 C ATOM 728 CG2 VAL A 262 -1.134 3.798 -0.270 1.00 0.00 C ATOM 0 H VAL A 262 -2.684 6.401 1.342 1.00 0.00 H new ATOM 0 HA VAL A 262 0.096 6.161 0.403 1.00 0.00 H new ATOM 0 HB VAL A 262 -2.417 5.291 -1.087 1.00 0.00 H new ATOM 0 HG11 VAL A 262 -0.868 4.574 -2.859 1.00 0.00 H new ATOM 0 HG12 VAL A 262 -0.789 6.330 -2.583 1.00 0.00 H new ATOM 0 HG13 VAL A 262 0.492 5.270 -1.948 1.00 0.00 H new ATOM 0 HG21 VAL A 262 -1.419 3.041 -1.001 1.00 0.00 H new ATOM 0 HG22 VAL A 262 -0.082 3.676 -0.013 1.00 0.00 H new ATOM 0 HG23 VAL A 262 -1.742 3.683 0.627 1.00 0.00 H new ATOM 738 N GLU A 263 -0.123 8.235 -0.993 1.00 0.00 N ATOM 739 CA GLU A 263 -0.211 9.549 -1.620 1.00 0.00 C ATOM 740 C GLU A 263 0.318 9.505 -3.051 1.00 0.00 C ATOM 741 O GLU A 263 1.499 9.753 -3.296 1.00 0.00 O ATOM 742 CB GLU A 263 0.573 10.581 -0.806 1.00 0.00 C ATOM 743 CG GLU A 263 0.718 11.923 -1.504 1.00 0.00 C ATOM 744 CD GLU A 263 1.565 12.902 -0.714 1.00 0.00 C ATOM 745 OE1 GLU A 263 1.208 13.195 0.446 1.00 0.00 O ATOM 746 OE2 GLU A 263 2.586 13.374 -1.256 1.00 0.00 O ATOM 0 H GLU A 263 0.812 7.827 -0.996 1.00 0.00 H new ATOM 0 HA GLU A 263 -1.261 9.841 -1.648 1.00 0.00 H new ATOM 0 HB2 GLU A 263 0.074 10.731 0.152 1.00 0.00 H new ATOM 0 HB3 GLU A 263 1.565 10.184 -0.590 1.00 0.00 H new ATOM 0 HG2 GLU A 263 1.166 11.771 -2.486 1.00 0.00 H new ATOM 0 HG3 GLU A 263 -0.270 12.352 -1.667 1.00 0.00 H new ATOM 753 N PHE A 264 -0.564 9.187 -3.993 1.00 0.00 N ATOM 754 CA PHE A 264 -0.186 9.108 -5.399 1.00 0.00 C ATOM 755 C PHE A 264 0.408 10.430 -5.877 1.00 0.00 C ATOM 756 O PHE A 264 -0.121 11.504 -5.585 1.00 0.00 O ATOM 757 CB PHE A 264 -1.400 8.743 -6.255 1.00 0.00 C ATOM 758 CG PHE A 264 -1.620 7.262 -6.381 1.00 0.00 C ATOM 759 CD1 PHE A 264 -2.002 6.509 -5.282 1.00 0.00 C ATOM 760 CD2 PHE A 264 -1.447 6.624 -7.599 1.00 0.00 C ATOM 761 CE1 PHE A 264 -2.204 5.147 -5.396 1.00 0.00 C ATOM 762 CE2 PHE A 264 -1.649 5.261 -7.718 1.00 0.00 C ATOM 763 CZ PHE A 264 -2.029 4.522 -6.615 1.00 0.00 C ATOM 0 H PHE A 264 -1.545 8.980 -3.808 1.00 0.00 H new ATOM 0 HA PHE A 264 0.571 8.331 -5.503 1.00 0.00 H new ATOM 0 HB2 PHE A 264 -2.290 9.199 -5.822 1.00 0.00 H new ATOM 0 HB3 PHE A 264 -1.275 9.170 -7.250 1.00 0.00 H new ATOM 0 HD1 PHE A 264 -2.143 6.992 -4.326 1.00 0.00 H new ATOM 0 HD2 PHE A 264 -1.151 7.198 -8.465 1.00 0.00 H new ATOM 0 HE1 PHE A 264 -2.499 4.571 -4.531 1.00 0.00 H new ATOM 0 HE2 PHE A 264 -1.510 4.775 -8.672 1.00 0.00 H new ATOM 0 HZ PHE A 264 -2.189 3.458 -6.705 1.00 0.00 H new ATOM 773 N LEU A 265 1.510 10.344 -6.613 1.00 0.00 N ATOM 774 CA LEU A 265 2.178 11.533 -7.132 1.00 0.00 C ATOM 775 C LEU A 265 1.287 12.267 -8.128 1.00 0.00 C ATOM 776 O LEU A 265 1.294 13.496 -8.193 1.00 0.00 O ATOM 777 CB LEU A 265 3.500 11.148 -7.800 1.00 0.00 C ATOM 778 CG LEU A 265 4.612 10.674 -6.865 1.00 0.00 C ATOM 779 CD1 LEU A 265 5.762 10.078 -7.661 1.00 0.00 C ATOM 780 CD2 LEU A 265 5.102 11.821 -5.994 1.00 0.00 C ATOM 0 H LEU A 265 1.960 9.464 -6.864 1.00 0.00 H new ATOM 0 HA LEU A 265 2.381 12.200 -6.295 1.00 0.00 H new ATOM 0 HB2 LEU A 265 3.301 10.358 -8.525 1.00 0.00 H new ATOM 0 HB3 LEU A 265 3.866 12.009 -8.359 1.00 0.00 H new ATOM 0 HG LEU A 265 4.207 9.898 -6.215 1.00 0.00 H new ATOM 0 HD11 LEU A 265 6.544 9.746 -6.978 1.00 0.00 H new ATOM 0 HD12 LEU A 265 5.402 9.228 -8.240 1.00 0.00 H new ATOM 0 HD13 LEU A 265 6.166 10.832 -8.336 1.00 0.00 H new ATOM 0 HD21 LEU A 265 5.894 11.465 -5.335 1.00 0.00 H new ATOM 0 HD22 LEU A 265 5.489 12.619 -6.627 1.00 0.00 H new ATOM 0 HD23 LEU A 265 4.275 12.202 -5.395 1.00 0.00 H new ATOM 792 N GLU A 266 0.518 11.505 -8.901 1.00 0.00 N ATOM 793 CA GLU A 266 -0.380 12.085 -9.892 1.00 0.00 C ATOM 794 C GLU A 266 -1.838 11.839 -9.515 1.00 0.00 C ATOM 795 O GLU A 266 -2.226 10.741 -9.117 1.00 0.00 O ATOM 796 CB GLU A 266 -0.094 11.499 -11.277 1.00 0.00 C ATOM 797 CG GLU A 266 -0.714 12.294 -12.414 1.00 0.00 C ATOM 798 CD GLU A 266 0.019 13.593 -12.685 1.00 0.00 C ATOM 799 OE1 GLU A 266 0.364 14.294 -11.711 1.00 0.00 O ATOM 800 OE2 GLU A 266 0.249 13.908 -13.871 1.00 0.00 O ATOM 0 H GLU A 266 0.499 10.486 -8.860 1.00 0.00 H new ATOM 0 HA GLU A 266 -0.206 13.161 -9.917 1.00 0.00 H new ATOM 0 HB2 GLU A 266 0.985 11.449 -11.426 1.00 0.00 H new ATOM 0 HB3 GLU A 266 -0.468 10.476 -11.314 1.00 0.00 H new ATOM 0 HG2 GLU A 266 -0.715 11.686 -13.319 1.00 0.00 H new ATOM 0 HG3 GLU A 266 -1.755 12.512 -12.175 1.00 0.00 H new ATOM 807 N PRO A 267 -2.666 12.887 -9.642 1.00 0.00 N ATOM 808 CA PRO A 267 -4.094 12.810 -9.319 1.00 0.00 C ATOM 809 C PRO A 267 -4.868 11.953 -10.315 1.00 0.00 C ATOM 810 O PRO A 267 -5.792 11.230 -9.940 1.00 0.00 O ATOM 811 CB PRO A 267 -4.554 14.268 -9.399 1.00 0.00 C ATOM 812 CG PRO A 267 -3.589 14.920 -10.327 1.00 0.00 C ATOM 813 CD PRO A 267 -2.273 14.226 -10.111 1.00 0.00 C ATOM 0 HA PRO A 267 -4.268 12.346 -8.348 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -5.575 14.341 -9.774 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -4.541 14.742 -8.417 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -3.916 14.822 -11.362 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -3.507 15.987 -10.118 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -1.690 14.175 -11.031 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -1.661 14.746 -9.374 1.00 0.00 H new ATOM 821 N LEU A 268 -4.486 12.037 -11.584 1.00 0.00 N ATOM 822 CA LEU A 268 -5.144 11.268 -12.634 1.00 0.00 C ATOM 823 C LEU A 268 -4.986 9.770 -12.393 1.00 0.00 C ATOM 824 O LEU A 268 -5.959 9.019 -12.436 1.00 0.00 O ATOM 825 CB LEU A 268 -4.568 11.638 -14.002 1.00 0.00 C ATOM 826 CG LEU A 268 -4.915 13.035 -14.520 1.00 0.00 C ATOM 827 CD1 LEU A 268 -4.063 13.381 -15.731 1.00 0.00 C ATOM 828 CD2 LEU A 268 -6.395 13.125 -14.863 1.00 0.00 C ATOM 0 H LEU A 268 -3.723 12.630 -11.911 1.00 0.00 H new ATOM 0 HA LEU A 268 -6.206 11.511 -12.615 1.00 0.00 H new ATOM 0 HB2 LEU A 268 -3.483 11.549 -13.953 1.00 0.00 H new ATOM 0 HB3 LEU A 268 -4.915 10.905 -14.731 1.00 0.00 H new ATOM 0 HG LEU A 268 -4.701 13.757 -13.732 1.00 0.00 H new ATOM 0 HD11 LEU A 268 -4.323 14.378 -16.086 1.00 0.00 H new ATOM 0 HD12 LEU A 268 -3.009 13.358 -15.453 1.00 0.00 H new ATOM 0 HD13 LEU A 268 -4.245 12.655 -16.523 1.00 0.00 H new ATOM 0 HD21 LEU A 268 -6.623 14.126 -15.230 1.00 0.00 H new ATOM 0 HD22 LEU A 268 -6.635 12.393 -15.634 1.00 0.00 H new ATOM 0 HD23 LEU A 268 -6.988 12.921 -13.972 1.00 0.00 H new ATOM 840 N GLU A 269 -3.753 9.344 -12.136 1.00 0.00 N ATOM 841 CA GLU A 269 -3.469 7.936 -11.885 1.00 0.00 C ATOM 842 C GLU A 269 -4.156 7.461 -10.608 1.00 0.00 C ATOM 843 O GLU A 269 -4.697 6.357 -10.556 1.00 0.00 O ATOM 844 CB GLU A 269 -1.959 7.708 -11.780 1.00 0.00 C ATOM 845 CG GLU A 269 -1.298 7.386 -13.110 1.00 0.00 C ATOM 846 CD GLU A 269 -1.020 8.625 -13.938 1.00 0.00 C ATOM 847 OE1 GLU A 269 -1.749 9.626 -13.772 1.00 0.00 O ATOM 848 OE2 GLU A 269 -0.073 8.595 -14.752 1.00 0.00 O ATOM 0 H GLU A 269 -2.936 9.953 -12.096 1.00 0.00 H new ATOM 0 HA GLU A 269 -3.859 7.358 -12.723 1.00 0.00 H new ATOM 0 HB2 GLU A 269 -1.494 8.599 -11.359 1.00 0.00 H new ATOM 0 HB3 GLU A 269 -1.771 6.891 -11.083 1.00 0.00 H new ATOM 0 HG2 GLU A 269 -0.362 6.858 -12.928 1.00 0.00 H new ATOM 0 HG3 GLU A 269 -1.940 6.711 -13.677 1.00 0.00 H new ATOM 855 N ALA A 270 -4.129 8.303 -9.580 1.00 0.00 N ATOM 856 CA ALA A 270 -4.750 7.970 -8.304 1.00 0.00 C ATOM 857 C ALA A 270 -6.202 7.545 -8.494 1.00 0.00 C ATOM 858 O ALA A 270 -6.616 6.488 -8.018 1.00 0.00 O ATOM 859 CB ALA A 270 -4.665 9.154 -7.352 1.00 0.00 C ATOM 0 H ALA A 270 -3.684 9.220 -9.606 1.00 0.00 H new ATOM 0 HA ALA A 270 -4.207 7.130 -7.872 1.00 0.00 H new ATOM 0 HB1 ALA A 270 -5.132 8.892 -6.403 1.00 0.00 H new ATOM 0 HB2 ALA A 270 -3.619 9.411 -7.183 1.00 0.00 H new ATOM 0 HB3 ALA A 270 -5.182 10.009 -7.787 1.00 0.00 H new ATOM 865 N ARG A 271 -6.970 8.375 -9.193 1.00 0.00 N ATOM 866 CA ARG A 271 -8.376 8.085 -9.444 1.00 0.00 C ATOM 867 C ARG A 271 -8.531 6.796 -10.246 1.00 0.00 C ATOM 868 O ARG A 271 -9.367 5.950 -9.928 1.00 0.00 O ATOM 869 CB ARG A 271 -9.033 9.246 -10.192 1.00 0.00 C ATOM 870 CG ARG A 271 -9.631 10.301 -9.276 1.00 0.00 C ATOM 871 CD ARG A 271 -9.789 11.635 -9.990 1.00 0.00 C ATOM 872 NE ARG A 271 -10.378 12.653 -9.124 1.00 0.00 N ATOM 873 CZ ARG A 271 -11.149 13.638 -9.568 1.00 0.00 C ATOM 874 NH1 ARG A 271 -11.425 13.738 -10.861 1.00 0.00 N ATOM 875 NH2 ARG A 271 -11.648 14.526 -8.718 1.00 0.00 N ATOM 0 H ARG A 271 -6.642 9.253 -9.595 1.00 0.00 H new ATOM 0 HA ARG A 271 -8.871 7.955 -8.482 1.00 0.00 H new ATOM 0 HB2 ARG A 271 -8.292 9.716 -10.838 1.00 0.00 H new ATOM 0 HB3 ARG A 271 -9.817 8.853 -10.839 1.00 0.00 H new ATOM 0 HG2 ARG A 271 -10.602 9.963 -8.916 1.00 0.00 H new ATOM 0 HG3 ARG A 271 -8.993 10.429 -8.401 1.00 0.00 H new ATOM 0 HD2 ARG A 271 -8.815 11.976 -10.340 1.00 0.00 H new ATOM 0 HD3 ARG A 271 -10.416 11.502 -10.872 1.00 0.00 H new ATOM 0 HE ARG A 271 -10.186 12.604 -8.123 1.00 0.00 H new ATOM 0 HH11 ARG A 271 -11.045 13.057 -11.518 1.00 0.00 H new ATOM 0 HH12 ARG A 271 -12.018 14.496 -11.199 1.00 0.00 H new ATOM 0 HH21 ARG A 271 -11.439 14.452 -7.722 1.00 0.00 H new ATOM 0 HH22 ARG A 271 -12.240 15.283 -9.060 1.00 0.00 H new ATOM 889 N LYS A 272 -7.720 6.654 -11.289 1.00 0.00 N ATOM 890 CA LYS A 272 -7.765 5.469 -12.137 1.00 0.00 C ATOM 891 C LYS A 272 -7.559 4.202 -11.314 1.00 0.00 C ATOM 892 O LYS A 272 -8.403 3.307 -11.313 1.00 0.00 O ATOM 893 CB LYS A 272 -6.698 5.559 -13.231 1.00 0.00 C ATOM 894 CG LYS A 272 -6.759 4.421 -14.236 1.00 0.00 C ATOM 895 CD LYS A 272 -5.799 4.646 -15.392 1.00 0.00 C ATOM 896 CE LYS A 272 -4.432 4.045 -15.105 1.00 0.00 C ATOM 897 NZ LYS A 272 -3.447 4.373 -16.172 1.00 0.00 N ATOM 0 H LYS A 272 -7.023 7.345 -11.567 1.00 0.00 H new ATOM 0 HA LYS A 272 -8.750 5.423 -12.601 1.00 0.00 H new ATOM 0 HB2 LYS A 272 -6.811 6.506 -13.760 1.00 0.00 H new ATOM 0 HB3 LYS A 272 -5.712 5.569 -12.766 1.00 0.00 H new ATOM 0 HG2 LYS A 272 -6.517 3.482 -13.739 1.00 0.00 H new ATOM 0 HG3 LYS A 272 -7.775 4.327 -14.619 1.00 0.00 H new ATOM 0 HD2 LYS A 272 -6.210 4.203 -16.299 1.00 0.00 H new ATOM 0 HD3 LYS A 272 -5.696 5.715 -15.578 1.00 0.00 H new ATOM 0 HE2 LYS A 272 -4.066 4.415 -14.147 1.00 0.00 H new ATOM 0 HE3 LYS A 272 -4.523 2.963 -15.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 272 -2.528 3.945 -15.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 272 -3.783 3.998 -17.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 272 -3.341 5.405 -16.241 1.00 0.00 H new ATOM 911 N ALA A 273 -6.431 4.134 -10.613 1.00 0.00 N ATOM 912 CA ALA A 273 -6.117 2.978 -9.783 1.00 0.00 C ATOM 913 C ALA A 273 -7.215 2.724 -8.756 1.00 0.00 C ATOM 914 O ALA A 273 -7.684 1.597 -8.599 1.00 0.00 O ATOM 915 CB ALA A 273 -4.777 3.176 -9.089 1.00 0.00 C ATOM 0 H ALA A 273 -5.720 4.866 -10.604 1.00 0.00 H new ATOM 0 HA ALA A 273 -6.053 2.103 -10.430 1.00 0.00 H new ATOM 0 HB1 ALA A 273 -4.555 2.305 -8.472 1.00 0.00 H new ATOM 0 HB2 ALA A 273 -3.994 3.300 -9.838 1.00 0.00 H new ATOM 0 HB3 ALA A 273 -4.821 4.065 -8.460 1.00 0.00 H new ATOM 921 N PHE A 274 -7.620 3.780 -8.057 1.00 0.00 N ATOM 922 CA PHE A 274 -8.662 3.671 -7.043 1.00 0.00 C ATOM 923 C PHE A 274 -9.826 2.822 -7.548 1.00 0.00 C ATOM 924 O PHE A 274 -10.224 1.851 -6.905 1.00 0.00 O ATOM 925 CB PHE A 274 -9.164 5.061 -6.646 1.00 0.00 C ATOM 926 CG PHE A 274 -9.836 5.095 -5.303 1.00 0.00 C ATOM 927 CD1 PHE A 274 -10.856 4.207 -5.001 1.00 0.00 C ATOM 928 CD2 PHE A 274 -9.447 6.015 -4.342 1.00 0.00 C ATOM 929 CE1 PHE A 274 -11.475 4.235 -3.766 1.00 0.00 C ATOM 930 CE2 PHE A 274 -10.063 6.047 -3.105 1.00 0.00 C ATOM 931 CZ PHE A 274 -11.079 5.157 -2.817 1.00 0.00 C ATOM 0 H PHE A 274 -7.242 4.720 -8.174 1.00 0.00 H new ATOM 0 HA PHE A 274 -8.233 3.184 -6.168 1.00 0.00 H new ATOM 0 HB2 PHE A 274 -8.323 5.754 -6.640 1.00 0.00 H new ATOM 0 HB3 PHE A 274 -9.864 5.416 -7.403 1.00 0.00 H new ATOM 0 HD1 PHE A 274 -11.171 3.485 -5.740 1.00 0.00 H new ATOM 0 HD2 PHE A 274 -8.654 6.714 -4.562 1.00 0.00 H new ATOM 0 HE1 PHE A 274 -12.268 3.536 -3.543 1.00 0.00 H new ATOM 0 HE2 PHE A 274 -9.750 6.768 -2.364 1.00 0.00 H new ATOM 0 HZ PHE A 274 -11.563 5.182 -1.852 1.00 0.00 H new ATOM 941 N ARG A 275 -10.367 3.198 -8.702 1.00 0.00 N ATOM 942 CA ARG A 275 -11.486 2.473 -9.293 1.00 0.00 C ATOM 943 C ARG A 275 -11.123 1.010 -9.528 1.00 0.00 C ATOM 944 O ARG A 275 -11.793 0.105 -9.029 1.00 0.00 O ATOM 945 CB ARG A 275 -11.903 3.125 -10.612 1.00 0.00 C ATOM 946 CG ARG A 275 -12.437 4.539 -10.452 1.00 0.00 C ATOM 947 CD ARG A 275 -13.786 4.549 -9.751 1.00 0.00 C ATOM 948 NE ARG A 275 -14.850 4.028 -10.604 1.00 0.00 N ATOM 949 CZ ARG A 275 -15.511 4.767 -11.488 1.00 0.00 C ATOM 950 NH1 ARG A 275 -15.219 6.052 -11.634 1.00 0.00 N ATOM 951 NH2 ARG A 275 -16.467 4.221 -12.229 1.00 0.00 N ATOM 0 H ARG A 275 -10.049 4.000 -9.246 1.00 0.00 H new ATOM 0 HA ARG A 275 -12.322 2.514 -8.595 1.00 0.00 H new ATOM 0 HB2 ARG A 275 -11.046 3.144 -11.285 1.00 0.00 H new ATOM 0 HB3 ARG A 275 -12.667 2.509 -11.086 1.00 0.00 H new ATOM 0 HG2 ARG A 275 -11.725 5.136 -9.882 1.00 0.00 H new ATOM 0 HG3 ARG A 275 -12.532 5.006 -11.432 1.00 0.00 H new ATOM 0 HD2 ARG A 275 -13.726 3.952 -8.841 1.00 0.00 H new ATOM 0 HD3 ARG A 275 -14.030 5.567 -9.449 1.00 0.00 H new ATOM 0 HE ARG A 275 -15.099 3.043 -10.516 1.00 0.00 H new ATOM 0 HH11 ARG A 275 -14.485 6.476 -11.067 1.00 0.00 H new ATOM 0 HH12 ARG A 275 -15.728 6.617 -12.314 1.00 0.00 H new ATOM 0 HH21 ARG A 275 -16.695 3.233 -12.120 1.00 0.00 H new ATOM 0 HH22 ARG A 275 -16.974 4.790 -12.907 1.00 0.00 H new ATOM 965 N HIS A 276 -10.058 0.785 -10.291 1.00 0.00 N ATOM 966 CA HIS A 276 -9.605 -0.568 -10.593 1.00 0.00 C ATOM 967 C HIS A 276 -9.527 -1.410 -9.323 1.00 0.00 C ATOM 968 O HIS A 276 -10.195 -2.438 -9.205 1.00 0.00 O ATOM 969 CB HIS A 276 -8.239 -0.531 -11.279 1.00 0.00 C ATOM 970 CG HIS A 276 -8.230 0.258 -12.552 1.00 0.00 C ATOM 971 ND1 HIS A 276 -9.217 0.153 -13.510 1.00 0.00 N ATOM 972 CD2 HIS A 276 -7.347 1.170 -13.022 1.00 0.00 C ATOM 973 CE1 HIS A 276 -8.940 0.965 -14.514 1.00 0.00 C ATOM 974 NE2 HIS A 276 -7.811 1.594 -14.243 1.00 0.00 N ATOM 0 H HIS A 276 -9.493 1.522 -10.711 1.00 0.00 H new ATOM 0 HA HIS A 276 -10.329 -1.025 -11.268 1.00 0.00 H new ATOM 0 HB2 HIS A 276 -7.508 -0.105 -10.592 1.00 0.00 H new ATOM 0 HB3 HIS A 276 -7.920 -1.552 -11.491 1.00 0.00 H new ATOM 0 HD1 HIS A 276 -10.033 -0.456 -13.452 1.00 0.00 H new ATOM 0 HD2 HIS A 276 -6.446 1.502 -12.529 1.00 0.00 H new ATOM 0 HE1 HIS A 276 -9.536 1.093 -15.406 1.00 0.00 H new ATOM 983 N LEU A 277 -8.706 -0.969 -8.376 1.00 0.00 N ATOM 984 CA LEU A 277 -8.540 -1.682 -7.114 1.00 0.00 C ATOM 985 C LEU A 277 -9.874 -1.824 -6.388 1.00 0.00 C ATOM 986 O LEU A 277 -10.151 -2.854 -5.775 1.00 0.00 O ATOM 987 CB LEU A 277 -7.536 -0.951 -6.221 1.00 0.00 C ATOM 988 CG LEU A 277 -6.193 -0.603 -6.866 1.00 0.00 C ATOM 989 CD1 LEU A 277 -5.259 0.028 -5.845 1.00 0.00 C ATOM 990 CD2 LEU A 277 -5.558 -1.842 -7.479 1.00 0.00 C ATOM 0 H LEU A 277 -8.145 -0.121 -8.458 1.00 0.00 H new ATOM 0 HA LEU A 277 -8.161 -2.679 -7.336 1.00 0.00 H new ATOM 0 HB2 LEU A 277 -7.997 -0.028 -5.869 1.00 0.00 H new ATOM 0 HB3 LEU A 277 -7.346 -1.567 -5.342 1.00 0.00 H new ATOM 0 HG LEU A 277 -6.370 0.120 -7.662 1.00 0.00 H new ATOM 0 HD11 LEU A 277 -4.309 0.269 -6.321 1.00 0.00 H new ATOM 0 HD12 LEU A 277 -5.710 0.940 -5.454 1.00 0.00 H new ATOM 0 HD13 LEU A 277 -5.088 -0.672 -5.027 1.00 0.00 H new ATOM 0 HD21 LEU A 277 -4.604 -1.575 -7.933 1.00 0.00 H new ATOM 0 HD22 LEU A 277 -5.394 -2.589 -6.702 1.00 0.00 H new ATOM 0 HD23 LEU A 277 -6.221 -2.251 -8.242 1.00 0.00 H new ATOM 1002 N ALA A 278 -10.697 -0.783 -6.465 1.00 0.00 N ATOM 1003 CA ALA A 278 -12.003 -0.793 -5.819 1.00 0.00 C ATOM 1004 C ALA A 278 -12.712 -2.126 -6.035 1.00 0.00 C ATOM 1005 O ALA A 278 -12.901 -2.563 -7.171 1.00 0.00 O ATOM 1006 CB ALA A 278 -12.859 0.352 -6.340 1.00 0.00 C ATOM 0 H ALA A 278 -10.482 0.078 -6.968 1.00 0.00 H new ATOM 0 HA ALA A 278 -11.852 -0.661 -4.748 1.00 0.00 H new ATOM 0 HB1 ALA A 278 -13.832 0.332 -5.849 1.00 0.00 H new ATOM 0 HB2 ALA A 278 -12.365 1.301 -6.129 1.00 0.00 H new ATOM 0 HB3 ALA A 278 -12.994 0.245 -7.416 1.00 0.00 H new ATOM 1012 N TYR A 279 -13.101 -2.768 -4.940 1.00 0.00 N ATOM 1013 CA TYR A 279 -13.787 -4.053 -5.010 1.00 0.00 C ATOM 1014 C TYR A 279 -12.819 -5.166 -5.400 1.00 0.00 C ATOM 1015 O TYR A 279 -13.175 -6.083 -6.141 1.00 0.00 O ATOM 1016 CB TYR A 279 -14.938 -3.987 -6.015 1.00 0.00 C ATOM 1017 CG TYR A 279 -15.772 -2.732 -5.898 1.00 0.00 C ATOM 1018 CD1 TYR A 279 -16.549 -2.492 -4.772 1.00 0.00 C ATOM 1019 CD2 TYR A 279 -15.783 -1.785 -6.915 1.00 0.00 C ATOM 1020 CE1 TYR A 279 -17.313 -1.347 -4.662 1.00 0.00 C ATOM 1021 CE2 TYR A 279 -16.543 -0.636 -6.813 1.00 0.00 C ATOM 1022 CZ TYR A 279 -17.307 -0.421 -5.685 1.00 0.00 C ATOM 1023 OH TYR A 279 -18.066 0.722 -5.578 1.00 0.00 O ATOM 0 H TYR A 279 -12.953 -2.420 -3.993 1.00 0.00 H new ATOM 0 HA TYR A 279 -14.190 -4.276 -4.022 1.00 0.00 H new ATOM 0 HB2 TYR A 279 -14.532 -4.051 -7.025 1.00 0.00 H new ATOM 0 HB3 TYR A 279 -15.582 -4.855 -5.875 1.00 0.00 H new ATOM 0 HD1 TYR A 279 -16.556 -3.214 -3.968 1.00 0.00 H new ATOM 0 HD2 TYR A 279 -15.187 -1.950 -7.800 1.00 0.00 H new ATOM 0 HE1 TYR A 279 -17.912 -1.177 -3.780 1.00 0.00 H new ATOM 0 HE2 TYR A 279 -16.539 0.090 -7.612 1.00 0.00 H new ATOM 0 HH TYR A 279 -17.949 1.269 -6.383 1.00 0.00 H new ATOM 1033 N SER A 280 -11.592 -5.079 -4.895 1.00 0.00 N ATOM 1034 CA SER A 280 -10.571 -6.076 -5.192 1.00 0.00 C ATOM 1035 C SER A 280 -9.957 -6.624 -3.908 1.00 0.00 C ATOM 1036 O SER A 280 -9.954 -5.957 -2.873 1.00 0.00 O ATOM 1037 CB SER A 280 -9.478 -5.470 -6.075 1.00 0.00 C ATOM 1038 OG SER A 280 -8.559 -4.715 -5.304 1.00 0.00 O ATOM 0 H SER A 280 -11.282 -4.328 -4.278 1.00 0.00 H new ATOM 0 HA SER A 280 -11.046 -6.898 -5.727 1.00 0.00 H new ATOM 0 HB2 SER A 280 -8.949 -6.265 -6.601 1.00 0.00 H new ATOM 0 HB3 SER A 280 -9.931 -4.832 -6.834 1.00 0.00 H new ATOM 0 HG SER A 280 -8.860 -3.784 -5.256 1.00 0.00 H new ATOM 1044 N LYS A 281 -9.436 -7.845 -3.982 1.00 0.00 N ATOM 1045 CA LYS A 281 -8.817 -8.485 -2.828 1.00 0.00 C ATOM 1046 C LYS A 281 -7.297 -8.483 -2.954 1.00 0.00 C ATOM 1047 O LYS A 281 -6.747 -8.945 -3.954 1.00 0.00 O ATOM 1048 CB LYS A 281 -9.326 -9.921 -2.681 1.00 0.00 C ATOM 1049 CG LYS A 281 -8.696 -10.892 -3.664 1.00 0.00 C ATOM 1050 CD LYS A 281 -9.641 -12.031 -4.006 1.00 0.00 C ATOM 1051 CE LYS A 281 -9.469 -13.204 -3.053 1.00 0.00 C ATOM 1052 NZ LYS A 281 -10.348 -13.080 -1.858 1.00 0.00 N ATOM 0 H LYS A 281 -9.431 -8.411 -4.831 1.00 0.00 H new ATOM 0 HA LYS A 281 -9.090 -7.916 -1.939 1.00 0.00 H new ATOM 0 HB2 LYS A 281 -9.129 -10.265 -1.666 1.00 0.00 H new ATOM 0 HB3 LYS A 281 -10.408 -9.930 -2.816 1.00 0.00 H new ATOM 0 HG2 LYS A 281 -8.420 -10.361 -4.575 1.00 0.00 H new ATOM 0 HG3 LYS A 281 -7.777 -11.296 -3.240 1.00 0.00 H new ATOM 0 HD2 LYS A 281 -10.671 -11.676 -3.965 1.00 0.00 H new ATOM 0 HD3 LYS A 281 -9.459 -12.362 -5.028 1.00 0.00 H new ATOM 0 HE2 LYS A 281 -9.696 -14.133 -3.576 1.00 0.00 H new ATOM 0 HE3 LYS A 281 -8.428 -13.263 -2.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 -10.202 -13.898 -1.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 -10.115 -12.206 -1.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 -11.343 -13.049 -2.160 1.00 0.00 H new ATOM 1066 N PHE A 282 -6.624 -7.961 -1.934 1.00 0.00 N ATOM 1067 CA PHE A 282 -5.167 -7.899 -1.932 1.00 0.00 C ATOM 1068 C PHE A 282 -4.564 -9.291 -1.761 1.00 0.00 C ATOM 1069 O PHE A 282 -3.816 -9.765 -2.617 1.00 0.00 O ATOM 1070 CB PHE A 282 -4.676 -6.978 -0.813 1.00 0.00 C ATOM 1071 CG PHE A 282 -3.274 -7.276 -0.363 1.00 0.00 C ATOM 1072 CD1 PHE A 282 -2.188 -6.819 -1.091 1.00 0.00 C ATOM 1073 CD2 PHE A 282 -3.043 -8.012 0.787 1.00 0.00 C ATOM 1074 CE1 PHE A 282 -0.896 -7.091 -0.680 1.00 0.00 C ATOM 1075 CE2 PHE A 282 -1.754 -8.287 1.204 1.00 0.00 C ATOM 1076 CZ PHE A 282 -0.679 -7.826 0.468 1.00 0.00 C ATOM 0 H PHE A 282 -7.064 -7.575 -1.099 1.00 0.00 H new ATOM 0 HA PHE A 282 -4.844 -7.497 -2.892 1.00 0.00 H new ATOM 0 HB2 PHE A 282 -4.727 -5.944 -1.155 1.00 0.00 H new ATOM 0 HB3 PHE A 282 -5.349 -7.065 0.040 1.00 0.00 H new ATOM 0 HD1 PHE A 282 -2.352 -6.244 -1.990 1.00 0.00 H new ATOM 0 HD2 PHE A 282 -3.880 -8.375 1.365 1.00 0.00 H new ATOM 0 HE1 PHE A 282 -0.058 -6.729 -1.257 1.00 0.00 H new ATOM 0 HE2 PHE A 282 -1.587 -8.861 2.103 1.00 0.00 H new ATOM 0 HZ PHE A 282 0.329 -8.040 0.791 1.00 0.00 H new ATOM 1086 N HIS A 283 -4.895 -9.940 -0.650 1.00 0.00 N ATOM 1087 CA HIS A 283 -4.387 -11.278 -0.366 1.00 0.00 C ATOM 1088 C HIS A 283 -5.534 -12.264 -0.168 1.00 0.00 C ATOM 1089 O HIS A 283 -5.819 -13.084 -1.042 1.00 0.00 O ATOM 1090 CB HIS A 283 -3.498 -11.256 0.877 1.00 0.00 C ATOM 1091 CG HIS A 283 -2.062 -10.948 0.582 1.00 0.00 C ATOM 1092 ND1 HIS A 283 -1.050 -11.125 1.501 1.00 0.00 N ATOM 1093 CD2 HIS A 283 -1.471 -10.474 -0.540 1.00 0.00 C ATOM 1094 CE1 HIS A 283 0.101 -10.772 0.958 1.00 0.00 C ATOM 1095 NE2 HIS A 283 -0.127 -10.373 -0.280 1.00 0.00 N ATOM 0 H HIS A 283 -5.512 -9.562 0.068 1.00 0.00 H new ATOM 0 HA HIS A 283 -3.795 -11.604 -1.221 1.00 0.00 H new ATOM 0 HB2 HIS A 283 -3.884 -10.514 1.576 1.00 0.00 H new ATOM 0 HB3 HIS A 283 -3.559 -12.224 1.374 1.00 0.00 H new ATOM 0 HD2 HIS A 283 -1.965 -10.222 -1.467 1.00 0.00 H new ATOM 0 HE1 HIS A 283 1.065 -10.804 1.444 1.00 0.00 H new ATOM 0 HE2 HIS A 283 0.581 -10.043 -0.936 1.00 0.00 H new ATOM 1104 N HIS A 284 -6.189 -12.179 0.986 1.00 0.00 N ATOM 1105 CA HIS A 284 -7.305 -13.065 1.298 1.00 0.00 C ATOM 1106 C HIS A 284 -8.544 -12.262 1.684 1.00 0.00 C ATOM 1107 O HIS A 284 -9.668 -12.758 1.604 1.00 0.00 O ATOM 1108 CB HIS A 284 -6.926 -14.017 2.433 1.00 0.00 C ATOM 1109 CG HIS A 284 -6.200 -13.348 3.559 1.00 0.00 C ATOM 1110 ND1 HIS A 284 -6.829 -12.906 4.703 1.00 0.00 N ATOM 1111 CD2 HIS A 284 -4.889 -13.047 3.712 1.00 0.00 C ATOM 1112 CE1 HIS A 284 -5.937 -12.361 5.511 1.00 0.00 C ATOM 1113 NE2 HIS A 284 -4.752 -12.435 4.933 1.00 0.00 N ATOM 0 H HIS A 284 -5.966 -11.506 1.720 1.00 0.00 H new ATOM 0 HA HIS A 284 -7.534 -13.648 0.406 1.00 0.00 H new ATOM 0 HB2 HIS A 284 -7.831 -14.484 2.822 1.00 0.00 H new ATOM 0 HB3 HIS A 284 -6.302 -14.816 2.033 1.00 0.00 H new ATOM 0 HD2 HIS A 284 -4.098 -13.250 3.005 1.00 0.00 H new ATOM 0 HE1 HIS A 284 -6.142 -11.929 6.479 1.00 0.00 H new ATOM 0 HE2 HIS A 284 -3.877 -12.093 5.330 1.00 0.00 H new ATOM 1122 N VAL A 285 -8.330 -11.019 2.105 1.00 0.00 N ATOM 1123 CA VAL A 285 -9.429 -10.147 2.503 1.00 0.00 C ATOM 1124 C VAL A 285 -9.603 -8.997 1.517 1.00 0.00 C ATOM 1125 O VAL A 285 -8.657 -8.559 0.862 1.00 0.00 O ATOM 1126 CB VAL A 285 -9.204 -9.570 3.913 1.00 0.00 C ATOM 1127 CG1 VAL A 285 -9.005 -10.690 4.923 1.00 0.00 C ATOM 1128 CG2 VAL A 285 -8.016 -8.620 3.917 1.00 0.00 C ATOM 0 H VAL A 285 -7.406 -10.594 2.179 1.00 0.00 H new ATOM 0 HA VAL A 285 -10.332 -10.757 2.508 1.00 0.00 H new ATOM 0 HB VAL A 285 -10.091 -9.006 4.202 1.00 0.00 H new ATOM 0 HG11 VAL A 285 -8.847 -10.263 5.913 1.00 0.00 H new ATOM 0 HG12 VAL A 285 -9.889 -11.327 4.939 1.00 0.00 H new ATOM 0 HG13 VAL A 285 -8.135 -11.284 4.641 1.00 0.00 H new ATOM 0 HG21 VAL A 285 -7.872 -8.222 4.921 1.00 0.00 H new ATOM 0 HG22 VAL A 285 -7.119 -9.157 3.608 1.00 0.00 H new ATOM 0 HG23 VAL A 285 -8.204 -7.799 3.225 1.00 0.00 H new ATOM 1138 N PRO A 286 -10.842 -8.494 1.408 1.00 0.00 N ATOM 1139 CA PRO A 286 -11.170 -7.387 0.505 1.00 0.00 C ATOM 1140 C PRO A 286 -10.568 -6.065 0.967 1.00 0.00 C ATOM 1141 O PRO A 286 -10.462 -5.804 2.166 1.00 0.00 O ATOM 1142 CB PRO A 286 -12.699 -7.327 0.559 1.00 0.00 C ATOM 1143 CG PRO A 286 -13.055 -7.915 1.880 1.00 0.00 C ATOM 1144 CD PRO A 286 -12.018 -8.967 2.158 1.00 0.00 C ATOM 0 HA PRO A 286 -10.771 -7.546 -0.497 1.00 0.00 H new ATOM 0 HB2 PRO A 286 -13.058 -6.302 0.472 1.00 0.00 H new ATOM 0 HB3 PRO A 286 -13.146 -7.892 -0.259 1.00 0.00 H new ATOM 0 HG2 PRO A 286 -13.056 -7.153 2.659 1.00 0.00 H new ATOM 0 HG3 PRO A 286 -14.055 -8.349 1.857 1.00 0.00 H new ATOM 0 HD2 PRO A 286 -11.807 -9.052 3.224 1.00 0.00 H new ATOM 0 HD3 PRO A 286 -12.342 -9.951 1.818 1.00 0.00 H new ATOM 1152 N LEU A 287 -10.175 -5.232 0.009 1.00 0.00 N ATOM 1153 CA LEU A 287 -9.584 -3.935 0.317 1.00 0.00 C ATOM 1154 C LEU A 287 -10.638 -2.833 0.279 1.00 0.00 C ATOM 1155 O LEU A 287 -11.452 -2.770 -0.643 1.00 0.00 O ATOM 1156 CB LEU A 287 -8.461 -3.616 -0.671 1.00 0.00 C ATOM 1157 CG LEU A 287 -7.214 -4.496 -0.577 1.00 0.00 C ATOM 1158 CD1 LEU A 287 -6.383 -4.383 -1.845 1.00 0.00 C ATOM 1159 CD2 LEU A 287 -6.385 -4.117 0.642 1.00 0.00 C ATOM 0 H LEU A 287 -10.255 -5.432 -0.988 1.00 0.00 H new ATOM 0 HA LEU A 287 -9.171 -3.982 1.324 1.00 0.00 H new ATOM 0 HB2 LEU A 287 -8.861 -3.694 -1.682 1.00 0.00 H new ATOM 0 HB3 LEU A 287 -8.161 -2.578 -0.526 1.00 0.00 H new ATOM 0 HG LEU A 287 -7.532 -5.533 -0.468 1.00 0.00 H new ATOM 0 HD11 LEU A 287 -5.500 -5.016 -1.759 1.00 0.00 H new ATOM 0 HD12 LEU A 287 -6.978 -4.704 -2.700 1.00 0.00 H new ATOM 0 HD13 LEU A 287 -6.074 -3.347 -1.987 1.00 0.00 H new ATOM 0 HD21 LEU A 287 -5.501 -4.753 0.693 1.00 0.00 H new ATOM 0 HD22 LEU A 287 -6.077 -3.074 0.563 1.00 0.00 H new ATOM 0 HD23 LEU A 287 -6.982 -4.252 1.544 1.00 0.00 H new ATOM 1171 N TYR A 288 -10.617 -1.966 1.285 1.00 0.00 N ATOM 1172 CA TYR A 288 -11.571 -0.866 1.367 1.00 0.00 C ATOM 1173 C TYR A 288 -10.871 0.477 1.182 1.00 0.00 C ATOM 1174 O TYR A 288 -10.258 1.004 2.111 1.00 0.00 O ATOM 1175 CB TYR A 288 -12.299 -0.894 2.712 1.00 0.00 C ATOM 1176 CG TYR A 288 -13.563 -1.722 2.699 1.00 0.00 C ATOM 1177 CD1 TYR A 288 -13.537 -3.062 2.334 1.00 0.00 C ATOM 1178 CD2 TYR A 288 -14.786 -1.164 3.054 1.00 0.00 C ATOM 1179 CE1 TYR A 288 -14.690 -3.822 2.320 1.00 0.00 C ATOM 1180 CE2 TYR A 288 -15.944 -1.917 3.044 1.00 0.00 C ATOM 1181 CZ TYR A 288 -15.891 -3.245 2.676 1.00 0.00 C ATOM 1182 OH TYR A 288 -17.042 -3.999 2.665 1.00 0.00 O ATOM 0 H TYR A 288 -9.950 -2.003 2.055 1.00 0.00 H new ATOM 0 HA TYR A 288 -12.299 -0.989 0.565 1.00 0.00 H new ATOM 0 HB2 TYR A 288 -11.625 -1.288 3.472 1.00 0.00 H new ATOM 0 HB3 TYR A 288 -12.546 0.127 3.003 1.00 0.00 H new ATOM 0 HD1 TYR A 288 -12.598 -3.518 2.056 1.00 0.00 H new ATOM 0 HD2 TYR A 288 -14.831 -0.124 3.342 1.00 0.00 H new ATOM 0 HE1 TYR A 288 -14.651 -4.862 2.032 1.00 0.00 H new ATOM 0 HE2 TYR A 288 -16.886 -1.468 3.323 1.00 0.00 H new ATOM 0 HH TYR A 288 -17.800 -3.443 2.943 1.00 0.00 H new ATOM 1192 N LEU A 289 -10.968 1.026 -0.023 1.00 0.00 N ATOM 1193 CA LEU A 289 -10.346 2.308 -0.332 1.00 0.00 C ATOM 1194 C LEU A 289 -11.270 3.465 0.034 1.00 0.00 C ATOM 1195 O LEU A 289 -12.480 3.395 -0.178 1.00 0.00 O ATOM 1196 CB LEU A 289 -9.986 2.379 -1.818 1.00 0.00 C ATOM 1197 CG LEU A 289 -8.998 1.326 -2.320 1.00 0.00 C ATOM 1198 CD1 LEU A 289 -8.790 1.461 -3.820 1.00 0.00 C ATOM 1199 CD2 LEU A 289 -7.672 1.445 -1.583 1.00 0.00 C ATOM 0 H LEU A 289 -11.472 0.603 -0.803 1.00 0.00 H new ATOM 0 HA LEU A 289 -9.435 2.393 0.261 1.00 0.00 H new ATOM 0 HB2 LEU A 289 -10.905 2.292 -2.398 1.00 0.00 H new ATOM 0 HB3 LEU A 289 -9.571 3.365 -2.024 1.00 0.00 H new ATOM 0 HG LEU A 289 -9.415 0.339 -2.119 1.00 0.00 H new ATOM 0 HD11 LEU A 289 -8.084 0.703 -4.159 1.00 0.00 H new ATOM 0 HD12 LEU A 289 -9.742 1.325 -4.333 1.00 0.00 H new ATOM 0 HD13 LEU A 289 -8.395 2.452 -4.045 1.00 0.00 H new ATOM 0 HD21 LEU A 289 -6.981 0.688 -1.953 1.00 0.00 H new ATOM 0 HD22 LEU A 289 -7.250 2.436 -1.752 1.00 0.00 H new ATOM 0 HD23 LEU A 289 -7.835 1.297 -0.515 1.00 0.00 H new ATOM 1211 N GLU A 290 -10.691 4.528 0.583 1.00 0.00 N ATOM 1212 CA GLU A 290 -11.464 5.700 0.978 1.00 0.00 C ATOM 1213 C GLU A 290 -10.651 6.977 0.789 1.00 0.00 C ATOM 1214 O GLU A 290 -9.627 7.176 1.444 1.00 0.00 O ATOM 1215 CB GLU A 290 -11.910 5.577 2.436 1.00 0.00 C ATOM 1216 CG GLU A 290 -13.216 6.295 2.736 1.00 0.00 C ATOM 1217 CD GLU A 290 -14.356 5.825 1.853 1.00 0.00 C ATOM 1218 OE1 GLU A 290 -14.843 4.695 2.065 1.00 0.00 O ATOM 1219 OE2 GLU A 290 -14.760 6.587 0.950 1.00 0.00 O ATOM 0 H GLU A 290 -9.690 4.602 0.764 1.00 0.00 H new ATOM 0 HA GLU A 290 -12.346 5.754 0.340 1.00 0.00 H new ATOM 0 HB2 GLU A 290 -12.020 4.522 2.686 1.00 0.00 H new ATOM 0 HB3 GLU A 290 -11.128 5.978 3.081 1.00 0.00 H new ATOM 0 HG2 GLU A 290 -13.482 6.136 3.781 1.00 0.00 H new ATOM 0 HG3 GLU A 290 -13.076 7.368 2.602 1.00 0.00 H new ATOM 1226 N TRP A 291 -11.113 7.838 -0.110 1.00 0.00 N ATOM 1227 CA TRP A 291 -10.428 9.096 -0.386 1.00 0.00 C ATOM 1228 C TRP A 291 -10.011 9.784 0.910 1.00 0.00 C ATOM 1229 O TRP A 291 -10.665 9.633 1.941 1.00 0.00 O ATOM 1230 CB TRP A 291 -11.330 10.023 -1.203 1.00 0.00 C ATOM 1231 CG TRP A 291 -11.421 9.640 -2.649 1.00 0.00 C ATOM 1232 CD1 TRP A 291 -12.557 9.355 -3.351 1.00 0.00 C ATOM 1233 CD2 TRP A 291 -10.332 9.497 -3.568 1.00 0.00 C ATOM 1234 NE1 TRP A 291 -12.240 9.044 -4.652 1.00 0.00 N ATOM 1235 CE2 TRP A 291 -10.882 9.125 -4.810 1.00 0.00 C ATOM 1236 CE3 TRP A 291 -8.947 9.649 -3.462 1.00 0.00 C ATOM 1237 CZ2 TRP A 291 -10.093 8.902 -5.936 1.00 0.00 C ATOM 1238 CZ3 TRP A 291 -8.166 9.427 -4.581 1.00 0.00 C ATOM 1239 CH2 TRP A 291 -8.740 9.058 -5.804 1.00 0.00 C ATOM 0 H TRP A 291 -11.959 7.689 -0.660 1.00 0.00 H new ATOM 0 HA TRP A 291 -9.530 8.874 -0.963 1.00 0.00 H new ATOM 0 HB2 TRP A 291 -12.330 10.019 -0.770 1.00 0.00 H new ATOM 0 HB3 TRP A 291 -10.954 11.043 -1.128 1.00 0.00 H new ATOM 0 HD1 TRP A 291 -13.557 9.371 -2.944 1.00 0.00 H new ATOM 0 HE1 TRP A 291 -12.908 8.794 -5.381 1.00 0.00 H new ATOM 0 HE3 TRP A 291 -8.495 9.935 -2.524 1.00 0.00 H new ATOM 0 HZ2 TRP A 291 -10.533 8.616 -6.880 1.00 0.00 H new ATOM 0 HZ3 TRP A 291 -7.094 9.540 -4.511 1.00 0.00 H new ATOM 0 HH2 TRP A 291 -8.102 8.893 -6.660 1.00 0.00 H new ATOM 1250 N ALA A 292 -8.920 10.540 0.849 1.00 0.00 N ATOM 1251 CA ALA A 292 -8.418 11.253 2.017 1.00 0.00 C ATOM 1252 C ALA A 292 -8.741 12.741 1.932 1.00 0.00 C ATOM 1253 O ALA A 292 -8.607 13.371 0.883 1.00 0.00 O ATOM 1254 CB ALA A 292 -6.918 11.044 2.159 1.00 0.00 C ATOM 0 H ALA A 292 -8.367 10.675 0.003 1.00 0.00 H new ATOM 0 HA ALA A 292 -8.915 10.850 2.899 1.00 0.00 H new ATOM 0 HB1 ALA A 292 -6.557 11.582 3.035 1.00 0.00 H new ATOM 0 HB2 ALA A 292 -6.708 9.981 2.274 1.00 0.00 H new ATOM 0 HB3 ALA A 292 -6.413 11.419 1.269 1.00 0.00 H new