USER MOD reduce.3.24.130724 H: found=0, std=0, add=265, rem=0, adj=10 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 -29:sc= 0.744 USER MOD Single : A 218 LYS NZ :NH3+ -163:sc= -0.0139 (180deg=-0.335) USER MOD Single : A 222 LYS NZ :NH3+ 148:sc= -0.318 (180deg=-1.43!) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0808) USER MOD Single : A 228 MET CE :methyl -161:sc= -0.0509 (180deg=-0.702) USER MOD Single : A 235 LYS NZ :NH3+ -160:sc= -0.11 (180deg=-0.693) USER MOD Single : A 236 SER OG : rot -74:sc= 0.346 USER MOD Single : A 237 LYS NZ :NH3+ -130:sc= -0.165 (180deg=-1.69!) USER MOD Single : A 240 GLN : amide:sc=-0.00123 K(o=-0.0012,f=-1.6!) USER MOD Single : A 242 HIS : no HD1:sc= -6.59! C(o=-6.6!,f=-16!) USER MOD Single : A 243 GLN : amide:sc= -3.61! C(o=-3.6!,f=-3.5!) USER MOD Single : A 246 GLN : amide:sc= -0.202 K(o=-0.2,f=-1.2) USER MOD Single : A 247 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 175 N SER A 217 45.651 -16.444 32.852 1.00 0.00 N ATOM 176 CA SER A 217 45.353 -16.619 31.434 1.00 0.00 C ATOM 177 C SER A 217 46.162 -15.637 30.596 1.00 0.00 C ATOM 178 O SER A 217 45.636 -14.634 30.116 1.00 0.00 O ATOM 179 CB SER A 217 43.861 -16.400 31.185 1.00 0.00 C ATOM 180 OG SER A 217 43.507 -16.969 29.931 1.00 0.00 O ATOM 0 HA SER A 217 45.623 -17.635 31.145 1.00 0.00 H new ATOM 0 HB2 SER A 217 43.276 -16.857 31.983 1.00 0.00 H new ATOM 0 HB3 SER A 217 43.632 -15.334 31.192 1.00 0.00 H new ATOM 0 HG SER A 217 44.281 -16.943 29.330 1.00 0.00 H new ATOM 186 N LYS A 218 47.441 -15.937 30.418 1.00 0.00 N ATOM 187 CA LYS A 218 48.310 -15.078 29.629 1.00 0.00 C ATOM 188 C LYS A 218 47.851 -15.031 28.176 1.00 0.00 C ATOM 189 O LYS A 218 47.969 -14.000 27.509 1.00 0.00 O ATOM 190 CB LYS A 218 49.751 -15.593 29.695 1.00 0.00 C ATOM 191 CG LYS A 218 50.721 -14.488 29.227 1.00 0.00 C ATOM 192 CD LYS A 218 51.116 -13.611 30.420 1.00 0.00 C ATOM 193 CE LYS A 218 51.994 -12.460 29.936 1.00 0.00 C ATOM 194 NZ LYS A 218 53.276 -13.005 29.407 1.00 0.00 N ATOM 0 H LYS A 218 47.897 -16.763 30.806 1.00 0.00 H new ATOM 0 HA LYS A 218 48.262 -14.071 30.042 1.00 0.00 H new ATOM 0 HB2 LYS A 218 49.993 -15.895 30.714 1.00 0.00 H new ATOM 0 HB3 LYS A 218 49.861 -16.477 29.066 1.00 0.00 H new ATOM 0 HG2 LYS A 218 51.610 -14.935 28.781 1.00 0.00 H new ATOM 0 HG3 LYS A 218 50.250 -13.879 28.456 1.00 0.00 H new ATOM 0 HD2 LYS A 218 50.224 -13.221 30.910 1.00 0.00 H new ATOM 0 HD3 LYS A 218 51.652 -14.205 31.160 1.00 0.00 H new ATOM 0 HE2 LYS A 218 51.478 -11.896 29.159 1.00 0.00 H new ATOM 0 HE3 LYS A 218 52.190 -11.768 30.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 218 53.979 -12.241 29.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 218 53.626 -13.749 30.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 218 53.118 -13.406 28.460 1.00 0.00 H new ATOM 208 N ASP A 219 47.335 -16.152 27.690 1.00 0.00 N ATOM 209 CA ASP A 219 46.864 -16.229 26.313 1.00 0.00 C ATOM 210 C ASP A 219 45.677 -15.296 26.099 1.00 0.00 C ATOM 211 O ASP A 219 45.401 -14.875 24.977 1.00 0.00 O ATOM 212 CB ASP A 219 46.450 -17.668 25.986 1.00 0.00 C ATOM 213 CG ASP A 219 45.406 -18.152 26.987 1.00 0.00 C ATOM 214 OD1 ASP A 219 44.906 -17.329 27.735 1.00 0.00 O ATOM 215 OD2 ASP A 219 45.122 -19.337 26.992 1.00 0.00 O ATOM 0 H ASP A 219 47.232 -17.015 28.224 1.00 0.00 H new ATOM 0 HA ASP A 219 47.675 -15.922 25.652 1.00 0.00 H new ATOM 0 HB2 ASP A 219 46.046 -17.718 24.975 1.00 0.00 H new ATOM 0 HB3 ASP A 219 47.322 -18.321 26.014 1.00 0.00 H new ATOM 220 N GLU A 220 44.978 -14.978 27.185 1.00 0.00 N ATOM 221 CA GLU A 220 43.821 -14.095 27.101 1.00 0.00 C ATOM 222 C GLU A 220 44.241 -12.709 26.620 1.00 0.00 C ATOM 223 O GLU A 220 43.538 -12.075 25.834 1.00 0.00 O ATOM 224 CB GLU A 220 43.153 -13.979 28.472 1.00 0.00 C ATOM 225 CG GLU A 220 41.868 -13.155 28.349 1.00 0.00 C ATOM 226 CD GLU A 220 41.159 -13.091 29.697 1.00 0.00 C ATOM 227 OE1 GLU A 220 41.508 -13.874 30.567 1.00 0.00 O ATOM 228 OE2 GLU A 220 40.276 -12.263 29.840 1.00 0.00 O ATOM 0 H GLU A 220 45.190 -15.315 28.124 1.00 0.00 H new ATOM 0 HA GLU A 220 43.114 -14.518 26.387 1.00 0.00 H new ATOM 0 HB2 GLU A 220 42.925 -14.971 28.862 1.00 0.00 H new ATOM 0 HB3 GLU A 220 43.833 -13.507 29.181 1.00 0.00 H new ATOM 0 HG2 GLU A 220 42.103 -12.148 28.004 1.00 0.00 H new ATOM 0 HG3 GLU A 220 41.210 -13.601 27.603 1.00 0.00 H new ATOM 235 N ILE A 221 45.392 -12.246 27.094 1.00 0.00 N ATOM 236 CA ILE A 221 45.896 -10.935 26.703 1.00 0.00 C ATOM 237 C ILE A 221 46.193 -10.898 25.213 1.00 0.00 C ATOM 238 O ILE A 221 45.857 -9.931 24.530 1.00 0.00 O ATOM 239 CB ILE A 221 47.170 -10.609 27.492 1.00 0.00 C ATOM 240 CG1 ILE A 221 46.906 -10.793 28.991 1.00 0.00 C ATOM 241 CG2 ILE A 221 47.584 -9.160 27.227 1.00 0.00 C ATOM 242 CD1 ILE A 221 45.687 -9.959 29.420 1.00 0.00 C ATOM 0 H ILE A 221 45.990 -12.755 27.745 1.00 0.00 H new ATOM 0 HA ILE A 221 45.131 -10.191 26.925 1.00 0.00 H new ATOM 0 HB ILE A 221 47.969 -11.279 27.176 1.00 0.00 H new ATOM 0 HG12 ILE A 221 46.731 -11.846 29.211 1.00 0.00 H new ATOM 0 HG13 ILE A 221 47.783 -10.490 29.562 1.00 0.00 H new ATOM 0 HG21 ILE A 221 48.490 -8.932 27.789 1.00 0.00 H new ATOM 0 HG22 ILE A 221 47.774 -9.025 26.162 1.00 0.00 H new ATOM 0 HG23 ILE A 221 46.784 -8.490 27.541 1.00 0.00 H new ATOM 0 HD11 ILE A 221 45.509 -10.097 30.486 1.00 0.00 H new ATOM 0 HD12 ILE A 221 45.878 -8.905 29.218 1.00 0.00 H new ATOM 0 HD13 ILE A 221 44.809 -10.283 28.860 1.00 0.00 H new ATOM 254 N LYS A 222 46.826 -11.949 24.715 1.00 0.00 N ATOM 255 CA LYS A 222 47.161 -12.024 23.299 1.00 0.00 C ATOM 256 C LYS A 222 45.898 -12.054 22.446 1.00 0.00 C ATOM 257 O LYS A 222 45.834 -11.422 21.394 1.00 0.00 O ATOM 258 CB LYS A 222 47.986 -13.277 23.027 1.00 0.00 C ATOM 259 CG LYS A 222 49.362 -13.134 23.684 1.00 0.00 C ATOM 260 CD LYS A 222 50.162 -14.437 23.504 1.00 0.00 C ATOM 261 CE LYS A 222 50.821 -14.452 22.122 1.00 0.00 C ATOM 262 NZ LYS A 222 51.713 -13.265 21.986 1.00 0.00 N ATOM 0 H LYS A 222 47.117 -12.757 25.265 1.00 0.00 H new ATOM 0 HA LYS A 222 47.741 -11.139 23.037 1.00 0.00 H new ATOM 0 HB2 LYS A 222 47.473 -14.155 23.419 1.00 0.00 H new ATOM 0 HB3 LYS A 222 48.098 -13.426 21.953 1.00 0.00 H new ATOM 0 HG2 LYS A 222 49.903 -12.299 23.238 1.00 0.00 H new ATOM 0 HG3 LYS A 222 49.248 -12.910 24.745 1.00 0.00 H new ATOM 0 HD2 LYS A 222 50.922 -14.518 24.281 1.00 0.00 H new ATOM 0 HD3 LYS A 222 49.502 -15.298 23.612 1.00 0.00 H new ATOM 0 HE2 LYS A 222 51.395 -15.369 21.991 1.00 0.00 H new ATOM 0 HE3 LYS A 222 50.059 -14.439 21.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 222 52.521 -13.506 21.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 222 51.182 -12.478 21.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 222 52.059 -12.981 22.925 1.00 0.00 H new ATOM 276 N ARG A 223 44.900 -12.802 22.904 1.00 0.00 N ATOM 277 CA ARG A 223 43.644 -12.915 22.173 1.00 0.00 C ATOM 278 C ARG A 223 42.914 -11.577 22.149 1.00 0.00 C ATOM 279 O ARG A 223 42.060 -11.339 21.296 1.00 0.00 O ATOM 280 CB ARG A 223 42.753 -13.971 22.832 1.00 0.00 C ATOM 281 CG ARG A 223 41.481 -14.155 22.003 1.00 0.00 C ATOM 282 CD ARG A 223 40.647 -15.296 22.586 1.00 0.00 C ATOM 283 NE ARG A 223 40.191 -14.949 23.930 1.00 0.00 N ATOM 284 CZ ARG A 223 39.081 -14.245 24.120 1.00 0.00 C ATOM 285 NH1 ARG A 223 38.375 -13.849 23.093 1.00 0.00 N ATOM 286 NH2 ARG A 223 38.694 -13.948 25.329 1.00 0.00 N ATOM 0 H ARG A 223 44.936 -13.336 23.772 1.00 0.00 H new ATOM 0 HA ARG A 223 43.867 -13.212 21.148 1.00 0.00 H new ATOM 0 HB2 ARG A 223 43.289 -14.917 22.910 1.00 0.00 H new ATOM 0 HB3 ARG A 223 42.498 -13.665 23.846 1.00 0.00 H new ATOM 0 HG2 ARG A 223 40.901 -13.232 22.000 1.00 0.00 H new ATOM 0 HG3 ARG A 223 41.739 -14.373 20.967 1.00 0.00 H new ATOM 0 HD2 ARG A 223 39.790 -15.496 21.943 1.00 0.00 H new ATOM 0 HD3 ARG A 223 41.240 -16.210 22.619 1.00 0.00 H new ATOM 0 HE ARG A 223 40.735 -15.253 24.737 1.00 0.00 H new ATOM 0 HH11 ARG A 223 38.677 -14.081 22.147 1.00 0.00 H new ATOM 0 HH12 ARG A 223 37.522 -13.308 23.238 1.00 0.00 H new ATOM 0 HH21 ARG A 223 39.244 -14.256 26.131 1.00 0.00 H new ATOM 0 HH22 ARG A 223 37.841 -13.407 25.473 1.00 0.00 H new ATOM 300 N GLU A 224 43.256 -10.706 23.091 1.00 0.00 N ATOM 301 CA GLU A 224 42.620 -9.396 23.170 1.00 0.00 C ATOM 302 C GLU A 224 42.866 -8.605 21.889 1.00 0.00 C ATOM 303 O GLU A 224 41.961 -7.949 21.372 1.00 0.00 O ATOM 304 CB GLU A 224 43.175 -8.619 24.366 1.00 0.00 C ATOM 305 CG GLU A 224 42.332 -7.365 24.602 1.00 0.00 C ATOM 306 CD GLU A 224 40.958 -7.757 25.136 1.00 0.00 C ATOM 307 OE1 GLU A 224 40.771 -8.924 25.438 1.00 0.00 O ATOM 308 OE2 GLU A 224 40.112 -6.885 25.234 1.00 0.00 O ATOM 0 H GLU A 224 43.963 -10.880 23.805 1.00 0.00 H new ATOM 0 HA GLU A 224 41.547 -9.539 23.296 1.00 0.00 H new ATOM 0 HB2 GLU A 224 43.166 -9.248 25.256 1.00 0.00 H new ATOM 0 HB3 GLU A 224 44.213 -8.342 24.182 1.00 0.00 H new ATOM 0 HG2 GLU A 224 42.834 -6.707 25.312 1.00 0.00 H new ATOM 0 HG3 GLU A 224 42.225 -6.808 23.671 1.00 0.00 H new ATOM 315 N TYR A 225 44.090 -8.672 21.378 1.00 0.00 N ATOM 316 CA TYR A 225 44.436 -7.959 20.153 1.00 0.00 C ATOM 317 C TYR A 225 43.617 -8.483 18.979 1.00 0.00 C ATOM 318 O TYR A 225 43.133 -7.708 18.160 1.00 0.00 O ATOM 319 CB TYR A 225 45.928 -8.116 19.856 1.00 0.00 C ATOM 320 CG TYR A 225 46.732 -7.363 20.890 1.00 0.00 C ATOM 321 CD1 TYR A 225 46.938 -5.985 20.751 1.00 0.00 C ATOM 322 CD2 TYR A 225 47.262 -8.042 21.994 1.00 0.00 C ATOM 323 CE1 TYR A 225 47.685 -5.289 21.709 1.00 0.00 C ATOM 324 CE2 TYR A 225 48.009 -7.345 22.951 1.00 0.00 C ATOM 325 CZ TYR A 225 48.216 -5.967 22.812 1.00 0.00 C ATOM 326 OH TYR A 225 48.950 -5.281 23.756 1.00 0.00 O ATOM 0 H TYR A 225 44.854 -9.208 21.789 1.00 0.00 H new ATOM 0 HA TYR A 225 44.209 -6.902 20.294 1.00 0.00 H new ATOM 0 HB2 TYR A 225 46.202 -9.171 19.865 1.00 0.00 H new ATOM 0 HB3 TYR A 225 46.153 -7.737 18.859 1.00 0.00 H new ATOM 0 HD1 TYR A 225 46.521 -5.459 19.905 1.00 0.00 H new ATOM 0 HD2 TYR A 225 47.095 -9.103 22.107 1.00 0.00 H new ATOM 0 HE1 TYR A 225 47.852 -4.228 21.597 1.00 0.00 H new ATOM 0 HE2 TYR A 225 48.426 -7.871 23.797 1.00 0.00 H new ATOM 0 HH TYR A 225 49.244 -5.901 24.456 1.00 0.00 H new ATOM 336 N LYS A 226 43.475 -9.800 18.902 1.00 0.00 N ATOM 337 CA LYS A 226 42.713 -10.413 17.818 1.00 0.00 C ATOM 338 C LYS A 226 41.246 -10.012 17.898 1.00 0.00 C ATOM 339 O LYS A 226 40.602 -9.781 16.874 1.00 0.00 O ATOM 340 CB LYS A 226 42.841 -11.943 17.890 1.00 0.00 C ATOM 341 CG LYS A 226 44.199 -12.378 17.331 1.00 0.00 C ATOM 342 CD LYS A 226 45.319 -11.846 18.227 1.00 0.00 C ATOM 343 CE LYS A 226 46.624 -12.561 17.894 1.00 0.00 C ATOM 344 NZ LYS A 226 47.048 -12.200 16.510 1.00 0.00 N ATOM 0 H LYS A 226 43.873 -10.460 19.570 1.00 0.00 H new ATOM 0 HA LYS A 226 43.117 -10.061 16.869 1.00 0.00 H new ATOM 0 HB2 LYS A 226 42.739 -12.277 18.922 1.00 0.00 H new ATOM 0 HB3 LYS A 226 42.037 -12.411 17.322 1.00 0.00 H new ATOM 0 HG2 LYS A 226 44.249 -13.465 17.276 1.00 0.00 H new ATOM 0 HG3 LYS A 226 44.323 -12.002 16.315 1.00 0.00 H new ATOM 0 HD2 LYS A 226 45.434 -10.772 18.083 1.00 0.00 H new ATOM 0 HD3 LYS A 226 45.065 -12.002 19.275 1.00 0.00 H new ATOM 0 HE2 LYS A 226 47.398 -12.280 18.608 1.00 0.00 H new ATOM 0 HE3 LYS A 226 46.491 -13.640 17.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 226 48.020 -12.531 16.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 226 46.410 -12.649 15.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 226 47.010 -11.167 16.394 1.00 0.00 H new ATOM 358 N GLU A 227 40.718 -9.949 19.115 1.00 0.00 N ATOM 359 CA GLU A 227 39.320 -9.588 19.313 1.00 0.00 C ATOM 360 C GLU A 227 38.998 -8.280 18.596 1.00 0.00 C ATOM 361 O GLU A 227 37.834 -7.959 18.358 1.00 0.00 O ATOM 362 CB GLU A 227 39.028 -9.438 20.807 1.00 0.00 C ATOM 363 CG GLU A 227 37.527 -9.232 21.015 1.00 0.00 C ATOM 364 CD GLU A 227 37.203 -9.217 22.503 1.00 0.00 C ATOM 365 OE1 GLU A 227 37.565 -10.167 23.177 1.00 0.00 O ATOM 366 OE2 GLU A 227 36.598 -8.254 22.948 1.00 0.00 O ATOM 0 H GLU A 227 41.233 -10.142 19.974 1.00 0.00 H new ATOM 0 HA GLU A 227 38.696 -10.380 18.898 1.00 0.00 H new ATOM 0 HB2 GLU A 227 39.362 -10.325 21.345 1.00 0.00 H new ATOM 0 HB3 GLU A 227 39.582 -8.592 21.214 1.00 0.00 H new ATOM 0 HG2 GLU A 227 37.214 -8.294 20.557 1.00 0.00 H new ATOM 0 HG3 GLU A 227 36.971 -10.029 20.522 1.00 0.00 H new ATOM 373 N MET A 228 40.034 -7.529 18.249 1.00 0.00 N ATOM 374 CA MET A 228 39.844 -6.258 17.560 1.00 0.00 C ATOM 375 C MET A 228 39.125 -6.471 16.230 1.00 0.00 C ATOM 376 O MET A 228 38.250 -5.691 15.853 1.00 0.00 O ATOM 377 CB MET A 228 41.205 -5.591 17.319 1.00 0.00 C ATOM 378 CG MET A 228 41.925 -6.290 16.161 1.00 0.00 C ATOM 379 SD MET A 228 43.676 -5.831 16.171 1.00 0.00 S ATOM 380 CE MET A 228 43.448 -4.078 15.788 1.00 0.00 C ATOM 0 H MET A 228 41.007 -7.774 18.431 1.00 0.00 H new ATOM 0 HA MET A 228 39.230 -5.610 18.185 1.00 0.00 H new ATOM 0 HB2 MET A 228 41.067 -4.534 17.089 1.00 0.00 H new ATOM 0 HB3 MET A 228 41.812 -5.644 18.223 1.00 0.00 H new ATOM 0 HG2 MET A 228 41.821 -7.371 16.254 1.00 0.00 H new ATOM 0 HG3 MET A 228 41.470 -6.007 15.212 1.00 0.00 H new ATOM 0 HE1 MET A 228 44.384 -3.662 15.415 1.00 0.00 H new ATOM 0 HE2 MET A 228 42.674 -3.969 15.028 1.00 0.00 H new ATOM 0 HE3 MET A 228 43.148 -3.545 16.690 1.00 0.00 H new ATOM 390 N GLU A 229 39.513 -7.523 15.521 1.00 0.00 N ATOM 391 CA GLU A 229 38.905 -7.827 14.233 1.00 0.00 C ATOM 392 C GLU A 229 37.461 -8.269 14.419 1.00 0.00 C ATOM 393 O GLU A 229 36.588 -7.923 13.623 1.00 0.00 O ATOM 394 CB GLU A 229 39.697 -8.932 13.527 1.00 0.00 C ATOM 395 CG GLU A 229 41.094 -8.420 13.169 1.00 0.00 C ATOM 396 CD GLU A 229 40.992 -7.317 12.120 1.00 0.00 C ATOM 397 OE1 GLU A 229 39.983 -7.269 11.438 1.00 0.00 O ATOM 398 OE2 GLU A 229 41.924 -6.535 12.018 1.00 0.00 O ATOM 0 H GLU A 229 40.240 -8.176 15.813 1.00 0.00 H new ATOM 0 HA GLU A 229 38.921 -6.926 13.620 1.00 0.00 H new ATOM 0 HB2 GLU A 229 39.775 -9.806 14.173 1.00 0.00 H new ATOM 0 HB3 GLU A 229 39.173 -9.248 12.625 1.00 0.00 H new ATOM 0 HG2 GLU A 229 41.591 -8.040 14.062 1.00 0.00 H new ATOM 0 HG3 GLU A 229 41.704 -9.239 12.789 1.00 0.00 H new ATOM 405 N GLY A 230 37.213 -9.035 15.477 1.00 0.00 N ATOM 406 CA GLY A 230 35.868 -9.519 15.759 1.00 0.00 C ATOM 407 C GLY A 230 34.914 -8.357 16.009 1.00 0.00 C ATOM 408 O GLY A 230 33.770 -8.373 15.556 1.00 0.00 O ATOM 0 H GLY A 230 37.921 -9.332 16.148 1.00 0.00 H new ATOM 0 HA2 GLY A 230 35.509 -10.116 14.921 1.00 0.00 H new ATOM 0 HA3 GLY A 230 35.888 -10.173 16.631 1.00 0.00 H new ATOM 437 N GLU A 233 30.541 -6.865 21.185 1.00 0.00 N ATOM 438 CA GLU A 233 29.749 -5.843 21.855 1.00 0.00 C ATOM 439 C GLU A 233 30.629 -5.000 22.772 1.00 0.00 C ATOM 440 O GLU A 233 30.379 -3.810 22.968 1.00 0.00 O ATOM 441 CB GLU A 233 28.634 -6.494 22.674 1.00 0.00 C ATOM 442 CG GLU A 233 27.625 -7.149 21.729 1.00 0.00 C ATOM 443 CD GLU A 233 26.553 -7.877 22.534 1.00 0.00 C ATOM 444 OE1 GLU A 233 26.607 -7.810 23.752 1.00 0.00 O ATOM 445 OE2 GLU A 233 25.695 -8.491 21.922 1.00 0.00 O ATOM 0 HA GLU A 233 29.309 -5.197 21.095 1.00 0.00 H new ATOM 0 HB2 GLU A 233 29.052 -7.239 23.350 1.00 0.00 H new ATOM 0 HB3 GLU A 233 28.137 -5.746 23.292 1.00 0.00 H new ATOM 0 HG2 GLU A 233 27.164 -6.392 21.095 1.00 0.00 H new ATOM 0 HG3 GLU A 233 28.135 -7.851 21.069 1.00 0.00 H new ATOM 452 N ILE A 234 31.658 -5.623 23.335 1.00 0.00 N ATOM 453 CA ILE A 234 32.566 -4.921 24.232 1.00 0.00 C ATOM 454 C ILE A 234 33.189 -3.717 23.528 1.00 0.00 C ATOM 455 O ILE A 234 33.936 -2.948 24.134 1.00 0.00 O ATOM 456 CB ILE A 234 33.674 -5.870 24.703 1.00 0.00 C ATOM 457 CG1 ILE A 234 33.057 -7.001 25.530 1.00 0.00 C ATOM 458 CG2 ILE A 234 34.682 -5.094 25.569 1.00 0.00 C ATOM 459 CD1 ILE A 234 34.102 -8.097 25.751 1.00 0.00 C ATOM 0 H ILE A 234 31.883 -6.607 23.187 1.00 0.00 H new ATOM 0 HA ILE A 234 31.998 -4.571 25.094 1.00 0.00 H new ATOM 0 HB ILE A 234 34.186 -6.289 23.837 1.00 0.00 H new ATOM 0 HG12 ILE A 234 32.708 -6.617 26.489 1.00 0.00 H new ATOM 0 HG13 ILE A 234 32.188 -7.410 25.015 1.00 0.00 H new ATOM 0 HG21 ILE A 234 35.470 -5.769 25.904 1.00 0.00 H new ATOM 0 HG22 ILE A 234 35.121 -4.287 24.982 1.00 0.00 H new ATOM 0 HG23 ILE A 234 34.171 -4.675 26.436 1.00 0.00 H new ATOM 0 HD11 ILE A 234 33.665 -8.903 26.340 1.00 0.00 H new ATOM 0 HD12 ILE A 234 34.429 -8.487 24.787 1.00 0.00 H new ATOM 0 HD13 ILE A 234 34.958 -7.682 26.284 1.00 0.00 H new ATOM 471 N LYS A 235 32.873 -3.555 22.252 1.00 0.00 N ATOM 472 CA LYS A 235 33.409 -2.441 21.481 1.00 0.00 C ATOM 473 C LYS A 235 32.866 -1.117 22.008 1.00 0.00 C ATOM 474 O LYS A 235 33.541 -0.089 21.943 1.00 0.00 O ATOM 475 CB LYS A 235 33.031 -2.601 20.004 1.00 0.00 C ATOM 476 CG LYS A 235 31.511 -2.500 19.846 1.00 0.00 C ATOM 477 CD LYS A 235 31.128 -2.799 18.397 1.00 0.00 C ATOM 478 CE LYS A 235 29.618 -2.621 18.223 1.00 0.00 C ATOM 479 NZ LYS A 235 28.901 -3.664 19.009 1.00 0.00 N ATOM 0 H LYS A 235 32.253 -4.175 21.731 1.00 0.00 H new ATOM 0 HA LYS A 235 34.494 -2.440 21.580 1.00 0.00 H new ATOM 0 HB2 LYS A 235 33.520 -1.831 19.408 1.00 0.00 H new ATOM 0 HB3 LYS A 235 33.382 -3.563 19.631 1.00 0.00 H new ATOM 0 HG2 LYS A 235 31.018 -3.204 20.516 1.00 0.00 H new ATOM 0 HG3 LYS A 235 31.171 -1.503 20.125 1.00 0.00 H new ATOM 0 HD2 LYS A 235 31.664 -2.131 17.722 1.00 0.00 H new ATOM 0 HD3 LYS A 235 31.418 -3.817 18.135 1.00 0.00 H new ATOM 0 HE2 LYS A 235 29.317 -1.628 18.557 1.00 0.00 H new ATOM 0 HE3 LYS A 235 29.351 -2.697 17.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 235 27.933 -3.770 18.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 235 29.404 -4.570 18.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 235 28.864 -3.381 20.009 1.00 0.00 H new ATOM 493 N SER A 236 31.641 -1.149 22.523 1.00 0.00 N ATOM 494 CA SER A 236 31.012 0.056 23.051 1.00 0.00 C ATOM 495 C SER A 236 31.763 0.549 24.282 1.00 0.00 C ATOM 496 O SER A 236 31.864 1.745 24.519 1.00 0.00 O ATOM 497 CB SER A 236 29.558 -0.231 23.420 1.00 0.00 C ATOM 498 OG SER A 236 29.514 -1.267 24.392 1.00 0.00 O ATOM 0 H SER A 236 31.068 -1.990 22.586 1.00 0.00 H new ATOM 0 HA SER A 236 31.043 0.828 22.283 1.00 0.00 H new ATOM 0 HB2 SER A 236 29.086 0.670 23.811 1.00 0.00 H new ATOM 0 HB3 SER A 236 28.997 -0.525 22.533 1.00 0.00 H new ATOM 0 HG SER A 236 29.707 -2.127 23.963 1.00 0.00 H new ATOM 504 N LYS A 237 32.287 -0.384 25.065 1.00 0.00 N ATOM 505 CA LYS A 237 33.028 -0.033 26.271 1.00 0.00 C ATOM 506 C LYS A 237 34.314 0.707 25.911 1.00 0.00 C ATOM 507 O LYS A 237 34.793 1.545 26.674 1.00 0.00 O ATOM 508 CB LYS A 237 33.363 -1.297 27.066 1.00 0.00 C ATOM 509 CG LYS A 237 33.963 -0.906 28.420 1.00 0.00 C ATOM 510 CD LYS A 237 34.187 -2.164 29.263 1.00 0.00 C ATOM 511 CE LYS A 237 34.756 -1.771 30.627 1.00 0.00 C ATOM 512 NZ LYS A 237 36.132 -1.226 30.452 1.00 0.00 N ATOM 0 H LYS A 237 32.214 -1.386 24.889 1.00 0.00 H new ATOM 0 HA LYS A 237 32.406 0.621 26.882 1.00 0.00 H new ATOM 0 HB2 LYS A 237 32.464 -1.895 27.214 1.00 0.00 H new ATOM 0 HB3 LYS A 237 34.068 -1.914 26.509 1.00 0.00 H new ATOM 0 HG2 LYS A 237 34.907 -0.381 28.273 1.00 0.00 H new ATOM 0 HG3 LYS A 237 33.295 -0.221 28.941 1.00 0.00 H new ATOM 0 HD2 LYS A 237 33.247 -2.701 29.391 1.00 0.00 H new ATOM 0 HD3 LYS A 237 34.873 -2.839 28.752 1.00 0.00 H new ATOM 0 HE2 LYS A 237 34.116 -1.026 31.099 1.00 0.00 H new ATOM 0 HE3 LYS A 237 34.778 -2.638 31.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 237 36.780 -1.699 31.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 237 36.450 -1.394 29.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 237 36.127 -0.204 30.644 1.00 0.00 H new ATOM 526 N ARG A 238 34.879 0.373 24.755 1.00 0.00 N ATOM 527 CA ARG A 238 36.119 1.000 24.311 1.00 0.00 C ATOM 528 C ARG A 238 35.905 2.488 24.052 1.00 0.00 C ATOM 529 O ARG A 238 36.852 3.274 24.065 1.00 0.00 O ATOM 530 CB ARG A 238 36.619 0.323 23.034 1.00 0.00 C ATOM 531 CG ARG A 238 37.975 0.912 22.635 1.00 0.00 C ATOM 532 CD ARG A 238 38.504 0.187 21.398 1.00 0.00 C ATOM 533 NE ARG A 238 39.850 0.654 21.077 1.00 0.00 N ATOM 534 CZ ARG A 238 40.921 0.125 21.661 1.00 0.00 C ATOM 535 NH1 ARG A 238 40.777 -0.824 22.546 1.00 0.00 N ATOM 536 NH2 ARG A 238 42.113 0.552 21.351 1.00 0.00 N ATOM 0 H ARG A 238 34.501 -0.323 24.113 1.00 0.00 H new ATOM 0 HA ARG A 238 36.864 0.884 25.098 1.00 0.00 H new ATOM 0 HB2 ARG A 238 36.711 -0.752 23.192 1.00 0.00 H new ATOM 0 HB3 ARG A 238 35.898 0.466 22.229 1.00 0.00 H new ATOM 0 HG2 ARG A 238 37.874 1.978 22.429 1.00 0.00 H new ATOM 0 HG3 ARG A 238 38.683 0.812 23.458 1.00 0.00 H new ATOM 0 HD2 ARG A 238 38.517 -0.888 21.576 1.00 0.00 H new ATOM 0 HD3 ARG A 238 37.839 0.362 20.552 1.00 0.00 H new ATOM 0 HE ARG A 238 39.971 1.400 20.392 1.00 0.00 H new ATOM 0 HH11 ARG A 238 39.844 -1.158 22.788 1.00 0.00 H new ATOM 0 HH12 ARG A 238 41.597 -1.231 22.995 1.00 0.00 H new ATOM 0 HH21 ARG A 238 42.225 1.293 20.659 1.00 0.00 H new ATOM 0 HH22 ARG A 238 42.933 0.145 21.800 1.00 0.00 H new ATOM 550 N ARG A 239 34.655 2.865 23.813 1.00 0.00 N ATOM 551 CA ARG A 239 34.327 4.260 23.545 1.00 0.00 C ATOM 552 C ARG A 239 34.669 5.131 24.748 1.00 0.00 C ATOM 553 O ARG A 239 35.092 6.270 24.595 1.00 0.00 O ATOM 554 CB ARG A 239 32.839 4.397 23.222 1.00 0.00 C ATOM 555 CG ARG A 239 32.536 3.686 21.897 1.00 0.00 C ATOM 556 CD ARG A 239 31.033 3.730 21.625 1.00 0.00 C ATOM 557 NE ARG A 239 30.595 5.109 21.443 1.00 0.00 N ATOM 558 CZ ARG A 239 29.305 5.413 21.341 1.00 0.00 C ATOM 559 NH1 ARG A 239 28.407 4.467 21.400 1.00 0.00 N ATOM 560 NH2 ARG A 239 28.936 6.654 21.183 1.00 0.00 N ATOM 0 H ARG A 239 33.857 2.230 23.799 1.00 0.00 H new ATOM 0 HA ARG A 239 34.915 4.592 22.690 1.00 0.00 H new ATOM 0 HB2 ARG A 239 32.241 3.965 24.024 1.00 0.00 H new ATOM 0 HB3 ARG A 239 32.566 5.450 23.153 1.00 0.00 H new ATOM 0 HG2 ARG A 239 33.078 4.167 21.082 1.00 0.00 H new ATOM 0 HG3 ARG A 239 32.878 2.652 21.941 1.00 0.00 H new ATOM 0 HD2 ARG A 239 30.800 3.146 20.735 1.00 0.00 H new ATOM 0 HD3 ARG A 239 30.492 3.275 22.455 1.00 0.00 H new ATOM 0 HE ARG A 239 31.291 5.853 21.393 1.00 0.00 H new ATOM 0 HH11 ARG A 239 28.696 3.497 21.524 1.00 0.00 H new ATOM 0 HH12 ARG A 239 27.417 4.698 21.322 1.00 0.00 H new ATOM 0 HH21 ARG A 239 29.638 7.393 21.138 1.00 0.00 H new ATOM 0 HH22 ARG A 239 27.946 6.886 21.105 1.00 0.00 H new ATOM 574 N GLN A 240 34.476 4.589 25.943 1.00 0.00 N ATOM 575 CA GLN A 240 34.766 5.331 27.168 1.00 0.00 C ATOM 576 C GLN A 240 36.251 5.668 27.258 1.00 0.00 C ATOM 577 O GLN A 240 36.625 6.738 27.735 1.00 0.00 O ATOM 578 CB GLN A 240 34.354 4.507 28.388 1.00 0.00 C ATOM 579 CG GLN A 240 34.618 5.315 29.662 1.00 0.00 C ATOM 580 CD GLN A 240 34.049 4.581 30.871 1.00 0.00 C ATOM 581 OE1 GLN A 240 33.210 3.693 30.722 1.00 0.00 O ATOM 582 NE2 GLN A 240 34.459 4.900 32.067 1.00 0.00 N ATOM 0 H GLN A 240 34.122 3.644 26.093 1.00 0.00 H new ATOM 0 HA GLN A 240 34.197 6.260 27.147 1.00 0.00 H new ATOM 0 HB2 GLN A 240 33.298 4.244 28.323 1.00 0.00 H new ATOM 0 HB3 GLN A 240 34.914 3.572 28.415 1.00 0.00 H new ATOM 0 HG2 GLN A 240 35.690 5.468 29.790 1.00 0.00 H new ATOM 0 HG3 GLN A 240 34.163 6.302 29.578 1.00 0.00 H new ATOM 0 HE21 GLN A 240 35.154 5.636 32.188 1.00 0.00 H new ATOM 0 HE22 GLN A 240 34.084 4.413 32.881 1.00 0.00 H new ATOM 591 N PHE A 241 37.092 4.748 26.800 1.00 0.00 N ATOM 592 CA PHE A 241 38.536 4.960 26.835 1.00 0.00 C ATOM 593 C PHE A 241 38.939 6.092 25.898 1.00 0.00 C ATOM 594 O PHE A 241 40.009 6.678 26.047 1.00 0.00 O ATOM 595 CB PHE A 241 39.266 3.675 26.433 1.00 0.00 C ATOM 596 CG PHE A 241 39.180 2.671 27.560 1.00 0.00 C ATOM 597 CD1 PHE A 241 38.017 1.912 27.736 1.00 0.00 C ATOM 598 CD2 PHE A 241 40.268 2.494 28.424 1.00 0.00 C ATOM 599 CE1 PHE A 241 37.939 0.984 28.778 1.00 0.00 C ATOM 600 CE2 PHE A 241 40.189 1.567 29.468 1.00 0.00 C ATOM 601 CZ PHE A 241 39.027 0.806 29.643 1.00 0.00 C ATOM 0 H PHE A 241 36.803 3.854 26.403 1.00 0.00 H new ATOM 0 HA PHE A 241 38.816 5.232 27.853 1.00 0.00 H new ATOM 0 HB2 PHE A 241 38.822 3.260 25.528 1.00 0.00 H new ATOM 0 HB3 PHE A 241 40.309 3.893 26.205 1.00 0.00 H new ATOM 0 HD1 PHE A 241 37.180 2.044 27.066 1.00 0.00 H new ATOM 0 HD2 PHE A 241 41.168 3.074 28.284 1.00 0.00 H new ATOM 0 HE1 PHE A 241 37.039 0.403 28.917 1.00 0.00 H new ATOM 0 HE2 PHE A 241 41.025 1.438 30.140 1.00 0.00 H new ATOM 0 HZ PHE A 241 38.969 0.083 30.443 1.00 0.00 H new ATOM 611 N HIS A 242 38.078 6.390 24.930 1.00 0.00 N ATOM 612 CA HIS A 242 38.362 7.452 23.973 1.00 0.00 C ATOM 613 C HIS A 242 38.961 8.664 24.679 1.00 0.00 C ATOM 614 O HIS A 242 39.680 9.460 24.077 1.00 0.00 O ATOM 615 CB HIS A 242 37.073 7.860 23.253 1.00 0.00 C ATOM 616 CG HIS A 242 36.176 8.600 24.210 1.00 0.00 C ATOM 617 ND1 HIS A 242 36.087 8.254 25.551 1.00 0.00 N ATOM 618 CD2 HIS A 242 35.335 9.666 24.041 1.00 0.00 C ATOM 619 CE1 HIS A 242 35.218 9.101 26.130 1.00 0.00 C ATOM 620 NE2 HIS A 242 34.730 9.982 25.255 1.00 0.00 N ATOM 0 H HIS A 242 37.186 5.916 24.788 1.00 0.00 H new ATOM 0 HA HIS A 242 39.083 7.080 23.245 1.00 0.00 H new ATOM 0 HB2 HIS A 242 37.307 8.491 22.395 1.00 0.00 H new ATOM 0 HB3 HIS A 242 36.563 6.976 22.869 1.00 0.00 H new ATOM 0 HD2 HIS A 242 35.166 10.184 23.108 1.00 0.00 H new ATOM 0 HE1 HIS A 242 34.948 9.072 27.175 1.00 0.00 H new ATOM 0 HE2 HIS A 242 34.058 10.727 25.436 1.00 0.00 H new ATOM 628 N GLN A 243 38.641 8.801 25.961 1.00 0.00 N ATOM 629 CA GLN A 243 39.146 9.915 26.750 1.00 0.00 C ATOM 630 C GLN A 243 40.654 9.802 26.915 1.00 0.00 C ATOM 631 O GLN A 243 41.371 10.797 26.836 1.00 0.00 O ATOM 632 CB GLN A 243 38.472 9.928 28.131 1.00 0.00 C ATOM 633 CG GLN A 243 38.542 11.338 28.727 1.00 0.00 C ATOM 634 CD GLN A 243 39.996 11.768 28.884 1.00 0.00 C ATOM 635 OE1 GLN A 243 40.776 11.088 29.551 1.00 0.00 O ATOM 636 NE2 GLN A 243 40.413 12.857 28.299 1.00 0.00 N ATOM 0 H GLN A 243 38.037 8.157 26.473 1.00 0.00 H new ATOM 0 HA GLN A 243 38.916 10.845 26.230 1.00 0.00 H new ATOM 0 HB2 GLN A 243 37.433 9.612 28.042 1.00 0.00 H new ATOM 0 HB3 GLN A 243 38.966 9.218 28.794 1.00 0.00 H new ATOM 0 HG2 GLN A 243 38.014 12.041 28.082 1.00 0.00 H new ATOM 0 HG3 GLN A 243 38.042 11.357 29.695 1.00 0.00 H new ATOM 0 HE21 GLN A 243 39.765 13.419 27.747 1.00 0.00 H new ATOM 0 HE22 GLN A 243 41.387 13.146 28.394 1.00 0.00 H new ATOM 645 N GLU A 244 41.127 8.582 27.142 1.00 0.00 N ATOM 646 CA GLU A 244 42.554 8.360 27.312 1.00 0.00 C ATOM 647 C GLU A 244 43.283 8.646 26.005 1.00 0.00 C ATOM 648 O GLU A 244 44.345 9.270 25.995 1.00 0.00 O ATOM 649 CB GLU A 244 42.817 6.916 27.739 1.00 0.00 C ATOM 650 CG GLU A 244 42.262 6.689 29.146 1.00 0.00 C ATOM 651 CD GLU A 244 42.443 5.229 29.549 1.00 0.00 C ATOM 652 OE1 GLU A 244 43.038 4.491 28.780 1.00 0.00 O ATOM 653 OE2 GLU A 244 41.979 4.869 30.620 1.00 0.00 O ATOM 0 H GLU A 244 40.551 7.743 27.212 1.00 0.00 H new ATOM 0 HA GLU A 244 42.922 9.033 28.086 1.00 0.00 H new ATOM 0 HB2 GLU A 244 42.348 6.227 27.036 1.00 0.00 H new ATOM 0 HB3 GLU A 244 43.887 6.710 27.721 1.00 0.00 H new ATOM 0 HG2 GLU A 244 42.774 7.337 29.857 1.00 0.00 H new ATOM 0 HG3 GLU A 244 41.205 6.955 29.176 1.00 0.00 H new ATOM 660 N ILE A 245 42.695 8.194 24.903 1.00 0.00 N ATOM 661 CA ILE A 245 43.281 8.406 23.587 1.00 0.00 C ATOM 662 C ILE A 245 43.237 9.883 23.211 1.00 0.00 C ATOM 663 O ILE A 245 44.066 10.361 22.433 1.00 0.00 O ATOM 664 CB ILE A 245 42.515 7.591 22.543 1.00 0.00 C ATOM 665 CG1 ILE A 245 42.568 6.108 22.918 1.00 0.00 C ATOM 666 CG2 ILE A 245 43.148 7.793 21.166 1.00 0.00 C ATOM 667 CD1 ILE A 245 41.605 5.320 22.027 1.00 0.00 C ATOM 0 H ILE A 245 41.814 7.679 24.896 1.00 0.00 H new ATOM 0 HA ILE A 245 44.321 8.082 23.615 1.00 0.00 H new ATOM 0 HB ILE A 245 41.477 7.923 22.514 1.00 0.00 H new ATOM 0 HG12 ILE A 245 43.583 5.728 22.799 1.00 0.00 H new ATOM 0 HG13 ILE A 245 42.299 5.977 23.966 1.00 0.00 H new ATOM 0 HG21 ILE A 245 42.600 7.211 20.425 1.00 0.00 H new ATOM 0 HG22 ILE A 245 43.109 8.849 20.899 1.00 0.00 H new ATOM 0 HG23 ILE A 245 44.187 7.463 21.191 1.00 0.00 H new ATOM 0 HD11 ILE A 245 41.643 4.264 22.295 1.00 0.00 H new ATOM 0 HD12 ILE A 245 40.591 5.694 22.168 1.00 0.00 H new ATOM 0 HD13 ILE A 245 41.894 5.440 20.983 1.00 0.00 H new ATOM 679 N GLN A 246 42.264 10.601 23.761 1.00 0.00 N ATOM 680 CA GLN A 246 42.120 12.021 23.471 1.00 0.00 C ATOM 681 C GLN A 246 43.334 12.795 23.980 1.00 0.00 C ATOM 682 O GLN A 246 43.868 13.657 23.283 1.00 0.00 O ATOM 683 CB GLN A 246 40.852 12.563 24.134 1.00 0.00 C ATOM 684 CG GLN A 246 40.594 13.998 23.660 1.00 0.00 C ATOM 685 CD GLN A 246 40.223 13.997 22.181 1.00 0.00 C ATOM 686 OE1 GLN A 246 39.543 13.085 21.711 1.00 0.00 O ATOM 687 NE2 GLN A 246 40.631 14.973 21.416 1.00 0.00 N ATOM 0 H GLN A 246 41.568 10.226 24.406 1.00 0.00 H new ATOM 0 HA GLN A 246 42.047 12.148 22.391 1.00 0.00 H new ATOM 0 HB2 GLN A 246 40.001 11.929 23.886 1.00 0.00 H new ATOM 0 HB3 GLN A 246 40.960 12.542 25.218 1.00 0.00 H new ATOM 0 HG2 GLN A 246 39.790 14.445 24.245 1.00 0.00 H new ATOM 0 HG3 GLN A 246 41.482 14.609 23.821 1.00 0.00 H new ATOM 0 HE21 GLN A 246 41.194 15.727 21.809 1.00 0.00 H new ATOM 0 HE22 GLN A 246 40.386 14.981 20.426 1.00 0.00 H new ATOM 696 N SER A 247 43.757 12.487 25.201 1.00 0.00 N ATOM 697 CA SER A 247 44.905 13.162 25.796 1.00 0.00 C ATOM 698 C SER A 247 46.185 12.788 25.060 1.00 0.00 C ATOM 699 O SER A 247 47.205 13.465 25.185 1.00 0.00 O ATOM 700 CB SER A 247 45.031 12.779 27.270 1.00 0.00 C ATOM 701 OG SER A 247 46.075 13.537 27.865 1.00 0.00 O ATOM 0 H SER A 247 43.326 11.779 25.795 1.00 0.00 H new ATOM 0 HA SER A 247 44.753 14.238 25.714 1.00 0.00 H new ATOM 0 HB2 SER A 247 44.090 12.966 27.788 1.00 0.00 H new ATOM 0 HB3 SER A 247 45.241 11.713 27.364 1.00 0.00 H new ATOM 0 HG SER A 247 46.157 13.295 28.811 1.00 0.00 H new ATOM 707 N ARG A 248 46.129 11.702 24.295 1.00 0.00 N ATOM 708 CA ARG A 248 47.296 11.241 23.544 1.00 0.00 C ATOM 709 C ARG A 248 47.305 11.848 22.144 1.00 0.00 C ATOM 710 O ARG A 248 48.125 11.479 21.306 1.00 0.00 O ATOM 711 CB ARG A 248 47.281 9.713 23.440 1.00 0.00 C ATOM 712 CG ARG A 248 47.455 9.105 24.832 1.00 0.00 C ATOM 713 CD ARG A 248 47.351 7.581 24.742 1.00 0.00 C ATOM 714 NE ARG A 248 48.443 7.050 23.930 1.00 0.00 N ATOM 715 CZ ARG A 248 49.629 6.778 24.464 1.00 0.00 C ATOM 716 NH1 ARG A 248 49.836 6.990 25.735 1.00 0.00 N ATOM 717 NH2 ARG A 248 50.586 6.300 23.717 1.00 0.00 N ATOM 0 H ARG A 248 45.295 11.127 24.178 1.00 0.00 H new ATOM 0 HA ARG A 248 48.194 11.560 24.073 1.00 0.00 H new ATOM 0 HB2 ARG A 248 46.342 9.377 23.000 1.00 0.00 H new ATOM 0 HB3 ARG A 248 48.081 9.375 22.781 1.00 0.00 H new ATOM 0 HG2 ARG A 248 48.422 9.390 25.246 1.00 0.00 H new ATOM 0 HG3 ARG A 248 46.692 9.493 25.507 1.00 0.00 H new ATOM 0 HD2 ARG A 248 47.386 7.147 25.741 1.00 0.00 H new ATOM 0 HD3 ARG A 248 46.393 7.299 24.306 1.00 0.00 H new ATOM 0 HE ARG A 248 48.292 6.885 22.935 1.00 0.00 H new ATOM 0 HH11 ARG A 248 49.088 7.364 26.318 1.00 0.00 H new ATOM 0 HH12 ARG A 248 50.746 6.781 26.145 1.00 0.00 H new ATOM 0 HH21 ARG A 248 50.424 6.135 22.724 1.00 0.00 H new ATOM 0 HH22 ARG A 248 51.497 6.091 24.126 1.00 0.00 H new