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 -44:sc= 1.03 USER MOD Single : A 218 LYS NZ :NH3+ -167:sc=-0.00447 (180deg=-0.241) USER MOD Single : A 222 LYS NZ :NH3+ 158:sc= -0.101 (180deg=-0.617) 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 180:sc= 0 (180deg=0) USER MOD Single : A 235 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 236 SER OG : rot -20:sc= -0.0607 USER MOD Single : A 237 LYS NZ :NH3+ -163:sc= -0.0367 (180deg=-0.421) USER MOD Single : A 240 GLN : amide:sc= -0.202 K(o=-0.2,f=-0.81) USER MOD Single : A 242 HIS : no HD1:sc= -0.335 K(o=-0.34,f=-1.2) USER MOD Single : A 243 GLN : amide:sc= -0.205 K(o=-0.21,f=-0.76) USER MOD Single : A 246 GLN : amide:sc=-0.00999 K(o=-0.01,f=-1.5!) USER MOD Single : A 247 SER OG : rot 77:sc= 0.193 USER MOD ----------------------------------------------------------------- ATOM 175 N SER A 217 12.786 15.862 7.309 1.00 0.00 N ATOM 176 CA SER A 217 12.831 15.000 8.486 1.00 0.00 C ATOM 177 C SER A 217 13.981 14.002 8.384 1.00 0.00 C ATOM 178 O SER A 217 13.943 12.934 8.994 1.00 0.00 O ATOM 179 CB SER A 217 11.510 14.249 8.632 1.00 0.00 C ATOM 180 OG SER A 217 11.529 13.492 9.835 1.00 0.00 O ATOM 0 HA SER A 217 12.992 15.627 9.363 1.00 0.00 H new ATOM 0 HB2 SER A 217 10.678 14.953 8.645 1.00 0.00 H new ATOM 0 HB3 SER A 217 11.357 13.590 7.777 1.00 0.00 H new ATOM 0 HG SER A 217 12.396 13.045 9.927 1.00 0.00 H new ATOM 186 N LYS A 218 14.999 14.357 7.609 1.00 0.00 N ATOM 187 CA LYS A 218 16.156 13.489 7.432 1.00 0.00 C ATOM 188 C LYS A 218 17.027 13.482 8.684 1.00 0.00 C ATOM 189 O LYS A 218 17.833 12.574 8.884 1.00 0.00 O ATOM 190 CB LYS A 218 16.979 13.961 6.232 1.00 0.00 C ATOM 191 CG LYS A 218 17.462 15.395 6.471 1.00 0.00 C ATOM 192 CD LYS A 218 18.247 15.881 5.252 1.00 0.00 C ATOM 193 CE LYS A 218 18.846 17.259 5.548 1.00 0.00 C ATOM 194 NZ LYS A 218 17.748 18.259 5.687 1.00 0.00 N ATOM 0 H LYS A 218 15.047 15.237 7.095 1.00 0.00 H new ATOM 0 HA LYS A 218 15.801 12.474 7.254 1.00 0.00 H new ATOM 0 HB2 LYS A 218 17.832 13.300 6.081 1.00 0.00 H new ATOM 0 HB3 LYS A 218 16.376 13.916 5.325 1.00 0.00 H new ATOM 0 HG2 LYS A 218 16.611 16.051 6.653 1.00 0.00 H new ATOM 0 HG3 LYS A 218 18.091 15.434 7.361 1.00 0.00 H new ATOM 0 HD2 LYS A 218 19.039 15.172 5.010 1.00 0.00 H new ATOM 0 HD3 LYS A 218 17.592 15.936 4.382 1.00 0.00 H new ATOM 0 HE2 LYS A 218 19.436 17.222 6.464 1.00 0.00 H new ATOM 0 HE3 LYS A 218 19.521 17.554 4.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 218 18.148 19.219 5.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 218 17.076 18.148 4.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 218 17.254 18.108 6.589 1.00 0.00 H new ATOM 208 N ASP A 219 16.867 14.504 9.517 1.00 0.00 N ATOM 209 CA ASP A 219 17.649 14.604 10.745 1.00 0.00 C ATOM 210 C ASP A 219 17.318 13.452 11.689 1.00 0.00 C ATOM 211 O ASP A 219 18.202 12.902 12.346 1.00 0.00 O ATOM 212 CB ASP A 219 17.366 15.936 11.441 1.00 0.00 C ATOM 213 CG ASP A 219 18.169 16.032 12.735 1.00 0.00 C ATOM 214 OD1 ASP A 219 18.839 15.068 13.068 1.00 0.00 O ATOM 215 OD2 ASP A 219 18.097 17.065 13.378 1.00 0.00 O ATOM 0 H ASP A 219 16.209 15.269 9.367 1.00 0.00 H new ATOM 0 HA ASP A 219 18.706 14.551 10.483 1.00 0.00 H new ATOM 0 HB2 ASP A 219 17.626 16.763 10.780 1.00 0.00 H new ATOM 0 HB3 ASP A 219 16.301 16.023 11.657 1.00 0.00 H new ATOM 220 N GLU A 220 16.043 13.089 11.752 1.00 0.00 N ATOM 221 CA GLU A 220 15.617 12.000 12.623 1.00 0.00 C ATOM 222 C GLU A 220 16.276 10.692 12.199 1.00 0.00 C ATOM 223 O GLU A 220 16.732 9.918 13.039 1.00 0.00 O ATOM 224 CB GLU A 220 14.093 11.851 12.566 1.00 0.00 C ATOM 225 CG GLU A 220 13.647 10.764 13.547 1.00 0.00 C ATOM 226 CD GLU A 220 12.129 10.641 13.532 1.00 0.00 C ATOM 227 OE1 GLU A 220 11.612 10.043 12.603 1.00 0.00 O ATOM 228 OE2 GLU A 220 11.505 11.140 14.453 1.00 0.00 O ATOM 0 H GLU A 220 15.293 13.527 11.217 1.00 0.00 H new ATOM 0 HA GLU A 220 15.919 12.233 13.644 1.00 0.00 H new ATOM 0 HB2 GLU A 220 13.615 12.798 12.815 1.00 0.00 H new ATOM 0 HB3 GLU A 220 13.780 11.593 11.554 1.00 0.00 H new ATOM 0 HG2 GLU A 220 14.100 9.810 13.277 1.00 0.00 H new ATOM 0 HG3 GLU A 220 13.991 11.007 14.553 1.00 0.00 H new ATOM 235 N ILE A 221 16.326 10.455 10.895 1.00 0.00 N ATOM 236 CA ILE A 221 16.932 9.236 10.371 1.00 0.00 C ATOM 237 C ILE A 221 18.416 9.190 10.727 1.00 0.00 C ATOM 238 O ILE A 221 18.940 8.146 11.113 1.00 0.00 O ATOM 239 CB ILE A 221 16.765 9.179 8.851 1.00 0.00 C ATOM 240 CG1 ILE A 221 15.280 9.023 8.510 1.00 0.00 C ATOM 241 CG2 ILE A 221 17.536 7.977 8.295 1.00 0.00 C ATOM 242 CD1 ILE A 221 15.078 9.227 7.008 1.00 0.00 C ATOM 0 H ILE A 221 15.957 11.086 10.183 1.00 0.00 H new ATOM 0 HA ILE A 221 16.432 8.377 10.819 1.00 0.00 H new ATOM 0 HB ILE A 221 17.152 10.098 8.410 1.00 0.00 H new ATOM 0 HG12 ILE A 221 14.930 8.033 8.804 1.00 0.00 H new ATOM 0 HG13 ILE A 221 14.689 9.749 9.069 1.00 0.00 H new ATOM 0 HG21 ILE A 221 17.416 7.937 7.212 1.00 0.00 H new ATOM 0 HG22 ILE A 221 18.593 8.078 8.540 1.00 0.00 H new ATOM 0 HG23 ILE A 221 17.147 7.059 8.737 1.00 0.00 H new ATOM 0 HD11 ILE A 221 14.021 9.116 6.765 1.00 0.00 H new ATOM 0 HD12 ILE A 221 15.412 10.226 6.728 1.00 0.00 H new ATOM 0 HD13 ILE A 221 15.657 8.484 6.459 1.00 0.00 H new ATOM 254 N LYS A 222 19.089 10.327 10.580 1.00 0.00 N ATOM 255 CA LYS A 222 20.514 10.402 10.880 1.00 0.00 C ATOM 256 C LYS A 222 20.777 9.995 12.326 1.00 0.00 C ATOM 257 O LYS A 222 21.749 9.302 12.619 1.00 0.00 O ATOM 258 CB LYS A 222 21.023 11.828 10.651 1.00 0.00 C ATOM 259 CG LYS A 222 22.539 11.869 10.855 1.00 0.00 C ATOM 260 CD LYS A 222 23.053 13.285 10.595 1.00 0.00 C ATOM 261 CE LYS A 222 24.569 13.322 10.790 1.00 0.00 C ATOM 262 NZ LYS A 222 25.218 12.421 9.795 1.00 0.00 N ATOM 0 H LYS A 222 18.675 11.202 10.258 1.00 0.00 H new ATOM 0 HA LYS A 222 21.042 9.717 10.217 1.00 0.00 H new ATOM 0 HB2 LYS A 222 20.772 12.157 9.643 1.00 0.00 H new ATOM 0 HB3 LYS A 222 20.534 12.515 11.341 1.00 0.00 H new ATOM 0 HG2 LYS A 222 22.788 11.562 11.871 1.00 0.00 H new ATOM 0 HG3 LYS A 222 23.026 11.165 10.180 1.00 0.00 H new ATOM 0 HD2 LYS A 222 22.799 13.595 9.582 1.00 0.00 H new ATOM 0 HD3 LYS A 222 22.571 13.988 11.274 1.00 0.00 H new ATOM 0 HE2 LYS A 222 24.938 14.341 10.669 1.00 0.00 H new ATOM 0 HE3 LYS A 222 24.824 13.008 11.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 222 26.209 12.707 9.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 222 25.184 11.441 10.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 222 24.714 12.486 8.887 1.00 0.00 H new ATOM 276 N ARG A 223 19.908 10.434 13.226 1.00 0.00 N ATOM 277 CA ARG A 223 20.060 10.108 14.640 1.00 0.00 C ATOM 278 C ARG A 223 19.901 8.607 14.864 1.00 0.00 C ATOM 279 O ARG A 223 20.592 8.015 15.693 1.00 0.00 O ATOM 280 CB ARG A 223 19.017 10.863 15.465 1.00 0.00 C ATOM 281 CG ARG A 223 19.359 12.355 15.477 1.00 0.00 C ATOM 282 CD ARG A 223 18.281 13.118 16.250 1.00 0.00 C ATOM 283 NE ARG A 223 18.267 12.691 17.645 1.00 0.00 N ATOM 284 CZ ARG A 223 17.314 13.096 18.477 1.00 0.00 C ATOM 285 NH1 ARG A 223 16.368 13.888 18.051 1.00 0.00 N ATOM 286 NH2 ARG A 223 17.322 12.699 19.720 1.00 0.00 N ATOM 0 H ARG A 223 19.097 11.012 13.007 1.00 0.00 H new ATOM 0 HA ARG A 223 21.059 10.407 14.957 1.00 0.00 H new ATOM 0 HB2 ARG A 223 18.024 10.710 15.043 1.00 0.00 H new ATOM 0 HB3 ARG A 223 18.994 10.476 16.484 1.00 0.00 H new ATOM 0 HG2 ARG A 223 20.333 12.512 15.939 1.00 0.00 H new ATOM 0 HG3 ARG A 223 19.426 12.732 14.457 1.00 0.00 H new ATOM 0 HD2 ARG A 223 18.471 14.190 16.192 1.00 0.00 H new ATOM 0 HD3 ARG A 223 17.305 12.942 15.798 1.00 0.00 H new ATOM 0 HE ARG A 223 19.001 12.071 17.987 1.00 0.00 H new ATOM 0 HH11 ARG A 223 16.360 14.196 17.079 1.00 0.00 H new ATOM 0 HH12 ARG A 223 15.636 14.199 18.690 1.00 0.00 H new ATOM 0 HH21 ARG A 223 18.060 12.078 20.052 1.00 0.00 H new ATOM 0 HH22 ARG A 223 16.590 13.010 20.359 1.00 0.00 H new ATOM 300 N GLU A 224 18.981 8.000 14.123 1.00 0.00 N ATOM 301 CA GLU A 224 18.732 6.567 14.249 1.00 0.00 C ATOM 302 C GLU A 224 19.937 5.767 13.765 1.00 0.00 C ATOM 303 O GLU A 224 20.197 4.666 14.247 1.00 0.00 O ATOM 304 CB GLU A 224 17.497 6.178 13.436 1.00 0.00 C ATOM 305 CG GLU A 224 16.252 6.806 14.065 1.00 0.00 C ATOM 306 CD GLU A 224 15.026 6.505 13.209 1.00 0.00 C ATOM 307 OE1 GLU A 224 15.185 5.849 12.194 1.00 0.00 O ATOM 308 OE2 GLU A 224 13.947 6.936 13.582 1.00 0.00 O ATOM 0 H GLU A 224 18.398 8.473 13.433 1.00 0.00 H new ATOM 0 HA GLU A 224 18.560 6.339 15.301 1.00 0.00 H new ATOM 0 HB2 GLU A 224 17.606 6.516 12.405 1.00 0.00 H new ATOM 0 HB3 GLU A 224 17.395 5.093 13.407 1.00 0.00 H new ATOM 0 HG2 GLU A 224 16.107 6.415 15.072 1.00 0.00 H new ATOM 0 HG3 GLU A 224 16.385 7.884 14.157 1.00 0.00 H new ATOM 315 N TYR A 225 20.663 6.325 12.800 1.00 0.00 N ATOM 316 CA TYR A 225 21.832 5.649 12.250 1.00 0.00 C ATOM 317 C TYR A 225 22.881 5.417 13.334 1.00 0.00 C ATOM 318 O TYR A 225 23.428 4.322 13.458 1.00 0.00 O ATOM 319 CB TYR A 225 22.437 6.489 11.120 1.00 0.00 C ATOM 320 CG TYR A 225 23.707 5.839 10.624 1.00 0.00 C ATOM 321 CD1 TYR A 225 23.639 4.733 9.769 1.00 0.00 C ATOM 322 CD2 TYR A 225 24.953 6.341 11.022 1.00 0.00 C ATOM 323 CE1 TYR A 225 24.815 4.130 9.309 1.00 0.00 C ATOM 324 CE2 TYR A 225 26.129 5.737 10.563 1.00 0.00 C ATOM 325 CZ TYR A 225 26.061 4.631 9.708 1.00 0.00 C ATOM 326 OH TYR A 225 27.221 4.037 9.254 1.00 0.00 O ATOM 0 H TYR A 225 20.464 7.236 12.386 1.00 0.00 H new ATOM 0 HA TYR A 225 21.517 4.683 11.856 1.00 0.00 H new ATOM 0 HB2 TYR A 225 21.723 6.584 10.302 1.00 0.00 H new ATOM 0 HB3 TYR A 225 22.649 7.497 11.477 1.00 0.00 H new ATOM 0 HD1 TYR A 225 22.678 4.345 9.464 1.00 0.00 H new ATOM 0 HD2 TYR A 225 25.006 7.194 11.683 1.00 0.00 H new ATOM 0 HE1 TYR A 225 24.762 3.279 8.647 1.00 0.00 H new ATOM 0 HE2 TYR A 225 27.090 6.125 10.869 1.00 0.00 H new ATOM 0 HH TYR A 225 27.996 4.508 9.625 1.00 0.00 H new ATOM 336 N LYS A 226 23.157 6.455 14.114 1.00 0.00 N ATOM 337 CA LYS A 226 24.143 6.358 15.184 1.00 0.00 C ATOM 338 C LYS A 226 23.713 5.349 16.246 1.00 0.00 C ATOM 339 O LYS A 226 24.526 4.565 16.733 1.00 0.00 O ATOM 340 CB LYS A 226 24.347 7.729 15.832 1.00 0.00 C ATOM 341 CG LYS A 226 25.072 8.655 14.853 1.00 0.00 C ATOM 342 CD LYS A 226 25.280 10.023 15.505 1.00 0.00 C ATOM 343 CE LYS A 226 26.022 10.944 14.535 1.00 0.00 C ATOM 344 NZ LYS A 226 26.268 12.261 15.190 1.00 0.00 N ATOM 0 H LYS A 226 22.714 7.370 14.027 1.00 0.00 H new ATOM 0 HA LYS A 226 25.080 6.015 14.746 1.00 0.00 H new ATOM 0 HB2 LYS A 226 23.384 8.158 16.110 1.00 0.00 H new ATOM 0 HB3 LYS A 226 24.927 7.627 16.749 1.00 0.00 H new ATOM 0 HG2 LYS A 226 26.033 8.224 14.572 1.00 0.00 H new ATOM 0 HG3 LYS A 226 24.490 8.761 13.937 1.00 0.00 H new ATOM 0 HD2 LYS A 226 24.318 10.460 15.774 1.00 0.00 H new ATOM 0 HD3 LYS A 226 25.850 9.915 16.428 1.00 0.00 H new ATOM 0 HE2 LYS A 226 26.968 10.491 14.238 1.00 0.00 H new ATOM 0 HE3 LYS A 226 25.436 11.081 13.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 226 26.772 12.888 14.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 226 25.359 12.694 15.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 226 26.844 12.121 16.045 1.00 0.00 H new ATOM 358 N GLU A 227 22.433 5.374 16.605 1.00 0.00 N ATOM 359 CA GLU A 227 21.922 4.455 17.616 1.00 0.00 C ATOM 360 C GLU A 227 21.969 3.016 17.107 1.00 0.00 C ATOM 361 O GLU A 227 22.279 2.093 17.861 1.00 0.00 O ATOM 362 CB GLU A 227 20.483 4.826 17.980 1.00 0.00 C ATOM 363 CG GLU A 227 20.050 4.036 19.219 1.00 0.00 C ATOM 364 CD GLU A 227 20.785 4.558 20.450 1.00 0.00 C ATOM 365 OE1 GLU A 227 21.465 5.563 20.328 1.00 0.00 O ATOM 366 OE2 GLU A 227 20.657 3.943 21.494 1.00 0.00 O ATOM 0 H GLU A 227 21.738 6.012 16.217 1.00 0.00 H new ATOM 0 HA GLU A 227 22.551 4.534 18.503 1.00 0.00 H new ATOM 0 HB2 GLU A 227 20.410 5.896 18.174 1.00 0.00 H new ATOM 0 HB3 GLU A 227 19.817 4.607 17.145 1.00 0.00 H new ATOM 0 HG2 GLU A 227 18.973 4.127 19.361 1.00 0.00 H new ATOM 0 HG3 GLU A 227 20.264 2.976 19.079 1.00 0.00 H new ATOM 373 N MET A 228 21.659 2.832 15.830 1.00 0.00 N ATOM 374 CA MET A 228 21.671 1.499 15.238 1.00 0.00 C ATOM 375 C MET A 228 23.083 0.923 15.248 1.00 0.00 C ATOM 376 O MET A 228 23.280 -0.261 15.525 1.00 0.00 O ATOM 377 CB MET A 228 21.149 1.557 13.801 1.00 0.00 C ATOM 378 CG MET A 228 21.104 0.145 13.214 1.00 0.00 C ATOM 379 SD MET A 228 20.406 0.205 11.546 1.00 0.00 S ATOM 380 CE MET A 228 21.952 0.535 10.664 1.00 0.00 C ATOM 0 H MET A 228 21.398 3.581 15.189 1.00 0.00 H new ATOM 0 HA MET A 228 21.023 0.853 15.830 1.00 0.00 H new ATOM 0 HB2 MET A 228 20.154 2.001 13.783 1.00 0.00 H new ATOM 0 HB3 MET A 228 21.794 2.193 13.195 1.00 0.00 H new ATOM 0 HG2 MET A 228 22.107 -0.280 13.184 1.00 0.00 H new ATOM 0 HG3 MET A 228 20.501 -0.505 13.849 1.00 0.00 H new ATOM 0 HE1 MET A 228 21.752 0.612 9.595 1.00 0.00 H new ATOM 0 HE2 MET A 228 22.382 1.471 11.021 1.00 0.00 H new ATOM 0 HE3 MET A 228 22.654 -0.279 10.844 1.00 0.00 H new ATOM 390 N GLU A 229 24.061 1.765 14.935 1.00 0.00 N ATOM 391 CA GLU A 229 25.448 1.328 14.904 1.00 0.00 C ATOM 392 C GLU A 229 25.940 1.009 16.311 1.00 0.00 C ATOM 393 O GLU A 229 26.721 0.078 16.510 1.00 0.00 O ATOM 394 CB GLU A 229 26.329 2.421 14.289 1.00 0.00 C ATOM 395 CG GLU A 229 27.672 1.823 13.853 1.00 0.00 C ATOM 396 CD GLU A 229 28.493 1.438 15.080 1.00 0.00 C ATOM 397 OE1 GLU A 229 28.546 2.230 16.007 1.00 0.00 O ATOM 398 OE2 GLU A 229 29.046 0.350 15.081 1.00 0.00 O ATOM 0 H GLU A 229 23.919 2.748 14.701 1.00 0.00 H new ATOM 0 HA GLU A 229 25.511 0.426 14.295 1.00 0.00 H new ATOM 0 HB2 GLU A 229 25.825 2.868 13.432 1.00 0.00 H new ATOM 0 HB3 GLU A 229 26.494 3.218 15.014 1.00 0.00 H new ATOM 0 HG2 GLU A 229 27.503 0.946 13.228 1.00 0.00 H new ATOM 0 HG3 GLU A 229 28.222 2.544 13.249 1.00 0.00 H new ATOM 405 N GLY A 230 25.484 1.794 17.279 1.00 0.00 N ATOM 406 CA GLY A 230 25.883 1.597 18.666 1.00 0.00 C ATOM 407 C GLY A 230 25.014 0.534 19.329 1.00 0.00 C ATOM 408 O GLY A 230 24.664 0.650 20.503 1.00 0.00 O ATOM 0 H GLY A 230 24.840 2.571 17.130 1.00 0.00 H new ATOM 0 HA2 GLY A 230 26.930 1.297 18.710 1.00 0.00 H new ATOM 0 HA3 GLY A 230 25.797 2.537 19.212 1.00 0.00 H new ATOM 437 N GLU A 233 27.187 -3.012 23.204 1.00 0.00 N ATOM 438 CA GLU A 233 27.725 -2.239 24.318 1.00 0.00 C ATOM 439 C GLU A 233 29.202 -2.568 24.536 1.00 0.00 C ATOM 440 O GLU A 233 29.927 -1.817 25.182 1.00 0.00 O ATOM 441 CB GLU A 233 26.932 -2.540 25.592 1.00 0.00 C ATOM 442 CG GLU A 233 27.206 -1.455 26.636 1.00 0.00 C ATOM 443 CD GLU A 233 26.537 -0.150 26.216 1.00 0.00 C ATOM 444 OE1 GLU A 233 25.793 -0.173 25.250 1.00 0.00 O ATOM 445 OE2 GLU A 233 26.784 0.854 26.864 1.00 0.00 O ATOM 0 HA GLU A 233 27.636 -1.179 24.080 1.00 0.00 H new ATOM 0 HB2 GLU A 233 25.866 -2.582 25.368 1.00 0.00 H new ATOM 0 HB3 GLU A 233 27.214 -3.517 25.985 1.00 0.00 H new ATOM 0 HG2 GLU A 233 26.829 -1.771 27.609 1.00 0.00 H new ATOM 0 HG3 GLU A 233 28.280 -1.305 26.744 1.00 0.00 H new ATOM 452 N ILE A 234 29.638 -3.702 24.009 1.00 0.00 N ATOM 453 CA ILE A 234 31.030 -4.117 24.169 1.00 0.00 C ATOM 454 C ILE A 234 31.968 -3.125 23.506 1.00 0.00 C ATOM 455 O ILE A 234 32.992 -2.752 24.083 1.00 0.00 O ATOM 456 CB ILE A 234 31.227 -5.509 23.554 1.00 0.00 C ATOM 457 CG1 ILE A 234 30.174 -6.475 24.113 1.00 0.00 C ATOM 458 CG2 ILE A 234 32.623 -6.030 23.896 1.00 0.00 C ATOM 459 CD1 ILE A 234 30.184 -6.438 25.647 1.00 0.00 C ATOM 0 H ILE A 234 29.059 -4.347 23.472 1.00 0.00 H new ATOM 0 HA ILE A 234 31.262 -4.151 25.234 1.00 0.00 H new ATOM 0 HB ILE A 234 31.119 -5.440 22.472 1.00 0.00 H new ATOM 0 HG12 ILE A 234 29.186 -6.203 23.742 1.00 0.00 H new ATOM 0 HG13 ILE A 234 30.377 -7.488 23.765 1.00 0.00 H new ATOM 0 HG21 ILE A 234 32.760 -7.019 23.458 1.00 0.00 H new ATOM 0 HG22 ILE A 234 33.374 -5.349 23.496 1.00 0.00 H new ATOM 0 HG23 ILE A 234 32.732 -6.095 24.979 1.00 0.00 H new ATOM 0 HD11 ILE A 234 29.433 -7.127 26.032 1.00 0.00 H new ATOM 0 HD12 ILE A 234 31.168 -6.733 26.012 1.00 0.00 H new ATOM 0 HD13 ILE A 234 29.958 -5.428 25.988 1.00 0.00 H new ATOM 471 N LYS A 235 31.618 -2.704 22.301 1.00 0.00 N ATOM 472 CA LYS A 235 32.433 -1.744 21.570 1.00 0.00 C ATOM 473 C LYS A 235 32.410 -0.381 22.254 1.00 0.00 C ATOM 474 O LYS A 235 33.416 0.327 22.287 1.00 0.00 O ATOM 475 CB LYS A 235 31.935 -1.611 20.130 1.00 0.00 C ATOM 476 CG LYS A 235 32.218 -2.911 19.372 1.00 0.00 C ATOM 477 CD LYS A 235 31.775 -2.763 17.916 1.00 0.00 C ATOM 478 CE LYS A 235 32.039 -4.068 17.167 1.00 0.00 C ATOM 479 NZ LYS A 235 31.567 -3.936 15.759 1.00 0.00 N ATOM 0 H LYS A 235 30.778 -3.010 21.809 1.00 0.00 H new ATOM 0 HA LYS A 235 33.460 -2.110 21.560 1.00 0.00 H new ATOM 0 HB2 LYS A 235 30.866 -1.397 20.121 1.00 0.00 H new ATOM 0 HB3 LYS A 235 32.431 -0.775 19.638 1.00 0.00 H new ATOM 0 HG2 LYS A 235 33.281 -3.146 19.417 1.00 0.00 H new ATOM 0 HG3 LYS A 235 31.688 -3.740 19.841 1.00 0.00 H new ATOM 0 HD2 LYS A 235 30.715 -2.514 17.871 1.00 0.00 H new ATOM 0 HD3 LYS A 235 32.315 -1.944 17.442 1.00 0.00 H new ATOM 0 HE2 LYS A 235 33.104 -4.301 17.185 1.00 0.00 H new ATOM 0 HE3 LYS A 235 31.524 -4.893 17.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 235 31.746 -4.824 15.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 235 30.547 -3.733 15.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 235 32.078 -3.159 15.293 1.00 0.00 H new ATOM 493 N SER A 236 31.248 -0.015 22.791 1.00 0.00 N ATOM 494 CA SER A 236 31.102 1.273 23.461 1.00 0.00 C ATOM 495 C SER A 236 32.025 1.354 24.672 1.00 0.00 C ATOM 496 O SER A 236 32.585 2.411 24.964 1.00 0.00 O ATOM 497 CB SER A 236 29.651 1.463 23.910 1.00 0.00 C ATOM 498 OG SER A 236 29.288 0.410 24.791 1.00 0.00 O ATOM 0 H SER A 236 30.403 -0.586 22.776 1.00 0.00 H new ATOM 0 HA SER A 236 31.373 2.061 22.759 1.00 0.00 H new ATOM 0 HB2 SER A 236 29.536 2.425 24.409 1.00 0.00 H new ATOM 0 HB3 SER A 236 28.989 1.472 23.044 1.00 0.00 H new ATOM 0 HG SER A 236 29.895 -0.348 24.662 1.00 0.00 H new ATOM 504 N LYS A 237 32.192 0.232 25.362 1.00 0.00 N ATOM 505 CA LYS A 237 33.064 0.186 26.531 1.00 0.00 C ATOM 506 C LYS A 237 34.512 0.463 26.136 1.00 0.00 C ATOM 507 O LYS A 237 35.231 1.177 26.834 1.00 0.00 O ATOM 508 CB LYS A 237 32.966 -1.183 27.206 1.00 0.00 C ATOM 509 CG LYS A 237 31.619 -1.306 27.921 1.00 0.00 C ATOM 510 CD LYS A 237 31.483 -2.710 28.516 1.00 0.00 C ATOM 511 CE LYS A 237 30.094 -2.869 29.138 1.00 0.00 C ATOM 512 NZ LYS A 237 29.931 -1.887 30.249 1.00 0.00 N ATOM 0 H LYS A 237 31.739 -0.653 25.135 1.00 0.00 H new ATOM 0 HA LYS A 237 32.740 0.957 27.230 1.00 0.00 H new ATOM 0 HB2 LYS A 237 33.069 -1.974 26.463 1.00 0.00 H new ATOM 0 HB3 LYS A 237 33.781 -1.307 27.919 1.00 0.00 H new ATOM 0 HG2 LYS A 237 31.544 -0.557 28.709 1.00 0.00 H new ATOM 0 HG3 LYS A 237 30.805 -1.116 27.221 1.00 0.00 H new ATOM 0 HD2 LYS A 237 31.634 -3.461 27.741 1.00 0.00 H new ATOM 0 HD3 LYS A 237 32.252 -2.872 29.271 1.00 0.00 H new ATOM 0 HE2 LYS A 237 29.325 -2.710 28.382 1.00 0.00 H new ATOM 0 HE3 LYS A 237 29.966 -3.884 29.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 237 29.132 -2.172 30.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 237 30.800 -1.860 30.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 237 29.747 -0.943 29.854 1.00 0.00 H new ATOM 526 N ARG A 238 34.930 -0.108 25.012 1.00 0.00 N ATOM 527 CA ARG A 238 36.295 0.080 24.529 1.00 0.00 C ATOM 528 C ARG A 238 36.536 1.545 24.175 1.00 0.00 C ATOM 529 O ARG A 238 37.636 2.066 24.365 1.00 0.00 O ATOM 530 CB ARG A 238 36.540 -0.793 23.298 1.00 0.00 C ATOM 531 CG ARG A 238 36.590 -2.263 23.718 1.00 0.00 C ATOM 532 CD ARG A 238 36.737 -3.144 22.476 1.00 0.00 C ATOM 533 NE ARG A 238 36.795 -4.550 22.860 1.00 0.00 N ATOM 534 CZ ARG A 238 36.866 -5.510 21.944 1.00 0.00 C ATOM 535 NH1 ARG A 238 36.893 -5.200 20.677 1.00 0.00 N ATOM 536 NH2 ARG A 238 36.910 -6.761 22.312 1.00 0.00 N ATOM 0 H ARG A 238 34.348 -0.702 24.421 1.00 0.00 H new ATOM 0 HA ARG A 238 36.986 -0.211 25.320 1.00 0.00 H new ATOM 0 HB2 ARG A 238 35.747 -0.639 22.566 1.00 0.00 H new ATOM 0 HB3 ARG A 238 37.476 -0.509 22.818 1.00 0.00 H new ATOM 0 HG2 ARG A 238 37.427 -2.430 24.396 1.00 0.00 H new ATOM 0 HG3 ARG A 238 35.682 -2.528 24.260 1.00 0.00 H new ATOM 0 HD2 ARG A 238 35.897 -2.978 21.802 1.00 0.00 H new ATOM 0 HD3 ARG A 238 37.641 -2.870 21.932 1.00 0.00 H new ATOM 0 HE ARG A 238 36.781 -4.801 23.849 1.00 0.00 H new ATOM 0 HH11 ARG A 238 36.860 -4.222 20.391 1.00 0.00 H new ATOM 0 HH12 ARG A 238 36.948 -5.936 19.973 1.00 0.00 H new ATOM 0 HH21 ARG A 238 36.890 -7.002 23.303 1.00 0.00 H new ATOM 0 HH22 ARG A 238 36.964 -7.498 21.609 1.00 0.00 H new ATOM 550 N ARG A 239 35.504 2.200 23.659 1.00 0.00 N ATOM 551 CA ARG A 239 35.613 3.603 23.279 1.00 0.00 C ATOM 552 C ARG A 239 36.046 4.447 24.473 1.00 0.00 C ATOM 553 O ARG A 239 36.716 5.467 24.311 1.00 0.00 O ATOM 554 CB ARG A 239 34.268 4.110 22.753 1.00 0.00 C ATOM 555 CG ARG A 239 34.415 5.559 22.281 1.00 0.00 C ATOM 556 CD ARG A 239 33.105 6.020 21.642 1.00 0.00 C ATOM 557 NE ARG A 239 32.863 5.286 20.407 1.00 0.00 N ATOM 558 CZ ARG A 239 31.681 5.333 19.802 1.00 0.00 C ATOM 559 NH1 ARG A 239 30.715 6.044 20.314 1.00 0.00 N ATOM 560 NH2 ARG A 239 31.487 4.668 18.695 1.00 0.00 N ATOM 0 H ARG A 239 34.587 1.785 23.495 1.00 0.00 H new ATOM 0 HA ARG A 239 36.364 3.690 22.494 1.00 0.00 H new ATOM 0 HB2 ARG A 239 33.928 3.482 21.930 1.00 0.00 H new ATOM 0 HB3 ARG A 239 33.512 4.047 23.536 1.00 0.00 H new ATOM 0 HG2 ARG A 239 34.668 6.203 23.123 1.00 0.00 H new ATOM 0 HG3 ARG A 239 35.231 5.638 21.562 1.00 0.00 H new ATOM 0 HD2 ARG A 239 32.279 5.863 22.335 1.00 0.00 H new ATOM 0 HD3 ARG A 239 33.149 7.089 21.436 1.00 0.00 H new ATOM 0 HE ARG A 239 33.613 4.727 20.000 1.00 0.00 H new ATOM 0 HH11 ARG A 239 30.867 6.564 21.178 1.00 0.00 H new ATOM 0 HH12 ARG A 239 29.807 6.080 19.850 1.00 0.00 H new ATOM 0 HH21 ARG A 239 32.243 4.112 18.295 1.00 0.00 H new ATOM 0 HH22 ARG A 239 30.580 4.704 18.231 1.00 0.00 H new ATOM 574 N GLN A 240 35.655 4.021 25.668 1.00 0.00 N ATOM 575 CA GLN A 240 36.006 4.755 26.878 1.00 0.00 C ATOM 576 C GLN A 240 37.512 4.989 26.938 1.00 0.00 C ATOM 577 O GLN A 240 37.964 6.089 27.260 1.00 0.00 O ATOM 578 CB GLN A 240 35.566 3.963 28.113 1.00 0.00 C ATOM 579 CG GLN A 240 35.731 4.829 29.365 1.00 0.00 C ATOM 580 CD GLN A 240 34.715 5.965 29.349 1.00 0.00 C ATOM 581 OE1 GLN A 240 33.548 5.750 29.021 1.00 0.00 O ATOM 582 NE2 GLN A 240 35.090 7.170 29.677 1.00 0.00 N ATOM 0 H GLN A 240 35.100 3.180 25.825 1.00 0.00 H new ATOM 0 HA GLN A 240 35.496 5.718 26.860 1.00 0.00 H new ATOM 0 HB2 GLN A 240 34.526 3.653 28.007 1.00 0.00 H new ATOM 0 HB3 GLN A 240 36.161 3.055 28.206 1.00 0.00 H new ATOM 0 HG2 GLN A 240 35.595 4.220 30.259 1.00 0.00 H new ATOM 0 HG3 GLN A 240 36.742 5.234 29.406 1.00 0.00 H new ATOM 0 HE21 GLN A 240 36.057 7.347 29.949 1.00 0.00 H new ATOM 0 HE22 GLN A 240 34.416 7.936 29.662 1.00 0.00 H new ATOM 591 N PHE A 241 38.284 3.958 26.617 1.00 0.00 N ATOM 592 CA PHE A 241 39.739 4.072 26.630 1.00 0.00 C ATOM 593 C PHE A 241 40.205 5.062 25.568 1.00 0.00 C ATOM 594 O PHE A 241 41.101 5.871 25.810 1.00 0.00 O ATOM 595 CB PHE A 241 40.372 2.706 26.373 1.00 0.00 C ATOM 596 CG PHE A 241 40.174 1.820 27.581 1.00 0.00 C ATOM 597 CD1 PHE A 241 41.120 1.827 28.614 1.00 0.00 C ATOM 598 CD2 PHE A 241 39.048 0.995 27.667 1.00 0.00 C ATOM 599 CE1 PHE A 241 40.937 1.006 29.734 1.00 0.00 C ATOM 600 CE2 PHE A 241 38.865 0.175 28.787 1.00 0.00 C ATOM 601 CZ PHE A 241 39.810 0.180 29.820 1.00 0.00 C ATOM 0 H PHE A 241 37.932 3.040 26.346 1.00 0.00 H new ATOM 0 HA PHE A 241 40.050 4.435 27.610 1.00 0.00 H new ATOM 0 HB2 PHE A 241 39.922 2.245 25.494 1.00 0.00 H new ATOM 0 HB3 PHE A 241 41.436 2.820 26.164 1.00 0.00 H new ATOM 0 HD1 PHE A 241 41.989 2.464 28.547 1.00 0.00 H new ATOM 0 HD2 PHE A 241 38.320 0.990 26.870 1.00 0.00 H new ATOM 0 HE1 PHE A 241 41.665 1.010 30.531 1.00 0.00 H new ATOM 0 HE2 PHE A 241 37.995 -0.461 28.854 1.00 0.00 H new ATOM 0 HZ PHE A 241 39.670 -0.453 30.683 1.00 0.00 H new ATOM 611 N HIS A 242 39.584 4.998 24.395 1.00 0.00 N ATOM 612 CA HIS A 242 39.937 5.901 23.306 1.00 0.00 C ATOM 613 C HIS A 242 39.651 7.344 23.707 1.00 0.00 C ATOM 614 O HIS A 242 40.379 8.261 23.327 1.00 0.00 O ATOM 615 CB HIS A 242 39.138 5.547 22.050 1.00 0.00 C ATOM 616 CG HIS A 242 39.553 6.449 20.920 1.00 0.00 C ATOM 617 ND1 HIS A 242 39.020 7.717 20.754 1.00 0.00 N ATOM 618 CD2 HIS A 242 40.445 6.280 19.891 1.00 0.00 C ATOM 619 CE1 HIS A 242 39.590 8.259 19.662 1.00 0.00 C ATOM 620 NE2 HIS A 242 40.468 7.424 19.098 1.00 0.00 N ATOM 0 H HIS A 242 38.840 4.336 24.175 1.00 0.00 H new ATOM 0 HA HIS A 242 41.001 5.794 23.095 1.00 0.00 H new ATOM 0 HB2 HIS A 242 39.309 4.505 21.779 1.00 0.00 H new ATOM 0 HB3 HIS A 242 38.071 5.655 22.243 1.00 0.00 H new ATOM 0 HD2 HIS A 242 41.039 5.394 19.722 1.00 0.00 H new ATOM 0 HE1 HIS A 242 39.366 9.247 19.288 1.00 0.00 H new ATOM 0 HE2 HIS A 242 41.033 7.589 18.265 1.00 0.00 H new ATOM 628 N GLN A 243 38.581 7.536 24.471 1.00 0.00 N ATOM 629 CA GLN A 243 38.200 8.872 24.913 1.00 0.00 C ATOM 630 C GLN A 243 39.269 9.452 25.835 1.00 0.00 C ATOM 631 O GLN A 243 39.455 10.667 25.897 1.00 0.00 O ATOM 632 CB GLN A 243 36.861 8.815 25.654 1.00 0.00 C ATOM 633 CG GLN A 243 36.352 10.238 25.907 1.00 0.00 C ATOM 634 CD GLN A 243 35.954 10.892 24.589 1.00 0.00 C ATOM 635 OE1 GLN A 243 35.309 10.260 23.752 1.00 0.00 O ATOM 636 NE2 GLN A 243 36.310 12.124 24.347 1.00 0.00 N ATOM 0 H GLN A 243 37.966 6.789 24.795 1.00 0.00 H new ATOM 0 HA GLN A 243 38.102 9.513 24.037 1.00 0.00 H new ATOM 0 HB2 GLN A 243 36.132 8.256 25.066 1.00 0.00 H new ATOM 0 HB3 GLN A 243 36.980 8.287 26.600 1.00 0.00 H new ATOM 0 HG2 GLN A 243 35.497 10.212 26.582 1.00 0.00 H new ATOM 0 HG3 GLN A 243 37.127 10.829 26.396 1.00 0.00 H new ATOM 0 HE21 GLN A 243 36.844 12.646 25.041 1.00 0.00 H new ATOM 0 HE22 GLN A 243 36.054 12.565 23.463 1.00 0.00 H new ATOM 645 N GLU A 244 39.965 8.578 26.552 1.00 0.00 N ATOM 646 CA GLU A 244 41.010 9.017 27.471 1.00 0.00 C ATOM 647 C GLU A 244 42.166 9.649 26.699 1.00 0.00 C ATOM 648 O GLU A 244 42.739 10.649 27.127 1.00 0.00 O ATOM 649 CB GLU A 244 41.526 7.826 28.282 1.00 0.00 C ATOM 650 CG GLU A 244 42.434 8.327 29.409 1.00 0.00 C ATOM 651 CD GLU A 244 41.598 9.026 30.476 1.00 0.00 C ATOM 652 OE1 GLU A 244 40.383 8.990 30.369 1.00 0.00 O ATOM 653 OE2 GLU A 244 42.186 9.586 31.386 1.00 0.00 O ATOM 0 H GLU A 244 39.827 7.568 26.516 1.00 0.00 H new ATOM 0 HA GLU A 244 40.588 9.760 28.147 1.00 0.00 H new ATOM 0 HB2 GLU A 244 40.688 7.266 28.698 1.00 0.00 H new ATOM 0 HB3 GLU A 244 42.076 7.143 27.635 1.00 0.00 H new ATOM 0 HG2 GLU A 244 42.977 7.491 29.850 1.00 0.00 H new ATOM 0 HG3 GLU A 244 43.179 9.015 29.009 1.00 0.00 H new ATOM 660 N ILE A 245 42.504 9.056 25.559 1.00 0.00 N ATOM 661 CA ILE A 245 43.595 9.567 24.735 1.00 0.00 C ATOM 662 C ILE A 245 43.264 10.966 24.222 1.00 0.00 C ATOM 663 O ILE A 245 44.114 11.856 24.225 1.00 0.00 O ATOM 664 CB ILE A 245 43.841 8.626 23.554 1.00 0.00 C ATOM 665 CG1 ILE A 245 44.391 7.294 24.074 1.00 0.00 C ATOM 666 CG2 ILE A 245 44.863 9.256 22.601 1.00 0.00 C ATOM 667 CD1 ILE A 245 44.343 6.252 22.956 1.00 0.00 C ATOM 0 H ILE A 245 42.042 8.227 25.186 1.00 0.00 H new ATOM 0 HA ILE A 245 44.497 9.622 25.345 1.00 0.00 H new ATOM 0 HB ILE A 245 42.904 8.456 23.024 1.00 0.00 H new ATOM 0 HG12 ILE A 245 45.416 7.423 24.422 1.00 0.00 H new ATOM 0 HG13 ILE A 245 43.804 6.954 24.928 1.00 0.00 H new ATOM 0 HG21 ILE A 245 45.038 8.585 21.760 1.00 0.00 H new ATOM 0 HG22 ILE A 245 44.479 10.207 22.233 1.00 0.00 H new ATOM 0 HG23 ILE A 245 45.800 9.424 23.132 1.00 0.00 H new ATOM 0 HD11 ILE A 245 44.734 5.304 23.325 1.00 0.00 H new ATOM 0 HD12 ILE A 245 43.312 6.116 22.629 1.00 0.00 H new ATOM 0 HD13 ILE A 245 44.948 6.592 22.116 1.00 0.00 H new ATOM 679 N GLN A 246 42.026 11.152 23.777 1.00 0.00 N ATOM 680 CA GLN A 246 41.602 12.448 23.256 1.00 0.00 C ATOM 681 C GLN A 246 41.705 13.515 24.341 1.00 0.00 C ATOM 682 O GLN A 246 42.048 14.663 24.063 1.00 0.00 O ATOM 683 CB GLN A 246 40.156 12.362 22.762 1.00 0.00 C ATOM 684 CG GLN A 246 39.740 13.710 22.165 1.00 0.00 C ATOM 685 CD GLN A 246 38.345 13.604 21.560 1.00 0.00 C ATOM 686 OE1 GLN A 246 37.864 12.503 21.293 1.00 0.00 O ATOM 687 NE2 GLN A 246 37.660 14.692 21.331 1.00 0.00 N ATOM 0 H GLN A 246 41.305 10.431 23.766 1.00 0.00 H new ATOM 0 HA GLN A 246 42.255 12.720 22.427 1.00 0.00 H new ATOM 0 HB2 GLN A 246 40.062 11.576 22.013 1.00 0.00 H new ATOM 0 HB3 GLN A 246 39.494 12.097 23.586 1.00 0.00 H new ATOM 0 HG2 GLN A 246 39.753 14.479 22.938 1.00 0.00 H new ATOM 0 HG3 GLN A 246 40.455 14.015 21.400 1.00 0.00 H new ATOM 0 HE21 GLN A 246 38.061 15.603 21.553 1.00 0.00 H new ATOM 0 HE22 GLN A 246 36.724 14.631 20.930 1.00 0.00 H new ATOM 696 N SER A 247 41.405 13.129 25.575 1.00 0.00 N ATOM 697 CA SER A 247 41.465 14.063 26.693 1.00 0.00 C ATOM 698 C SER A 247 42.907 14.467 26.977 1.00 0.00 C ATOM 699 O SER A 247 43.165 15.356 27.789 1.00 0.00 O ATOM 700 CB SER A 247 40.857 13.425 27.942 1.00 0.00 C ATOM 701 OG SER A 247 39.469 13.202 27.729 1.00 0.00 O ATOM 0 H SER A 247 41.120 12.183 25.826 1.00 0.00 H new ATOM 0 HA SER A 247 40.895 14.954 26.427 1.00 0.00 H new ATOM 0 HB2 SER A 247 41.358 12.483 28.164 1.00 0.00 H new ATOM 0 HB3 SER A 247 41.004 14.075 28.805 1.00 0.00 H new ATOM 0 HG SER A 247 39.348 12.417 27.155 1.00 0.00 H new ATOM 707 N ARG A 248 43.843 13.808 26.302 1.00 0.00 N ATOM 708 CA ARG A 248 45.258 14.106 26.491 1.00 0.00 C ATOM 709 C ARG A 248 45.544 15.558 26.124 1.00 0.00 C ATOM 710 O ARG A 248 46.300 16.245 26.810 1.00 0.00 O ATOM 711 CB ARG A 248 46.110 13.176 25.626 1.00 0.00 C ATOM 712 CG ARG A 248 47.593 13.425 25.911 1.00 0.00 C ATOM 713 CD ARG A 248 48.441 12.479 25.063 1.00 0.00 C ATOM 714 NE ARG A 248 49.853 12.628 25.402 1.00 0.00 N ATOM 715 CZ ARG A 248 50.401 11.936 26.397 1.00 0.00 C ATOM 716 NH1 ARG A 248 49.671 11.106 27.092 1.00 0.00 N ATOM 717 NH2 ARG A 248 51.665 12.087 26.679 1.00 0.00 N ATOM 0 H ARG A 248 43.650 13.070 25.625 1.00 0.00 H new ATOM 0 HA ARG A 248 45.511 13.949 27.540 1.00 0.00 H new ATOM 0 HB2 ARG A 248 45.859 12.136 25.836 1.00 0.00 H new ATOM 0 HB3 ARG A 248 45.898 13.349 24.571 1.00 0.00 H new ATOM 0 HG2 ARG A 248 47.849 14.460 25.686 1.00 0.00 H new ATOM 0 HG3 ARG A 248 47.802 13.268 26.969 1.00 0.00 H new ATOM 0 HD2 ARG A 248 48.126 11.449 25.229 1.00 0.00 H new ATOM 0 HD3 ARG A 248 48.289 12.692 24.005 1.00 0.00 H new ATOM 0 HE ARG A 248 50.431 13.275 24.865 1.00 0.00 H new ATOM 0 HH11 ARG A 248 48.682 10.989 26.872 1.00 0.00 H new ATOM 0 HH12 ARG A 248 50.090 10.575 27.855 1.00 0.00 H new ATOM 0 HH21 ARG A 248 52.235 12.736 26.136 1.00 0.00 H new ATOM 0 HH22 ARG A 248 52.084 11.556 27.442 1.00 0.00 H new