USER MOD reduce.3.24.130724 H: found=0, std=0, add=593, rem=0, adj=11 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 140:sc= -0.165 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 : amide:sc= -1.51 K(o=-1.5,f=-0.48) USER MOD Single : A 233 THR OG1 : rot 82:sc= -0.382 USER MOD Single : A 239 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 241 THR OG1 : rot 74:sc= 0.842 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= -1.96 K(o=-2,f=-3.3!) USER MOD Single : A 279 TYR OH : rot 180:sc= 0 USER MOD Single : A 280 SER OG : rot -104:sc= 1.19 USER MOD Single : A 281 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 283 HIS : no HD1:sc= -8.95! C(o=-9!,f=-10!) USER MOD Single : A 284 HIS : no HD1:sc= -0.585 K(o=-0.59,f=-0.046) USER MOD Single : A 288 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 90 N SER A 220 -8.950 14.931 -0.108 1.00 0.00 N ATOM 91 CA SER A 220 -7.705 14.923 -0.867 1.00 0.00 C ATOM 92 C SER A 220 -7.924 14.348 -2.263 1.00 0.00 C ATOM 93 O SER A 220 -8.874 13.601 -2.498 1.00 0.00 O ATOM 94 CB SER A 220 -6.639 14.110 -0.130 1.00 0.00 C ATOM 95 OG SER A 220 -5.335 14.518 -0.508 1.00 0.00 O ATOM 0 HA SER A 220 -7.362 15.953 -0.966 1.00 0.00 H new ATOM 0 HB2 SER A 220 -6.764 14.231 0.946 1.00 0.00 H new ATOM 0 HB3 SER A 220 -6.770 13.050 -0.349 1.00 0.00 H new ATOM 0 HG SER A 220 -4.755 14.533 0.282 1.00 0.00 H new ATOM 101 N LYS A 221 -7.038 14.703 -3.188 1.00 0.00 N ATOM 102 CA LYS A 221 -7.132 14.224 -4.562 1.00 0.00 C ATOM 103 C LYS A 221 -5.980 13.279 -4.887 1.00 0.00 C ATOM 104 O LYS A 221 -6.081 12.447 -5.790 1.00 0.00 O ATOM 105 CB LYS A 221 -7.129 15.403 -5.537 1.00 0.00 C ATOM 106 CG LYS A 221 -5.737 15.892 -5.896 1.00 0.00 C ATOM 107 CD LYS A 221 -5.729 17.381 -6.198 1.00 0.00 C ATOM 108 CE LYS A 221 -4.320 17.952 -6.153 1.00 0.00 C ATOM 109 NZ LYS A 221 -4.279 19.365 -6.623 1.00 0.00 N ATOM 0 H LYS A 221 -6.246 15.321 -3.011 1.00 0.00 H new ATOM 0 HA LYS A 221 -8.069 13.677 -4.667 1.00 0.00 H new ATOM 0 HB2 LYS A 221 -7.649 15.110 -6.449 1.00 0.00 H new ATOM 0 HB3 LYS A 221 -7.693 16.227 -5.099 1.00 0.00 H new ATOM 0 HG2 LYS A 221 -5.054 15.683 -5.073 1.00 0.00 H new ATOM 0 HG3 LYS A 221 -5.370 15.342 -6.763 1.00 0.00 H new ATOM 0 HD2 LYS A 221 -6.162 17.556 -7.183 1.00 0.00 H new ATOM 0 HD3 LYS A 221 -6.357 17.903 -5.476 1.00 0.00 H new ATOM 0 HE2 LYS A 221 -3.938 17.897 -5.134 1.00 0.00 H new ATOM 0 HE3 LYS A 221 -3.662 17.344 -6.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 221 -3.302 19.718 -6.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 221 -4.619 19.414 -7.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 221 -4.887 19.951 -6.016 1.00 0.00 H new ATOM 123 N THR A 222 -4.884 13.411 -4.146 1.00 0.00 N ATOM 124 CA THR A 222 -3.713 12.569 -4.356 1.00 0.00 C ATOM 125 C THR A 222 -3.374 11.776 -3.099 1.00 0.00 C ATOM 126 O THR A 222 -2.215 11.435 -2.862 1.00 0.00 O ATOM 127 CB THR A 222 -2.487 13.405 -4.769 1.00 0.00 C ATOM 128 OG1 THR A 222 -2.225 14.411 -3.783 1.00 0.00 O ATOM 129 CG2 THR A 222 -2.709 14.060 -6.123 1.00 0.00 C ATOM 0 H THR A 222 -4.783 14.094 -3.395 1.00 0.00 H new ATOM 0 HA THR A 222 -3.960 11.878 -5.162 1.00 0.00 H new ATOM 0 HB THR A 222 -1.628 12.738 -4.843 1.00 0.00 H new ATOM 0 HG1 THR A 222 -1.443 14.937 -4.052 1.00 0.00 H new ATOM 0 HG21 THR A 222 -1.830 14.645 -6.393 1.00 0.00 H new ATOM 0 HG22 THR A 222 -2.878 13.290 -6.876 1.00 0.00 H new ATOM 0 HG23 THR A 222 -3.579 14.715 -6.072 1.00 0.00 H new ATOM 137 N VAL A 223 -4.392 11.484 -2.296 1.00 0.00 N ATOM 138 CA VAL A 223 -4.202 10.728 -1.064 1.00 0.00 C ATOM 139 C VAL A 223 -5.392 9.816 -0.789 1.00 0.00 C ATOM 140 O VAL A 223 -6.516 10.284 -0.607 1.00 0.00 O ATOM 141 CB VAL A 223 -3.997 11.664 0.142 1.00 0.00 C ATOM 142 CG1 VAL A 223 -3.796 10.858 1.416 1.00 0.00 C ATOM 143 CG2 VAL A 223 -2.819 12.596 -0.101 1.00 0.00 C ATOM 0 H VAL A 223 -5.357 11.760 -2.477 1.00 0.00 H new ATOM 0 HA VAL A 223 -3.307 10.121 -1.200 1.00 0.00 H new ATOM 0 HB VAL A 223 -4.893 12.273 0.264 1.00 0.00 H new ATOM 0 HG11 VAL A 223 -3.653 11.536 2.257 1.00 0.00 H new ATOM 0 HG12 VAL A 223 -4.674 10.237 1.596 1.00 0.00 H new ATOM 0 HG13 VAL A 223 -2.917 10.222 1.309 1.00 0.00 H new ATOM 0 HG21 VAL A 223 -2.689 13.250 0.761 1.00 0.00 H new ATOM 0 HG22 VAL A 223 -1.914 12.007 -0.250 1.00 0.00 H new ATOM 0 HG23 VAL A 223 -3.009 13.199 -0.989 1.00 0.00 H new ATOM 153 N ILE A 224 -5.136 8.512 -0.760 1.00 0.00 N ATOM 154 CA ILE A 224 -6.187 7.534 -0.506 1.00 0.00 C ATOM 155 C ILE A 224 -5.864 6.687 0.720 1.00 0.00 C ATOM 156 O ILE A 224 -4.705 6.352 0.969 1.00 0.00 O ATOM 157 CB ILE A 224 -6.397 6.606 -1.717 1.00 0.00 C ATOM 158 CG1 ILE A 224 -6.597 7.430 -2.990 1.00 0.00 C ATOM 159 CG2 ILE A 224 -7.587 5.689 -1.481 1.00 0.00 C ATOM 160 CD1 ILE A 224 -6.380 6.640 -4.262 1.00 0.00 C ATOM 0 H ILE A 224 -4.211 8.109 -0.909 1.00 0.00 H new ATOM 0 HA ILE A 224 -7.104 8.095 -0.326 1.00 0.00 H new ATOM 0 HB ILE A 224 -5.507 5.989 -1.842 1.00 0.00 H new ATOM 0 HG12 ILE A 224 -7.608 7.838 -2.994 1.00 0.00 H new ATOM 0 HG13 ILE A 224 -5.911 8.277 -2.976 1.00 0.00 H new ATOM 0 HG21 ILE A 224 -7.723 5.039 -2.346 1.00 0.00 H new ATOM 0 HG22 ILE A 224 -7.407 5.081 -0.595 1.00 0.00 H new ATOM 0 HG23 ILE A 224 -8.485 6.289 -1.334 1.00 0.00 H new ATOM 0 HD11 ILE A 224 -6.539 7.288 -5.124 1.00 0.00 H new ATOM 0 HD12 ILE A 224 -5.361 6.254 -4.281 1.00 0.00 H new ATOM 0 HD13 ILE A 224 -7.084 5.809 -4.298 1.00 0.00 H new ATOM 172 N LEU A 225 -6.895 6.341 1.482 1.00 0.00 N ATOM 173 CA LEU A 225 -6.722 5.530 2.682 1.00 0.00 C ATOM 174 C LEU A 225 -7.215 4.105 2.452 1.00 0.00 C ATOM 175 O LEU A 225 -8.400 3.879 2.209 1.00 0.00 O ATOM 176 CB LEU A 225 -7.473 6.158 3.858 1.00 0.00 C ATOM 177 CG LEU A 225 -6.962 7.520 4.330 1.00 0.00 C ATOM 178 CD1 LEU A 225 -7.805 8.034 5.487 1.00 0.00 C ATOM 179 CD2 LEU A 225 -5.498 7.429 4.734 1.00 0.00 C ATOM 0 H LEU A 225 -7.860 6.609 1.290 1.00 0.00 H new ATOM 0 HA LEU A 225 -5.658 5.493 2.916 1.00 0.00 H new ATOM 0 HB2 LEU A 225 -8.522 6.262 3.580 1.00 0.00 H new ATOM 0 HB3 LEU A 225 -7.434 5.466 4.699 1.00 0.00 H new ATOM 0 HG LEU A 225 -7.047 8.225 3.503 1.00 0.00 H new ATOM 0 HD11 LEU A 225 -7.427 9.004 5.810 1.00 0.00 H new ATOM 0 HD12 LEU A 225 -8.841 8.137 5.165 1.00 0.00 H new ATOM 0 HD13 LEU A 225 -7.752 7.329 6.317 1.00 0.00 H new ATOM 0 HD21 LEU A 225 -5.151 8.407 5.067 1.00 0.00 H new ATOM 0 HD22 LEU A 225 -5.389 6.709 5.545 1.00 0.00 H new ATOM 0 HD23 LEU A 225 -4.904 7.105 3.879 1.00 0.00 H new ATOM 191 N ALA A 226 -6.298 3.147 2.532 1.00 0.00 N ATOM 192 CA ALA A 226 -6.640 1.743 2.337 1.00 0.00 C ATOM 193 C ALA A 226 -6.999 1.077 3.661 1.00 0.00 C ATOM 194 O ALA A 226 -6.261 1.180 4.641 1.00 0.00 O ATOM 195 CB ALA A 226 -5.488 1.008 1.669 1.00 0.00 C ATOM 0 H ALA A 226 -5.312 3.317 2.731 1.00 0.00 H new ATOM 0 HA ALA A 226 -7.514 1.693 1.687 1.00 0.00 H new ATOM 0 HB1 ALA A 226 -5.757 -0.039 1.529 1.00 0.00 H new ATOM 0 HB2 ALA A 226 -5.280 1.462 0.700 1.00 0.00 H new ATOM 0 HB3 ALA A 226 -4.601 1.074 2.298 1.00 0.00 H new ATOM 201 N LYS A 227 -8.138 0.393 3.683 1.00 0.00 N ATOM 202 CA LYS A 227 -8.596 -0.292 4.887 1.00 0.00 C ATOM 203 C LYS A 227 -8.850 -1.770 4.608 1.00 0.00 C ATOM 204 O LYS A 227 -8.943 -2.186 3.454 1.00 0.00 O ATOM 205 CB LYS A 227 -9.873 0.365 5.417 1.00 0.00 C ATOM 206 CG LYS A 227 -9.649 1.749 6.000 1.00 0.00 C ATOM 207 CD LYS A 227 -10.964 2.452 6.290 1.00 0.00 C ATOM 208 CE LYS A 227 -10.756 3.935 6.558 1.00 0.00 C ATOM 209 NZ LYS A 227 -12.049 4.658 6.706 1.00 0.00 N ATOM 0 H LYS A 227 -8.761 0.298 2.881 1.00 0.00 H new ATOM 0 HA LYS A 227 -7.813 -0.212 5.641 1.00 0.00 H new ATOM 0 HB2 LYS A 227 -10.599 0.435 4.607 1.00 0.00 H new ATOM 0 HB3 LYS A 227 -10.310 -0.276 6.183 1.00 0.00 H new ATOM 0 HG2 LYS A 227 -9.068 1.668 6.919 1.00 0.00 H new ATOM 0 HG3 LYS A 227 -9.062 2.347 5.304 1.00 0.00 H new ATOM 0 HD2 LYS A 227 -11.640 2.325 5.444 1.00 0.00 H new ATOM 0 HD3 LYS A 227 -11.443 1.989 7.153 1.00 0.00 H new ATOM 0 HE2 LYS A 227 -10.164 4.061 7.464 1.00 0.00 H new ATOM 0 HE3 LYS A 227 -10.185 4.375 5.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 227 -11.865 5.665 6.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 227 -12.604 4.560 5.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 227 -12.583 4.255 7.502 1.00 0.00 H new ATOM 223 N ASN A 228 -8.961 -2.557 5.673 1.00 0.00 N ATOM 224 CA ASN A 228 -9.205 -3.989 5.543 1.00 0.00 C ATOM 225 C ASN A 228 -7.967 -4.705 5.011 1.00 0.00 C ATOM 226 O ASN A 228 -8.045 -5.477 4.054 1.00 0.00 O ATOM 227 CB ASN A 228 -10.393 -4.243 4.613 1.00 0.00 C ATOM 228 CG ASN A 228 -11.122 -5.531 4.945 1.00 0.00 C ATOM 229 OD1 ASN A 228 -12.336 -5.535 5.149 1.00 0.00 O ATOM 230 ND2 ASN A 228 -10.382 -6.632 5.000 1.00 0.00 N ATOM 0 H ASN A 228 -8.886 -2.228 6.635 1.00 0.00 H new ATOM 0 HA ASN A 228 -9.436 -4.384 6.532 1.00 0.00 H new ATOM 0 HB2 ASN A 228 -11.089 -3.407 4.681 1.00 0.00 H new ATOM 0 HB3 ASN A 228 -10.042 -4.283 3.582 1.00 0.00 H new ATOM 0 HD21 ASN A 228 -10.817 -7.528 5.219 1.00 0.00 H new ATOM 0 HD22 ASN A 228 -9.379 -6.581 4.824 1.00 0.00 H new ATOM 237 N LEU A 229 -6.825 -4.445 5.638 1.00 0.00 N ATOM 238 CA LEU A 229 -5.569 -5.065 5.229 1.00 0.00 C ATOM 239 C LEU A 229 -5.107 -6.090 6.260 1.00 0.00 C ATOM 240 O LEU A 229 -5.152 -5.856 7.468 1.00 0.00 O ATOM 241 CB LEU A 229 -4.490 -3.998 5.035 1.00 0.00 C ATOM 242 CG LEU A 229 -4.720 -3.012 3.890 1.00 0.00 C ATOM 243 CD1 LEU A 229 -3.838 -1.785 4.057 1.00 0.00 C ATOM 244 CD2 LEU A 229 -4.456 -3.681 2.549 1.00 0.00 C ATOM 0 H LEU A 229 -6.743 -3.809 6.431 1.00 0.00 H new ATOM 0 HA LEU A 229 -5.737 -5.579 4.283 1.00 0.00 H new ATOM 0 HB2 LEU A 229 -4.396 -3.432 5.962 1.00 0.00 H new ATOM 0 HB3 LEU A 229 -3.537 -4.500 4.870 1.00 0.00 H new ATOM 0 HG LEU A 229 -5.762 -2.692 3.916 1.00 0.00 H new ATOM 0 HD11 LEU A 229 -4.016 -1.094 3.233 1.00 0.00 H new ATOM 0 HD12 LEU A 229 -4.074 -1.293 5.000 1.00 0.00 H new ATOM 0 HD13 LEU A 229 -2.791 -2.087 4.058 1.00 0.00 H new ATOM 0 HD21 LEU A 229 -4.625 -2.964 1.745 1.00 0.00 H new ATOM 0 HD22 LEU A 229 -3.424 -4.030 2.513 1.00 0.00 H new ATOM 0 HD23 LEU A 229 -5.130 -4.529 2.426 1.00 0.00 H new ATOM 256 N PRO A 230 -4.650 -7.254 5.773 1.00 0.00 N ATOM 257 CA PRO A 230 -4.169 -8.337 6.635 1.00 0.00 C ATOM 258 C PRO A 230 -2.849 -7.992 7.318 1.00 0.00 C ATOM 259 O PRO A 230 -1.933 -7.465 6.688 1.00 0.00 O ATOM 260 CB PRO A 230 -3.978 -9.505 5.664 1.00 0.00 C ATOM 261 CG PRO A 230 -3.751 -8.863 4.340 1.00 0.00 C ATOM 262 CD PRO A 230 -4.568 -7.601 4.345 1.00 0.00 C ATOM 0 HA PRO A 230 -4.863 -8.549 7.448 1.00 0.00 H new ATOM 0 HB2 PRO A 230 -3.130 -10.126 5.953 1.00 0.00 H new ATOM 0 HB3 PRO A 230 -4.855 -10.152 5.645 1.00 0.00 H new ATOM 0 HG2 PRO A 230 -2.694 -8.643 4.189 1.00 0.00 H new ATOM 0 HG3 PRO A 230 -4.058 -9.523 3.529 1.00 0.00 H new ATOM 0 HD2 PRO A 230 -4.090 -6.811 3.766 1.00 0.00 H new ATOM 0 HD3 PRO A 230 -5.556 -7.760 3.913 1.00 0.00 H new ATOM 270 N ALA A 231 -2.760 -8.293 8.609 1.00 0.00 N ATOM 271 CA ALA A 231 -1.552 -8.016 9.376 1.00 0.00 C ATOM 272 C ALA A 231 -0.303 -8.404 8.592 1.00 0.00 C ATOM 273 O ALA A 231 0.761 -7.812 8.768 1.00 0.00 O ATOM 274 CB ALA A 231 -1.591 -8.753 10.707 1.00 0.00 C ATOM 0 H ALA A 231 -3.510 -8.729 9.146 1.00 0.00 H new ATOM 0 HA ALA A 231 -1.511 -6.944 9.567 1.00 0.00 H new ATOM 0 HB1 ALA A 231 -0.683 -8.537 11.269 1.00 0.00 H new ATOM 0 HB2 ALA A 231 -2.459 -8.425 11.279 1.00 0.00 H new ATOM 0 HB3 ALA A 231 -1.660 -9.826 10.527 1.00 0.00 H new ATOM 280 N GLY A 232 -0.440 -9.403 7.725 1.00 0.00 N ATOM 281 CA GLY A 232 0.686 -9.852 6.927 1.00 0.00 C ATOM 282 C GLY A 232 1.225 -8.764 6.020 1.00 0.00 C ATOM 283 O GLY A 232 2.436 -8.643 5.834 1.00 0.00 O ATOM 0 H GLY A 232 -1.310 -9.909 7.561 1.00 0.00 H new ATOM 0 HA2 GLY A 232 1.481 -10.197 7.588 1.00 0.00 H new ATOM 0 HA3 GLY A 232 0.381 -10.706 6.323 1.00 0.00 H new ATOM 287 N THR A 233 0.324 -7.969 5.451 1.00 0.00 N ATOM 288 CA THR A 233 0.715 -6.887 4.556 1.00 0.00 C ATOM 289 C THR A 233 1.897 -6.107 5.121 1.00 0.00 C ATOM 290 O THR A 233 2.194 -6.187 6.313 1.00 0.00 O ATOM 291 CB THR A 233 -0.454 -5.916 4.305 1.00 0.00 C ATOM 292 OG1 THR A 233 -1.655 -6.651 4.047 1.00 0.00 O ATOM 293 CG2 THR A 233 -0.152 -5.000 3.129 1.00 0.00 C ATOM 0 H THR A 233 -0.682 -8.054 5.594 1.00 0.00 H new ATOM 0 HA THR A 233 1.005 -7.347 3.611 1.00 0.00 H new ATOM 0 HB THR A 233 -0.588 -5.305 5.197 1.00 0.00 H new ATOM 0 HG1 THR A 233 -2.059 -6.927 4.896 1.00 0.00 H new ATOM 0 HG21 THR A 233 -0.991 -4.323 2.970 1.00 0.00 H new ATOM 0 HG22 THR A 233 0.747 -4.420 3.341 1.00 0.00 H new ATOM 0 HG23 THR A 233 0.006 -5.599 2.232 1.00 0.00 H new ATOM 301 N LEU A 234 2.568 -5.353 4.258 1.00 0.00 N ATOM 302 CA LEU A 234 3.718 -4.556 4.671 1.00 0.00 C ATOM 303 C LEU A 234 3.832 -3.288 3.831 1.00 0.00 C ATOM 304 O LEU A 234 3.462 -3.273 2.657 1.00 0.00 O ATOM 305 CB LEU A 234 5.002 -5.378 4.550 1.00 0.00 C ATOM 306 CG LEU A 234 5.049 -6.673 5.362 1.00 0.00 C ATOM 307 CD1 LEU A 234 6.235 -7.526 4.940 1.00 0.00 C ATOM 308 CD2 LEU A 234 5.113 -6.367 6.851 1.00 0.00 C ATOM 0 H LEU A 234 2.336 -5.277 3.268 1.00 0.00 H new ATOM 0 HA LEU A 234 3.574 -4.268 5.712 1.00 0.00 H new ATOM 0 HB2 LEU A 234 5.153 -5.626 3.499 1.00 0.00 H new ATOM 0 HB3 LEU A 234 5.841 -4.752 4.854 1.00 0.00 H new ATOM 0 HG LEU A 234 4.136 -7.235 5.166 1.00 0.00 H new ATOM 0 HD11 LEU A 234 6.252 -8.443 5.529 1.00 0.00 H new ATOM 0 HD12 LEU A 234 6.146 -7.775 3.883 1.00 0.00 H new ATOM 0 HD13 LEU A 234 7.159 -6.972 5.105 1.00 0.00 H new ATOM 0 HD21 LEU A 234 5.146 -7.300 7.413 1.00 0.00 H new ATOM 0 HD22 LEU A 234 6.008 -5.783 7.064 1.00 0.00 H new ATOM 0 HD23 LEU A 234 4.231 -5.798 7.144 1.00 0.00 H new ATOM 320 N ALA A 235 4.349 -2.226 4.440 1.00 0.00 N ATOM 321 CA ALA A 235 4.516 -0.954 3.747 1.00 0.00 C ATOM 322 C ALA A 235 5.031 -1.166 2.328 1.00 0.00 C ATOM 323 O ALA A 235 4.557 -0.533 1.385 1.00 0.00 O ATOM 324 CB ALA A 235 5.461 -0.050 4.525 1.00 0.00 C ATOM 0 H ALA A 235 4.659 -2.221 5.412 1.00 0.00 H new ATOM 0 HA ALA A 235 3.541 -0.472 3.683 1.00 0.00 H new ATOM 0 HB1 ALA A 235 5.577 0.896 3.996 1.00 0.00 H new ATOM 0 HB2 ALA A 235 5.051 0.137 5.518 1.00 0.00 H new ATOM 0 HB3 ALA A 235 6.433 -0.534 4.619 1.00 0.00 H new ATOM 330 N ALA A 236 6.005 -2.059 2.184 1.00 0.00 N ATOM 331 CA ALA A 236 6.583 -2.354 0.879 1.00 0.00 C ATOM 332 C ALA A 236 5.540 -2.944 -0.063 1.00 0.00 C ATOM 333 O ALA A 236 5.412 -2.515 -1.209 1.00 0.00 O ATOM 334 CB ALA A 236 7.762 -3.305 1.027 1.00 0.00 C ATOM 0 H ALA A 236 6.410 -2.590 2.955 1.00 0.00 H new ATOM 0 HA ALA A 236 6.937 -1.418 0.446 1.00 0.00 H new ATOM 0 HB1 ALA A 236 8.184 -3.517 0.045 1.00 0.00 H new ATOM 0 HB2 ALA A 236 8.523 -2.846 1.658 1.00 0.00 H new ATOM 0 HB3 ALA A 236 7.424 -4.235 1.485 1.00 0.00 H new ATOM 340 N GLU A 237 4.796 -3.931 0.427 1.00 0.00 N ATOM 341 CA GLU A 237 3.765 -4.580 -0.373 1.00 0.00 C ATOM 342 C GLU A 237 2.816 -3.550 -0.978 1.00 0.00 C ATOM 343 O GLU A 237 2.612 -3.516 -2.192 1.00 0.00 O ATOM 344 CB GLU A 237 2.977 -5.576 0.481 1.00 0.00 C ATOM 345 CG GLU A 237 3.815 -6.735 0.993 1.00 0.00 C ATOM 346 CD GLU A 237 4.579 -7.436 -0.113 1.00 0.00 C ATOM 347 OE1 GLU A 237 5.689 -6.975 -0.453 1.00 0.00 O ATOM 348 OE2 GLU A 237 4.068 -8.447 -0.639 1.00 0.00 O ATOM 0 H GLU A 237 4.888 -4.298 1.374 1.00 0.00 H new ATOM 0 HA GLU A 237 4.256 -5.117 -1.185 1.00 0.00 H new ATOM 0 HB2 GLU A 237 2.543 -5.049 1.331 1.00 0.00 H new ATOM 0 HB3 GLU A 237 2.148 -5.970 -0.107 1.00 0.00 H new ATOM 0 HG2 GLU A 237 4.519 -6.367 1.739 1.00 0.00 H new ATOM 0 HG3 GLU A 237 3.167 -7.454 1.494 1.00 0.00 H new ATOM 355 N ILE A 238 2.239 -2.712 -0.123 1.00 0.00 N ATOM 356 CA ILE A 238 1.313 -1.680 -0.572 1.00 0.00 C ATOM 357 C ILE A 238 1.958 -0.782 -1.623 1.00 0.00 C ATOM 358 O ILE A 238 1.459 -0.662 -2.741 1.00 0.00 O ATOM 359 CB ILE A 238 0.826 -0.810 0.602 1.00 0.00 C ATOM 360 CG1 ILE A 238 0.089 -1.670 1.630 1.00 0.00 C ATOM 361 CG2 ILE A 238 -0.074 0.307 0.095 1.00 0.00 C ATOM 362 CD1 ILE A 238 -1.115 -2.390 1.065 1.00 0.00 C ATOM 0 H ILE A 238 2.397 -2.728 0.885 1.00 0.00 H new ATOM 0 HA ILE A 238 0.458 -2.193 -1.011 1.00 0.00 H new ATOM 0 HB ILE A 238 1.693 -0.360 1.087 1.00 0.00 H new ATOM 0 HG12 ILE A 238 0.782 -2.405 2.040 1.00 0.00 H new ATOM 0 HG13 ILE A 238 -0.232 -1.037 2.458 1.00 0.00 H new ATOM 0 HG21 ILE A 238 -0.410 0.913 0.936 1.00 0.00 H new ATOM 0 HG22 ILE A 238 0.481 0.932 -0.604 1.00 0.00 H new ATOM 0 HG23 ILE A 238 -0.938 -0.123 -0.411 1.00 0.00 H new ATOM 0 HD11 ILE A 238 -1.588 -2.980 1.850 1.00 0.00 H new ATOM 0 HD12 ILE A 238 -1.828 -1.661 0.680 1.00 0.00 H new ATOM 0 HD13 ILE A 238 -0.799 -3.049 0.257 1.00 0.00 H new ATOM 374 N GLN A 239 3.070 -0.155 -1.254 1.00 0.00 N ATOM 375 CA GLN A 239 3.784 0.732 -2.166 1.00 0.00 C ATOM 376 C GLN A 239 3.858 0.130 -3.565 1.00 0.00 C ATOM 377 O GLN A 239 3.482 0.770 -4.546 1.00 0.00 O ATOM 378 CB GLN A 239 5.194 1.008 -1.642 1.00 0.00 C ATOM 379 CG GLN A 239 5.864 2.204 -2.299 1.00 0.00 C ATOM 380 CD GLN A 239 7.262 2.455 -1.769 1.00 0.00 C ATOM 381 OE1 GLN A 239 8.204 1.734 -2.102 1.00 0.00 O ATOM 382 NE2 GLN A 239 7.405 3.481 -0.938 1.00 0.00 N ATOM 0 H GLN A 239 3.496 -0.244 -0.331 1.00 0.00 H new ATOM 0 HA GLN A 239 3.234 1.672 -2.223 1.00 0.00 H new ATOM 0 HB2 GLN A 239 5.147 1.175 -0.566 1.00 0.00 H new ATOM 0 HB3 GLN A 239 5.811 0.124 -1.801 1.00 0.00 H new ATOM 0 HG2 GLN A 239 5.912 2.042 -3.376 1.00 0.00 H new ATOM 0 HG3 GLN A 239 5.253 3.092 -2.137 1.00 0.00 H new ATOM 0 HE21 GLN A 239 6.597 4.052 -0.689 1.00 0.00 H new ATOM 0 HE22 GLN A 239 8.322 3.698 -0.549 1.00 0.00 H new ATOM 391 N GLU A 240 4.344 -1.105 -3.648 1.00 0.00 N ATOM 392 CA GLU A 240 4.468 -1.792 -4.928 1.00 0.00 C ATOM 393 C GLU A 240 3.097 -2.022 -5.557 1.00 0.00 C ATOM 394 O GLU A 240 2.813 -1.537 -6.653 1.00 0.00 O ATOM 395 CB GLU A 240 5.189 -3.129 -4.746 1.00 0.00 C ATOM 396 CG GLU A 240 5.659 -3.749 -6.051 1.00 0.00 C ATOM 397 CD GLU A 240 6.499 -2.796 -6.880 1.00 0.00 C ATOM 398 OE1 GLU A 240 5.916 -1.890 -7.512 1.00 0.00 O ATOM 399 OE2 GLU A 240 7.737 -2.956 -6.897 1.00 0.00 O ATOM 0 H GLU A 240 4.658 -1.649 -2.845 1.00 0.00 H new ATOM 0 HA GLU A 240 5.053 -1.160 -5.596 1.00 0.00 H new ATOM 0 HB2 GLU A 240 6.049 -2.983 -4.093 1.00 0.00 H new ATOM 0 HB3 GLU A 240 4.521 -3.827 -4.242 1.00 0.00 H new ATOM 0 HG2 GLU A 240 6.240 -4.645 -5.835 1.00 0.00 H new ATOM 0 HG3 GLU A 240 4.792 -4.064 -6.632 1.00 0.00 H new ATOM 406 N THR A 241 2.248 -2.766 -4.855 1.00 0.00 N ATOM 407 CA THR A 241 0.907 -3.063 -5.343 1.00 0.00 C ATOM 408 C THR A 241 0.327 -1.879 -6.110 1.00 0.00 C ATOM 409 O THR A 241 -0.028 -2.000 -7.282 1.00 0.00 O ATOM 410 CB THR A 241 -0.044 -3.427 -4.188 1.00 0.00 C ATOM 411 OG1 THR A 241 0.392 -4.636 -3.557 1.00 0.00 O ATOM 412 CG2 THR A 241 -1.469 -3.598 -4.693 1.00 0.00 C ATOM 0 H THR A 241 2.466 -3.174 -3.946 1.00 0.00 H new ATOM 0 HA THR A 241 0.997 -3.918 -6.013 1.00 0.00 H new ATOM 0 HB THR A 241 -0.028 -2.613 -3.463 1.00 0.00 H new ATOM 0 HG1 THR A 241 1.187 -4.453 -3.015 1.00 0.00 H new ATOM 0 HG21 THR A 241 -2.122 -3.855 -3.859 1.00 0.00 H new ATOM 0 HG22 THR A 241 -1.809 -2.667 -5.146 1.00 0.00 H new ATOM 0 HG23 THR A 241 -1.499 -4.395 -5.436 1.00 0.00 H new ATOM 420 N PHE A 242 0.234 -0.735 -5.440 1.00 0.00 N ATOM 421 CA PHE A 242 -0.304 0.471 -6.059 1.00 0.00 C ATOM 422 C PHE A 242 0.652 1.011 -7.119 1.00 0.00 C ATOM 423 O PHE A 242 0.241 1.334 -8.234 1.00 0.00 O ATOM 424 CB PHE A 242 -0.564 1.542 -4.998 1.00 0.00 C ATOM 425 CG PHE A 242 -1.747 1.243 -4.122 1.00 0.00 C ATOM 426 CD1 PHE A 242 -1.665 0.279 -3.130 1.00 0.00 C ATOM 427 CD2 PHE A 242 -2.940 1.927 -4.290 1.00 0.00 C ATOM 428 CE1 PHE A 242 -2.752 0.002 -2.322 1.00 0.00 C ATOM 429 CE2 PHE A 242 -4.030 1.655 -3.485 1.00 0.00 C ATOM 430 CZ PHE A 242 -3.936 0.690 -2.500 1.00 0.00 C ATOM 0 H PHE A 242 0.524 -0.618 -4.469 1.00 0.00 H new ATOM 0 HA PHE A 242 -1.246 0.212 -6.542 1.00 0.00 H new ATOM 0 HB2 PHE A 242 0.323 1.646 -4.374 1.00 0.00 H new ATOM 0 HB3 PHE A 242 -0.721 2.501 -5.492 1.00 0.00 H new ATOM 0 HD1 PHE A 242 -0.741 -0.262 -2.986 1.00 0.00 H new ATOM 0 HD2 PHE A 242 -3.019 2.681 -5.059 1.00 0.00 H new ATOM 0 HE1 PHE A 242 -2.675 -0.752 -1.552 1.00 0.00 H new ATOM 0 HE2 PHE A 242 -4.954 2.196 -3.625 1.00 0.00 H new ATOM 0 HZ PHE A 242 -4.787 0.474 -1.871 1.00 0.00 H new ATOM 440 N SER A 243 1.929 1.105 -6.763 1.00 0.00 N ATOM 441 CA SER A 243 2.943 1.610 -7.681 1.00 0.00 C ATOM 442 C SER A 243 2.733 1.049 -9.085 1.00 0.00 C ATOM 443 O SER A 243 2.879 1.761 -10.078 1.00 0.00 O ATOM 444 CB SER A 243 4.342 1.246 -7.179 1.00 0.00 C ATOM 445 OG SER A 243 5.333 1.607 -8.126 1.00 0.00 O ATOM 0 H SER A 243 2.286 0.838 -5.846 1.00 0.00 H new ATOM 0 HA SER A 243 2.850 2.695 -7.724 1.00 0.00 H new ATOM 0 HB2 SER A 243 4.536 1.753 -6.234 1.00 0.00 H new ATOM 0 HB3 SER A 243 4.394 0.175 -6.983 1.00 0.00 H new ATOM 0 HG SER A 243 6.218 1.366 -7.781 1.00 0.00 H new ATOM 451 N ARG A 244 2.389 -0.233 -9.157 1.00 0.00 N ATOM 452 CA ARG A 244 2.159 -0.891 -10.438 1.00 0.00 C ATOM 453 C ARG A 244 1.431 0.039 -11.404 1.00 0.00 C ATOM 454 O ARG A 244 1.881 0.260 -12.528 1.00 0.00 O ATOM 455 CB ARG A 244 1.349 -2.173 -10.239 1.00 0.00 C ATOM 456 CG ARG A 244 2.035 -3.195 -9.348 1.00 0.00 C ATOM 457 CD ARG A 244 3.171 -3.895 -10.077 1.00 0.00 C ATOM 458 NE ARG A 244 2.681 -4.806 -11.108 1.00 0.00 N ATOM 459 CZ ARG A 244 3.477 -5.524 -11.894 1.00 0.00 C ATOM 460 NH1 ARG A 244 4.793 -5.438 -11.765 1.00 0.00 N ATOM 461 NH2 ARG A 244 2.955 -6.331 -12.809 1.00 0.00 N ATOM 0 H ARG A 244 2.264 -0.836 -8.344 1.00 0.00 H new ATOM 0 HA ARG A 244 3.128 -1.145 -10.867 1.00 0.00 H new ATOM 0 HB2 ARG A 244 0.382 -1.918 -9.807 1.00 0.00 H new ATOM 0 HB3 ARG A 244 1.154 -2.624 -11.212 1.00 0.00 H new ATOM 0 HG2 ARG A 244 2.423 -2.701 -8.457 1.00 0.00 H new ATOM 0 HG3 ARG A 244 1.307 -3.933 -9.012 1.00 0.00 H new ATOM 0 HD2 ARG A 244 3.823 -3.150 -10.532 1.00 0.00 H new ATOM 0 HD3 ARG A 244 3.774 -4.451 -9.359 1.00 0.00 H new ATOM 0 HE ARG A 244 1.673 -4.896 -11.232 1.00 0.00 H new ATOM 0 HH11 ARG A 244 5.197 -4.820 -11.061 1.00 0.00 H new ATOM 0 HH12 ARG A 244 5.402 -5.990 -12.369 1.00 0.00 H new ATOM 0 HH21 ARG A 244 1.942 -6.401 -12.910 1.00 0.00 H new ATOM 0 HH22 ARG A 244 3.566 -6.882 -13.412 1.00 0.00 H new ATOM 475 N PHE A 245 0.302 0.581 -10.958 1.00 0.00 N ATOM 476 CA PHE A 245 -0.490 1.486 -11.783 1.00 0.00 C ATOM 477 C PHE A 245 0.315 2.728 -12.155 1.00 0.00 C ATOM 478 O PHE A 245 0.357 3.129 -13.317 1.00 0.00 O ATOM 479 CB PHE A 245 -1.768 1.894 -11.048 1.00 0.00 C ATOM 480 CG PHE A 245 -2.796 0.801 -10.983 1.00 0.00 C ATOM 481 CD1 PHE A 245 -2.654 -0.250 -10.090 1.00 0.00 C ATOM 482 CD2 PHE A 245 -3.905 0.824 -11.813 1.00 0.00 C ATOM 483 CE1 PHE A 245 -3.598 -1.257 -10.029 1.00 0.00 C ATOM 484 CE2 PHE A 245 -4.853 -0.180 -11.756 1.00 0.00 C ATOM 485 CZ PHE A 245 -4.700 -1.222 -10.861 1.00 0.00 C ATOM 0 H PHE A 245 -0.085 0.409 -10.030 1.00 0.00 H new ATOM 0 HA PHE A 245 -0.759 0.961 -12.699 1.00 0.00 H new ATOM 0 HB2 PHE A 245 -1.512 2.202 -10.034 1.00 0.00 H new ATOM 0 HB3 PHE A 245 -2.202 2.762 -11.545 1.00 0.00 H new ATOM 0 HD1 PHE A 245 -1.796 -0.282 -9.435 1.00 0.00 H new ATOM 0 HD2 PHE A 245 -4.030 1.637 -12.513 1.00 0.00 H new ATOM 0 HE1 PHE A 245 -3.474 -2.072 -9.331 1.00 0.00 H new ATOM 0 HE2 PHE A 245 -5.712 -0.150 -12.410 1.00 0.00 H new ATOM 0 HZ PHE A 245 -5.440 -2.007 -10.812 1.00 0.00 H new ATOM 495 N GLY A 246 0.952 3.333 -11.157 1.00 0.00 N ATOM 496 CA GLY A 246 1.746 4.524 -11.397 1.00 0.00 C ATOM 497 C GLY A 246 2.708 4.819 -10.263 1.00 0.00 C ATOM 498 O GLY A 246 2.523 4.342 -9.144 1.00 0.00 O ATOM 0 H GLY A 246 0.932 3.020 -10.187 1.00 0.00 H new ATOM 0 HA2 GLY A 246 2.308 4.402 -12.323 1.00 0.00 H new ATOM 0 HA3 GLY A 246 1.082 5.377 -11.537 1.00 0.00 H new ATOM 502 N SER A 247 3.738 5.607 -10.553 1.00 0.00 N ATOM 503 CA SER A 247 4.736 5.960 -9.550 1.00 0.00 C ATOM 504 C SER A 247 4.078 6.603 -8.332 1.00 0.00 C ATOM 505 O SER A 247 3.217 7.473 -8.464 1.00 0.00 O ATOM 506 CB SER A 247 5.774 6.913 -10.145 1.00 0.00 C ATOM 507 OG SER A 247 6.666 6.224 -11.004 1.00 0.00 O ATOM 0 H SER A 247 3.903 6.013 -11.474 1.00 0.00 H new ATOM 0 HA SER A 247 5.235 5.044 -9.232 1.00 0.00 H new ATOM 0 HB2 SER A 247 5.270 7.705 -10.699 1.00 0.00 H new ATOM 0 HB3 SER A 247 6.334 7.392 -9.342 1.00 0.00 H new ATOM 0 HG SER A 247 7.318 6.856 -11.373 1.00 0.00 H new ATOM 513 N LEU A 248 4.489 6.167 -7.147 1.00 0.00 N ATOM 514 CA LEU A 248 3.941 6.698 -5.904 1.00 0.00 C ATOM 515 C LEU A 248 4.922 7.662 -5.244 1.00 0.00 C ATOM 516 O LEU A 248 6.136 7.531 -5.399 1.00 0.00 O ATOM 517 CB LEU A 248 3.604 5.557 -4.942 1.00 0.00 C ATOM 518 CG LEU A 248 2.413 4.681 -5.332 1.00 0.00 C ATOM 519 CD1 LEU A 248 2.334 3.457 -4.433 1.00 0.00 C ATOM 520 CD2 LEU A 248 1.119 5.480 -5.263 1.00 0.00 C ATOM 0 H LEU A 248 5.200 5.447 -7.020 1.00 0.00 H new ATOM 0 HA LEU A 248 3.028 7.244 -6.143 1.00 0.00 H new ATOM 0 HB2 LEU A 248 4.482 4.919 -4.845 1.00 0.00 H new ATOM 0 HB3 LEU A 248 3.409 5.983 -3.958 1.00 0.00 H new ATOM 0 HG LEU A 248 2.555 4.344 -6.359 1.00 0.00 H new ATOM 0 HD11 LEU A 248 1.480 2.845 -4.725 1.00 0.00 H new ATOM 0 HD12 LEU A 248 3.249 2.873 -4.532 1.00 0.00 H new ATOM 0 HD13 LEU A 248 2.216 3.774 -3.397 1.00 0.00 H new ATOM 0 HD21 LEU A 248 0.282 4.841 -5.544 1.00 0.00 H new ATOM 0 HD22 LEU A 248 0.971 5.846 -4.247 1.00 0.00 H new ATOM 0 HD23 LEU A 248 1.176 6.325 -5.949 1.00 0.00 H new ATOM 532 N GLY A 249 4.388 8.629 -4.504 1.00 0.00 N ATOM 533 CA GLY A 249 5.231 9.599 -3.830 1.00 0.00 C ATOM 534 C GLY A 249 5.548 9.198 -2.402 1.00 0.00 C ATOM 535 O GLY A 249 6.707 8.963 -2.060 1.00 0.00 O ATOM 0 H GLY A 249 3.387 8.758 -4.359 1.00 0.00 H new ATOM 0 HA2 GLY A 249 6.161 9.716 -4.386 1.00 0.00 H new ATOM 0 HA3 GLY A 249 4.735 10.570 -3.830 1.00 0.00 H new ATOM 539 N ARG A 250 4.516 9.122 -1.568 1.00 0.00 N ATOM 540 CA ARG A 250 4.691 8.750 -0.169 1.00 0.00 C ATOM 541 C ARG A 250 3.847 7.527 0.178 1.00 0.00 C ATOM 542 O ARG A 250 2.827 7.264 -0.458 1.00 0.00 O ATOM 543 CB ARG A 250 4.314 9.919 0.743 1.00 0.00 C ATOM 544 CG ARG A 250 5.159 11.163 0.519 1.00 0.00 C ATOM 545 CD ARG A 250 6.526 11.032 1.171 1.00 0.00 C ATOM 546 NE ARG A 250 7.494 11.970 0.607 1.00 0.00 N ATOM 547 CZ ARG A 250 8.581 12.381 1.250 1.00 0.00 C ATOM 548 NH1 ARG A 250 8.837 11.939 2.474 1.00 0.00 N ATOM 549 NH2 ARG A 250 9.413 13.236 0.670 1.00 0.00 N ATOM 0 H ARG A 250 3.551 9.313 -1.836 1.00 0.00 H new ATOM 0 HA ARG A 250 5.741 8.501 -0.014 1.00 0.00 H new ATOM 0 HB2 ARG A 250 3.265 10.169 0.584 1.00 0.00 H new ATOM 0 HB3 ARG A 250 4.413 9.605 1.782 1.00 0.00 H new ATOM 0 HG2 ARG A 250 5.280 11.335 -0.551 1.00 0.00 H new ATOM 0 HG3 ARG A 250 4.643 12.033 0.925 1.00 0.00 H new ATOM 0 HD2 ARG A 250 6.434 11.206 2.243 1.00 0.00 H new ATOM 0 HD3 ARG A 250 6.892 10.013 1.044 1.00 0.00 H new ATOM 0 HE ARG A 250 7.326 12.329 -0.333 1.00 0.00 H new ATOM 0 HH11 ARG A 250 8.199 11.282 2.923 1.00 0.00 H new ATOM 0 HH12 ARG A 250 9.672 12.256 2.966 1.00 0.00 H new ATOM 0 HH21 ARG A 250 9.218 13.579 -0.271 1.00 0.00 H new ATOM 0 HH22 ARG A 250 10.247 13.551 1.165 1.00 0.00 H new ATOM 563 N VAL A 251 4.280 6.784 1.191 1.00 0.00 N ATOM 564 CA VAL A 251 3.564 5.589 1.624 1.00 0.00 C ATOM 565 C VAL A 251 3.809 5.307 3.102 1.00 0.00 C ATOM 566 O VAL A 251 4.899 4.889 3.493 1.00 0.00 O ATOM 567 CB VAL A 251 3.982 4.356 0.801 1.00 0.00 C ATOM 568 CG1 VAL A 251 3.301 3.104 1.333 1.00 0.00 C ATOM 569 CG2 VAL A 251 3.659 4.564 -0.671 1.00 0.00 C ATOM 0 H VAL A 251 5.123 6.988 1.728 1.00 0.00 H new ATOM 0 HA VAL A 251 2.503 5.780 1.465 1.00 0.00 H new ATOM 0 HB VAL A 251 5.060 4.224 0.898 1.00 0.00 H new ATOM 0 HG11 VAL A 251 3.608 2.243 0.740 1.00 0.00 H new ATOM 0 HG12 VAL A 251 3.587 2.948 2.373 1.00 0.00 H new ATOM 0 HG13 VAL A 251 2.219 3.223 1.268 1.00 0.00 H new ATOM 0 HG21 VAL A 251 3.961 3.683 -1.238 1.00 0.00 H new ATOM 0 HG22 VAL A 251 2.587 4.722 -0.790 1.00 0.00 H new ATOM 0 HG23 VAL A 251 4.197 5.436 -1.042 1.00 0.00 H new ATOM 579 N LEU A 252 2.787 5.538 3.919 1.00 0.00 N ATOM 580 CA LEU A 252 2.890 5.308 5.356 1.00 0.00 C ATOM 581 C LEU A 252 1.881 4.260 5.814 1.00 0.00 C ATOM 582 O LEU A 252 0.670 4.454 5.693 1.00 0.00 O ATOM 583 CB LEU A 252 2.667 6.615 6.119 1.00 0.00 C ATOM 584 CG LEU A 252 3.644 7.749 5.808 1.00 0.00 C ATOM 585 CD1 LEU A 252 3.078 9.083 6.270 1.00 0.00 C ATOM 586 CD2 LEU A 252 4.993 7.485 6.461 1.00 0.00 C ATOM 0 H LEU A 252 1.878 5.884 3.611 1.00 0.00 H new ATOM 0 HA LEU A 252 3.893 4.937 5.568 1.00 0.00 H new ATOM 0 HB2 LEU A 252 1.656 6.966 5.911 1.00 0.00 H new ATOM 0 HB3 LEU A 252 2.717 6.402 7.187 1.00 0.00 H new ATOM 0 HG LEU A 252 3.788 7.793 4.728 1.00 0.00 H new ATOM 0 HD11 LEU A 252 3.787 9.878 6.040 1.00 0.00 H new ATOM 0 HD12 LEU A 252 2.137 9.277 5.756 1.00 0.00 H new ATOM 0 HD13 LEU A 252 2.904 9.052 7.346 1.00 0.00 H new ATOM 0 HD21 LEU A 252 5.676 8.302 6.229 1.00 0.00 H new ATOM 0 HD22 LEU A 252 4.867 7.413 7.541 1.00 0.00 H new ATOM 0 HD23 LEU A 252 5.404 6.550 6.081 1.00 0.00 H new ATOM 598 N LEU A 253 2.386 3.150 6.340 1.00 0.00 N ATOM 599 CA LEU A 253 1.528 2.071 6.819 1.00 0.00 C ATOM 600 C LEU A 253 1.998 1.564 8.178 1.00 0.00 C ATOM 601 O LEU A 253 2.922 0.757 8.281 1.00 0.00 O ATOM 602 CB LEU A 253 1.512 0.921 5.810 1.00 0.00 C ATOM 603 CG LEU A 253 1.066 -0.438 6.350 1.00 0.00 C ATOM 604 CD1 LEU A 253 -0.339 -0.349 6.925 1.00 0.00 C ATOM 605 CD2 LEU A 253 1.130 -1.494 5.256 1.00 0.00 C ATOM 0 H LEU A 253 3.385 2.973 6.446 1.00 0.00 H new ATOM 0 HA LEU A 253 0.517 2.464 6.929 1.00 0.00 H new ATOM 0 HB2 LEU A 253 0.854 1.196 4.986 1.00 0.00 H new ATOM 0 HB3 LEU A 253 2.514 0.814 5.395 1.00 0.00 H new ATOM 0 HG LEU A 253 1.746 -0.730 7.150 1.00 0.00 H new ATOM 0 HD11 LEU A 253 -0.639 -1.326 7.304 1.00 0.00 H new ATOM 0 HD12 LEU A 253 -0.354 0.377 7.738 1.00 0.00 H new ATOM 0 HD13 LEU A 253 -1.032 -0.034 6.145 1.00 0.00 H new ATOM 0 HD21 LEU A 253 0.809 -2.455 5.658 1.00 0.00 H new ATOM 0 HD22 LEU A 253 0.473 -1.207 4.435 1.00 0.00 H new ATOM 0 HD23 LEU A 253 2.153 -1.577 4.890 1.00 0.00 H new ATOM 617 N PRO A 254 1.348 2.046 9.247 1.00 0.00 N ATOM 618 CA PRO A 254 1.680 1.654 10.620 1.00 0.00 C ATOM 619 C PRO A 254 1.298 0.208 10.917 1.00 0.00 C ATOM 620 O PRO A 254 0.330 -0.314 10.365 1.00 0.00 O ATOM 621 CB PRO A 254 0.848 2.613 11.475 1.00 0.00 C ATOM 622 CG PRO A 254 -0.297 3.000 10.604 1.00 0.00 C ATOM 623 CD PRO A 254 0.237 3.012 9.198 1.00 0.00 C ATOM 0 HA PRO A 254 2.751 1.711 10.812 1.00 0.00 H new ATOM 0 HB2 PRO A 254 0.504 2.131 12.390 1.00 0.00 H new ATOM 0 HB3 PRO A 254 1.431 3.484 11.773 1.00 0.00 H new ATOM 0 HG2 PRO A 254 -1.119 2.291 10.703 1.00 0.00 H new ATOM 0 HG3 PRO A 254 -0.685 3.980 10.882 1.00 0.00 H new ATOM 0 HD2 PRO A 254 -0.524 2.713 8.477 1.00 0.00 H new ATOM 0 HD3 PRO A 254 0.580 4.005 8.907 1.00 0.00 H new ATOM 631 N GLU A 255 2.065 -0.434 11.793 1.00 0.00 N ATOM 632 CA GLU A 255 1.806 -1.821 12.163 1.00 0.00 C ATOM 633 C GLU A 255 0.581 -1.923 13.067 1.00 0.00 C ATOM 634 O GLU A 255 -0.273 -2.788 12.878 1.00 0.00 O ATOM 635 CB GLU A 255 3.025 -2.420 12.868 1.00 0.00 C ATOM 636 CG GLU A 255 3.333 -1.773 14.208 1.00 0.00 C ATOM 637 CD GLU A 255 2.558 -2.400 15.350 1.00 0.00 C ATOM 638 OE1 GLU A 255 2.313 -3.623 15.301 1.00 0.00 O ATOM 639 OE2 GLU A 255 2.196 -1.666 16.294 1.00 0.00 O ATOM 0 H GLU A 255 2.870 -0.016 12.259 1.00 0.00 H new ATOM 0 HA GLU A 255 1.610 -2.383 11.250 1.00 0.00 H new ATOM 0 HB2 GLU A 255 2.859 -3.487 13.019 1.00 0.00 H new ATOM 0 HB3 GLU A 255 3.895 -2.322 12.218 1.00 0.00 H new ATOM 0 HG2 GLU A 255 4.401 -1.855 14.410 1.00 0.00 H new ATOM 0 HG3 GLU A 255 3.100 -0.710 14.156 1.00 0.00 H new ATOM 646 N GLY A 256 0.503 -1.032 14.051 1.00 0.00 N ATOM 647 CA GLY A 256 -0.620 -1.039 14.970 1.00 0.00 C ATOM 648 C GLY A 256 -1.956 -1.012 14.254 1.00 0.00 C ATOM 649 O GLY A 256 -2.914 -1.649 14.689 1.00 0.00 O ATOM 0 H GLY A 256 1.197 -0.306 14.228 1.00 0.00 H new ATOM 0 HA2 GLY A 256 -0.566 -1.928 15.598 1.00 0.00 H new ATOM 0 HA3 GLY A 256 -0.549 -0.176 15.632 1.00 0.00 H new ATOM 653 N GLY A 257 -2.020 -0.269 13.153 1.00 0.00 N ATOM 654 CA GLY A 257 -3.254 -0.173 12.394 1.00 0.00 C ATOM 655 C GLY A 257 -3.095 -0.660 10.967 1.00 0.00 C ATOM 656 O GLY A 257 -2.269 -0.142 10.216 1.00 0.00 O ATOM 0 H GLY A 257 -1.240 0.268 12.773 1.00 0.00 H new ATOM 0 HA2 GLY A 257 -4.029 -0.758 12.890 1.00 0.00 H new ATOM 0 HA3 GLY A 257 -3.592 0.863 12.386 1.00 0.00 H new ATOM 660 N ILE A 258 -3.888 -1.659 10.593 1.00 0.00 N ATOM 661 CA ILE A 258 -3.831 -2.215 9.247 1.00 0.00 C ATOM 662 C ILE A 258 -3.946 -1.118 8.194 1.00 0.00 C ATOM 663 O ILE A 258 -3.368 -1.219 7.111 1.00 0.00 O ATOM 664 CB ILE A 258 -4.948 -3.250 9.018 1.00 0.00 C ATOM 665 CG1 ILE A 258 -6.306 -2.662 9.406 1.00 0.00 C ATOM 666 CG2 ILE A 258 -4.667 -4.517 9.813 1.00 0.00 C ATOM 667 CD1 ILE A 258 -7.481 -3.433 8.847 1.00 0.00 C ATOM 0 H ILE A 258 -4.577 -2.099 11.203 1.00 0.00 H new ATOM 0 HA ILE A 258 -2.864 -2.709 9.150 1.00 0.00 H new ATOM 0 HB ILE A 258 -4.974 -3.507 7.959 1.00 0.00 H new ATOM 0 HG12 ILE A 258 -6.384 -2.635 10.493 1.00 0.00 H new ATOM 0 HG13 ILE A 258 -6.359 -1.631 9.057 1.00 0.00 H new ATOM 0 HG21 ILE A 258 -5.465 -5.239 9.641 1.00 0.00 H new ATOM 0 HG22 ILE A 258 -3.716 -4.944 9.493 1.00 0.00 H new ATOM 0 HG23 ILE A 258 -4.618 -4.277 10.875 1.00 0.00 H new ATOM 0 HD11 ILE A 258 -8.410 -2.959 9.163 1.00 0.00 H new ATOM 0 HD12 ILE A 258 -7.428 -3.438 7.758 1.00 0.00 H new ATOM 0 HD13 ILE A 258 -7.453 -4.458 9.217 1.00 0.00 H new ATOM 679 N THR A 259 -4.695 -0.069 8.518 1.00 0.00 N ATOM 680 CA THR A 259 -4.886 1.047 7.601 1.00 0.00 C ATOM 681 C THR A 259 -3.557 1.510 7.015 1.00 0.00 C ATOM 682 O THR A 259 -2.571 1.665 7.735 1.00 0.00 O ATOM 683 CB THR A 259 -5.568 2.238 8.300 1.00 0.00 C ATOM 684 OG1 THR A 259 -4.854 2.582 9.492 1.00 0.00 O ATOM 685 CG2 THR A 259 -7.012 1.907 8.646 1.00 0.00 C ATOM 0 H THR A 259 -5.180 0.031 9.410 1.00 0.00 H new ATOM 0 HA THR A 259 -5.530 0.689 6.798 1.00 0.00 H new ATOM 0 HB THR A 259 -5.559 3.086 7.615 1.00 0.00 H new ATOM 0 HG1 THR A 259 -5.293 3.341 9.929 1.00 0.00 H new ATOM 0 HG21 THR A 259 -7.473 2.763 9.139 1.00 0.00 H new ATOM 0 HG22 THR A 259 -7.561 1.675 7.733 1.00 0.00 H new ATOM 0 HG23 THR A 259 -7.038 1.046 9.314 1.00 0.00 H new ATOM 693 N ALA A 260 -3.538 1.730 5.705 1.00 0.00 N ATOM 694 CA ALA A 260 -2.331 2.178 5.022 1.00 0.00 C ATOM 695 C ALA A 260 -2.583 3.470 4.252 1.00 0.00 C ATOM 696 O ALA A 260 -3.498 3.545 3.431 1.00 0.00 O ATOM 697 CB ALA A 260 -1.820 1.094 4.085 1.00 0.00 C ATOM 0 H ALA A 260 -4.346 1.605 5.095 1.00 0.00 H new ATOM 0 HA ALA A 260 -1.570 2.378 5.777 1.00 0.00 H new ATOM 0 HB1 ALA A 260 -0.918 1.443 3.582 1.00 0.00 H new ATOM 0 HB2 ALA A 260 -1.591 0.196 4.658 1.00 0.00 H new ATOM 0 HB3 ALA A 260 -2.584 0.865 3.342 1.00 0.00 H new ATOM 703 N ILE A 261 -1.767 4.483 4.522 1.00 0.00 N ATOM 704 CA ILE A 261 -1.902 5.771 3.853 1.00 0.00 C ATOM 705 C ILE A 261 -0.983 5.859 2.639 1.00 0.00 C ATOM 706 O ILE A 261 0.233 5.706 2.755 1.00 0.00 O ATOM 707 CB ILE A 261 -1.585 6.937 4.808 1.00 0.00 C ATOM 708 CG1 ILE A 261 -2.483 6.870 6.045 1.00 0.00 C ATOM 709 CG2 ILE A 261 -1.758 8.269 4.093 1.00 0.00 C ATOM 710 CD1 ILE A 261 -1.838 7.435 7.291 1.00 0.00 C ATOM 0 H ILE A 261 -1.006 4.437 5.199 1.00 0.00 H new ATOM 0 HA ILE A 261 -2.939 5.850 3.527 1.00 0.00 H new ATOM 0 HB ILE A 261 -0.547 6.852 5.130 1.00 0.00 H new ATOM 0 HG12 ILE A 261 -3.406 7.415 5.844 1.00 0.00 H new ATOM 0 HG13 ILE A 261 -2.759 5.832 6.228 1.00 0.00 H new ATOM 0 HG21 ILE A 261 -1.530 9.083 4.781 1.00 0.00 H new ATOM 0 HG22 ILE A 261 -1.081 8.315 3.240 1.00 0.00 H new ATOM 0 HG23 ILE A 261 -2.787 8.364 3.745 1.00 0.00 H new ATOM 0 HD11 ILE A 261 -2.531 7.355 8.128 1.00 0.00 H new ATOM 0 HD12 ILE A 261 -0.930 6.875 7.517 1.00 0.00 H new ATOM 0 HD13 ILE A 261 -1.587 8.483 7.127 1.00 0.00 H new ATOM 722 N VAL A 262 -1.573 6.109 1.474 1.00 0.00 N ATOM 723 CA VAL A 262 -0.808 6.221 0.238 1.00 0.00 C ATOM 724 C VAL A 262 -1.056 7.563 -0.442 1.00 0.00 C ATOM 725 O VAL A 262 -2.191 8.035 -0.509 1.00 0.00 O ATOM 726 CB VAL A 262 -1.158 5.087 -0.743 1.00 0.00 C ATOM 727 CG1 VAL A 262 -0.372 5.238 -2.037 1.00 0.00 C ATOM 728 CG2 VAL A 262 -0.896 3.731 -0.106 1.00 0.00 C ATOM 0 H VAL A 262 -2.578 6.238 1.361 1.00 0.00 H new ATOM 0 HA VAL A 262 0.245 6.144 0.509 1.00 0.00 H new ATOM 0 HB VAL A 262 -2.220 5.152 -0.981 1.00 0.00 H new ATOM 0 HG11 VAL A 262 -0.633 4.428 -2.718 1.00 0.00 H new ATOM 0 HG12 VAL A 262 -0.615 6.194 -2.501 1.00 0.00 H new ATOM 0 HG13 VAL A 262 0.696 5.201 -1.821 1.00 0.00 H new ATOM 0 HG21 VAL A 262 -1.149 2.942 -0.814 1.00 0.00 H new ATOM 0 HG22 VAL A 262 0.157 3.653 0.163 1.00 0.00 H new ATOM 0 HG23 VAL A 262 -1.508 3.625 0.790 1.00 0.00 H new ATOM 738 N GLU A 263 0.013 8.171 -0.947 1.00 0.00 N ATOM 739 CA GLU A 263 -0.090 9.459 -1.622 1.00 0.00 C ATOM 740 C GLU A 263 0.450 9.371 -3.047 1.00 0.00 C ATOM 741 O GLU A 263 1.659 9.430 -3.269 1.00 0.00 O ATOM 742 CB GLU A 263 0.672 10.532 -0.842 1.00 0.00 C ATOM 743 CG GLU A 263 0.723 11.877 -1.547 1.00 0.00 C ATOM 744 CD GLU A 263 1.626 12.871 -0.843 1.00 0.00 C ATOM 745 OE1 GLU A 263 1.141 13.570 0.071 1.00 0.00 O ATOM 746 OE2 GLU A 263 2.819 12.948 -1.206 1.00 0.00 O ATOM 0 H GLU A 263 0.959 7.793 -0.901 1.00 0.00 H new ATOM 0 HA GLU A 263 -1.144 9.733 -1.667 1.00 0.00 H new ATOM 0 HB2 GLU A 263 0.204 10.661 0.134 1.00 0.00 H new ATOM 0 HB3 GLU A 263 1.690 10.186 -0.664 1.00 0.00 H new ATOM 0 HG2 GLU A 263 1.073 11.734 -2.569 1.00 0.00 H new ATOM 0 HG3 GLU A 263 -0.284 12.288 -1.610 1.00 0.00 H new ATOM 753 N PHE A 264 -0.456 9.229 -4.009 1.00 0.00 N ATOM 754 CA PHE A 264 -0.071 9.131 -5.412 1.00 0.00 C ATOM 755 C PHE A 264 0.522 10.447 -5.907 1.00 0.00 C ATOM 756 O PHE A 264 0.065 11.528 -5.530 1.00 0.00 O ATOM 757 CB PHE A 264 -1.280 8.750 -6.269 1.00 0.00 C ATOM 758 CG PHE A 264 -1.483 7.267 -6.394 1.00 0.00 C ATOM 759 CD1 PHE A 264 -2.058 6.543 -5.361 1.00 0.00 C ATOM 760 CD2 PHE A 264 -1.098 6.596 -7.544 1.00 0.00 C ATOM 761 CE1 PHE A 264 -2.244 5.178 -5.473 1.00 0.00 C ATOM 762 CE2 PHE A 264 -1.283 5.231 -7.662 1.00 0.00 C ATOM 763 CZ PHE A 264 -1.857 4.522 -6.625 1.00 0.00 C ATOM 0 H PHE A 264 -1.461 9.179 -3.843 1.00 0.00 H new ATOM 0 HA PHE A 264 0.689 8.354 -5.501 1.00 0.00 H new ATOM 0 HB2 PHE A 264 -2.176 9.196 -5.838 1.00 0.00 H new ATOM 0 HB3 PHE A 264 -1.159 9.177 -7.264 1.00 0.00 H new ATOM 0 HD1 PHE A 264 -2.364 7.051 -4.459 1.00 0.00 H new ATOM 0 HD2 PHE A 264 -0.648 7.146 -8.357 1.00 0.00 H new ATOM 0 HE1 PHE A 264 -2.692 4.625 -4.660 1.00 0.00 H new ATOM 0 HE2 PHE A 264 -0.979 4.720 -8.564 1.00 0.00 H new ATOM 0 HZ PHE A 264 -2.003 3.456 -6.715 1.00 0.00 H new ATOM 773 N LEU A 265 1.542 10.349 -6.752 1.00 0.00 N ATOM 774 CA LEU A 265 2.199 11.531 -7.299 1.00 0.00 C ATOM 775 C LEU A 265 1.309 12.223 -8.326 1.00 0.00 C ATOM 776 O LEU A 265 1.409 13.431 -8.534 1.00 0.00 O ATOM 777 CB LEU A 265 3.533 11.146 -7.941 1.00 0.00 C ATOM 778 CG LEU A 265 4.661 10.780 -6.975 1.00 0.00 C ATOM 779 CD1 LEU A 265 5.827 10.159 -7.728 1.00 0.00 C ATOM 780 CD2 LEU A 265 5.118 12.007 -6.200 1.00 0.00 C ATOM 0 H LEU A 265 1.932 9.463 -7.073 1.00 0.00 H new ATOM 0 HA LEU A 265 2.384 12.225 -6.479 1.00 0.00 H new ATOM 0 HB2 LEU A 265 3.362 10.300 -8.606 1.00 0.00 H new ATOM 0 HB3 LEU A 265 3.868 11.977 -8.562 1.00 0.00 H new ATOM 0 HG LEU A 265 4.281 10.046 -6.264 1.00 0.00 H new ATOM 0 HD11 LEU A 265 6.620 9.905 -7.025 1.00 0.00 H new ATOM 0 HD12 LEU A 265 5.491 9.256 -8.238 1.00 0.00 H new ATOM 0 HD13 LEU A 265 6.207 10.870 -8.462 1.00 0.00 H new ATOM 0 HD21 LEU A 265 5.921 11.728 -5.518 1.00 0.00 H new ATOM 0 HD22 LEU A 265 5.480 12.763 -6.896 1.00 0.00 H new ATOM 0 HD23 LEU A 265 4.281 12.410 -5.630 1.00 0.00 H new ATOM 792 N GLU A 266 0.436 11.448 -8.963 1.00 0.00 N ATOM 793 CA GLU A 266 -0.473 11.988 -9.968 1.00 0.00 C ATOM 794 C GLU A 266 -1.926 11.796 -9.545 1.00 0.00 C ATOM 795 O GLU A 266 -2.335 10.720 -9.108 1.00 0.00 O ATOM 796 CB GLU A 266 -0.230 11.316 -11.321 1.00 0.00 C ATOM 797 CG GLU A 266 -0.952 11.992 -12.474 1.00 0.00 C ATOM 798 CD GLU A 266 -0.169 13.156 -13.051 1.00 0.00 C ATOM 799 OE1 GLU A 266 0.952 12.926 -13.550 1.00 0.00 O ATOM 800 OE2 GLU A 266 -0.677 14.295 -13.002 1.00 0.00 O ATOM 0 H GLU A 266 0.339 10.446 -8.801 1.00 0.00 H new ATOM 0 HA GLU A 266 -0.278 13.056 -10.062 1.00 0.00 H new ATOM 0 HB2 GLU A 266 0.840 11.310 -11.527 1.00 0.00 H new ATOM 0 HB3 GLU A 266 -0.550 10.276 -11.263 1.00 0.00 H new ATOM 0 HG2 GLU A 266 -1.139 11.260 -13.260 1.00 0.00 H new ATOM 0 HG3 GLU A 266 -1.924 12.347 -12.131 1.00 0.00 H new ATOM 807 N PRO A 267 -2.727 12.864 -9.678 1.00 0.00 N ATOM 808 CA PRO A 267 -4.147 12.839 -9.315 1.00 0.00 C ATOM 809 C PRO A 267 -4.973 11.980 -10.267 1.00 0.00 C ATOM 810 O PRO A 267 -5.803 11.179 -9.834 1.00 0.00 O ATOM 811 CB PRO A 267 -4.566 14.307 -9.421 1.00 0.00 C ATOM 812 CG PRO A 267 -3.607 14.906 -10.392 1.00 0.00 C ATOM 813 CD PRO A 267 -2.307 14.178 -10.192 1.00 0.00 C ATOM 0 HA PRO A 267 -4.308 12.406 -8.328 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -5.594 14.401 -9.771 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -4.512 14.805 -8.453 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -3.965 14.792 -11.415 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -3.487 15.975 -10.214 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -1.751 14.085 -11.125 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -1.660 14.698 -9.485 1.00 0.00 H new ATOM 821 N LEU A 268 -4.740 12.150 -11.563 1.00 0.00 N ATOM 822 CA LEU A 268 -5.463 11.390 -12.577 1.00 0.00 C ATOM 823 C LEU A 268 -5.240 9.892 -12.395 1.00 0.00 C ATOM 824 O LEU A 268 -6.178 9.100 -12.486 1.00 0.00 O ATOM 825 CB LEU A 268 -5.018 11.817 -13.977 1.00 0.00 C ATOM 826 CG LEU A 268 -5.500 13.190 -14.444 1.00 0.00 C ATOM 827 CD1 LEU A 268 -7.013 13.200 -14.602 1.00 0.00 C ATOM 828 CD2 LEU A 268 -5.057 14.271 -13.469 1.00 0.00 C ATOM 0 H LEU A 268 -4.056 12.808 -11.937 1.00 0.00 H new ATOM 0 HA LEU A 268 -6.527 11.598 -12.462 1.00 0.00 H new ATOM 0 HB2 LEU A 268 -3.929 11.806 -14.009 1.00 0.00 H new ATOM 0 HB3 LEU A 268 -5.365 11.070 -14.691 1.00 0.00 H new ATOM 0 HG LEU A 268 -5.052 13.399 -15.416 1.00 0.00 H new ATOM 0 HD11 LEU A 268 -7.338 14.186 -14.935 1.00 0.00 H new ATOM 0 HD12 LEU A 268 -7.307 12.453 -15.339 1.00 0.00 H new ATOM 0 HD13 LEU A 268 -7.480 12.968 -13.645 1.00 0.00 H new ATOM 0 HD21 LEU A 268 -5.409 15.242 -13.818 1.00 0.00 H new ATOM 0 HD22 LEU A 268 -5.475 14.066 -12.484 1.00 0.00 H new ATOM 0 HD23 LEU A 268 -3.969 14.281 -13.406 1.00 0.00 H new ATOM 840 N GLU A 269 -3.993 9.511 -12.136 1.00 0.00 N ATOM 841 CA GLU A 269 -3.648 8.108 -11.940 1.00 0.00 C ATOM 842 C GLU A 269 -4.306 7.557 -10.678 1.00 0.00 C ATOM 843 O GLU A 269 -4.873 6.465 -10.687 1.00 0.00 O ATOM 844 CB GLU A 269 -2.130 7.940 -11.851 1.00 0.00 C ATOM 845 CG GLU A 269 -1.421 8.102 -13.185 1.00 0.00 C ATOM 846 CD GLU A 269 0.086 7.986 -13.063 1.00 0.00 C ATOM 847 OE1 GLU A 269 0.559 7.446 -12.041 1.00 0.00 O ATOM 848 OE2 GLU A 269 0.792 8.436 -13.989 1.00 0.00 O ATOM 0 H GLU A 269 -3.205 10.154 -12.057 1.00 0.00 H new ATOM 0 HA GLU A 269 -4.019 7.547 -12.798 1.00 0.00 H new ATOM 0 HB2 GLU A 269 -1.733 8.671 -11.147 1.00 0.00 H new ATOM 0 HB3 GLU A 269 -1.905 6.953 -11.447 1.00 0.00 H new ATOM 0 HG2 GLU A 269 -1.785 7.345 -13.880 1.00 0.00 H new ATOM 0 HG3 GLU A 269 -1.674 9.073 -13.611 1.00 0.00 H new ATOM 855 N ALA A 270 -4.226 8.322 -9.594 1.00 0.00 N ATOM 856 CA ALA A 270 -4.814 7.912 -8.325 1.00 0.00 C ATOM 857 C ALA A 270 -6.269 7.493 -8.504 1.00 0.00 C ATOM 858 O ALA A 270 -6.683 6.434 -8.033 1.00 0.00 O ATOM 859 CB ALA A 270 -4.708 9.038 -7.306 1.00 0.00 C ATOM 0 H ALA A 270 -3.760 9.229 -9.570 1.00 0.00 H new ATOM 0 HA ALA A 270 -4.258 7.050 -7.957 1.00 0.00 H new ATOM 0 HB1 ALA A 270 -5.151 8.718 -6.363 1.00 0.00 H new ATOM 0 HB2 ALA A 270 -3.659 9.288 -7.148 1.00 0.00 H new ATOM 0 HB3 ALA A 270 -5.238 9.915 -7.677 1.00 0.00 H new ATOM 865 N ARG A 271 -7.042 8.332 -9.187 1.00 0.00 N ATOM 866 CA ARG A 271 -8.452 8.049 -9.426 1.00 0.00 C ATOM 867 C ARG A 271 -8.618 6.782 -10.261 1.00 0.00 C ATOM 868 O ARG A 271 -9.448 5.927 -9.952 1.00 0.00 O ATOM 869 CB ARG A 271 -9.118 9.230 -10.134 1.00 0.00 C ATOM 870 CG ARG A 271 -9.502 10.364 -9.198 1.00 0.00 C ATOM 871 CD ARG A 271 -10.102 11.536 -9.959 1.00 0.00 C ATOM 872 NE ARG A 271 -10.769 12.483 -9.069 1.00 0.00 N ATOM 873 CZ ARG A 271 -10.134 13.451 -8.418 1.00 0.00 C ATOM 874 NH1 ARG A 271 -8.824 13.601 -8.557 1.00 0.00 N ATOM 875 NH2 ARG A 271 -10.810 14.274 -7.626 1.00 0.00 N ATOM 0 H ARG A 271 -6.715 9.213 -9.584 1.00 0.00 H new ATOM 0 HA ARG A 271 -8.935 7.894 -8.461 1.00 0.00 H new ATOM 0 HB2 ARG A 271 -8.441 9.614 -10.897 1.00 0.00 H new ATOM 0 HB3 ARG A 271 -10.012 8.877 -10.649 1.00 0.00 H new ATOM 0 HG2 ARG A 271 -10.219 10.002 -8.461 1.00 0.00 H new ATOM 0 HG3 ARG A 271 -8.622 10.698 -8.649 1.00 0.00 H new ATOM 0 HD2 ARG A 271 -9.316 12.050 -10.512 1.00 0.00 H new ATOM 0 HD3 ARG A 271 -10.816 11.164 -10.693 1.00 0.00 H new ATOM 0 HE ARG A 271 -11.777 12.396 -8.941 1.00 0.00 H new ATOM 0 HH11 ARG A 271 -8.300 12.972 -9.166 1.00 0.00 H new ATOM 0 HH12 ARG A 271 -8.340 14.346 -8.055 1.00 0.00 H new ATOM 0 HH21 ARG A 271 -11.818 14.163 -7.517 1.00 0.00 H new ATOM 0 HH22 ARG A 271 -10.321 15.017 -7.126 1.00 0.00 H new ATOM 889 N LYS A 272 -7.823 6.669 -11.320 1.00 0.00 N ATOM 890 CA LYS A 272 -7.881 5.508 -12.199 1.00 0.00 C ATOM 891 C LYS A 272 -7.736 4.215 -11.403 1.00 0.00 C ATOM 892 O LYS A 272 -8.603 3.343 -11.455 1.00 0.00 O ATOM 893 CB LYS A 272 -6.782 5.591 -13.261 1.00 0.00 C ATOM 894 CG LYS A 272 -6.899 4.531 -14.342 1.00 0.00 C ATOM 895 CD LYS A 272 -5.935 4.794 -15.487 1.00 0.00 C ATOM 896 CE LYS A 272 -4.592 4.121 -15.250 1.00 0.00 C ATOM 897 NZ LYS A 272 -3.611 4.447 -16.323 1.00 0.00 N ATOM 0 H LYS A 272 -7.131 7.368 -11.590 1.00 0.00 H new ATOM 0 HA LYS A 272 -8.854 5.504 -12.691 1.00 0.00 H new ATOM 0 HB2 LYS A 272 -6.811 6.577 -13.726 1.00 0.00 H new ATOM 0 HB3 LYS A 272 -5.811 5.497 -12.775 1.00 0.00 H new ATOM 0 HG2 LYS A 272 -6.697 3.549 -13.914 1.00 0.00 H new ATOM 0 HG3 LYS A 272 -7.920 4.509 -14.723 1.00 0.00 H new ATOM 0 HD2 LYS A 272 -6.367 4.429 -16.419 1.00 0.00 H new ATOM 0 HD3 LYS A 272 -5.790 5.868 -15.602 1.00 0.00 H new ATOM 0 HE2 LYS A 272 -4.193 4.436 -14.286 1.00 0.00 H new ATOM 0 HE3 LYS A 272 -4.731 3.041 -15.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 272 -2.709 3.969 -16.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 272 -3.980 4.124 -17.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 272 -3.459 5.475 -16.354 1.00 0.00 H new ATOM 911 N ALA A 273 -6.636 4.099 -10.666 1.00 0.00 N ATOM 912 CA ALA A 273 -6.380 2.914 -9.857 1.00 0.00 C ATOM 913 C ALA A 273 -7.531 2.649 -8.892 1.00 0.00 C ATOM 914 O ALA A 273 -8.083 1.549 -8.855 1.00 0.00 O ATOM 915 CB ALA A 273 -5.074 3.069 -9.092 1.00 0.00 C ATOM 0 H ALA A 273 -5.908 4.811 -10.613 1.00 0.00 H new ATOM 0 HA ALA A 273 -6.297 2.058 -10.527 1.00 0.00 H new ATOM 0 HB1 ALA A 273 -4.896 2.177 -8.492 1.00 0.00 H new ATOM 0 HB2 ALA A 273 -4.253 3.203 -9.797 1.00 0.00 H new ATOM 0 HB3 ALA A 273 -5.136 3.939 -8.438 1.00 0.00 H new ATOM 921 N PHE A 274 -7.890 3.663 -8.113 1.00 0.00 N ATOM 922 CA PHE A 274 -8.975 3.539 -7.146 1.00 0.00 C ATOM 923 C PHE A 274 -10.158 2.790 -7.751 1.00 0.00 C ATOM 924 O PHE A 274 -10.726 1.895 -7.125 1.00 0.00 O ATOM 925 CB PHE A 274 -9.422 4.922 -6.669 1.00 0.00 C ATOM 926 CG PHE A 274 -10.363 4.878 -5.499 1.00 0.00 C ATOM 927 CD1 PHE A 274 -11.605 4.274 -5.615 1.00 0.00 C ATOM 928 CD2 PHE A 274 -10.006 5.440 -4.285 1.00 0.00 C ATOM 929 CE1 PHE A 274 -12.473 4.230 -4.540 1.00 0.00 C ATOM 930 CE2 PHE A 274 -10.870 5.399 -3.206 1.00 0.00 C ATOM 931 CZ PHE A 274 -12.105 4.795 -3.335 1.00 0.00 C ATOM 0 H PHE A 274 -7.445 4.581 -8.132 1.00 0.00 H new ATOM 0 HA PHE A 274 -8.605 2.971 -6.293 1.00 0.00 H new ATOM 0 HB2 PHE A 274 -8.542 5.505 -6.396 1.00 0.00 H new ATOM 0 HB3 PHE A 274 -9.906 5.443 -7.495 1.00 0.00 H new ATOM 0 HD1 PHE A 274 -11.898 3.833 -6.556 1.00 0.00 H new ATOM 0 HD2 PHE A 274 -9.042 5.916 -4.180 1.00 0.00 H new ATOM 0 HE1 PHE A 274 -13.437 3.755 -4.642 1.00 0.00 H new ATOM 0 HE2 PHE A 274 -10.579 5.839 -2.264 1.00 0.00 H new ATOM 0 HZ PHE A 274 -12.782 4.765 -2.494 1.00 0.00 H new ATOM 941 N ARG A 275 -10.525 3.163 -8.973 1.00 0.00 N ATOM 942 CA ARG A 275 -11.642 2.528 -9.662 1.00 0.00 C ATOM 943 C ARG A 275 -11.362 1.048 -9.904 1.00 0.00 C ATOM 944 O ARG A 275 -12.140 0.184 -9.498 1.00 0.00 O ATOM 945 CB ARG A 275 -11.913 3.231 -10.994 1.00 0.00 C ATOM 946 CG ARG A 275 -12.568 4.594 -10.842 1.00 0.00 C ATOM 947 CD ARG A 275 -14.048 4.467 -10.518 1.00 0.00 C ATOM 948 NE ARG A 275 -14.855 4.257 -11.717 1.00 0.00 N ATOM 949 CZ ARG A 275 -16.169 4.444 -11.761 1.00 0.00 C ATOM 950 NH1 ARG A 275 -16.822 4.843 -10.678 1.00 0.00 N ATOM 951 NH2 ARG A 275 -16.834 4.231 -12.890 1.00 0.00 N ATOM 0 H ARG A 275 -10.065 3.901 -9.506 1.00 0.00 H new ATOM 0 HA ARG A 275 -12.524 2.614 -9.027 1.00 0.00 H new ATOM 0 HB2 ARG A 275 -10.972 3.348 -11.531 1.00 0.00 H new ATOM 0 HB3 ARG A 275 -12.553 2.596 -11.606 1.00 0.00 H new ATOM 0 HG2 ARG A 275 -12.068 5.153 -10.051 1.00 0.00 H new ATOM 0 HG3 ARG A 275 -12.443 5.164 -11.763 1.00 0.00 H new ATOM 0 HD2 ARG A 275 -14.198 3.635 -9.830 1.00 0.00 H new ATOM 0 HD3 ARG A 275 -14.386 5.369 -10.007 1.00 0.00 H new ATOM 0 HE ARG A 275 -14.383 3.950 -12.568 1.00 0.00 H new ATOM 0 HH11 ARG A 275 -16.315 5.007 -9.808 1.00 0.00 H new ATOM 0 HH12 ARG A 275 -17.831 4.986 -10.715 1.00 0.00 H new ATOM 0 HH21 ARG A 275 -16.336 3.923 -13.725 1.00 0.00 H new ATOM 0 HH22 ARG A 275 -17.843 4.375 -12.922 1.00 0.00 H new ATOM 965 N HIS A 276 -10.245 0.763 -10.567 1.00 0.00 N ATOM 966 CA HIS A 276 -9.862 -0.613 -10.862 1.00 0.00 C ATOM 967 C HIS A 276 -9.749 -1.433 -9.580 1.00 0.00 C ATOM 968 O HIS A 276 -10.485 -2.400 -9.383 1.00 0.00 O ATOM 969 CB HIS A 276 -8.534 -0.643 -11.619 1.00 0.00 C ATOM 970 CG HIS A 276 -8.522 0.221 -12.842 1.00 0.00 C ATOM 971 ND1 HIS A 276 -9.480 0.140 -13.830 1.00 0.00 N ATOM 972 CD2 HIS A 276 -7.661 1.190 -13.233 1.00 0.00 C ATOM 973 CE1 HIS A 276 -9.208 1.021 -14.777 1.00 0.00 C ATOM 974 NE2 HIS A 276 -8.109 1.671 -14.439 1.00 0.00 N ATOM 0 H HIS A 276 -9.590 1.466 -10.910 1.00 0.00 H new ATOM 0 HA HIS A 276 -10.638 -1.054 -11.487 1.00 0.00 H new ATOM 0 HB2 HIS A 276 -7.736 -0.322 -10.949 1.00 0.00 H new ATOM 0 HB3 HIS A 276 -8.313 -1.671 -11.908 1.00 0.00 H new ATOM 0 HD1 HIS A 276 -10.274 -0.500 -13.830 1.00 0.00 H new ATOM 0 HD2 HIS A 276 -6.785 1.523 -12.696 1.00 0.00 H new ATOM 0 HE1 HIS A 276 -9.786 1.182 -15.675 1.00 0.00 H new ATOM 983 N LEU A 277 -8.823 -1.040 -8.712 1.00 0.00 N ATOM 984 CA LEU A 277 -8.614 -1.739 -7.449 1.00 0.00 C ATOM 985 C LEU A 277 -9.934 -1.943 -6.714 1.00 0.00 C ATOM 986 O LEU A 277 -10.233 -3.042 -6.248 1.00 0.00 O ATOM 987 CB LEU A 277 -7.641 -0.956 -6.566 1.00 0.00 C ATOM 988 CG LEU A 277 -6.307 -0.575 -7.210 1.00 0.00 C ATOM 989 CD1 LEU A 277 -5.414 0.139 -6.207 1.00 0.00 C ATOM 990 CD2 LEU A 277 -5.610 -1.810 -7.763 1.00 0.00 C ATOM 0 H LEU A 277 -8.206 -0.242 -8.860 1.00 0.00 H new ATOM 0 HA LEU A 277 -8.188 -2.718 -7.670 1.00 0.00 H new ATOM 0 HB2 LEU A 277 -8.136 -0.043 -6.236 1.00 0.00 H new ATOM 0 HB3 LEU A 277 -7.435 -1.547 -5.674 1.00 0.00 H new ATOM 0 HG LEU A 277 -6.506 0.106 -8.037 1.00 0.00 H new ATOM 0 HD11 LEU A 277 -4.470 0.402 -6.683 1.00 0.00 H new ATOM 0 HD12 LEU A 277 -5.910 1.045 -5.859 1.00 0.00 H new ATOM 0 HD13 LEU A 277 -5.222 -0.518 -5.359 1.00 0.00 H new ATOM 0 HD21 LEU A 277 -4.663 -1.520 -8.217 1.00 0.00 H new ATOM 0 HD22 LEU A 277 -5.423 -2.516 -6.953 1.00 0.00 H new ATOM 0 HD23 LEU A 277 -6.244 -2.280 -8.515 1.00 0.00 H new ATOM 1002 N ALA A 278 -10.722 -0.877 -6.616 1.00 0.00 N ATOM 1003 CA ALA A 278 -12.012 -0.940 -5.941 1.00 0.00 C ATOM 1004 C ALA A 278 -12.717 -2.262 -6.226 1.00 0.00 C ATOM 1005 O ALA A 278 -12.718 -2.744 -7.359 1.00 0.00 O ATOM 1006 CB ALA A 278 -12.888 0.230 -6.366 1.00 0.00 C ATOM 0 H ALA A 278 -10.489 0.041 -6.996 1.00 0.00 H new ATOM 0 HA ALA A 278 -11.836 -0.877 -4.867 1.00 0.00 H new ATOM 0 HB1 ALA A 278 -13.848 0.170 -5.854 1.00 0.00 H new ATOM 0 HB2 ALA A 278 -12.396 1.167 -6.105 1.00 0.00 H new ATOM 0 HB3 ALA A 278 -13.048 0.192 -7.443 1.00 0.00 H new ATOM 1012 N TYR A 279 -13.314 -2.843 -5.192 1.00 0.00 N ATOM 1013 CA TYR A 279 -14.020 -4.112 -5.331 1.00 0.00 C ATOM 1014 C TYR A 279 -13.055 -5.234 -5.700 1.00 0.00 C ATOM 1015 O TYR A 279 -13.338 -6.048 -6.579 1.00 0.00 O ATOM 1016 CB TYR A 279 -15.115 -3.996 -6.392 1.00 0.00 C ATOM 1017 CG TYR A 279 -16.134 -2.919 -6.095 1.00 0.00 C ATOM 1018 CD1 TYR A 279 -16.990 -3.025 -5.006 1.00 0.00 C ATOM 1019 CD2 TYR A 279 -16.240 -1.794 -6.905 1.00 0.00 C ATOM 1020 CE1 TYR A 279 -17.923 -2.044 -4.733 1.00 0.00 C ATOM 1021 CE2 TYR A 279 -17.169 -0.807 -6.638 1.00 0.00 C ATOM 1022 CZ TYR A 279 -18.008 -0.937 -5.551 1.00 0.00 C ATOM 1023 OH TYR A 279 -18.935 0.044 -5.281 1.00 0.00 O ATOM 0 H TYR A 279 -13.324 -2.456 -4.248 1.00 0.00 H new ATOM 0 HA TYR A 279 -14.477 -4.352 -4.371 1.00 0.00 H new ATOM 0 HB2 TYR A 279 -14.653 -3.791 -7.358 1.00 0.00 H new ATOM 0 HB3 TYR A 279 -15.627 -4.954 -6.480 1.00 0.00 H new ATOM 0 HD1 TYR A 279 -16.925 -3.889 -4.362 1.00 0.00 H new ATOM 0 HD2 TYR A 279 -15.585 -1.690 -7.757 1.00 0.00 H new ATOM 0 HE1 TYR A 279 -18.582 -2.143 -3.884 1.00 0.00 H new ATOM 0 HE2 TYR A 279 -17.238 0.061 -7.277 1.00 0.00 H new ATOM 0 HH TYR A 279 -18.864 0.755 -5.952 1.00 0.00 H new ATOM 1033 N SER A 280 -11.913 -5.271 -5.020 1.00 0.00 N ATOM 1034 CA SER A 280 -10.903 -6.291 -5.277 1.00 0.00 C ATOM 1035 C SER A 280 -10.271 -6.772 -3.974 1.00 0.00 C ATOM 1036 O SER A 280 -10.321 -6.083 -2.955 1.00 0.00 O ATOM 1037 CB SER A 280 -9.821 -5.744 -6.211 1.00 0.00 C ATOM 1038 OG SER A 280 -8.868 -4.979 -5.493 1.00 0.00 O ATOM 0 H SER A 280 -11.664 -4.606 -4.287 1.00 0.00 H new ATOM 0 HA SER A 280 -11.393 -7.138 -5.757 1.00 0.00 H new ATOM 0 HB2 SER A 280 -9.322 -6.570 -6.718 1.00 0.00 H new ATOM 0 HB3 SER A 280 -10.280 -5.127 -6.983 1.00 0.00 H new ATOM 0 HG SER A 280 -9.027 -4.025 -5.653 1.00 0.00 H new ATOM 1044 N LYS A 281 -9.677 -7.959 -4.015 1.00 0.00 N ATOM 1045 CA LYS A 281 -9.033 -8.534 -2.839 1.00 0.00 C ATOM 1046 C LYS A 281 -7.516 -8.541 -2.998 1.00 0.00 C ATOM 1047 O LYS A 281 -6.997 -8.792 -4.086 1.00 0.00 O ATOM 1048 CB LYS A 281 -9.538 -9.958 -2.601 1.00 0.00 C ATOM 1049 CG LYS A 281 -8.945 -10.981 -3.554 1.00 0.00 C ATOM 1050 CD LYS A 281 -9.898 -12.141 -3.791 1.00 0.00 C ATOM 1051 CE LYS A 281 -9.864 -13.134 -2.639 1.00 0.00 C ATOM 1052 NZ LYS A 281 -10.397 -14.466 -3.039 1.00 0.00 N ATOM 0 H LYS A 281 -9.628 -8.543 -4.850 1.00 0.00 H new ATOM 0 HA LYS A 281 -9.287 -7.916 -1.978 1.00 0.00 H new ATOM 0 HB2 LYS A 281 -9.306 -10.250 -1.577 1.00 0.00 H new ATOM 0 HB3 LYS A 281 -10.624 -9.970 -2.698 1.00 0.00 H new ATOM 0 HG2 LYS A 281 -8.711 -10.501 -4.504 1.00 0.00 H new ATOM 0 HG3 LYS A 281 -8.006 -11.357 -3.147 1.00 0.00 H new ATOM 0 HD2 LYS A 281 -10.912 -11.761 -3.915 1.00 0.00 H new ATOM 0 HD3 LYS A 281 -9.632 -12.648 -4.718 1.00 0.00 H new ATOM 0 HE2 LYS A 281 -8.839 -13.244 -2.285 1.00 0.00 H new ATOM 0 HE3 LYS A 281 -10.449 -12.744 -1.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 -10.357 -15.114 -2.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 -11.383 -14.365 -3.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 -9.824 -14.850 -3.817 1.00 0.00 H new ATOM 1066 N PHE A 282 -6.810 -8.265 -1.907 1.00 0.00 N ATOM 1067 CA PHE A 282 -5.352 -8.241 -1.925 1.00 0.00 C ATOM 1068 C PHE A 282 -4.782 -9.642 -1.724 1.00 0.00 C ATOM 1069 O PHE A 282 -4.262 -10.253 -2.658 1.00 0.00 O ATOM 1070 CB PHE A 282 -4.823 -7.302 -0.839 1.00 0.00 C ATOM 1071 CG PHE A 282 -3.382 -7.540 -0.491 1.00 0.00 C ATOM 1072 CD1 PHE A 282 -2.372 -7.140 -1.351 1.00 0.00 C ATOM 1073 CD2 PHE A 282 -3.036 -8.164 0.697 1.00 0.00 C ATOM 1074 CE1 PHE A 282 -1.044 -7.357 -1.034 1.00 0.00 C ATOM 1075 CE2 PHE A 282 -1.711 -8.384 1.020 1.00 0.00 C ATOM 1076 CZ PHE A 282 -0.714 -7.981 0.153 1.00 0.00 C ATOM 0 H PHE A 282 -7.224 -8.055 -0.999 1.00 0.00 H new ATOM 0 HA PHE A 282 -5.032 -7.874 -2.900 1.00 0.00 H new ATOM 0 HB2 PHE A 282 -4.943 -6.271 -1.172 1.00 0.00 H new ATOM 0 HB3 PHE A 282 -5.430 -7.420 0.059 1.00 0.00 H new ATOM 0 HD1 PHE A 282 -2.625 -6.652 -2.281 1.00 0.00 H new ATOM 0 HD2 PHE A 282 -3.811 -8.482 1.378 1.00 0.00 H new ATOM 0 HE1 PHE A 282 -0.267 -7.039 -1.713 1.00 0.00 H new ATOM 0 HE2 PHE A 282 -1.455 -8.871 1.950 1.00 0.00 H new ATOM 0 HZ PHE A 282 0.322 -8.154 0.403 1.00 0.00 H new ATOM 1086 N HIS A 283 -4.883 -10.145 -0.497 1.00 0.00 N ATOM 1087 CA HIS A 283 -4.377 -11.474 -0.172 1.00 0.00 C ATOM 1088 C HIS A 283 -5.526 -12.437 0.112 1.00 0.00 C ATOM 1089 O HIS A 283 -5.850 -13.293 -0.713 1.00 0.00 O ATOM 1090 CB HIS A 283 -3.443 -11.405 1.036 1.00 0.00 C ATOM 1091 CG HIS A 283 -2.008 -11.182 0.672 1.00 0.00 C ATOM 1092 ND1 HIS A 283 -0.983 -11.219 1.593 1.00 0.00 N ATOM 1093 CD2 HIS A 283 -1.428 -10.920 -0.523 1.00 0.00 C ATOM 1094 CE1 HIS A 283 0.165 -10.987 0.981 1.00 0.00 C ATOM 1095 NE2 HIS A 283 -0.078 -10.803 -0.304 1.00 0.00 N ATOM 0 H HIS A 283 -5.310 -9.653 0.288 1.00 0.00 H new ATOM 0 HA HIS A 283 -3.819 -11.845 -1.032 1.00 0.00 H new ATOM 0 HB2 HIS A 283 -3.772 -10.600 1.693 1.00 0.00 H new ATOM 0 HB3 HIS A 283 -3.526 -12.333 1.602 1.00 0.00 H new ATOM 0 HD2 HIS A 283 -1.934 -10.821 -1.472 1.00 0.00 H new ATOM 0 HE1 HIS A 283 1.137 -10.954 1.452 1.00 0.00 H new ATOM 0 HE2 HIS A 283 0.624 -10.606 -1.018 1.00 0.00 H new ATOM 1104 N HIS A 284 -6.137 -12.293 1.283 1.00 0.00 N ATOM 1105 CA HIS A 284 -7.250 -13.151 1.675 1.00 0.00 C ATOM 1106 C HIS A 284 -8.470 -12.318 2.055 1.00 0.00 C ATOM 1107 O HIS A 284 -9.576 -12.843 2.190 1.00 0.00 O ATOM 1108 CB HIS A 284 -6.843 -14.045 2.847 1.00 0.00 C ATOM 1109 CG HIS A 284 -5.641 -14.892 2.565 1.00 0.00 C ATOM 1110 ND1 HIS A 284 -5.725 -16.189 2.105 1.00 0.00 N ATOM 1111 CD2 HIS A 284 -4.320 -14.620 2.679 1.00 0.00 C ATOM 1112 CE1 HIS A 284 -4.508 -16.679 1.949 1.00 0.00 C ATOM 1113 NE2 HIS A 284 -3.637 -15.746 2.291 1.00 0.00 N ATOM 0 H HIS A 284 -5.881 -11.591 1.977 1.00 0.00 H new ATOM 0 HA HIS A 284 -7.512 -13.778 0.823 1.00 0.00 H new ATOM 0 HB2 HIS A 284 -6.641 -13.420 3.717 1.00 0.00 H new ATOM 0 HB3 HIS A 284 -7.680 -14.692 3.107 1.00 0.00 H new ATOM 0 HD2 HIS A 284 -3.884 -13.690 3.013 1.00 0.00 H new ATOM 0 HE1 HIS A 284 -4.266 -17.673 1.601 1.00 0.00 H new ATOM 0 HE2 HIS A 284 -2.622 -15.846 2.270 1.00 0.00 H new ATOM 1122 N VAL A 285 -8.262 -11.016 2.228 1.00 0.00 N ATOM 1123 CA VAL A 285 -9.345 -10.111 2.592 1.00 0.00 C ATOM 1124 C VAL A 285 -9.551 -9.043 1.524 1.00 0.00 C ATOM 1125 O VAL A 285 -8.629 -8.668 0.800 1.00 0.00 O ATOM 1126 CB VAL A 285 -9.072 -9.424 3.943 1.00 0.00 C ATOM 1127 CG1 VAL A 285 -8.956 -10.457 5.054 1.00 0.00 C ATOM 1128 CG2 VAL A 285 -7.815 -8.572 3.863 1.00 0.00 C ATOM 0 H VAL A 285 -7.353 -10.565 2.122 1.00 0.00 H new ATOM 0 HA VAL A 285 -10.248 -10.716 2.676 1.00 0.00 H new ATOM 0 HB VAL A 285 -9.913 -8.770 4.174 1.00 0.00 H new ATOM 0 HG11 VAL A 285 -8.763 -9.953 6.001 1.00 0.00 H new ATOM 0 HG12 VAL A 285 -9.886 -11.020 5.126 1.00 0.00 H new ATOM 0 HG13 VAL A 285 -8.135 -11.139 4.832 1.00 0.00 H new ATOM 0 HG21 VAL A 285 -7.637 -8.094 4.826 1.00 0.00 H new ATOM 0 HG22 VAL A 285 -6.963 -9.203 3.608 1.00 0.00 H new ATOM 0 HG23 VAL A 285 -7.942 -7.807 3.097 1.00 0.00 H new ATOM 1138 N PRO A 286 -10.790 -8.539 1.422 1.00 0.00 N ATOM 1139 CA PRO A 286 -11.147 -7.505 0.445 1.00 0.00 C ATOM 1140 C PRO A 286 -10.519 -6.155 0.775 1.00 0.00 C ATOM 1141 O PRO A 286 -10.391 -5.788 1.944 1.00 0.00 O ATOM 1142 CB PRO A 286 -12.672 -7.427 0.552 1.00 0.00 C ATOM 1143 CG PRO A 286 -12.980 -7.903 1.930 1.00 0.00 C ATOM 1144 CD PRO A 286 -11.939 -8.939 2.252 1.00 0.00 C ATOM 0 HA PRO A 286 -10.789 -7.748 -0.555 1.00 0.00 H new ATOM 0 HB2 PRO A 286 -13.028 -6.409 0.396 1.00 0.00 H new ATOM 0 HB3 PRO A 286 -13.154 -8.052 -0.200 1.00 0.00 H new ATOM 0 HG2 PRO A 286 -12.946 -7.080 2.644 1.00 0.00 H new ATOM 0 HG3 PRO A 286 -13.982 -8.328 1.981 1.00 0.00 H new ATOM 0 HD2 PRO A 286 -11.688 -8.940 3.313 1.00 0.00 H new ATOM 0 HD3 PRO A 286 -12.282 -9.944 2.005 1.00 0.00 H new ATOM 1152 N LEU A 287 -10.130 -5.420 -0.260 1.00 0.00 N ATOM 1153 CA LEU A 287 -9.516 -4.109 -0.081 1.00 0.00 C ATOM 1154 C LEU A 287 -10.575 -3.011 -0.055 1.00 0.00 C ATOM 1155 O LEU A 287 -11.397 -2.906 -0.966 1.00 0.00 O ATOM 1156 CB LEU A 287 -8.510 -3.837 -1.200 1.00 0.00 C ATOM 1157 CG LEU A 287 -7.266 -4.726 -1.214 1.00 0.00 C ATOM 1158 CD1 LEU A 287 -6.615 -4.711 -2.589 1.00 0.00 C ATOM 1159 CD2 LEU A 287 -6.276 -4.275 -0.149 1.00 0.00 C ATOM 0 H LEU A 287 -10.229 -5.710 -1.233 1.00 0.00 H new ATOM 0 HA LEU A 287 -8.994 -4.108 0.876 1.00 0.00 H new ATOM 0 HB2 LEU A 287 -9.022 -3.947 -2.156 1.00 0.00 H new ATOM 0 HB3 LEU A 287 -8.189 -2.798 -1.128 1.00 0.00 H new ATOM 0 HG LEU A 287 -7.571 -5.748 -0.989 1.00 0.00 H new ATOM 0 HD11 LEU A 287 -5.731 -5.349 -2.580 1.00 0.00 H new ATOM 0 HD12 LEU A 287 -7.323 -5.081 -3.331 1.00 0.00 H new ATOM 0 HD13 LEU A 287 -6.324 -3.692 -2.843 1.00 0.00 H new ATOM 0 HD21 LEU A 287 -5.397 -4.919 -0.173 1.00 0.00 H new ATOM 0 HD22 LEU A 287 -5.977 -3.245 -0.343 1.00 0.00 H new ATOM 0 HD23 LEU A 287 -6.744 -4.338 0.833 1.00 0.00 H new ATOM 1171 N TYR A 288 -10.547 -2.194 0.992 1.00 0.00 N ATOM 1172 CA TYR A 288 -11.505 -1.104 1.137 1.00 0.00 C ATOM 1173 C TYR A 288 -10.812 0.249 1.012 1.00 0.00 C ATOM 1174 O TYR A 288 -10.187 0.730 1.958 1.00 0.00 O ATOM 1175 CB TYR A 288 -12.220 -1.201 2.485 1.00 0.00 C ATOM 1176 CG TYR A 288 -13.456 -2.071 2.454 1.00 0.00 C ATOM 1177 CD1 TYR A 288 -13.415 -3.351 1.913 1.00 0.00 C ATOM 1178 CD2 TYR A 288 -14.664 -1.615 2.966 1.00 0.00 C ATOM 1179 CE1 TYR A 288 -14.542 -4.149 1.882 1.00 0.00 C ATOM 1180 CE2 TYR A 288 -15.796 -2.407 2.940 1.00 0.00 C ATOM 1181 CZ TYR A 288 -15.730 -3.673 2.397 1.00 0.00 C ATOM 1182 OH TYR A 288 -16.854 -4.466 2.369 1.00 0.00 O ATOM 0 H TYR A 288 -9.871 -2.266 1.753 1.00 0.00 H new ATOM 0 HA TYR A 288 -12.240 -1.191 0.337 1.00 0.00 H new ATOM 0 HB2 TYR A 288 -11.526 -1.596 3.227 1.00 0.00 H new ATOM 0 HB3 TYR A 288 -12.499 -0.199 2.812 1.00 0.00 H new ATOM 0 HD1 TYR A 288 -12.486 -3.728 1.510 1.00 0.00 H new ATOM 0 HD2 TYR A 288 -14.719 -0.624 3.392 1.00 0.00 H new ATOM 0 HE1 TYR A 288 -14.493 -5.141 1.457 1.00 0.00 H new ATOM 0 HE2 TYR A 288 -16.727 -2.037 3.343 1.00 0.00 H new ATOM 0 HH TYR A 288 -17.605 -3.983 2.772 1.00 0.00 H new ATOM 1192 N LEU A 289 -10.927 0.859 -0.163 1.00 0.00 N ATOM 1193 CA LEU A 289 -10.313 2.159 -0.413 1.00 0.00 C ATOM 1194 C LEU A 289 -11.268 3.292 -0.051 1.00 0.00 C ATOM 1195 O LEU A 289 -12.438 3.274 -0.430 1.00 0.00 O ATOM 1196 CB LEU A 289 -9.900 2.275 -1.882 1.00 0.00 C ATOM 1197 CG LEU A 289 -9.004 1.157 -2.417 1.00 0.00 C ATOM 1198 CD1 LEU A 289 -8.787 1.319 -3.914 1.00 0.00 C ATOM 1199 CD2 LEU A 289 -7.672 1.143 -1.681 1.00 0.00 C ATOM 0 H LEU A 289 -11.439 0.475 -0.957 1.00 0.00 H new ATOM 0 HA LEU A 289 -9.427 2.241 0.216 1.00 0.00 H new ATOM 0 HB2 LEU A 289 -10.803 2.312 -2.491 1.00 0.00 H new ATOM 0 HB3 LEU A 289 -9.383 3.225 -2.020 1.00 0.00 H new ATOM 0 HG LEU A 289 -9.502 0.203 -2.244 1.00 0.00 H new ATOM 0 HD11 LEU A 289 -8.147 0.515 -4.278 1.00 0.00 H new ATOM 0 HD12 LEU A 289 -9.748 1.279 -4.427 1.00 0.00 H new ATOM 0 HD13 LEU A 289 -8.310 2.279 -4.111 1.00 0.00 H new ATOM 0 HD21 LEU A 289 -7.047 0.341 -2.075 1.00 0.00 H new ATOM 0 HD22 LEU A 289 -7.168 2.099 -1.823 1.00 0.00 H new ATOM 0 HD23 LEU A 289 -7.846 0.979 -0.618 1.00 0.00 H new ATOM 1211 N GLU A 290 -10.759 4.275 0.684 1.00 0.00 N ATOM 1212 CA GLU A 290 -11.567 5.417 1.097 1.00 0.00 C ATOM 1213 C GLU A 290 -10.804 6.724 0.899 1.00 0.00 C ATOM 1214 O GLU A 290 -9.738 6.926 1.481 1.00 0.00 O ATOM 1215 CB GLU A 290 -11.983 5.273 2.562 1.00 0.00 C ATOM 1216 CG GLU A 290 -12.890 6.390 3.050 1.00 0.00 C ATOM 1217 CD GLU A 290 -14.352 6.132 2.740 1.00 0.00 C ATOM 1218 OE1 GLU A 290 -14.743 4.947 2.674 1.00 0.00 O ATOM 1219 OE2 GLU A 290 -15.104 7.112 2.563 1.00 0.00 O ATOM 0 H GLU A 290 -9.792 4.304 1.006 1.00 0.00 H new ATOM 0 HA GLU A 290 -12.461 5.441 0.474 1.00 0.00 H new ATOM 0 HB2 GLU A 290 -12.493 4.319 2.694 1.00 0.00 H new ATOM 0 HB3 GLU A 290 -11.088 5.245 3.184 1.00 0.00 H new ATOM 0 HG2 GLU A 290 -12.766 6.509 4.126 1.00 0.00 H new ATOM 0 HG3 GLU A 290 -12.585 7.329 2.588 1.00 0.00 H new ATOM 1226 N TRP A 291 -11.356 7.605 0.073 1.00 0.00 N ATOM 1227 CA TRP A 291 -10.727 8.892 -0.202 1.00 0.00 C ATOM 1228 C TRP A 291 -10.227 9.540 1.084 1.00 0.00 C ATOM 1229 O TRP A 291 -10.972 9.672 2.054 1.00 0.00 O ATOM 1230 CB TRP A 291 -11.715 9.824 -0.906 1.00 0.00 C ATOM 1231 CG TRP A 291 -11.779 9.612 -2.388 1.00 0.00 C ATOM 1232 CD1 TRP A 291 -12.895 9.354 -3.132 1.00 0.00 C ATOM 1233 CD2 TRP A 291 -10.680 9.636 -3.306 1.00 0.00 C ATOM 1234 NE1 TRP A 291 -12.556 9.217 -4.456 1.00 0.00 N ATOM 1235 CE2 TRP A 291 -11.204 9.387 -4.590 1.00 0.00 C ATOM 1236 CE3 TRP A 291 -9.305 9.847 -3.169 1.00 0.00 C ATOM 1237 CZ2 TRP A 291 -10.399 9.341 -5.725 1.00 0.00 C ATOM 1238 CZ3 TRP A 291 -8.509 9.802 -4.297 1.00 0.00 C ATOM 1239 CH2 TRP A 291 -9.057 9.551 -5.562 1.00 0.00 C ATOM 0 H TRP A 291 -12.237 7.452 -0.418 1.00 0.00 H new ATOM 0 HA TRP A 291 -9.872 8.718 -0.855 1.00 0.00 H new ATOM 0 HB2 TRP A 291 -12.708 9.676 -0.482 1.00 0.00 H new ATOM 0 HB3 TRP A 291 -11.434 10.858 -0.706 1.00 0.00 H new ATOM 0 HD1 TRP A 291 -13.897 9.270 -2.737 1.00 0.00 H new ATOM 0 HE1 TRP A 291 -13.206 9.020 -5.217 1.00 0.00 H new ATOM 0 HE3 TRP A 291 -8.873 10.042 -2.199 1.00 0.00 H new ATOM 0 HZ2 TRP A 291 -10.819 9.146 -6.701 1.00 0.00 H new ATOM 0 HZ3 TRP A 291 -7.445 9.963 -4.202 1.00 0.00 H new ATOM 0 HH2 TRP A 291 -8.408 9.523 -6.425 1.00 0.00 H new ATOM 1250 N ALA A 292 -8.960 9.941 1.085 1.00 0.00 N ATOM 1251 CA ALA A 292 -8.361 10.577 2.252 1.00 0.00 C ATOM 1252 C ALA A 292 -8.611 12.081 2.246 1.00 0.00 C ATOM 1253 O ALA A 292 -8.388 12.768 1.249 1.00 0.00 O ATOM 1254 CB ALA A 292 -6.867 10.289 2.301 1.00 0.00 C ATOM 0 H ALA A 292 -8.329 9.837 0.291 1.00 0.00 H new ATOM 0 HA ALA A 292 -8.830 10.160 3.143 1.00 0.00 H new ATOM 0 HB1 ALA A 292 -6.432 10.770 3.177 1.00 0.00 H new ATOM 0 HB2 ALA A 292 -6.706 9.213 2.360 1.00 0.00 H new ATOM 0 HB3 ALA A 292 -6.392 10.678 1.401 1.00 0.00 H new