USER MOD reduce.3.24.130724 H: found=0, std=0, add=265, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 266 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 217 SER OG : rot 180:sc= 0 USER MOD Single : A 218 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 222 LYS NZ :NH3+ -164:sc= -0.0221 (180deg=-0.265) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 228 MET CE :methyl 153:sc= -0.235 (180deg=-1.31) USER MOD Single : A 235 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 236 SER OG : rot 180:sc= 0 USER MOD Single : A 237 LYS NZ :NH3+ 167:sc=-0.00567 (180deg=-0.202) USER MOD Single : A 240 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 242 HIS : no HD1:sc= -0.0636 X(o=-0.064,f=0.0084) USER MOD Single : A 243 GLN : amide:sc= 0 K(o=0,f=-0.98) USER MOD Single : A 246 GLN : amide:sc= -0.169 K(o=-0.17,f=-0.99) USER MOD Single : A 247 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 175 N SER A 217 11.318 -26.715 21.034 1.00 0.00 N ATOM 176 CA SER A 217 12.116 -26.675 22.252 1.00 0.00 C ATOM 177 C SER A 217 12.007 -25.305 22.917 1.00 0.00 C ATOM 178 O SER A 217 12.121 -24.273 22.256 1.00 0.00 O ATOM 179 CB SER A 217 13.579 -26.976 21.930 1.00 0.00 C ATOM 180 OG SER A 217 13.734 -28.373 21.714 1.00 0.00 O ATOM 0 HA SER A 217 11.736 -27.431 22.939 1.00 0.00 H new ATOM 0 HB2 SER A 217 13.890 -26.423 21.044 1.00 0.00 H new ATOM 0 HB3 SER A 217 14.219 -26.650 22.750 1.00 0.00 H new ATOM 0 HG SER A 217 14.671 -28.570 21.505 1.00 0.00 H new ATOM 186 N LYS A 218 11.790 -25.304 24.228 1.00 0.00 N ATOM 187 CA LYS A 218 11.669 -24.053 24.971 1.00 0.00 C ATOM 188 C LYS A 218 13.045 -23.471 25.281 1.00 0.00 C ATOM 189 O LYS A 218 13.185 -22.266 25.486 1.00 0.00 O ATOM 190 CB LYS A 218 10.915 -24.293 26.280 1.00 0.00 C ATOM 191 CG LYS A 218 11.598 -25.411 27.066 1.00 0.00 C ATOM 192 CD LYS A 218 10.964 -25.518 28.454 1.00 0.00 C ATOM 193 CE LYS A 218 9.532 -26.041 28.321 1.00 0.00 C ATOM 194 NZ LYS A 218 9.069 -26.559 29.639 1.00 0.00 N ATOM 0 H LYS A 218 11.695 -26.147 24.795 1.00 0.00 H new ATOM 0 HA LYS A 218 11.117 -23.344 24.354 1.00 0.00 H new ATOM 0 HB2 LYS A 218 10.894 -23.378 26.872 1.00 0.00 H new ATOM 0 HB3 LYS A 218 9.879 -24.561 26.071 1.00 0.00 H new ATOM 0 HG2 LYS A 218 11.498 -26.357 26.535 1.00 0.00 H new ATOM 0 HG3 LYS A 218 12.665 -25.207 27.156 1.00 0.00 H new ATOM 0 HD2 LYS A 218 11.550 -26.188 29.083 1.00 0.00 H new ATOM 0 HD3 LYS A 218 10.963 -24.543 28.941 1.00 0.00 H new ATOM 0 HE2 LYS A 218 8.872 -25.243 27.979 1.00 0.00 H new ATOM 0 HE3 LYS A 218 9.490 -26.832 27.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 218 8.096 -26.915 29.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 218 9.693 -27.332 29.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 218 9.094 -25.793 30.342 1.00 0.00 H new ATOM 208 N ASP A 219 14.058 -24.332 25.310 1.00 0.00 N ATOM 209 CA ASP A 219 15.414 -23.880 25.598 1.00 0.00 C ATOM 210 C ASP A 219 15.907 -22.949 24.494 1.00 0.00 C ATOM 211 O ASP A 219 16.609 -21.974 24.759 1.00 0.00 O ATOM 212 CB ASP A 219 16.352 -25.083 25.711 1.00 0.00 C ATOM 213 CG ASP A 219 17.727 -24.628 26.186 1.00 0.00 C ATOM 214 OD1 ASP A 219 17.949 -23.430 26.238 1.00 0.00 O ATOM 215 OD2 ASP A 219 18.540 -25.486 26.494 1.00 0.00 O ATOM 0 H ASP A 219 13.968 -25.334 25.140 1.00 0.00 H new ATOM 0 HA ASP A 219 15.407 -23.337 26.543 1.00 0.00 H new ATOM 0 HB2 ASP A 219 15.940 -25.812 26.409 1.00 0.00 H new ATOM 0 HB3 ASP A 219 16.438 -25.580 24.745 1.00 0.00 H new ATOM 220 N GLU A 220 15.527 -23.253 23.256 1.00 0.00 N ATOM 221 CA GLU A 220 15.936 -22.434 22.121 1.00 0.00 C ATOM 222 C GLU A 220 15.332 -21.036 22.228 1.00 0.00 C ATOM 223 O GLU A 220 16.007 -20.037 21.982 1.00 0.00 O ATOM 224 CB GLU A 220 15.485 -23.088 20.813 1.00 0.00 C ATOM 225 CG GLU A 220 16.197 -24.431 20.638 1.00 0.00 C ATOM 226 CD GLU A 220 17.693 -24.207 20.444 1.00 0.00 C ATOM 227 OE1 GLU A 220 18.067 -23.101 20.094 1.00 0.00 O ATOM 228 OE2 GLU A 220 18.444 -25.148 20.649 1.00 0.00 O ATOM 0 H GLU A 220 14.942 -24.053 23.015 1.00 0.00 H new ATOM 0 HA GLU A 220 17.023 -22.352 22.128 1.00 0.00 H new ATOM 0 HB2 GLU A 220 14.405 -23.236 20.822 1.00 0.00 H new ATOM 0 HB3 GLU A 220 15.710 -22.433 19.971 1.00 0.00 H new ATOM 0 HG2 GLU A 220 16.025 -25.059 21.512 1.00 0.00 H new ATOM 0 HG3 GLU A 220 15.786 -24.961 19.779 1.00 0.00 H new ATOM 235 N ILE A 221 14.056 -20.977 22.599 1.00 0.00 N ATOM 236 CA ILE A 221 13.366 -19.698 22.736 1.00 0.00 C ATOM 237 C ILE A 221 14.000 -18.857 23.840 1.00 0.00 C ATOM 238 O ILE A 221 14.218 -17.658 23.672 1.00 0.00 O ATOM 239 CB ILE A 221 11.887 -19.932 23.057 1.00 0.00 C ATOM 240 CG1 ILE A 221 11.291 -20.903 22.036 1.00 0.00 C ATOM 241 CG2 ILE A 221 11.134 -18.602 22.995 1.00 0.00 C ATOM 242 CD1 ILE A 221 11.554 -20.384 20.621 1.00 0.00 C ATOM 0 H ILE A 221 13.482 -21.794 22.809 1.00 0.00 H new ATOM 0 HA ILE A 221 13.453 -19.160 21.792 1.00 0.00 H new ATOM 0 HB ILE A 221 11.795 -20.355 24.058 1.00 0.00 H new ATOM 0 HG12 ILE A 221 11.732 -21.892 22.159 1.00 0.00 H new ATOM 0 HG13 ILE A 221 10.219 -21.009 22.202 1.00 0.00 H new ATOM 0 HG21 ILE A 221 10.081 -18.769 23.223 1.00 0.00 H new ATOM 0 HG22 ILE A 221 11.558 -17.910 23.722 1.00 0.00 H new ATOM 0 HG23 ILE A 221 11.225 -18.178 21.995 1.00 0.00 H new ATOM 0 HD11 ILE A 221 11.129 -21.077 19.895 1.00 0.00 H new ATOM 0 HD12 ILE A 221 11.092 -19.404 20.501 1.00 0.00 H new ATOM 0 HD13 ILE A 221 12.629 -20.301 20.458 1.00 0.00 H new ATOM 254 N LYS A 222 14.294 -19.497 24.967 1.00 0.00 N ATOM 255 CA LYS A 222 14.899 -18.799 26.098 1.00 0.00 C ATOM 256 C LYS A 222 16.287 -18.287 25.728 1.00 0.00 C ATOM 257 O LYS A 222 16.652 -17.159 26.058 1.00 0.00 O ATOM 258 CB LYS A 222 15.004 -19.743 27.296 1.00 0.00 C ATOM 259 CG LYS A 222 13.603 -20.050 27.827 1.00 0.00 C ATOM 260 CD LYS A 222 13.700 -21.038 28.991 1.00 0.00 C ATOM 261 CE LYS A 222 12.292 -21.405 29.464 1.00 0.00 C ATOM 262 NZ LYS A 222 11.641 -20.210 30.069 1.00 0.00 N ATOM 0 H LYS A 222 14.125 -20.491 25.122 1.00 0.00 H new ATOM 0 HA LYS A 222 14.268 -17.950 26.359 1.00 0.00 H new ATOM 0 HB2 LYS A 222 15.504 -20.666 27.003 1.00 0.00 H new ATOM 0 HB3 LYS A 222 15.610 -19.288 28.079 1.00 0.00 H new ATOM 0 HG2 LYS A 222 13.119 -19.131 28.157 1.00 0.00 H new ATOM 0 HG3 LYS A 222 12.986 -20.468 27.032 1.00 0.00 H new ATOM 0 HD2 LYS A 222 14.236 -21.934 28.678 1.00 0.00 H new ATOM 0 HD3 LYS A 222 14.268 -20.597 29.810 1.00 0.00 H new ATOM 0 HE2 LYS A 222 11.699 -21.769 28.625 1.00 0.00 H new ATOM 0 HE3 LYS A 222 12.342 -22.213 30.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 222 10.815 -20.509 30.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 222 12.318 -19.723 30.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 222 11.335 -19.562 29.315 1.00 0.00 H new ATOM 276 N ARG A 223 17.057 -19.125 25.041 1.00 0.00 N ATOM 277 CA ARG A 223 18.402 -18.747 24.624 1.00 0.00 C ATOM 278 C ARG A 223 18.349 -17.773 23.450 1.00 0.00 C ATOM 279 O ARG A 223 19.326 -17.080 23.164 1.00 0.00 O ATOM 280 CB ARG A 223 19.188 -19.995 24.220 1.00 0.00 C ATOM 281 CG ARG A 223 19.506 -20.828 25.464 1.00 0.00 C ATOM 282 CD ARG A 223 20.253 -22.099 25.053 1.00 0.00 C ATOM 283 NE ARG A 223 19.364 -22.985 24.310 1.00 0.00 N ATOM 284 CZ ARG A 223 19.810 -24.124 23.791 1.00 0.00 C ATOM 285 NH1 ARG A 223 21.061 -24.466 23.942 1.00 0.00 N ATOM 286 NH2 ARG A 223 18.997 -24.903 23.130 1.00 0.00 N ATOM 0 H ARG A 223 16.775 -20.065 24.763 1.00 0.00 H new ATOM 0 HA ARG A 223 18.899 -18.257 25.461 1.00 0.00 H new ATOM 0 HB2 ARG A 223 18.609 -20.588 23.512 1.00 0.00 H new ATOM 0 HB3 ARG A 223 20.111 -19.708 23.716 1.00 0.00 H new ATOM 0 HG2 ARG A 223 20.112 -20.246 26.159 1.00 0.00 H new ATOM 0 HG3 ARG A 223 18.585 -21.088 25.985 1.00 0.00 H new ATOM 0 HD2 ARG A 223 21.117 -21.840 24.440 1.00 0.00 H new ATOM 0 HD3 ARG A 223 20.632 -22.610 25.938 1.00 0.00 H new ATOM 0 HE ARG A 223 18.385 -22.726 24.187 1.00 0.00 H new ATOM 0 HH11 ARG A 223 21.697 -23.859 24.459 1.00 0.00 H new ATOM 0 HH12 ARG A 223 21.402 -25.341 23.543 1.00 0.00 H new ATOM 0 HH21 ARG A 223 18.019 -24.637 23.012 1.00 0.00 H new ATOM 0 HH22 ARG A 223 19.340 -25.777 22.732 1.00 0.00 H new ATOM 300 N GLU A 224 17.207 -17.725 22.772 1.00 0.00 N ATOM 301 CA GLU A 224 17.048 -16.827 21.632 1.00 0.00 C ATOM 302 C GLU A 224 17.037 -15.376 22.099 1.00 0.00 C ATOM 303 O GLU A 224 17.500 -14.484 21.389 1.00 0.00 O ATOM 304 CB GLU A 224 15.749 -17.141 20.889 1.00 0.00 C ATOM 305 CG GLU A 224 15.655 -16.273 19.633 1.00 0.00 C ATOM 306 CD GLU A 224 14.393 -16.621 18.851 1.00 0.00 C ATOM 307 OE1 GLU A 224 13.340 -16.685 19.463 1.00 0.00 O ATOM 308 OE2 GLU A 224 14.499 -16.817 17.652 1.00 0.00 O ATOM 0 H GLU A 224 16.386 -18.290 22.988 1.00 0.00 H new ATOM 0 HA GLU A 224 17.890 -16.975 20.955 1.00 0.00 H new ATOM 0 HB2 GLU A 224 15.719 -18.196 20.617 1.00 0.00 H new ATOM 0 HB3 GLU A 224 14.893 -16.955 21.537 1.00 0.00 H new ATOM 0 HG2 GLU A 224 15.642 -15.219 19.910 1.00 0.00 H new ATOM 0 HG3 GLU A 224 16.534 -16.428 19.008 1.00 0.00 H new ATOM 315 N TYR A 225 16.517 -15.146 23.301 1.00 0.00 N ATOM 316 CA TYR A 225 16.455 -13.793 23.843 1.00 0.00 C ATOM 317 C TYR A 225 17.866 -13.262 24.058 1.00 0.00 C ATOM 318 O TYR A 225 18.086 -12.053 24.138 1.00 0.00 O ATOM 319 CB TYR A 225 15.699 -13.789 25.171 1.00 0.00 C ATOM 320 CG TYR A 225 15.640 -12.378 25.705 1.00 0.00 C ATOM 321 CD1 TYR A 225 14.711 -11.470 25.182 1.00 0.00 C ATOM 322 CD2 TYR A 225 16.515 -11.978 26.721 1.00 0.00 C ATOM 323 CE1 TYR A 225 14.660 -10.160 25.674 1.00 0.00 C ATOM 324 CE2 TYR A 225 16.462 -10.668 27.215 1.00 0.00 C ATOM 325 CZ TYR A 225 15.535 -9.759 26.690 1.00 0.00 C ATOM 326 OH TYR A 225 15.485 -8.469 27.175 1.00 0.00 O ATOM 0 H TYR A 225 16.137 -15.869 23.912 1.00 0.00 H new ATOM 0 HA TYR A 225 15.929 -13.154 23.134 1.00 0.00 H new ATOM 0 HB2 TYR A 225 14.691 -14.180 25.031 1.00 0.00 H new ATOM 0 HB3 TYR A 225 16.197 -14.441 25.888 1.00 0.00 H new ATOM 0 HD1 TYR A 225 14.034 -11.780 24.400 1.00 0.00 H new ATOM 0 HD2 TYR A 225 17.231 -12.679 27.124 1.00 0.00 H new ATOM 0 HE1 TYR A 225 13.945 -9.459 25.269 1.00 0.00 H new ATOM 0 HE2 TYR A 225 17.136 -10.359 28.000 1.00 0.00 H new ATOM 0 HH TYR A 225 16.159 -8.357 27.878 1.00 0.00 H new ATOM 336 N LYS A 226 18.818 -14.184 24.153 1.00 0.00 N ATOM 337 CA LYS A 226 20.212 -13.822 24.372 1.00 0.00 C ATOM 338 C LYS A 226 20.734 -13.014 23.190 1.00 0.00 C ATOM 339 O LYS A 226 21.484 -12.054 23.362 1.00 0.00 O ATOM 340 CB LYS A 226 21.058 -15.086 24.545 1.00 0.00 C ATOM 341 CG LYS A 226 22.491 -14.694 24.911 1.00 0.00 C ATOM 342 CD LYS A 226 23.325 -15.957 25.135 1.00 0.00 C ATOM 343 CE LYS A 226 24.755 -15.565 25.517 1.00 0.00 C ATOM 344 NZ LYS A 226 25.572 -16.794 25.715 1.00 0.00 N ATOM 0 H LYS A 226 18.649 -15.187 24.082 1.00 0.00 H new ATOM 0 HA LYS A 226 20.281 -13.217 25.276 1.00 0.00 H new ATOM 0 HB2 LYS A 226 20.632 -15.718 25.324 1.00 0.00 H new ATOM 0 HB3 LYS A 226 21.053 -15.669 23.624 1.00 0.00 H new ATOM 0 HG2 LYS A 226 22.929 -14.093 24.115 1.00 0.00 H new ATOM 0 HG3 LYS A 226 22.492 -14.080 25.812 1.00 0.00 H new ATOM 0 HD2 LYS A 226 22.880 -16.564 25.924 1.00 0.00 H new ATOM 0 HD3 LYS A 226 23.333 -16.565 24.231 1.00 0.00 H new ATOM 0 HE2 LYS A 226 25.195 -14.946 24.735 1.00 0.00 H new ATOM 0 HE3 LYS A 226 24.748 -14.969 26.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 226 26.543 -16.527 25.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 226 25.156 -17.369 26.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 226 25.588 -17.346 24.834 1.00 0.00 H new ATOM 358 N GLU A 227 20.326 -13.413 21.989 1.00 0.00 N ATOM 359 CA GLU A 227 20.752 -12.729 20.776 1.00 0.00 C ATOM 360 C GLU A 227 20.190 -11.311 20.739 1.00 0.00 C ATOM 361 O GLU A 227 20.862 -10.377 20.301 1.00 0.00 O ATOM 362 CB GLU A 227 20.270 -13.497 19.544 1.00 0.00 C ATOM 363 CG GLU A 227 21.109 -14.766 19.376 1.00 0.00 C ATOM 364 CD GLU A 227 20.614 -15.850 20.326 1.00 0.00 C ATOM 365 OE1 GLU A 227 19.733 -15.558 21.118 1.00 0.00 O ATOM 366 OE2 GLU A 227 21.121 -16.955 20.247 1.00 0.00 O ATOM 0 H GLU A 227 19.702 -14.205 21.832 1.00 0.00 H new ATOM 0 HA GLU A 227 21.841 -12.682 20.772 1.00 0.00 H new ATOM 0 HB2 GLU A 227 19.217 -13.756 19.652 1.00 0.00 H new ATOM 0 HB3 GLU A 227 20.355 -12.871 18.656 1.00 0.00 H new ATOM 0 HG2 GLU A 227 21.048 -15.118 18.346 1.00 0.00 H new ATOM 0 HG3 GLU A 227 22.158 -14.547 19.576 1.00 0.00 H new ATOM 373 N MET A 228 18.956 -11.160 21.204 1.00 0.00 N ATOM 374 CA MET A 228 18.307 -9.854 21.225 1.00 0.00 C ATOM 375 C MET A 228 19.063 -8.891 22.137 1.00 0.00 C ATOM 376 O MET A 228 19.211 -7.710 21.821 1.00 0.00 O ATOM 377 CB MET A 228 16.864 -9.996 21.713 1.00 0.00 C ATOM 378 CG MET A 228 15.984 -10.489 20.563 1.00 0.00 C ATOM 379 SD MET A 228 16.525 -12.139 20.054 1.00 0.00 S ATOM 380 CE MET A 228 14.968 -12.661 19.290 1.00 0.00 C ATOM 0 H MET A 228 18.386 -11.922 21.570 1.00 0.00 H new ATOM 0 HA MET A 228 18.310 -9.452 20.212 1.00 0.00 H new ATOM 0 HB2 MET A 228 16.818 -10.697 22.547 1.00 0.00 H new ATOM 0 HB3 MET A 228 16.497 -9.038 22.081 1.00 0.00 H new ATOM 0 HG2 MET A 228 14.940 -10.517 20.876 1.00 0.00 H new ATOM 0 HG3 MET A 228 16.046 -9.799 19.722 1.00 0.00 H new ATOM 0 HE1 MET A 228 15.172 -13.401 18.516 1.00 0.00 H new ATOM 0 HE2 MET A 228 14.319 -13.099 20.049 1.00 0.00 H new ATOM 0 HE3 MET A 228 14.474 -11.798 18.844 1.00 0.00 H new ATOM 390 N GLU A 229 19.536 -9.403 23.267 1.00 0.00 N ATOM 391 CA GLU A 229 20.274 -8.577 24.217 1.00 0.00 C ATOM 392 C GLU A 229 21.619 -8.156 23.632 1.00 0.00 C ATOM 393 O GLU A 229 22.063 -7.024 23.826 1.00 0.00 O ATOM 394 CB GLU A 229 20.500 -9.350 25.517 1.00 0.00 C ATOM 395 CG GLU A 229 21.039 -8.399 26.588 1.00 0.00 C ATOM 396 CD GLU A 229 19.945 -7.431 27.026 1.00 0.00 C ATOM 397 OE1 GLU A 229 18.816 -7.615 26.605 1.00 0.00 O ATOM 398 OE2 GLU A 229 20.253 -6.520 27.776 1.00 0.00 O ATOM 0 H GLU A 229 19.424 -10.377 23.547 1.00 0.00 H new ATOM 0 HA GLU A 229 19.686 -7.683 24.424 1.00 0.00 H new ATOM 0 HB2 GLU A 229 19.566 -9.800 25.852 1.00 0.00 H new ATOM 0 HB3 GLU A 229 21.205 -10.165 25.351 1.00 0.00 H new ATOM 0 HG2 GLU A 229 21.396 -8.969 27.446 1.00 0.00 H new ATOM 0 HG3 GLU A 229 21.892 -7.844 26.197 1.00 0.00 H new ATOM 405 N GLY A 230 22.259 -9.073 22.916 1.00 0.00 N ATOM 406 CA GLY A 230 23.554 -8.789 22.304 1.00 0.00 C ATOM 407 C GLY A 230 24.612 -8.516 23.366 1.00 0.00 C ATOM 408 O GLY A 230 24.683 -9.211 24.380 1.00 0.00 O ATOM 0 H GLY A 230 21.906 -10.015 22.745 1.00 0.00 H new ATOM 0 HA2 GLY A 230 23.862 -9.634 21.688 1.00 0.00 H new ATOM 0 HA3 GLY A 230 23.466 -7.927 21.643 1.00 0.00 H new ATOM 437 N GLU A 233 27.935 -3.397 25.340 1.00 0.00 N ATOM 438 CA GLU A 233 28.707 -2.855 26.453 1.00 0.00 C ATOM 439 C GLU A 233 30.201 -2.927 26.152 1.00 0.00 C ATOM 440 O GLU A 233 30.955 -2.011 26.482 1.00 0.00 O ATOM 441 CB GLU A 233 28.405 -3.640 27.732 1.00 0.00 C ATOM 442 CG GLU A 233 26.963 -3.367 28.168 1.00 0.00 C ATOM 443 CD GLU A 233 26.634 -4.179 29.416 1.00 0.00 C ATOM 444 OE1 GLU A 233 27.519 -4.864 29.903 1.00 0.00 O ATOM 445 OE2 GLU A 233 25.503 -4.105 29.866 1.00 0.00 O ATOM 0 HA GLU A 233 28.424 -1.812 26.593 1.00 0.00 H new ATOM 0 HB2 GLU A 233 28.549 -4.707 27.560 1.00 0.00 H new ATOM 0 HB3 GLU A 233 29.097 -3.349 28.522 1.00 0.00 H new ATOM 0 HG2 GLU A 233 26.830 -2.304 28.370 1.00 0.00 H new ATOM 0 HG3 GLU A 233 26.275 -3.627 27.363 1.00 0.00 H new ATOM 452 N ILE A 234 30.621 -4.018 25.523 1.00 0.00 N ATOM 453 CA ILE A 234 32.026 -4.194 25.178 1.00 0.00 C ATOM 454 C ILE A 234 32.465 -3.140 24.167 1.00 0.00 C ATOM 455 O ILE A 234 33.543 -2.559 24.287 1.00 0.00 O ATOM 456 CB ILE A 234 32.252 -5.590 24.596 1.00 0.00 C ATOM 457 CG1 ILE A 234 33.755 -5.860 24.493 1.00 0.00 C ATOM 458 CG2 ILE A 234 31.623 -5.672 23.205 1.00 0.00 C ATOM 459 CD1 ILE A 234 34.353 -5.964 25.897 1.00 0.00 C ATOM 0 H ILE A 234 30.014 -4.789 25.243 1.00 0.00 H new ATOM 0 HA ILE A 234 32.620 -4.080 26.085 1.00 0.00 H new ATOM 0 HB ILE A 234 31.791 -6.334 25.246 1.00 0.00 H new ATOM 0 HG12 ILE A 234 33.932 -6.783 23.942 1.00 0.00 H new ATOM 0 HG13 ILE A 234 34.242 -5.058 23.937 1.00 0.00 H new ATOM 0 HG21 ILE A 234 31.784 -6.667 22.791 1.00 0.00 H new ATOM 0 HG22 ILE A 234 30.553 -5.478 23.278 1.00 0.00 H new ATOM 0 HG23 ILE A 234 32.083 -4.929 22.553 1.00 0.00 H new ATOM 0 HD11 ILE A 234 35.423 -6.156 25.823 1.00 0.00 H new ATOM 0 HD12 ILE A 234 34.188 -5.029 26.433 1.00 0.00 H new ATOM 0 HD13 ILE A 234 33.874 -6.781 26.437 1.00 0.00 H new ATOM 471 N LYS A 235 31.619 -2.899 23.171 1.00 0.00 N ATOM 472 CA LYS A 235 31.922 -1.906 22.147 1.00 0.00 C ATOM 473 C LYS A 235 31.981 -0.510 22.759 1.00 0.00 C ATOM 474 O LYS A 235 32.833 0.303 22.396 1.00 0.00 O ATOM 475 CB LYS A 235 30.855 -1.941 21.051 1.00 0.00 C ATOM 476 CG LYS A 235 31.248 -0.986 19.923 1.00 0.00 C ATOM 477 CD LYS A 235 30.206 -1.058 18.805 1.00 0.00 C ATOM 478 CE LYS A 235 30.606 -0.114 17.669 1.00 0.00 C ATOM 479 NZ LYS A 235 29.614 -0.218 16.562 1.00 0.00 N ATOM 0 H LYS A 235 30.724 -3.374 23.051 1.00 0.00 H new ATOM 0 HA LYS A 235 32.893 -2.143 21.713 1.00 0.00 H new ATOM 0 HB2 LYS A 235 30.750 -2.954 20.663 1.00 0.00 H new ATOM 0 HB3 LYS A 235 29.887 -1.655 21.462 1.00 0.00 H new ATOM 0 HG2 LYS A 235 31.319 0.033 20.303 1.00 0.00 H new ATOM 0 HG3 LYS A 235 32.232 -1.250 19.535 1.00 0.00 H new ATOM 0 HD2 LYS A 235 30.128 -2.079 18.432 1.00 0.00 H new ATOM 0 HD3 LYS A 235 29.224 -0.783 19.191 1.00 0.00 H new ATOM 0 HE2 LYS A 235 30.653 0.912 18.034 1.00 0.00 H new ATOM 0 HE3 LYS A 235 31.601 -0.368 17.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 235 29.886 0.424 15.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 235 29.591 -1.195 16.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 235 28.672 0.045 16.915 1.00 0.00 H new ATOM 493 N SER A 236 31.072 -0.241 23.689 1.00 0.00 N ATOM 494 CA SER A 236 31.027 1.059 24.350 1.00 0.00 C ATOM 495 C SER A 236 32.311 1.300 25.137 1.00 0.00 C ATOM 496 O SER A 236 32.829 2.417 25.170 1.00 0.00 O ATOM 497 CB SER A 236 29.827 1.124 25.295 1.00 0.00 C ATOM 498 OG SER A 236 28.634 0.891 24.555 1.00 0.00 O ATOM 0 H SER A 236 30.360 -0.901 24.001 1.00 0.00 H new ATOM 0 HA SER A 236 30.929 1.832 23.588 1.00 0.00 H new ATOM 0 HB2 SER A 236 29.930 0.380 26.085 1.00 0.00 H new ATOM 0 HB3 SER A 236 29.783 2.099 25.780 1.00 0.00 H new ATOM 0 HG SER A 236 27.862 0.930 25.158 1.00 0.00 H new ATOM 504 N LYS A 237 32.817 0.247 25.770 1.00 0.00 N ATOM 505 CA LYS A 237 34.041 0.356 26.555 1.00 0.00 C ATOM 506 C LYS A 237 35.217 0.742 25.665 1.00 0.00 C ATOM 507 O LYS A 237 36.083 1.518 26.069 1.00 0.00 O ATOM 508 CB LYS A 237 34.340 -0.976 27.248 1.00 0.00 C ATOM 509 CG LYS A 237 35.399 -0.764 28.331 1.00 0.00 C ATOM 510 CD LYS A 237 34.724 -0.303 29.623 1.00 0.00 C ATOM 511 CE LYS A 237 35.761 -0.240 30.747 1.00 0.00 C ATOM 512 NZ LYS A 237 36.738 0.848 30.461 1.00 0.00 N ATOM 0 H LYS A 237 32.402 -0.685 25.755 1.00 0.00 H new ATOM 0 HA LYS A 237 33.898 1.132 27.307 1.00 0.00 H new ATOM 0 HB2 LYS A 237 33.429 -1.380 27.690 1.00 0.00 H new ATOM 0 HB3 LYS A 237 34.692 -1.706 26.519 1.00 0.00 H new ATOM 0 HG2 LYS A 237 35.947 -1.690 28.505 1.00 0.00 H new ATOM 0 HG3 LYS A 237 36.126 -0.021 28.003 1.00 0.00 H new ATOM 0 HD2 LYS A 237 34.269 0.677 29.478 1.00 0.00 H new ATOM 0 HD3 LYS A 237 33.922 -0.990 29.892 1.00 0.00 H new ATOM 0 HE2 LYS A 237 35.268 -0.058 31.702 1.00 0.00 H new ATOM 0 HE3 LYS A 237 36.279 -1.195 30.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 237 37.303 1.040 31.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 237 37.367 0.555 29.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 237 36.226 1.710 30.184 1.00 0.00 H new ATOM 526 N ARG A 238 35.242 0.196 24.453 1.00 0.00 N ATOM 527 CA ARG A 238 36.319 0.493 23.517 1.00 0.00 C ATOM 528 C ARG A 238 36.335 1.978 23.179 1.00 0.00 C ATOM 529 O ARG A 238 37.395 2.603 23.138 1.00 0.00 O ATOM 530 CB ARG A 238 36.134 -0.322 22.235 1.00 0.00 C ATOM 531 CG ARG A 238 37.412 -0.244 21.398 1.00 0.00 C ATOM 532 CD ARG A 238 38.350 -1.385 21.796 1.00 0.00 C ATOM 533 NE ARG A 238 37.730 -2.672 21.501 1.00 0.00 N ATOM 534 CZ ARG A 238 38.198 -3.799 22.030 1.00 0.00 C ATOM 535 NH1 ARG A 238 39.223 -3.767 22.836 1.00 0.00 N ATOM 536 NH2 ARG A 238 37.629 -4.938 21.743 1.00 0.00 N ATOM 0 H ARG A 238 34.535 -0.449 24.099 1.00 0.00 H new ATOM 0 HA ARG A 238 37.268 0.226 23.983 1.00 0.00 H new ATOM 0 HB2 ARG A 238 35.908 -1.360 22.480 1.00 0.00 H new ATOM 0 HB3 ARG A 238 35.288 0.062 21.665 1.00 0.00 H new ATOM 0 HG2 ARG A 238 37.170 -0.311 20.337 1.00 0.00 H new ATOM 0 HG3 ARG A 238 37.903 0.716 21.553 1.00 0.00 H new ATOM 0 HD2 ARG A 238 39.293 -1.295 21.257 1.00 0.00 H new ATOM 0 HD3 ARG A 238 38.583 -1.320 22.859 1.00 0.00 H new ATOM 0 HE ARG A 238 36.923 -2.708 20.878 1.00 0.00 H new ATOM 0 HH11 ARG A 238 39.667 -2.877 23.061 1.00 0.00 H new ATOM 0 HH12 ARG A 238 39.581 -4.632 23.241 1.00 0.00 H new ATOM 0 HH21 ARG A 238 36.827 -4.963 21.114 1.00 0.00 H new ATOM 0 HH22 ARG A 238 37.987 -5.803 22.148 1.00 0.00 H new ATOM 550 N ARG A 239 35.157 2.538 22.934 1.00 0.00 N ATOM 551 CA ARG A 239 35.054 3.954 22.602 1.00 0.00 C ATOM 552 C ARG A 239 35.570 4.809 23.755 1.00 0.00 C ATOM 553 O ARG A 239 36.235 5.822 23.539 1.00 0.00 O ATOM 554 CB ARG A 239 33.597 4.316 22.306 1.00 0.00 C ATOM 555 CG ARG A 239 33.516 5.776 21.853 1.00 0.00 C ATOM 556 CD ARG A 239 32.058 6.141 21.566 1.00 0.00 C ATOM 557 NE ARG A 239 31.544 5.338 20.463 1.00 0.00 N ATOM 558 CZ ARG A 239 31.777 5.677 19.200 1.00 0.00 C ATOM 559 NH1 ARG A 239 32.482 6.741 18.930 1.00 0.00 N ATOM 560 NH2 ARG A 239 31.305 4.945 18.229 1.00 0.00 N ATOM 0 H ARG A 239 34.267 2.040 22.958 1.00 0.00 H new ATOM 0 HA ARG A 239 35.662 4.149 21.718 1.00 0.00 H new ATOM 0 HB2 ARG A 239 33.199 3.661 21.531 1.00 0.00 H new ATOM 0 HB3 ARG A 239 32.986 4.166 23.196 1.00 0.00 H new ATOM 0 HG2 ARG A 239 33.921 6.430 22.625 1.00 0.00 H new ATOM 0 HG3 ARG A 239 34.122 5.925 20.959 1.00 0.00 H new ATOM 0 HD2 ARG A 239 31.453 5.977 22.457 1.00 0.00 H new ATOM 0 HD3 ARG A 239 31.983 7.200 21.320 1.00 0.00 H new ATOM 0 HE ARG A 239 30.996 4.502 20.665 1.00 0.00 H new ATOM 0 HH11 ARG A 239 32.854 7.312 19.689 1.00 0.00 H new ATOM 0 HH12 ARG A 239 32.661 7.002 17.960 1.00 0.00 H new ATOM 0 HH21 ARG A 239 30.756 4.111 18.439 1.00 0.00 H new ATOM 0 HH22 ARG A 239 31.485 5.206 17.260 1.00 0.00 H new ATOM 574 N GLN A 240 35.256 4.397 24.980 1.00 0.00 N ATOM 575 CA GLN A 240 35.688 5.141 26.157 1.00 0.00 C ATOM 576 C GLN A 240 37.210 5.167 26.239 1.00 0.00 C ATOM 577 O GLN A 240 37.802 6.134 26.715 1.00 0.00 O ATOM 578 CB GLN A 240 35.115 4.497 27.422 1.00 0.00 C ATOM 579 CG GLN A 240 33.602 4.729 27.475 1.00 0.00 C ATOM 580 CD GLN A 240 33.013 4.051 28.707 1.00 0.00 C ATOM 581 OE1 GLN A 240 33.750 3.505 29.528 1.00 0.00 O ATOM 582 NE2 GLN A 240 31.721 4.052 28.885 1.00 0.00 N ATOM 0 H GLN A 240 34.709 3.560 25.182 1.00 0.00 H new ATOM 0 HA GLN A 240 35.321 6.164 26.075 1.00 0.00 H new ATOM 0 HB2 GLN A 240 35.330 3.428 27.428 1.00 0.00 H new ATOM 0 HB3 GLN A 240 35.590 4.922 28.306 1.00 0.00 H new ATOM 0 HG2 GLN A 240 33.390 5.798 27.502 1.00 0.00 H new ATOM 0 HG3 GLN A 240 33.133 4.334 26.574 1.00 0.00 H new ATOM 0 HE21 GLN A 240 31.113 4.505 28.203 1.00 0.00 H new ATOM 0 HE22 GLN A 240 31.319 3.600 29.706 1.00 0.00 H new ATOM 591 N PHE A 241 37.835 4.093 25.766 1.00 0.00 N ATOM 592 CA PHE A 241 39.289 3.994 25.785 1.00 0.00 C ATOM 593 C PHE A 241 39.905 5.087 24.920 1.00 0.00 C ATOM 594 O PHE A 241 40.869 5.741 25.319 1.00 0.00 O ATOM 595 CB PHE A 241 39.725 2.622 25.265 1.00 0.00 C ATOM 596 CG PHE A 241 41.218 2.470 25.424 1.00 0.00 C ATOM 597 CD1 PHE A 241 41.756 2.129 26.671 1.00 0.00 C ATOM 598 CD2 PHE A 241 42.065 2.671 24.328 1.00 0.00 C ATOM 599 CE1 PHE A 241 43.142 1.990 26.822 1.00 0.00 C ATOM 600 CE2 PHE A 241 43.451 2.532 24.478 1.00 0.00 C ATOM 601 CZ PHE A 241 43.988 2.192 25.724 1.00 0.00 C ATOM 0 H PHE A 241 37.360 3.283 25.367 1.00 0.00 H new ATOM 0 HA PHE A 241 39.633 4.118 26.812 1.00 0.00 H new ATOM 0 HB2 PHE A 241 39.209 1.834 25.813 1.00 0.00 H new ATOM 0 HB3 PHE A 241 39.448 2.515 24.216 1.00 0.00 H new ATOM 0 HD1 PHE A 241 41.102 1.973 27.517 1.00 0.00 H new ATOM 0 HD2 PHE A 241 41.650 2.933 23.366 1.00 0.00 H new ATOM 0 HE1 PHE A 241 43.558 1.727 27.784 1.00 0.00 H new ATOM 0 HE2 PHE A 241 44.104 2.687 23.632 1.00 0.00 H new ATOM 0 HZ PHE A 241 45.056 2.085 25.840 1.00 0.00 H new ATOM 611 N HIS A 242 39.340 5.280 23.732 1.00 0.00 N ATOM 612 CA HIS A 242 39.841 6.295 22.814 1.00 0.00 C ATOM 613 C HIS A 242 39.656 7.689 23.404 1.00 0.00 C ATOM 614 O HIS A 242 40.526 8.549 23.277 1.00 0.00 O ATOM 615 CB HIS A 242 39.100 6.205 21.478 1.00 0.00 C ATOM 616 CG HIS A 242 39.477 4.926 20.778 1.00 0.00 C ATOM 617 ND1 HIS A 242 40.677 4.783 20.099 1.00 0.00 N ATOM 618 CD2 HIS A 242 38.824 3.726 20.640 1.00 0.00 C ATOM 619 CE1 HIS A 242 40.709 3.539 19.588 1.00 0.00 C ATOM 620 NE2 HIS A 242 39.604 2.852 19.889 1.00 0.00 N ATOM 0 H HIS A 242 38.540 4.750 23.385 1.00 0.00 H new ATOM 0 HA HIS A 242 40.904 6.117 22.653 1.00 0.00 H new ATOM 0 HB2 HIS A 242 38.023 6.237 21.645 1.00 0.00 H new ATOM 0 HB3 HIS A 242 39.351 7.062 20.853 1.00 0.00 H new ATOM 0 HD2 HIS A 242 37.853 3.496 21.052 1.00 0.00 H new ATOM 0 HE1 HIS A 242 41.528 3.144 19.005 1.00 0.00 H new ATOM 0 HE2 HIS A 242 39.380 1.893 19.625 1.00 0.00 H new ATOM 628 N GLN A 243 38.513 7.906 24.048 1.00 0.00 N ATOM 629 CA GLN A 243 38.220 9.201 24.648 1.00 0.00 C ATOM 630 C GLN A 243 39.122 9.447 25.853 1.00 0.00 C ATOM 631 O GLN A 243 39.421 10.592 26.195 1.00 0.00 O ATOM 632 CB GLN A 243 36.754 9.261 25.080 1.00 0.00 C ATOM 633 CG GLN A 243 35.855 9.265 23.841 1.00 0.00 C ATOM 634 CD GLN A 243 34.390 9.233 24.263 1.00 0.00 C ATOM 635 OE1 GLN A 243 33.941 8.266 24.879 1.00 0.00 O ATOM 636 NE2 GLN A 243 33.613 10.238 23.964 1.00 0.00 N ATOM 0 H GLN A 243 37.780 7.207 24.167 1.00 0.00 H new ATOM 0 HA GLN A 243 38.407 9.976 23.904 1.00 0.00 H new ATOM 0 HB2 GLN A 243 36.515 8.406 25.713 1.00 0.00 H new ATOM 0 HB3 GLN A 243 36.576 10.157 25.674 1.00 0.00 H new ATOM 0 HG2 GLN A 243 36.051 10.154 23.242 1.00 0.00 H new ATOM 0 HG3 GLN A 243 36.081 8.402 23.214 1.00 0.00 H new ATOM 0 HE21 GLN A 243 33.987 11.038 23.454 1.00 0.00 H new ATOM 0 HE22 GLN A 243 32.631 10.224 24.241 1.00 0.00 H new ATOM 645 N GLU A 244 39.552 8.364 26.492 1.00 0.00 N ATOM 646 CA GLU A 244 40.414 8.471 27.665 1.00 0.00 C ATOM 647 C GLU A 244 41.761 9.075 27.283 1.00 0.00 C ATOM 648 O GLU A 244 42.294 9.928 27.994 1.00 0.00 O ATOM 649 CB GLU A 244 40.629 7.090 28.285 1.00 0.00 C ATOM 650 CG GLU A 244 41.452 7.226 29.567 1.00 0.00 C ATOM 651 CD GLU A 244 41.582 5.870 30.252 1.00 0.00 C ATOM 652 OE1 GLU A 244 41.212 4.881 29.641 1.00 0.00 O ATOM 653 OE2 GLU A 244 42.050 5.839 31.378 1.00 0.00 O ATOM 0 H GLU A 244 39.320 7.409 26.221 1.00 0.00 H new ATOM 0 HA GLU A 244 39.928 9.122 28.392 1.00 0.00 H new ATOM 0 HB2 GLU A 244 39.668 6.625 28.505 1.00 0.00 H new ATOM 0 HB3 GLU A 244 41.143 6.439 27.578 1.00 0.00 H new ATOM 0 HG2 GLU A 244 42.441 7.621 29.333 1.00 0.00 H new ATOM 0 HG3 GLU A 244 40.975 7.938 30.241 1.00 0.00 H new ATOM 660 N ILE A 245 42.307 8.624 26.158 1.00 0.00 N ATOM 661 CA ILE A 245 43.593 9.127 25.692 1.00 0.00 C ATOM 662 C ILE A 245 43.419 10.473 24.995 1.00 0.00 C ATOM 663 O ILE A 245 44.387 11.203 24.784 1.00 0.00 O ATOM 664 CB ILE A 245 44.223 8.125 24.723 1.00 0.00 C ATOM 665 CG1 ILE A 245 43.237 7.821 23.594 1.00 0.00 C ATOM 666 CG2 ILE A 245 44.555 6.831 25.469 1.00 0.00 C ATOM 667 CD1 ILE A 245 43.923 6.952 22.538 1.00 0.00 C ATOM 0 H ILE A 245 41.883 7.917 25.557 1.00 0.00 H new ATOM 0 HA ILE A 245 44.247 9.259 26.554 1.00 0.00 H new ATOM 0 HB ILE A 245 45.137 8.549 24.306 1.00 0.00 H new ATOM 0 HG12 ILE A 245 42.361 7.307 23.990 1.00 0.00 H new ATOM 0 HG13 ILE A 245 42.885 8.749 23.144 1.00 0.00 H new ATOM 0 HG21 ILE A 245 45.004 6.118 24.778 1.00 0.00 H new ATOM 0 HG22 ILE A 245 45.256 7.046 26.275 1.00 0.00 H new ATOM 0 HG23 ILE A 245 43.642 6.407 25.886 1.00 0.00 H new ATOM 0 HD11 ILE A 245 43.221 6.735 21.733 1.00 0.00 H new ATOM 0 HD12 ILE A 245 44.785 7.483 22.134 1.00 0.00 H new ATOM 0 HD13 ILE A 245 44.253 6.018 22.993 1.00 0.00 H new ATOM 679 N GLN A 246 42.179 10.792 24.637 1.00 0.00 N ATOM 680 CA GLN A 246 41.886 12.053 23.962 1.00 0.00 C ATOM 681 C GLN A 246 42.207 13.232 24.874 1.00 0.00 C ATOM 682 O GLN A 246 42.792 14.225 24.442 1.00 0.00 O ATOM 683 CB GLN A 246 40.411 12.103 23.555 1.00 0.00 C ATOM 684 CG GLN A 246 40.165 13.330 22.676 1.00 0.00 C ATOM 685 CD GLN A 246 40.879 13.163 21.339 1.00 0.00 C ATOM 686 OE1 GLN A 246 40.901 12.069 20.778 1.00 0.00 O ATOM 687 NE2 GLN A 246 41.467 14.193 20.794 1.00 0.00 N ATOM 0 H GLN A 246 41.365 10.199 24.801 1.00 0.00 H new ATOM 0 HA GLN A 246 42.507 12.118 23.069 1.00 0.00 H new ATOM 0 HB2 GLN A 246 40.141 11.196 23.015 1.00 0.00 H new ATOM 0 HB3 GLN A 246 39.779 12.146 24.442 1.00 0.00 H new ATOM 0 HG2 GLN A 246 39.095 13.463 22.513 1.00 0.00 H new ATOM 0 HG3 GLN A 246 40.524 14.227 23.180 1.00 0.00 H new ATOM 0 HE21 GLN A 246 41.447 15.099 21.262 1.00 0.00 H new ATOM 0 HE22 GLN A 246 41.947 14.092 19.900 1.00 0.00 H new ATOM 696 N SER A 247 41.817 13.112 26.139 1.00 0.00 N ATOM 697 CA SER A 247 42.064 14.172 27.110 1.00 0.00 C ATOM 698 C SER A 247 43.547 14.248 27.457 1.00 0.00 C ATOM 699 O SER A 247 44.017 15.252 27.995 1.00 0.00 O ATOM 700 CB SER A 247 41.252 13.913 28.377 1.00 0.00 C ATOM 701 OG SER A 247 39.883 14.195 28.123 1.00 0.00 O ATOM 0 H SER A 247 41.332 12.297 26.514 1.00 0.00 H new ATOM 0 HA SER A 247 41.759 15.122 26.671 1.00 0.00 H new ATOM 0 HB2 SER A 247 41.369 12.876 28.692 1.00 0.00 H new ATOM 0 HB3 SER A 247 41.619 14.537 29.192 1.00 0.00 H new ATOM 0 HG SER A 247 39.359 14.028 28.934 1.00 0.00 H new ATOM 707 N ARG A 248 44.279 13.184 27.145 1.00 0.00 N ATOM 708 CA ARG A 248 45.709 13.144 27.433 1.00 0.00 C ATOM 709 C ARG A 248 46.494 13.859 26.339 1.00 0.00 C ATOM 710 O ARG A 248 47.723 13.930 26.387 1.00 0.00 O ATOM 711 CB ARG A 248 46.183 11.691 27.535 1.00 0.00 C ATOM 712 CG ARG A 248 45.450 10.994 28.684 1.00 0.00 C ATOM 713 CD ARG A 248 46.188 11.264 29.997 1.00 0.00 C ATOM 714 NE ARG A 248 47.558 10.769 29.916 1.00 0.00 N ATOM 715 CZ ARG A 248 48.438 11.033 30.874 1.00 0.00 C ATOM 716 NH1 ARG A 248 48.084 11.738 31.913 1.00 0.00 N ATOM 717 NH2 ARG A 248 49.661 10.582 30.779 1.00 0.00 N ATOM 0 H ARG A 248 43.911 12.345 26.697 1.00 0.00 H new ATOM 0 HA ARG A 248 45.883 13.650 28.383 1.00 0.00 H new ATOM 0 HB2 ARG A 248 45.992 11.168 26.598 1.00 0.00 H new ATOM 0 HB3 ARG A 248 47.259 11.659 27.704 1.00 0.00 H new ATOM 0 HG2 ARG A 248 44.425 11.358 28.749 1.00 0.00 H new ATOM 0 HG3 ARG A 248 45.397 9.921 28.498 1.00 0.00 H new ATOM 0 HD2 ARG A 248 46.192 12.334 30.207 1.00 0.00 H new ATOM 0 HD3 ARG A 248 45.667 10.779 30.822 1.00 0.00 H new ATOM 0 HE ARG A 248 47.844 10.212 29.111 1.00 0.00 H new ATOM 0 HH11 ARG A 248 47.129 12.088 31.991 1.00 0.00 H new ATOM 0 HH12 ARG A 248 48.762 11.939 32.648 1.00 0.00 H new ATOM 0 HH21 ARG A 248 49.939 10.028 29.969 1.00 0.00 H new ATOM 0 HH22 ARG A 248 50.338 10.784 31.515 1.00 0.00 H new