USER MOD reduce.3.24.130724 H: found=0, std=0, add=610, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 610 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 274 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 275 ASN :FLIP amide:sc= -1.52! C(o=-3.5!,f=-1.5!) USER MOD Set 2.1: A 237 ASN : amide:sc= -1.63 K(o=-1.8,f=-3) USER MOD Set 2.2: A 294 SER OG : rot -132:sc= -0.125 USER MOD Single : A 229 SER OG : rot 180:sc= 0 USER MOD Single : A 231 LYS NZ :NH3+ -154:sc= -0.0741 (180deg=-0.495) USER MOD Single : A 234 TYR OH : rot 180:sc= 0 USER MOD Single : A 239 MET CE :methyl 165:sc= 0 (180deg=-0.0367) USER MOD Single : A 241 SER OG : rot 180:sc= 0 USER MOD Single : A 242 THR OG1 : rot -119:sc= 1.27 USER MOD Single : A 243 SER OG : rot 180:sc= 0 USER MOD Single : A 246 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 249 LYS NZ :NH3+ 161:sc= 0.85 (180deg=0.717) USER MOD Single : A 252 ASN :FLIP amide:sc= -2.03 F(o=-6.5!,f=-2) USER MOD Single : A 253 ASN : amide:sc= -0.309 K(o=-0.31,f=-1.7) USER MOD Single : A 255 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 263 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 264 LYS NZ :NH3+ 169:sc= 0.438 (180deg=-0.227) USER MOD Single : A 268 TYR OH : rot 180:sc= 0 USER MOD Single : A 272 HIS : no HD1:sc= -0.0841 X(o=-0.084,f=-0.27) USER MOD Single : A 283 MET CE :methyl 163:sc= -0.0529 (180deg=-0.433) USER MOD Single : A 284 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 287 ASN : amide:sc=-0.000117 X(o=-0.00012,f=0) USER MOD Single : A 289 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 299 THR OG1 : rot 180:sc= 0 USER MOD Single : A 302 LYS NZ :NH3+ 169:sc= 0.244 (180deg=0.117) USER MOD ----------------------------------------------------------------- ATOM 147 N SER A 229 -14.340 0.468 0.152 1.00 0.00 N ATOM 148 CA SER A 229 -13.118 0.792 0.878 1.00 0.00 C ATOM 149 C SER A 229 -11.921 0.059 0.279 1.00 0.00 C ATOM 150 O SER A 229 -11.688 -1.114 0.568 1.00 0.00 O ATOM 151 CB SER A 229 -13.265 0.427 2.356 1.00 0.00 C ATOM 152 OG SER A 229 -14.182 1.291 3.005 1.00 0.00 O ATOM 0 HA SER A 229 -12.947 1.865 0.792 1.00 0.00 H new ATOM 0 HB2 SER A 229 -13.605 -0.605 2.447 1.00 0.00 H new ATOM 0 HB3 SER A 229 -12.294 0.487 2.847 1.00 0.00 H new ATOM 0 HG SER A 229 -14.260 1.036 3.948 1.00 0.00 H new ATOM 158 N VAL A 230 -11.164 0.762 -0.559 1.00 0.00 N ATOM 159 CA VAL A 230 -9.990 0.180 -1.199 1.00 0.00 C ATOM 160 C VAL A 230 -8.707 0.822 -0.682 1.00 0.00 C ATOM 161 O VAL A 230 -8.600 2.046 -0.603 1.00 0.00 O ATOM 162 CB VAL A 230 -10.049 0.338 -2.730 1.00 0.00 C ATOM 163 CG1 VAL A 230 -10.604 1.704 -3.104 1.00 0.00 C ATOM 164 CG2 VAL A 230 -8.672 0.127 -3.340 1.00 0.00 C ATOM 0 H VAL A 230 -11.343 1.734 -0.810 1.00 0.00 H new ATOM 0 HA VAL A 230 -9.988 -0.881 -0.950 1.00 0.00 H new ATOM 0 HB VAL A 230 -10.719 -0.422 -3.132 1.00 0.00 H new ATOM 0 HG11 VAL A 230 -10.638 1.798 -4.189 1.00 0.00 H new ATOM 0 HG12 VAL A 230 -11.610 1.812 -2.698 1.00 0.00 H new ATOM 0 HG13 VAL A 230 -9.962 2.483 -2.693 1.00 0.00 H new ATOM 0 HG21 VAL A 230 -8.732 0.242 -4.422 1.00 0.00 H new ATOM 0 HG22 VAL A 230 -7.978 0.863 -2.935 1.00 0.00 H new ATOM 0 HG23 VAL A 230 -8.318 -0.876 -3.101 1.00 0.00 H new ATOM 174 N LYS A 231 -7.735 -0.012 -0.330 1.00 0.00 N ATOM 175 CA LYS A 231 -6.457 0.473 0.178 1.00 0.00 C ATOM 176 C LYS A 231 -5.294 -0.207 -0.536 1.00 0.00 C ATOM 177 O LYS A 231 -5.123 -1.423 -0.445 1.00 0.00 O ATOM 178 CB LYS A 231 -6.358 0.227 1.685 1.00 0.00 C ATOM 179 CG LYS A 231 -6.556 -1.227 2.079 1.00 0.00 C ATOM 180 CD LYS A 231 -7.159 -1.351 3.468 1.00 0.00 C ATOM 181 CE LYS A 231 -7.997 -2.613 3.601 1.00 0.00 C ATOM 182 NZ LYS A 231 -9.215 -2.563 2.745 1.00 0.00 N ATOM 0 H LYS A 231 -7.808 -1.028 -0.387 1.00 0.00 H new ATOM 0 HA LYS A 231 -6.401 1.545 -0.014 1.00 0.00 H new ATOM 0 HB2 LYS A 231 -5.381 0.560 2.035 1.00 0.00 H new ATOM 0 HB3 LYS A 231 -7.104 0.837 2.194 1.00 0.00 H new ATOM 0 HG2 LYS A 231 -7.207 -1.716 1.354 1.00 0.00 H new ATOM 0 HG3 LYS A 231 -5.598 -1.747 2.049 1.00 0.00 H new ATOM 0 HD2 LYS A 231 -6.362 -1.362 4.212 1.00 0.00 H new ATOM 0 HD3 LYS A 231 -7.778 -0.478 3.676 1.00 0.00 H new ATOM 0 HE2 LYS A 231 -7.395 -3.479 3.326 1.00 0.00 H new ATOM 0 HE3 LYS A 231 -8.290 -2.746 4.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 231 -9.952 -3.171 3.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 231 -9.563 -1.584 2.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 231 -8.981 -2.898 1.789 1.00 0.00 H new ATOM 196 N ILE A 232 -4.496 0.584 -1.245 1.00 0.00 N ATOM 197 CA ILE A 232 -3.348 0.058 -1.973 1.00 0.00 C ATOM 198 C ILE A 232 -2.215 1.077 -2.024 1.00 0.00 C ATOM 199 O ILE A 232 -2.447 2.271 -2.222 1.00 0.00 O ATOM 200 CB ILE A 232 -3.728 -0.343 -3.410 1.00 0.00 C ATOM 201 CG1 ILE A 232 -4.792 -1.442 -3.392 1.00 0.00 C ATOM 202 CG2 ILE A 232 -2.496 -0.803 -4.175 1.00 0.00 C ATOM 203 CD1 ILE A 232 -5.343 -1.773 -4.762 1.00 0.00 C ATOM 0 H ILE A 232 -4.624 1.592 -1.331 1.00 0.00 H new ATOM 0 HA ILE A 232 -3.012 -0.828 -1.434 1.00 0.00 H new ATOM 0 HB ILE A 232 -4.142 0.529 -3.917 1.00 0.00 H new ATOM 0 HG12 ILE A 232 -4.364 -2.344 -2.954 1.00 0.00 H new ATOM 0 HG13 ILE A 232 -5.612 -1.132 -2.745 1.00 0.00 H new ATOM 0 HG21 ILE A 232 -2.781 -1.083 -5.189 1.00 0.00 H new ATOM 0 HG22 ILE A 232 -1.768 0.007 -4.213 1.00 0.00 H new ATOM 0 HG23 ILE A 232 -2.055 -1.663 -3.671 1.00 0.00 H new ATOM 0 HD11 ILE A 232 -6.092 -2.560 -4.673 1.00 0.00 H new ATOM 0 HD12 ILE A 232 -5.801 -0.884 -5.195 1.00 0.00 H new ATOM 0 HD13 ILE A 232 -4.533 -2.114 -5.407 1.00 0.00 H new ATOM 215 N LEU A 233 -0.989 0.599 -1.845 1.00 0.00 N ATOM 216 CA LEU A 233 0.183 1.469 -1.873 1.00 0.00 C ATOM 217 C LEU A 233 1.178 1.007 -2.932 1.00 0.00 C ATOM 218 O LEU A 233 1.832 -0.024 -2.776 1.00 0.00 O ATOM 219 CB LEU A 233 0.856 1.493 -0.500 1.00 0.00 C ATOM 220 CG LEU A 233 0.074 2.182 0.619 1.00 0.00 C ATOM 221 CD1 LEU A 233 0.863 2.151 1.919 1.00 0.00 C ATOM 222 CD2 LEU A 233 -0.262 3.614 0.232 1.00 0.00 C ATOM 0 H LEU A 233 -0.780 -0.385 -1.679 1.00 0.00 H new ATOM 0 HA LEU A 233 -0.148 2.476 -2.127 1.00 0.00 H new ATOM 0 HB2 LEU A 233 1.055 0.465 -0.197 1.00 0.00 H new ATOM 0 HB3 LEU A 233 1.822 1.989 -0.600 1.00 0.00 H new ATOM 0 HG LEU A 233 -0.859 1.639 0.771 1.00 0.00 H new ATOM 0 HD11 LEU A 233 0.291 2.646 2.704 1.00 0.00 H new ATOM 0 HD12 LEU A 233 1.052 1.116 2.205 1.00 0.00 H new ATOM 0 HD13 LEU A 233 1.812 2.669 1.781 1.00 0.00 H new ATOM 0 HD21 LEU A 233 -0.818 4.088 1.040 1.00 0.00 H new ATOM 0 HD22 LEU A 233 0.659 4.168 0.052 1.00 0.00 H new ATOM 0 HD23 LEU A 233 -0.868 3.613 -0.674 1.00 0.00 H new ATOM 234 N TYR A 234 1.290 1.779 -4.008 1.00 0.00 N ATOM 235 CA TYR A 234 2.206 1.449 -5.093 1.00 0.00 C ATOM 236 C TYR A 234 3.561 2.120 -4.885 1.00 0.00 C ATOM 237 O TYR A 234 3.648 3.339 -4.741 1.00 0.00 O ATOM 238 CB TYR A 234 1.613 1.878 -6.436 1.00 0.00 C ATOM 239 CG TYR A 234 2.646 2.042 -7.529 1.00 0.00 C ATOM 240 CD1 TYR A 234 3.087 0.950 -8.265 1.00 0.00 C ATOM 241 CD2 TYR A 234 3.179 3.291 -7.825 1.00 0.00 C ATOM 242 CE1 TYR A 234 4.031 1.095 -9.263 1.00 0.00 C ATOM 243 CE2 TYR A 234 4.122 3.446 -8.823 1.00 0.00 C ATOM 244 CZ TYR A 234 4.545 2.345 -9.539 1.00 0.00 C ATOM 245 OH TYR A 234 5.484 2.495 -10.533 1.00 0.00 O ATOM 0 H TYR A 234 0.758 2.637 -4.152 1.00 0.00 H new ATOM 0 HA TYR A 234 2.352 0.369 -5.096 1.00 0.00 H new ATOM 0 HB2 TYR A 234 0.877 1.139 -6.751 1.00 0.00 H new ATOM 0 HB3 TYR A 234 1.082 2.821 -6.305 1.00 0.00 H new ATOM 0 HD1 TYR A 234 2.685 -0.030 -8.053 1.00 0.00 H new ATOM 0 HD2 TYR A 234 2.851 4.155 -7.266 1.00 0.00 H new ATOM 0 HE1 TYR A 234 4.365 0.235 -9.824 1.00 0.00 H new ATOM 0 HE2 TYR A 234 4.526 4.424 -9.041 1.00 0.00 H new ATOM 0 HH TYR A 234 5.741 3.438 -10.600 1.00 0.00 H new ATOM 255 N VAL A 235 4.617 1.313 -4.871 1.00 0.00 N ATOM 256 CA VAL A 235 5.968 1.826 -4.682 1.00 0.00 C ATOM 257 C VAL A 235 6.783 1.714 -5.966 1.00 0.00 C ATOM 258 O VAL A 235 6.647 0.748 -6.717 1.00 0.00 O ATOM 259 CB VAL A 235 6.702 1.075 -3.555 1.00 0.00 C ATOM 260 CG1 VAL A 235 8.025 1.753 -3.234 1.00 0.00 C ATOM 261 CG2 VAL A 235 5.825 0.986 -2.316 1.00 0.00 C ATOM 0 H VAL A 235 4.563 0.301 -4.988 1.00 0.00 H new ATOM 0 HA VAL A 235 5.871 2.876 -4.406 1.00 0.00 H new ATOM 0 HB VAL A 235 6.914 0.062 -3.896 1.00 0.00 H new ATOM 0 HG11 VAL A 235 8.529 1.208 -2.436 1.00 0.00 H new ATOM 0 HG12 VAL A 235 8.656 1.759 -4.123 1.00 0.00 H new ATOM 0 HG13 VAL A 235 7.840 2.778 -2.913 1.00 0.00 H new ATOM 0 HG21 VAL A 235 6.359 0.452 -1.530 1.00 0.00 H new ATOM 0 HG22 VAL A 235 5.580 1.990 -1.971 1.00 0.00 H new ATOM 0 HG23 VAL A 235 4.907 0.451 -2.558 1.00 0.00 H new ATOM 271 N ARG A 236 7.630 2.708 -6.212 1.00 0.00 N ATOM 272 CA ARG A 236 8.466 2.722 -7.406 1.00 0.00 C ATOM 273 C ARG A 236 9.902 3.105 -7.059 1.00 0.00 C ATOM 274 O ARG A 236 10.176 3.603 -5.968 1.00 0.00 O ATOM 275 CB ARG A 236 7.902 3.700 -8.438 1.00 0.00 C ATOM 276 CG ARG A 236 8.121 5.160 -8.079 1.00 0.00 C ATOM 277 CD ARG A 236 7.589 6.086 -9.161 1.00 0.00 C ATOM 278 NE ARG A 236 7.163 7.374 -8.618 1.00 0.00 N ATOM 279 CZ ARG A 236 6.528 8.298 -9.331 1.00 0.00 C ATOM 280 NH1 ARG A 236 6.246 8.077 -10.608 1.00 0.00 N ATOM 281 NH2 ARG A 236 6.172 9.444 -8.766 1.00 0.00 N ATOM 0 H ARG A 236 7.755 3.514 -5.600 1.00 0.00 H new ATOM 0 HA ARG A 236 8.468 1.718 -7.830 1.00 0.00 H new ATOM 0 HB2 ARG A 236 8.363 3.500 -9.405 1.00 0.00 H new ATOM 0 HB3 ARG A 236 6.833 3.519 -8.551 1.00 0.00 H new ATOM 0 HG2 ARG A 236 7.626 5.381 -7.134 1.00 0.00 H new ATOM 0 HG3 ARG A 236 9.185 5.344 -7.932 1.00 0.00 H new ATOM 0 HD2 ARG A 236 8.362 6.247 -9.913 1.00 0.00 H new ATOM 0 HD3 ARG A 236 6.748 5.609 -9.665 1.00 0.00 H new ATOM 0 HE ARG A 236 7.364 7.575 -7.638 1.00 0.00 H new ATOM 0 HH11 ARG A 236 6.517 7.196 -11.045 1.00 0.00 H new ATOM 0 HH12 ARG A 236 5.758 8.788 -11.153 1.00 0.00 H new ATOM 0 HH21 ARG A 236 6.386 9.616 -7.784 1.00 0.00 H new ATOM 0 HH22 ARG A 236 5.685 10.153 -9.314 1.00 0.00 H new ATOM 295 N ASN A 237 10.815 2.868 -7.996 1.00 0.00 N ATOM 296 CA ASN A 237 12.223 3.187 -7.789 1.00 0.00 C ATOM 297 C ASN A 237 12.860 2.217 -6.799 1.00 0.00 C ATOM 298 O ASN A 237 13.664 2.614 -5.954 1.00 0.00 O ATOM 299 CB ASN A 237 12.373 4.623 -7.283 1.00 0.00 C ATOM 300 CG ASN A 237 13.782 5.154 -7.462 1.00 0.00 C ATOM 301 OD1 ASN A 237 14.685 4.425 -7.872 1.00 0.00 O ATOM 302 ND2 ASN A 237 13.976 6.432 -7.155 1.00 0.00 N ATOM 0 H ASN A 237 10.605 2.456 -8.905 1.00 0.00 H new ATOM 0 HA ASN A 237 12.737 3.091 -8.746 1.00 0.00 H new ATOM 0 HB2 ASN A 237 11.674 5.268 -7.816 1.00 0.00 H new ATOM 0 HB3 ASN A 237 12.104 4.664 -6.228 1.00 0.00 H new ATOM 0 HD21 ASN A 237 14.903 6.846 -7.256 1.00 0.00 H new ATOM 0 HD22 ASN A 237 13.198 6.999 -6.818 1.00 0.00 H new ATOM 309 N LEU A 238 12.497 0.944 -6.909 1.00 0.00 N ATOM 310 CA LEU A 238 13.034 -0.084 -6.024 1.00 0.00 C ATOM 311 C LEU A 238 14.167 -0.848 -6.701 1.00 0.00 C ATOM 312 O LEU A 238 13.957 -1.531 -7.703 1.00 0.00 O ATOM 313 CB LEU A 238 11.927 -1.054 -5.607 1.00 0.00 C ATOM 314 CG LEU A 238 10.800 -0.463 -4.759 1.00 0.00 C ATOM 315 CD1 LEU A 238 9.589 -1.383 -4.765 1.00 0.00 C ATOM 316 CD2 LEU A 238 11.277 -0.215 -3.336 1.00 0.00 C ATOM 0 H LEU A 238 11.833 0.599 -7.602 1.00 0.00 H new ATOM 0 HA LEU A 238 13.432 0.407 -5.136 1.00 0.00 H new ATOM 0 HB2 LEU A 238 11.489 -1.483 -6.508 1.00 0.00 H new ATOM 0 HB3 LEU A 238 12.381 -1.874 -5.051 1.00 0.00 H new ATOM 0 HG LEU A 238 10.507 0.493 -5.194 1.00 0.00 H new ATOM 0 HD11 LEU A 238 8.797 -0.946 -4.156 1.00 0.00 H new ATOM 0 HD12 LEU A 238 9.233 -1.509 -5.787 1.00 0.00 H new ATOM 0 HD13 LEU A 238 9.868 -2.354 -4.355 1.00 0.00 H new ATOM 0 HD21 LEU A 238 10.462 0.206 -2.747 1.00 0.00 H new ATOM 0 HD22 LEU A 238 11.598 -1.157 -2.891 1.00 0.00 H new ATOM 0 HD23 LEU A 238 12.113 0.484 -3.349 1.00 0.00 H new ATOM 328 N MET A 239 15.369 -0.729 -6.145 1.00 0.00 N ATOM 329 CA MET A 239 16.535 -1.412 -6.694 1.00 0.00 C ATOM 330 C MET A 239 16.293 -2.915 -6.783 1.00 0.00 C ATOM 331 O MET A 239 15.854 -3.542 -5.817 1.00 0.00 O ATOM 332 CB MET A 239 17.768 -1.132 -5.832 1.00 0.00 C ATOM 333 CG MET A 239 18.158 0.337 -5.788 1.00 0.00 C ATOM 334 SD MET A 239 19.878 0.585 -5.307 1.00 0.00 S ATOM 335 CE MET A 239 20.304 2.014 -6.299 1.00 0.00 C ATOM 0 H MET A 239 15.561 -0.167 -5.316 1.00 0.00 H new ATOM 0 HA MET A 239 16.709 -1.030 -7.700 1.00 0.00 H new ATOM 0 HB2 MET A 239 17.578 -1.480 -4.817 1.00 0.00 H new ATOM 0 HB3 MET A 239 18.608 -1.711 -6.215 1.00 0.00 H new ATOM 0 HG2 MET A 239 17.991 0.783 -6.769 1.00 0.00 H new ATOM 0 HG3 MET A 239 17.509 0.860 -5.086 1.00 0.00 H new ATOM 0 HE1 MET A 239 21.231 2.451 -5.928 1.00 0.00 H new ATOM 0 HE2 MET A 239 20.436 1.710 -7.337 1.00 0.00 H new ATOM 0 HE3 MET A 239 19.504 2.752 -6.236 1.00 0.00 H new ATOM 345 N LEU A 240 16.581 -3.488 -7.946 1.00 0.00 N ATOM 346 CA LEU A 240 16.395 -4.919 -8.161 1.00 0.00 C ATOM 347 C LEU A 240 16.924 -5.721 -6.976 1.00 0.00 C ATOM 348 O LEU A 240 16.322 -6.715 -6.568 1.00 0.00 O ATOM 349 CB LEU A 240 17.101 -5.358 -9.445 1.00 0.00 C ATOM 350 CG LEU A 240 16.671 -4.642 -10.726 1.00 0.00 C ATOM 351 CD1 LEU A 240 17.634 -4.954 -11.861 1.00 0.00 C ATOM 352 CD2 LEU A 240 15.251 -5.036 -11.106 1.00 0.00 C ATOM 0 H LEU A 240 16.944 -2.984 -8.755 1.00 0.00 H new ATOM 0 HA LEU A 240 15.326 -5.111 -8.258 1.00 0.00 H new ATOM 0 HB2 LEU A 240 18.173 -5.213 -9.314 1.00 0.00 H new ATOM 0 HB3 LEU A 240 16.938 -6.427 -9.578 1.00 0.00 H new ATOM 0 HG LEU A 240 16.693 -3.568 -10.544 1.00 0.00 H new ATOM 0 HD11 LEU A 240 17.312 -4.436 -12.764 1.00 0.00 H new ATOM 0 HD12 LEU A 240 18.636 -4.622 -11.590 1.00 0.00 H new ATOM 0 HD13 LEU A 240 17.645 -6.029 -12.044 1.00 0.00 H new ATOM 0 HD21 LEU A 240 14.962 -4.517 -12.020 1.00 0.00 H new ATOM 0 HD22 LEU A 240 15.204 -6.113 -11.270 1.00 0.00 H new ATOM 0 HD23 LEU A 240 14.569 -4.761 -10.301 1.00 0.00 H new ATOM 364 N SER A 241 18.051 -5.282 -6.427 1.00 0.00 N ATOM 365 CA SER A 241 18.663 -5.960 -5.290 1.00 0.00 C ATOM 366 C SER A 241 17.685 -6.051 -4.122 1.00 0.00 C ATOM 367 O SER A 241 17.655 -7.046 -3.397 1.00 0.00 O ATOM 368 CB SER A 241 19.930 -5.225 -4.852 1.00 0.00 C ATOM 369 OG SER A 241 20.986 -5.435 -5.773 1.00 0.00 O ATOM 0 H SER A 241 18.560 -4.459 -6.751 1.00 0.00 H new ATOM 0 HA SER A 241 18.927 -6.971 -5.601 1.00 0.00 H new ATOM 0 HB2 SER A 241 19.724 -4.158 -4.767 1.00 0.00 H new ATOM 0 HB3 SER A 241 20.231 -5.571 -3.863 1.00 0.00 H new ATOM 0 HG SER A 241 21.784 -4.953 -5.471 1.00 0.00 H new ATOM 375 N THR A 242 16.884 -5.005 -3.946 1.00 0.00 N ATOM 376 CA THR A 242 15.905 -4.965 -2.867 1.00 0.00 C ATOM 377 C THR A 242 14.895 -6.098 -2.998 1.00 0.00 C ATOM 378 O THR A 242 14.417 -6.392 -4.094 1.00 0.00 O ATOM 379 CB THR A 242 15.152 -3.621 -2.841 1.00 0.00 C ATOM 380 OG1 THR A 242 16.086 -2.536 -2.857 1.00 0.00 O ATOM 381 CG2 THR A 242 14.269 -3.519 -1.606 1.00 0.00 C ATOM 0 H THR A 242 16.894 -4.174 -4.537 1.00 0.00 H new ATOM 0 HA THR A 242 16.458 -5.081 -1.935 1.00 0.00 H new ATOM 0 HB THR A 242 14.518 -3.567 -3.726 1.00 0.00 H new ATOM 0 HG1 THR A 242 15.979 -2.000 -2.043 1.00 0.00 H new ATOM 0 HG21 THR A 242 13.748 -2.562 -1.610 1.00 0.00 H new ATOM 0 HG22 THR A 242 13.540 -4.329 -1.612 1.00 0.00 H new ATOM 0 HG23 THR A 242 14.886 -3.593 -0.710 1.00 0.00 H new ATOM 389 N SER A 243 14.573 -6.731 -1.875 1.00 0.00 N ATOM 390 CA SER A 243 13.620 -7.836 -1.866 1.00 0.00 C ATOM 391 C SER A 243 12.358 -7.458 -1.096 1.00 0.00 C ATOM 392 O SER A 243 12.309 -6.421 -0.435 1.00 0.00 O ATOM 393 CB SER A 243 14.257 -9.081 -1.245 1.00 0.00 C ATOM 394 OG SER A 243 15.140 -9.711 -2.157 1.00 0.00 O ATOM 0 H SER A 243 14.958 -6.498 -0.959 1.00 0.00 H new ATOM 0 HA SER A 243 13.344 -8.054 -2.898 1.00 0.00 H new ATOM 0 HB2 SER A 243 14.800 -8.803 -0.341 1.00 0.00 H new ATOM 0 HB3 SER A 243 13.477 -9.782 -0.946 1.00 0.00 H new ATOM 0 HG SER A 243 15.535 -10.503 -1.736 1.00 0.00 H new ATOM 400 N GLU A 244 11.341 -8.308 -1.187 1.00 0.00 N ATOM 401 CA GLU A 244 10.078 -8.064 -0.500 1.00 0.00 C ATOM 402 C GLU A 244 10.307 -7.818 0.989 1.00 0.00 C ATOM 403 O GLU A 244 9.849 -6.818 1.540 1.00 0.00 O ATOM 404 CB GLU A 244 9.129 -9.249 -0.692 1.00 0.00 C ATOM 405 CG GLU A 244 8.260 -9.138 -1.933 1.00 0.00 C ATOM 406 CD GLU A 244 7.153 -10.174 -1.965 1.00 0.00 C ATOM 407 OE1 GLU A 244 6.786 -10.682 -0.885 1.00 0.00 O ATOM 408 OE2 GLU A 244 6.654 -10.476 -3.069 1.00 0.00 O ATOM 0 H GLU A 244 11.366 -9.171 -1.729 1.00 0.00 H new ATOM 0 HA GLU A 244 9.625 -7.172 -0.933 1.00 0.00 H new ATOM 0 HB2 GLU A 244 9.714 -10.167 -0.750 1.00 0.00 H new ATOM 0 HB3 GLU A 244 8.487 -9.335 0.184 1.00 0.00 H new ATOM 0 HG2 GLU A 244 7.821 -8.141 -1.977 1.00 0.00 H new ATOM 0 HG3 GLU A 244 8.884 -9.251 -2.820 1.00 0.00 H new ATOM 415 N GLU A 245 11.020 -8.738 1.632 1.00 0.00 N ATOM 416 CA GLU A 245 11.308 -8.622 3.056 1.00 0.00 C ATOM 417 C GLU A 245 11.630 -7.177 3.430 1.00 0.00 C ATOM 418 O GLU A 245 11.097 -6.644 4.403 1.00 0.00 O ATOM 419 CB GLU A 245 12.478 -9.531 3.438 1.00 0.00 C ATOM 420 CG GLU A 245 12.501 -9.908 4.910 1.00 0.00 C ATOM 421 CD GLU A 245 13.231 -11.212 5.167 1.00 0.00 C ATOM 422 OE1 GLU A 245 12.589 -12.279 5.071 1.00 0.00 O ATOM 423 OE2 GLU A 245 14.443 -11.165 5.464 1.00 0.00 O ATOM 0 H GLU A 245 11.408 -9.571 1.189 1.00 0.00 H new ATOM 0 HA GLU A 245 10.420 -8.933 3.607 1.00 0.00 H new ATOM 0 HB2 GLU A 245 12.431 -10.441 2.839 1.00 0.00 H new ATOM 0 HB3 GLU A 245 13.413 -9.031 3.185 1.00 0.00 H new ATOM 0 HG2 GLU A 245 12.979 -9.110 5.478 1.00 0.00 H new ATOM 0 HG3 GLU A 245 11.478 -9.991 5.276 1.00 0.00 H new ATOM 430 N MET A 246 12.505 -6.551 2.650 1.00 0.00 N ATOM 431 CA MET A 246 12.897 -5.169 2.899 1.00 0.00 C ATOM 432 C MET A 246 11.688 -4.240 2.831 1.00 0.00 C ATOM 433 O MET A 246 11.579 -3.291 3.608 1.00 0.00 O ATOM 434 CB MET A 246 13.952 -4.725 1.884 1.00 0.00 C ATOM 435 CG MET A 246 15.063 -5.742 1.679 1.00 0.00 C ATOM 436 SD MET A 246 16.607 -4.983 1.137 1.00 0.00 S ATOM 437 CE MET A 246 17.557 -6.434 0.688 1.00 0.00 C ATOM 0 H MET A 246 12.956 -6.978 1.841 1.00 0.00 H new ATOM 0 HA MET A 246 13.321 -5.113 3.902 1.00 0.00 H new ATOM 0 HB2 MET A 246 13.466 -4.532 0.928 1.00 0.00 H new ATOM 0 HB3 MET A 246 14.389 -3.783 2.215 1.00 0.00 H new ATOM 0 HG2 MET A 246 15.235 -6.280 2.611 1.00 0.00 H new ATOM 0 HG3 MET A 246 14.745 -6.478 0.940 1.00 0.00 H new ATOM 0 HE1 MET A 246 18.541 -6.129 0.332 1.00 0.00 H new ATOM 0 HE2 MET A 246 17.670 -7.079 1.560 1.00 0.00 H new ATOM 0 HE3 MET A 246 17.038 -6.979 -0.101 1.00 0.00 H new ATOM 447 N ILE A 247 10.783 -4.521 1.900 1.00 0.00 N ATOM 448 CA ILE A 247 9.583 -3.711 1.733 1.00 0.00 C ATOM 449 C ILE A 247 8.584 -3.971 2.856 1.00 0.00 C ATOM 450 O ILE A 247 7.899 -3.057 3.313 1.00 0.00 O ATOM 451 CB ILE A 247 8.901 -3.987 0.380 1.00 0.00 C ATOM 452 CG1 ILE A 247 9.901 -3.815 -0.765 1.00 0.00 C ATOM 453 CG2 ILE A 247 7.707 -3.063 0.190 1.00 0.00 C ATOM 454 CD1 ILE A 247 9.398 -4.341 -2.091 1.00 0.00 C ATOM 0 H ILE A 247 10.858 -5.303 1.250 1.00 0.00 H new ATOM 0 HA ILE A 247 9.899 -2.668 1.765 1.00 0.00 H new ATOM 0 HB ILE A 247 8.544 -5.017 0.374 1.00 0.00 H new ATOM 0 HG12 ILE A 247 10.141 -2.757 -0.871 1.00 0.00 H new ATOM 0 HG13 ILE A 247 10.827 -4.328 -0.508 1.00 0.00 H new ATOM 0 HG21 ILE A 247 7.236 -3.270 -0.771 1.00 0.00 H new ATOM 0 HG22 ILE A 247 6.987 -3.230 0.991 1.00 0.00 H new ATOM 0 HG23 ILE A 247 8.042 -2.026 0.213 1.00 0.00 H new ATOM 0 HD11 ILE A 247 10.159 -4.186 -2.856 1.00 0.00 H new ATOM 0 HD12 ILE A 247 9.184 -5.406 -2.002 1.00 0.00 H new ATOM 0 HD13 ILE A 247 8.488 -3.811 -2.371 1.00 0.00 H new ATOM 466 N GLU A 248 8.509 -5.223 3.295 1.00 0.00 N ATOM 467 CA GLU A 248 7.594 -5.603 4.365 1.00 0.00 C ATOM 468 C GLU A 248 8.058 -5.036 5.704 1.00 0.00 C ATOM 469 O GLU A 248 7.268 -4.468 6.458 1.00 0.00 O ATOM 470 CB GLU A 248 7.483 -7.126 4.456 1.00 0.00 C ATOM 471 CG GLU A 248 6.465 -7.603 5.478 1.00 0.00 C ATOM 472 CD GLU A 248 6.725 -9.023 5.941 1.00 0.00 C ATOM 473 OE1 GLU A 248 7.622 -9.217 6.788 1.00 0.00 O ATOM 474 OE2 GLU A 248 6.031 -9.941 5.456 1.00 0.00 O ATOM 0 H GLU A 248 9.070 -5.991 2.927 1.00 0.00 H new ATOM 0 HA GLU A 248 6.613 -5.188 4.133 1.00 0.00 H new ATOM 0 HB2 GLU A 248 7.214 -7.521 3.476 1.00 0.00 H new ATOM 0 HB3 GLU A 248 8.460 -7.538 4.709 1.00 0.00 H new ATOM 0 HG2 GLU A 248 6.480 -6.935 6.339 1.00 0.00 H new ATOM 0 HG3 GLU A 248 5.466 -7.543 5.046 1.00 0.00 H new ATOM 481 N LYS A 249 9.345 -5.194 5.993 1.00 0.00 N ATOM 482 CA LYS A 249 9.917 -4.698 7.239 1.00 0.00 C ATOM 483 C LYS A 249 9.811 -3.179 7.320 1.00 0.00 C ATOM 484 O LYS A 249 9.381 -2.631 8.334 1.00 0.00 O ATOM 485 CB LYS A 249 11.381 -5.126 7.358 1.00 0.00 C ATOM 486 CG LYS A 249 12.344 -4.205 6.630 1.00 0.00 C ATOM 487 CD LYS A 249 13.786 -4.647 6.814 1.00 0.00 C ATOM 488 CE LYS A 249 14.391 -4.061 8.081 1.00 0.00 C ATOM 489 NZ LYS A 249 14.757 -2.628 7.909 1.00 0.00 N ATOM 0 H LYS A 249 10.013 -5.662 5.380 1.00 0.00 H new ATOM 0 HA LYS A 249 9.351 -5.128 8.066 1.00 0.00 H new ATOM 0 HB2 LYS A 249 11.655 -5.165 8.412 1.00 0.00 H new ATOM 0 HB3 LYS A 249 11.489 -6.136 6.963 1.00 0.00 H new ATOM 0 HG2 LYS A 249 12.100 -4.189 5.568 1.00 0.00 H new ATOM 0 HG3 LYS A 249 12.225 -3.187 7.000 1.00 0.00 H new ATOM 0 HD2 LYS A 249 13.831 -5.735 6.857 1.00 0.00 H new ATOM 0 HD3 LYS A 249 14.376 -4.337 5.951 1.00 0.00 H new ATOM 0 HE2 LYS A 249 13.680 -4.158 8.902 1.00 0.00 H new ATOM 0 HE3 LYS A 249 15.277 -4.632 8.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 249 14.857 -2.181 8.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 249 15.658 -2.559 7.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 249 14.012 -2.142 7.370 1.00 0.00 H new ATOM 503 N GLU A 250 10.204 -2.505 6.244 1.00 0.00 N ATOM 504 CA GLU A 250 10.153 -1.049 6.194 1.00 0.00 C ATOM 505 C GLU A 250 8.741 -0.544 6.480 1.00 0.00 C ATOM 506 O GLU A 250 8.532 0.275 7.375 1.00 0.00 O ATOM 507 CB GLU A 250 10.619 -0.546 4.826 1.00 0.00 C ATOM 508 CG GLU A 250 12.129 -0.537 4.663 1.00 0.00 C ATOM 509 CD GLU A 250 12.835 0.181 5.797 1.00 0.00 C ATOM 510 OE1 GLU A 250 12.848 1.429 5.792 1.00 0.00 O ATOM 511 OE2 GLU A 250 13.373 -0.507 6.689 1.00 0.00 O ATOM 0 H GLU A 250 10.561 -2.944 5.395 1.00 0.00 H new ATOM 0 HA GLU A 250 10.822 -0.661 6.962 1.00 0.00 H new ATOM 0 HB2 GLU A 250 10.182 -1.174 4.049 1.00 0.00 H new ATOM 0 HB3 GLU A 250 10.239 0.464 4.671 1.00 0.00 H new ATOM 0 HG2 GLU A 250 12.491 -1.564 4.607 1.00 0.00 H new ATOM 0 HG3 GLU A 250 12.386 -0.057 3.719 1.00 0.00 H new ATOM 518 N PHE A 251 7.776 -1.039 5.712 1.00 0.00 N ATOM 519 CA PHE A 251 6.384 -0.638 5.881 1.00 0.00 C ATOM 520 C PHE A 251 5.862 -1.050 7.254 1.00 0.00 C ATOM 521 O PHE A 251 5.242 -0.254 7.958 1.00 0.00 O ATOM 522 CB PHE A 251 5.516 -1.260 4.785 1.00 0.00 C ATOM 523 CG PHE A 251 5.565 -0.511 3.484 1.00 0.00 C ATOM 524 CD1 PHE A 251 6.760 -0.367 2.797 1.00 0.00 C ATOM 525 CD2 PHE A 251 4.416 0.048 2.947 1.00 0.00 C ATOM 526 CE1 PHE A 251 6.808 0.322 1.600 1.00 0.00 C ATOM 527 CE2 PHE A 251 4.458 0.738 1.750 1.00 0.00 C ATOM 528 CZ PHE A 251 5.656 0.874 1.075 1.00 0.00 C ATOM 0 H PHE A 251 7.932 -1.718 4.967 1.00 0.00 H new ATOM 0 HA PHE A 251 6.333 0.448 5.804 1.00 0.00 H new ATOM 0 HB2 PHE A 251 5.839 -2.287 4.616 1.00 0.00 H new ATOM 0 HB3 PHE A 251 4.483 -1.303 5.131 1.00 0.00 H new ATOM 0 HD1 PHE A 251 7.664 -0.798 3.202 1.00 0.00 H new ATOM 0 HD2 PHE A 251 3.477 -0.057 3.470 1.00 0.00 H new ATOM 0 HE1 PHE A 251 7.746 0.429 1.075 1.00 0.00 H new ATOM 0 HE2 PHE A 251 3.556 1.170 1.343 1.00 0.00 H new ATOM 0 HZ PHE A 251 5.691 1.411 0.139 1.00 0.00 H new ATOM 538 N ASN A 252 6.118 -2.300 7.627 1.00 0.00 N ATOM 539 CA ASN A 252 5.673 -2.819 8.916 1.00 0.00 C ATOM 540 C ASN A 252 6.165 -1.935 10.058 1.00 0.00 C ATOM 541 O ASN A 252 5.401 -1.579 10.954 1.00 0.00 O ATOM 542 CB ASN A 252 6.174 -4.251 9.112 1.00 0.00 C ATOM 543 CG ASN A 252 5.352 -5.263 8.337 1.00 0.00 C ATOM 544 OD1 ASN A 252 4.951 -4.895 7.126 1.00 0.00 O flip ATOM 545 ND2 ASN A 252 5.083 -6.362 8.821 1.00 0.00 N flip ATOM 0 H ASN A 252 6.631 -2.972 7.056 1.00 0.00 H new ATOM 0 HA ASN A 252 4.583 -2.818 8.924 1.00 0.00 H new ATOM 0 HB2 ASN A 252 7.215 -4.315 8.796 1.00 0.00 H new ATOM 0 HB3 ASN A 252 6.146 -4.501 10.173 1.00 0.00 H new ATOM 0 HD21 ASN A 252 5.413 -6.602 9.756 1.00 0.00 H new ATOM 0 HD22 ASN A 252 4.531 -7.033 8.287 1.00 0.00 H new ATOM 552 N ASN A 253 7.446 -1.583 10.017 1.00 0.00 N ATOM 553 CA ASN A 253 8.041 -0.740 11.048 1.00 0.00 C ATOM 554 C ASN A 253 7.063 0.341 11.497 1.00 0.00 C ATOM 555 O ASN A 253 6.857 0.548 12.694 1.00 0.00 O ATOM 556 CB ASN A 253 9.328 -0.096 10.530 1.00 0.00 C ATOM 557 CG ASN A 253 10.529 -1.011 10.668 1.00 0.00 C ATOM 558 OD1 ASN A 253 10.389 -2.233 10.730 1.00 0.00 O ATOM 559 ND2 ASN A 253 11.719 -0.423 10.718 1.00 0.00 N ATOM 0 H ASN A 253 8.092 -1.868 9.281 1.00 0.00 H new ATOM 0 HA ASN A 253 8.278 -1.370 11.905 1.00 0.00 H new ATOM 0 HB2 ASN A 253 9.199 0.174 9.482 1.00 0.00 H new ATOM 0 HB3 ASN A 253 9.514 0.828 11.077 1.00 0.00 H new ATOM 0 HD21 ASN A 253 12.563 -0.988 10.811 1.00 0.00 H new ATOM 0 HD22 ASN A 253 11.788 0.593 10.663 1.00 0.00 H new ATOM 566 N ILE A 254 6.463 1.027 10.530 1.00 0.00 N ATOM 567 CA ILE A 254 5.505 2.086 10.827 1.00 0.00 C ATOM 568 C ILE A 254 4.474 1.623 11.850 1.00 0.00 C ATOM 569 O ILE A 254 4.325 2.224 12.914 1.00 0.00 O ATOM 570 CB ILE A 254 4.775 2.556 9.555 1.00 0.00 C ATOM 571 CG1 ILE A 254 5.785 3.023 8.504 1.00 0.00 C ATOM 572 CG2 ILE A 254 3.796 3.672 9.889 1.00 0.00 C ATOM 573 CD1 ILE A 254 6.706 4.118 8.995 1.00 0.00 C ATOM 0 H ILE A 254 6.623 0.869 9.535 1.00 0.00 H new ATOM 0 HA ILE A 254 6.073 2.920 11.240 1.00 0.00 H new ATOM 0 HB ILE A 254 4.214 1.717 9.144 1.00 0.00 H new ATOM 0 HG12 ILE A 254 6.385 2.171 8.185 1.00 0.00 H new ATOM 0 HG13 ILE A 254 5.245 3.380 7.627 1.00 0.00 H new ATOM 0 HG21 ILE A 254 3.288 3.994 8.980 1.00 0.00 H new ATOM 0 HG22 ILE A 254 3.061 3.308 10.607 1.00 0.00 H new ATOM 0 HG23 ILE A 254 4.338 4.514 10.320 1.00 0.00 H new ATOM 0 HD11 ILE A 254 7.394 4.399 8.198 1.00 0.00 H new ATOM 0 HD12 ILE A 254 6.115 4.986 9.287 1.00 0.00 H new ATOM 0 HD13 ILE A 254 7.273 3.759 9.854 1.00 0.00 H new ATOM 585 N LYS A 255 3.763 0.550 11.521 1.00 0.00 N ATOM 586 CA LYS A 255 2.746 0.003 12.412 1.00 0.00 C ATOM 587 C LYS A 255 2.763 -1.522 12.386 1.00 0.00 C ATOM 588 O LYS A 255 2.711 -2.149 11.328 1.00 0.00 O ATOM 589 CB LYS A 255 1.360 0.515 12.013 1.00 0.00 C ATOM 590 CG LYS A 255 0.259 0.102 12.975 1.00 0.00 C ATOM 591 CD LYS A 255 -0.971 0.982 12.825 1.00 0.00 C ATOM 592 CE LYS A 255 -1.799 1.003 14.100 1.00 0.00 C ATOM 593 NZ LYS A 255 -2.824 -0.078 14.113 1.00 0.00 N ATOM 0 H LYS A 255 3.872 0.042 10.644 1.00 0.00 H new ATOM 0 HA LYS A 255 2.971 0.334 13.426 1.00 0.00 H new ATOM 0 HB2 LYS A 255 1.388 1.603 11.951 1.00 0.00 H new ATOM 0 HB3 LYS A 255 1.118 0.145 11.017 1.00 0.00 H new ATOM 0 HG2 LYS A 255 -0.012 -0.938 12.794 1.00 0.00 H new ATOM 0 HG3 LYS A 255 0.628 0.162 13.999 1.00 0.00 H new ATOM 0 HD2 LYS A 255 -0.665 1.997 12.572 1.00 0.00 H new ATOM 0 HD3 LYS A 255 -1.582 0.618 11.999 1.00 0.00 H new ATOM 0 HE2 LYS A 255 -1.141 0.891 14.962 1.00 0.00 H new ATOM 0 HE3 LYS A 255 -2.291 1.971 14.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 255 -3.368 -0.030 14.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 255 -3.467 0.044 13.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 255 -2.354 -1.003 14.045 1.00 0.00 H new ATOM 607 N PRO A 256 2.836 -2.135 13.577 1.00 0.00 N ATOM 608 CA PRO A 256 2.860 -3.594 13.717 1.00 0.00 C ATOM 609 C PRO A 256 1.521 -4.232 13.361 1.00 0.00 C ATOM 610 O PRO A 256 0.498 -3.936 13.977 1.00 0.00 O ATOM 611 CB PRO A 256 3.174 -3.803 15.200 1.00 0.00 C ATOM 612 CG PRO A 256 2.691 -2.563 15.868 1.00 0.00 C ATOM 613 CD PRO A 256 2.901 -1.450 14.879 1.00 0.00 C ATOM 0 HA PRO A 256 3.583 -4.056 13.045 1.00 0.00 H new ATOM 0 HB2 PRO A 256 2.668 -4.686 15.591 1.00 0.00 H new ATOM 0 HB3 PRO A 256 4.242 -3.949 15.362 1.00 0.00 H new ATOM 0 HG2 PRO A 256 1.639 -2.651 16.139 1.00 0.00 H new ATOM 0 HG3 PRO A 256 3.243 -2.376 16.789 1.00 0.00 H new ATOM 0 HD2 PRO A 256 2.132 -0.683 14.968 1.00 0.00 H new ATOM 0 HD3 PRO A 256 3.862 -0.957 15.026 1.00 0.00 H new ATOM 621 N GLY A 257 1.536 -5.109 12.362 1.00 0.00 N ATOM 622 CA GLY A 257 0.317 -5.775 11.942 1.00 0.00 C ATOM 623 C GLY A 257 -0.583 -4.874 11.120 1.00 0.00 C ATOM 624 O GLY A 257 -1.807 -4.963 11.206 1.00 0.00 O ATOM 0 H GLY A 257 2.370 -5.370 11.836 1.00 0.00 H new ATOM 0 HA2 GLY A 257 0.573 -6.659 11.357 1.00 0.00 H new ATOM 0 HA3 GLY A 257 -0.226 -6.121 12.822 1.00 0.00 H new ATOM 628 N ALA A 258 0.025 -4.002 10.323 1.00 0.00 N ATOM 629 CA ALA A 258 -0.729 -3.080 9.482 1.00 0.00 C ATOM 630 C ALA A 258 -0.713 -3.528 8.025 1.00 0.00 C ATOM 631 O ALA A 258 -1.688 -3.341 7.296 1.00 0.00 O ATOM 632 CB ALA A 258 -0.170 -1.671 9.610 1.00 0.00 C ATOM 0 H ALA A 258 1.038 -3.914 10.242 1.00 0.00 H new ATOM 0 HA ALA A 258 -1.764 -3.080 9.823 1.00 0.00 H new ATOM 0 HB1 ALA A 258 -0.743 -0.993 8.977 1.00 0.00 H new ATOM 0 HB2 ALA A 258 -0.240 -1.344 10.648 1.00 0.00 H new ATOM 0 HB3 ALA A 258 0.874 -1.664 9.298 1.00 0.00 H new ATOM 638 N VAL A 259 0.400 -4.121 7.605 1.00 0.00 N ATOM 639 CA VAL A 259 0.543 -4.596 6.234 1.00 0.00 C ATOM 640 C VAL A 259 -0.136 -5.948 6.047 1.00 0.00 C ATOM 641 O VAL A 259 -0.205 -6.752 6.975 1.00 0.00 O ATOM 642 CB VAL A 259 2.026 -4.719 5.834 1.00 0.00 C ATOM 643 CG1 VAL A 259 2.158 -5.376 4.469 1.00 0.00 C ATOM 644 CG2 VAL A 259 2.695 -3.353 5.844 1.00 0.00 C ATOM 0 H VAL A 259 1.216 -4.284 8.195 1.00 0.00 H new ATOM 0 HA VAL A 259 0.061 -3.859 5.592 1.00 0.00 H new ATOM 0 HB VAL A 259 2.530 -5.351 6.565 1.00 0.00 H new ATOM 0 HG11 VAL A 259 3.212 -5.454 4.203 1.00 0.00 H new ATOM 0 HG12 VAL A 259 1.717 -6.372 4.500 1.00 0.00 H new ATOM 0 HG13 VAL A 259 1.640 -4.773 3.723 1.00 0.00 H new ATOM 0 HG21 VAL A 259 3.742 -3.458 5.559 1.00 0.00 H new ATOM 0 HG22 VAL A 259 2.191 -2.696 5.136 1.00 0.00 H new ATOM 0 HG23 VAL A 259 2.633 -2.925 6.844 1.00 0.00 H new ATOM 654 N GLU A 260 -0.636 -6.191 4.839 1.00 0.00 N ATOM 655 CA GLU A 260 -1.311 -7.446 4.531 1.00 0.00 C ATOM 656 C GLU A 260 -0.433 -8.335 3.655 1.00 0.00 C ATOM 657 O GLU A 260 -0.096 -9.458 4.033 1.00 0.00 O ATOM 658 CB GLU A 260 -2.643 -7.176 3.828 1.00 0.00 C ATOM 659 CG GLU A 260 -3.709 -6.601 4.746 1.00 0.00 C ATOM 660 CD GLU A 260 -4.446 -7.672 5.527 1.00 0.00 C ATOM 661 OE1 GLU A 260 -3.804 -8.669 5.918 1.00 0.00 O ATOM 662 OE2 GLU A 260 -5.665 -7.512 5.747 1.00 0.00 O ATOM 0 H GLU A 260 -0.586 -5.536 4.059 1.00 0.00 H new ATOM 0 HA GLU A 260 -1.503 -7.965 5.470 1.00 0.00 H new ATOM 0 HB2 GLU A 260 -2.475 -6.485 3.002 1.00 0.00 H new ATOM 0 HB3 GLU A 260 -3.011 -8.106 3.395 1.00 0.00 H new ATOM 0 HG2 GLU A 260 -3.245 -5.903 5.443 1.00 0.00 H new ATOM 0 HG3 GLU A 260 -4.425 -6.031 4.153 1.00 0.00 H new ATOM 669 N ARG A 261 -0.066 -7.825 2.484 1.00 0.00 N ATOM 670 CA ARG A 261 0.771 -8.572 1.554 1.00 0.00 C ATOM 671 C ARG A 261 1.599 -7.627 0.688 1.00 0.00 C ATOM 672 O ARG A 261 1.230 -6.471 0.484 1.00 0.00 O ATOM 673 CB ARG A 261 -0.092 -9.470 0.665 1.00 0.00 C ATOM 674 CG ARG A 261 -0.976 -8.700 -0.302 1.00 0.00 C ATOM 675 CD ARG A 261 -1.877 -9.633 -1.097 1.00 0.00 C ATOM 676 NE ARG A 261 -2.790 -10.378 -0.235 1.00 0.00 N ATOM 677 CZ ARG A 261 -2.466 -11.514 0.372 1.00 0.00 C ATOM 678 NH1 ARG A 261 -1.257 -12.033 0.212 1.00 0.00 N ATOM 679 NH2 ARG A 261 -3.352 -12.133 1.141 1.00 0.00 N ATOM 0 H ARG A 261 -0.335 -6.897 2.157 1.00 0.00 H new ATOM 0 HA ARG A 261 1.451 -9.194 2.136 1.00 0.00 H new ATOM 0 HB2 ARG A 261 0.557 -10.137 0.098 1.00 0.00 H new ATOM 0 HB3 ARG A 261 -0.720 -10.097 1.297 1.00 0.00 H new ATOM 0 HG2 ARG A 261 -1.587 -7.986 0.251 1.00 0.00 H new ATOM 0 HG3 ARG A 261 -0.353 -8.124 -0.986 1.00 0.00 H new ATOM 0 HD2 ARG A 261 -2.452 -9.053 -1.819 1.00 0.00 H new ATOM 0 HD3 ARG A 261 -1.264 -10.332 -1.665 1.00 0.00 H new ATOM 0 HE ARG A 261 -3.729 -10.005 -0.091 1.00 0.00 H new ATOM 0 HH11 ARG A 261 -0.573 -11.560 -0.378 1.00 0.00 H new ATOM 0 HH12 ARG A 261 -1.011 -12.906 0.679 1.00 0.00 H new ATOM 0 HH21 ARG A 261 -4.283 -11.737 1.267 1.00 0.00 H new ATOM 0 HH22 ARG A 261 -3.102 -13.005 1.607 1.00 0.00 H new ATOM 693 N VAL A 262 2.722 -8.127 0.182 1.00 0.00 N ATOM 694 CA VAL A 262 3.603 -7.328 -0.662 1.00 0.00 C ATOM 695 C VAL A 262 3.980 -8.083 -1.932 1.00 0.00 C ATOM 696 O VAL A 262 4.012 -9.314 -1.950 1.00 0.00 O ATOM 697 CB VAL A 262 4.889 -6.930 0.087 1.00 0.00 C ATOM 698 CG1 VAL A 262 5.821 -6.153 -0.829 1.00 0.00 C ATOM 699 CG2 VAL A 262 4.552 -6.121 1.330 1.00 0.00 C ATOM 0 H VAL A 262 3.043 -9.082 0.342 1.00 0.00 H new ATOM 0 HA VAL A 262 3.053 -6.425 -0.929 1.00 0.00 H new ATOM 0 HB VAL A 262 5.402 -7.839 0.401 1.00 0.00 H new ATOM 0 HG11 VAL A 262 6.724 -5.880 -0.283 1.00 0.00 H new ATOM 0 HG12 VAL A 262 6.088 -6.772 -1.686 1.00 0.00 H new ATOM 0 HG13 VAL A 262 5.320 -5.249 -1.176 1.00 0.00 H new ATOM 0 HG21 VAL A 262 5.472 -5.848 1.847 1.00 0.00 H new ATOM 0 HG22 VAL A 262 4.016 -5.217 1.041 1.00 0.00 H new ATOM 0 HG23 VAL A 262 3.926 -6.717 1.994 1.00 0.00 H new ATOM 709 N LYS A 263 4.266 -7.337 -2.994 1.00 0.00 N ATOM 710 CA LYS A 263 4.644 -7.934 -4.269 1.00 0.00 C ATOM 711 C LYS A 263 5.754 -7.130 -4.939 1.00 0.00 C ATOM 712 O LYS A 263 5.531 -6.012 -5.404 1.00 0.00 O ATOM 713 CB LYS A 263 3.429 -8.017 -5.196 1.00 0.00 C ATOM 714 CG LYS A 263 3.642 -8.921 -6.398 1.00 0.00 C ATOM 715 CD LYS A 263 2.321 -9.325 -7.032 1.00 0.00 C ATOM 716 CE LYS A 263 1.612 -8.131 -7.652 1.00 0.00 C ATOM 717 NZ LYS A 263 2.126 -7.828 -9.016 1.00 0.00 N ATOM 0 H LYS A 263 4.243 -6.317 -2.997 1.00 0.00 H new ATOM 0 HA LYS A 263 5.015 -8.940 -4.075 1.00 0.00 H new ATOM 0 HB2 LYS A 263 2.572 -8.379 -4.627 1.00 0.00 H new ATOM 0 HB3 LYS A 263 3.180 -7.015 -5.545 1.00 0.00 H new ATOM 0 HG2 LYS A 263 4.259 -8.408 -7.136 1.00 0.00 H new ATOM 0 HG3 LYS A 263 4.188 -9.813 -6.091 1.00 0.00 H new ATOM 0 HD2 LYS A 263 2.499 -10.081 -7.797 1.00 0.00 H new ATOM 0 HD3 LYS A 263 1.678 -9.780 -6.278 1.00 0.00 H new ATOM 0 HE2 LYS A 263 0.542 -8.331 -7.703 1.00 0.00 H new ATOM 0 HE3 LYS A 263 1.743 -7.258 -7.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 263 1.618 -7.008 -9.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 263 3.142 -7.613 -8.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 263 1.978 -8.651 -9.634 1.00 0.00 H new ATOM 731 N LYS A 264 6.950 -7.706 -4.985 1.00 0.00 N ATOM 732 CA LYS A 264 8.095 -7.046 -5.600 1.00 0.00 C ATOM 733 C LYS A 264 8.049 -7.179 -7.118 1.00 0.00 C ATOM 734 O LYS A 264 7.665 -8.223 -7.648 1.00 0.00 O ATOM 735 CB LYS A 264 9.401 -7.639 -5.064 1.00 0.00 C ATOM 736 CG LYS A 264 10.645 -7.047 -5.704 1.00 0.00 C ATOM 737 CD LYS A 264 11.057 -5.751 -5.026 1.00 0.00 C ATOM 738 CE LYS A 264 11.890 -4.878 -5.953 1.00 0.00 C ATOM 739 NZ LYS A 264 11.038 -3.980 -6.781 1.00 0.00 N ATOM 0 H LYS A 264 7.152 -8.630 -4.603 1.00 0.00 H new ATOM 0 HA LYS A 264 8.052 -5.987 -5.344 1.00 0.00 H new ATOM 0 HB2 LYS A 264 9.447 -7.481 -3.986 1.00 0.00 H new ATOM 0 HB3 LYS A 264 9.396 -8.717 -5.228 1.00 0.00 H new ATOM 0 HG2 LYS A 264 11.463 -7.765 -5.645 1.00 0.00 H new ATOM 0 HG3 LYS A 264 10.458 -6.862 -6.762 1.00 0.00 H new ATOM 0 HD2 LYS A 264 10.168 -5.205 -4.712 1.00 0.00 H new ATOM 0 HD3 LYS A 264 11.628 -5.976 -4.125 1.00 0.00 H new ATOM 0 HE2 LYS A 264 12.583 -4.279 -5.362 1.00 0.00 H new ATOM 0 HE3 LYS A 264 12.492 -5.511 -6.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 264 11.637 -3.277 -7.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 264 10.530 -4.543 -7.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 264 10.352 -3.493 -6.170 1.00 0.00 H new ATOM 753 N ILE A 265 8.444 -6.118 -7.813 1.00 0.00 N ATOM 754 CA ILE A 265 8.450 -6.118 -9.271 1.00 0.00 C ATOM 755 C ILE A 265 9.771 -5.584 -9.815 1.00 0.00 C ATOM 756 O ILE A 265 10.610 -5.091 -9.062 1.00 0.00 O ATOM 757 CB ILE A 265 7.294 -5.274 -9.839 1.00 0.00 C ATOM 758 CG1 ILE A 265 6.026 -5.482 -9.009 1.00 0.00 C ATOM 759 CG2 ILE A 265 7.044 -5.631 -11.296 1.00 0.00 C ATOM 760 CD1 ILE A 265 4.940 -4.470 -9.300 1.00 0.00 C ATOM 0 H ILE A 265 8.764 -5.247 -7.390 1.00 0.00 H new ATOM 0 HA ILE A 265 8.322 -7.153 -9.587 1.00 0.00 H new ATOM 0 HB ILE A 265 7.572 -4.221 -9.786 1.00 0.00 H new ATOM 0 HG12 ILE A 265 5.638 -6.483 -9.198 1.00 0.00 H new ATOM 0 HG13 ILE A 265 6.282 -5.434 -7.951 1.00 0.00 H new ATOM 0 HG21 ILE A 265 6.224 -5.026 -11.683 1.00 0.00 H new ATOM 0 HG22 ILE A 265 7.945 -5.436 -11.878 1.00 0.00 H new ATOM 0 HG23 ILE A 265 6.784 -6.687 -11.372 1.00 0.00 H new ATOM 0 HD11 ILE A 265 4.071 -4.679 -8.676 1.00 0.00 H new ATOM 0 HD12 ILE A 265 5.310 -3.468 -9.084 1.00 0.00 H new ATOM 0 HD13 ILE A 265 4.656 -4.533 -10.350 1.00 0.00 H new ATOM 772 N ARG A 266 9.946 -5.683 -11.129 1.00 0.00 N ATOM 773 CA ARG A 266 11.164 -5.209 -11.775 1.00 0.00 C ATOM 774 C ARG A 266 11.746 -4.014 -11.027 1.00 0.00 C ATOM 775 O ARG A 266 12.773 -4.128 -10.357 1.00 0.00 O ATOM 776 CB ARG A 266 10.880 -4.825 -13.228 1.00 0.00 C ATOM 777 CG ARG A 266 10.375 -5.982 -14.076 1.00 0.00 C ATOM 778 CD ARG A 266 11.523 -6.733 -14.733 1.00 0.00 C ATOM 779 NE ARG A 266 12.060 -6.014 -15.885 1.00 0.00 N ATOM 780 CZ ARG A 266 13.072 -6.458 -16.621 1.00 0.00 C ATOM 781 NH1 ARG A 266 13.654 -7.613 -16.328 1.00 0.00 N ATOM 782 NH2 ARG A 266 13.504 -5.746 -17.655 1.00 0.00 N ATOM 0 H ARG A 266 9.260 -6.087 -11.767 1.00 0.00 H new ATOM 0 HA ARG A 266 11.894 -6.018 -11.756 1.00 0.00 H new ATOM 0 HB2 ARG A 266 10.142 -4.023 -13.245 1.00 0.00 H new ATOM 0 HB3 ARG A 266 11.792 -4.429 -13.675 1.00 0.00 H new ATOM 0 HG2 ARG A 266 9.800 -6.667 -13.453 1.00 0.00 H new ATOM 0 HG3 ARG A 266 9.699 -5.604 -14.843 1.00 0.00 H new ATOM 0 HD2 ARG A 266 12.317 -6.892 -14.003 1.00 0.00 H new ATOM 0 HD3 ARG A 266 11.178 -7.718 -15.049 1.00 0.00 H new ATOM 0 HE ARG A 266 11.635 -5.122 -16.138 1.00 0.00 H new ATOM 0 HH11 ARG A 266 13.324 -8.163 -15.535 1.00 0.00 H new ATOM 0 HH12 ARG A 266 14.431 -7.951 -16.896 1.00 0.00 H new ATOM 0 HH21 ARG A 266 13.058 -4.858 -17.884 1.00 0.00 H new ATOM 0 HH22 ARG A 266 14.281 -6.087 -18.220 1.00 0.00 H new ATOM 796 N ASP A 267 11.084 -2.868 -11.145 1.00 0.00 N ATOM 797 CA ASP A 267 11.535 -1.652 -10.480 1.00 0.00 C ATOM 798 C ASP A 267 10.414 -1.040 -9.646 1.00 0.00 C ATOM 799 O ASP A 267 10.475 0.130 -9.267 1.00 0.00 O ATOM 800 CB ASP A 267 12.033 -0.636 -11.510 1.00 0.00 C ATOM 801 CG ASP A 267 11.218 -0.661 -12.788 1.00 0.00 C ATOM 802 OD1 ASP A 267 11.025 -1.760 -13.348 1.00 0.00 O ATOM 803 OD2 ASP A 267 10.773 0.419 -13.228 1.00 0.00 O ATOM 0 H ASP A 267 10.233 -2.756 -11.696 1.00 0.00 H new ATOM 0 HA ASP A 267 12.357 -1.916 -9.814 1.00 0.00 H new ATOM 0 HB2 ASP A 267 11.995 0.364 -11.078 1.00 0.00 H new ATOM 0 HB3 ASP A 267 13.077 -0.842 -11.744 1.00 0.00 H new ATOM 808 N TYR A 268 9.390 -1.839 -9.365 1.00 0.00 N ATOM 809 CA TYR A 268 8.252 -1.375 -8.579 1.00 0.00 C ATOM 810 C TYR A 268 7.705 -2.496 -7.700 1.00 0.00 C ATOM 811 O TYR A 268 8.169 -3.634 -7.765 1.00 0.00 O ATOM 812 CB TYR A 268 7.150 -0.850 -9.500 1.00 0.00 C ATOM 813 CG TYR A 268 7.030 -1.615 -10.798 1.00 0.00 C ATOM 814 CD1 TYR A 268 8.070 -1.629 -11.719 1.00 0.00 C ATOM 815 CD2 TYR A 268 5.875 -2.324 -11.105 1.00 0.00 C ATOM 816 CE1 TYR A 268 7.964 -2.325 -12.907 1.00 0.00 C ATOM 817 CE2 TYR A 268 5.760 -3.025 -12.290 1.00 0.00 C ATOM 818 CZ TYR A 268 6.807 -3.022 -13.187 1.00 0.00 C ATOM 819 OH TYR A 268 6.698 -3.719 -14.369 1.00 0.00 O ATOM 0 H TYR A 268 9.325 -2.810 -9.669 1.00 0.00 H new ATOM 0 HA TYR A 268 8.593 -0.565 -7.934 1.00 0.00 H new ATOM 0 HB2 TYR A 268 6.197 -0.893 -8.973 1.00 0.00 H new ATOM 0 HB3 TYR A 268 7.344 0.199 -9.723 1.00 0.00 H new ATOM 0 HD1 TYR A 268 8.978 -1.086 -11.502 1.00 0.00 H new ATOM 0 HD2 TYR A 268 5.053 -2.327 -10.405 1.00 0.00 H new ATOM 0 HE1 TYR A 268 8.782 -2.324 -13.612 1.00 0.00 H new ATOM 0 HE2 TYR A 268 4.856 -3.572 -12.512 1.00 0.00 H new ATOM 0 HH TYR A 268 5.822 -4.156 -14.412 1.00 0.00 H new ATOM 829 N ALA A 269 6.714 -2.164 -6.879 1.00 0.00 N ATOM 830 CA ALA A 269 6.100 -3.141 -5.989 1.00 0.00 C ATOM 831 C ALA A 269 4.788 -2.616 -5.418 1.00 0.00 C ATOM 832 O ALA A 269 4.550 -1.408 -5.391 1.00 0.00 O ATOM 833 CB ALA A 269 7.059 -3.506 -4.864 1.00 0.00 C ATOM 0 H ALA A 269 6.319 -1.226 -6.812 1.00 0.00 H new ATOM 0 HA ALA A 269 5.880 -4.037 -6.570 1.00 0.00 H new ATOM 0 HB1 ALA A 269 6.588 -4.237 -4.207 1.00 0.00 H new ATOM 0 HB2 ALA A 269 7.969 -3.932 -5.286 1.00 0.00 H new ATOM 0 HB3 ALA A 269 7.307 -2.611 -4.293 1.00 0.00 H new ATOM 839 N PHE A 270 3.938 -3.530 -4.962 1.00 0.00 N ATOM 840 CA PHE A 270 2.648 -3.158 -4.393 1.00 0.00 C ATOM 841 C PHE A 270 2.559 -3.576 -2.928 1.00 0.00 C ATOM 842 O PHE A 270 3.191 -4.545 -2.507 1.00 0.00 O ATOM 843 CB PHE A 270 1.511 -3.802 -5.189 1.00 0.00 C ATOM 844 CG PHE A 270 1.381 -3.271 -6.587 1.00 0.00 C ATOM 845 CD1 PHE A 270 0.686 -2.098 -6.836 1.00 0.00 C ATOM 846 CD2 PHE A 270 1.955 -3.944 -7.654 1.00 0.00 C ATOM 847 CE1 PHE A 270 0.566 -1.606 -8.122 1.00 0.00 C ATOM 848 CE2 PHE A 270 1.839 -3.456 -8.942 1.00 0.00 C ATOM 849 CZ PHE A 270 1.142 -2.287 -9.176 1.00 0.00 C ATOM 0 H PHE A 270 4.119 -4.534 -4.975 1.00 0.00 H new ATOM 0 HA PHE A 270 2.553 -2.074 -4.450 1.00 0.00 H new ATOM 0 HB2 PHE A 270 1.673 -4.879 -5.232 1.00 0.00 H new ATOM 0 HB3 PHE A 270 0.572 -3.642 -4.660 1.00 0.00 H new ATOM 0 HD1 PHE A 270 0.233 -1.562 -6.015 1.00 0.00 H new ATOM 0 HD2 PHE A 270 2.499 -4.860 -7.477 1.00 0.00 H new ATOM 0 HE1 PHE A 270 0.023 -0.690 -8.302 1.00 0.00 H new ATOM 0 HE2 PHE A 270 2.293 -3.988 -9.765 1.00 0.00 H new ATOM 0 HZ PHE A 270 1.048 -1.906 -10.182 1.00 0.00 H new ATOM 859 N VAL A 271 1.769 -2.837 -2.155 1.00 0.00 N ATOM 860 CA VAL A 271 1.596 -3.130 -0.737 1.00 0.00 C ATOM 861 C VAL A 271 0.142 -2.954 -0.313 1.00 0.00 C ATOM 862 O VAL A 271 -0.503 -1.965 -0.663 1.00 0.00 O ATOM 863 CB VAL A 271 2.487 -2.226 0.135 1.00 0.00 C ATOM 864 CG1 VAL A 271 2.304 -2.557 1.609 1.00 0.00 C ATOM 865 CG2 VAL A 271 3.946 -2.362 -0.273 1.00 0.00 C ATOM 0 H VAL A 271 1.239 -2.031 -2.487 1.00 0.00 H new ATOM 0 HA VAL A 271 1.891 -4.169 -0.590 1.00 0.00 H new ATOM 0 HB VAL A 271 2.185 -1.190 -0.020 1.00 0.00 H new ATOM 0 HG11 VAL A 271 2.942 -1.908 2.209 1.00 0.00 H new ATOM 0 HG12 VAL A 271 1.262 -2.403 1.890 1.00 0.00 H new ATOM 0 HG13 VAL A 271 2.577 -3.597 1.785 1.00 0.00 H new ATOM 0 HG21 VAL A 271 4.561 -1.716 0.354 1.00 0.00 H new ATOM 0 HG22 VAL A 271 4.264 -3.397 -0.149 1.00 0.00 H new ATOM 0 HG23 VAL A 271 4.061 -2.070 -1.317 1.00 0.00 H new ATOM 875 N HIS A 272 -0.369 -3.921 0.443 1.00 0.00 N ATOM 876 CA HIS A 272 -1.748 -3.873 0.916 1.00 0.00 C ATOM 877 C HIS A 272 -1.796 -3.720 2.434 1.00 0.00 C ATOM 878 O HIS A 272 -0.836 -4.047 3.132 1.00 0.00 O ATOM 879 CB HIS A 272 -2.498 -5.137 0.495 1.00 0.00 C ATOM 880 CG HIS A 272 -3.071 -5.061 -0.886 1.00 0.00 C ATOM 881 ND1 HIS A 272 -4.421 -5.169 -1.148 1.00 0.00 N ATOM 882 CD2 HIS A 272 -2.470 -4.884 -2.086 1.00 0.00 C ATOM 883 CE1 HIS A 272 -4.624 -5.064 -2.449 1.00 0.00 C ATOM 884 NE2 HIS A 272 -3.456 -4.890 -3.041 1.00 0.00 N ATOM 0 H HIS A 272 0.151 -4.747 0.741 1.00 0.00 H new ATOM 0 HA HIS A 272 -2.231 -3.006 0.465 1.00 0.00 H new ATOM 0 HB2 HIS A 272 -1.819 -5.988 0.552 1.00 0.00 H new ATOM 0 HB3 HIS A 272 -3.304 -5.324 1.204 1.00 0.00 H new ATOM 0 HD2 HIS A 272 -1.411 -4.761 -2.260 1.00 0.00 H new ATOM 0 HE1 HIS A 272 -5.582 -5.112 -2.945 1.00 0.00 H new ATOM 0 HE2 HIS A 272 -3.310 -4.778 -4.044 1.00 0.00 H new ATOM 892 N PHE A 273 -2.919 -3.220 2.937 1.00 0.00 N ATOM 893 CA PHE A 273 -3.092 -3.022 4.372 1.00 0.00 C ATOM 894 C PHE A 273 -4.440 -3.566 4.838 1.00 0.00 C ATOM 895 O PHE A 273 -5.269 -3.977 4.026 1.00 0.00 O ATOM 896 CB PHE A 273 -2.981 -1.536 4.720 1.00 0.00 C ATOM 897 CG PHE A 273 -1.565 -1.046 4.814 1.00 0.00 C ATOM 898 CD1 PHE A 273 -0.811 -0.843 3.669 1.00 0.00 C ATOM 899 CD2 PHE A 273 -0.987 -0.788 6.046 1.00 0.00 C ATOM 900 CE1 PHE A 273 0.494 -0.394 3.753 1.00 0.00 C ATOM 901 CE2 PHE A 273 0.317 -0.337 6.136 1.00 0.00 C ATOM 902 CZ PHE A 273 1.057 -0.139 4.988 1.00 0.00 C ATOM 0 H PHE A 273 -3.723 -2.944 2.373 1.00 0.00 H new ATOM 0 HA PHE A 273 -2.302 -3.569 4.887 1.00 0.00 H new ATOM 0 HB2 PHE A 273 -3.509 -0.954 3.965 1.00 0.00 H new ATOM 0 HB3 PHE A 273 -3.483 -1.355 5.670 1.00 0.00 H new ATOM 0 HD1 PHE A 273 -1.248 -1.038 2.701 1.00 0.00 H new ATOM 0 HD2 PHE A 273 -1.562 -0.941 6.947 1.00 0.00 H new ATOM 0 HE1 PHE A 273 1.073 -0.243 2.854 1.00 0.00 H new ATOM 0 HE2 PHE A 273 0.756 -0.140 7.103 1.00 0.00 H new ATOM 0 HZ PHE A 273 2.075 0.215 5.055 1.00 0.00 H new ATOM 912 N SER A 274 -4.650 -3.564 6.150 1.00 0.00 N ATOM 913 CA SER A 274 -5.894 -4.062 6.725 1.00 0.00 C ATOM 914 C SER A 274 -6.988 -3.000 6.654 1.00 0.00 C ATOM 915 O SER A 274 -8.174 -3.307 6.766 1.00 0.00 O ATOM 916 CB SER A 274 -5.674 -4.487 8.178 1.00 0.00 C ATOM 917 OG SER A 274 -6.869 -4.995 8.747 1.00 0.00 O ATOM 0 H SER A 274 -3.975 -3.223 6.835 1.00 0.00 H new ATOM 0 HA SER A 274 -6.213 -4.928 6.145 1.00 0.00 H new ATOM 0 HB2 SER A 274 -4.894 -5.247 8.224 1.00 0.00 H new ATOM 0 HB3 SER A 274 -5.324 -3.635 8.760 1.00 0.00 H new ATOM 0 HG SER A 274 -6.702 -5.261 9.675 1.00 0.00 H new ATOM 923 N ASN A 275 -6.578 -1.750 6.467 1.00 0.00 N ATOM 924 CA ASN A 275 -7.522 -0.641 6.382 1.00 0.00 C ATOM 925 C ASN A 275 -6.910 0.538 5.632 1.00 0.00 C ATOM 926 O ASN A 275 -5.689 0.648 5.518 1.00 0.00 O ATOM 927 CB ASN A 275 -7.953 -0.201 7.782 1.00 0.00 C ATOM 928 CG ASN A 275 -8.189 -1.377 8.711 1.00 0.00 C ATOM 929 OD1 ASN A 275 -9.358 -1.997 8.595 1.00 0.00 O flip ATOM 930 ND2 ASN A 275 -7.330 -1.724 9.522 1.00 0.00 N flip ATOM 0 H ASN A 275 -5.599 -1.479 6.371 1.00 0.00 H new ATOM 0 HA ASN A 275 -8.398 -0.984 5.831 1.00 0.00 H new ATOM 0 HB2 ASN A 275 -7.187 0.447 8.208 1.00 0.00 H new ATOM 0 HB3 ASN A 275 -8.866 0.390 7.709 1.00 0.00 H new ATOM 0 HD21 ASN A 275 -6.446 -1.218 9.576 1.00 0.00 H new ATOM 0 HD22 ASN A 275 -7.502 -2.517 10.140 1.00 0.00 H new ATOM 937 N ARG A 276 -7.767 1.417 5.122 1.00 0.00 N ATOM 938 CA ARG A 276 -7.311 2.588 4.383 1.00 0.00 C ATOM 939 C ARG A 276 -6.460 3.493 5.269 1.00 0.00 C ATOM 940 O ARG A 276 -5.375 3.920 4.875 1.00 0.00 O ATOM 941 CB ARG A 276 -8.507 3.370 3.835 1.00 0.00 C ATOM 942 CG ARG A 276 -8.123 4.446 2.833 1.00 0.00 C ATOM 943 CD ARG A 276 -9.318 4.881 1.999 1.00 0.00 C ATOM 944 NE ARG A 276 -9.098 6.176 1.360 1.00 0.00 N ATOM 945 CZ ARG A 276 -9.744 6.578 0.272 1.00 0.00 C ATOM 946 NH1 ARG A 276 -10.646 5.790 -0.297 1.00 0.00 N ATOM 947 NH2 ARG A 276 -9.488 7.770 -0.251 1.00 0.00 N ATOM 0 H ARG A 276 -8.781 1.340 5.207 1.00 0.00 H new ATOM 0 HA ARG A 276 -6.698 2.244 3.550 1.00 0.00 H new ATOM 0 HB2 ARG A 276 -9.199 2.674 3.361 1.00 0.00 H new ATOM 0 HB3 ARG A 276 -9.040 3.833 4.666 1.00 0.00 H new ATOM 0 HG2 ARG A 276 -7.713 5.307 3.361 1.00 0.00 H new ATOM 0 HG3 ARG A 276 -7.337 4.071 2.177 1.00 0.00 H new ATOM 0 HD2 ARG A 276 -9.520 4.130 1.235 1.00 0.00 H new ATOM 0 HD3 ARG A 276 -10.202 4.936 2.634 1.00 0.00 H new ATOM 0 HE ARG A 276 -8.410 6.806 1.772 1.00 0.00 H new ATOM 0 HH11 ARG A 276 -10.845 4.872 0.101 1.00 0.00 H new ATOM 0 HH12 ARG A 276 -11.141 6.102 -1.133 1.00 0.00 H new ATOM 0 HH21 ARG A 276 -8.794 8.379 0.183 1.00 0.00 H new ATOM 0 HH22 ARG A 276 -9.985 8.078 -1.087 1.00 0.00 H new ATOM 961 N GLU A 277 -6.961 3.781 6.466 1.00 0.00 N ATOM 962 CA GLU A 277 -6.247 4.637 7.406 1.00 0.00 C ATOM 963 C GLU A 277 -4.790 4.204 7.537 1.00 0.00 C ATOM 964 O GLU A 277 -3.882 5.035 7.537 1.00 0.00 O ATOM 965 CB GLU A 277 -6.925 4.603 8.777 1.00 0.00 C ATOM 966 CG GLU A 277 -7.050 3.205 9.360 1.00 0.00 C ATOM 967 CD GLU A 277 -7.844 3.181 10.652 1.00 0.00 C ATOM 968 OE1 GLU A 277 -8.893 3.855 10.718 1.00 0.00 O ATOM 969 OE2 GLU A 277 -7.416 2.486 11.598 1.00 0.00 O ATOM 0 H GLU A 277 -7.858 3.435 6.807 1.00 0.00 H new ATOM 0 HA GLU A 277 -6.272 5.656 7.021 1.00 0.00 H new ATOM 0 HB2 GLU A 277 -6.359 5.227 9.469 1.00 0.00 H new ATOM 0 HB3 GLU A 277 -7.919 5.042 8.692 1.00 0.00 H new ATOM 0 HG2 GLU A 277 -7.530 2.553 8.631 1.00 0.00 H new ATOM 0 HG3 GLU A 277 -6.054 2.801 9.542 1.00 0.00 H new ATOM 976 N ASP A 278 -4.574 2.898 7.649 1.00 0.00 N ATOM 977 CA ASP A 278 -3.228 2.353 7.780 1.00 0.00 C ATOM 978 C ASP A 278 -2.414 2.605 6.514 1.00 0.00 C ATOM 979 O ASP A 278 -1.299 3.122 6.574 1.00 0.00 O ATOM 980 CB ASP A 278 -3.288 0.853 8.073 1.00 0.00 C ATOM 981 CG ASP A 278 -4.084 0.539 9.324 1.00 0.00 C ATOM 982 OD1 ASP A 278 -3.616 0.887 10.428 1.00 0.00 O ATOM 983 OD2 ASP A 278 -5.176 -0.056 9.199 1.00 0.00 O ATOM 0 H ASP A 278 -5.315 2.197 7.652 1.00 0.00 H new ATOM 0 HA ASP A 278 -2.738 2.858 8.612 1.00 0.00 H new ATOM 0 HB2 ASP A 278 -3.734 0.337 7.223 1.00 0.00 H new ATOM 0 HB3 ASP A 278 -2.275 0.467 8.184 1.00 0.00 H new ATOM 988 N ALA A 279 -2.980 2.234 5.370 1.00 0.00 N ATOM 989 CA ALA A 279 -2.308 2.420 4.090 1.00 0.00 C ATOM 990 C ALA A 279 -1.924 3.881 3.879 1.00 0.00 C ATOM 991 O ALA A 279 -0.852 4.182 3.354 1.00 0.00 O ATOM 992 CB ALA A 279 -3.195 1.936 2.953 1.00 0.00 C ATOM 0 H ALA A 279 -3.902 1.803 5.304 1.00 0.00 H new ATOM 0 HA ALA A 279 -1.393 1.828 4.099 1.00 0.00 H new ATOM 0 HB1 ALA A 279 -2.680 2.081 2.003 1.00 0.00 H new ATOM 0 HB2 ALA A 279 -3.415 0.877 3.089 1.00 0.00 H new ATOM 0 HB3 ALA A 279 -4.126 2.503 2.951 1.00 0.00 H new ATOM 998 N VAL A 280 -2.807 4.786 4.291 1.00 0.00 N ATOM 999 CA VAL A 280 -2.560 6.215 4.147 1.00 0.00 C ATOM 1000 C VAL A 280 -1.419 6.670 5.051 1.00 0.00 C ATOM 1001 O VAL A 280 -0.510 7.373 4.612 1.00 0.00 O ATOM 1002 CB VAL A 280 -3.819 7.038 4.476 1.00 0.00 C ATOM 1003 CG1 VAL A 280 -3.496 8.524 4.496 1.00 0.00 C ATOM 1004 CG2 VAL A 280 -4.926 6.739 3.476 1.00 0.00 C ATOM 0 H VAL A 280 -3.699 4.554 4.727 1.00 0.00 H new ATOM 0 HA VAL A 280 -2.285 6.385 3.106 1.00 0.00 H new ATOM 0 HB VAL A 280 -4.169 6.753 5.468 1.00 0.00 H new ATOM 0 HG11 VAL A 280 -4.398 9.089 4.730 1.00 0.00 H new ATOM 0 HG12 VAL A 280 -2.737 8.721 5.253 1.00 0.00 H new ATOM 0 HG13 VAL A 280 -3.121 8.828 3.519 1.00 0.00 H new ATOM 0 HG21 VAL A 280 -5.809 7.329 3.723 1.00 0.00 H new ATOM 0 HG22 VAL A 280 -4.588 6.995 2.472 1.00 0.00 H new ATOM 0 HG23 VAL A 280 -5.176 5.679 3.516 1.00 0.00 H new ATOM 1014 N GLU A 281 -1.475 6.262 6.315 1.00 0.00 N ATOM 1015 CA GLU A 281 -0.446 6.628 7.281 1.00 0.00 C ATOM 1016 C GLU A 281 0.926 6.138 6.826 1.00 0.00 C ATOM 1017 O GLU A 281 1.901 6.889 6.839 1.00 0.00 O ATOM 1018 CB GLU A 281 -0.777 6.047 8.657 1.00 0.00 C ATOM 1019 CG GLU A 281 0.138 6.544 9.764 1.00 0.00 C ATOM 1020 CD GLU A 281 -0.155 7.977 10.164 1.00 0.00 C ATOM 1021 OE1 GLU A 281 0.373 8.896 9.503 1.00 0.00 O ATOM 1022 OE2 GLU A 281 -0.911 8.180 11.136 1.00 0.00 O ATOM 0 H GLU A 281 -2.221 5.679 6.693 1.00 0.00 H new ATOM 0 HA GLU A 281 -0.420 7.715 7.351 1.00 0.00 H new ATOM 0 HB2 GLU A 281 -1.807 6.297 8.909 1.00 0.00 H new ATOM 0 HB3 GLU A 281 -0.716 4.960 8.607 1.00 0.00 H new ATOM 0 HG2 GLU A 281 0.031 5.898 10.636 1.00 0.00 H new ATOM 0 HG3 GLU A 281 1.174 6.467 9.435 1.00 0.00 H new ATOM 1029 N ALA A 282 0.993 4.872 6.426 1.00 0.00 N ATOM 1030 CA ALA A 282 2.244 4.282 5.966 1.00 0.00 C ATOM 1031 C ALA A 282 2.765 4.997 4.724 1.00 0.00 C ATOM 1032 O ALA A 282 3.973 5.140 4.540 1.00 0.00 O ATOM 1033 CB ALA A 282 2.054 2.799 5.683 1.00 0.00 C ATOM 0 H ALA A 282 0.196 4.236 6.411 1.00 0.00 H new ATOM 0 HA ALA A 282 2.985 4.399 6.757 1.00 0.00 H new ATOM 0 HB1 ALA A 282 2.996 2.370 5.340 1.00 0.00 H new ATOM 0 HB2 ALA A 282 1.735 2.293 6.594 1.00 0.00 H new ATOM 0 HB3 ALA A 282 1.295 2.670 4.912 1.00 0.00 H new ATOM 1039 N MET A 283 1.845 5.443 3.874 1.00 0.00 N ATOM 1040 CA MET A 283 2.213 6.144 2.649 1.00 0.00 C ATOM 1041 C MET A 283 2.994 7.415 2.964 1.00 0.00 C ATOM 1042 O MET A 283 4.133 7.581 2.527 1.00 0.00 O ATOM 1043 CB MET A 283 0.962 6.488 1.838 1.00 0.00 C ATOM 1044 CG MET A 283 1.267 7.118 0.489 1.00 0.00 C ATOM 1045 SD MET A 283 -0.219 7.435 -0.482 1.00 0.00 S ATOM 1046 CE MET A 283 -1.022 8.680 0.526 1.00 0.00 C ATOM 0 H MET A 283 0.840 5.331 4.011 1.00 0.00 H new ATOM 0 HA MET A 283 2.850 5.484 2.059 1.00 0.00 H new ATOM 0 HB2 MET A 283 0.379 5.580 1.682 1.00 0.00 H new ATOM 0 HB3 MET A 283 0.340 7.171 2.417 1.00 0.00 H new ATOM 0 HG2 MET A 283 1.802 8.055 0.643 1.00 0.00 H new ATOM 0 HG3 MET A 283 1.930 6.460 -0.073 1.00 0.00 H new ATOM 0 HE1 MET A 283 -1.780 9.193 -0.065 1.00 0.00 H new ATOM 0 HE2 MET A 283 -1.493 8.204 1.386 1.00 0.00 H new ATOM 0 HE3 MET A 283 -0.282 9.401 0.871 1.00 0.00 H new ATOM 1056 N LYS A 284 2.376 8.311 3.726 1.00 0.00 N ATOM 1057 CA LYS A 284 3.013 9.568 4.101 1.00 0.00 C ATOM 1058 C LYS A 284 4.249 9.317 4.958 1.00 0.00 C ATOM 1059 O LYS A 284 5.191 10.109 4.954 1.00 0.00 O ATOM 1060 CB LYS A 284 2.026 10.458 4.859 1.00 0.00 C ATOM 1061 CG LYS A 284 0.714 10.675 4.124 1.00 0.00 C ATOM 1062 CD LYS A 284 -0.306 11.381 5.001 1.00 0.00 C ATOM 1063 CE LYS A 284 -1.679 11.407 4.348 1.00 0.00 C ATOM 1064 NZ LYS A 284 -2.695 12.062 5.218 1.00 0.00 N ATOM 0 H LYS A 284 1.433 8.190 4.096 1.00 0.00 H new ATOM 0 HA LYS A 284 3.323 10.076 3.188 1.00 0.00 H new ATOM 0 HB2 LYS A 284 1.819 10.010 5.831 1.00 0.00 H new ATOM 0 HB3 LYS A 284 2.492 11.425 5.047 1.00 0.00 H new ATOM 0 HG2 LYS A 284 0.893 11.265 3.225 1.00 0.00 H new ATOM 0 HG3 LYS A 284 0.314 9.714 3.800 1.00 0.00 H new ATOM 0 HD2 LYS A 284 -0.370 10.876 5.965 1.00 0.00 H new ATOM 0 HD3 LYS A 284 0.025 12.401 5.196 1.00 0.00 H new ATOM 0 HE2 LYS A 284 -1.619 11.937 3.397 1.00 0.00 H new ATOM 0 HE3 LYS A 284 -1.995 10.388 4.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 284 -3.617 12.060 4.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 284 -2.771 11.542 6.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 284 -2.407 13.043 5.410 1.00 0.00 H new ATOM 1078 N ALA A 285 4.240 8.208 5.692 1.00 0.00 N ATOM 1079 CA ALA A 285 5.361 7.851 6.551 1.00 0.00 C ATOM 1080 C ALA A 285 6.611 7.555 5.729 1.00 0.00 C ATOM 1081 O ALA A 285 7.690 8.080 6.009 1.00 0.00 O ATOM 1082 CB ALA A 285 5.002 6.653 7.418 1.00 0.00 C ATOM 0 H ALA A 285 3.468 7.542 5.708 1.00 0.00 H new ATOM 0 HA ALA A 285 5.576 8.702 7.197 1.00 0.00 H new ATOM 0 HB1 ALA A 285 5.849 6.398 8.055 1.00 0.00 H new ATOM 0 HB2 ALA A 285 4.142 6.899 8.040 1.00 0.00 H new ATOM 0 HB3 ALA A 285 4.758 5.803 6.781 1.00 0.00 H new ATOM 1088 N LEU A 286 6.459 6.712 4.713 1.00 0.00 N ATOM 1089 CA LEU A 286 7.576 6.346 3.850 1.00 0.00 C ATOM 1090 C LEU A 286 7.760 7.368 2.733 1.00 0.00 C ATOM 1091 O LEU A 286 8.813 7.430 2.102 1.00 0.00 O ATOM 1092 CB LEU A 286 7.349 4.956 3.252 1.00 0.00 C ATOM 1093 CG LEU A 286 7.562 3.775 4.199 1.00 0.00 C ATOM 1094 CD1 LEU A 286 7.186 2.469 3.517 1.00 0.00 C ATOM 1095 CD2 LEU A 286 9.004 3.730 4.681 1.00 0.00 C ATOM 0 H LEU A 286 5.573 6.270 4.467 1.00 0.00 H new ATOM 0 HA LEU A 286 8.482 6.332 4.456 1.00 0.00 H new ATOM 0 HB2 LEU A 286 6.330 4.909 2.869 1.00 0.00 H new ATOM 0 HB3 LEU A 286 8.016 4.836 2.398 1.00 0.00 H new ATOM 0 HG LEU A 286 6.914 3.909 5.065 1.00 0.00 H new ATOM 0 HD11 LEU A 286 7.344 1.640 4.206 1.00 0.00 H new ATOM 0 HD12 LEU A 286 6.137 2.501 3.223 1.00 0.00 H new ATOM 0 HD13 LEU A 286 7.807 2.329 2.632 1.00 0.00 H new ATOM 0 HD21 LEU A 286 9.136 2.883 5.354 1.00 0.00 H new ATOM 0 HD22 LEU A 286 9.670 3.621 3.825 1.00 0.00 H new ATOM 0 HD23 LEU A 286 9.240 4.654 5.210 1.00 0.00 H new ATOM 1107 N ASN A 287 6.727 8.171 2.497 1.00 0.00 N ATOM 1108 CA ASN A 287 6.775 9.193 1.458 1.00 0.00 C ATOM 1109 C ASN A 287 7.946 10.144 1.684 1.00 0.00 C ATOM 1110 O ASN A 287 7.937 10.945 2.618 1.00 0.00 O ATOM 1111 CB ASN A 287 5.463 9.980 1.427 1.00 0.00 C ATOM 1112 CG ASN A 287 5.560 11.233 0.578 1.00 0.00 C ATOM 1113 OD1 ASN A 287 5.889 11.169 -0.607 1.00 0.00 O ATOM 1114 ND2 ASN A 287 5.274 12.380 1.182 1.00 0.00 N ATOM 0 H ASN A 287 5.847 8.133 3.011 1.00 0.00 H new ATOM 0 HA ASN A 287 6.915 8.694 0.499 1.00 0.00 H new ATOM 0 HB2 ASN A 287 4.669 9.342 1.039 1.00 0.00 H new ATOM 0 HB3 ASN A 287 5.183 10.254 2.444 1.00 0.00 H new ATOM 0 HD21 ASN A 287 5.322 13.256 0.662 1.00 0.00 H new ATOM 0 HD22 ASN A 287 5.006 12.385 2.166 1.00 0.00 H new ATOM 1121 N GLY A 288 8.953 10.050 0.821 1.00 0.00 N ATOM 1122 CA GLY A 288 10.117 10.907 0.943 1.00 0.00 C ATOM 1123 C GLY A 288 11.265 10.228 1.663 1.00 0.00 C ATOM 1124 O GLY A 288 12.037 10.877 2.369 1.00 0.00 O ATOM 0 H GLY A 288 8.983 9.395 0.039 1.00 0.00 H new ATOM 0 HA2 GLY A 288 10.445 11.212 -0.051 1.00 0.00 H new ATOM 0 HA3 GLY A 288 9.841 11.814 1.480 1.00 0.00 H new ATOM 1128 N LYS A 289 11.379 8.916 1.486 1.00 0.00 N ATOM 1129 CA LYS A 289 12.440 8.146 2.124 1.00 0.00 C ATOM 1130 C LYS A 289 13.430 7.622 1.089 1.00 0.00 C ATOM 1131 O LYS A 289 13.085 7.445 -0.080 1.00 0.00 O ATOM 1132 CB LYS A 289 11.846 6.978 2.915 1.00 0.00 C ATOM 1133 CG LYS A 289 11.256 7.387 4.253 1.00 0.00 C ATOM 1134 CD LYS A 289 12.311 7.406 5.346 1.00 0.00 C ATOM 1135 CE LYS A 289 11.682 7.526 6.726 1.00 0.00 C ATOM 1136 NZ LYS A 289 12.711 7.610 7.799 1.00 0.00 N ATOM 0 H LYS A 289 10.749 8.363 0.905 1.00 0.00 H new ATOM 0 HA LYS A 289 12.973 8.806 2.808 1.00 0.00 H new ATOM 0 HB2 LYS A 289 11.070 6.502 2.316 1.00 0.00 H new ATOM 0 HB3 LYS A 289 12.622 6.232 3.083 1.00 0.00 H new ATOM 0 HG2 LYS A 289 10.804 8.375 4.165 1.00 0.00 H new ATOM 0 HG3 LYS A 289 10.460 6.695 4.527 1.00 0.00 H new ATOM 0 HD2 LYS A 289 12.906 6.494 5.294 1.00 0.00 H new ATOM 0 HD3 LYS A 289 12.992 8.241 5.181 1.00 0.00 H new ATOM 0 HE2 LYS A 289 11.048 8.412 6.760 1.00 0.00 H new ATOM 0 HE3 LYS A 289 11.037 6.666 6.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 289 12.242 7.691 8.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 289 13.300 6.753 7.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 289 13.310 8.445 7.641 1.00 0.00 H new ATOM 1150 N VAL A 290 14.661 7.374 1.525 1.00 0.00 N ATOM 1151 CA VAL A 290 15.699 6.868 0.636 1.00 0.00 C ATOM 1152 C VAL A 290 16.184 5.494 1.085 1.00 0.00 C ATOM 1153 O VAL A 290 17.042 5.382 1.962 1.00 0.00 O ATOM 1154 CB VAL A 290 16.901 7.829 0.573 1.00 0.00 C ATOM 1155 CG1 VAL A 290 18.022 7.228 -0.263 1.00 0.00 C ATOM 1156 CG2 VAL A 290 16.475 9.179 0.016 1.00 0.00 C ATOM 0 H VAL A 290 14.963 7.515 2.489 1.00 0.00 H new ATOM 0 HA VAL A 290 15.255 6.788 -0.356 1.00 0.00 H new ATOM 0 HB VAL A 290 17.276 7.981 1.585 1.00 0.00 H new ATOM 0 HG11 VAL A 290 18.863 7.921 -0.296 1.00 0.00 H new ATOM 0 HG12 VAL A 290 18.345 6.287 0.183 1.00 0.00 H new ATOM 0 HG13 VAL A 290 17.663 7.045 -1.276 1.00 0.00 H new ATOM 0 HG21 VAL A 290 17.337 9.845 -0.021 1.00 0.00 H new ATOM 0 HG22 VAL A 290 16.074 9.048 -0.989 1.00 0.00 H new ATOM 0 HG23 VAL A 290 15.709 9.612 0.659 1.00 0.00 H new ATOM 1166 N LEU A 291 15.631 4.450 0.478 1.00 0.00 N ATOM 1167 CA LEU A 291 16.007 3.081 0.814 1.00 0.00 C ATOM 1168 C LEU A 291 17.123 2.584 -0.099 1.00 0.00 C ATOM 1169 O LEU A 291 17.249 3.026 -1.241 1.00 0.00 O ATOM 1170 CB LEU A 291 14.794 2.156 0.705 1.00 0.00 C ATOM 1171 CG LEU A 291 13.829 2.173 1.892 1.00 0.00 C ATOM 1172 CD1 LEU A 291 12.652 1.245 1.636 1.00 0.00 C ATOM 1173 CD2 LEU A 291 14.552 1.780 3.172 1.00 0.00 C ATOM 0 H LEU A 291 14.920 4.525 -0.250 1.00 0.00 H new ATOM 0 HA LEU A 291 16.371 3.072 1.841 1.00 0.00 H new ATOM 0 HB2 LEU A 291 14.238 2.423 -0.194 1.00 0.00 H new ATOM 0 HB3 LEU A 291 15.151 1.135 0.567 1.00 0.00 H new ATOM 0 HG LEU A 291 13.447 3.187 2.011 1.00 0.00 H new ATOM 0 HD11 LEU A 291 11.976 1.270 2.491 1.00 0.00 H new ATOM 0 HD12 LEU A 291 12.119 1.571 0.743 1.00 0.00 H new ATOM 0 HD13 LEU A 291 13.016 0.228 1.491 1.00 0.00 H new ATOM 0 HD21 LEU A 291 13.851 1.797 4.006 1.00 0.00 H new ATOM 0 HD22 LEU A 291 14.963 0.776 3.064 1.00 0.00 H new ATOM 0 HD23 LEU A 291 15.361 2.485 3.364 1.00 0.00 H new ATOM 1185 N ASP A 292 17.930 1.660 0.411 1.00 0.00 N ATOM 1186 CA ASP A 292 19.034 1.099 -0.360 1.00 0.00 C ATOM 1187 C ASP A 292 19.757 2.188 -1.146 1.00 0.00 C ATOM 1188 O ASP A 292 20.372 1.919 -2.177 1.00 0.00 O ATOM 1189 CB ASP A 292 18.521 0.019 -1.314 1.00 0.00 C ATOM 1190 CG ASP A 292 17.894 -1.151 -0.581 1.00 0.00 C ATOM 1191 OD1 ASP A 292 18.629 -1.865 0.133 1.00 0.00 O ATOM 1192 OD2 ASP A 292 16.670 -1.353 -0.722 1.00 0.00 O ATOM 0 H ASP A 292 17.841 1.284 1.355 1.00 0.00 H new ATOM 0 HA ASP A 292 19.741 0.650 0.338 1.00 0.00 H new ATOM 0 HB2 ASP A 292 17.787 0.455 -1.991 1.00 0.00 H new ATOM 0 HB3 ASP A 292 19.346 -0.341 -1.928 1.00 0.00 H new ATOM 1197 N GLY A 293 19.677 3.420 -0.651 1.00 0.00 N ATOM 1198 CA GLY A 293 20.327 4.531 -1.320 1.00 0.00 C ATOM 1199 C GLY A 293 19.585 4.972 -2.567 1.00 0.00 C ATOM 1200 O GLY A 293 20.197 5.227 -3.604 1.00 0.00 O ATOM 0 H GLY A 293 19.174 3.668 0.201 1.00 0.00 H new ATOM 0 HA2 GLY A 293 20.404 5.372 -0.630 1.00 0.00 H new ATOM 0 HA3 GLY A 293 21.344 4.245 -1.588 1.00 0.00 H new ATOM 1204 N SER A 294 18.262 5.059 -2.467 1.00 0.00 N ATOM 1205 CA SER A 294 17.435 5.466 -3.597 1.00 0.00 C ATOM 1206 C SER A 294 16.122 6.076 -3.117 1.00 0.00 C ATOM 1207 O SER A 294 15.481 5.583 -2.189 1.00 0.00 O ATOM 1208 CB SER A 294 17.152 4.268 -4.506 1.00 0.00 C ATOM 1209 OG SER A 294 16.655 4.689 -5.764 1.00 0.00 O ATOM 0 H SER A 294 17.740 4.853 -1.615 1.00 0.00 H new ATOM 0 HA SER A 294 17.981 6.221 -4.162 1.00 0.00 H new ATOM 0 HB2 SER A 294 18.066 3.691 -4.647 1.00 0.00 H new ATOM 0 HB3 SER A 294 16.428 3.608 -4.028 1.00 0.00 H new ATOM 0 HG SER A 294 15.860 4.164 -5.994 1.00 0.00 H new ATOM 1215 N PRO A 295 15.711 7.177 -3.764 1.00 0.00 N ATOM 1216 CA PRO A 295 14.471 7.880 -3.422 1.00 0.00 C ATOM 1217 C PRO A 295 13.229 7.078 -3.794 1.00 0.00 C ATOM 1218 O PRO A 295 12.788 7.097 -4.944 1.00 0.00 O ATOM 1219 CB PRO A 295 14.549 9.162 -4.253 1.00 0.00 C ATOM 1220 CG PRO A 295 15.427 8.814 -5.406 1.00 0.00 C ATOM 1221 CD PRO A 295 16.425 7.820 -4.880 1.00 0.00 C ATOM 0 HA PRO A 295 14.385 8.056 -2.350 1.00 0.00 H new ATOM 0 HB2 PRO A 295 13.561 9.477 -4.589 1.00 0.00 H new ATOM 0 HB3 PRO A 295 14.966 9.985 -3.673 1.00 0.00 H new ATOM 0 HG2 PRO A 295 14.846 8.388 -6.224 1.00 0.00 H new ATOM 0 HG3 PRO A 295 15.927 9.700 -5.797 1.00 0.00 H new ATOM 0 HD2 PRO A 295 16.712 7.097 -5.643 1.00 0.00 H new ATOM 0 HD3 PRO A 295 17.340 8.308 -4.544 1.00 0.00 H new ATOM 1229 N ILE A 296 12.668 6.376 -2.816 1.00 0.00 N ATOM 1230 CA ILE A 296 11.475 5.569 -3.041 1.00 0.00 C ATOM 1231 C ILE A 296 10.209 6.405 -2.891 1.00 0.00 C ATOM 1232 O ILE A 296 10.142 7.301 -2.051 1.00 0.00 O ATOM 1233 CB ILE A 296 11.409 4.378 -2.067 1.00 0.00 C ATOM 1234 CG1 ILE A 296 11.379 4.875 -0.621 1.00 0.00 C ATOM 1235 CG2 ILE A 296 12.590 3.446 -2.289 1.00 0.00 C ATOM 1236 CD1 ILE A 296 10.668 3.934 0.327 1.00 0.00 C ATOM 0 H ILE A 296 13.021 6.350 -1.859 1.00 0.00 H new ATOM 0 HA ILE A 296 11.538 5.190 -4.061 1.00 0.00 H new ATOM 0 HB ILE A 296 10.492 3.821 -2.259 1.00 0.00 H new ATOM 0 HG12 ILE A 296 12.402 5.022 -0.275 1.00 0.00 H new ATOM 0 HG13 ILE A 296 10.889 5.848 -0.590 1.00 0.00 H new ATOM 0 HG21 ILE A 296 12.529 2.609 -1.593 1.00 0.00 H new ATOM 0 HG22 ILE A 296 12.569 3.070 -3.312 1.00 0.00 H new ATOM 0 HG23 ILE A 296 13.519 3.990 -2.122 1.00 0.00 H new ATOM 0 HD11 ILE A 296 10.685 4.350 1.334 1.00 0.00 H new ATOM 0 HD12 ILE A 296 9.635 3.806 0.005 1.00 0.00 H new ATOM 0 HD13 ILE A 296 11.171 2.967 0.325 1.00 0.00 H new ATOM 1248 N GLU A 297 9.207 6.105 -3.712 1.00 0.00 N ATOM 1249 CA GLU A 297 7.943 6.829 -3.669 1.00 0.00 C ATOM 1250 C GLU A 297 6.801 5.907 -3.250 1.00 0.00 C ATOM 1251 O GLU A 297 6.756 4.740 -3.639 1.00 0.00 O ATOM 1252 CB GLU A 297 7.637 7.448 -5.035 1.00 0.00 C ATOM 1253 CG GLU A 297 6.634 8.588 -4.976 1.00 0.00 C ATOM 1254 CD GLU A 297 7.230 9.862 -4.411 1.00 0.00 C ATOM 1255 OE1 GLU A 297 7.962 9.779 -3.403 1.00 0.00 O ATOM 1256 OE2 GLU A 297 6.964 10.943 -4.978 1.00 0.00 O ATOM 0 H GLU A 297 9.247 5.366 -4.414 1.00 0.00 H new ATOM 0 HA GLU A 297 8.035 7.624 -2.930 1.00 0.00 H new ATOM 0 HB2 GLU A 297 8.565 7.814 -5.475 1.00 0.00 H new ATOM 0 HB3 GLU A 297 7.254 6.672 -5.698 1.00 0.00 H new ATOM 0 HG2 GLU A 297 6.253 8.783 -5.978 1.00 0.00 H new ATOM 0 HG3 GLU A 297 5.783 8.287 -4.364 1.00 0.00 H new ATOM 1263 N VAL A 298 5.880 6.439 -2.453 1.00 0.00 N ATOM 1264 CA VAL A 298 4.738 5.666 -1.981 1.00 0.00 C ATOM 1265 C VAL A 298 3.430 6.405 -2.237 1.00 0.00 C ATOM 1266 O VAL A 298 3.153 7.434 -1.619 1.00 0.00 O ATOM 1267 CB VAL A 298 4.854 5.355 -0.477 1.00 0.00 C ATOM 1268 CG1 VAL A 298 3.927 4.210 -0.095 1.00 0.00 C ATOM 1269 CG2 VAL A 298 6.294 5.031 -0.110 1.00 0.00 C ATOM 0 H VAL A 298 5.903 7.403 -2.121 1.00 0.00 H new ATOM 0 HA VAL A 298 4.737 4.730 -2.539 1.00 0.00 H new ATOM 0 HB VAL A 298 4.550 6.239 0.084 1.00 0.00 H new ATOM 0 HG11 VAL A 298 4.023 4.005 0.971 1.00 0.00 H new ATOM 0 HG12 VAL A 298 2.897 4.485 -0.320 1.00 0.00 H new ATOM 0 HG13 VAL A 298 4.197 3.319 -0.662 1.00 0.00 H new ATOM 0 HG21 VAL A 298 6.358 4.814 0.956 1.00 0.00 H new ATOM 0 HG22 VAL A 298 6.628 4.162 -0.678 1.00 0.00 H new ATOM 0 HG23 VAL A 298 6.930 5.884 -0.345 1.00 0.00 H new ATOM 1279 N THR A 299 2.625 5.874 -3.152 1.00 0.00 N ATOM 1280 CA THR A 299 1.345 6.484 -3.491 1.00 0.00 C ATOM 1281 C THR A 299 0.232 5.443 -3.524 1.00 0.00 C ATOM 1282 O THR A 299 0.472 4.255 -3.303 1.00 0.00 O ATOM 1283 CB THR A 299 1.406 7.197 -4.855 1.00 0.00 C ATOM 1284 OG1 THR A 299 1.631 6.243 -5.898 1.00 0.00 O ATOM 1285 CG2 THR A 299 2.512 8.242 -4.870 1.00 0.00 C ATOM 0 H THR A 299 2.837 5.022 -3.672 1.00 0.00 H new ATOM 0 HA THR A 299 1.129 7.218 -2.715 1.00 0.00 H new ATOM 0 HB THR A 299 0.452 7.697 -5.021 1.00 0.00 H new ATOM 0 HG1 THR A 299 1.667 6.705 -6.762 1.00 0.00 H new ATOM 0 HG21 THR A 299 2.536 8.732 -5.843 1.00 0.00 H new ATOM 0 HG22 THR A 299 2.322 8.984 -4.094 1.00 0.00 H new ATOM 0 HG23 THR A 299 3.471 7.759 -4.683 1.00 0.00 H new ATOM 1293 N LEU A 300 -0.986 5.895 -3.803 1.00 0.00 N ATOM 1294 CA LEU A 300 -2.137 5.001 -3.866 1.00 0.00 C ATOM 1295 C LEU A 300 -2.413 4.569 -5.302 1.00 0.00 C ATOM 1296 O LEU A 300 -2.844 5.370 -6.130 1.00 0.00 O ATOM 1297 CB LEU A 300 -3.373 5.688 -3.282 1.00 0.00 C ATOM 1298 CG LEU A 300 -3.405 5.832 -1.760 1.00 0.00 C ATOM 1299 CD1 LEU A 300 -4.187 7.073 -1.357 1.00 0.00 C ATOM 1300 CD2 LEU A 300 -4.006 4.589 -1.119 1.00 0.00 C ATOM 0 H LEU A 300 -1.202 6.874 -3.989 1.00 0.00 H new ATOM 0 HA LEU A 300 -1.909 4.113 -3.276 1.00 0.00 H new ATOM 0 HB2 LEU A 300 -3.454 6.682 -3.723 1.00 0.00 H new ATOM 0 HB3 LEU A 300 -4.256 5.129 -3.593 1.00 0.00 H new ATOM 0 HG LEU A 300 -2.381 5.941 -1.403 1.00 0.00 H new ATOM 0 HD11 LEU A 300 -4.199 7.159 -0.270 1.00 0.00 H new ATOM 0 HD12 LEU A 300 -3.714 7.956 -1.786 1.00 0.00 H new ATOM 0 HD13 LEU A 300 -5.210 6.994 -1.726 1.00 0.00 H new ATOM 0 HD21 LEU A 300 -4.021 4.709 -0.036 1.00 0.00 H new ATOM 0 HD22 LEU A 300 -5.024 4.448 -1.482 1.00 0.00 H new ATOM 0 HD23 LEU A 300 -3.404 3.718 -1.379 1.00 0.00 H new ATOM 1312 N ALA A 301 -2.162 3.296 -5.590 1.00 0.00 N ATOM 1313 CA ALA A 301 -2.387 2.756 -6.925 1.00 0.00 C ATOM 1314 C ALA A 301 -3.871 2.761 -7.277 1.00 0.00 C ATOM 1315 O ALA A 301 -4.725 2.569 -6.412 1.00 0.00 O ATOM 1316 CB ALA A 301 -1.824 1.345 -7.025 1.00 0.00 C ATOM 0 H ALA A 301 -1.803 2.620 -4.916 1.00 0.00 H new ATOM 0 HA ALA A 301 -1.869 3.395 -7.640 1.00 0.00 H new ATOM 0 HB1 ALA A 301 -1.999 0.954 -8.027 1.00 0.00 H new ATOM 0 HB2 ALA A 301 -0.753 1.366 -6.825 1.00 0.00 H new ATOM 0 HB3 ALA A 301 -2.317 0.704 -6.294 1.00 0.00 H new ATOM 1322 N LYS A 302 -4.171 2.985 -8.552 1.00 0.00 N ATOM 1323 CA LYS A 302 -5.552 3.015 -9.019 1.00 0.00 C ATOM 1324 C LYS A 302 -6.079 1.603 -9.251 1.00 0.00 C ATOM 1325 O LYS A 302 -5.504 0.816 -10.003 1.00 0.00 O ATOM 1326 CB LYS A 302 -5.656 3.829 -10.311 1.00 0.00 C ATOM 1327 CG LYS A 302 -5.848 5.318 -10.078 1.00 0.00 C ATOM 1328 CD LYS A 302 -4.518 6.029 -9.888 1.00 0.00 C ATOM 1329 CE LYS A 302 -4.672 7.280 -9.037 1.00 0.00 C ATOM 1330 NZ LYS A 302 -4.997 6.952 -7.622 1.00 0.00 N ATOM 0 H LYS A 302 -3.476 3.148 -9.280 1.00 0.00 H new ATOM 0 HA LYS A 302 -6.160 3.488 -8.248 1.00 0.00 H new ATOM 0 HB2 LYS A 302 -4.752 3.676 -10.901 1.00 0.00 H new ATOM 0 HB3 LYS A 302 -6.490 3.452 -10.902 1.00 0.00 H new ATOM 0 HG2 LYS A 302 -6.377 5.754 -10.925 1.00 0.00 H new ATOM 0 HG3 LYS A 302 -6.473 5.472 -9.198 1.00 0.00 H new ATOM 0 HD2 LYS A 302 -3.806 5.352 -9.416 1.00 0.00 H new ATOM 0 HD3 LYS A 302 -4.105 6.298 -10.861 1.00 0.00 H new ATOM 0 HE2 LYS A 302 -3.749 7.859 -9.073 1.00 0.00 H new ATOM 0 HE3 LYS A 302 -5.459 7.908 -9.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 302 -4.911 7.809 -7.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 302 -5.970 6.590 -7.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 302 -4.337 6.228 -7.273 1.00 0.00 H new