USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 590 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 296 ASN :FLIP amide:sc= 0 X(o=-0.19,f=-0.0066) USER MOD Set 1.2: A 306 ASN :FLIP amide:sc=-0.00656 X(o=-0.29,f=-0.0066) USER MOD Set 2.1: A 274 GLN : amide:sc= 0 X(o=-0.35,f=-0.67) USER MOD Set 2.2: A 276 CYS SG : rot 180:sc= -0.352 USER MOD Single : A 239 THR OG1 : rot 132:sc= 0.58 USER MOD Single : A 240 THR OG1 : rot 180:sc= 0 USER MOD Single : A 242 TYR OH : rot 180:sc= -0.259 USER MOD Single : A 249 THR OG1 : rot -100:sc= 0 USER MOD Single : A 251 THR OG1 : rot -60:sc= 0.00586 USER MOD Single : A 253 THR OG1 : rot 180:sc= 0 USER MOD Single : A 257 ASN : amide:sc= -0.374 X(o=-0.37,f=0) USER MOD Single : A 258 HIS :FLIP no HD1:sc= -3.17 F(o=-5!,f=-3.2) USER MOD Single : A 260 TYR OH : rot 180:sc= 0 USER MOD Single : A 261 GLN : amide:sc= 0.696 K(o=0.7,f=-1) USER MOD Single : A 267 THR OG1 : rot 180:sc= -0.157 USER MOD Single : A 269 THR OG1 : rot 180:sc= 0 USER MOD Single : A 272 GLN : amide:sc= -0.135 X(o=-0.13,f=-0.00027) USER MOD Single : A 275 GLN : amide:sc= -0.112 K(o=-0.11,f=-1.8!) USER MOD Single : A 280 GLN : amide:sc= -0.172 K(o=-0.17,f=-2.2!) USER MOD Single : A 283 THR OG1 : rot 42:sc= 0.226 USER MOD Single : A 285 GLN : amide:sc= -3.98! C(o=-4!,f=-11!) USER MOD Single : A 293 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 294 SER OG : rot 90:sc= 0.461 USER MOD Single : A 297 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 301 ASN : amide:sc= -0.548 X(o=-0.55,f=-0.28) USER MOD Single : A 308 LYS NZ :NH3+ -124:sc= -0.573 (180deg=-2.49!) USER MOD ----------------------------------------------------------------- ATOM 129 N ILE A 238 4.954 11.604 0.831 1.00 0.00 N ATOM 130 CA ILE A 238 4.953 10.184 1.159 1.00 0.00 C ATOM 131 C ILE A 238 4.527 9.343 -0.040 1.00 0.00 C ATOM 132 O ILE A 238 3.356 9.333 -0.421 1.00 0.00 O ATOM 133 CB ILE A 238 4.017 9.880 2.343 1.00 0.00 C ATOM 134 CG1 ILE A 238 4.294 10.841 3.501 1.00 0.00 C ATOM 135 CG2 ILE A 238 4.185 8.437 2.795 1.00 0.00 C ATOM 136 CD1 ILE A 238 3.353 10.664 4.672 1.00 0.00 C ATOM 0 HA ILE A 238 5.974 9.924 1.438 1.00 0.00 H new ATOM 0 HB ILE A 238 2.987 10.021 2.017 1.00 0.00 H new ATOM 0 HG12 ILE A 238 5.319 10.698 3.844 1.00 0.00 H new ATOM 0 HG13 ILE A 238 4.220 11.866 3.137 1.00 0.00 H new ATOM 0 HG21 ILE A 238 3.517 8.238 3.633 1.00 0.00 H new ATOM 0 HG22 ILE A 238 3.943 7.767 1.970 1.00 0.00 H new ATOM 0 HG23 ILE A 238 5.216 8.271 3.106 1.00 0.00 H new ATOM 0 HD11 ILE A 238 3.608 11.378 5.455 1.00 0.00 H new ATOM 0 HD12 ILE A 238 2.328 10.836 4.344 1.00 0.00 H new ATOM 0 HD13 ILE A 238 3.444 9.650 5.062 1.00 0.00 H new ATOM 148 N THR A 239 5.486 8.637 -0.631 1.00 0.00 N ATOM 149 CA THR A 239 5.211 7.792 -1.787 1.00 0.00 C ATOM 150 C THR A 239 5.057 6.332 -1.377 1.00 0.00 C ATOM 151 O THR A 239 5.469 5.426 -2.102 1.00 0.00 O ATOM 152 CB THR A 239 6.328 7.903 -2.842 1.00 0.00 C ATOM 153 OG1 THR A 239 7.522 7.278 -2.359 1.00 0.00 O ATOM 154 CG2 THR A 239 6.612 9.359 -3.179 1.00 0.00 C ATOM 0 H THR A 239 6.460 8.634 -0.328 1.00 0.00 H new ATOM 0 HA THR A 239 4.275 8.145 -2.221 1.00 0.00 H new ATOM 0 HB THR A 239 5.994 7.396 -3.747 1.00 0.00 H new ATOM 0 HG1 THR A 239 7.881 6.682 -3.049 1.00 0.00 H new ATOM 0 HG21 THR A 239 7.404 9.412 -3.926 1.00 0.00 H new ATOM 0 HG22 THR A 239 5.709 9.824 -3.574 1.00 0.00 H new ATOM 0 HG23 THR A 239 6.927 9.886 -2.278 1.00 0.00 H new ATOM 162 N THR A 240 4.462 6.110 -0.209 1.00 0.00 N ATOM 163 CA THR A 240 4.254 4.759 0.298 1.00 0.00 C ATOM 164 C THR A 240 2.862 4.605 0.898 1.00 0.00 C ATOM 165 O THR A 240 2.375 5.494 1.599 1.00 0.00 O ATOM 166 CB THR A 240 5.304 4.392 1.364 1.00 0.00 C ATOM 167 OG1 THR A 240 6.622 4.623 0.854 1.00 0.00 O ATOM 168 CG2 THR A 240 5.164 2.936 1.782 1.00 0.00 C ATOM 0 H THR A 240 4.116 6.848 0.404 1.00 0.00 H new ATOM 0 HA THR A 240 4.357 4.083 -0.551 1.00 0.00 H new ATOM 0 HB THR A 240 5.138 5.022 2.238 1.00 0.00 H new ATOM 0 HG1 THR A 240 7.283 4.389 1.538 1.00 0.00 H new ATOM 0 HG21 THR A 240 5.916 2.700 2.535 1.00 0.00 H new ATOM 0 HG22 THR A 240 4.170 2.771 2.197 1.00 0.00 H new ATOM 0 HG23 THR A 240 5.306 2.293 0.914 1.00 0.00 H new ATOM 176 N LEU A 241 2.225 3.473 0.621 1.00 0.00 N ATOM 177 CA LEU A 241 0.887 3.202 1.135 1.00 0.00 C ATOM 178 C LEU A 241 0.852 1.879 1.893 1.00 0.00 C ATOM 179 O LEU A 241 1.689 1.003 1.673 1.00 0.00 O ATOM 180 CB LEU A 241 -0.125 3.172 -0.012 1.00 0.00 C ATOM 181 CG LEU A 241 -0.584 4.533 -0.538 1.00 0.00 C ATOM 182 CD1 LEU A 241 -1.168 4.396 -1.935 1.00 0.00 C ATOM 183 CD2 LEU A 241 -1.600 5.156 0.408 1.00 0.00 C ATOM 0 H LEU A 241 2.613 2.728 0.043 1.00 0.00 H new ATOM 0 HA LEU A 241 0.621 4.002 1.826 1.00 0.00 H new ATOM 0 HB2 LEU A 241 0.311 2.613 -0.840 1.00 0.00 H new ATOM 0 HB3 LEU A 241 -1.003 2.618 0.319 1.00 0.00 H new ATOM 0 HG LEU A 241 0.283 5.191 -0.592 1.00 0.00 H new ATOM 0 HD11 LEU A 241 -1.489 5.374 -2.293 1.00 0.00 H new ATOM 0 HD12 LEU A 241 -0.411 3.994 -2.608 1.00 0.00 H new ATOM 0 HD13 LEU A 241 -2.024 3.721 -1.907 1.00 0.00 H new ATOM 0 HD21 LEU A 241 -1.915 6.124 0.018 1.00 0.00 H new ATOM 0 HD22 LEU A 241 -2.466 4.500 0.495 1.00 0.00 H new ATOM 0 HD23 LEU A 241 -1.147 5.291 1.390 1.00 0.00 H new ATOM 195 N TYR A 242 -0.122 1.740 2.785 1.00 0.00 N ATOM 196 CA TYR A 242 -0.266 0.523 3.576 1.00 0.00 C ATOM 197 C TYR A 242 -1.497 -0.266 3.143 1.00 0.00 C ATOM 198 O TYR A 242 -2.491 0.307 2.696 1.00 0.00 O ATOM 199 CB TYR A 242 -0.364 0.866 5.064 1.00 0.00 C ATOM 200 CG TYR A 242 -1.170 -0.132 5.863 1.00 0.00 C ATOM 201 CD1 TYR A 242 -2.559 -0.103 5.851 1.00 0.00 C ATOM 202 CD2 TYR A 242 -0.543 -1.107 6.630 1.00 0.00 C ATOM 203 CE1 TYR A 242 -3.300 -1.012 6.581 1.00 0.00 C ATOM 204 CE2 TYR A 242 -1.275 -2.021 7.362 1.00 0.00 C ATOM 205 CZ TYR A 242 -2.653 -1.970 7.334 1.00 0.00 C ATOM 206 OH TYR A 242 -3.387 -2.879 8.061 1.00 0.00 O ATOM 0 H TYR A 242 -0.824 2.455 2.979 1.00 0.00 H new ATOM 0 HA TYR A 242 0.616 -0.095 3.409 1.00 0.00 H new ATOM 0 HB2 TYR A 242 0.641 0.926 5.481 1.00 0.00 H new ATOM 0 HB3 TYR A 242 -0.814 1.853 5.172 1.00 0.00 H new ATOM 0 HD1 TYR A 242 -3.069 0.644 5.260 1.00 0.00 H new ATOM 0 HD2 TYR A 242 0.536 -1.151 6.654 1.00 0.00 H new ATOM 0 HE1 TYR A 242 -4.379 -0.973 6.562 1.00 0.00 H new ATOM 0 HE2 TYR A 242 -0.771 -2.772 7.953 1.00 0.00 H new ATOM 0 HH TYR A 242 -2.780 -3.486 8.535 1.00 0.00 H new ATOM 216 N VAL A 243 -1.423 -1.587 3.278 1.00 0.00 N ATOM 217 CA VAL A 243 -2.531 -2.457 2.902 1.00 0.00 C ATOM 218 C VAL A 243 -2.677 -3.615 3.883 1.00 0.00 C ATOM 219 O VAL A 243 -1.764 -4.424 4.045 1.00 0.00 O ATOM 220 CB VAL A 243 -2.345 -3.022 1.482 1.00 0.00 C ATOM 221 CG1 VAL A 243 -3.484 -3.965 1.128 1.00 0.00 C ATOM 222 CG2 VAL A 243 -2.244 -1.891 0.469 1.00 0.00 C ATOM 0 H VAL A 243 -0.607 -2.077 3.645 1.00 0.00 H new ATOM 0 HA VAL A 243 -3.434 -1.847 2.926 1.00 0.00 H new ATOM 0 HB VAL A 243 -1.415 -3.589 1.454 1.00 0.00 H new ATOM 0 HG11 VAL A 243 -3.335 -4.354 0.121 1.00 0.00 H new ATOM 0 HG12 VAL A 243 -3.505 -4.793 1.837 1.00 0.00 H new ATOM 0 HG13 VAL A 243 -4.430 -3.425 1.172 1.00 0.00 H new ATOM 0 HG21 VAL A 243 -2.113 -2.308 -0.530 1.00 0.00 H new ATOM 0 HG22 VAL A 243 -3.156 -1.295 0.497 1.00 0.00 H new ATOM 0 HG23 VAL A 243 -1.390 -1.259 0.713 1.00 0.00 H new ATOM 232 N GLY A 244 -3.833 -3.689 4.536 1.00 0.00 N ATOM 233 CA GLY A 244 -4.078 -4.752 5.492 1.00 0.00 C ATOM 234 C GLY A 244 -5.113 -5.746 5.003 1.00 0.00 C ATOM 235 O GLY A 244 -5.580 -5.658 3.868 1.00 0.00 O ATOM 0 H GLY A 244 -4.604 -3.031 4.420 1.00 0.00 H new ATOM 0 HA2 GLY A 244 -3.144 -5.276 5.695 1.00 0.00 H new ATOM 0 HA3 GLY A 244 -4.412 -4.319 6.435 1.00 0.00 H new ATOM 239 N GLY A 245 -5.472 -6.696 5.861 1.00 0.00 N ATOM 240 CA GLY A 245 -6.455 -7.697 5.490 1.00 0.00 C ATOM 241 C GLY A 245 -6.073 -8.446 4.228 1.00 0.00 C ATOM 242 O GLY A 245 -6.900 -8.638 3.337 1.00 0.00 O ATOM 0 H GLY A 245 -5.100 -6.790 6.806 1.00 0.00 H new ATOM 0 HA2 GLY A 245 -6.573 -8.407 6.309 1.00 0.00 H new ATOM 0 HA3 GLY A 245 -7.422 -7.216 5.344 1.00 0.00 H new ATOM 246 N LEU A 246 -4.815 -8.868 4.151 1.00 0.00 N ATOM 247 CA LEU A 246 -4.324 -9.598 2.988 1.00 0.00 C ATOM 248 C LEU A 246 -4.762 -11.058 3.036 1.00 0.00 C ATOM 249 O LEU A 246 -5.447 -11.541 2.136 1.00 0.00 O ATOM 250 CB LEU A 246 -2.798 -9.514 2.915 1.00 0.00 C ATOM 251 CG LEU A 246 -2.217 -8.138 2.588 1.00 0.00 C ATOM 252 CD1 LEU A 246 -0.708 -8.223 2.421 1.00 0.00 C ATOM 253 CD2 LEU A 246 -2.863 -7.571 1.332 1.00 0.00 C ATOM 0 H LEU A 246 -4.118 -8.717 4.880 1.00 0.00 H new ATOM 0 HA LEU A 246 -4.750 -9.139 2.096 1.00 0.00 H new ATOM 0 HB2 LEU A 246 -2.390 -9.841 3.871 1.00 0.00 H new ATOM 0 HB3 LEU A 246 -2.451 -10.221 2.162 1.00 0.00 H new ATOM 0 HG LEU A 246 -2.433 -7.466 3.419 1.00 0.00 H new ATOM 0 HD11 LEU A 246 -0.311 -7.235 2.189 1.00 0.00 H new ATOM 0 HD12 LEU A 246 -0.259 -8.586 3.346 1.00 0.00 H new ATOM 0 HD13 LEU A 246 -0.470 -8.910 1.609 1.00 0.00 H new ATOM 0 HD21 LEU A 246 -2.437 -6.591 1.114 1.00 0.00 H new ATOM 0 HD22 LEU A 246 -2.678 -8.242 0.493 1.00 0.00 H new ATOM 0 HD23 LEU A 246 -3.937 -7.473 1.488 1.00 0.00 H new ATOM 265 N GLY A 247 -4.364 -11.756 4.096 1.00 0.00 N ATOM 266 CA GLY A 247 -4.727 -13.153 4.243 1.00 0.00 C ATOM 267 C GLY A 247 -4.157 -14.020 3.138 1.00 0.00 C ATOM 268 O GLY A 247 -3.899 -13.540 2.034 1.00 0.00 O ATOM 0 H GLY A 247 -3.797 -11.378 4.855 1.00 0.00 H new ATOM 0 HA2 GLY A 247 -4.372 -13.518 5.207 1.00 0.00 H new ATOM 0 HA3 GLY A 247 -5.813 -13.244 4.248 1.00 0.00 H new ATOM 272 N ASP A 248 -3.958 -15.299 3.435 1.00 0.00 N ATOM 273 CA ASP A 248 -3.413 -16.235 2.458 1.00 0.00 C ATOM 274 C ASP A 248 -4.038 -16.012 1.085 1.00 0.00 C ATOM 275 O ASP A 248 -3.364 -16.115 0.059 1.00 0.00 O ATOM 276 CB ASP A 248 -3.652 -17.676 2.913 1.00 0.00 C ATOM 277 CG ASP A 248 -3.199 -17.916 4.340 1.00 0.00 C ATOM 278 OD1 ASP A 248 -1.975 -17.895 4.585 1.00 0.00 O ATOM 279 OD2 ASP A 248 -4.069 -18.122 5.211 1.00 0.00 O ATOM 0 H ASP A 248 -4.166 -15.712 4.344 1.00 0.00 H new ATOM 0 HA ASP A 248 -2.340 -16.059 2.382 1.00 0.00 H new ATOM 0 HB2 ASP A 248 -4.713 -17.909 2.828 1.00 0.00 H new ATOM 0 HB3 ASP A 248 -3.121 -18.357 2.247 1.00 0.00 H new ATOM 284 N THR A 249 -5.332 -15.707 1.071 1.00 0.00 N ATOM 285 CA THR A 249 -6.049 -15.471 -0.176 1.00 0.00 C ATOM 286 C THR A 249 -5.296 -14.490 -1.066 1.00 0.00 C ATOM 287 O THR A 249 -5.164 -14.706 -2.271 1.00 0.00 O ATOM 288 CB THR A 249 -7.466 -14.926 0.085 1.00 0.00 C ATOM 289 OG1 THR A 249 -7.397 -13.753 0.903 1.00 0.00 O ATOM 290 CG2 THR A 249 -8.332 -15.975 0.766 1.00 0.00 C ATOM 0 H THR A 249 -5.905 -15.618 1.910 1.00 0.00 H new ATOM 0 HA THR A 249 -6.125 -16.433 -0.683 1.00 0.00 H new ATOM 0 HB THR A 249 -7.916 -14.673 -0.875 1.00 0.00 H new ATOM 0 HG1 THR A 249 -7.604 -13.989 1.831 1.00 0.00 H new ATOM 0 HG21 THR A 249 -9.328 -15.567 0.940 1.00 0.00 H new ATOM 0 HG22 THR A 249 -8.407 -16.855 0.128 1.00 0.00 H new ATOM 0 HG23 THR A 249 -7.883 -16.255 1.719 1.00 0.00 H new ATOM 298 N ILE A 250 -4.802 -13.412 -0.466 1.00 0.00 N ATOM 299 CA ILE A 250 -4.060 -12.399 -1.205 1.00 0.00 C ATOM 300 C ILE A 250 -2.556 -12.617 -1.078 1.00 0.00 C ATOM 301 O ILE A 250 -2.068 -13.069 -0.042 1.00 0.00 O ATOM 302 CB ILE A 250 -4.405 -10.979 -0.716 1.00 0.00 C ATOM 303 CG1 ILE A 250 -5.909 -10.727 -0.835 1.00 0.00 C ATOM 304 CG2 ILE A 250 -3.624 -9.942 -1.509 1.00 0.00 C ATOM 305 CD1 ILE A 250 -6.378 -9.502 -0.081 1.00 0.00 C ATOM 0 H ILE A 250 -4.903 -13.218 0.530 1.00 0.00 H new ATOM 0 HA ILE A 250 -4.352 -12.495 -2.251 1.00 0.00 H new ATOM 0 HB ILE A 250 -4.123 -10.893 0.333 1.00 0.00 H new ATOM 0 HG12 ILE A 250 -6.169 -10.617 -1.888 1.00 0.00 H new ATOM 0 HG13 ILE A 250 -6.446 -11.600 -0.464 1.00 0.00 H new ATOM 0 HG21 ILE A 250 -3.878 -8.944 -1.152 1.00 0.00 H new ATOM 0 HG22 ILE A 250 -2.555 -10.113 -1.378 1.00 0.00 H new ATOM 0 HG23 ILE A 250 -3.878 -10.025 -2.566 1.00 0.00 H new ATOM 0 HD11 ILE A 250 -7.454 -9.385 -0.210 1.00 0.00 H new ATOM 0 HD12 ILE A 250 -6.150 -9.618 0.979 1.00 0.00 H new ATOM 0 HD13 ILE A 250 -5.868 -8.619 -0.468 1.00 0.00 H new ATOM 317 N THR A 251 -1.825 -12.291 -2.140 1.00 0.00 N ATOM 318 CA THR A 251 -0.376 -12.450 -2.147 1.00 0.00 C ATOM 319 C THR A 251 0.318 -11.147 -2.526 1.00 0.00 C ATOM 320 O THR A 251 -0.335 -10.130 -2.758 1.00 0.00 O ATOM 321 CB THR A 251 0.062 -13.556 -3.126 1.00 0.00 C ATOM 322 OG1 THR A 251 -0.269 -13.182 -4.468 1.00 0.00 O ATOM 323 CG2 THR A 251 -0.606 -14.878 -2.783 1.00 0.00 C ATOM 0 H THR A 251 -2.213 -11.916 -3.006 1.00 0.00 H new ATOM 0 HA THR A 251 -0.083 -12.733 -1.136 1.00 0.00 H new ATOM 0 HB THR A 251 1.142 -13.680 -3.040 1.00 0.00 H new ATOM 0 HG1 THR A 251 -1.238 -13.060 -4.544 1.00 0.00 H new ATOM 0 HG21 THR A 251 -0.281 -15.643 -3.488 1.00 0.00 H new ATOM 0 HG22 THR A 251 -0.328 -15.175 -1.772 1.00 0.00 H new ATOM 0 HG23 THR A 251 -1.688 -14.765 -2.843 1.00 0.00 H new ATOM 331 N GLU A 252 1.646 -11.185 -2.588 1.00 0.00 N ATOM 332 CA GLU A 252 2.428 -10.006 -2.940 1.00 0.00 C ATOM 333 C GLU A 252 2.171 -9.594 -4.386 1.00 0.00 C ATOM 334 O GLU A 252 1.761 -8.465 -4.660 1.00 0.00 O ATOM 335 CB GLU A 252 3.919 -10.275 -2.732 1.00 0.00 C ATOM 336 CG GLU A 252 4.819 -9.189 -3.298 1.00 0.00 C ATOM 337 CD GLU A 252 5.219 -9.454 -4.736 1.00 0.00 C ATOM 338 OE1 GLU A 252 6.081 -10.330 -4.960 1.00 0.00 O ATOM 339 OE2 GLU A 252 4.672 -8.786 -5.638 1.00 0.00 O ATOM 0 H GLU A 252 2.202 -12.019 -2.399 1.00 0.00 H new ATOM 0 HA GLU A 252 2.119 -9.189 -2.288 1.00 0.00 H new ATOM 0 HB2 GLU A 252 4.115 -10.378 -1.665 1.00 0.00 H new ATOM 0 HB3 GLU A 252 4.176 -11.227 -3.197 1.00 0.00 H new ATOM 0 HG2 GLU A 252 4.306 -8.229 -3.239 1.00 0.00 H new ATOM 0 HG3 GLU A 252 5.716 -9.109 -2.684 1.00 0.00 H new ATOM 346 N THR A 253 2.414 -10.517 -5.311 1.00 0.00 N ATOM 347 CA THR A 253 2.212 -10.251 -6.729 1.00 0.00 C ATOM 348 C THR A 253 0.862 -9.589 -6.977 1.00 0.00 C ATOM 349 O THR A 253 0.785 -8.524 -7.590 1.00 0.00 O ATOM 350 CB THR A 253 2.297 -11.545 -7.561 1.00 0.00 C ATOM 351 OG1 THR A 253 3.584 -12.150 -7.396 1.00 0.00 O ATOM 352 CG2 THR A 253 2.051 -11.258 -9.035 1.00 0.00 C ATOM 0 H THR A 253 2.752 -11.457 -5.103 1.00 0.00 H new ATOM 0 HA THR A 253 3.008 -9.575 -7.040 1.00 0.00 H new ATOM 0 HB THR A 253 1.526 -12.230 -7.207 1.00 0.00 H new ATOM 0 HG1 THR A 253 3.629 -12.973 -7.927 1.00 0.00 H new ATOM 0 HG21 THR A 253 2.116 -12.186 -9.602 1.00 0.00 H new ATOM 0 HG22 THR A 253 1.059 -10.825 -9.161 1.00 0.00 H new ATOM 0 HG23 THR A 253 2.802 -10.557 -9.399 1.00 0.00 H new ATOM 360 N ASP A 254 -0.201 -10.225 -6.497 1.00 0.00 N ATOM 361 CA ASP A 254 -1.550 -9.696 -6.665 1.00 0.00 C ATOM 362 C ASP A 254 -1.570 -8.185 -6.460 1.00 0.00 C ATOM 363 O ASP A 254 -2.173 -7.449 -7.242 1.00 0.00 O ATOM 364 CB ASP A 254 -2.511 -10.370 -5.684 1.00 0.00 C ATOM 365 CG ASP A 254 -3.147 -11.618 -6.262 1.00 0.00 C ATOM 366 OD1 ASP A 254 -3.451 -11.623 -7.473 1.00 0.00 O ATOM 367 OD2 ASP A 254 -3.341 -12.591 -5.503 1.00 0.00 O ATOM 0 H ASP A 254 -0.155 -11.108 -5.988 1.00 0.00 H new ATOM 0 HA ASP A 254 -1.874 -9.910 -7.683 1.00 0.00 H new ATOM 0 HB2 ASP A 254 -1.972 -10.629 -4.772 1.00 0.00 H new ATOM 0 HB3 ASP A 254 -3.293 -9.664 -5.403 1.00 0.00 H new ATOM 372 N LEU A 255 -0.908 -7.728 -5.403 1.00 0.00 N ATOM 373 CA LEU A 255 -0.850 -6.303 -5.093 1.00 0.00 C ATOM 374 C LEU A 255 0.085 -5.575 -6.053 1.00 0.00 C ATOM 375 O LEU A 255 -0.252 -4.512 -6.575 1.00 0.00 O ATOM 376 CB LEU A 255 -0.383 -6.093 -3.651 1.00 0.00 C ATOM 377 CG LEU A 255 -1.077 -6.947 -2.590 1.00 0.00 C ATOM 378 CD1 LEU A 255 -0.212 -7.058 -1.344 1.00 0.00 C ATOM 379 CD2 LEU A 255 -2.440 -6.365 -2.245 1.00 0.00 C ATOM 0 H LEU A 255 -0.404 -8.323 -4.746 1.00 0.00 H new ATOM 0 HA LEU A 255 -1.852 -5.890 -5.208 1.00 0.00 H new ATOM 0 HB2 LEU A 255 0.688 -6.291 -3.605 1.00 0.00 H new ATOM 0 HB3 LEU A 255 -0.525 -5.043 -3.394 1.00 0.00 H new ATOM 0 HG LEU A 255 -1.223 -7.948 -2.996 1.00 0.00 H new ATOM 0 HD11 LEU A 255 -0.722 -7.669 -0.600 1.00 0.00 H new ATOM 0 HD12 LEU A 255 0.741 -7.521 -1.602 1.00 0.00 H new ATOM 0 HD13 LEU A 255 -0.033 -6.063 -0.935 1.00 0.00 H new ATOM 0 HD21 LEU A 255 -2.920 -6.986 -1.488 1.00 0.00 H new ATOM 0 HD22 LEU A 255 -2.316 -5.353 -1.859 1.00 0.00 H new ATOM 0 HD23 LEU A 255 -3.062 -6.339 -3.140 1.00 0.00 H new ATOM 391 N ARG A 256 1.258 -6.155 -6.284 1.00 0.00 N ATOM 392 CA ARG A 256 2.240 -5.561 -7.182 1.00 0.00 C ATOM 393 C ARG A 256 1.595 -5.160 -8.505 1.00 0.00 C ATOM 394 O ARG A 256 1.820 -4.060 -9.009 1.00 0.00 O ATOM 395 CB ARG A 256 3.387 -6.541 -7.438 1.00 0.00 C ATOM 396 CG ARG A 256 4.560 -5.925 -8.183 1.00 0.00 C ATOM 397 CD ARG A 256 5.522 -6.990 -8.684 1.00 0.00 C ATOM 398 NE ARG A 256 4.956 -7.766 -9.784 1.00 0.00 N ATOM 399 CZ ARG A 256 5.006 -7.384 -11.056 1.00 0.00 C ATOM 400 NH1 ARG A 256 5.594 -6.243 -11.386 1.00 0.00 N ATOM 401 NH2 ARG A 256 4.467 -8.145 -12.000 1.00 0.00 N ATOM 0 H ARG A 256 1.551 -7.036 -5.861 1.00 0.00 H new ATOM 0 HA ARG A 256 2.636 -4.665 -6.705 1.00 0.00 H new ATOM 0 HB2 ARG A 256 3.739 -6.932 -6.484 1.00 0.00 H new ATOM 0 HB3 ARG A 256 3.009 -7.388 -8.010 1.00 0.00 H new ATOM 0 HG2 ARG A 256 4.191 -5.341 -9.026 1.00 0.00 H new ATOM 0 HG3 ARG A 256 5.089 -5.236 -7.525 1.00 0.00 H new ATOM 0 HD2 ARG A 256 6.447 -6.517 -9.013 1.00 0.00 H new ATOM 0 HD3 ARG A 256 5.781 -7.660 -7.864 1.00 0.00 H new ATOM 0 HE ARG A 256 4.497 -8.650 -9.564 1.00 0.00 H new ATOM 0 HH11 ARG A 256 6.010 -5.656 -10.663 1.00 0.00 H new ATOM 0 HH12 ARG A 256 5.631 -5.952 -12.363 1.00 0.00 H new ATOM 0 HH21 ARG A 256 4.014 -9.024 -11.750 1.00 0.00 H new ATOM 0 HH22 ARG A 256 4.506 -7.851 -12.976 1.00 0.00 H new ATOM 415 N ASN A 257 0.792 -6.060 -9.063 1.00 0.00 N ATOM 416 CA ASN A 257 0.114 -5.801 -10.328 1.00 0.00 C ATOM 417 C ASN A 257 -1.072 -4.863 -10.127 1.00 0.00 C ATOM 418 O ASN A 257 -1.335 -3.991 -10.957 1.00 0.00 O ATOM 419 CB ASN A 257 -0.360 -7.114 -10.955 1.00 0.00 C ATOM 420 CG ASN A 257 0.741 -7.816 -11.728 1.00 0.00 C ATOM 421 OD1 ASN A 257 1.119 -7.387 -12.818 1.00 0.00 O ATOM 422 ND2 ASN A 257 1.259 -8.900 -11.165 1.00 0.00 N ATOM 0 H ASN A 257 0.595 -6.976 -8.659 1.00 0.00 H new ATOM 0 HA ASN A 257 0.824 -5.321 -11.001 1.00 0.00 H new ATOM 0 HB2 ASN A 257 -0.729 -7.776 -10.171 1.00 0.00 H new ATOM 0 HB3 ASN A 257 -1.198 -6.913 -11.623 1.00 0.00 H new ATOM 0 HD21 ASN A 257 2.002 -9.414 -11.638 1.00 0.00 H new ATOM 0 HD22 ASN A 257 0.914 -9.219 -10.260 1.00 0.00 H new ATOM 429 N HIS A 258 -1.785 -5.048 -9.021 1.00 0.00 N ATOM 430 CA HIS A 258 -2.943 -4.217 -8.710 1.00 0.00 C ATOM 431 C HIS A 258 -2.539 -2.753 -8.568 1.00 0.00 C ATOM 432 O HIS A 258 -3.297 -1.851 -8.927 1.00 0.00 O ATOM 433 CB HIS A 258 -3.613 -4.700 -7.423 1.00 0.00 C ATOM 434 CG HIS A 258 -5.039 -4.262 -7.290 1.00 0.00 C ATOM 435 ND1 HIS A 258 -6.192 -4.970 -7.340 1.00 0.00 N flip ATOM 436 CD2 HIS A 258 -5.406 -2.950 -7.078 1.00 0.00 C flip ATOM 437 CE1 HIS A 258 -7.223 -4.082 -7.159 1.00 0.00 C flip ATOM 438 NE2 HIS A 258 -6.723 -2.870 -7.002 1.00 0.00 N flip ATOM 0 H HIS A 258 -1.582 -5.766 -8.325 1.00 0.00 H new ATOM 0 HA HIS A 258 -3.652 -4.302 -9.534 1.00 0.00 H new ATOM 0 HB2 HIS A 258 -3.571 -5.789 -7.388 1.00 0.00 H new ATOM 0 HB3 HIS A 258 -3.047 -4.331 -6.568 1.00 0.00 H new ATOM 0 HD2 HIS A 258 -4.724 -2.118 -6.988 1.00 0.00 H new ATOM 0 HE1 HIS A 258 -8.273 -4.334 -7.147 1.00 0.00 H new ATOM 0 HE2 HIS A 258 -7.261 -2.017 -6.848 1.00 0.00 H new ATOM 446 N PHE A 259 -1.341 -2.523 -8.042 1.00 0.00 N ATOM 447 CA PHE A 259 -0.837 -1.168 -7.850 1.00 0.00 C ATOM 448 C PHE A 259 0.019 -0.733 -9.037 1.00 0.00 C ATOM 449 O PHE A 259 -0.048 0.414 -9.477 1.00 0.00 O ATOM 450 CB PHE A 259 -0.020 -1.082 -6.559 1.00 0.00 C ATOM 451 CG PHE A 259 -0.862 -1.094 -5.316 1.00 0.00 C ATOM 452 CD1 PHE A 259 -1.574 0.032 -4.934 1.00 0.00 C ATOM 453 CD2 PHE A 259 -0.942 -2.231 -4.528 1.00 0.00 C ATOM 454 CE1 PHE A 259 -2.348 0.024 -3.789 1.00 0.00 C ATOM 455 CE2 PHE A 259 -1.716 -2.246 -3.383 1.00 0.00 C ATOM 456 CZ PHE A 259 -2.421 -1.117 -3.014 1.00 0.00 C ATOM 0 H PHE A 259 -0.701 -3.258 -7.741 1.00 0.00 H new ATOM 0 HA PHE A 259 -1.692 -0.497 -7.775 1.00 0.00 H new ATOM 0 HB2 PHE A 259 0.678 -1.918 -6.524 1.00 0.00 H new ATOM 0 HB3 PHE A 259 0.576 -0.170 -6.576 1.00 0.00 H new ATOM 0 HD1 PHE A 259 -1.523 0.926 -5.538 1.00 0.00 H new ATOM 0 HD2 PHE A 259 -0.393 -3.116 -4.812 1.00 0.00 H new ATOM 0 HE1 PHE A 259 -2.895 0.909 -3.500 1.00 0.00 H new ATOM 0 HE2 PHE A 259 -1.769 -3.139 -2.778 1.00 0.00 H new ATOM 0 HZ PHE A 259 -3.028 -1.126 -2.121 1.00 0.00 H new ATOM 466 N TYR A 260 0.823 -1.659 -9.549 1.00 0.00 N ATOM 467 CA TYR A 260 1.694 -1.372 -10.682 1.00 0.00 C ATOM 468 C TYR A 260 0.955 -0.570 -11.749 1.00 0.00 C ATOM 469 O TYR A 260 1.520 0.335 -12.362 1.00 0.00 O ATOM 470 CB TYR A 260 2.228 -2.673 -11.284 1.00 0.00 C ATOM 471 CG TYR A 260 2.467 -2.596 -12.775 1.00 0.00 C ATOM 472 CD1 TYR A 260 3.559 -1.907 -13.288 1.00 0.00 C ATOM 473 CD2 TYR A 260 1.602 -3.212 -13.670 1.00 0.00 C ATOM 474 CE1 TYR A 260 3.782 -1.834 -14.650 1.00 0.00 C ATOM 475 CE2 TYR A 260 1.817 -3.145 -15.033 1.00 0.00 C ATOM 476 CZ TYR A 260 2.909 -2.455 -15.518 1.00 0.00 C ATOM 477 OH TYR A 260 3.126 -2.385 -16.875 1.00 0.00 O ATOM 0 H TYR A 260 0.889 -2.614 -9.197 1.00 0.00 H new ATOM 0 HA TYR A 260 2.532 -0.775 -10.321 1.00 0.00 H new ATOM 0 HB2 TYR A 260 3.162 -2.937 -10.788 1.00 0.00 H new ATOM 0 HB3 TYR A 260 1.520 -3.476 -11.079 1.00 0.00 H new ATOM 0 HD1 TYR A 260 4.245 -1.420 -12.611 1.00 0.00 H new ATOM 0 HD2 TYR A 260 0.746 -3.753 -13.294 1.00 0.00 H new ATOM 0 HE1 TYR A 260 4.635 -1.294 -15.032 1.00 0.00 H new ATOM 0 HE2 TYR A 260 1.134 -3.630 -15.715 1.00 0.00 H new ATOM 0 HH TYR A 260 2.420 -2.876 -17.345 1.00 0.00 H new ATOM 487 N GLN A 261 -0.312 -0.910 -11.962 1.00 0.00 N ATOM 488 CA GLN A 261 -1.130 -0.222 -12.955 1.00 0.00 C ATOM 489 C GLN A 261 -1.051 1.290 -12.772 1.00 0.00 C ATOM 490 O GLN A 261 -0.924 2.038 -13.742 1.00 0.00 O ATOM 491 CB GLN A 261 -2.584 -0.684 -12.857 1.00 0.00 C ATOM 492 CG GLN A 261 -3.281 -0.235 -11.583 1.00 0.00 C ATOM 493 CD GLN A 261 -4.754 -0.594 -11.566 1.00 0.00 C ATOM 494 OE1 GLN A 261 -5.422 -0.572 -12.600 1.00 0.00 O ATOM 495 NE2 GLN A 261 -5.269 -0.927 -10.388 1.00 0.00 N ATOM 0 H GLN A 261 -0.794 -1.656 -11.461 1.00 0.00 H new ATOM 0 HA GLN A 261 -0.743 -0.471 -13.943 1.00 0.00 H new ATOM 0 HB2 GLN A 261 -3.136 -0.304 -13.716 1.00 0.00 H new ATOM 0 HB3 GLN A 261 -2.615 -1.772 -12.914 1.00 0.00 H new ATOM 0 HG2 GLN A 261 -2.790 -0.692 -10.724 1.00 0.00 H new ATOM 0 HG3 GLN A 261 -3.173 0.844 -11.475 1.00 0.00 H new ATOM 0 HE21 GLN A 261 -4.679 -0.932 -9.556 1.00 0.00 H new ATOM 0 HE22 GLN A 261 -6.255 -1.178 -10.315 1.00 0.00 H new ATOM 504 N PHE A 262 -1.128 1.735 -11.521 1.00 0.00 N ATOM 505 CA PHE A 262 -1.067 3.158 -11.211 1.00 0.00 C ATOM 506 C PHE A 262 0.256 3.760 -11.675 1.00 0.00 C ATOM 507 O PHE A 262 0.283 4.808 -12.319 1.00 0.00 O ATOM 508 CB PHE A 262 -1.242 3.382 -9.707 1.00 0.00 C ATOM 509 CG PHE A 262 -2.610 3.020 -9.203 1.00 0.00 C ATOM 510 CD1 PHE A 262 -2.928 1.704 -8.907 1.00 0.00 C ATOM 511 CD2 PHE A 262 -3.577 3.996 -9.024 1.00 0.00 C ATOM 512 CE1 PHE A 262 -4.186 1.369 -8.443 1.00 0.00 C ATOM 513 CE2 PHE A 262 -4.837 3.666 -8.560 1.00 0.00 C ATOM 514 CZ PHE A 262 -5.141 2.351 -8.269 1.00 0.00 C ATOM 0 H PHE A 262 -1.233 1.130 -10.706 1.00 0.00 H new ATOM 0 HA PHE A 262 -1.878 3.655 -11.743 1.00 0.00 H new ATOM 0 HB2 PHE A 262 -0.498 2.793 -9.171 1.00 0.00 H new ATOM 0 HB3 PHE A 262 -1.044 4.429 -9.478 1.00 0.00 H new ATOM 0 HD1 PHE A 262 -2.185 0.932 -9.040 1.00 0.00 H new ATOM 0 HD2 PHE A 262 -3.344 5.026 -9.249 1.00 0.00 H new ATOM 0 HE1 PHE A 262 -4.422 0.340 -8.217 1.00 0.00 H new ATOM 0 HE2 PHE A 262 -5.582 4.436 -8.425 1.00 0.00 H new ATOM 0 HZ PHE A 262 -6.124 2.091 -7.906 1.00 0.00 H new ATOM 524 N GLY A 263 1.355 3.087 -11.343 1.00 0.00 N ATOM 525 CA GLY A 263 2.666 3.570 -11.733 1.00 0.00 C ATOM 526 C GLY A 263 3.779 2.633 -11.307 1.00 0.00 C ATOM 527 O GLY A 263 3.525 1.494 -10.920 1.00 0.00 O ATOM 0 H GLY A 263 1.360 2.217 -10.811 1.00 0.00 H new ATOM 0 HA2 GLY A 263 2.696 3.697 -12.815 1.00 0.00 H new ATOM 0 HA3 GLY A 263 2.834 4.553 -11.292 1.00 0.00 H new ATOM 531 N GLU A 264 5.016 3.114 -11.381 1.00 0.00 N ATOM 532 CA GLU A 264 6.172 2.309 -11.002 1.00 0.00 C ATOM 533 C GLU A 264 6.195 2.066 -9.496 1.00 0.00 C ATOM 534 O GLU A 264 6.120 3.006 -8.704 1.00 0.00 O ATOM 535 CB GLU A 264 7.466 2.998 -11.439 1.00 0.00 C ATOM 536 CG GLU A 264 8.723 2.247 -11.031 1.00 0.00 C ATOM 537 CD GLU A 264 9.973 2.804 -11.684 1.00 0.00 C ATOM 538 OE1 GLU A 264 9.910 3.155 -12.881 1.00 0.00 O ATOM 539 OE2 GLU A 264 11.014 2.888 -11.000 1.00 0.00 O ATOM 0 H GLU A 264 5.244 4.056 -11.699 1.00 0.00 H new ATOM 0 HA GLU A 264 6.094 1.346 -11.507 1.00 0.00 H new ATOM 0 HB2 GLU A 264 7.458 3.114 -12.523 1.00 0.00 H new ATOM 0 HB3 GLU A 264 7.497 4.000 -11.011 1.00 0.00 H new ATOM 0 HG2 GLU A 264 8.833 2.292 -9.947 1.00 0.00 H new ATOM 0 HG3 GLU A 264 8.616 1.195 -11.297 1.00 0.00 H new ATOM 546 N ILE A 265 6.300 0.799 -9.109 1.00 0.00 N ATOM 547 CA ILE A 265 6.334 0.433 -7.698 1.00 0.00 C ATOM 548 C ILE A 265 7.768 0.274 -7.206 1.00 0.00 C ATOM 549 O ILE A 265 8.466 -0.665 -7.589 1.00 0.00 O ATOM 550 CB ILE A 265 5.566 -0.877 -7.438 1.00 0.00 C ATOM 551 CG1 ILE A 265 4.086 -0.704 -7.788 1.00 0.00 C ATOM 552 CG2 ILE A 265 5.726 -1.306 -5.988 1.00 0.00 C ATOM 553 CD1 ILE A 265 3.335 -2.012 -7.900 1.00 0.00 C ATOM 0 H ILE A 265 6.363 0.010 -9.752 1.00 0.00 H new ATOM 0 HA ILE A 265 5.852 1.243 -7.150 1.00 0.00 H new ATOM 0 HB ILE A 265 5.982 -1.657 -8.075 1.00 0.00 H new ATOM 0 HG12 ILE A 265 3.611 -0.086 -7.027 1.00 0.00 H new ATOM 0 HG13 ILE A 265 4.005 -0.166 -8.732 1.00 0.00 H new ATOM 0 HG21 ILE A 265 5.178 -2.233 -5.820 1.00 0.00 H new ATOM 0 HG22 ILE A 265 6.782 -1.465 -5.770 1.00 0.00 H new ATOM 0 HG23 ILE A 265 5.333 -0.528 -5.333 1.00 0.00 H new ATOM 0 HD11 ILE A 265 2.293 -1.813 -8.150 1.00 0.00 H new ATOM 0 HD12 ILE A 265 3.785 -2.624 -8.681 1.00 0.00 H new ATOM 0 HD13 ILE A 265 3.385 -2.543 -6.949 1.00 0.00 H new ATOM 565 N ARG A 266 8.200 1.197 -6.353 1.00 0.00 N ATOM 566 CA ARG A 266 9.552 1.160 -5.807 1.00 0.00 C ATOM 567 C ARG A 266 9.839 -0.191 -5.159 1.00 0.00 C ATOM 568 O ARG A 266 10.847 -0.833 -5.455 1.00 0.00 O ATOM 569 CB ARG A 266 9.742 2.280 -4.783 1.00 0.00 C ATOM 570 CG ARG A 266 10.290 3.565 -5.380 1.00 0.00 C ATOM 571 CD ARG A 266 11.166 4.312 -4.387 1.00 0.00 C ATOM 572 NE ARG A 266 12.570 3.923 -4.493 1.00 0.00 N ATOM 573 CZ ARG A 266 13.577 4.687 -4.086 1.00 0.00 C ATOM 574 NH1 ARG A 266 13.338 5.874 -3.547 1.00 0.00 N ATOM 575 NH2 ARG A 266 14.828 4.262 -4.216 1.00 0.00 N ATOM 0 H ARG A 266 7.634 1.979 -6.025 1.00 0.00 H new ATOM 0 HA ARG A 266 10.253 1.306 -6.629 1.00 0.00 H new ATOM 0 HB2 ARG A 266 8.785 2.490 -4.306 1.00 0.00 H new ATOM 0 HB3 ARG A 266 10.419 1.935 -4.001 1.00 0.00 H new ATOM 0 HG2 ARG A 266 10.868 3.334 -6.275 1.00 0.00 H new ATOM 0 HG3 ARG A 266 9.464 4.204 -5.691 1.00 0.00 H new ATOM 0 HD2 ARG A 266 11.073 5.385 -4.558 1.00 0.00 H new ATOM 0 HD3 ARG A 266 10.812 4.119 -3.374 1.00 0.00 H new ATOM 0 HE ARG A 266 12.789 3.015 -4.902 1.00 0.00 H new ATOM 0 HH11 ARG A 266 12.378 6.203 -3.444 1.00 0.00 H new ATOM 0 HH12 ARG A 266 14.114 6.458 -3.235 1.00 0.00 H new ATOM 0 HH21 ARG A 266 15.016 3.348 -4.629 1.00 0.00 H new ATOM 0 HH22 ARG A 266 15.601 4.849 -3.903 1.00 0.00 H new ATOM 589 N THR A 267 8.946 -0.618 -4.272 1.00 0.00 N ATOM 590 CA THR A 267 9.103 -1.891 -3.580 1.00 0.00 C ATOM 591 C THR A 267 7.800 -2.323 -2.919 1.00 0.00 C ATOM 592 O THR A 267 6.847 -1.547 -2.838 1.00 0.00 O ATOM 593 CB THR A 267 10.208 -1.816 -2.509 1.00 0.00 C ATOM 594 OG1 THR A 267 10.514 -3.129 -2.028 1.00 0.00 O ATOM 595 CG2 THR A 267 9.778 -0.932 -1.348 1.00 0.00 C ATOM 0 H THR A 267 8.105 -0.100 -4.016 1.00 0.00 H new ATOM 0 HA THR A 267 9.386 -2.626 -4.333 1.00 0.00 H new ATOM 0 HB THR A 267 11.097 -1.381 -2.966 1.00 0.00 H new ATOM 0 HG1 THR A 267 11.218 -3.073 -1.349 1.00 0.00 H new ATOM 0 HG21 THR A 267 10.574 -0.895 -0.605 1.00 0.00 H new ATOM 0 HG22 THR A 267 9.575 0.075 -1.713 1.00 0.00 H new ATOM 0 HG23 THR A 267 8.876 -1.342 -0.893 1.00 0.00 H new ATOM 603 N ILE A 268 7.764 -3.564 -2.446 1.00 0.00 N ATOM 604 CA ILE A 268 6.577 -4.098 -1.790 1.00 0.00 C ATOM 605 C ILE A 268 6.953 -5.065 -0.673 1.00 0.00 C ATOM 606 O ILE A 268 7.513 -6.133 -0.924 1.00 0.00 O ATOM 607 CB ILE A 268 5.657 -4.821 -2.792 1.00 0.00 C ATOM 608 CG1 ILE A 268 5.196 -3.854 -3.885 1.00 0.00 C ATOM 609 CG2 ILE A 268 4.460 -5.424 -2.072 1.00 0.00 C ATOM 610 CD1 ILE A 268 4.432 -4.527 -5.003 1.00 0.00 C ATOM 0 H ILE A 268 8.544 -4.219 -2.505 1.00 0.00 H new ATOM 0 HA ILE A 268 6.042 -3.248 -1.366 1.00 0.00 H new ATOM 0 HB ILE A 268 6.219 -5.628 -3.261 1.00 0.00 H new ATOM 0 HG12 ILE A 268 4.566 -3.085 -3.437 1.00 0.00 H new ATOM 0 HG13 ILE A 268 6.067 -3.349 -4.303 1.00 0.00 H new ATOM 0 HG21 ILE A 268 3.819 -5.931 -2.793 1.00 0.00 H new ATOM 0 HG22 ILE A 268 4.806 -6.141 -1.327 1.00 0.00 H new ATOM 0 HG23 ILE A 268 3.895 -4.633 -1.579 1.00 0.00 H new ATOM 0 HD11 ILE A 268 4.137 -3.782 -5.742 1.00 0.00 H new ATOM 0 HD12 ILE A 268 5.066 -5.277 -5.477 1.00 0.00 H new ATOM 0 HD13 ILE A 268 3.542 -5.008 -4.597 1.00 0.00 H new ATOM 622 N THR A 269 6.642 -4.684 0.562 1.00 0.00 N ATOM 623 CA THR A 269 6.947 -5.518 1.718 1.00 0.00 C ATOM 624 C THR A 269 5.677 -6.110 2.319 1.00 0.00 C ATOM 625 O THR A 269 4.969 -5.447 3.077 1.00 0.00 O ATOM 626 CB THR A 269 7.691 -4.720 2.805 1.00 0.00 C ATOM 627 OG1 THR A 269 8.906 -4.180 2.271 1.00 0.00 O ATOM 628 CG2 THR A 269 8.006 -5.601 4.004 1.00 0.00 C ATOM 0 H THR A 269 6.179 -3.803 0.787 1.00 0.00 H new ATOM 0 HA THR A 269 7.590 -6.325 1.365 1.00 0.00 H new ATOM 0 HB THR A 269 7.045 -3.906 3.133 1.00 0.00 H new ATOM 0 HG1 THR A 269 9.372 -3.673 2.968 1.00 0.00 H new ATOM 0 HG21 THR A 269 8.531 -5.015 4.758 1.00 0.00 H new ATOM 0 HG22 THR A 269 7.078 -5.987 4.426 1.00 0.00 H new ATOM 0 HG23 THR A 269 8.635 -6.434 3.689 1.00 0.00 H new ATOM 636 N VAL A 270 5.395 -7.363 1.976 1.00 0.00 N ATOM 637 CA VAL A 270 4.211 -8.046 2.484 1.00 0.00 C ATOM 638 C VAL A 270 4.530 -8.830 3.752 1.00 0.00 C ATOM 639 O VAL A 270 5.245 -9.831 3.714 1.00 0.00 O ATOM 640 CB VAL A 270 3.625 -9.008 1.433 1.00 0.00 C ATOM 641 CG1 VAL A 270 2.417 -9.742 1.996 1.00 0.00 C ATOM 642 CG2 VAL A 270 3.257 -8.252 0.166 1.00 0.00 C ATOM 0 H VAL A 270 5.970 -7.925 1.349 1.00 0.00 H new ATOM 0 HA VAL A 270 3.475 -7.276 2.713 1.00 0.00 H new ATOM 0 HB VAL A 270 4.384 -9.748 1.179 1.00 0.00 H new ATOM 0 HG11 VAL A 270 2.016 -10.417 1.240 1.00 0.00 H new ATOM 0 HG12 VAL A 270 2.716 -10.316 2.873 1.00 0.00 H new ATOM 0 HG13 VAL A 270 1.652 -9.019 2.279 1.00 0.00 H new ATOM 0 HG21 VAL A 270 2.845 -8.947 -0.566 1.00 0.00 H new ATOM 0 HG22 VAL A 270 2.515 -7.489 0.400 1.00 0.00 H new ATOM 0 HG23 VAL A 270 4.148 -7.777 -0.246 1.00 0.00 H new ATOM 652 N VAL A 271 3.994 -8.367 4.877 1.00 0.00 N ATOM 653 CA VAL A 271 4.219 -9.025 6.159 1.00 0.00 C ATOM 654 C VAL A 271 3.099 -10.009 6.476 1.00 0.00 C ATOM 655 O VAL A 271 2.016 -9.612 6.907 1.00 0.00 O ATOM 656 CB VAL A 271 4.329 -8.001 7.304 1.00 0.00 C ATOM 657 CG1 VAL A 271 4.695 -8.694 8.607 1.00 0.00 C ATOM 658 CG2 VAL A 271 5.346 -6.923 6.959 1.00 0.00 C ATOM 0 H VAL A 271 3.401 -7.539 4.927 1.00 0.00 H new ATOM 0 HA VAL A 271 5.161 -9.567 6.076 1.00 0.00 H new ATOM 0 HB VAL A 271 3.358 -7.523 7.435 1.00 0.00 H new ATOM 0 HG11 VAL A 271 4.768 -7.954 9.404 1.00 0.00 H new ATOM 0 HG12 VAL A 271 3.926 -9.424 8.859 1.00 0.00 H new ATOM 0 HG13 VAL A 271 5.653 -9.201 8.493 1.00 0.00 H new ATOM 0 HG21 VAL A 271 5.411 -6.208 7.779 1.00 0.00 H new ATOM 0 HG22 VAL A 271 6.322 -7.381 6.799 1.00 0.00 H new ATOM 0 HG23 VAL A 271 5.035 -6.406 6.051 1.00 0.00 H new ATOM 668 N GLN A 272 3.367 -11.292 6.261 1.00 0.00 N ATOM 669 CA GLN A 272 2.380 -12.333 6.525 1.00 0.00 C ATOM 670 C GLN A 272 1.953 -12.320 7.989 1.00 0.00 C ATOM 671 O GLN A 272 0.775 -12.489 8.303 1.00 0.00 O ATOM 672 CB GLN A 272 2.946 -13.706 6.159 1.00 0.00 C ATOM 673 CG GLN A 272 4.279 -14.012 6.823 1.00 0.00 C ATOM 674 CD GLN A 272 4.638 -15.483 6.761 1.00 0.00 C ATOM 675 OE1 GLN A 272 5.692 -15.855 6.244 1.00 0.00 O ATOM 676 NE2 GLN A 272 3.762 -16.330 7.288 1.00 0.00 N ATOM 0 H GLN A 272 4.259 -11.636 5.905 1.00 0.00 H new ATOM 0 HA GLN A 272 1.504 -12.133 5.908 1.00 0.00 H new ATOM 0 HB2 GLN A 272 2.225 -14.474 6.440 1.00 0.00 H new ATOM 0 HB3 GLN A 272 3.067 -13.763 5.077 1.00 0.00 H new ATOM 0 HG2 GLN A 272 5.063 -13.430 6.339 1.00 0.00 H new ATOM 0 HG3 GLN A 272 4.243 -13.694 7.865 1.00 0.00 H new ATOM 0 HE21 GLN A 272 2.901 -15.978 7.706 1.00 0.00 H new ATOM 0 HE22 GLN A 272 3.950 -17.332 7.274 1.00 0.00 H new ATOM 685 N ARG A 273 2.918 -12.118 8.880 1.00 0.00 N ATOM 686 CA ARG A 273 2.641 -12.085 10.311 1.00 0.00 C ATOM 687 C ARG A 273 1.694 -10.939 10.655 1.00 0.00 C ATOM 688 O ARG A 273 1.033 -10.959 11.693 1.00 0.00 O ATOM 689 CB ARG A 273 3.944 -11.939 11.101 1.00 0.00 C ATOM 690 CG ARG A 273 4.564 -10.555 11.002 1.00 0.00 C ATOM 691 CD ARG A 273 5.320 -10.192 12.270 1.00 0.00 C ATOM 692 NE ARG A 273 6.536 -10.985 12.429 1.00 0.00 N ATOM 693 CZ ARG A 273 7.698 -10.670 11.868 1.00 0.00 C ATOM 694 NH1 ARG A 273 7.801 -9.583 11.116 1.00 0.00 N ATOM 695 NH2 ARG A 273 8.760 -11.442 12.059 1.00 0.00 N ATOM 0 H ARG A 273 3.898 -11.975 8.636 1.00 0.00 H new ATOM 0 HA ARG A 273 2.161 -13.025 10.585 1.00 0.00 H new ATOM 0 HB2 ARG A 273 3.751 -12.167 12.149 1.00 0.00 H new ATOM 0 HB3 ARG A 273 4.662 -12.676 10.741 1.00 0.00 H new ATOM 0 HG2 ARG A 273 5.242 -10.519 10.150 1.00 0.00 H new ATOM 0 HG3 ARG A 273 3.783 -9.817 10.819 1.00 0.00 H new ATOM 0 HD2 ARG A 273 5.578 -9.133 12.247 1.00 0.00 H new ATOM 0 HD3 ARG A 273 4.673 -10.344 13.134 1.00 0.00 H new ATOM 0 HE ARG A 273 6.490 -11.827 13.003 1.00 0.00 H new ATOM 0 HH11 ARG A 273 6.987 -8.987 10.967 1.00 0.00 H new ATOM 0 HH12 ARG A 273 8.694 -9.343 10.686 1.00 0.00 H new ATOM 0 HH21 ARG A 273 8.685 -12.279 12.637 1.00 0.00 H new ATOM 0 HH22 ARG A 273 9.652 -11.199 11.627 1.00 0.00 H new ATOM 709 N GLN A 274 1.636 -9.942 9.778 1.00 0.00 N ATOM 710 CA GLN A 274 0.772 -8.788 9.990 1.00 0.00 C ATOM 711 C GLN A 274 -0.285 -8.690 8.895 1.00 0.00 C ATOM 712 O GLN A 274 -0.939 -7.659 8.741 1.00 0.00 O ATOM 713 CB GLN A 274 1.601 -7.503 10.030 1.00 0.00 C ATOM 714 CG GLN A 274 2.351 -7.304 11.338 1.00 0.00 C ATOM 715 CD GLN A 274 3.373 -6.187 11.260 1.00 0.00 C ATOM 716 OE1 GLN A 274 3.377 -5.398 10.315 1.00 0.00 O ATOM 717 NE2 GLN A 274 4.248 -6.115 12.256 1.00 0.00 N ATOM 0 H GLN A 274 2.177 -9.911 8.914 1.00 0.00 H new ATOM 0 HA GLN A 274 0.267 -8.916 10.947 1.00 0.00 H new ATOM 0 HB2 GLN A 274 2.317 -7.517 9.208 1.00 0.00 H new ATOM 0 HB3 GLN A 274 0.943 -6.650 9.865 1.00 0.00 H new ATOM 0 HG2 GLN A 274 1.637 -7.084 12.132 1.00 0.00 H new ATOM 0 HG3 GLN A 274 2.853 -8.233 11.610 1.00 0.00 H new ATOM 0 HE21 GLN A 274 4.208 -6.790 13.020 1.00 0.00 H new ATOM 0 HE22 GLN A 274 4.960 -5.385 12.258 1.00 0.00 H new ATOM 726 N GLN A 275 -0.446 -9.770 8.137 1.00 0.00 N ATOM 727 CA GLN A 275 -1.423 -9.805 7.055 1.00 0.00 C ATOM 728 C GLN A 275 -1.548 -8.438 6.391 1.00 0.00 C ATOM 729 O GLN A 275 -2.654 -7.972 6.112 1.00 0.00 O ATOM 730 CB GLN A 275 -2.786 -10.255 7.584 1.00 0.00 C ATOM 731 CG GLN A 275 -2.810 -11.703 8.048 1.00 0.00 C ATOM 732 CD GLN A 275 -3.948 -11.988 9.008 1.00 0.00 C ATOM 733 OE1 GLN A 275 -4.461 -11.084 9.669 1.00 0.00 O ATOM 734 NE2 GLN A 275 -4.351 -13.251 9.090 1.00 0.00 N ATOM 0 H GLN A 275 0.087 -10.632 8.252 1.00 0.00 H new ATOM 0 HA GLN A 275 -1.077 -10.521 6.309 1.00 0.00 H new ATOM 0 HB2 GLN A 275 -3.075 -9.611 8.415 1.00 0.00 H new ATOM 0 HB3 GLN A 275 -3.533 -10.120 6.802 1.00 0.00 H new ATOM 0 HG2 GLN A 275 -2.899 -12.357 7.181 1.00 0.00 H new ATOM 0 HG3 GLN A 275 -1.863 -11.942 8.532 1.00 0.00 H new ATOM 0 HE21 GLN A 275 -3.898 -13.969 8.524 1.00 0.00 H new ATOM 0 HE22 GLN A 275 -5.114 -13.503 9.719 1.00 0.00 H new ATOM 743 N CYS A 276 -0.410 -7.801 6.140 1.00 0.00 N ATOM 744 CA CYS A 276 -0.393 -6.486 5.509 1.00 0.00 C ATOM 745 C CYS A 276 0.760 -6.375 4.516 1.00 0.00 C ATOM 746 O CYS A 276 1.596 -7.272 4.417 1.00 0.00 O ATOM 747 CB CYS A 276 -0.276 -5.390 6.570 1.00 0.00 C ATOM 748 SG CYS A 276 1.324 -5.344 7.411 1.00 0.00 S ATOM 0 H CYS A 276 0.513 -8.173 6.364 1.00 0.00 H new ATOM 0 HA CYS A 276 -1.330 -6.358 4.966 1.00 0.00 H new ATOM 0 HB2 CYS A 276 -0.455 -4.423 6.099 1.00 0.00 H new ATOM 0 HB3 CYS A 276 -1.061 -5.533 7.313 1.00 0.00 H new ATOM 0 HG CYS A 276 1.326 -4.384 8.288 1.00 0.00 H new ATOM 754 N ALA A 277 0.796 -5.268 3.782 1.00 0.00 N ATOM 755 CA ALA A 277 1.846 -5.039 2.797 1.00 0.00 C ATOM 756 C ALA A 277 2.008 -3.551 2.503 1.00 0.00 C ATOM 757 O ALA A 277 1.025 -2.815 2.414 1.00 0.00 O ATOM 758 CB ALA A 277 1.543 -5.802 1.516 1.00 0.00 C ATOM 0 H ALA A 277 0.110 -4.516 3.851 1.00 0.00 H new ATOM 0 HA ALA A 277 2.785 -5.405 3.212 1.00 0.00 H new ATOM 0 HB1 ALA A 277 2.335 -5.622 0.789 1.00 0.00 H new ATOM 0 HB2 ALA A 277 1.485 -6.869 1.733 1.00 0.00 H new ATOM 0 HB3 ALA A 277 0.591 -5.463 1.107 1.00 0.00 H new ATOM 764 N PHE A 278 3.254 -3.114 2.354 1.00 0.00 N ATOM 765 CA PHE A 278 3.544 -1.713 2.072 1.00 0.00 C ATOM 766 C PHE A 278 3.945 -1.524 0.611 1.00 0.00 C ATOM 767 O PHE A 278 4.907 -2.129 0.138 1.00 0.00 O ATOM 768 CB PHE A 278 4.661 -1.208 2.988 1.00 0.00 C ATOM 769 CG PHE A 278 4.193 -0.876 4.376 1.00 0.00 C ATOM 770 CD1 PHE A 278 3.721 0.391 4.678 1.00 0.00 C ATOM 771 CD2 PHE A 278 4.225 -1.831 5.379 1.00 0.00 C ATOM 772 CE1 PHE A 278 3.290 0.700 5.954 1.00 0.00 C ATOM 773 CE2 PHE A 278 3.795 -1.529 6.657 1.00 0.00 C ATOM 774 CZ PHE A 278 3.328 -0.261 6.945 1.00 0.00 C ATOM 0 H PHE A 278 4.079 -3.710 2.424 1.00 0.00 H new ATOM 0 HA PHE A 278 2.639 -1.135 2.260 1.00 0.00 H new ATOM 0 HB2 PHE A 278 5.442 -1.966 3.048 1.00 0.00 H new ATOM 0 HB3 PHE A 278 5.112 -0.321 2.543 1.00 0.00 H new ATOM 0 HD1 PHE A 278 3.690 1.146 3.907 1.00 0.00 H new ATOM 0 HD2 PHE A 278 4.590 -2.823 5.159 1.00 0.00 H new ATOM 0 HE1 PHE A 278 2.924 1.692 6.176 1.00 0.00 H new ATOM 0 HE2 PHE A 278 3.824 -2.283 7.430 1.00 0.00 H new ATOM 0 HZ PHE A 278 2.993 -0.022 7.944 1.00 0.00 H new ATOM 784 N ILE A 279 3.199 -0.683 -0.096 1.00 0.00 N ATOM 785 CA ILE A 279 3.476 -0.413 -1.501 1.00 0.00 C ATOM 786 C ILE A 279 4.180 0.928 -1.676 1.00 0.00 C ATOM 787 O ILE A 279 3.624 1.978 -1.356 1.00 0.00 O ATOM 788 CB ILE A 279 2.184 -0.414 -2.340 1.00 0.00 C ATOM 789 CG1 ILE A 279 1.249 -1.533 -1.875 1.00 0.00 C ATOM 790 CG2 ILE A 279 2.511 -0.571 -3.817 1.00 0.00 C ATOM 791 CD1 ILE A 279 1.721 -2.916 -2.264 1.00 0.00 C ATOM 0 H ILE A 279 2.398 -0.177 0.281 1.00 0.00 H new ATOM 0 HA ILE A 279 4.129 -1.212 -1.852 1.00 0.00 H new ATOM 0 HB ILE A 279 1.677 0.541 -2.199 1.00 0.00 H new ATOM 0 HG12 ILE A 279 1.148 -1.484 -0.791 1.00 0.00 H new ATOM 0 HG13 ILE A 279 0.257 -1.365 -2.295 1.00 0.00 H new ATOM 0 HG21 ILE A 279 1.588 -0.570 -4.396 1.00 0.00 H new ATOM 0 HG22 ILE A 279 3.143 0.256 -4.140 1.00 0.00 H new ATOM 0 HG23 ILE A 279 3.037 -1.512 -3.975 1.00 0.00 H new ATOM 0 HD11 ILE A 279 1.010 -3.658 -1.902 1.00 0.00 H new ATOM 0 HD12 ILE A 279 1.795 -2.983 -3.349 1.00 0.00 H new ATOM 0 HD13 ILE A 279 2.699 -3.104 -1.822 1.00 0.00 H new ATOM 803 N GLN A 280 5.407 0.883 -2.187 1.00 0.00 N ATOM 804 CA GLN A 280 6.187 2.095 -2.405 1.00 0.00 C ATOM 805 C GLN A 280 6.236 2.452 -3.887 1.00 0.00 C ATOM 806 O GLN A 280 6.359 1.575 -4.743 1.00 0.00 O ATOM 807 CB GLN A 280 7.607 1.918 -1.864 1.00 0.00 C ATOM 808 CG GLN A 280 8.351 3.229 -1.667 1.00 0.00 C ATOM 809 CD GLN A 280 9.372 3.158 -0.548 1.00 0.00 C ATOM 810 OE1 GLN A 280 9.284 2.304 0.335 1.00 0.00 O ATOM 811 NE2 GLN A 280 10.349 4.056 -0.580 1.00 0.00 N ATOM 0 H GLN A 280 5.881 0.021 -2.457 1.00 0.00 H new ATOM 0 HA GLN A 280 5.701 2.910 -1.869 1.00 0.00 H new ATOM 0 HB2 GLN A 280 7.561 1.389 -0.912 1.00 0.00 H new ATOM 0 HB3 GLN A 280 8.173 1.288 -2.551 1.00 0.00 H new ATOM 0 HG2 GLN A 280 8.853 3.500 -2.595 1.00 0.00 H new ATOM 0 HG3 GLN A 280 7.634 4.020 -1.450 1.00 0.00 H new ATOM 0 HE21 GLN A 280 10.383 4.746 -1.331 1.00 0.00 H new ATOM 0 HE22 GLN A 280 11.065 4.056 0.146 1.00 0.00 H new ATOM 820 N PHE A 281 6.139 3.743 -4.184 1.00 0.00 N ATOM 821 CA PHE A 281 6.171 4.216 -5.563 1.00 0.00 C ATOM 822 C PHE A 281 7.330 5.185 -5.779 1.00 0.00 C ATOM 823 O PHE A 281 7.719 5.917 -4.869 1.00 0.00 O ATOM 824 CB PHE A 281 4.849 4.896 -5.922 1.00 0.00 C ATOM 825 CG PHE A 281 3.663 3.976 -5.851 1.00 0.00 C ATOM 826 CD1 PHE A 281 3.269 3.245 -6.960 1.00 0.00 C ATOM 827 CD2 PHE A 281 2.943 3.842 -4.675 1.00 0.00 C ATOM 828 CE1 PHE A 281 2.178 2.399 -6.897 1.00 0.00 C ATOM 829 CE2 PHE A 281 1.852 2.997 -4.606 1.00 0.00 C ATOM 830 CZ PHE A 281 1.469 2.274 -5.719 1.00 0.00 C ATOM 0 H PHE A 281 6.037 4.481 -3.488 1.00 0.00 H new ATOM 0 HA PHE A 281 6.316 3.353 -6.213 1.00 0.00 H new ATOM 0 HB2 PHE A 281 4.687 5.737 -5.248 1.00 0.00 H new ATOM 0 HB3 PHE A 281 4.922 5.305 -6.930 1.00 0.00 H new ATOM 0 HD1 PHE A 281 3.821 3.337 -7.884 1.00 0.00 H new ATOM 0 HD2 PHE A 281 3.238 4.405 -3.802 1.00 0.00 H new ATOM 0 HE1 PHE A 281 1.880 1.836 -7.769 1.00 0.00 H new ATOM 0 HE2 PHE A 281 1.299 2.902 -3.683 1.00 0.00 H new ATOM 0 HZ PHE A 281 0.617 1.612 -5.668 1.00 0.00 H new ATOM 840 N ALA A 282 7.877 5.184 -6.990 1.00 0.00 N ATOM 841 CA ALA A 282 8.989 6.063 -7.327 1.00 0.00 C ATOM 842 C ALA A 282 8.537 7.517 -7.399 1.00 0.00 C ATOM 843 O ALA A 282 9.289 8.430 -7.055 1.00 0.00 O ATOM 844 CB ALA A 282 9.617 5.638 -8.646 1.00 0.00 C ATOM 0 H ALA A 282 7.568 4.584 -7.754 1.00 0.00 H new ATOM 0 HA ALA A 282 9.737 5.981 -6.538 1.00 0.00 H new ATOM 0 HB1 ALA A 282 10.446 6.304 -8.885 1.00 0.00 H new ATOM 0 HB2 ALA A 282 9.985 4.616 -8.561 1.00 0.00 H new ATOM 0 HB3 ALA A 282 8.870 5.690 -9.438 1.00 0.00 H new ATOM 850 N THR A 283 7.304 7.728 -7.848 1.00 0.00 N ATOM 851 CA THR A 283 6.752 9.071 -7.966 1.00 0.00 C ATOM 852 C THR A 283 5.426 9.189 -7.222 1.00 0.00 C ATOM 853 O THR A 283 4.449 8.525 -7.568 1.00 0.00 O ATOM 854 CB THR A 283 6.537 9.462 -9.441 1.00 0.00 C ATOM 855 OG1 THR A 283 5.835 8.420 -10.126 1.00 0.00 O ATOM 856 CG2 THR A 283 7.867 9.724 -10.131 1.00 0.00 C ATOM 0 H THR A 283 6.668 6.984 -8.136 1.00 0.00 H new ATOM 0 HA THR A 283 7.477 9.751 -7.519 1.00 0.00 H new ATOM 0 HB THR A 283 5.945 10.377 -9.469 1.00 0.00 H new ATOM 0 HG1 THR A 283 5.116 8.079 -9.554 1.00 0.00 H new ATOM 0 HG21 THR A 283 7.690 9.998 -11.171 1.00 0.00 H new ATOM 0 HG22 THR A 283 8.386 10.538 -9.624 1.00 0.00 H new ATOM 0 HG23 THR A 283 8.480 8.824 -10.093 1.00 0.00 H new ATOM 864 N ARG A 284 5.400 10.038 -6.200 1.00 0.00 N ATOM 865 CA ARG A 284 4.194 10.242 -5.407 1.00 0.00 C ATOM 866 C ARG A 284 2.948 10.171 -6.285 1.00 0.00 C ATOM 867 O ARG A 284 1.925 9.619 -5.882 1.00 0.00 O ATOM 868 CB ARG A 284 4.250 11.594 -4.693 1.00 0.00 C ATOM 869 CG ARG A 284 2.949 11.974 -4.006 1.00 0.00 C ATOM 870 CD ARG A 284 2.589 10.986 -2.908 1.00 0.00 C ATOM 871 NE ARG A 284 1.374 11.376 -2.197 1.00 0.00 N ATOM 872 CZ ARG A 284 1.355 12.261 -1.206 1.00 0.00 C ATOM 873 NH1 ARG A 284 2.478 12.844 -0.812 1.00 0.00 N ATOM 874 NH2 ARG A 284 0.210 12.564 -0.608 1.00 0.00 N ATOM 0 H ARG A 284 6.200 10.596 -5.902 1.00 0.00 H new ATOM 0 HA ARG A 284 4.140 9.447 -4.663 1.00 0.00 H new ATOM 0 HB2 ARG A 284 5.049 11.571 -3.952 1.00 0.00 H new ATOM 0 HB3 ARG A 284 4.508 12.367 -5.417 1.00 0.00 H new ATOM 0 HG2 ARG A 284 3.039 12.974 -3.582 1.00 0.00 H new ATOM 0 HG3 ARG A 284 2.145 12.011 -4.741 1.00 0.00 H new ATOM 0 HD2 ARG A 284 2.453 9.996 -3.342 1.00 0.00 H new ATOM 0 HD3 ARG A 284 3.415 10.913 -2.201 1.00 0.00 H new ATOM 0 HE ARG A 284 0.492 10.946 -2.476 1.00 0.00 H new ATOM 0 HH11 ARG A 284 3.360 12.614 -1.270 1.00 0.00 H new ATOM 0 HH12 ARG A 284 2.460 13.523 -0.051 1.00 0.00 H new ATOM 0 HH21 ARG A 284 -0.656 12.117 -0.909 1.00 0.00 H new ATOM 0 HH22 ARG A 284 0.196 13.243 0.153 1.00 0.00 H new ATOM 888 N GLN A 285 3.043 10.733 -7.486 1.00 0.00 N ATOM 889 CA GLN A 285 1.923 10.734 -8.419 1.00 0.00 C ATOM 890 C GLN A 285 1.094 9.462 -8.276 1.00 0.00 C ATOM 891 O GLN A 285 -0.074 9.511 -7.891 1.00 0.00 O ATOM 892 CB GLN A 285 2.429 10.867 -9.856 1.00 0.00 C ATOM 893 CG GLN A 285 1.344 11.246 -10.851 1.00 0.00 C ATOM 894 CD GLN A 285 0.237 10.214 -10.929 1.00 0.00 C ATOM 895 OE1 GLN A 285 -0.859 10.421 -10.406 1.00 0.00 O ATOM 896 NE2 GLN A 285 0.517 9.093 -11.584 1.00 0.00 N ATOM 0 H GLN A 285 3.884 11.193 -7.835 1.00 0.00 H new ATOM 0 HA GLN A 285 1.288 11.588 -8.184 1.00 0.00 H new ATOM 0 HB2 GLN A 285 3.217 11.619 -9.887 1.00 0.00 H new ATOM 0 HB3 GLN A 285 2.878 9.922 -10.163 1.00 0.00 H new ATOM 0 HG2 GLN A 285 0.918 12.209 -10.569 1.00 0.00 H new ATOM 0 HG3 GLN A 285 1.789 11.371 -11.838 1.00 0.00 H new ATOM 0 HE21 GLN A 285 1.438 8.963 -12.002 1.00 0.00 H new ATOM 0 HE22 GLN A 285 -0.189 8.362 -11.669 1.00 0.00 H new ATOM 905 N ALA A 286 1.706 8.324 -8.588 1.00 0.00 N ATOM 906 CA ALA A 286 1.025 7.039 -8.492 1.00 0.00 C ATOM 907 C ALA A 286 0.496 6.802 -7.081 1.00 0.00 C ATOM 908 O ALA A 286 -0.652 6.399 -6.898 1.00 0.00 O ATOM 909 CB ALA A 286 1.962 5.913 -8.903 1.00 0.00 C ATOM 0 H ALA A 286 2.672 8.266 -8.909 1.00 0.00 H new ATOM 0 HA ALA A 286 0.174 7.055 -9.173 1.00 0.00 H new ATOM 0 HB1 ALA A 286 1.440 4.959 -8.826 1.00 0.00 H new ATOM 0 HB2 ALA A 286 2.287 6.067 -9.932 1.00 0.00 H new ATOM 0 HB3 ALA A 286 2.831 5.905 -8.245 1.00 0.00 H new ATOM 915 N ALA A 287 1.341 7.054 -6.088 1.00 0.00 N ATOM 916 CA ALA A 287 0.958 6.868 -4.693 1.00 0.00 C ATOM 917 C ALA A 287 -0.365 7.563 -4.391 1.00 0.00 C ATOM 918 O ALA A 287 -1.296 6.945 -3.875 1.00 0.00 O ATOM 919 CB ALA A 287 2.052 7.388 -3.772 1.00 0.00 C ATOM 0 H ALA A 287 2.295 7.388 -6.223 1.00 0.00 H new ATOM 0 HA ALA A 287 0.827 5.800 -4.516 1.00 0.00 H new ATOM 0 HB1 ALA A 287 1.753 7.243 -2.734 1.00 0.00 H new ATOM 0 HB2 ALA A 287 2.977 6.844 -3.963 1.00 0.00 H new ATOM 0 HB3 ALA A 287 2.211 8.450 -3.959 1.00 0.00 H new ATOM 925 N GLU A 288 -0.441 8.850 -4.715 1.00 0.00 N ATOM 926 CA GLU A 288 -1.651 9.627 -4.475 1.00 0.00 C ATOM 927 C GLU A 288 -2.860 8.969 -5.133 1.00 0.00 C ATOM 928 O GLU A 288 -3.903 8.791 -4.504 1.00 0.00 O ATOM 929 CB GLU A 288 -1.481 11.053 -5.006 1.00 0.00 C ATOM 930 CG GLU A 288 -0.909 12.019 -3.983 1.00 0.00 C ATOM 931 CD GLU A 288 -1.366 13.447 -4.210 1.00 0.00 C ATOM 932 OE1 GLU A 288 -1.348 13.898 -5.374 1.00 0.00 O ATOM 933 OE2 GLU A 288 -1.741 14.113 -3.222 1.00 0.00 O ATOM 0 H GLU A 288 0.320 9.376 -5.144 1.00 0.00 H new ATOM 0 HA GLU A 288 -1.821 9.665 -3.399 1.00 0.00 H new ATOM 0 HB2 GLU A 288 -0.827 11.031 -5.878 1.00 0.00 H new ATOM 0 HB3 GLU A 288 -2.449 11.424 -5.342 1.00 0.00 H new ATOM 0 HG2 GLU A 288 -1.205 11.701 -2.983 1.00 0.00 H new ATOM 0 HG3 GLU A 288 0.180 11.980 -4.020 1.00 0.00 H new ATOM 940 N VAL A 289 -2.712 8.609 -6.404 1.00 0.00 N ATOM 941 CA VAL A 289 -3.790 7.969 -7.148 1.00 0.00 C ATOM 942 C VAL A 289 -4.242 6.683 -6.465 1.00 0.00 C ATOM 943 O VAL A 289 -5.402 6.548 -6.079 1.00 0.00 O ATOM 944 CB VAL A 289 -3.362 7.648 -8.592 1.00 0.00 C ATOM 945 CG1 VAL A 289 -4.532 7.080 -9.382 1.00 0.00 C ATOM 946 CG2 VAL A 289 -2.802 8.889 -9.270 1.00 0.00 C ATOM 0 H VAL A 289 -1.856 8.750 -6.940 1.00 0.00 H new ATOM 0 HA VAL A 289 -4.620 8.675 -7.172 1.00 0.00 H new ATOM 0 HB VAL A 289 -2.576 6.894 -8.560 1.00 0.00 H new ATOM 0 HG11 VAL A 289 -4.211 6.859 -10.400 1.00 0.00 H new ATOM 0 HG12 VAL A 289 -4.883 6.164 -8.905 1.00 0.00 H new ATOM 0 HG13 VAL A 289 -5.342 7.809 -9.407 1.00 0.00 H new ATOM 0 HG21 VAL A 289 -2.505 8.644 -10.290 1.00 0.00 H new ATOM 0 HG22 VAL A 289 -3.565 9.667 -9.292 1.00 0.00 H new ATOM 0 HG23 VAL A 289 -1.935 9.247 -8.715 1.00 0.00 H new ATOM 956 N ALA A 290 -3.316 5.741 -6.319 1.00 0.00 N ATOM 957 CA ALA A 290 -3.618 4.466 -5.680 1.00 0.00 C ATOM 958 C ALA A 290 -4.184 4.674 -4.279 1.00 0.00 C ATOM 959 O ALA A 290 -5.033 3.910 -3.823 1.00 0.00 O ATOM 960 CB ALA A 290 -2.371 3.596 -5.623 1.00 0.00 C ATOM 0 H ALA A 290 -2.351 5.837 -6.634 1.00 0.00 H new ATOM 0 HA ALA A 290 -4.375 3.959 -6.278 1.00 0.00 H new ATOM 0 HB1 ALA A 290 -2.611 2.647 -5.143 1.00 0.00 H new ATOM 0 HB2 ALA A 290 -2.010 3.410 -6.635 1.00 0.00 H new ATOM 0 HB3 ALA A 290 -1.597 4.107 -5.050 1.00 0.00 H new ATOM 966 N ALA A 291 -3.707 5.714 -3.602 1.00 0.00 N ATOM 967 CA ALA A 291 -4.168 6.023 -2.254 1.00 0.00 C ATOM 968 C ALA A 291 -5.688 6.126 -2.203 1.00 0.00 C ATOM 969 O ALA A 291 -6.355 5.291 -1.593 1.00 0.00 O ATOM 970 CB ALA A 291 -3.532 7.315 -1.763 1.00 0.00 C ATOM 0 H ALA A 291 -3.002 6.356 -3.965 1.00 0.00 H new ATOM 0 HA ALA A 291 -3.864 5.208 -1.597 1.00 0.00 H new ATOM 0 HB1 ALA A 291 -3.885 7.534 -0.755 1.00 0.00 H new ATOM 0 HB2 ALA A 291 -2.448 7.205 -1.752 1.00 0.00 H new ATOM 0 HB3 ALA A 291 -3.807 8.132 -2.430 1.00 0.00 H new ATOM 976 N GLU A 292 -6.229 7.156 -2.847 1.00 0.00 N ATOM 977 CA GLU A 292 -7.672 7.367 -2.873 1.00 0.00 C ATOM 978 C GLU A 292 -8.391 6.142 -3.429 1.00 0.00 C ATOM 979 O GLU A 292 -9.453 5.755 -2.939 1.00 0.00 O ATOM 980 CB GLU A 292 -8.014 8.599 -3.714 1.00 0.00 C ATOM 981 CG GLU A 292 -7.937 9.904 -2.941 1.00 0.00 C ATOM 982 CD GLU A 292 -9.149 10.133 -2.060 1.00 0.00 C ATOM 983 OE1 GLU A 292 -9.484 9.231 -1.264 1.00 0.00 O ATOM 984 OE2 GLU A 292 -9.764 11.215 -2.166 1.00 0.00 O ATOM 0 H GLU A 292 -5.691 7.856 -3.357 1.00 0.00 H new ATOM 0 HA GLU A 292 -8.008 7.530 -1.849 1.00 0.00 H new ATOM 0 HB2 GLU A 292 -7.333 8.649 -4.564 1.00 0.00 H new ATOM 0 HB3 GLU A 292 -9.020 8.485 -4.118 1.00 0.00 H new ATOM 0 HG2 GLU A 292 -7.039 9.904 -2.324 1.00 0.00 H new ATOM 0 HG3 GLU A 292 -7.841 10.732 -3.643 1.00 0.00 H new ATOM 991 N LYS A 293 -7.807 5.535 -4.456 1.00 0.00 N ATOM 992 CA LYS A 293 -8.390 4.353 -5.080 1.00 0.00 C ATOM 993 C LYS A 293 -8.190 3.121 -4.204 1.00 0.00 C ATOM 994 O LYS A 293 -8.590 2.016 -4.570 1.00 0.00 O ATOM 995 CB LYS A 293 -7.766 4.119 -6.458 1.00 0.00 C ATOM 996 CG LYS A 293 -8.415 4.931 -7.565 1.00 0.00 C ATOM 997 CD LYS A 293 -8.360 4.201 -8.897 1.00 0.00 C ATOM 998 CE LYS A 293 -8.667 5.136 -10.058 1.00 0.00 C ATOM 999 NZ LYS A 293 -10.128 5.223 -10.328 1.00 0.00 N ATOM 0 H LYS A 293 -6.929 5.842 -4.875 1.00 0.00 H new ATOM 0 HA LYS A 293 -9.460 4.524 -5.196 1.00 0.00 H new ATOM 0 HB2 LYS A 293 -6.705 4.364 -6.413 1.00 0.00 H new ATOM 0 HB3 LYS A 293 -7.838 3.060 -6.705 1.00 0.00 H new ATOM 0 HG2 LYS A 293 -9.453 5.138 -7.305 1.00 0.00 H new ATOM 0 HG3 LYS A 293 -7.911 5.893 -7.655 1.00 0.00 H new ATOM 0 HD2 LYS A 293 -7.371 3.763 -9.033 1.00 0.00 H new ATOM 0 HD3 LYS A 293 -9.075 3.378 -8.892 1.00 0.00 H new ATOM 0 HE2 LYS A 293 -8.279 6.130 -9.836 1.00 0.00 H new ATOM 0 HE3 LYS A 293 -8.153 4.785 -10.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 293 -10.296 5.869 -11.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 293 -10.494 4.279 -10.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 293 -10.616 5.582 -9.483 1.00 0.00 H new ATOM 1013 N SER A 294 -7.572 3.319 -3.044 1.00 0.00 N ATOM 1014 CA SER A 294 -7.318 2.223 -2.116 1.00 0.00 C ATOM 1015 C SER A 294 -8.082 2.427 -0.812 1.00 0.00 C ATOM 1016 O SER A 294 -8.520 1.466 -0.179 1.00 0.00 O ATOM 1017 CB SER A 294 -5.819 2.106 -1.830 1.00 0.00 C ATOM 1018 OG SER A 294 -5.170 1.327 -2.819 1.00 0.00 O ATOM 0 H SER A 294 -7.238 4.228 -2.724 1.00 0.00 H new ATOM 0 HA SER A 294 -7.665 1.299 -2.579 1.00 0.00 H new ATOM 0 HB2 SER A 294 -5.374 3.100 -1.796 1.00 0.00 H new ATOM 0 HB3 SER A 294 -5.667 1.655 -0.850 1.00 0.00 H new ATOM 0 HG SER A 294 -4.871 1.908 -3.549 1.00 0.00 H new ATOM 1024 N PHE A 295 -8.240 3.685 -0.417 1.00 0.00 N ATOM 1025 CA PHE A 295 -8.951 4.017 0.813 1.00 0.00 C ATOM 1026 C PHE A 295 -10.302 3.311 0.867 1.00 0.00 C ATOM 1027 O PHE A 295 -11.260 3.731 0.218 1.00 0.00 O ATOM 1028 CB PHE A 295 -9.149 5.531 0.920 1.00 0.00 C ATOM 1029 CG PHE A 295 -8.017 6.236 1.611 1.00 0.00 C ATOM 1030 CD1 PHE A 295 -6.701 5.909 1.324 1.00 0.00 C ATOM 1031 CD2 PHE A 295 -8.268 7.224 2.549 1.00 0.00 C ATOM 1032 CE1 PHE A 295 -5.657 6.556 1.958 1.00 0.00 C ATOM 1033 CE2 PHE A 295 -7.229 7.875 3.186 1.00 0.00 C ATOM 1034 CZ PHE A 295 -5.922 7.540 2.891 1.00 0.00 C ATOM 0 H PHE A 295 -7.886 4.492 -0.930 1.00 0.00 H new ATOM 0 HA PHE A 295 -8.349 3.676 1.655 1.00 0.00 H new ATOM 0 HB2 PHE A 295 -9.268 5.946 -0.081 1.00 0.00 H new ATOM 0 HB3 PHE A 295 -10.075 5.731 1.460 1.00 0.00 H new ATOM 0 HD1 PHE A 295 -6.489 5.140 0.596 1.00 0.00 H new ATOM 0 HD2 PHE A 295 -9.288 7.489 2.785 1.00 0.00 H new ATOM 0 HE1 PHE A 295 -4.636 6.293 1.724 1.00 0.00 H new ATOM 0 HE2 PHE A 295 -7.439 8.645 3.914 1.00 0.00 H new ATOM 0 HZ PHE A 295 -5.108 8.046 3.389 1.00 0.00 H new ATOM 1044 N ASN A 296 -10.371 2.236 1.645 1.00 0.00 N ATOM 1045 CA ASN A 296 -11.605 1.471 1.784 1.00 0.00 C ATOM 1046 C ASN A 296 -12.266 1.254 0.426 1.00 0.00 C ATOM 1047 O ASN A 296 -13.491 1.181 0.324 1.00 0.00 O ATOM 1048 CB ASN A 296 -12.572 2.189 2.727 1.00 0.00 C ATOM 1049 CG ASN A 296 -11.878 2.740 3.957 1.00 0.00 C ATOM 1050 OD1 ASN A 296 -11.470 1.850 4.855 1.00 0.00 O flip ATOM 1051 ND2 ASN A 296 -11.711 3.952 4.099 1.00 0.00 N flip ATOM 0 H ASN A 296 -9.587 1.875 2.189 1.00 0.00 H new ATOM 0 HA ASN A 296 -11.354 0.498 2.206 1.00 0.00 H new ATOM 0 HB2 ASN A 296 -13.059 3.004 2.192 1.00 0.00 H new ATOM 0 HB3 ASN A 296 -13.356 1.497 3.035 1.00 0.00 H new ATOM 0 HD21 ASN A 296 -12.041 4.600 3.383 1.00 0.00 H new ATOM 0 HD22 ASN A 296 -11.243 4.308 4.932 1.00 0.00 H new ATOM 1058 N LYS A 297 -11.447 1.152 -0.615 1.00 0.00 N ATOM 1059 CA LYS A 297 -11.950 0.941 -1.967 1.00 0.00 C ATOM 1060 C LYS A 297 -11.229 -0.221 -2.642 1.00 0.00 C ATOM 1061 O LYS A 297 -11.805 -0.925 -3.472 1.00 0.00 O ATOM 1062 CB LYS A 297 -11.780 2.214 -2.800 1.00 0.00 C ATOM 1063 CG LYS A 297 -12.288 2.080 -4.225 1.00 0.00 C ATOM 1064 CD LYS A 297 -12.395 3.433 -4.909 1.00 0.00 C ATOM 1065 CE LYS A 297 -12.689 3.286 -6.394 1.00 0.00 C ATOM 1066 NZ LYS A 297 -13.042 4.590 -7.021 1.00 0.00 N ATOM 0 H LYS A 297 -10.431 1.212 -0.548 1.00 0.00 H new ATOM 0 HA LYS A 297 -13.010 0.696 -1.899 1.00 0.00 H new ATOM 0 HB2 LYS A 297 -12.308 3.032 -2.310 1.00 0.00 H new ATOM 0 HB3 LYS A 297 -10.724 2.485 -2.823 1.00 0.00 H new ATOM 0 HG2 LYS A 297 -11.616 1.437 -4.793 1.00 0.00 H new ATOM 0 HG3 LYS A 297 -13.264 1.596 -4.220 1.00 0.00 H new ATOM 0 HD2 LYS A 297 -13.184 4.019 -4.437 1.00 0.00 H new ATOM 0 HD3 LYS A 297 -11.464 3.984 -4.774 1.00 0.00 H new ATOM 0 HE2 LYS A 297 -11.818 2.865 -6.897 1.00 0.00 H new ATOM 0 HE3 LYS A 297 -13.509 2.582 -6.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 297 -13.235 4.448 -8.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 297 -13.888 4.980 -6.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 297 -12.250 5.254 -6.910 1.00 0.00 H new ATOM 1080 N LEU A 298 -9.966 -0.417 -2.280 1.00 0.00 N ATOM 1081 CA LEU A 298 -9.166 -1.496 -2.849 1.00 0.00 C ATOM 1082 C LEU A 298 -9.653 -2.854 -2.355 1.00 0.00 C ATOM 1083 O LEU A 298 -9.384 -3.245 -1.219 1.00 0.00 O ATOM 1084 CB LEU A 298 -7.691 -1.308 -2.489 1.00 0.00 C ATOM 1085 CG LEU A 298 -6.813 -2.557 -2.581 1.00 0.00 C ATOM 1086 CD1 LEU A 298 -6.409 -2.820 -4.023 1.00 0.00 C ATOM 1087 CD2 LEU A 298 -5.582 -2.410 -1.698 1.00 0.00 C ATOM 0 H LEU A 298 -9.474 0.157 -1.595 1.00 0.00 H new ATOM 0 HA LEU A 298 -9.276 -1.464 -3.933 1.00 0.00 H new ATOM 0 HB2 LEU A 298 -7.272 -0.545 -3.145 1.00 0.00 H new ATOM 0 HB3 LEU A 298 -7.632 -0.921 -1.472 1.00 0.00 H new ATOM 0 HG LEU A 298 -7.390 -3.411 -2.226 1.00 0.00 H new ATOM 0 HD11 LEU A 298 -5.785 -3.712 -4.069 1.00 0.00 H new ATOM 0 HD12 LEU A 298 -7.302 -2.970 -4.629 1.00 0.00 H new ATOM 0 HD13 LEU A 298 -5.850 -1.966 -4.406 1.00 0.00 H new ATOM 0 HD21 LEU A 298 -4.969 -3.308 -1.776 1.00 0.00 H new ATOM 0 HD22 LEU A 298 -5.003 -1.546 -2.023 1.00 0.00 H new ATOM 0 HD23 LEU A 298 -5.892 -2.271 -0.662 1.00 0.00 H new ATOM 1099 N ILE A 299 -10.368 -3.569 -3.217 1.00 0.00 N ATOM 1100 CA ILE A 299 -10.889 -4.885 -2.869 1.00 0.00 C ATOM 1101 C ILE A 299 -10.341 -5.958 -3.804 1.00 0.00 C ATOM 1102 O ILE A 299 -10.863 -6.168 -4.900 1.00 0.00 O ATOM 1103 CB ILE A 299 -12.428 -4.913 -2.920 1.00 0.00 C ATOM 1104 CG1 ILE A 299 -13.007 -3.728 -2.145 1.00 0.00 C ATOM 1105 CG2 ILE A 299 -12.953 -6.227 -2.360 1.00 0.00 C ATOM 1106 CD1 ILE A 299 -14.519 -3.685 -2.147 1.00 0.00 C ATOM 0 H ILE A 299 -10.600 -3.259 -4.161 1.00 0.00 H new ATOM 0 HA ILE A 299 -10.564 -5.094 -1.850 1.00 0.00 H new ATOM 0 HB ILE A 299 -12.744 -4.832 -3.960 1.00 0.00 H new ATOM 0 HG12 ILE A 299 -12.654 -3.771 -1.115 1.00 0.00 H new ATOM 0 HG13 ILE A 299 -12.625 -2.802 -2.574 1.00 0.00 H new ATOM 0 HG21 ILE A 299 -14.042 -6.231 -2.403 1.00 0.00 H new ATOM 0 HG22 ILE A 299 -12.563 -7.056 -2.951 1.00 0.00 H new ATOM 0 HG23 ILE A 299 -12.630 -6.336 -1.325 1.00 0.00 H new ATOM 0 HD11 ILE A 299 -14.859 -2.819 -1.579 1.00 0.00 H new ATOM 0 HD12 ILE A 299 -14.880 -3.610 -3.173 1.00 0.00 H new ATOM 0 HD13 ILE A 299 -14.909 -4.595 -1.690 1.00 0.00 H new ATOM 1118 N VAL A 300 -9.287 -6.638 -3.363 1.00 0.00 N ATOM 1119 CA VAL A 300 -8.669 -7.692 -4.159 1.00 0.00 C ATOM 1120 C VAL A 300 -9.194 -9.065 -3.754 1.00 0.00 C ATOM 1121 O VAL A 300 -9.359 -9.353 -2.570 1.00 0.00 O ATOM 1122 CB VAL A 300 -7.136 -7.678 -4.017 1.00 0.00 C ATOM 1123 CG1 VAL A 300 -6.502 -8.682 -4.966 1.00 0.00 C ATOM 1124 CG2 VAL A 300 -6.591 -6.279 -4.265 1.00 0.00 C ATOM 0 H VAL A 300 -8.843 -6.478 -2.459 1.00 0.00 H new ATOM 0 HA VAL A 300 -8.931 -7.498 -5.199 1.00 0.00 H new ATOM 0 HB VAL A 300 -6.880 -7.967 -2.998 1.00 0.00 H new ATOM 0 HG11 VAL A 300 -5.418 -8.657 -4.851 1.00 0.00 H new ATOM 0 HG12 VAL A 300 -6.869 -9.682 -4.736 1.00 0.00 H new ATOM 0 HG13 VAL A 300 -6.764 -8.427 -5.993 1.00 0.00 H new ATOM 0 HG21 VAL A 300 -5.506 -6.287 -4.161 1.00 0.00 H new ATOM 0 HG22 VAL A 300 -6.856 -5.959 -5.273 1.00 0.00 H new ATOM 0 HG23 VAL A 300 -7.020 -5.588 -3.540 1.00 0.00 H new ATOM 1134 N ASN A 301 -9.454 -9.909 -4.747 1.00 0.00 N ATOM 1135 CA ASN A 301 -9.960 -11.254 -4.494 1.00 0.00 C ATOM 1136 C ASN A 301 -11.256 -11.204 -3.691 1.00 0.00 C ATOM 1137 O ASN A 301 -11.420 -11.931 -2.712 1.00 0.00 O ATOM 1138 CB ASN A 301 -8.914 -12.082 -3.746 1.00 0.00 C ATOM 1139 CG ASN A 301 -7.778 -12.528 -4.645 1.00 0.00 C ATOM 1140 OD1 ASN A 301 -8.004 -13.052 -5.737 1.00 0.00 O ATOM 1141 ND2 ASN A 301 -6.548 -12.323 -4.190 1.00 0.00 N ATOM 0 H ASN A 301 -9.323 -9.686 -5.734 1.00 0.00 H new ATOM 0 HA ASN A 301 -10.167 -11.725 -5.455 1.00 0.00 H new ATOM 0 HB2 ASN A 301 -8.511 -11.494 -2.921 1.00 0.00 H new ATOM 0 HB3 ASN A 301 -9.393 -12.958 -3.309 1.00 0.00 H new ATOM 0 HD21 ASN A 301 -5.743 -12.603 -4.751 1.00 0.00 H new ATOM 0 HD22 ASN A 301 -6.407 -11.885 -3.279 1.00 0.00 H new ATOM 1148 N GLY A 302 -12.176 -10.342 -4.114 1.00 0.00 N ATOM 1149 CA GLY A 302 -13.446 -10.214 -3.423 1.00 0.00 C ATOM 1150 C GLY A 302 -13.279 -10.081 -1.923 1.00 0.00 C ATOM 1151 O GLY A 302 -14.149 -10.493 -1.155 1.00 0.00 O ATOM 0 H GLY A 302 -12.064 -9.730 -4.923 1.00 0.00 H new ATOM 0 HA2 GLY A 302 -13.978 -9.342 -3.805 1.00 0.00 H new ATOM 0 HA3 GLY A 302 -14.064 -11.085 -3.641 1.00 0.00 H new ATOM 1155 N ARG A 303 -12.158 -9.505 -1.502 1.00 0.00 N ATOM 1156 CA ARG A 303 -11.878 -9.321 -0.083 1.00 0.00 C ATOM 1157 C ARG A 303 -11.452 -7.884 0.205 1.00 0.00 C ATOM 1158 O ARG A 303 -10.321 -7.492 -0.081 1.00 0.00 O ATOM 1159 CB ARG A 303 -10.786 -10.289 0.373 1.00 0.00 C ATOM 1160 CG ARG A 303 -10.480 -10.206 1.860 1.00 0.00 C ATOM 1161 CD ARG A 303 -9.029 -10.558 2.150 1.00 0.00 C ATOM 1162 NE ARG A 303 -8.802 -10.813 3.570 1.00 0.00 N ATOM 1163 CZ ARG A 303 -9.010 -11.991 4.148 1.00 0.00 C ATOM 1164 NH1 ARG A 303 -9.447 -13.017 3.430 1.00 0.00 N ATOM 1165 NH2 ARG A 303 -8.780 -12.145 5.445 1.00 0.00 N ATOM 0 H ARG A 303 -11.428 -9.157 -2.124 1.00 0.00 H new ATOM 0 HA ARG A 303 -12.793 -9.529 0.472 1.00 0.00 H new ATOM 0 HB2 ARG A 303 -11.090 -11.307 0.130 1.00 0.00 H new ATOM 0 HB3 ARG A 303 -9.874 -10.086 -0.189 1.00 0.00 H new ATOM 0 HG2 ARG A 303 -10.690 -9.199 2.220 1.00 0.00 H new ATOM 0 HG3 ARG A 303 -11.136 -10.884 2.406 1.00 0.00 H new ATOM 0 HD2 ARG A 303 -8.747 -11.439 1.574 1.00 0.00 H new ATOM 0 HD3 ARG A 303 -8.385 -9.743 1.820 1.00 0.00 H new ATOM 0 HE ARG A 303 -8.465 -10.044 4.150 1.00 0.00 H new ATOM 0 HH11 ARG A 303 -9.624 -12.902 2.432 1.00 0.00 H new ATOM 0 HH12 ARG A 303 -9.606 -13.921 3.876 1.00 0.00 H new ATOM 0 HH21 ARG A 303 -8.443 -11.358 6.000 1.00 0.00 H new ATOM 0 HH22 ARG A 303 -8.940 -13.050 5.887 1.00 0.00 H new ATOM 1179 N ARG A 304 -12.366 -7.104 0.773 1.00 0.00 N ATOM 1180 CA ARG A 304 -12.086 -5.711 1.099 1.00 0.00 C ATOM 1181 C ARG A 304 -10.756 -5.582 1.836 1.00 0.00 C ATOM 1182 O ARG A 304 -10.444 -6.381 2.720 1.00 0.00 O ATOM 1183 CB ARG A 304 -13.213 -5.128 1.953 1.00 0.00 C ATOM 1184 CG ARG A 304 -13.392 -3.628 1.783 1.00 0.00 C ATOM 1185 CD ARG A 304 -14.291 -3.048 2.864 1.00 0.00 C ATOM 1186 NE ARG A 304 -15.706 -3.186 2.531 1.00 0.00 N ATOM 1187 CZ ARG A 304 -16.676 -3.204 3.439 1.00 0.00 C ATOM 1188 NH1 ARG A 304 -16.385 -3.093 4.728 1.00 0.00 N ATOM 1189 NH2 ARG A 304 -17.941 -3.333 3.058 1.00 0.00 N ATOM 0 H ARG A 304 -13.307 -7.413 1.017 1.00 0.00 H new ATOM 0 HA ARG A 304 -12.021 -5.152 0.166 1.00 0.00 H new ATOM 0 HB2 ARG A 304 -14.147 -5.628 1.697 1.00 0.00 H new ATOM 0 HB3 ARG A 304 -13.012 -5.345 3.002 1.00 0.00 H new ATOM 0 HG2 ARG A 304 -12.419 -3.138 1.816 1.00 0.00 H new ATOM 0 HG3 ARG A 304 -13.820 -3.420 0.802 1.00 0.00 H new ATOM 0 HD2 ARG A 304 -14.091 -3.550 3.810 1.00 0.00 H new ATOM 0 HD3 ARG A 304 -14.053 -1.994 3.006 1.00 0.00 H new ATOM 0 HE ARG A 304 -15.964 -3.273 1.548 1.00 0.00 H new ATOM 0 HH11 ARG A 304 -15.414 -2.993 5.025 1.00 0.00 H new ATOM 0 HH12 ARG A 304 -17.132 -3.107 5.423 1.00 0.00 H new ATOM 0 HH21 ARG A 304 -18.169 -3.418 2.068 1.00 0.00 H new ATOM 0 HH22 ARG A 304 -18.685 -3.347 3.756 1.00 0.00 H new ATOM 1203 N LEU A 305 -9.977 -4.572 1.466 1.00 0.00 N ATOM 1204 CA LEU A 305 -8.680 -4.338 2.091 1.00 0.00 C ATOM 1205 C LEU A 305 -8.595 -2.924 2.657 1.00 0.00 C ATOM 1206 O LEU A 305 -8.959 -1.956 1.992 1.00 0.00 O ATOM 1207 CB LEU A 305 -7.555 -4.562 1.079 1.00 0.00 C ATOM 1208 CG LEU A 305 -7.631 -5.856 0.268 1.00 0.00 C ATOM 1209 CD1 LEU A 305 -6.568 -5.867 -0.820 1.00 0.00 C ATOM 1210 CD2 LEU A 305 -7.477 -7.066 1.178 1.00 0.00 C ATOM 0 H LEU A 305 -10.221 -3.902 0.737 1.00 0.00 H new ATOM 0 HA LEU A 305 -8.568 -5.046 2.912 1.00 0.00 H new ATOM 0 HB2 LEU A 305 -7.545 -3.722 0.385 1.00 0.00 H new ATOM 0 HB3 LEU A 305 -6.605 -4.546 1.613 1.00 0.00 H new ATOM 0 HG LEU A 305 -8.610 -5.907 -0.208 1.00 0.00 H new ATOM 0 HD11 LEU A 305 -6.637 -6.795 -1.387 1.00 0.00 H new ATOM 0 HD12 LEU A 305 -6.723 -5.021 -1.489 1.00 0.00 H new ATOM 0 HD13 LEU A 305 -5.580 -5.793 -0.365 1.00 0.00 H new ATOM 0 HD21 LEU A 305 -7.534 -7.978 0.584 1.00 0.00 H new ATOM 0 HD22 LEU A 305 -6.512 -7.021 1.683 1.00 0.00 H new ATOM 0 HD23 LEU A 305 -8.275 -7.067 1.920 1.00 0.00 H new ATOM 1222 N ASN A 306 -8.110 -2.813 3.890 1.00 0.00 N ATOM 1223 CA ASN A 306 -7.976 -1.517 4.545 1.00 0.00 C ATOM 1224 C ASN A 306 -6.633 -0.875 4.210 1.00 0.00 C ATOM 1225 O ASN A 306 -5.588 -1.304 4.698 1.00 0.00 O ATOM 1226 CB ASN A 306 -8.116 -1.672 6.061 1.00 0.00 C ATOM 1227 CG ASN A 306 -8.650 -0.416 6.723 1.00 0.00 C ATOM 1228 OD1 ASN A 306 -9.840 0.008 6.314 1.00 0.00 O flip ATOM 1229 ND2 ASN A 306 -8.000 0.165 7.592 1.00 0.00 N flip ATOM 0 H ASN A 306 -7.803 -3.605 4.455 1.00 0.00 H new ATOM 0 HA ASN A 306 -8.771 -0.868 4.178 1.00 0.00 H new ATOM 0 HB2 ASN A 306 -8.783 -2.506 6.278 1.00 0.00 H new ATOM 0 HB3 ASN A 306 -7.145 -1.921 6.489 1.00 0.00 H new ATOM 0 HD21 ASN A 306 -7.089 -0.197 7.875 1.00 0.00 H new ATOM 0 HD22 ASN A 306 -8.372 1.008 8.029 1.00 0.00 H new ATOM 1236 N VAL A 307 -6.670 0.158 3.374 1.00 0.00 N ATOM 1237 CA VAL A 307 -5.457 0.862 2.975 1.00 0.00 C ATOM 1238 C VAL A 307 -5.348 2.211 3.676 1.00 0.00 C ATOM 1239 O VAL A 307 -6.349 2.893 3.894 1.00 0.00 O ATOM 1240 CB VAL A 307 -5.412 1.083 1.451 1.00 0.00 C ATOM 1241 CG1 VAL A 307 -4.290 2.042 1.083 1.00 0.00 C ATOM 1242 CG2 VAL A 307 -5.251 -0.244 0.725 1.00 0.00 C ATOM 0 H VAL A 307 -7.527 0.526 2.960 1.00 0.00 H new ATOM 0 HA VAL A 307 -4.616 0.234 3.269 1.00 0.00 H new ATOM 0 HB VAL A 307 -6.356 1.530 1.138 1.00 0.00 H new ATOM 0 HG11 VAL A 307 -4.274 2.186 0.003 1.00 0.00 H new ATOM 0 HG12 VAL A 307 -4.455 3.001 1.574 1.00 0.00 H new ATOM 0 HG13 VAL A 307 -3.336 1.627 1.408 1.00 0.00 H new ATOM 0 HG21 VAL A 307 -5.221 -0.069 -0.350 1.00 0.00 H new ATOM 0 HG22 VAL A 307 -4.323 -0.721 1.041 1.00 0.00 H new ATOM 0 HG23 VAL A 307 -6.093 -0.894 0.964 1.00 0.00 H new ATOM 1252 N LYS A 308 -4.124 2.591 4.028 1.00 0.00 N ATOM 1253 CA LYS A 308 -3.882 3.860 4.704 1.00 0.00 C ATOM 1254 C LYS A 308 -2.541 4.453 4.283 1.00 0.00 C ATOM 1255 O LYS A 308 -1.704 3.766 3.699 1.00 0.00 O ATOM 1256 CB LYS A 308 -3.912 3.667 6.222 1.00 0.00 C ATOM 1257 CG LYS A 308 -2.605 3.147 6.795 1.00 0.00 C ATOM 1258 CD LYS A 308 -2.676 3.004 8.306 1.00 0.00 C ATOM 1259 CE LYS A 308 -3.477 1.777 8.713 1.00 0.00 C ATOM 1260 NZ LYS A 308 -4.938 2.061 8.768 1.00 0.00 N ATOM 0 H LYS A 308 -3.284 2.038 3.856 1.00 0.00 H new ATOM 0 HA LYS A 308 -4.673 4.553 4.416 1.00 0.00 H new ATOM 0 HB2 LYS A 308 -4.154 4.618 6.696 1.00 0.00 H new ATOM 0 HB3 LYS A 308 -4.712 2.972 6.476 1.00 0.00 H new ATOM 0 HG2 LYS A 308 -2.369 2.181 6.348 1.00 0.00 H new ATOM 0 HG3 LYS A 308 -1.795 3.827 6.531 1.00 0.00 H new ATOM 0 HD2 LYS A 308 -1.668 2.933 8.714 1.00 0.00 H new ATOM 0 HD3 LYS A 308 -3.131 3.896 8.736 1.00 0.00 H new ATOM 0 HE2 LYS A 308 -3.290 0.970 8.004 1.00 0.00 H new ATOM 0 HE3 LYS A 308 -3.138 1.429 9.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 308 -5.303 1.822 9.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 308 -5.103 3.070 8.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 308 -5.430 1.490 8.052 1.00 0.00 H new ATOM 1274 N TRP A 309 -2.344 5.732 4.585 1.00 0.00 N ATOM 1275 CA TRP A 309 -1.104 6.416 4.239 1.00 0.00 C ATOM 1276 C TRP A 309 0.033 5.979 5.155 1.00 0.00 C ATOM 1277 O TRP A 309 -0.053 6.113 6.375 1.00 0.00 O ATOM 1278 CB TRP A 309 -1.292 7.932 4.327 1.00 0.00 C ATOM 1279 CG TRP A 309 -1.741 8.550 3.038 1.00 0.00 C ATOM 1280 CD1 TRP A 309 -2.905 9.231 2.817 1.00 0.00 C ATOM 1281 CD2 TRP A 309 -1.036 8.543 1.792 1.00 0.00 C ATOM 1282 NE1 TRP A 309 -2.965 9.647 1.509 1.00 0.00 N ATOM 1283 CE2 TRP A 309 -1.831 9.238 0.859 1.00 0.00 C ATOM 1284 CE3 TRP A 309 0.189 8.018 1.374 1.00 0.00 C ATOM 1285 CZ2 TRP A 309 -1.438 9.420 -0.464 1.00 0.00 C ATOM 1286 CZ3 TRP A 309 0.578 8.199 0.060 1.00 0.00 C ATOM 1287 CH2 TRP A 309 -0.233 8.895 -0.846 1.00 0.00 C ATOM 0 H TRP A 309 -3.027 6.315 5.068 1.00 0.00 H new ATOM 0 HA TRP A 309 -0.844 6.148 3.215 1.00 0.00 H new ATOM 0 HB2 TRP A 309 -2.024 8.156 5.103 1.00 0.00 H new ATOM 0 HB3 TRP A 309 -0.352 8.390 4.633 1.00 0.00 H new ATOM 0 HD1 TRP A 309 -3.666 9.415 3.561 1.00 0.00 H new ATOM 0 HE1 TRP A 309 -3.730 10.175 1.090 1.00 0.00 H new ATOM 0 HE3 TRP A 309 0.821 7.480 2.065 1.00 0.00 H new ATOM 0 HZ2 TRP A 309 -2.062 9.956 -1.164 1.00 0.00 H new ATOM 0 HZ3 TRP A 309 1.523 7.797 -0.274 1.00 0.00 H new ATOM 0 HH2 TRP A 309 0.099 9.020 -1.866 1.00 0.00 H new ATOM 1298 N GLY A 310 1.100 5.454 4.559 1.00 0.00 N ATOM 1299 CA GLY A 310 2.240 5.005 5.337 1.00 0.00 C ATOM 1300 C GLY A 310 2.984 6.153 5.991 1.00 0.00 C ATOM 1301 O GLY A 310 2.396 7.192 6.291 1.00 0.00 O ATOM 0 H GLY A 310 1.195 5.332 3.551 1.00 0.00 H new ATOM 0 HA2 GLY A 310 1.901 4.311 6.106 1.00 0.00 H new ATOM 0 HA3 GLY A 310 2.923 4.455 4.690 1.00 0.00 H new