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 -30:sc= 0.322 USER MOD Single : A 218 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 222 LYS NZ :NH3+ 161:sc= -0.061 (180deg=-0.483) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 LYS NZ :NH3+ -163:sc= -0.0404 (180deg=-0.363) USER MOD Single : A 228 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 235 LYS NZ :NH3+ 151:sc= -0.119 (180deg=-0.633) USER MOD Single : A 236 SER OG : rot 180:sc= 0 USER MOD Single : A 237 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 240 GLN : amide:sc= -0.213 X(o=-0.21,f=-0.35) USER MOD Single : A 242 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 243 GLN : amide:sc= -0.25 K(o=-0.25,f=-0.93) USER MOD Single : A 246 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 247 SER OG : rot -22:sc= 0.489 USER MOD ----------------------------------------------------------------- ATOM 175 N SER A 217 42.829 -3.088 4.708 1.00 0.00 N ATOM 176 CA SER A 217 41.588 -3.520 4.077 1.00 0.00 C ATOM 177 C SER A 217 40.480 -2.500 4.315 1.00 0.00 C ATOM 178 O SER A 217 39.829 -2.507 5.360 1.00 0.00 O ATOM 179 CB SER A 217 41.163 -4.877 4.639 1.00 0.00 C ATOM 180 OG SER A 217 41.344 -4.879 6.049 1.00 0.00 O ATOM 0 HA SER A 217 41.760 -3.607 3.004 1.00 0.00 H new ATOM 0 HB2 SER A 217 40.119 -5.074 4.395 1.00 0.00 H new ATOM 0 HB3 SER A 217 41.753 -5.673 4.184 1.00 0.00 H new ATOM 0 HG SER A 217 42.084 -4.281 6.285 1.00 0.00 H new ATOM 186 N LYS A 218 40.267 -1.625 3.336 1.00 0.00 N ATOM 187 CA LYS A 218 39.233 -0.602 3.448 1.00 0.00 C ATOM 188 C LYS A 218 37.851 -1.241 3.511 1.00 0.00 C ATOM 189 O LYS A 218 36.942 -0.713 4.152 1.00 0.00 O ATOM 190 CB LYS A 218 39.305 0.345 2.249 1.00 0.00 C ATOM 191 CG LYS A 218 38.312 1.492 2.443 1.00 0.00 C ATOM 192 CD LYS A 218 38.413 2.465 1.266 1.00 0.00 C ATOM 193 CE LYS A 218 37.432 3.620 1.470 1.00 0.00 C ATOM 194 NZ LYS A 218 37.531 4.564 0.321 1.00 0.00 N ATOM 0 H LYS A 218 40.793 -1.604 2.462 1.00 0.00 H new ATOM 0 HA LYS A 218 39.402 -0.040 4.366 1.00 0.00 H new ATOM 0 HB2 LYS A 218 40.316 0.739 2.144 1.00 0.00 H new ATOM 0 HB3 LYS A 218 39.077 -0.196 1.331 1.00 0.00 H new ATOM 0 HG2 LYS A 218 37.298 1.099 2.517 1.00 0.00 H new ATOM 0 HG3 LYS A 218 38.521 2.013 3.377 1.00 0.00 H new ATOM 0 HD2 LYS A 218 39.430 2.848 1.184 1.00 0.00 H new ATOM 0 HD3 LYS A 218 38.192 1.947 0.333 1.00 0.00 H new ATOM 0 HE2 LYS A 218 36.415 3.237 1.553 1.00 0.00 H new ATOM 0 HE3 LYS A 218 37.654 4.140 2.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 218 36.864 5.350 0.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 218 38.500 4.938 0.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 218 37.299 4.063 -0.561 1.00 0.00 H new ATOM 208 N ASP A 219 37.696 -2.378 2.841 1.00 0.00 N ATOM 209 CA ASP A 219 36.416 -3.076 2.831 1.00 0.00 C ATOM 210 C ASP A 219 36.074 -3.567 4.234 1.00 0.00 C ATOM 211 O ASP A 219 34.903 -3.738 4.571 1.00 0.00 O ATOM 212 CB ASP A 219 36.475 -4.264 1.869 1.00 0.00 C ATOM 213 CG ASP A 219 36.550 -3.766 0.429 1.00 0.00 C ATOM 214 OD1 ASP A 219 36.268 -2.600 0.211 1.00 0.00 O ATOM 215 OD2 ASP A 219 36.892 -4.559 -0.433 1.00 0.00 O ATOM 0 H ASP A 219 38.434 -2.832 2.302 1.00 0.00 H new ATOM 0 HA ASP A 219 35.643 -2.384 2.498 1.00 0.00 H new ATOM 0 HB2 ASP A 219 37.344 -4.882 2.094 1.00 0.00 H new ATOM 0 HB3 ASP A 219 35.594 -4.893 2.000 1.00 0.00 H new ATOM 220 N GLU A 220 37.101 -3.785 5.049 1.00 0.00 N ATOM 221 CA GLU A 220 36.886 -4.253 6.413 1.00 0.00 C ATOM 222 C GLU A 220 36.141 -3.194 7.219 1.00 0.00 C ATOM 223 O GLU A 220 35.275 -3.512 8.034 1.00 0.00 O ATOM 224 CB GLU A 220 38.230 -4.554 7.083 1.00 0.00 C ATOM 225 CG GLU A 220 38.007 -5.469 8.289 1.00 0.00 C ATOM 226 CD GLU A 220 37.245 -4.720 9.376 1.00 0.00 C ATOM 227 OE1 GLU A 220 37.436 -3.519 9.485 1.00 0.00 O ATOM 228 OE2 GLU A 220 36.481 -5.356 10.082 1.00 0.00 O ATOM 0 H GLU A 220 38.079 -3.647 4.793 1.00 0.00 H new ATOM 0 HA GLU A 220 36.289 -5.164 6.379 1.00 0.00 H new ATOM 0 HB2 GLU A 220 38.904 -5.031 6.371 1.00 0.00 H new ATOM 0 HB3 GLU A 220 38.706 -3.626 7.400 1.00 0.00 H new ATOM 0 HG2 GLU A 220 37.448 -6.355 7.986 1.00 0.00 H new ATOM 0 HG3 GLU A 220 38.966 -5.814 8.677 1.00 0.00 H new ATOM 235 N ILE A 221 36.489 -1.933 6.985 1.00 0.00 N ATOM 236 CA ILE A 221 35.857 -0.828 7.696 1.00 0.00 C ATOM 237 C ILE A 221 34.373 -0.753 7.357 1.00 0.00 C ATOM 238 O ILE A 221 33.535 -0.550 8.236 1.00 0.00 O ATOM 239 CB ILE A 221 36.535 0.491 7.324 1.00 0.00 C ATOM 240 CG1 ILE A 221 38.047 0.356 7.523 1.00 0.00 C ATOM 241 CG2 ILE A 221 36.003 1.610 8.222 1.00 0.00 C ATOM 242 CD1 ILE A 221 38.338 -0.120 8.948 1.00 0.00 C ATOM 0 H ILE A 221 37.202 -1.652 6.312 1.00 0.00 H new ATOM 0 HA ILE A 221 35.966 -1.001 8.767 1.00 0.00 H new ATOM 0 HB ILE A 221 36.322 0.729 6.282 1.00 0.00 H new ATOM 0 HG12 ILE A 221 38.457 -0.351 6.802 1.00 0.00 H new ATOM 0 HG13 ILE A 221 38.535 1.314 7.342 1.00 0.00 H new ATOM 0 HG21 ILE A 221 36.486 2.550 7.957 1.00 0.00 H new ATOM 0 HG22 ILE A 221 34.926 1.705 8.086 1.00 0.00 H new ATOM 0 HG23 ILE A 221 36.217 1.373 9.264 1.00 0.00 H new ATOM 0 HD11 ILE A 221 39.415 -0.215 9.087 1.00 0.00 H new ATOM 0 HD12 ILE A 221 37.943 0.603 9.661 1.00 0.00 H new ATOM 0 HD13 ILE A 221 37.864 -1.088 9.112 1.00 0.00 H new ATOM 254 N LYS A 222 34.053 -0.917 6.078 1.00 0.00 N ATOM 255 CA LYS A 222 32.665 -0.860 5.638 1.00 0.00 C ATOM 256 C LYS A 222 31.838 -1.942 6.329 1.00 0.00 C ATOM 257 O LYS A 222 30.672 -1.725 6.658 1.00 0.00 O ATOM 258 CB LYS A 222 32.583 -1.040 4.120 1.00 0.00 C ATOM 259 CG LYS A 222 31.136 -0.849 3.664 1.00 0.00 C ATOM 260 CD LYS A 222 31.059 -0.982 2.142 1.00 0.00 C ATOM 261 CE LYS A 222 29.609 -0.816 1.687 1.00 0.00 C ATOM 262 NZ LYS A 222 29.144 0.566 1.995 1.00 0.00 N ATOM 0 H LYS A 222 34.729 -1.089 5.334 1.00 0.00 H new ATOM 0 HA LYS A 222 32.262 0.117 5.906 1.00 0.00 H new ATOM 0 HB2 LYS A 222 33.231 -0.319 3.622 1.00 0.00 H new ATOM 0 HB3 LYS A 222 32.936 -2.033 3.841 1.00 0.00 H new ATOM 0 HG2 LYS A 222 30.493 -1.591 4.138 1.00 0.00 H new ATOM 0 HG3 LYS A 222 30.772 0.131 3.973 1.00 0.00 H new ATOM 0 HD2 LYS A 222 31.688 -0.228 1.668 1.00 0.00 H new ATOM 0 HD3 LYS A 222 31.439 -1.955 1.832 1.00 0.00 H new ATOM 0 HE2 LYS A 222 29.529 -1.008 0.617 1.00 0.00 H new ATOM 0 HE3 LYS A 222 28.974 -1.545 2.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 222 28.307 0.787 1.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 222 28.898 0.633 3.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 222 29.902 1.244 1.778 1.00 0.00 H new ATOM 276 N ARG A 223 32.443 -3.105 6.544 1.00 0.00 N ATOM 277 CA ARG A 223 31.739 -4.200 7.201 1.00 0.00 C ATOM 278 C ARG A 223 31.421 -3.818 8.641 1.00 0.00 C ATOM 279 O ARG A 223 30.368 -4.171 9.174 1.00 0.00 O ATOM 280 CB ARG A 223 32.596 -5.468 7.181 1.00 0.00 C ATOM 281 CG ARG A 223 32.702 -5.992 5.746 1.00 0.00 C ATOM 282 CD ARG A 223 33.575 -7.247 5.724 1.00 0.00 C ATOM 283 NE ARG A 223 33.691 -7.759 4.364 1.00 0.00 N ATOM 284 CZ ARG A 223 32.806 -8.622 3.875 1.00 0.00 C ATOM 285 NH1 ARG A 223 31.806 -9.021 4.613 1.00 0.00 N ATOM 286 NH2 ARG A 223 32.934 -9.069 2.655 1.00 0.00 N ATOM 0 H ARG A 223 33.405 -3.313 6.277 1.00 0.00 H new ATOM 0 HA ARG A 223 30.810 -4.393 6.664 1.00 0.00 H new ATOM 0 HB2 ARG A 223 33.589 -5.254 7.575 1.00 0.00 H new ATOM 0 HB3 ARG A 223 32.154 -6.228 7.825 1.00 0.00 H new ATOM 0 HG2 ARG A 223 31.710 -6.220 5.357 1.00 0.00 H new ATOM 0 HG3 ARG A 223 33.131 -5.227 5.099 1.00 0.00 H new ATOM 0 HD2 ARG A 223 34.565 -7.017 6.119 1.00 0.00 H new ATOM 0 HD3 ARG A 223 33.143 -8.010 6.372 1.00 0.00 H new ATOM 0 HE ARG A 223 34.465 -7.449 3.777 1.00 0.00 H new ATOM 0 HH11 ARG A 223 31.703 -8.671 5.565 1.00 0.00 H new ATOM 0 HH12 ARG A 223 31.127 -9.683 4.237 1.00 0.00 H new ATOM 0 HH21 ARG A 223 33.714 -8.756 2.076 1.00 0.00 H new ATOM 0 HH22 ARG A 223 32.255 -9.731 2.281 1.00 0.00 H new ATOM 300 N GLU A 224 32.346 -3.094 9.262 1.00 0.00 N ATOM 301 CA GLU A 224 32.178 -2.665 10.644 1.00 0.00 C ATOM 302 C GLU A 224 31.077 -1.614 10.738 1.00 0.00 C ATOM 303 O GLU A 224 30.456 -1.439 11.787 1.00 0.00 O ATOM 304 CB GLU A 224 33.491 -2.085 11.176 1.00 0.00 C ATOM 305 CG GLU A 224 34.536 -3.199 11.283 1.00 0.00 C ATOM 306 CD GLU A 224 35.856 -2.626 11.784 1.00 0.00 C ATOM 307 OE1 GLU A 224 35.900 -1.437 12.054 1.00 0.00 O ATOM 308 OE2 GLU A 224 36.806 -3.385 11.892 1.00 0.00 O ATOM 0 H GLU A 224 33.219 -2.792 8.830 1.00 0.00 H new ATOM 0 HA GLU A 224 31.898 -3.529 11.247 1.00 0.00 H new ATOM 0 HB2 GLU A 224 33.849 -1.299 10.511 1.00 0.00 H new ATOM 0 HB3 GLU A 224 33.330 -1.628 12.152 1.00 0.00 H new ATOM 0 HG2 GLU A 224 34.185 -3.975 11.963 1.00 0.00 H new ATOM 0 HG3 GLU A 224 34.680 -3.669 10.310 1.00 0.00 H new ATOM 315 N TYR A 225 30.841 -0.918 9.629 1.00 0.00 N ATOM 316 CA TYR A 225 29.814 0.115 9.585 1.00 0.00 C ATOM 317 C TYR A 225 28.439 -0.484 9.868 1.00 0.00 C ATOM 318 O TYR A 225 27.631 0.107 10.585 1.00 0.00 O ATOM 319 CB TYR A 225 29.807 0.787 8.210 1.00 0.00 C ATOM 320 CG TYR A 225 28.856 1.960 8.227 1.00 0.00 C ATOM 321 CD1 TYR A 225 29.313 3.227 8.613 1.00 0.00 C ATOM 322 CD2 TYR A 225 27.517 1.784 7.857 1.00 0.00 C ATOM 323 CE1 TYR A 225 28.431 4.315 8.629 1.00 0.00 C ATOM 324 CE2 TYR A 225 26.636 2.871 7.873 1.00 0.00 C ATOM 325 CZ TYR A 225 27.092 4.137 8.258 1.00 0.00 C ATOM 326 OH TYR A 225 26.224 5.209 8.274 1.00 0.00 O ATOM 0 H TYR A 225 31.346 -1.051 8.753 1.00 0.00 H new ATOM 0 HA TYR A 225 30.039 0.857 10.351 1.00 0.00 H new ATOM 0 HB2 TYR A 225 30.811 1.123 7.953 1.00 0.00 H new ATOM 0 HB3 TYR A 225 29.505 0.071 7.445 1.00 0.00 H new ATOM 0 HD1 TYR A 225 30.346 3.365 8.898 1.00 0.00 H new ATOM 0 HD2 TYR A 225 27.164 0.808 7.559 1.00 0.00 H new ATOM 0 HE1 TYR A 225 28.783 5.291 8.927 1.00 0.00 H new ATOM 0 HE2 TYR A 225 25.603 2.733 7.588 1.00 0.00 H new ATOM 0 HH TYR A 225 25.334 4.914 7.988 1.00 0.00 H new ATOM 336 N LYS A 226 28.182 -1.657 9.300 1.00 0.00 N ATOM 337 CA LYS A 226 26.900 -2.322 9.493 1.00 0.00 C ATOM 338 C LYS A 226 26.685 -2.651 10.968 1.00 0.00 C ATOM 339 O LYS A 226 25.590 -2.467 11.500 1.00 0.00 O ATOM 340 CB LYS A 226 26.853 -3.612 8.670 1.00 0.00 C ATOM 341 CG LYS A 226 25.461 -4.236 8.779 1.00 0.00 C ATOM 342 CD LYS A 226 25.388 -5.485 7.900 1.00 0.00 C ATOM 343 CE LYS A 226 23.988 -6.091 7.986 1.00 0.00 C ATOM 344 NZ LYS A 226 23.750 -6.596 9.368 1.00 0.00 N ATOM 0 H LYS A 226 28.839 -2.163 8.707 1.00 0.00 H new ATOM 0 HA LYS A 226 26.109 -1.650 9.162 1.00 0.00 H new ATOM 0 HB2 LYS A 226 27.087 -3.399 7.627 1.00 0.00 H new ATOM 0 HB3 LYS A 226 27.607 -4.313 9.029 1.00 0.00 H new ATOM 0 HG2 LYS A 226 25.248 -4.496 9.816 1.00 0.00 H new ATOM 0 HG3 LYS A 226 24.704 -3.516 8.469 1.00 0.00 H new ATOM 0 HD2 LYS A 226 25.622 -5.229 6.867 1.00 0.00 H new ATOM 0 HD3 LYS A 226 26.131 -6.214 8.224 1.00 0.00 H new ATOM 0 HE2 LYS A 226 23.239 -5.342 7.727 1.00 0.00 H new ATOM 0 HE3 LYS A 226 23.887 -6.905 7.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 226 22.942 -7.251 9.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 226 24.598 -7.094 9.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 226 23.543 -5.796 9.999 1.00 0.00 H new ATOM 358 N GLU A 227 27.735 -3.137 11.618 1.00 0.00 N ATOM 359 CA GLU A 227 27.650 -3.493 13.030 1.00 0.00 C ATOM 360 C GLU A 227 27.428 -2.250 13.884 1.00 0.00 C ATOM 361 O GLU A 227 26.730 -2.296 14.896 1.00 0.00 O ATOM 362 CB GLU A 227 28.936 -4.197 13.470 1.00 0.00 C ATOM 363 CG GLU A 227 29.034 -5.558 12.780 1.00 0.00 C ATOM 364 CD GLU A 227 30.361 -6.224 13.128 1.00 0.00 C ATOM 365 OE1 GLU A 227 31.095 -5.658 13.921 1.00 0.00 O ATOM 366 OE2 GLU A 227 30.623 -7.290 12.596 1.00 0.00 O ATOM 0 H GLU A 227 28.650 -3.293 11.194 1.00 0.00 H new ATOM 0 HA GLU A 227 26.804 -4.167 13.165 1.00 0.00 H new ATOM 0 HB2 GLU A 227 29.802 -3.586 13.217 1.00 0.00 H new ATOM 0 HB3 GLU A 227 28.941 -4.325 14.552 1.00 0.00 H new ATOM 0 HG2 GLU A 227 28.206 -6.194 13.092 1.00 0.00 H new ATOM 0 HG3 GLU A 227 28.952 -5.434 11.700 1.00 0.00 H new ATOM 373 N MET A 228 28.027 -1.139 13.468 1.00 0.00 N ATOM 374 CA MET A 228 27.889 0.115 14.200 1.00 0.00 C ATOM 375 C MET A 228 26.440 0.595 14.170 1.00 0.00 C ATOM 376 O MET A 228 25.958 1.201 15.125 1.00 0.00 O ATOM 377 CB MET A 228 28.797 1.182 13.589 1.00 0.00 C ATOM 378 CG MET A 228 30.243 0.930 14.019 1.00 0.00 C ATOM 379 SD MET A 228 31.324 2.163 13.253 1.00 0.00 S ATOM 380 CE MET A 228 32.808 1.794 14.219 1.00 0.00 C ATOM 0 H MET A 228 28.610 -1.081 12.633 1.00 0.00 H new ATOM 0 HA MET A 228 28.182 -0.057 15.236 1.00 0.00 H new ATOM 0 HB2 MET A 228 28.721 1.160 12.502 1.00 0.00 H new ATOM 0 HB3 MET A 228 28.478 2.173 13.911 1.00 0.00 H new ATOM 0 HG2 MET A 228 30.325 0.983 15.105 1.00 0.00 H new ATOM 0 HG3 MET A 228 30.552 -0.073 13.724 1.00 0.00 H new ATOM 0 HE1 MET A 228 33.619 2.452 13.906 1.00 0.00 H new ATOM 0 HE2 MET A 228 32.601 1.951 15.278 1.00 0.00 H new ATOM 0 HE3 MET A 228 33.099 0.756 14.056 1.00 0.00 H new ATOM 390 N GLU A 229 25.755 0.319 13.065 1.00 0.00 N ATOM 391 CA GLU A 229 24.363 0.730 12.920 1.00 0.00 C ATOM 392 C GLU A 229 23.478 -0.013 13.917 1.00 0.00 C ATOM 393 O GLU A 229 22.533 0.556 14.466 1.00 0.00 O ATOM 394 CB GLU A 229 23.880 0.446 11.495 1.00 0.00 C ATOM 395 CG GLU A 229 22.517 1.101 11.277 1.00 0.00 C ATOM 396 CD GLU A 229 22.667 2.619 11.242 1.00 0.00 C ATOM 397 OE1 GLU A 229 23.775 3.079 11.015 1.00 0.00 O ATOM 398 OE2 GLU A 229 21.675 3.298 11.443 1.00 0.00 O ATOM 0 H GLU A 229 26.137 -0.183 12.263 1.00 0.00 H new ATOM 0 HA GLU A 229 24.297 1.800 13.120 1.00 0.00 H new ATOM 0 HB2 GLU A 229 24.600 0.831 10.773 1.00 0.00 H new ATOM 0 HB3 GLU A 229 23.809 -0.629 11.332 1.00 0.00 H new ATOM 0 HG2 GLU A 229 22.080 0.749 10.342 1.00 0.00 H new ATOM 0 HG3 GLU A 229 21.834 0.813 12.076 1.00 0.00 H new ATOM 405 N GLY A 230 23.790 -1.283 14.145 1.00 0.00 N ATOM 406 CA GLY A 230 23.016 -2.096 15.078 1.00 0.00 C ATOM 407 C GLY A 230 22.946 -1.436 16.451 1.00 0.00 C ATOM 408 O GLY A 230 22.229 -0.453 16.642 1.00 0.00 O ATOM 0 H GLY A 230 24.568 -1.771 13.701 1.00 0.00 H new ATOM 0 HA2 GLY A 230 22.008 -2.242 14.689 1.00 0.00 H new ATOM 0 HA3 GLY A 230 23.469 -3.083 15.168 1.00 0.00 H new ATOM 437 N GLU A 233 26.813 -2.309 22.282 1.00 0.00 N ATOM 438 CA GLU A 233 27.067 -1.660 23.563 1.00 0.00 C ATOM 439 C GLU A 233 28.416 -2.096 24.129 1.00 0.00 C ATOM 440 O GLU A 233 29.057 -1.354 24.873 1.00 0.00 O ATOM 441 CB GLU A 233 25.954 -2.003 24.555 1.00 0.00 C ATOM 442 CG GLU A 233 24.651 -1.329 24.119 1.00 0.00 C ATOM 443 CD GLU A 233 23.506 -1.773 25.023 1.00 0.00 C ATOM 444 OE1 GLU A 233 23.776 -2.476 25.984 1.00 0.00 O ATOM 445 OE2 GLU A 233 22.378 -1.407 24.739 1.00 0.00 O ATOM 0 HA GLU A 233 27.087 -0.582 23.404 1.00 0.00 H new ATOM 0 HB2 GLU A 233 25.817 -3.083 24.604 1.00 0.00 H new ATOM 0 HB3 GLU A 233 26.230 -1.671 25.556 1.00 0.00 H new ATOM 0 HG2 GLU A 233 24.760 -0.245 24.162 1.00 0.00 H new ATOM 0 HG3 GLU A 233 24.428 -1.586 23.083 1.00 0.00 H new ATOM 452 N ILE A 234 28.835 -3.306 23.773 1.00 0.00 N ATOM 453 CA ILE A 234 30.108 -3.836 24.253 1.00 0.00 C ATOM 454 C ILE A 234 31.273 -3.026 23.693 1.00 0.00 C ATOM 455 O ILE A 234 32.239 -2.740 24.398 1.00 0.00 O ATOM 456 CB ILE A 234 30.253 -5.300 23.836 1.00 0.00 C ATOM 457 CG1 ILE A 234 31.466 -5.912 24.543 1.00 0.00 C ATOM 458 CG2 ILE A 234 30.449 -5.387 22.324 1.00 0.00 C ATOM 459 CD1 ILE A 234 31.199 -5.990 26.047 1.00 0.00 C ATOM 0 H ILE A 234 28.317 -3.934 23.159 1.00 0.00 H new ATOM 0 HA ILE A 234 30.123 -3.765 25.341 1.00 0.00 H new ATOM 0 HB ILE A 234 29.352 -5.847 24.115 1.00 0.00 H new ATOM 0 HG12 ILE A 234 31.666 -6.908 24.147 1.00 0.00 H new ATOM 0 HG13 ILE A 234 32.353 -5.309 24.352 1.00 0.00 H new ATOM 0 HG21 ILE A 234 30.552 -6.432 22.030 1.00 0.00 H new ATOM 0 HG22 ILE A 234 29.586 -4.951 21.820 1.00 0.00 H new ATOM 0 HG23 ILE A 234 31.349 -4.840 22.042 1.00 0.00 H new ATOM 0 HD11 ILE A 234 32.063 -6.426 26.548 1.00 0.00 H new ATOM 0 HD12 ILE A 234 31.020 -4.988 26.437 1.00 0.00 H new ATOM 0 HD13 ILE A 234 30.323 -6.612 26.229 1.00 0.00 H new ATOM 471 N LYS A 235 31.172 -2.657 22.418 1.00 0.00 N ATOM 472 CA LYS A 235 32.230 -1.887 21.773 1.00 0.00 C ATOM 473 C LYS A 235 32.334 -0.496 22.394 1.00 0.00 C ATOM 474 O LYS A 235 33.338 0.195 22.222 1.00 0.00 O ATOM 475 CB LYS A 235 31.940 -1.759 20.276 1.00 0.00 C ATOM 476 CG LYS A 235 31.787 -3.154 19.664 1.00 0.00 C ATOM 477 CD LYS A 235 33.130 -3.884 19.707 1.00 0.00 C ATOM 478 CE LYS A 235 33.119 -5.035 18.700 1.00 0.00 C ATOM 479 NZ LYS A 235 33.111 -4.482 17.317 1.00 0.00 N ATOM 0 H LYS A 235 30.377 -2.876 21.818 1.00 0.00 H new ATOM 0 HA LYS A 235 33.176 -2.409 21.918 1.00 0.00 H new ATOM 0 HB2 LYS A 235 31.030 -1.180 20.119 1.00 0.00 H new ATOM 0 HB3 LYS A 235 32.749 -1.221 19.783 1.00 0.00 H new ATOM 0 HG2 LYS A 235 31.035 -3.722 20.212 1.00 0.00 H new ATOM 0 HG3 LYS A 235 31.438 -3.074 18.634 1.00 0.00 H new ATOM 0 HD2 LYS A 235 33.939 -3.192 19.475 1.00 0.00 H new ATOM 0 HD3 LYS A 235 33.316 -4.267 20.711 1.00 0.00 H new ATOM 0 HE2 LYS A 235 33.994 -5.668 18.845 1.00 0.00 H new ATOM 0 HE3 LYS A 235 32.242 -5.662 18.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 235 33.579 -5.151 16.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 235 32.129 -4.334 17.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 235 33.619 -3.575 17.303 1.00 0.00 H new ATOM 493 N SER A 236 31.294 -0.096 23.117 1.00 0.00 N ATOM 494 CA SER A 236 31.281 1.213 23.762 1.00 0.00 C ATOM 495 C SER A 236 32.370 1.299 24.828 1.00 0.00 C ATOM 496 O SER A 236 32.997 2.343 25.005 1.00 0.00 O ATOM 497 CB SER A 236 29.917 1.464 24.405 1.00 0.00 C ATOM 498 OG SER A 236 28.896 1.232 23.444 1.00 0.00 O ATOM 0 H SER A 236 30.454 -0.654 23.271 1.00 0.00 H new ATOM 0 HA SER A 236 31.471 1.972 23.003 1.00 0.00 H new ATOM 0 HB2 SER A 236 29.780 0.807 25.264 1.00 0.00 H new ATOM 0 HB3 SER A 236 29.859 2.488 24.775 1.00 0.00 H new ATOM 0 HG SER A 236 28.020 1.390 23.853 1.00 0.00 H new ATOM 504 N LYS A 237 32.587 0.196 25.538 1.00 0.00 N ATOM 505 CA LYS A 237 33.600 0.161 26.586 1.00 0.00 C ATOM 506 C LYS A 237 34.987 0.418 26.006 1.00 0.00 C ATOM 507 O LYS A 237 35.812 1.095 26.619 1.00 0.00 O ATOM 508 CB LYS A 237 33.581 -1.200 27.285 1.00 0.00 C ATOM 509 CG LYS A 237 34.551 -1.181 28.468 1.00 0.00 C ATOM 510 CD LYS A 237 34.419 -2.486 29.257 1.00 0.00 C ATOM 511 CE LYS A 237 35.057 -3.627 28.464 1.00 0.00 C ATOM 512 NZ LYS A 237 35.277 -4.794 29.365 1.00 0.00 N ATOM 0 H LYS A 237 32.079 -0.679 25.408 1.00 0.00 H new ATOM 0 HA LYS A 237 33.373 0.945 27.308 1.00 0.00 H new ATOM 0 HB2 LYS A 237 32.573 -1.429 27.631 1.00 0.00 H new ATOM 0 HB3 LYS A 237 33.862 -1.985 26.583 1.00 0.00 H new ATOM 0 HG2 LYS A 237 35.574 -1.061 28.111 1.00 0.00 H new ATOM 0 HG3 LYS A 237 34.337 -0.330 29.114 1.00 0.00 H new ATOM 0 HD2 LYS A 237 34.905 -2.387 30.228 1.00 0.00 H new ATOM 0 HD3 LYS A 237 33.368 -2.704 29.447 1.00 0.00 H new ATOM 0 HE2 LYS A 237 34.412 -3.912 27.633 1.00 0.00 H new ATOM 0 HE3 LYS A 237 36.005 -3.301 28.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 237 35.711 -5.571 28.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 237 35.908 -4.517 30.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 237 34.365 -5.109 29.754 1.00 0.00 H new ATOM 526 N ARG A 238 35.239 -0.128 24.821 1.00 0.00 N ATOM 527 CA ARG A 238 36.532 0.044 24.169 1.00 0.00 C ATOM 528 C ARG A 238 36.771 1.511 23.827 1.00 0.00 C ATOM 529 O ARG A 238 37.895 2.005 23.922 1.00 0.00 O ATOM 530 CB ARG A 238 36.589 -0.794 22.890 1.00 0.00 C ATOM 531 CG ARG A 238 36.591 -2.279 23.251 1.00 0.00 C ATOM 532 CD ARG A 238 36.522 -3.116 21.973 1.00 0.00 C ATOM 533 NE ARG A 238 37.726 -2.921 21.175 1.00 0.00 N ATOM 534 CZ ARG A 238 38.832 -3.619 21.416 1.00 0.00 C ATOM 535 NH1 ARG A 238 38.851 -4.499 22.379 1.00 0.00 N ATOM 536 NH2 ARG A 238 39.899 -3.423 20.691 1.00 0.00 N ATOM 0 H ARG A 238 34.570 -0.690 24.295 1.00 0.00 H new ATOM 0 HA ARG A 238 37.309 -0.288 24.857 1.00 0.00 H new ATOM 0 HB2 ARG A 238 35.734 -0.565 22.254 1.00 0.00 H new ATOM 0 HB3 ARG A 238 37.485 -0.546 22.320 1.00 0.00 H new ATOM 0 HG2 ARG A 238 37.492 -2.526 23.812 1.00 0.00 H new ATOM 0 HG3 ARG A 238 35.742 -2.509 23.895 1.00 0.00 H new ATOM 0 HD2 ARG A 238 36.412 -4.170 22.226 1.00 0.00 H new ATOM 0 HD3 ARG A 238 35.643 -2.834 21.393 1.00 0.00 H new ATOM 0 HE ARG A 238 37.720 -2.237 20.418 1.00 0.00 H new ATOM 0 HH11 ARG A 238 38.018 -4.652 22.947 1.00 0.00 H new ATOM 0 HH12 ARG A 238 39.699 -5.034 22.564 1.00 0.00 H new ATOM 0 HH21 ARG A 238 39.885 -2.734 19.939 1.00 0.00 H new ATOM 0 HH22 ARG A 238 40.747 -3.959 20.876 1.00 0.00 H new ATOM 550 N ARG A 239 35.710 2.203 23.424 1.00 0.00 N ATOM 551 CA ARG A 239 35.824 3.613 23.062 1.00 0.00 C ATOM 552 C ARG A 239 36.260 4.447 24.260 1.00 0.00 C ATOM 553 O ARG A 239 37.012 5.411 24.115 1.00 0.00 O ATOM 554 CB ARG A 239 34.479 4.124 22.540 1.00 0.00 C ATOM 555 CG ARG A 239 34.159 3.459 21.200 1.00 0.00 C ATOM 556 CD ARG A 239 34.848 4.225 20.070 1.00 0.00 C ATOM 557 NE ARG A 239 34.602 3.570 18.791 1.00 0.00 N ATOM 558 CZ ARG A 239 35.381 3.799 17.740 1.00 0.00 C ATOM 559 NH1 ARG A 239 36.390 4.620 17.843 1.00 0.00 N ATOM 560 NH2 ARG A 239 35.138 3.202 16.606 1.00 0.00 N ATOM 0 H ARG A 239 34.770 1.816 23.340 1.00 0.00 H new ATOM 0 HA ARG A 239 36.579 3.708 22.282 1.00 0.00 H new ATOM 0 HB2 ARG A 239 33.692 3.907 23.262 1.00 0.00 H new ATOM 0 HB3 ARG A 239 34.512 5.207 22.421 1.00 0.00 H new ATOM 0 HG2 ARG A 239 34.495 2.422 21.208 1.00 0.00 H new ATOM 0 HG3 ARG A 239 33.081 3.444 21.038 1.00 0.00 H new ATOM 0 HD2 ARG A 239 34.479 5.250 20.038 1.00 0.00 H new ATOM 0 HD3 ARG A 239 35.920 4.278 20.259 1.00 0.00 H new ATOM 0 HE ARG A 239 33.818 2.924 18.702 1.00 0.00 H new ATOM 0 HH11 ARG A 239 36.580 5.086 18.730 1.00 0.00 H new ATOM 0 HH12 ARG A 239 36.989 4.796 17.036 1.00 0.00 H new ATOM 0 HH21 ARG A 239 34.350 2.559 16.527 1.00 0.00 H new ATOM 0 HH22 ARG A 239 35.736 3.378 15.799 1.00 0.00 H new ATOM 574 N GLN A 240 35.786 4.074 25.444 1.00 0.00 N ATOM 575 CA GLN A 240 36.139 4.801 26.659 1.00 0.00 C ATOM 576 C GLN A 240 37.654 4.939 26.775 1.00 0.00 C ATOM 577 O GLN A 240 38.162 5.982 27.188 1.00 0.00 O ATOM 578 CB GLN A 240 35.595 4.067 27.886 1.00 0.00 C ATOM 579 CG GLN A 240 34.069 4.015 27.816 1.00 0.00 C ATOM 580 CD GLN A 240 33.493 5.423 27.914 1.00 0.00 C ATOM 581 OE1 GLN A 240 33.822 6.167 28.838 1.00 0.00 O ATOM 582 NE2 GLN A 240 32.648 5.837 27.009 1.00 0.00 N ATOM 0 H GLN A 240 35.162 3.280 25.588 1.00 0.00 H new ATOM 0 HA GLN A 240 35.696 5.796 26.608 1.00 0.00 H new ATOM 0 HB2 GLN A 240 36.002 3.057 27.928 1.00 0.00 H new ATOM 0 HB3 GLN A 240 35.910 4.576 28.797 1.00 0.00 H new ATOM 0 HG2 GLN A 240 33.756 3.549 26.882 1.00 0.00 H new ATOM 0 HG3 GLN A 240 33.681 3.397 28.626 1.00 0.00 H new ATOM 0 HE21 GLN A 240 32.377 5.219 26.244 1.00 0.00 H new ATOM 0 HE22 GLN A 240 32.259 6.778 27.067 1.00 0.00 H new ATOM 591 N PHE A 241 38.370 3.883 26.406 1.00 0.00 N ATOM 592 CA PHE A 241 39.827 3.898 26.473 1.00 0.00 C ATOM 593 C PHE A 241 40.395 4.972 25.551 1.00 0.00 C ATOM 594 O PHE A 241 41.287 5.728 25.939 1.00 0.00 O ATOM 595 CB PHE A 241 40.383 2.531 26.069 1.00 0.00 C ATOM 596 CG PHE A 241 41.892 2.569 26.112 1.00 0.00 C ATOM 597 CD1 PHE A 241 42.558 2.512 27.343 1.00 0.00 C ATOM 598 CD2 PHE A 241 42.625 2.659 24.924 1.00 0.00 C ATOM 599 CE1 PHE A 241 43.956 2.546 27.383 1.00 0.00 C ATOM 600 CE2 PHE A 241 44.024 2.694 24.964 1.00 0.00 C ATOM 601 CZ PHE A 241 44.689 2.637 26.194 1.00 0.00 C ATOM 0 H PHE A 241 37.969 3.011 26.060 1.00 0.00 H new ATOM 0 HA PHE A 241 40.122 4.122 27.498 1.00 0.00 H new ATOM 0 HB2 PHE A 241 40.009 1.761 26.743 1.00 0.00 H new ATOM 0 HB3 PHE A 241 40.043 2.270 25.067 1.00 0.00 H new ATOM 0 HD1 PHE A 241 41.993 2.442 28.261 1.00 0.00 H new ATOM 0 HD2 PHE A 241 42.111 2.702 23.975 1.00 0.00 H new ATOM 0 HE1 PHE A 241 44.470 2.502 28.332 1.00 0.00 H new ATOM 0 HE2 PHE A 241 44.589 2.765 24.047 1.00 0.00 H new ATOM 0 HZ PHE A 241 45.768 2.663 26.226 1.00 0.00 H new ATOM 611 N HIS A 242 39.874 5.036 24.330 1.00 0.00 N ATOM 612 CA HIS A 242 40.337 6.025 23.364 1.00 0.00 C ATOM 613 C HIS A 242 39.825 7.414 23.732 1.00 0.00 C ATOM 614 O HIS A 242 40.421 8.424 23.359 1.00 0.00 O ATOM 615 CB HIS A 242 39.849 5.656 21.963 1.00 0.00 C ATOM 616 CG HIS A 242 40.513 4.381 21.522 1.00 0.00 C ATOM 617 ND1 HIS A 242 41.832 4.343 21.093 1.00 0.00 N ATOM 618 CD2 HIS A 242 40.057 3.089 21.442 1.00 0.00 C ATOM 619 CE1 HIS A 242 42.121 3.068 20.778 1.00 0.00 C ATOM 620 NE2 HIS A 242 41.074 2.261 20.972 1.00 0.00 N ATOM 0 H HIS A 242 39.137 4.420 23.988 1.00 0.00 H new ATOM 0 HA HIS A 242 41.427 6.035 23.378 1.00 0.00 H new ATOM 0 HB2 HIS A 242 38.766 5.533 21.964 1.00 0.00 H new ATOM 0 HB3 HIS A 242 40.078 6.459 21.263 1.00 0.00 H new ATOM 0 HD2 HIS A 242 39.061 2.764 21.704 1.00 0.00 H new ATOM 0 HE1 HIS A 242 43.082 2.737 20.413 1.00 0.00 H new ATOM 0 HE2 HIS A 242 41.029 1.255 20.811 1.00 0.00 H new ATOM 628 N GLN A 243 38.717 7.454 24.462 1.00 0.00 N ATOM 629 CA GLN A 243 38.131 8.725 24.874 1.00 0.00 C ATOM 630 C GLN A 243 39.061 9.453 25.840 1.00 0.00 C ATOM 631 O GLN A 243 39.180 10.677 25.797 1.00 0.00 O ATOM 632 CB GLN A 243 36.782 8.480 25.548 1.00 0.00 C ATOM 633 CG GLN A 243 36.087 9.818 25.799 1.00 0.00 C ATOM 634 CD GLN A 243 35.704 10.466 24.472 1.00 0.00 C ATOM 635 OE1 GLN A 243 35.254 9.780 23.553 1.00 0.00 O ATOM 636 NE2 GLN A 243 35.859 11.752 24.315 1.00 0.00 N ATOM 0 H GLN A 243 38.209 6.628 24.779 1.00 0.00 H new ATOM 0 HA GLN A 243 37.988 9.345 23.989 1.00 0.00 H new ATOM 0 HB2 GLN A 243 36.158 7.847 24.917 1.00 0.00 H new ATOM 0 HB3 GLN A 243 36.925 7.950 26.490 1.00 0.00 H new ATOM 0 HG2 GLN A 243 35.196 9.665 26.409 1.00 0.00 H new ATOM 0 HG3 GLN A 243 36.747 10.480 26.359 1.00 0.00 H new ATOM 0 HE21 GLN A 243 36.232 12.318 25.078 1.00 0.00 H new ATOM 0 HE22 GLN A 243 35.607 12.192 23.430 1.00 0.00 H new ATOM 645 N GLU A 244 39.713 8.691 26.710 1.00 0.00 N ATOM 646 CA GLU A 244 40.630 9.273 27.683 1.00 0.00 C ATOM 647 C GLU A 244 41.836 9.887 26.979 1.00 0.00 C ATOM 648 O GLU A 244 42.291 10.973 27.340 1.00 0.00 O ATOM 649 CB GLU A 244 41.102 8.200 28.664 1.00 0.00 C ATOM 650 CG GLU A 244 41.993 8.837 29.732 1.00 0.00 C ATOM 651 CD GLU A 244 42.389 7.795 30.772 1.00 0.00 C ATOM 652 OE1 GLU A 244 42.158 6.623 30.525 1.00 0.00 O ATOM 653 OE2 GLU A 244 42.916 8.184 31.801 1.00 0.00 O ATOM 0 H GLU A 244 39.625 7.676 26.762 1.00 0.00 H new ATOM 0 HA GLU A 244 40.103 10.056 28.229 1.00 0.00 H new ATOM 0 HB2 GLU A 244 40.244 7.718 29.132 1.00 0.00 H new ATOM 0 HB3 GLU A 244 41.653 7.424 28.132 1.00 0.00 H new ATOM 0 HG2 GLU A 244 42.886 9.258 29.269 1.00 0.00 H new ATOM 0 HG3 GLU A 244 41.465 9.661 30.213 1.00 0.00 H new ATOM 660 N ILE A 245 42.347 9.187 25.972 1.00 0.00 N ATOM 661 CA ILE A 245 43.501 9.675 25.226 1.00 0.00 C ATOM 662 C ILE A 245 43.158 10.972 24.502 1.00 0.00 C ATOM 663 O ILE A 245 43.945 11.920 24.500 1.00 0.00 O ATOM 664 CB ILE A 245 43.949 8.623 24.210 1.00 0.00 C ATOM 665 CG1 ILE A 245 44.499 7.401 24.952 1.00 0.00 C ATOM 666 CG2 ILE A 245 45.043 9.209 23.315 1.00 0.00 C ATOM 667 CD1 ILE A 245 44.688 6.248 23.965 1.00 0.00 C ATOM 0 H ILE A 245 41.984 8.288 25.656 1.00 0.00 H new ATOM 0 HA ILE A 245 44.311 9.867 25.929 1.00 0.00 H new ATOM 0 HB ILE A 245 43.099 8.326 23.596 1.00 0.00 H new ATOM 0 HG12 ILE A 245 45.449 7.647 25.426 1.00 0.00 H new ATOM 0 HG13 ILE A 245 43.813 7.105 25.746 1.00 0.00 H new ATOM 0 HG21 ILE A 245 45.362 8.459 22.591 1.00 0.00 H new ATOM 0 HG22 ILE A 245 44.654 10.080 22.787 1.00 0.00 H new ATOM 0 HG23 ILE A 245 45.894 9.506 23.928 1.00 0.00 H new ATOM 0 HD11 ILE A 245 45.079 5.378 24.492 1.00 0.00 H new ATOM 0 HD12 ILE A 245 43.729 5.996 23.512 1.00 0.00 H new ATOM 0 HD13 ILE A 245 45.390 6.547 23.187 1.00 0.00 H new ATOM 679 N GLN A 246 41.980 11.008 23.888 1.00 0.00 N ATOM 680 CA GLN A 246 41.544 12.195 23.159 1.00 0.00 C ATOM 681 C GLN A 246 41.415 13.387 24.101 1.00 0.00 C ATOM 682 O GLN A 246 41.773 14.510 23.747 1.00 0.00 O ATOM 683 CB GLN A 246 40.197 11.926 22.483 1.00 0.00 C ATOM 684 CG GLN A 246 39.804 13.132 21.629 1.00 0.00 C ATOM 685 CD GLN A 246 38.534 12.822 20.842 1.00 0.00 C ATOM 686 OE1 GLN A 246 38.167 11.658 20.687 1.00 0.00 O ATOM 687 NE2 GLN A 246 37.838 13.802 20.333 1.00 0.00 N ATOM 0 H GLN A 246 41.314 10.235 23.880 1.00 0.00 H new ATOM 0 HA GLN A 246 42.291 12.428 22.400 1.00 0.00 H new ATOM 0 HB2 GLN A 246 40.262 11.033 21.862 1.00 0.00 H new ATOM 0 HB3 GLN A 246 39.432 11.735 23.236 1.00 0.00 H new ATOM 0 HG2 GLN A 246 39.644 14.002 22.266 1.00 0.00 H new ATOM 0 HG3 GLN A 246 40.614 13.383 20.944 1.00 0.00 H new ATOM 0 HE21 GLN A 246 38.144 14.766 20.463 1.00 0.00 H new ATOM 0 HE22 GLN A 246 36.988 13.604 19.805 1.00 0.00 H new ATOM 696 N SER A 247 40.900 13.135 25.300 1.00 0.00 N ATOM 697 CA SER A 247 40.726 14.198 26.283 1.00 0.00 C ATOM 698 C SER A 247 42.078 14.732 26.741 1.00 0.00 C ATOM 699 O SER A 247 42.243 15.933 26.956 1.00 0.00 O ATOM 700 CB SER A 247 39.949 13.673 27.489 1.00 0.00 C ATOM 701 OG SER A 247 40.658 12.583 28.066 1.00 0.00 O ATOM 0 H SER A 247 40.598 12.212 25.613 1.00 0.00 H new ATOM 0 HA SER A 247 40.167 15.009 25.816 1.00 0.00 H new ATOM 0 HB2 SER A 247 39.817 14.466 28.225 1.00 0.00 H new ATOM 0 HB3 SER A 247 38.953 13.353 27.183 1.00 0.00 H new ATOM 0 HG SER A 247 41.258 12.192 27.397 1.00 0.00 H new ATOM 707 N ARG A 248 43.045 13.832 26.889 1.00 0.00 N ATOM 708 CA ARG A 248 44.380 14.225 27.325 1.00 0.00 C ATOM 709 C ARG A 248 45.096 14.999 26.223 1.00 0.00 C ATOM 710 O ARG A 248 45.988 15.804 26.495 1.00 0.00 O ATOM 711 CB ARG A 248 45.195 12.984 27.692 1.00 0.00 C ATOM 712 CG ARG A 248 44.526 12.259 28.863 1.00 0.00 C ATOM 713 CD ARG A 248 45.031 12.847 30.183 1.00 0.00 C ATOM 714 NE ARG A 248 46.462 12.600 30.329 1.00 0.00 N ATOM 715 CZ ARG A 248 46.914 11.447 30.810 1.00 0.00 C ATOM 716 NH1 ARG A 248 46.074 10.513 31.164 1.00 0.00 N ATOM 717 NH2 ARG A 248 48.198 11.248 30.932 1.00 0.00 N ATOM 0 H ARG A 248 42.931 12.833 26.715 1.00 0.00 H new ATOM 0 HA ARG A 248 44.283 14.867 28.200 1.00 0.00 H new ATOM 0 HB2 ARG A 248 45.269 12.318 26.833 1.00 0.00 H new ATOM 0 HB3 ARG A 248 46.212 13.271 27.961 1.00 0.00 H new ATOM 0 HG2 ARG A 248 43.443 12.362 28.797 1.00 0.00 H new ATOM 0 HG3 ARG A 248 44.748 11.193 28.819 1.00 0.00 H new ATOM 0 HD2 ARG A 248 44.835 13.919 30.211 1.00 0.00 H new ATOM 0 HD3 ARG A 248 44.490 12.402 31.018 1.00 0.00 H new ATOM 0 HE ARG A 248 47.126 13.325 30.057 1.00 0.00 H new ATOM 0 HH11 ARG A 248 45.070 10.668 31.071 1.00 0.00 H new ATOM 0 HH12 ARG A 248 46.421 9.628 31.533 1.00 0.00 H new ATOM 0 HH21 ARG A 248 48.856 11.978 30.658 1.00 0.00 H new ATOM 0 HH22 ARG A 248 48.544 10.362 31.301 1.00 0.00 H new