USER MOD reduce.3.24.130724 H: found=0, std=0, add=593, rem=0, adj=13 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+ -134:sc= -1.09 (180deg=-3.16!) 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= -1.15 K(o=-1.2,f=-0.56) USER MOD Single : A 233 THR OG1 : rot -64:sc= 0.146 USER MOD Single : A 239 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 241 THR OG1 : rot 95:sc= 1.26 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= -3.61 K(o=-3.6,f=-4.3!) USER MOD Single : A 279 TYR OH : rot 180:sc= 0 USER MOD Single : A 280 SER OG : rot 180:sc= 0 USER MOD Single : A 281 LYS NZ :NH3+ 144:sc= 0.00401 (180deg=-0.0535) USER MOD Single : A 283 HIS : no HD1:sc= -14.2! C(o=-14!,f=-15!) USER MOD Single : A 284 HIS : no HD1:sc= -0.947 K(o=-0.95,f=-0.27) USER MOD Single : A 288 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 90 N SER A 220 -9.093 14.798 -0.998 1.00 0.00 N ATOM 91 CA SER A 220 -7.874 14.873 -1.795 1.00 0.00 C ATOM 92 C SER A 220 -7.972 13.974 -3.024 1.00 0.00 C ATOM 93 O SER A 220 -8.710 12.988 -3.029 1.00 0.00 O ATOM 94 CB SER A 220 -6.662 14.473 -0.952 1.00 0.00 C ATOM 95 OG SER A 220 -6.349 15.476 -0.001 1.00 0.00 O ATOM 0 HA SER A 220 -7.751 15.903 -2.129 1.00 0.00 H new ATOM 0 HB2 SER A 220 -6.866 13.533 -0.440 1.00 0.00 H new ATOM 0 HB3 SER A 220 -5.803 14.303 -1.602 1.00 0.00 H new ATOM 0 HG SER A 220 -5.572 15.196 0.526 1.00 0.00 H new ATOM 101 N LYS A 221 -7.223 14.321 -4.065 1.00 0.00 N ATOM 102 CA LYS A 221 -7.223 13.546 -5.300 1.00 0.00 C ATOM 103 C LYS A 221 -5.911 12.786 -5.465 1.00 0.00 C ATOM 104 O LYS A 221 -5.806 11.880 -6.292 1.00 0.00 O ATOM 105 CB LYS A 221 -7.446 14.466 -6.503 1.00 0.00 C ATOM 106 CG LYS A 221 -8.848 15.044 -6.575 1.00 0.00 C ATOM 107 CD LYS A 221 -8.997 16.260 -5.676 1.00 0.00 C ATOM 108 CE LYS A 221 -8.345 17.490 -6.290 1.00 0.00 C ATOM 109 NZ LYS A 221 -6.901 17.584 -5.940 1.00 0.00 N ATOM 0 H LYS A 221 -6.608 15.134 -4.078 1.00 0.00 H new ATOM 0 HA LYS A 221 -8.037 12.823 -5.246 1.00 0.00 H new ATOM 0 HB2 LYS A 221 -6.727 15.284 -6.463 1.00 0.00 H new ATOM 0 HB3 LYS A 221 -7.244 13.909 -7.418 1.00 0.00 H new ATOM 0 HG2 LYS A 221 -9.076 15.321 -7.604 1.00 0.00 H new ATOM 0 HG3 LYS A 221 -9.572 14.283 -6.282 1.00 0.00 H new ATOM 0 HD2 LYS A 221 -10.055 16.457 -5.501 1.00 0.00 H new ATOM 0 HD3 LYS A 221 -8.546 16.054 -4.705 1.00 0.00 H new ATOM 0 HE2 LYS A 221 -8.455 17.457 -7.374 1.00 0.00 H new ATOM 0 HE3 LYS A 221 -8.862 18.386 -5.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 221 -6.678 18.556 -5.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 221 -6.689 16.927 -5.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 221 -6.326 17.335 -6.770 1.00 0.00 H new ATOM 123 N THR A 222 -4.912 13.158 -4.671 1.00 0.00 N ATOM 124 CA THR A 222 -3.607 12.511 -4.729 1.00 0.00 C ATOM 125 C THR A 222 -3.309 11.759 -3.436 1.00 0.00 C ATOM 126 O THR A 222 -2.153 11.465 -3.131 1.00 0.00 O ATOM 127 CB THR A 222 -2.484 13.533 -4.986 1.00 0.00 C ATOM 128 OG1 THR A 222 -2.536 14.575 -4.005 1.00 0.00 O ATOM 129 CG2 THR A 222 -2.607 14.134 -6.378 1.00 0.00 C ATOM 0 H THR A 222 -4.982 13.905 -3.980 1.00 0.00 H new ATOM 0 HA THR A 222 -3.641 11.804 -5.558 1.00 0.00 H new ATOM 0 HB THR A 222 -1.528 13.014 -4.915 1.00 0.00 H new ATOM 0 HG1 THR A 222 -1.818 15.220 -4.174 1.00 0.00 H new ATOM 0 HG21 THR A 222 -1.803 14.853 -6.536 1.00 0.00 H new ATOM 0 HG22 THR A 222 -2.538 13.342 -7.124 1.00 0.00 H new ATOM 0 HG23 THR A 222 -3.569 14.638 -6.473 1.00 0.00 H new ATOM 137 N VAL A 223 -4.358 11.450 -2.681 1.00 0.00 N ATOM 138 CA VAL A 223 -4.208 10.731 -1.422 1.00 0.00 C ATOM 139 C VAL A 223 -5.407 9.827 -1.159 1.00 0.00 C ATOM 140 O VAL A 223 -6.556 10.265 -1.232 1.00 0.00 O ATOM 141 CB VAL A 223 -4.041 11.701 -0.237 1.00 0.00 C ATOM 142 CG1 VAL A 223 -3.914 10.932 1.069 1.00 0.00 C ATOM 143 CG2 VAL A 223 -2.837 12.604 -0.454 1.00 0.00 C ATOM 0 H VAL A 223 -5.321 11.686 -2.919 1.00 0.00 H new ATOM 0 HA VAL A 223 -3.309 10.121 -1.512 1.00 0.00 H new ATOM 0 HB VAL A 223 -4.930 12.329 -0.175 1.00 0.00 H new ATOM 0 HG11 VAL A 223 -3.797 11.634 1.895 1.00 0.00 H new ATOM 0 HG12 VAL A 223 -4.811 10.332 1.227 1.00 0.00 H new ATOM 0 HG13 VAL A 223 -3.043 10.278 1.023 1.00 0.00 H new ATOM 0 HG21 VAL A 223 -2.734 13.283 0.393 1.00 0.00 H new ATOM 0 HG22 VAL A 223 -1.937 11.995 -0.543 1.00 0.00 H new ATOM 0 HG23 VAL A 223 -2.976 13.182 -1.368 1.00 0.00 H new ATOM 153 N ILE A 224 -5.133 8.563 -0.853 1.00 0.00 N ATOM 154 CA ILE A 224 -6.189 7.597 -0.578 1.00 0.00 C ATOM 155 C ILE A 224 -5.889 6.799 0.685 1.00 0.00 C ATOM 156 O ILE A 224 -4.729 6.537 1.006 1.00 0.00 O ATOM 157 CB ILE A 224 -6.381 6.623 -1.755 1.00 0.00 C ATOM 158 CG1 ILE A 224 -6.519 7.395 -3.069 1.00 0.00 C ATOM 159 CG2 ILE A 224 -7.600 5.743 -1.521 1.00 0.00 C ATOM 160 CD1 ILE A 224 -6.035 6.624 -4.277 1.00 0.00 C ATOM 0 H ILE A 224 -4.188 8.184 -0.789 1.00 0.00 H new ATOM 0 HA ILE A 224 -7.108 8.166 -0.435 1.00 0.00 H new ATOM 0 HB ILE A 224 -5.502 5.982 -1.823 1.00 0.00 H new ATOM 0 HG12 ILE A 224 -7.565 7.664 -3.215 1.00 0.00 H new ATOM 0 HG13 ILE A 224 -5.958 8.327 -2.994 1.00 0.00 H new ATOM 0 HG21 ILE A 224 -7.722 5.060 -2.362 1.00 0.00 H new ATOM 0 HG22 ILE A 224 -7.464 5.169 -0.604 1.00 0.00 H new ATOM 0 HG23 ILE A 224 -8.488 6.368 -1.429 1.00 0.00 H new ATOM 0 HD11 ILE A 224 -6.163 7.232 -5.172 1.00 0.00 H new ATOM 0 HD12 ILE A 224 -4.980 6.378 -4.153 1.00 0.00 H new ATOM 0 HD13 ILE A 224 -6.612 5.705 -4.377 1.00 0.00 H new ATOM 172 N LEU A 225 -6.941 6.411 1.398 1.00 0.00 N ATOM 173 CA LEU A 225 -6.790 5.640 2.627 1.00 0.00 C ATOM 174 C LEU A 225 -7.262 4.203 2.428 1.00 0.00 C ATOM 175 O LEU A 225 -8.395 3.963 2.012 1.00 0.00 O ATOM 176 CB LEU A 225 -7.577 6.295 3.763 1.00 0.00 C ATOM 177 CG LEU A 225 -7.151 7.713 4.144 1.00 0.00 C ATOM 178 CD1 LEU A 225 -8.294 8.448 4.828 1.00 0.00 C ATOM 179 CD2 LEU A 225 -5.923 7.678 5.042 1.00 0.00 C ATOM 0 H LEU A 225 -7.908 6.618 1.146 1.00 0.00 H new ATOM 0 HA LEU A 225 -5.732 5.623 2.890 1.00 0.00 H new ATOM 0 HB2 LEU A 225 -8.630 6.316 3.483 1.00 0.00 H new ATOM 0 HB3 LEU A 225 -7.495 5.663 4.647 1.00 0.00 H new ATOM 0 HG LEU A 225 -6.894 8.252 3.232 1.00 0.00 H new ATOM 0 HD11 LEU A 225 -7.972 9.455 5.092 1.00 0.00 H new ATOM 0 HD12 LEU A 225 -9.147 8.505 4.151 1.00 0.00 H new ATOM 0 HD13 LEU A 225 -8.583 7.911 5.731 1.00 0.00 H new ATOM 0 HD21 LEU A 225 -5.634 8.696 5.303 1.00 0.00 H new ATOM 0 HD22 LEU A 225 -6.153 7.122 5.951 1.00 0.00 H new ATOM 0 HD23 LEU A 225 -5.102 7.191 4.516 1.00 0.00 H new ATOM 191 N ALA A 226 -6.386 3.250 2.731 1.00 0.00 N ATOM 192 CA ALA A 226 -6.714 1.837 2.590 1.00 0.00 C ATOM 193 C ALA A 226 -7.072 1.220 3.938 1.00 0.00 C ATOM 194 O ALA A 226 -6.457 1.530 4.958 1.00 0.00 O ATOM 195 CB ALA A 226 -5.554 1.086 1.955 1.00 0.00 C ATOM 0 H ALA A 226 -5.443 3.432 3.076 1.00 0.00 H new ATOM 0 HA ALA A 226 -7.584 1.755 1.939 1.00 0.00 H new ATOM 0 HB1 ALA A 226 -5.814 0.032 1.856 1.00 0.00 H new ATOM 0 HB2 ALA A 226 -5.347 1.503 0.969 1.00 0.00 H new ATOM 0 HB3 ALA A 226 -4.669 1.184 2.584 1.00 0.00 H new ATOM 201 N LYS A 227 -8.072 0.345 3.936 1.00 0.00 N ATOM 202 CA LYS A 227 -8.513 -0.317 5.158 1.00 0.00 C ATOM 203 C LYS A 227 -8.808 -1.792 4.901 1.00 0.00 C ATOM 204 O LYS A 227 -8.836 -2.239 3.756 1.00 0.00 O ATOM 205 CB LYS A 227 -9.759 0.373 5.715 1.00 0.00 C ATOM 206 CG LYS A 227 -9.447 1.564 6.606 1.00 0.00 C ATOM 207 CD LYS A 227 -10.716 2.228 7.113 1.00 0.00 C ATOM 208 CE LYS A 227 -10.438 3.622 7.653 1.00 0.00 C ATOM 209 NZ LYS A 227 -11.582 4.147 8.450 1.00 0.00 N ATOM 0 H LYS A 227 -8.593 0.078 3.101 1.00 0.00 H new ATOM 0 HA LYS A 227 -7.709 -0.247 5.890 1.00 0.00 H new ATOM 0 HB2 LYS A 227 -10.383 0.704 4.885 1.00 0.00 H new ATOM 0 HB3 LYS A 227 -10.343 -0.352 6.282 1.00 0.00 H new ATOM 0 HG2 LYS A 227 -8.843 1.238 7.452 1.00 0.00 H new ATOM 0 HG3 LYS A 227 -8.853 2.289 6.051 1.00 0.00 H new ATOM 0 HD2 LYS A 227 -11.444 2.289 6.304 1.00 0.00 H new ATOM 0 HD3 LYS A 227 -11.160 1.615 7.897 1.00 0.00 H new ATOM 0 HE2 LYS A 227 -9.543 3.599 8.274 1.00 0.00 H new ATOM 0 HE3 LYS A 227 -10.233 4.299 6.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 227 -11.353 5.099 8.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 227 -12.431 4.193 7.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 227 -11.762 3.515 9.256 1.00 0.00 H new ATOM 223 N ASN A 228 -9.028 -2.542 5.976 1.00 0.00 N ATOM 224 CA ASN A 228 -9.322 -3.966 5.867 1.00 0.00 C ATOM 225 C ASN A 228 -8.148 -4.718 5.249 1.00 0.00 C ATOM 226 O ASN A 228 -8.317 -5.486 4.301 1.00 0.00 O ATOM 227 CB ASN A 228 -10.582 -4.185 5.026 1.00 0.00 C ATOM 228 CG ASN A 228 -11.324 -5.449 5.415 1.00 0.00 C ATOM 229 OD1 ASN A 228 -12.276 -5.408 6.196 1.00 0.00 O ATOM 230 ND2 ASN A 228 -10.892 -6.581 4.871 1.00 0.00 N ATOM 0 H ASN A 228 -9.008 -2.187 6.932 1.00 0.00 H new ATOM 0 HA ASN A 228 -9.491 -4.355 6.871 1.00 0.00 H new ATOM 0 HB2 ASN A 228 -11.245 -3.328 5.140 1.00 0.00 H new ATOM 0 HB3 ASN A 228 -10.308 -4.238 3.972 1.00 0.00 H new ATOM 0 HD21 ASN A 228 -11.353 -7.463 5.095 1.00 0.00 H new ATOM 0 HD22 ASN A 228 -10.100 -6.568 4.229 1.00 0.00 H new ATOM 237 N LEU A 229 -6.957 -4.494 5.793 1.00 0.00 N ATOM 238 CA LEU A 229 -5.752 -5.150 5.296 1.00 0.00 C ATOM 239 C LEU A 229 -5.249 -6.190 6.292 1.00 0.00 C ATOM 240 O LEU A 229 -5.301 -5.998 7.507 1.00 0.00 O ATOM 241 CB LEU A 229 -4.659 -4.116 5.024 1.00 0.00 C ATOM 242 CG LEU A 229 -4.932 -3.135 3.884 1.00 0.00 C ATOM 243 CD1 LEU A 229 -4.019 -1.923 3.993 1.00 0.00 C ATOM 244 CD2 LEU A 229 -4.753 -3.819 2.537 1.00 0.00 C ATOM 0 H LEU A 229 -6.800 -3.863 6.579 1.00 0.00 H new ATOM 0 HA LEU A 229 -6.002 -5.657 4.364 1.00 0.00 H new ATOM 0 HB2 LEU A 229 -4.493 -3.544 5.937 1.00 0.00 H new ATOM 0 HB3 LEU A 229 -3.732 -4.646 4.806 1.00 0.00 H new ATOM 0 HG LEU A 229 -5.965 -2.795 3.962 1.00 0.00 H new ATOM 0 HD11 LEU A 229 -4.227 -1.236 3.173 1.00 0.00 H new ATOM 0 HD12 LEU A 229 -4.195 -1.419 4.943 1.00 0.00 H new ATOM 0 HD13 LEU A 229 -2.979 -2.245 3.941 1.00 0.00 H new ATOM 0 HD21 LEU A 229 -4.951 -3.105 1.737 1.00 0.00 H new ATOM 0 HD22 LEU A 229 -3.731 -4.188 2.449 1.00 0.00 H new ATOM 0 HD23 LEU A 229 -5.448 -4.655 2.458 1.00 0.00 H new ATOM 256 N PRO A 230 -4.747 -7.318 5.768 1.00 0.00 N ATOM 257 CA PRO A 230 -4.221 -8.409 6.594 1.00 0.00 C ATOM 258 C PRO A 230 -2.916 -8.034 7.287 1.00 0.00 C ATOM 259 O PRO A 230 -2.044 -7.402 6.691 1.00 0.00 O ATOM 260 CB PRO A 230 -3.986 -9.536 5.585 1.00 0.00 C ATOM 261 CG PRO A 230 -3.786 -8.842 4.282 1.00 0.00 C ATOM 262 CD PRO A 230 -4.653 -7.614 4.329 1.00 0.00 C ATOM 0 HA PRO A 230 -4.904 -8.676 7.400 1.00 0.00 H new ATOM 0 HB2 PRO A 230 -3.114 -10.133 5.854 1.00 0.00 H new ATOM 0 HB3 PRO A 230 -4.837 -10.216 5.545 1.00 0.00 H new ATOM 0 HG2 PRO A 230 -2.739 -8.575 4.139 1.00 0.00 H new ATOM 0 HG3 PRO A 230 -4.067 -9.487 3.449 1.00 0.00 H new ATOM 0 HD2 PRO A 230 -4.208 -6.786 3.777 1.00 0.00 H new ATOM 0 HD3 PRO A 230 -5.634 -7.798 3.892 1.00 0.00 H new ATOM 270 N ALA A 231 -2.787 -8.429 8.550 1.00 0.00 N ATOM 271 CA ALA A 231 -1.587 -8.136 9.323 1.00 0.00 C ATOM 272 C ALA A 231 -0.330 -8.529 8.555 1.00 0.00 C ATOM 273 O ALA A 231 0.757 -8.017 8.820 1.00 0.00 O ATOM 274 CB ALA A 231 -1.635 -8.854 10.664 1.00 0.00 C ATOM 0 H ALA A 231 -3.499 -8.953 9.059 1.00 0.00 H new ATOM 0 HA ALA A 231 -1.552 -7.061 9.500 1.00 0.00 H new ATOM 0 HB1 ALA A 231 -0.732 -8.626 11.231 1.00 0.00 H new ATOM 0 HB2 ALA A 231 -2.509 -8.521 11.224 1.00 0.00 H new ATOM 0 HB3 ALA A 231 -1.698 -9.930 10.499 1.00 0.00 H new ATOM 280 N GLY A 232 -0.485 -9.443 7.602 1.00 0.00 N ATOM 281 CA GLY A 232 0.646 -9.890 6.811 1.00 0.00 C ATOM 282 C GLY A 232 1.187 -8.801 5.905 1.00 0.00 C ATOM 283 O GLY A 232 2.395 -8.711 5.682 1.00 0.00 O ATOM 0 H GLY A 232 -1.374 -9.882 7.364 1.00 0.00 H new ATOM 0 HA2 GLY A 232 1.439 -10.231 7.477 1.00 0.00 H new ATOM 0 HA3 GLY A 232 0.347 -10.746 6.206 1.00 0.00 H new ATOM 287 N THR A 233 0.291 -7.971 5.380 1.00 0.00 N ATOM 288 CA THR A 233 0.684 -6.885 4.492 1.00 0.00 C ATOM 289 C THR A 233 1.901 -6.145 5.034 1.00 0.00 C ATOM 290 O THR A 233 2.243 -6.269 6.210 1.00 0.00 O ATOM 291 CB THR A 233 -0.466 -5.880 4.290 1.00 0.00 C ATOM 292 OG1 THR A 233 -1.690 -6.580 4.039 1.00 0.00 O ATOM 293 CG2 THR A 233 -0.167 -4.941 3.131 1.00 0.00 C ATOM 0 H THR A 233 -0.712 -8.031 5.555 1.00 0.00 H new ATOM 0 HA THR A 233 0.934 -7.337 3.532 1.00 0.00 H new ATOM 0 HB THR A 233 -0.566 -5.288 5.200 1.00 0.00 H new ATOM 0 HG1 THR A 233 -1.617 -7.075 3.197 1.00 0.00 H new ATOM 0 HG21 THR A 233 -0.993 -4.241 3.008 1.00 0.00 H new ATOM 0 HG22 THR A 233 0.749 -4.388 3.338 1.00 0.00 H new ATOM 0 HG23 THR A 233 -0.043 -5.520 2.216 1.00 0.00 H new ATOM 301 N LEU A 234 2.552 -5.374 4.169 1.00 0.00 N ATOM 302 CA LEU A 234 3.733 -4.612 4.562 1.00 0.00 C ATOM 303 C LEU A 234 3.861 -3.340 3.729 1.00 0.00 C ATOM 304 O LEU A 234 3.561 -3.335 2.536 1.00 0.00 O ATOM 305 CB LEU A 234 4.991 -5.467 4.405 1.00 0.00 C ATOM 306 CG LEU A 234 5.063 -6.721 5.276 1.00 0.00 C ATOM 307 CD1 LEU A 234 6.180 -7.638 4.802 1.00 0.00 C ATOM 308 CD2 LEU A 234 5.264 -6.345 6.737 1.00 0.00 C ATOM 0 H LEU A 234 2.282 -5.260 3.192 1.00 0.00 H new ATOM 0 HA LEU A 234 3.622 -4.330 5.609 1.00 0.00 H new ATOM 0 HB2 LEU A 234 5.073 -5.769 3.361 1.00 0.00 H new ATOM 0 HB3 LEU A 234 5.859 -4.845 4.626 1.00 0.00 H new ATOM 0 HG LEU A 234 4.118 -7.257 5.186 1.00 0.00 H new ATOM 0 HD11 LEU A 234 6.215 -8.525 5.434 1.00 0.00 H new ATOM 0 HD12 LEU A 234 5.994 -7.935 3.770 1.00 0.00 H new ATOM 0 HD13 LEU A 234 7.133 -7.112 4.861 1.00 0.00 H new ATOM 0 HD21 LEU A 234 5.313 -7.250 7.342 1.00 0.00 H new ATOM 0 HD22 LEU A 234 6.194 -5.786 6.844 1.00 0.00 H new ATOM 0 HD23 LEU A 234 4.430 -5.729 7.072 1.00 0.00 H new ATOM 320 N ALA A 235 4.311 -2.264 4.367 1.00 0.00 N ATOM 321 CA ALA A 235 4.484 -0.988 3.685 1.00 0.00 C ATOM 322 C ALA A 235 4.998 -1.191 2.263 1.00 0.00 C ATOM 323 O ALA A 235 4.613 -0.467 1.345 1.00 0.00 O ATOM 324 CB ALA A 235 5.433 -0.094 4.469 1.00 0.00 C ATOM 0 H ALA A 235 4.562 -2.251 5.355 1.00 0.00 H new ATOM 0 HA ALA A 235 3.511 -0.501 3.626 1.00 0.00 H new ATOM 0 HB1 ALA A 235 5.553 0.856 3.947 1.00 0.00 H new ATOM 0 HB2 ALA A 235 5.024 0.087 5.463 1.00 0.00 H new ATOM 0 HB3 ALA A 235 6.403 -0.583 4.559 1.00 0.00 H new ATOM 330 N ALA A 236 5.870 -2.178 2.090 1.00 0.00 N ATOM 331 CA ALA A 236 6.436 -2.476 0.780 1.00 0.00 C ATOM 332 C ALA A 236 5.381 -3.060 -0.154 1.00 0.00 C ATOM 333 O ALA A 236 5.227 -2.610 -1.288 1.00 0.00 O ATOM 334 CB ALA A 236 7.610 -3.434 0.918 1.00 0.00 C ATOM 0 H ALA A 236 6.200 -2.785 2.840 1.00 0.00 H new ATOM 0 HA ALA A 236 6.792 -1.542 0.345 1.00 0.00 H new ATOM 0 HB1 ALA A 236 8.023 -3.648 -0.068 1.00 0.00 H new ATOM 0 HB2 ALA A 236 8.379 -2.980 1.543 1.00 0.00 H new ATOM 0 HB3 ALA A 236 7.270 -4.362 1.378 1.00 0.00 H new ATOM 340 N GLU A 237 4.659 -4.065 0.332 1.00 0.00 N ATOM 341 CA GLU A 237 3.620 -4.711 -0.462 1.00 0.00 C ATOM 342 C GLU A 237 2.650 -3.679 -1.031 1.00 0.00 C ATOM 343 O GLU A 237 2.413 -3.634 -2.238 1.00 0.00 O ATOM 344 CB GLU A 237 2.857 -5.729 0.388 1.00 0.00 C ATOM 345 CG GLU A 237 3.646 -6.997 0.673 1.00 0.00 C ATOM 346 CD GLU A 237 4.218 -7.622 -0.585 1.00 0.00 C ATOM 347 OE1 GLU A 237 3.447 -8.256 -1.335 1.00 0.00 O ATOM 348 OE2 GLU A 237 5.436 -7.478 -0.818 1.00 0.00 O ATOM 0 H GLU A 237 4.774 -4.449 1.270 1.00 0.00 H new ATOM 0 HA GLU A 237 4.101 -5.229 -1.292 1.00 0.00 H new ATOM 0 HB2 GLU A 237 2.578 -5.264 1.334 1.00 0.00 H new ATOM 0 HB3 GLU A 237 1.931 -5.994 -0.122 1.00 0.00 H new ATOM 0 HG2 GLU A 237 4.459 -6.768 1.362 1.00 0.00 H new ATOM 0 HG3 GLU A 237 2.999 -7.719 1.171 1.00 0.00 H new ATOM 355 N ILE A 238 2.091 -2.853 -0.152 1.00 0.00 N ATOM 356 CA ILE A 238 1.148 -1.823 -0.567 1.00 0.00 C ATOM 357 C ILE A 238 1.796 -0.841 -1.537 1.00 0.00 C ATOM 358 O ILE A 238 1.335 -0.673 -2.666 1.00 0.00 O ATOM 359 CB ILE A 238 0.598 -1.043 0.642 1.00 0.00 C ATOM 360 CG1 ILE A 238 -0.246 -1.962 1.528 1.00 0.00 C ATOM 361 CG2 ILE A 238 -0.222 0.150 0.175 1.00 0.00 C ATOM 362 CD1 ILE A 238 -1.394 -2.621 0.795 1.00 0.00 C ATOM 0 H ILE A 238 2.275 -2.878 0.851 1.00 0.00 H new ATOM 0 HA ILE A 238 0.324 -2.334 -1.066 1.00 0.00 H new ATOM 0 HB ILE A 238 1.438 -0.673 1.230 1.00 0.00 H new ATOM 0 HG12 ILE A 238 0.396 -2.735 1.951 1.00 0.00 H new ATOM 0 HG13 ILE A 238 -0.642 -1.384 2.363 1.00 0.00 H new ATOM 0 HG21 ILE A 238 -0.604 0.691 1.041 1.00 0.00 H new ATOM 0 HG22 ILE A 238 0.407 0.813 -0.419 1.00 0.00 H new ATOM 0 HG23 ILE A 238 -1.058 -0.198 -0.432 1.00 0.00 H new ATOM 0 HD11 ILE A 238 -1.948 -3.258 1.485 1.00 0.00 H new ATOM 0 HD12 ILE A 238 -2.058 -1.855 0.395 1.00 0.00 H new ATOM 0 HD13 ILE A 238 -1.004 -3.226 -0.023 1.00 0.00 H new ATOM 374 N GLN A 239 2.870 -0.198 -1.090 1.00 0.00 N ATOM 375 CA GLN A 239 3.583 0.766 -1.920 1.00 0.00 C ATOM 376 C GLN A 239 3.756 0.238 -3.341 1.00 0.00 C ATOM 377 O GLN A 239 3.346 0.883 -4.306 1.00 0.00 O ATOM 378 CB GLN A 239 4.950 1.082 -1.311 1.00 0.00 C ATOM 379 CG GLN A 239 5.664 2.242 -1.987 1.00 0.00 C ATOM 380 CD GLN A 239 7.139 2.300 -1.642 1.00 0.00 C ATOM 381 OE1 GLN A 239 7.981 1.788 -2.380 1.00 0.00 O ATOM 382 NE2 GLN A 239 7.460 2.927 -0.516 1.00 0.00 N ATOM 0 H GLN A 239 3.265 -0.327 -0.159 1.00 0.00 H new ATOM 0 HA GLN A 239 2.991 1.680 -1.961 1.00 0.00 H new ATOM 0 HB2 GLN A 239 4.823 1.311 -0.253 1.00 0.00 H new ATOM 0 HB3 GLN A 239 5.579 0.194 -1.371 1.00 0.00 H new ATOM 0 HG2 GLN A 239 5.551 2.153 -3.067 1.00 0.00 H new ATOM 0 HG3 GLN A 239 5.189 3.178 -1.692 1.00 0.00 H new ATOM 0 HE21 GLN A 239 6.729 3.337 0.066 1.00 0.00 H new ATOM 0 HE22 GLN A 239 8.437 2.999 -0.233 1.00 0.00 H new ATOM 391 N GLU A 240 4.365 -0.937 -3.461 1.00 0.00 N ATOM 392 CA GLU A 240 4.592 -1.550 -4.764 1.00 0.00 C ATOM 393 C GLU A 240 3.269 -1.880 -5.449 1.00 0.00 C ATOM 394 O GLU A 240 2.987 -1.397 -6.546 1.00 0.00 O ATOM 395 CB GLU A 240 5.433 -2.820 -4.616 1.00 0.00 C ATOM 396 CG GLU A 240 6.211 -3.184 -5.869 1.00 0.00 C ATOM 397 CD GLU A 240 7.304 -4.201 -5.602 1.00 0.00 C ATOM 398 OE1 GLU A 240 7.081 -5.109 -4.775 1.00 0.00 O ATOM 399 OE2 GLU A 240 8.383 -4.088 -6.220 1.00 0.00 O ATOM 0 H GLU A 240 4.710 -1.483 -2.672 1.00 0.00 H new ATOM 0 HA GLU A 240 5.133 -0.835 -5.383 1.00 0.00 H new ATOM 0 HB2 GLU A 240 6.132 -2.689 -3.790 1.00 0.00 H new ATOM 0 HB3 GLU A 240 4.778 -3.650 -4.351 1.00 0.00 H new ATOM 0 HG2 GLU A 240 5.524 -3.582 -6.616 1.00 0.00 H new ATOM 0 HG3 GLU A 240 6.654 -2.282 -6.292 1.00 0.00 H new ATOM 406 N THR A 241 2.460 -2.706 -4.793 1.00 0.00 N ATOM 407 CA THR A 241 1.167 -3.102 -5.337 1.00 0.00 C ATOM 408 C THR A 241 0.469 -1.925 -6.008 1.00 0.00 C ATOM 409 O THR A 241 0.012 -2.027 -7.146 1.00 0.00 O ATOM 410 CB THR A 241 0.247 -3.674 -4.242 1.00 0.00 C ATOM 411 OG1 THR A 241 0.813 -4.874 -3.704 1.00 0.00 O ATOM 412 CG2 THR A 241 -1.139 -3.965 -4.796 1.00 0.00 C ATOM 0 H THR A 241 2.678 -3.114 -3.884 1.00 0.00 H new ATOM 0 HA THR A 241 1.361 -3.877 -6.079 1.00 0.00 H new ATOM 0 HB THR A 241 0.155 -2.930 -3.451 1.00 0.00 H new ATOM 0 HG1 THR A 241 1.333 -4.659 -2.902 1.00 0.00 H new ATOM 0 HG21 THR A 241 -1.770 -4.368 -4.004 1.00 0.00 H new ATOM 0 HG22 THR A 241 -1.579 -3.044 -5.177 1.00 0.00 H new ATOM 0 HG23 THR A 241 -1.062 -4.692 -5.604 1.00 0.00 H new ATOM 420 N PHE A 242 0.389 -0.806 -5.295 1.00 0.00 N ATOM 421 CA PHE A 242 -0.254 0.392 -5.822 1.00 0.00 C ATOM 422 C PHE A 242 0.608 1.044 -6.899 1.00 0.00 C ATOM 423 O PHE A 242 0.122 1.378 -7.980 1.00 0.00 O ATOM 424 CB PHE A 242 -0.522 1.391 -4.694 1.00 0.00 C ATOM 425 CG PHE A 242 -1.762 1.084 -3.904 1.00 0.00 C ATOM 426 CD1 PHE A 242 -1.786 0.026 -3.010 1.00 0.00 C ATOM 427 CD2 PHE A 242 -2.904 1.854 -4.055 1.00 0.00 C ATOM 428 CE1 PHE A 242 -2.925 -0.259 -2.281 1.00 0.00 C ATOM 429 CE2 PHE A 242 -4.046 1.575 -3.328 1.00 0.00 C ATOM 430 CZ PHE A 242 -4.057 0.516 -2.441 1.00 0.00 C ATOM 0 H PHE A 242 0.761 -0.704 -4.351 1.00 0.00 H new ATOM 0 HA PHE A 242 -1.203 0.097 -6.270 1.00 0.00 H new ATOM 0 HB2 PHE A 242 0.335 1.404 -4.020 1.00 0.00 H new ATOM 0 HB3 PHE A 242 -0.609 2.391 -5.118 1.00 0.00 H new ATOM 0 HD1 PHE A 242 -0.904 -0.584 -2.881 1.00 0.00 H new ATOM 0 HD2 PHE A 242 -2.902 2.682 -4.749 1.00 0.00 H new ATOM 0 HE1 PHE A 242 -2.930 -1.087 -1.587 1.00 0.00 H new ATOM 0 HE2 PHE A 242 -4.929 2.184 -3.453 1.00 0.00 H new ATOM 0 HZ PHE A 242 -4.949 0.295 -1.874 1.00 0.00 H new ATOM 440 N SER A 243 1.890 1.222 -6.596 1.00 0.00 N ATOM 441 CA SER A 243 2.819 1.837 -7.535 1.00 0.00 C ATOM 442 C SER A 243 2.714 1.185 -8.910 1.00 0.00 C ATOM 443 O SER A 243 2.880 1.844 -9.937 1.00 0.00 O ATOM 444 CB SER A 243 4.253 1.725 -7.014 1.00 0.00 C ATOM 445 OG SER A 243 5.143 2.500 -7.798 1.00 0.00 O ATOM 0 H SER A 243 2.308 0.949 -5.707 1.00 0.00 H new ATOM 0 HA SER A 243 2.555 2.890 -7.630 1.00 0.00 H new ATOM 0 HB2 SER A 243 4.293 2.058 -5.977 1.00 0.00 H new ATOM 0 HB3 SER A 243 4.567 0.681 -7.026 1.00 0.00 H new ATOM 0 HG SER A 243 6.052 2.412 -7.443 1.00 0.00 H new ATOM 451 N ARG A 244 2.436 -0.115 -8.922 1.00 0.00 N ATOM 452 CA ARG A 244 2.309 -0.858 -10.169 1.00 0.00 C ATOM 453 C ARG A 244 1.504 -0.066 -11.195 1.00 0.00 C ATOM 454 O ARG A 244 1.819 -0.070 -12.385 1.00 0.00 O ATOM 455 CB ARG A 244 1.642 -2.211 -9.916 1.00 0.00 C ATOM 456 CG ARG A 244 2.576 -3.248 -9.314 1.00 0.00 C ATOM 457 CD ARG A 244 3.443 -3.902 -10.378 1.00 0.00 C ATOM 458 NE ARG A 244 4.667 -3.145 -10.628 1.00 0.00 N ATOM 459 CZ ARG A 244 5.500 -3.404 -11.629 1.00 0.00 C ATOM 460 NH1 ARG A 244 5.242 -4.396 -12.470 1.00 0.00 N ATOM 461 NH2 ARG A 244 6.593 -2.670 -11.791 1.00 0.00 N ATOM 0 H ARG A 244 2.294 -0.675 -8.081 1.00 0.00 H new ATOM 0 HA ARG A 244 3.310 -1.023 -10.567 1.00 0.00 H new ATOM 0 HB2 ARG A 244 0.793 -2.068 -9.248 1.00 0.00 H new ATOM 0 HB3 ARG A 244 1.247 -2.593 -10.857 1.00 0.00 H new ATOM 0 HG2 ARG A 244 3.212 -2.775 -8.565 1.00 0.00 H new ATOM 0 HG3 ARG A 244 1.991 -4.011 -8.800 1.00 0.00 H new ATOM 0 HD2 ARG A 244 3.700 -4.914 -10.065 1.00 0.00 H new ATOM 0 HD3 ARG A 244 2.875 -3.990 -11.304 1.00 0.00 H new ATOM 0 HE ARG A 244 4.894 -2.375 -9.999 1.00 0.00 H new ATOM 0 HH11 ARG A 244 4.402 -4.962 -12.349 1.00 0.00 H new ATOM 0 HH12 ARG A 244 5.883 -4.593 -13.238 1.00 0.00 H new ATOM 0 HH21 ARG A 244 6.794 -1.906 -11.146 1.00 0.00 H new ATOM 0 HH22 ARG A 244 7.232 -2.870 -12.560 1.00 0.00 H new ATOM 475 N PHE A 245 0.462 0.613 -10.725 1.00 0.00 N ATOM 476 CA PHE A 245 -0.390 1.409 -11.601 1.00 0.00 C ATOM 477 C PHE A 245 0.340 2.662 -12.077 1.00 0.00 C ATOM 478 O PHE A 245 0.362 2.966 -13.268 1.00 0.00 O ATOM 479 CB PHE A 245 -1.679 1.800 -10.876 1.00 0.00 C ATOM 480 CG PHE A 245 -2.633 0.654 -10.691 1.00 0.00 C ATOM 481 CD1 PHE A 245 -2.464 -0.244 -9.649 1.00 0.00 C ATOM 482 CD2 PHE A 245 -3.699 0.476 -11.558 1.00 0.00 C ATOM 483 CE1 PHE A 245 -3.340 -1.299 -9.477 1.00 0.00 C ATOM 484 CE2 PHE A 245 -4.579 -0.577 -11.391 1.00 0.00 C ATOM 485 CZ PHE A 245 -4.399 -1.465 -10.348 1.00 0.00 C ATOM 0 H PHE A 245 0.188 0.628 -9.743 1.00 0.00 H new ATOM 0 HA PHE A 245 -0.641 0.803 -12.472 1.00 0.00 H new ATOM 0 HB2 PHE A 245 -1.426 2.213 -9.900 1.00 0.00 H new ATOM 0 HB3 PHE A 245 -2.177 2.590 -11.438 1.00 0.00 H new ATOM 0 HD1 PHE A 245 -1.639 -0.118 -8.964 1.00 0.00 H new ATOM 0 HD2 PHE A 245 -3.844 1.168 -12.374 1.00 0.00 H new ATOM 0 HE1 PHE A 245 -3.197 -1.993 -8.662 1.00 0.00 H new ATOM 0 HE2 PHE A 245 -5.405 -0.705 -12.074 1.00 0.00 H new ATOM 0 HZ PHE A 245 -5.085 -2.288 -10.214 1.00 0.00 H new ATOM 495 N GLY A 246 0.935 3.387 -11.134 1.00 0.00 N ATOM 496 CA GLY A 246 1.656 4.599 -11.475 1.00 0.00 C ATOM 497 C GLY A 246 2.660 4.996 -10.411 1.00 0.00 C ATOM 498 O GLY A 246 2.665 4.437 -9.314 1.00 0.00 O ATOM 0 H GLY A 246 0.930 3.156 -10.140 1.00 0.00 H new ATOM 0 HA2 GLY A 246 2.174 4.455 -12.423 1.00 0.00 H new ATOM 0 HA3 GLY A 246 0.945 5.412 -11.620 1.00 0.00 H new ATOM 502 N SER A 247 3.513 5.962 -10.735 1.00 0.00 N ATOM 503 CA SER A 247 4.530 6.429 -9.800 1.00 0.00 C ATOM 504 C SER A 247 3.888 7.009 -8.544 1.00 0.00 C ATOM 505 O SER A 247 3.076 7.933 -8.617 1.00 0.00 O ATOM 506 CB SER A 247 5.420 7.481 -10.464 1.00 0.00 C ATOM 507 OG SER A 247 6.022 6.970 -11.641 1.00 0.00 O ATOM 0 H SER A 247 3.520 6.437 -11.638 1.00 0.00 H new ATOM 0 HA SER A 247 5.143 5.575 -9.512 1.00 0.00 H new ATOM 0 HB2 SER A 247 4.827 8.362 -10.708 1.00 0.00 H new ATOM 0 HB3 SER A 247 6.193 7.801 -9.766 1.00 0.00 H new ATOM 0 HG SER A 247 6.584 7.662 -12.048 1.00 0.00 H new ATOM 513 N LEU A 248 4.256 6.461 -7.391 1.00 0.00 N ATOM 514 CA LEU A 248 3.717 6.924 -6.117 1.00 0.00 C ATOM 515 C LEU A 248 4.637 7.959 -5.479 1.00 0.00 C ATOM 516 O LEU A 248 5.800 8.088 -5.859 1.00 0.00 O ATOM 517 CB LEU A 248 3.522 5.743 -5.164 1.00 0.00 C ATOM 518 CG LEU A 248 2.235 4.938 -5.348 1.00 0.00 C ATOM 519 CD1 LEU A 248 2.223 3.732 -4.421 1.00 0.00 C ATOM 520 CD2 LEU A 248 1.017 5.816 -5.099 1.00 0.00 C ATOM 0 H LEU A 248 4.925 5.695 -7.312 1.00 0.00 H new ATOM 0 HA LEU A 248 2.752 7.393 -6.309 1.00 0.00 H new ATOM 0 HB2 LEU A 248 4.369 5.067 -5.277 1.00 0.00 H new ATOM 0 HB3 LEU A 248 3.549 6.119 -4.141 1.00 0.00 H new ATOM 0 HG LEU A 248 2.196 4.580 -6.377 1.00 0.00 H new ATOM 0 HD11 LEU A 248 1.300 3.171 -4.566 1.00 0.00 H new ATOM 0 HD12 LEU A 248 3.076 3.092 -4.646 1.00 0.00 H new ATOM 0 HD13 LEU A 248 2.285 4.068 -3.386 1.00 0.00 H new ATOM 0 HD21 LEU A 248 0.110 5.227 -5.234 1.00 0.00 H new ATOM 0 HD22 LEU A 248 1.050 6.203 -4.081 1.00 0.00 H new ATOM 0 HD23 LEU A 248 1.018 6.648 -5.804 1.00 0.00 H new ATOM 532 N GLY A 249 4.108 8.695 -4.506 1.00 0.00 N ATOM 533 CA GLY A 249 4.897 9.708 -3.830 1.00 0.00 C ATOM 534 C GLY A 249 5.236 9.323 -2.404 1.00 0.00 C ATOM 535 O GLY A 249 6.359 8.909 -2.116 1.00 0.00 O ATOM 0 H GLY A 249 3.147 8.608 -4.174 1.00 0.00 H new ATOM 0 HA2 GLY A 249 5.819 9.877 -4.386 1.00 0.00 H new ATOM 0 HA3 GLY A 249 4.349 10.650 -3.828 1.00 0.00 H new ATOM 539 N ARG A 250 4.263 9.461 -1.508 1.00 0.00 N ATOM 540 CA ARG A 250 4.465 9.127 -0.104 1.00 0.00 C ATOM 541 C ARG A 250 3.627 7.915 0.293 1.00 0.00 C ATOM 542 O ARG A 250 2.530 7.709 -0.225 1.00 0.00 O ATOM 543 CB ARG A 250 4.107 10.321 0.783 1.00 0.00 C ATOM 544 CG ARG A 250 5.173 11.404 0.807 1.00 0.00 C ATOM 545 CD ARG A 250 6.459 10.906 1.447 1.00 0.00 C ATOM 546 NE ARG A 250 7.339 10.259 0.478 1.00 0.00 N ATOM 547 CZ ARG A 250 8.554 9.812 0.772 1.00 0.00 C ATOM 548 NH1 ARG A 250 9.031 9.940 2.003 1.00 0.00 N ATOM 549 NH2 ARG A 250 9.295 9.235 -0.165 1.00 0.00 N ATOM 0 H ARG A 250 3.328 9.802 -1.730 1.00 0.00 H new ATOM 0 HA ARG A 250 5.517 8.881 0.037 1.00 0.00 H new ATOM 0 HB2 ARG A 250 3.169 10.754 0.434 1.00 0.00 H new ATOM 0 HB3 ARG A 250 3.936 9.969 1.800 1.00 0.00 H new ATOM 0 HG2 ARG A 250 5.377 11.738 -0.210 1.00 0.00 H new ATOM 0 HG3 ARG A 250 4.802 12.269 1.358 1.00 0.00 H new ATOM 0 HD2 ARG A 250 6.982 11.744 1.908 1.00 0.00 H new ATOM 0 HD3 ARG A 250 6.218 10.202 2.244 1.00 0.00 H new ATOM 0 HE ARG A 250 7.002 10.144 -0.478 1.00 0.00 H new ATOM 0 HH11 ARG A 250 8.464 10.383 2.726 1.00 0.00 H new ATOM 0 HH12 ARG A 250 9.965 9.596 2.226 1.00 0.00 H new ATOM 0 HH21 ARG A 250 8.931 9.134 -1.113 1.00 0.00 H new ATOM 0 HH22 ARG A 250 10.228 8.892 0.062 1.00 0.00 H new ATOM 563 N VAL A 251 4.153 7.115 1.215 1.00 0.00 N ATOM 564 CA VAL A 251 3.453 5.924 1.682 1.00 0.00 C ATOM 565 C VAL A 251 3.686 5.698 3.172 1.00 0.00 C ATOM 566 O VAL A 251 4.827 5.614 3.628 1.00 0.00 O ATOM 567 CB VAL A 251 3.902 4.670 0.908 1.00 0.00 C ATOM 568 CG1 VAL A 251 3.300 3.417 1.526 1.00 0.00 C ATOM 569 CG2 VAL A 251 3.522 4.786 -0.560 1.00 0.00 C ATOM 0 H VAL A 251 5.061 7.270 1.653 1.00 0.00 H new ATOM 0 HA VAL A 251 2.391 6.091 1.505 1.00 0.00 H new ATOM 0 HB VAL A 251 4.987 4.593 0.974 1.00 0.00 H new ATOM 0 HG11 VAL A 251 3.628 2.541 0.966 1.00 0.00 H new ATOM 0 HG12 VAL A 251 3.627 3.329 2.562 1.00 0.00 H new ATOM 0 HG13 VAL A 251 2.212 3.482 1.493 1.00 0.00 H new ATOM 0 HG21 VAL A 251 3.847 3.892 -1.092 1.00 0.00 H new ATOM 0 HG22 VAL A 251 2.440 4.888 -0.649 1.00 0.00 H new ATOM 0 HG23 VAL A 251 4.006 5.661 -0.993 1.00 0.00 H new ATOM 579 N LEU A 252 2.597 5.600 3.927 1.00 0.00 N ATOM 580 CA LEU A 252 2.682 5.383 5.367 1.00 0.00 C ATOM 581 C LEU A 252 1.730 4.275 5.807 1.00 0.00 C ATOM 582 O LEU A 252 0.515 4.470 5.860 1.00 0.00 O ATOM 583 CB LEU A 252 2.359 6.677 6.117 1.00 0.00 C ATOM 584 CG LEU A 252 3.274 7.867 5.828 1.00 0.00 C ATOM 585 CD1 LEU A 252 2.655 9.155 6.347 1.00 0.00 C ATOM 586 CD2 LEU A 252 4.647 7.646 6.446 1.00 0.00 C ATOM 0 H LEU A 252 1.645 5.667 3.566 1.00 0.00 H new ATOM 0 HA LEU A 252 3.701 5.077 5.605 1.00 0.00 H new ATOM 0 HB2 LEU A 252 1.335 6.965 5.879 1.00 0.00 H new ATOM 0 HB3 LEU A 252 2.391 6.471 7.187 1.00 0.00 H new ATOM 0 HG LEU A 252 3.393 7.955 4.748 1.00 0.00 H new ATOM 0 HD11 LEU A 252 3.321 9.991 6.132 1.00 0.00 H new ATOM 0 HD12 LEU A 252 1.695 9.320 5.858 1.00 0.00 H new ATOM 0 HD13 LEU A 252 2.505 9.078 7.424 1.00 0.00 H new ATOM 0 HD21 LEU A 252 5.285 8.503 6.230 1.00 0.00 H new ATOM 0 HD22 LEU A 252 4.546 7.531 7.525 1.00 0.00 H new ATOM 0 HD23 LEU A 252 5.095 6.745 6.026 1.00 0.00 H new ATOM 598 N LEU A 253 2.291 3.114 6.126 1.00 0.00 N ATOM 599 CA LEU A 253 1.493 1.974 6.565 1.00 0.00 C ATOM 600 C LEU A 253 1.973 1.462 7.919 1.00 0.00 C ATOM 601 O LEU A 253 2.943 0.710 8.017 1.00 0.00 O ATOM 602 CB LEU A 253 1.559 0.851 5.529 1.00 0.00 C ATOM 603 CG LEU A 253 1.145 -0.538 6.017 1.00 0.00 C ATOM 604 CD1 LEU A 253 -0.157 -0.463 6.800 1.00 0.00 C ATOM 605 CD2 LEU A 253 1.010 -1.498 4.844 1.00 0.00 C ATOM 0 H LEU A 253 3.295 2.937 6.089 1.00 0.00 H new ATOM 0 HA LEU A 253 0.459 2.304 6.668 1.00 0.00 H new ATOM 0 HB2 LEU A 253 0.923 1.123 4.687 1.00 0.00 H new ATOM 0 HB3 LEU A 253 2.580 0.792 5.151 1.00 0.00 H new ATOM 0 HG LEU A 253 1.923 -0.915 6.681 1.00 0.00 H new ATOM 0 HD11 LEU A 253 -0.436 -1.461 7.139 1.00 0.00 H new ATOM 0 HD12 LEU A 253 -0.026 0.190 7.663 1.00 0.00 H new ATOM 0 HD13 LEU A 253 -0.944 -0.064 6.160 1.00 0.00 H new ATOM 0 HD21 LEU A 253 0.715 -2.481 5.211 1.00 0.00 H new ATOM 0 HD22 LEU A 253 0.253 -1.125 4.154 1.00 0.00 H new ATOM 0 HD23 LEU A 253 1.966 -1.576 4.326 1.00 0.00 H new ATOM 617 N PRO A 254 1.279 1.877 8.989 1.00 0.00 N ATOM 618 CA PRO A 254 1.615 1.470 10.357 1.00 0.00 C ATOM 619 C PRO A 254 1.318 -0.003 10.613 1.00 0.00 C ATOM 620 O PRO A 254 0.393 -0.569 10.032 1.00 0.00 O ATOM 621 CB PRO A 254 0.714 2.356 11.221 1.00 0.00 C ATOM 622 CG PRO A 254 -0.440 2.695 10.342 1.00 0.00 C ATOM 623 CD PRO A 254 0.113 2.774 8.946 1.00 0.00 C ATOM 0 HA PRO A 254 2.678 1.585 10.568 1.00 0.00 H new ATOM 0 HB2 PRO A 254 0.387 1.832 12.119 1.00 0.00 H new ATOM 0 HB3 PRO A 254 1.239 3.253 11.549 1.00 0.00 H new ATOM 0 HG2 PRO A 254 -1.219 1.936 10.411 1.00 0.00 H new ATOM 0 HG3 PRO A 254 -0.891 3.642 10.638 1.00 0.00 H new ATOM 0 HD2 PRO A 254 -0.617 2.448 8.206 1.00 0.00 H new ATOM 0 HD3 PRO A 254 0.399 3.793 8.684 1.00 0.00 H new ATOM 631 N GLU A 255 2.109 -0.619 11.486 1.00 0.00 N ATOM 632 CA GLU A 255 1.930 -2.027 11.818 1.00 0.00 C ATOM 633 C GLU A 255 0.757 -2.215 12.776 1.00 0.00 C ATOM 634 O GLU A 255 -0.072 -3.106 12.594 1.00 0.00 O ATOM 635 CB GLU A 255 3.207 -2.594 12.440 1.00 0.00 C ATOM 636 CG GLU A 255 3.598 -1.923 13.746 1.00 0.00 C ATOM 637 CD GLU A 255 4.891 -2.471 14.320 1.00 0.00 C ATOM 638 OE1 GLU A 255 5.967 -2.141 13.779 1.00 0.00 O ATOM 639 OE2 GLU A 255 4.825 -3.229 15.310 1.00 0.00 O ATOM 0 H GLU A 255 2.880 -0.165 11.976 1.00 0.00 H new ATOM 0 HA GLU A 255 1.714 -2.567 10.896 1.00 0.00 H new ATOM 0 HB2 GLU A 255 3.073 -3.661 12.616 1.00 0.00 H new ATOM 0 HB3 GLU A 255 4.026 -2.489 11.728 1.00 0.00 H new ATOM 0 HG2 GLU A 255 3.704 -0.851 13.582 1.00 0.00 H new ATOM 0 HG3 GLU A 255 2.797 -2.057 14.473 1.00 0.00 H new ATOM 646 N GLY A 256 0.696 -1.369 13.800 1.00 0.00 N ATOM 647 CA GLY A 256 -0.378 -1.458 14.773 1.00 0.00 C ATOM 648 C GLY A 256 -1.749 -1.376 14.132 1.00 0.00 C ATOM 649 O GLY A 256 -2.712 -1.954 14.634 1.00 0.00 O ATOM 0 H GLY A 256 1.371 -0.624 13.973 1.00 0.00 H new ATOM 0 HA2 GLY A 256 -0.292 -2.397 15.320 1.00 0.00 H new ATOM 0 HA3 GLY A 256 -0.272 -0.654 15.501 1.00 0.00 H new ATOM 653 N GLY A 257 -1.839 -0.654 13.020 1.00 0.00 N ATOM 654 CA GLY A 257 -3.107 -0.510 12.329 1.00 0.00 C ATOM 655 C GLY A 257 -3.037 -0.971 10.887 1.00 0.00 C ATOM 656 O GLY A 257 -2.321 -0.386 10.075 1.00 0.00 O ATOM 0 H GLY A 257 -1.056 -0.166 12.585 1.00 0.00 H new ATOM 0 HA2 GLY A 257 -3.871 -1.084 12.854 1.00 0.00 H new ATOM 0 HA3 GLY A 257 -3.417 0.535 12.359 1.00 0.00 H new ATOM 660 N ILE A 258 -3.782 -2.025 10.568 1.00 0.00 N ATOM 661 CA ILE A 258 -3.801 -2.564 9.214 1.00 0.00 C ATOM 662 C ILE A 258 -3.941 -1.452 8.181 1.00 0.00 C ATOM 663 O ILE A 258 -3.481 -1.580 7.046 1.00 0.00 O ATOM 664 CB ILE A 258 -4.950 -3.572 9.026 1.00 0.00 C ATOM 665 CG1 ILE A 258 -6.273 -2.963 9.493 1.00 0.00 C ATOM 666 CG2 ILE A 258 -4.656 -4.858 9.783 1.00 0.00 C ATOM 667 CD1 ILE A 258 -7.476 -3.834 9.201 1.00 0.00 C ATOM 0 H ILE A 258 -4.380 -2.522 11.229 1.00 0.00 H new ATOM 0 HA ILE A 258 -2.851 -3.077 9.065 1.00 0.00 H new ATOM 0 HB ILE A 258 -5.035 -3.809 7.966 1.00 0.00 H new ATOM 0 HG12 ILE A 258 -6.220 -2.779 10.566 1.00 0.00 H new ATOM 0 HG13 ILE A 258 -6.409 -1.996 9.010 1.00 0.00 H new ATOM 0 HG21 ILE A 258 -5.477 -5.560 9.640 1.00 0.00 H new ATOM 0 HG22 ILE A 258 -3.733 -5.298 9.407 1.00 0.00 H new ATOM 0 HG23 ILE A 258 -4.547 -4.638 10.845 1.00 0.00 H new ATOM 0 HD11 ILE A 258 -8.379 -3.339 9.559 1.00 0.00 H new ATOM 0 HD12 ILE A 258 -7.554 -3.998 8.126 1.00 0.00 H new ATOM 0 HD13 ILE A 258 -7.362 -4.793 9.707 1.00 0.00 H new ATOM 679 N THR A 259 -4.580 -0.356 8.581 1.00 0.00 N ATOM 680 CA THR A 259 -4.780 0.780 7.691 1.00 0.00 C ATOM 681 C THR A 259 -3.474 1.193 7.024 1.00 0.00 C ATOM 682 O THR A 259 -2.419 1.204 7.657 1.00 0.00 O ATOM 683 CB THR A 259 -5.363 1.990 8.447 1.00 0.00 C ATOM 684 OG1 THR A 259 -4.445 2.424 9.456 1.00 0.00 O ATOM 685 CG2 THR A 259 -6.698 1.637 9.085 1.00 0.00 C ATOM 0 H THR A 259 -4.968 -0.232 9.516 1.00 0.00 H new ATOM 0 HA THR A 259 -5.489 0.462 6.927 1.00 0.00 H new ATOM 0 HB THR A 259 -5.523 2.796 7.731 1.00 0.00 H new ATOM 0 HG1 THR A 259 -4.821 3.194 9.931 1.00 0.00 H new ATOM 0 HG21 THR A 259 -7.090 2.506 9.613 1.00 0.00 H new ATOM 0 HG22 THR A 259 -7.403 1.334 8.310 1.00 0.00 H new ATOM 0 HG23 THR A 259 -6.559 0.817 9.789 1.00 0.00 H new ATOM 693 N ALA A 260 -3.551 1.534 5.741 1.00 0.00 N ATOM 694 CA ALA A 260 -2.375 1.951 4.989 1.00 0.00 C ATOM 695 C ALA A 260 -2.648 3.232 4.209 1.00 0.00 C ATOM 696 O ALA A 260 -3.587 3.299 3.415 1.00 0.00 O ATOM 697 CB ALA A 260 -1.930 0.842 4.047 1.00 0.00 C ATOM 0 H ALA A 260 -4.417 1.529 5.201 1.00 0.00 H new ATOM 0 HA ALA A 260 -1.573 2.153 5.699 1.00 0.00 H new ATOM 0 HB1 ALA A 260 -1.050 1.168 3.492 1.00 0.00 H new ATOM 0 HB2 ALA A 260 -1.685 -0.049 4.624 1.00 0.00 H new ATOM 0 HB3 ALA A 260 -2.735 0.612 3.349 1.00 0.00 H new ATOM 703 N ILE A 261 -1.821 4.247 4.439 1.00 0.00 N ATOM 704 CA ILE A 261 -1.974 5.526 3.757 1.00 0.00 C ATOM 705 C ILE A 261 -1.063 5.611 2.537 1.00 0.00 C ATOM 706 O ILE A 261 0.139 5.362 2.628 1.00 0.00 O ATOM 707 CB ILE A 261 -1.666 6.706 4.698 1.00 0.00 C ATOM 708 CG1 ILE A 261 -2.510 6.607 5.970 1.00 0.00 C ATOM 709 CG2 ILE A 261 -1.919 8.028 3.989 1.00 0.00 C ATOM 710 CD1 ILE A 261 -1.851 7.227 7.182 1.00 0.00 C ATOM 0 H ILE A 261 -1.039 4.208 5.092 1.00 0.00 H new ATOM 0 HA ILE A 261 -3.014 5.590 3.436 1.00 0.00 H new ATOM 0 HB ILE A 261 -0.614 6.662 4.979 1.00 0.00 H new ATOM 0 HG12 ILE A 261 -3.469 7.095 5.799 1.00 0.00 H new ATOM 0 HG13 ILE A 261 -2.719 5.557 6.177 1.00 0.00 H new ATOM 0 HG21 ILE A 261 -1.697 8.853 4.666 1.00 0.00 H new ATOM 0 HG22 ILE A 261 -1.278 8.098 3.110 1.00 0.00 H new ATOM 0 HG23 ILE A 261 -2.963 8.082 3.682 1.00 0.00 H new ATOM 0 HD11 ILE A 261 -2.506 7.120 8.047 1.00 0.00 H new ATOM 0 HD12 ILE A 261 -0.905 6.723 7.379 1.00 0.00 H new ATOM 0 HD13 ILE A 261 -1.667 8.285 6.995 1.00 0.00 H new ATOM 722 N VAL A 262 -1.644 5.966 1.396 1.00 0.00 N ATOM 723 CA VAL A 262 -0.884 6.087 0.157 1.00 0.00 C ATOM 724 C VAL A 262 -1.097 7.453 -0.487 1.00 0.00 C ATOM 725 O VAL A 262 -2.207 7.982 -0.490 1.00 0.00 O ATOM 726 CB VAL A 262 -1.276 4.990 -0.851 1.00 0.00 C ATOM 727 CG1 VAL A 262 -0.506 5.161 -2.152 1.00 0.00 C ATOM 728 CG2 VAL A 262 -1.037 3.611 -0.257 1.00 0.00 C ATOM 0 H VAL A 262 -2.638 6.175 1.303 1.00 0.00 H new ATOM 0 HA VAL A 262 0.168 5.971 0.418 1.00 0.00 H new ATOM 0 HB VAL A 262 -2.339 5.086 -1.071 1.00 0.00 H new ATOM 0 HG11 VAL A 262 -0.796 4.377 -2.852 1.00 0.00 H new ATOM 0 HG12 VAL A 262 -0.733 6.136 -2.584 1.00 0.00 H new ATOM 0 HG13 VAL A 262 0.564 5.093 -1.953 1.00 0.00 H new ATOM 0 HG21 VAL A 262 -1.319 2.848 -0.983 1.00 0.00 H new ATOM 0 HG22 VAL A 262 0.018 3.501 -0.006 1.00 0.00 H new ATOM 0 HG23 VAL A 262 -1.638 3.494 0.645 1.00 0.00 H new ATOM 738 N GLU A 263 -0.023 8.018 -1.030 1.00 0.00 N ATOM 739 CA GLU A 263 -0.092 9.323 -1.677 1.00 0.00 C ATOM 740 C GLU A 263 0.472 9.259 -3.093 1.00 0.00 C ATOM 741 O GLU A 263 1.672 9.065 -3.288 1.00 0.00 O ATOM 742 CB GLU A 263 0.673 10.364 -0.858 1.00 0.00 C ATOM 743 CG GLU A 263 0.803 11.710 -1.552 1.00 0.00 C ATOM 744 CD GLU A 263 1.588 12.715 -0.732 1.00 0.00 C ATOM 745 OE1 GLU A 263 1.017 13.273 0.229 1.00 0.00 O ATOM 746 OE2 GLU A 263 2.773 12.945 -1.052 1.00 0.00 O ATOM 0 H GLU A 263 0.904 7.593 -1.035 1.00 0.00 H new ATOM 0 HA GLU A 263 -1.140 9.616 -1.735 1.00 0.00 H new ATOM 0 HB2 GLU A 263 0.168 10.505 0.098 1.00 0.00 H new ATOM 0 HB3 GLU A 263 1.669 9.980 -0.638 1.00 0.00 H new ATOM 0 HG2 GLU A 263 1.292 11.572 -2.516 1.00 0.00 H new ATOM 0 HG3 GLU A 263 -0.191 12.108 -1.753 1.00 0.00 H new ATOM 753 N PHE A 264 -0.403 9.424 -4.080 1.00 0.00 N ATOM 754 CA PHE A 264 0.006 9.383 -5.479 1.00 0.00 C ATOM 755 C PHE A 264 0.595 10.723 -5.912 1.00 0.00 C ATOM 756 O PHE A 264 0.236 11.774 -5.379 1.00 0.00 O ATOM 757 CB PHE A 264 -1.185 9.025 -6.371 1.00 0.00 C ATOM 758 CG PHE A 264 -1.442 7.548 -6.462 1.00 0.00 C ATOM 759 CD1 PHE A 264 -2.094 6.880 -5.437 1.00 0.00 C ATOM 760 CD2 PHE A 264 -1.033 6.827 -7.572 1.00 0.00 C ATOM 761 CE1 PHE A 264 -2.331 5.521 -5.518 1.00 0.00 C ATOM 762 CE2 PHE A 264 -1.267 5.468 -7.659 1.00 0.00 C ATOM 763 CZ PHE A 264 -1.918 4.814 -6.631 1.00 0.00 C ATOM 0 H PHE A 264 -1.400 9.587 -3.937 1.00 0.00 H new ATOM 0 HA PHE A 264 0.774 8.616 -5.585 1.00 0.00 H new ATOM 0 HB2 PHE A 264 -2.078 9.518 -5.987 1.00 0.00 H new ATOM 0 HB3 PHE A 264 -1.010 9.418 -7.373 1.00 0.00 H new ATOM 0 HD1 PHE A 264 -2.420 7.428 -4.565 1.00 0.00 H new ATOM 0 HD2 PHE A 264 -0.525 7.333 -8.379 1.00 0.00 H new ATOM 0 HE1 PHE A 264 -2.839 5.012 -4.712 1.00 0.00 H new ATOM 0 HE2 PHE A 264 -0.941 4.918 -8.529 1.00 0.00 H new ATOM 0 HZ PHE A 264 -2.104 3.752 -6.697 1.00 0.00 H new ATOM 773 N LEU A 265 1.502 10.677 -6.882 1.00 0.00 N ATOM 774 CA LEU A 265 2.142 11.887 -7.388 1.00 0.00 C ATOM 775 C LEU A 265 1.285 12.549 -8.461 1.00 0.00 C ATOM 776 O LEU A 265 1.600 13.640 -8.935 1.00 0.00 O ATOM 777 CB LEU A 265 3.524 11.557 -7.955 1.00 0.00 C ATOM 778 CG LEU A 265 4.549 11.020 -6.955 1.00 0.00 C ATOM 779 CD1 LEU A 265 5.744 10.425 -7.683 1.00 0.00 C ATOM 780 CD2 LEU A 265 4.996 12.123 -6.005 1.00 0.00 C ATOM 0 H LEU A 265 1.811 9.816 -7.333 1.00 0.00 H new ATOM 0 HA LEU A 265 2.253 12.584 -6.557 1.00 0.00 H new ATOM 0 HB2 LEU A 265 3.402 10.822 -8.750 1.00 0.00 H new ATOM 0 HB3 LEU A 265 3.931 12.458 -8.414 1.00 0.00 H new ATOM 0 HG LEU A 265 4.077 10.231 -6.369 1.00 0.00 H new ATOM 0 HD11 LEU A 265 6.463 10.048 -6.955 1.00 0.00 H new ATOM 0 HD12 LEU A 265 5.411 9.607 -8.321 1.00 0.00 H new ATOM 0 HD13 LEU A 265 6.217 11.193 -8.295 1.00 0.00 H new ATOM 0 HD21 LEU A 265 5.725 11.723 -5.300 1.00 0.00 H new ATOM 0 HD22 LEU A 265 5.450 12.933 -6.576 1.00 0.00 H new ATOM 0 HD23 LEU A 265 4.134 12.503 -5.458 1.00 0.00 H new ATOM 792 N GLU A 266 0.198 11.882 -8.839 1.00 0.00 N ATOM 793 CA GLU A 266 -0.705 12.407 -9.856 1.00 0.00 C ATOM 794 C GLU A 266 -2.156 12.081 -9.515 1.00 0.00 C ATOM 795 O GLU A 266 -2.486 10.976 -9.082 1.00 0.00 O ATOM 796 CB GLU A 266 -0.351 11.834 -11.230 1.00 0.00 C ATOM 797 CG GLU A 266 -1.172 12.422 -12.364 1.00 0.00 C ATOM 798 CD GLU A 266 -0.638 13.760 -12.839 1.00 0.00 C ATOM 799 OE1 GLU A 266 0.025 14.452 -12.039 1.00 0.00 O ATOM 800 OE2 GLU A 266 -0.882 14.113 -14.012 1.00 0.00 O ATOM 0 H GLU A 266 -0.078 10.978 -8.456 1.00 0.00 H new ATOM 0 HA GLU A 266 -0.590 13.491 -9.882 1.00 0.00 H new ATOM 0 HB2 GLU A 266 0.706 12.013 -11.427 1.00 0.00 H new ATOM 0 HB3 GLU A 266 -0.494 10.754 -11.212 1.00 0.00 H new ATOM 0 HG2 GLU A 266 -1.184 11.722 -13.200 1.00 0.00 H new ATOM 0 HG3 GLU A 266 -2.204 12.543 -12.035 1.00 0.00 H new ATOM 807 N PRO A 267 -3.046 13.065 -9.714 1.00 0.00 N ATOM 808 CA PRO A 267 -4.476 12.907 -9.434 1.00 0.00 C ATOM 809 C PRO A 267 -5.158 11.959 -10.416 1.00 0.00 C ATOM 810 O PRO A 267 -6.017 11.165 -10.032 1.00 0.00 O ATOM 811 CB PRO A 267 -5.027 14.326 -9.591 1.00 0.00 C ATOM 812 CG PRO A 267 -4.074 15.002 -10.516 1.00 0.00 C ATOM 813 CD PRO A 267 -2.724 14.407 -10.227 1.00 0.00 C ATOM 0 HA PRO A 267 -4.653 12.473 -8.450 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -6.037 14.315 -10.001 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -5.078 14.839 -8.631 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -4.358 14.839 -11.556 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -4.069 16.080 -10.352 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -2.107 14.357 -11.124 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -2.174 14.996 -9.494 1.00 0.00 H new ATOM 821 N LEU A 268 -4.769 12.048 -11.683 1.00 0.00 N ATOM 822 CA LEU A 268 -5.342 11.198 -12.720 1.00 0.00 C ATOM 823 C LEU A 268 -5.031 9.729 -12.454 1.00 0.00 C ATOM 824 O LEU A 268 -5.926 8.885 -12.454 1.00 0.00 O ATOM 825 CB LEU A 268 -4.806 11.604 -14.094 1.00 0.00 C ATOM 826 CG LEU A 268 -5.370 12.899 -14.679 1.00 0.00 C ATOM 827 CD1 LEU A 268 -4.558 13.338 -15.887 1.00 0.00 C ATOM 828 CD2 LEU A 268 -6.835 12.722 -15.054 1.00 0.00 C ATOM 0 H LEU A 268 -4.059 12.700 -12.017 1.00 0.00 H new ATOM 0 HA LEU A 268 -6.424 11.329 -12.706 1.00 0.00 H new ATOM 0 HB2 LEU A 268 -3.723 11.702 -14.025 1.00 0.00 H new ATOM 0 HB3 LEU A 268 -5.009 10.794 -14.795 1.00 0.00 H new ATOM 0 HG LEU A 268 -5.302 13.678 -13.919 1.00 0.00 H new ATOM 0 HD11 LEU A 268 -4.975 14.261 -16.289 1.00 0.00 H new ATOM 0 HD12 LEU A 268 -3.523 13.507 -15.588 1.00 0.00 H new ATOM 0 HD13 LEU A 268 -4.593 12.561 -16.651 1.00 0.00 H new ATOM 0 HD21 LEU A 268 -7.220 13.654 -15.469 1.00 0.00 H new ATOM 0 HD22 LEU A 268 -6.927 11.929 -15.796 1.00 0.00 H new ATOM 0 HD23 LEU A 268 -7.408 12.456 -14.166 1.00 0.00 H new ATOM 840 N GLU A 269 -3.755 9.432 -12.225 1.00 0.00 N ATOM 841 CA GLU A 269 -3.326 8.064 -11.956 1.00 0.00 C ATOM 842 C GLU A 269 -3.980 7.529 -10.685 1.00 0.00 C ATOM 843 O GLU A 269 -4.397 6.372 -10.629 1.00 0.00 O ATOM 844 CB GLU A 269 -1.803 8.000 -11.825 1.00 0.00 C ATOM 845 CG GLU A 269 -1.088 7.760 -13.144 1.00 0.00 C ATOM 846 CD GLU A 269 -1.026 9.004 -14.008 1.00 0.00 C ATOM 847 OE1 GLU A 269 -1.968 9.224 -14.799 1.00 0.00 O ATOM 848 OE2 GLU A 269 -0.036 9.757 -13.896 1.00 0.00 O ATOM 0 H GLU A 269 -3.001 10.119 -12.220 1.00 0.00 H new ATOM 0 HA GLU A 269 -3.638 7.441 -12.794 1.00 0.00 H new ATOM 0 HB2 GLU A 269 -1.445 8.934 -11.392 1.00 0.00 H new ATOM 0 HB3 GLU A 269 -1.540 7.204 -11.129 1.00 0.00 H new ATOM 0 HG2 GLU A 269 -0.075 7.409 -12.946 1.00 0.00 H new ATOM 0 HG3 GLU A 269 -1.599 6.967 -13.691 1.00 0.00 H new ATOM 855 N ALA A 270 -4.066 8.379 -9.668 1.00 0.00 N ATOM 856 CA ALA A 270 -4.670 7.994 -8.399 1.00 0.00 C ATOM 857 C ALA A 270 -6.094 7.487 -8.600 1.00 0.00 C ATOM 858 O ALA A 270 -6.454 6.413 -8.119 1.00 0.00 O ATOM 859 CB ALA A 270 -4.657 9.167 -7.430 1.00 0.00 C ATOM 0 H ALA A 270 -3.725 9.340 -9.698 1.00 0.00 H new ATOM 0 HA ALA A 270 -4.079 7.181 -7.976 1.00 0.00 H new ATOM 0 HB1 ALA A 270 -5.111 8.865 -6.486 1.00 0.00 H new ATOM 0 HB2 ALA A 270 -3.628 9.481 -7.253 1.00 0.00 H new ATOM 0 HB3 ALA A 270 -5.222 9.997 -7.855 1.00 0.00 H new ATOM 865 N ARG A 271 -6.900 8.268 -9.312 1.00 0.00 N ATOM 866 CA ARG A 271 -8.285 7.899 -9.575 1.00 0.00 C ATOM 867 C ARG A 271 -8.363 6.556 -10.294 1.00 0.00 C ATOM 868 O ARG A 271 -9.115 5.667 -9.894 1.00 0.00 O ATOM 869 CB ARG A 271 -8.973 8.979 -10.412 1.00 0.00 C ATOM 870 CG ARG A 271 -9.499 10.144 -9.590 1.00 0.00 C ATOM 871 CD ARG A 271 -10.351 11.081 -10.433 1.00 0.00 C ATOM 872 NE ARG A 271 -11.280 11.858 -9.618 1.00 0.00 N ATOM 873 CZ ARG A 271 -11.852 12.985 -10.027 1.00 0.00 C ATOM 874 NH1 ARG A 271 -11.590 13.464 -11.235 1.00 0.00 N ATOM 875 NH2 ARG A 271 -12.687 13.635 -9.227 1.00 0.00 N ATOM 0 H ARG A 271 -6.617 9.160 -9.717 1.00 0.00 H new ATOM 0 HA ARG A 271 -8.799 7.809 -8.618 1.00 0.00 H new ATOM 0 HB2 ARG A 271 -8.268 9.357 -11.152 1.00 0.00 H new ATOM 0 HB3 ARG A 271 -9.801 8.529 -10.960 1.00 0.00 H new ATOM 0 HG2 ARG A 271 -10.090 9.765 -8.756 1.00 0.00 H new ATOM 0 HG3 ARG A 271 -8.662 10.697 -9.163 1.00 0.00 H new ATOM 0 HD2 ARG A 271 -9.703 11.758 -10.989 1.00 0.00 H new ATOM 0 HD3 ARG A 271 -10.910 10.501 -11.167 1.00 0.00 H new ATOM 0 HE ARG A 271 -11.502 11.517 -8.683 1.00 0.00 H new ATOM 0 HH11 ARG A 271 -10.948 12.967 -11.853 1.00 0.00 H new ATOM 0 HH12 ARG A 271 -12.030 14.330 -11.547 1.00 0.00 H new ATOM 0 HH21 ARG A 271 -12.890 13.270 -8.297 1.00 0.00 H new ATOM 0 HH22 ARG A 271 -13.126 14.500 -9.542 1.00 0.00 H new ATOM 889 N LYS A 272 -7.581 6.415 -11.359 1.00 0.00 N ATOM 890 CA LYS A 272 -7.560 5.181 -12.135 1.00 0.00 C ATOM 891 C LYS A 272 -7.373 3.970 -11.227 1.00 0.00 C ATOM 892 O LYS A 272 -8.180 3.041 -11.240 1.00 0.00 O ATOM 893 CB LYS A 272 -6.439 5.228 -13.177 1.00 0.00 C ATOM 894 CG LYS A 272 -6.355 3.979 -14.037 1.00 0.00 C ATOM 895 CD LYS A 272 -5.403 4.170 -15.205 1.00 0.00 C ATOM 896 CE LYS A 272 -4.883 2.838 -15.724 1.00 0.00 C ATOM 897 NZ LYS A 272 -3.781 3.018 -16.709 1.00 0.00 N ATOM 0 H LYS A 272 -6.953 7.141 -11.704 1.00 0.00 H new ATOM 0 HA LYS A 272 -8.519 5.086 -12.645 1.00 0.00 H new ATOM 0 HB2 LYS A 272 -6.590 6.094 -13.822 1.00 0.00 H new ATOM 0 HB3 LYS A 272 -5.486 5.373 -12.667 1.00 0.00 H new ATOM 0 HG2 LYS A 272 -6.022 3.139 -13.428 1.00 0.00 H new ATOM 0 HG3 LYS A 272 -7.347 3.727 -14.412 1.00 0.00 H new ATOM 0 HD2 LYS A 272 -5.913 4.701 -16.009 1.00 0.00 H new ATOM 0 HD3 LYS A 272 -4.564 4.793 -14.894 1.00 0.00 H new ATOM 0 HE2 LYS A 272 -4.528 2.236 -14.888 1.00 0.00 H new ATOM 0 HE3 LYS A 272 -5.700 2.286 -16.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 272 -3.454 2.087 -17.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 272 -4.127 3.571 -17.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 272 -2.991 3.522 -16.258 1.00 0.00 H new ATOM 911 N ALA A 273 -6.304 3.987 -10.437 1.00 0.00 N ATOM 912 CA ALA A 273 -6.013 2.893 -9.520 1.00 0.00 C ATOM 913 C ALA A 273 -7.176 2.656 -8.562 1.00 0.00 C ATOM 914 O ALA A 273 -7.624 1.524 -8.382 1.00 0.00 O ATOM 915 CB ALA A 273 -4.737 3.179 -8.743 1.00 0.00 C ATOM 0 H ALA A 273 -5.625 4.748 -10.414 1.00 0.00 H new ATOM 0 HA ALA A 273 -5.870 1.987 -10.109 1.00 0.00 H new ATOM 0 HB1 ALA A 273 -4.533 2.353 -8.062 1.00 0.00 H new ATOM 0 HB2 ALA A 273 -3.905 3.290 -9.438 1.00 0.00 H new ATOM 0 HB3 ALA A 273 -4.858 4.099 -8.171 1.00 0.00 H new ATOM 921 N PHE A 274 -7.659 3.732 -7.948 1.00 0.00 N ATOM 922 CA PHE A 274 -8.769 3.640 -7.007 1.00 0.00 C ATOM 923 C PHE A 274 -9.910 2.812 -7.589 1.00 0.00 C ATOM 924 O PHE A 274 -10.467 1.944 -6.917 1.00 0.00 O ATOM 925 CB PHE A 274 -9.273 5.039 -6.643 1.00 0.00 C ATOM 926 CG PHE A 274 -10.350 5.034 -5.596 1.00 0.00 C ATOM 927 CD1 PHE A 274 -11.609 4.532 -5.881 1.00 0.00 C ATOM 928 CD2 PHE A 274 -10.102 5.532 -4.327 1.00 0.00 C ATOM 929 CE1 PHE A 274 -12.602 4.526 -4.919 1.00 0.00 C ATOM 930 CE2 PHE A 274 -11.091 5.528 -3.361 1.00 0.00 C ATOM 931 CZ PHE A 274 -12.343 5.026 -3.658 1.00 0.00 C ATOM 0 H PHE A 274 -7.299 4.677 -8.085 1.00 0.00 H new ATOM 0 HA PHE A 274 -8.408 3.144 -6.106 1.00 0.00 H new ATOM 0 HB2 PHE A 274 -8.434 5.638 -6.287 1.00 0.00 H new ATOM 0 HB3 PHE A 274 -9.653 5.525 -7.542 1.00 0.00 H new ATOM 0 HD1 PHE A 274 -11.817 4.141 -6.866 1.00 0.00 H new ATOM 0 HD2 PHE A 274 -9.125 5.928 -4.090 1.00 0.00 H new ATOM 0 HE1 PHE A 274 -13.579 4.131 -5.153 1.00 0.00 H new ATOM 0 HE2 PHE A 274 -10.885 5.917 -2.375 1.00 0.00 H new ATOM 0 HZ PHE A 274 -13.118 5.024 -2.906 1.00 0.00 H new ATOM 941 N ARG A 275 -10.252 3.086 -8.844 1.00 0.00 N ATOM 942 CA ARG A 275 -11.327 2.367 -9.517 1.00 0.00 C ATOM 943 C ARG A 275 -10.999 0.882 -9.634 1.00 0.00 C ATOM 944 O ARG A 275 -11.827 0.026 -9.320 1.00 0.00 O ATOM 945 CB ARG A 275 -11.571 2.957 -10.908 1.00 0.00 C ATOM 946 CG ARG A 275 -12.436 4.207 -10.896 1.00 0.00 C ATOM 947 CD ARG A 275 -13.186 4.377 -12.208 1.00 0.00 C ATOM 948 NE ARG A 275 -14.354 3.504 -12.287 1.00 0.00 N ATOM 949 CZ ARG A 275 -15.455 3.680 -11.565 1.00 0.00 C ATOM 950 NH1 ARG A 275 -15.537 4.693 -10.713 1.00 0.00 N ATOM 951 NH2 ARG A 275 -16.476 2.843 -11.694 1.00 0.00 N ATOM 0 H ARG A 275 -9.800 3.800 -9.415 1.00 0.00 H new ATOM 0 HA ARG A 275 -12.232 2.475 -8.919 1.00 0.00 H new ATOM 0 HB2 ARG A 275 -10.611 3.194 -11.366 1.00 0.00 H new ATOM 0 HB3 ARG A 275 -12.046 2.203 -11.535 1.00 0.00 H new ATOM 0 HG2 ARG A 275 -13.148 4.150 -10.073 1.00 0.00 H new ATOM 0 HG3 ARG A 275 -11.811 5.082 -10.717 1.00 0.00 H new ATOM 0 HD2 ARG A 275 -13.501 5.415 -12.314 1.00 0.00 H new ATOM 0 HD3 ARG A 275 -12.515 4.161 -13.040 1.00 0.00 H new ATOM 0 HE ARG A 275 -14.323 2.715 -12.933 1.00 0.00 H new ATOM 0 HH11 ARG A 275 -14.754 5.339 -10.611 1.00 0.00 H new ATOM 0 HH12 ARG A 275 -16.383 4.827 -10.159 1.00 0.00 H new ATOM 0 HH21 ARG A 275 -16.416 2.063 -12.348 1.00 0.00 H new ATOM 0 HH22 ARG A 275 -17.321 2.980 -11.139 1.00 0.00 H new ATOM 965 N HIS A 276 -9.785 0.583 -10.087 1.00 0.00 N ATOM 966 CA HIS A 276 -9.347 -0.800 -10.245 1.00 0.00 C ATOM 967 C HIS A 276 -9.310 -1.515 -8.898 1.00 0.00 C ATOM 968 O HIS A 276 -10.148 -2.372 -8.615 1.00 0.00 O ATOM 969 CB HIS A 276 -7.967 -0.848 -10.900 1.00 0.00 C ATOM 970 CG HIS A 276 -7.905 -0.143 -12.220 1.00 0.00 C ATOM 971 ND1 HIS A 276 -8.740 -0.446 -13.275 1.00 0.00 N ATOM 972 CD2 HIS A 276 -7.102 0.857 -12.654 1.00 0.00 C ATOM 973 CE1 HIS A 276 -8.452 0.336 -14.300 1.00 0.00 C ATOM 974 NE2 HIS A 276 -7.462 1.136 -13.949 1.00 0.00 N ATOM 0 H HIS A 276 -9.088 1.279 -10.351 1.00 0.00 H new ATOM 0 HA HIS A 276 -10.063 -1.311 -10.888 1.00 0.00 H new ATOM 0 HB2 HIS A 276 -7.238 -0.401 -10.224 1.00 0.00 H new ATOM 0 HB3 HIS A 276 -7.676 -1.889 -11.040 1.00 0.00 H new ATOM 0 HD1 HIS A 276 -9.466 -1.162 -13.265 1.00 0.00 H new ATOM 0 HD2 HIS A 276 -6.323 1.345 -12.087 1.00 0.00 H new ATOM 0 HE1 HIS A 276 -8.943 0.323 -15.262 1.00 0.00 H new ATOM 983 N LEU A 277 -8.333 -1.159 -8.072 1.00 0.00 N ATOM 984 CA LEU A 277 -8.185 -1.767 -6.754 1.00 0.00 C ATOM 985 C LEU A 277 -9.528 -1.841 -6.035 1.00 0.00 C ATOM 986 O LEU A 277 -9.739 -2.700 -5.180 1.00 0.00 O ATOM 987 CB LEU A 277 -7.186 -0.972 -5.912 1.00 0.00 C ATOM 988 CG LEU A 277 -5.849 -0.651 -6.583 1.00 0.00 C ATOM 989 CD1 LEU A 277 -4.915 0.046 -5.605 1.00 0.00 C ATOM 990 CD2 LEU A 277 -5.207 -1.919 -7.126 1.00 0.00 C ATOM 0 H LEU A 277 -7.631 -0.452 -8.291 1.00 0.00 H new ATOM 0 HA LEU A 277 -7.809 -2.781 -6.889 1.00 0.00 H new ATOM 0 HB2 LEU A 277 -7.656 -0.034 -5.616 1.00 0.00 H new ATOM 0 HB3 LEU A 277 -6.986 -1.531 -4.998 1.00 0.00 H new ATOM 0 HG LEU A 277 -6.036 0.024 -7.418 1.00 0.00 H new ATOM 0 HD11 LEU A 277 -3.969 0.267 -6.100 1.00 0.00 H new ATOM 0 HD12 LEU A 277 -5.372 0.975 -5.265 1.00 0.00 H new ATOM 0 HD13 LEU A 277 -4.734 -0.604 -4.749 1.00 0.00 H new ATOM 0 HD21 LEU A 277 -4.257 -1.672 -7.600 1.00 0.00 H new ATOM 0 HD22 LEU A 277 -5.033 -2.618 -6.308 1.00 0.00 H new ATOM 0 HD23 LEU A 277 -5.870 -2.377 -7.860 1.00 0.00 H new ATOM 1002 N ALA A 278 -10.433 -0.934 -6.389 1.00 0.00 N ATOM 1003 CA ALA A 278 -11.757 -0.899 -5.780 1.00 0.00 C ATOM 1004 C ALA A 278 -12.574 -2.126 -6.170 1.00 0.00 C ATOM 1005 O ALA A 278 -12.569 -2.545 -7.328 1.00 0.00 O ATOM 1006 CB ALA A 278 -12.489 0.373 -6.182 1.00 0.00 C ATOM 0 H ALA A 278 -10.273 -0.214 -7.094 1.00 0.00 H new ATOM 0 HA ALA A 278 -11.632 -0.907 -4.697 1.00 0.00 H new ATOM 0 HB1 ALA A 278 -13.476 0.386 -5.720 1.00 0.00 H new ATOM 0 HB2 ALA A 278 -11.921 1.241 -5.848 1.00 0.00 H new ATOM 0 HB3 ALA A 278 -12.595 0.404 -7.266 1.00 0.00 H new ATOM 1012 N TYR A 279 -13.274 -2.699 -5.197 1.00 0.00 N ATOM 1013 CA TYR A 279 -14.093 -3.881 -5.438 1.00 0.00 C ATOM 1014 C TYR A 279 -13.219 -5.107 -5.686 1.00 0.00 C ATOM 1015 O TYR A 279 -13.590 -6.004 -6.444 1.00 0.00 O ATOM 1016 CB TYR A 279 -15.019 -3.650 -6.633 1.00 0.00 C ATOM 1017 CG TYR A 279 -15.737 -2.320 -6.595 1.00 0.00 C ATOM 1018 CD1 TYR A 279 -16.711 -2.062 -5.638 1.00 0.00 C ATOM 1019 CD2 TYR A 279 -15.441 -1.322 -7.514 1.00 0.00 C ATOM 1020 CE1 TYR A 279 -17.371 -0.849 -5.600 1.00 0.00 C ATOM 1021 CE2 TYR A 279 -16.094 -0.105 -7.483 1.00 0.00 C ATOM 1022 CZ TYR A 279 -17.058 0.127 -6.524 1.00 0.00 C ATOM 1023 OH TYR A 279 -17.712 1.337 -6.489 1.00 0.00 O ATOM 0 H TYR A 279 -13.291 -2.364 -4.234 1.00 0.00 H new ATOM 0 HA TYR A 279 -14.697 -4.062 -4.549 1.00 0.00 H new ATOM 0 HB2 TYR A 279 -14.435 -3.712 -7.551 1.00 0.00 H new ATOM 0 HB3 TYR A 279 -15.757 -4.451 -6.670 1.00 0.00 H new ATOM 0 HD1 TYR A 279 -16.956 -2.823 -4.912 1.00 0.00 H new ATOM 0 HD2 TYR A 279 -14.687 -1.500 -8.266 1.00 0.00 H new ATOM 0 HE1 TYR A 279 -18.128 -0.666 -4.851 1.00 0.00 H new ATOM 0 HE2 TYR A 279 -15.851 0.660 -8.205 1.00 0.00 H new ATOM 0 HH TYR A 279 -17.374 1.913 -7.206 1.00 0.00 H new ATOM 1033 N SER A 280 -12.058 -5.139 -5.041 1.00 0.00 N ATOM 1034 CA SER A 280 -11.129 -6.253 -5.193 1.00 0.00 C ATOM 1035 C SER A 280 -10.504 -6.626 -3.852 1.00 0.00 C ATOM 1036 O SER A 280 -10.650 -5.906 -2.864 1.00 0.00 O ATOM 1037 CB SER A 280 -10.032 -5.896 -6.198 1.00 0.00 C ATOM 1038 OG SER A 280 -10.450 -6.164 -7.525 1.00 0.00 O ATOM 0 H SER A 280 -11.738 -4.406 -4.408 1.00 0.00 H new ATOM 0 HA SER A 280 -11.688 -7.112 -5.565 1.00 0.00 H new ATOM 0 HB2 SER A 280 -9.774 -4.841 -6.100 1.00 0.00 H new ATOM 0 HB3 SER A 280 -9.130 -6.467 -5.975 1.00 0.00 H new ATOM 0 HG SER A 280 -9.732 -5.926 -8.148 1.00 0.00 H new ATOM 1044 N LYS A 281 -9.807 -7.757 -3.826 1.00 0.00 N ATOM 1045 CA LYS A 281 -9.158 -8.227 -2.608 1.00 0.00 C ATOM 1046 C LYS A 281 -7.642 -8.258 -2.777 1.00 0.00 C ATOM 1047 O LYS A 281 -7.134 -8.578 -3.852 1.00 0.00 O ATOM 1048 CB LYS A 281 -9.669 -9.622 -2.239 1.00 0.00 C ATOM 1049 CG LYS A 281 -9.121 -10.725 -3.127 1.00 0.00 C ATOM 1050 CD LYS A 281 -9.787 -12.059 -2.834 1.00 0.00 C ATOM 1051 CE LYS A 281 -9.285 -13.150 -3.768 1.00 0.00 C ATOM 1052 NZ LYS A 281 -7.853 -13.474 -3.522 1.00 0.00 N ATOM 0 H LYS A 281 -9.677 -8.365 -4.635 1.00 0.00 H new ATOM 0 HA LYS A 281 -9.403 -7.533 -1.804 1.00 0.00 H new ATOM 0 HB2 LYS A 281 -9.403 -9.835 -1.204 1.00 0.00 H new ATOM 0 HB3 LYS A 281 -10.757 -9.628 -2.296 1.00 0.00 H new ATOM 0 HG2 LYS A 281 -9.276 -10.462 -4.173 1.00 0.00 H new ATOM 0 HG3 LYS A 281 -8.045 -10.814 -2.977 1.00 0.00 H new ATOM 0 HD2 LYS A 281 -9.592 -12.345 -1.801 1.00 0.00 H new ATOM 0 HD3 LYS A 281 -10.867 -11.958 -2.938 1.00 0.00 H new ATOM 0 HE2 LYS A 281 -9.889 -14.048 -3.635 1.00 0.00 H new ATOM 0 HE3 LYS A 281 -9.413 -12.830 -4.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 -7.699 -14.494 -3.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 -7.257 -12.942 -4.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 -7.600 -13.213 -2.547 1.00 0.00 H new ATOM 1066 N PHE A 282 -6.925 -7.926 -1.708 1.00 0.00 N ATOM 1067 CA PHE A 282 -5.467 -7.916 -1.739 1.00 0.00 C ATOM 1068 C PHE A 282 -4.911 -9.332 -1.618 1.00 0.00 C ATOM 1069 O PHE A 282 -4.409 -9.899 -2.589 1.00 0.00 O ATOM 1070 CB PHE A 282 -4.918 -7.043 -0.608 1.00 0.00 C ATOM 1071 CG PHE A 282 -3.512 -7.390 -0.212 1.00 0.00 C ATOM 1072 CD1 PHE A 282 -2.451 -7.114 -1.060 1.00 0.00 C ATOM 1073 CD2 PHE A 282 -3.250 -7.992 1.008 1.00 0.00 C ATOM 1074 CE1 PHE A 282 -1.155 -7.432 -0.698 1.00 0.00 C ATOM 1075 CE2 PHE A 282 -1.956 -8.311 1.376 1.00 0.00 C ATOM 1076 CZ PHE A 282 -0.908 -8.032 0.521 1.00 0.00 C ATOM 0 H PHE A 282 -7.330 -7.661 -0.810 1.00 0.00 H new ATOM 0 HA PHE A 282 -5.152 -7.501 -2.696 1.00 0.00 H new ATOM 0 HB2 PHE A 282 -4.953 -5.998 -0.917 1.00 0.00 H new ATOM 0 HB3 PHE A 282 -5.567 -7.140 0.263 1.00 0.00 H new ATOM 0 HD1 PHE A 282 -2.639 -6.645 -2.015 1.00 0.00 H new ATOM 0 HD2 PHE A 282 -4.066 -8.215 1.679 1.00 0.00 H new ATOM 0 HE1 PHE A 282 -0.337 -7.211 -1.368 1.00 0.00 H new ATOM 0 HE2 PHE A 282 -1.765 -8.778 2.331 1.00 0.00 H new ATOM 0 HZ PHE A 282 0.103 -8.283 0.805 1.00 0.00 H new ATOM 1086 N HIS A 283 -5.005 -9.898 -0.419 1.00 0.00 N ATOM 1087 CA HIS A 283 -4.512 -11.248 -0.170 1.00 0.00 C ATOM 1088 C HIS A 283 -5.670 -12.223 0.021 1.00 0.00 C ATOM 1089 O HIS A 283 -5.955 -13.043 -0.852 1.00 0.00 O ATOM 1090 CB HIS A 283 -3.607 -11.264 1.062 1.00 0.00 C ATOM 1091 CG HIS A 283 -2.167 -10.992 0.751 1.00 0.00 C ATOM 1092 ND1 HIS A 283 -1.171 -11.034 1.704 1.00 0.00 N ATOM 1093 CD2 HIS A 283 -1.557 -10.675 -0.415 1.00 0.00 C ATOM 1094 CE1 HIS A 283 -0.011 -10.753 1.137 1.00 0.00 C ATOM 1095 NE2 HIS A 283 -0.218 -10.531 -0.148 1.00 0.00 N ATOM 0 H HIS A 283 -5.418 -9.443 0.395 1.00 0.00 H new ATOM 0 HA HIS A 283 -3.935 -11.564 -1.039 1.00 0.00 H new ATOM 0 HB2 HIS A 283 -3.963 -10.520 1.774 1.00 0.00 H new ATOM 0 HB3 HIS A 283 -3.688 -12.236 1.549 1.00 0.00 H new ATOM 0 HD2 HIS A 283 -2.035 -10.557 -1.376 1.00 0.00 H new ATOM 0 HE1 HIS A 283 0.944 -10.712 1.639 1.00 0.00 H new ATOM 0 HE2 HIS A 283 0.500 -10.291 -0.831 1.00 0.00 H new ATOM 1104 N HIS A 284 -6.333 -12.128 1.169 1.00 0.00 N ATOM 1105 CA HIS A 284 -7.460 -13.002 1.476 1.00 0.00 C ATOM 1106 C HIS A 284 -8.676 -12.188 1.909 1.00 0.00 C ATOM 1107 O HIS A 284 -9.767 -12.730 2.086 1.00 0.00 O ATOM 1108 CB HIS A 284 -7.079 -13.995 2.574 1.00 0.00 C ATOM 1109 CG HIS A 284 -5.802 -14.729 2.301 1.00 0.00 C ATOM 1110 ND1 HIS A 284 -5.756 -15.943 1.649 1.00 0.00 N ATOM 1111 CD2 HIS A 284 -4.519 -14.412 2.594 1.00 0.00 C ATOM 1112 CE1 HIS A 284 -4.501 -16.342 1.554 1.00 0.00 C ATOM 1113 NE2 HIS A 284 -3.730 -15.431 2.120 1.00 0.00 N ATOM 0 H HIS A 284 -6.110 -11.455 1.902 1.00 0.00 H new ATOM 0 HA HIS A 284 -7.717 -13.554 0.572 1.00 0.00 H new ATOM 0 HB2 HIS A 284 -6.986 -13.461 3.520 1.00 0.00 H new ATOM 0 HB3 HIS A 284 -7.886 -14.718 2.694 1.00 0.00 H new ATOM 0 HD2 HIS A 284 -4.179 -13.523 3.105 1.00 0.00 H new ATOM 0 HE1 HIS A 284 -4.162 -17.258 1.092 1.00 0.00 H new ATOM 0 HE2 HIS A 284 -2.714 -15.477 2.193 1.00 0.00 H new ATOM 1122 N VAL A 285 -8.480 -10.884 2.079 1.00 0.00 N ATOM 1123 CA VAL A 285 -9.560 -9.996 2.491 1.00 0.00 C ATOM 1124 C VAL A 285 -9.819 -8.922 1.441 1.00 0.00 C ATOM 1125 O VAL A 285 -8.937 -8.548 0.669 1.00 0.00 O ATOM 1126 CB VAL A 285 -9.245 -9.317 3.837 1.00 0.00 C ATOM 1127 CG1 VAL A 285 -9.325 -10.323 4.975 1.00 0.00 C ATOM 1128 CG2 VAL A 285 -7.875 -8.657 3.793 1.00 0.00 C ATOM 0 H VAL A 285 -7.583 -10.420 1.938 1.00 0.00 H new ATOM 0 HA VAL A 285 -10.452 -10.613 2.603 1.00 0.00 H new ATOM 0 HB VAL A 285 -9.991 -8.542 4.016 1.00 0.00 H new ATOM 0 HG11 VAL A 285 -9.099 -9.825 5.918 1.00 0.00 H new ATOM 0 HG12 VAL A 285 -10.329 -10.744 5.018 1.00 0.00 H new ATOM 0 HG13 VAL A 285 -8.604 -11.122 4.805 1.00 0.00 H new ATOM 0 HG21 VAL A 285 -7.669 -8.182 4.752 1.00 0.00 H new ATOM 0 HG22 VAL A 285 -7.114 -9.411 3.590 1.00 0.00 H new ATOM 0 HG23 VAL A 285 -7.859 -7.904 3.005 1.00 0.00 H new ATOM 1138 N PRO A 286 -11.060 -8.412 1.410 1.00 0.00 N ATOM 1139 CA PRO A 286 -11.465 -7.373 0.459 1.00 0.00 C ATOM 1140 C PRO A 286 -10.814 -6.027 0.759 1.00 0.00 C ATOM 1141 O PRO A 286 -10.884 -5.529 1.884 1.00 0.00 O ATOM 1142 CB PRO A 286 -12.981 -7.288 0.650 1.00 0.00 C ATOM 1143 CG PRO A 286 -13.215 -7.769 2.041 1.00 0.00 C ATOM 1144 CD PRO A 286 -12.162 -8.812 2.301 1.00 0.00 C ATOM 0 HA PRO A 286 -11.163 -7.614 -0.560 1.00 0.00 H new ATOM 0 HB2 PRO A 286 -13.340 -6.267 0.518 1.00 0.00 H new ATOM 0 HB3 PRO A 286 -13.507 -7.907 -0.077 1.00 0.00 H new ATOM 0 HG2 PRO A 286 -13.138 -6.950 2.756 1.00 0.00 H new ATOM 0 HG3 PRO A 286 -14.215 -8.190 2.146 1.00 0.00 H new ATOM 0 HD2 PRO A 286 -11.852 -8.819 3.346 1.00 0.00 H new ATOM 0 HD3 PRO A 286 -12.523 -9.814 2.069 1.00 0.00 H new ATOM 1152 N LEU A 287 -10.181 -5.442 -0.252 1.00 0.00 N ATOM 1153 CA LEU A 287 -9.518 -4.152 -0.096 1.00 0.00 C ATOM 1154 C LEU A 287 -10.539 -3.027 0.032 1.00 0.00 C ATOM 1155 O LEU A 287 -11.356 -2.811 -0.864 1.00 0.00 O ATOM 1156 CB LEU A 287 -8.593 -3.885 -1.285 1.00 0.00 C ATOM 1157 CG LEU A 287 -7.290 -4.685 -1.314 1.00 0.00 C ATOM 1158 CD1 LEU A 287 -6.631 -4.582 -2.681 1.00 0.00 C ATOM 1159 CD2 LEU A 287 -6.343 -4.202 -0.226 1.00 0.00 C ATOM 0 H LEU A 287 -10.113 -5.840 -1.188 1.00 0.00 H new ATOM 0 HA LEU A 287 -8.925 -4.184 0.818 1.00 0.00 H new ATOM 0 HB2 LEU A 287 -9.144 -4.093 -2.202 1.00 0.00 H new ATOM 0 HB3 LEU A 287 -8.345 -2.824 -1.296 1.00 0.00 H new ATOM 0 HG LEU A 287 -7.525 -5.732 -1.124 1.00 0.00 H new ATOM 0 HD11 LEU A 287 -5.705 -5.157 -2.683 1.00 0.00 H new ATOM 0 HD12 LEU A 287 -7.305 -4.977 -3.441 1.00 0.00 H new ATOM 0 HD13 LEU A 287 -6.409 -3.538 -2.900 1.00 0.00 H new ATOM 0 HD21 LEU A 287 -5.421 -4.783 -0.262 1.00 0.00 H new ATOM 0 HD22 LEU A 287 -6.114 -3.148 -0.384 1.00 0.00 H new ATOM 0 HD23 LEU A 287 -6.814 -4.329 0.749 1.00 0.00 H new ATOM 1171 N TYR A 288 -10.485 -2.310 1.149 1.00 0.00 N ATOM 1172 CA TYR A 288 -11.405 -1.206 1.394 1.00 0.00 C ATOM 1173 C TYR A 288 -10.701 0.137 1.228 1.00 0.00 C ATOM 1174 O TYR A 288 -9.973 0.584 2.116 1.00 0.00 O ATOM 1175 CB TYR A 288 -12.000 -1.312 2.799 1.00 0.00 C ATOM 1176 CG TYR A 288 -13.272 -2.128 2.857 1.00 0.00 C ATOM 1177 CD1 TYR A 288 -13.325 -3.409 2.324 1.00 0.00 C ATOM 1178 CD2 TYR A 288 -14.422 -1.616 3.448 1.00 0.00 C ATOM 1179 CE1 TYR A 288 -14.485 -4.157 2.375 1.00 0.00 C ATOM 1180 CE2 TYR A 288 -15.586 -2.357 3.504 1.00 0.00 C ATOM 1181 CZ TYR A 288 -15.613 -3.627 2.966 1.00 0.00 C ATOM 1182 OH TYR A 288 -16.770 -4.370 3.020 1.00 0.00 O ATOM 0 H TYR A 288 -9.814 -2.474 1.899 1.00 0.00 H new ATOM 0 HA TYR A 288 -12.209 -1.268 0.661 1.00 0.00 H new ATOM 0 HB2 TYR A 288 -11.261 -1.758 3.465 1.00 0.00 H new ATOM 0 HB3 TYR A 288 -12.204 -0.309 3.175 1.00 0.00 H new ATOM 0 HD1 TYR A 288 -12.444 -3.828 1.861 1.00 0.00 H new ATOM 0 HD2 TYR A 288 -14.405 -0.622 3.870 1.00 0.00 H new ATOM 0 HE1 TYR A 288 -14.509 -5.151 1.954 1.00 0.00 H new ATOM 0 HE2 TYR A 288 -16.470 -1.944 3.967 1.00 0.00 H new ATOM 0 HH TYR A 288 -17.470 -3.852 3.469 1.00 0.00 H new ATOM 1192 N LEU A 289 -10.923 0.777 0.085 1.00 0.00 N ATOM 1193 CA LEU A 289 -10.312 2.071 -0.199 1.00 0.00 C ATOM 1194 C LEU A 289 -11.249 3.212 0.183 1.00 0.00 C ATOM 1195 O LEU A 289 -12.462 3.117 0.003 1.00 0.00 O ATOM 1196 CB LEU A 289 -9.946 2.170 -1.681 1.00 0.00 C ATOM 1197 CG LEU A 289 -9.102 1.025 -2.242 1.00 0.00 C ATOM 1198 CD1 LEU A 289 -8.976 1.145 -3.753 1.00 0.00 C ATOM 1199 CD2 LEU A 289 -7.726 1.008 -1.591 1.00 0.00 C ATOM 0 H LEU A 289 -11.522 0.421 -0.660 1.00 0.00 H new ATOM 0 HA LEU A 289 -9.405 2.156 0.399 1.00 0.00 H new ATOM 0 HB2 LEU A 289 -10.868 2.232 -2.259 1.00 0.00 H new ATOM 0 HB3 LEU A 289 -9.407 3.104 -1.840 1.00 0.00 H new ATOM 0 HG LEU A 289 -9.603 0.084 -2.013 1.00 0.00 H new ATOM 0 HD11 LEU A 289 -8.372 0.322 -4.134 1.00 0.00 H new ATOM 0 HD12 LEU A 289 -9.967 1.108 -4.205 1.00 0.00 H new ATOM 0 HD13 LEU A 289 -8.498 2.092 -4.004 1.00 0.00 H new ATOM 0 HD21 LEU A 289 -7.139 0.187 -2.002 1.00 0.00 H new ATOM 0 HD22 LEU A 289 -7.218 1.952 -1.789 1.00 0.00 H new ATOM 0 HD23 LEU A 289 -7.834 0.873 -0.515 1.00 0.00 H new ATOM 1211 N GLU A 290 -10.676 4.290 0.708 1.00 0.00 N ATOM 1212 CA GLU A 290 -11.461 5.450 1.114 1.00 0.00 C ATOM 1213 C GLU A 290 -10.667 6.739 0.921 1.00 0.00 C ATOM 1214 O GLU A 290 -9.718 7.012 1.656 1.00 0.00 O ATOM 1215 CB GLU A 290 -11.891 5.317 2.576 1.00 0.00 C ATOM 1216 CG GLU A 290 -13.035 4.340 2.788 1.00 0.00 C ATOM 1217 CD GLU A 290 -13.622 4.423 4.184 1.00 0.00 C ATOM 1218 OE1 GLU A 290 -12.917 4.900 5.097 1.00 0.00 O ATOM 1219 OE2 GLU A 290 -14.787 4.010 4.362 1.00 0.00 O ATOM 0 H GLU A 290 -9.672 4.384 0.862 1.00 0.00 H new ATOM 0 HA GLU A 290 -12.350 5.493 0.484 1.00 0.00 H new ATOM 0 HB2 GLU A 290 -11.035 4.996 3.170 1.00 0.00 H new ATOM 0 HB3 GLU A 290 -12.188 6.297 2.949 1.00 0.00 H new ATOM 0 HG2 GLU A 290 -13.818 4.539 2.056 1.00 0.00 H new ATOM 0 HG3 GLU A 290 -12.680 3.326 2.607 1.00 0.00 H new ATOM 1226 N TRP A 291 -11.063 7.527 -0.073 1.00 0.00 N ATOM 1227 CA TRP A 291 -10.388 8.787 -0.363 1.00 0.00 C ATOM 1228 C TRP A 291 -9.986 9.499 0.924 1.00 0.00 C ATOM 1229 O TRP A 291 -10.684 9.415 1.934 1.00 0.00 O ATOM 1230 CB TRP A 291 -11.293 9.693 -1.201 1.00 0.00 C ATOM 1231 CG TRP A 291 -11.311 9.333 -2.656 1.00 0.00 C ATOM 1232 CD1 TRP A 291 -12.385 8.904 -3.381 1.00 0.00 C ATOM 1233 CD2 TRP A 291 -10.202 9.370 -3.561 1.00 0.00 C ATOM 1234 NE1 TRP A 291 -12.011 8.672 -4.682 1.00 0.00 N ATOM 1235 CE2 TRP A 291 -10.677 8.951 -4.819 1.00 0.00 C ATOM 1236 CE3 TRP A 291 -8.855 9.719 -3.432 1.00 0.00 C ATOM 1237 CZ2 TRP A 291 -9.852 8.871 -5.937 1.00 0.00 C ATOM 1238 CZ3 TRP A 291 -8.037 9.639 -4.543 1.00 0.00 C ATOM 1239 CH2 TRP A 291 -8.537 9.218 -5.782 1.00 0.00 C ATOM 0 H TRP A 291 -11.847 7.316 -0.691 1.00 0.00 H new ATOM 0 HA TRP A 291 -9.484 8.564 -0.930 1.00 0.00 H new ATOM 0 HB2 TRP A 291 -12.309 9.642 -0.809 1.00 0.00 H new ATOM 0 HB3 TRP A 291 -10.961 10.726 -1.094 1.00 0.00 H new ATOM 0 HD1 TRP A 291 -13.382 8.767 -2.989 1.00 0.00 H new ATOM 0 HE1 TRP A 291 -12.627 8.345 -5.426 1.00 0.00 H new ATOM 0 HE3 TRP A 291 -8.460 10.045 -2.481 1.00 0.00 H new ATOM 0 HZ2 TRP A 291 -10.236 8.547 -6.893 1.00 0.00 H new ATOM 0 HZ3 TRP A 291 -6.994 9.906 -4.454 1.00 0.00 H new ATOM 0 HH2 TRP A 291 -7.872 9.166 -6.631 1.00 0.00 H new ATOM 1250 N ALA A 292 -8.858 10.200 0.880 1.00 0.00 N ATOM 1251 CA ALA A 292 -8.365 10.928 2.042 1.00 0.00 C ATOM 1252 C ALA A 292 -8.770 12.397 1.981 1.00 0.00 C ATOM 1253 O ALA A 292 -8.806 13.012 0.916 1.00 0.00 O ATOM 1254 CB ALA A 292 -6.853 10.799 2.144 1.00 0.00 C ATOM 0 H ALA A 292 -8.268 10.279 0.052 1.00 0.00 H new ATOM 0 HA ALA A 292 -8.816 10.490 2.932 1.00 0.00 H new ATOM 0 HB1 ALA A 292 -6.499 11.348 3.017 1.00 0.00 H new ATOM 0 HB2 ALA A 292 -6.583 9.748 2.243 1.00 0.00 H new ATOM 0 HB3 ALA A 292 -6.391 11.209 1.246 1.00 0.00 H new