USER MOD reduce.3.24.130724 H: found=0, std=0, add=265, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 266 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 217 SER OG : rot 180:sc= 0 USER MOD Single : A 218 LYS NZ :NH3+ 160:sc= -0.102 (180deg=-0.642) USER MOD Single : A 222 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 -103:sc= 0.0933 USER MOD Single : A 237 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 240 GLN : amide:sc= -0.164 X(o=-0.16,f=-0.24) USER MOD Single : A 242 HIS : no HD1:sc= -0.0356 X(o=-0.036,f=-0.17) USER MOD Single : A 243 GLN : amide:sc= -0.976 X(o=-0.98,f=-1.4!) USER MOD Single : A 246 GLN : amide:sc= -0.263 K(o=-0.26,f=-0.97) USER MOD Single : A 247 SER OG : rot -98:sc= 0.883 USER MOD ----------------------------------------------------------------- ATOM 175 N SER A 217 24.453 13.339 36.992 1.00 0.00 N ATOM 176 CA SER A 217 25.128 14.042 35.910 1.00 0.00 C ATOM 177 C SER A 217 26.161 13.134 35.247 1.00 0.00 C ATOM 178 O SER A 217 26.352 13.176 34.036 1.00 0.00 O ATOM 179 CB SER A 217 25.808 15.302 36.443 1.00 0.00 C ATOM 180 OG SER A 217 26.061 16.193 35.363 1.00 0.00 O ATOM 0 HA SER A 217 24.384 14.328 35.166 1.00 0.00 H new ATOM 0 HB2 SER A 217 25.174 15.785 37.187 1.00 0.00 H new ATOM 0 HB3 SER A 217 26.742 15.042 36.941 1.00 0.00 H new ATOM 0 HG SER A 217 26.496 17.003 35.702 1.00 0.00 H new ATOM 186 N LYS A 218 26.832 12.323 36.058 1.00 0.00 N ATOM 187 CA LYS A 218 27.852 11.417 35.542 1.00 0.00 C ATOM 188 C LYS A 218 27.241 10.437 34.542 1.00 0.00 C ATOM 189 O LYS A 218 27.822 10.169 33.491 1.00 0.00 O ATOM 190 CB LYS A 218 28.494 10.639 36.692 1.00 0.00 C ATOM 191 CG LYS A 218 29.646 9.788 36.151 1.00 0.00 C ATOM 192 CD LYS A 218 30.328 9.057 37.309 1.00 0.00 C ATOM 193 CE LYS A 218 31.487 8.217 36.770 1.00 0.00 C ATOM 194 NZ LYS A 218 32.494 9.111 36.132 1.00 0.00 N ATOM 0 H LYS A 218 26.690 12.274 37.067 1.00 0.00 H new ATOM 0 HA LYS A 218 28.614 12.010 35.036 1.00 0.00 H new ATOM 0 HB2 LYS A 218 28.863 11.329 37.451 1.00 0.00 H new ATOM 0 HB3 LYS A 218 27.752 10.002 37.173 1.00 0.00 H new ATOM 0 HG2 LYS A 218 29.270 9.068 35.424 1.00 0.00 H new ATOM 0 HG3 LYS A 218 30.366 10.420 35.631 1.00 0.00 H new ATOM 0 HD2 LYS A 218 30.696 9.776 38.041 1.00 0.00 H new ATOM 0 HD3 LYS A 218 29.610 8.418 37.823 1.00 0.00 H new ATOM 0 HE2 LYS A 218 31.948 7.652 37.580 1.00 0.00 H new ATOM 0 HE3 LYS A 218 31.118 7.491 36.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 218 33.408 8.618 36.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 218 32.175 9.366 35.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 218 32.603 9.974 36.702 1.00 0.00 H new ATOM 208 N ASP A 219 26.069 9.908 34.875 1.00 0.00 N ATOM 209 CA ASP A 219 25.396 8.962 33.993 1.00 0.00 C ATOM 210 C ASP A 219 25.027 9.637 32.676 1.00 0.00 C ATOM 211 O ASP A 219 25.149 9.042 31.605 1.00 0.00 O ATOM 212 CB ASP A 219 24.131 8.427 34.664 1.00 0.00 C ATOM 213 CG ASP A 219 24.504 7.466 35.789 1.00 0.00 C ATOM 214 OD1 ASP A 219 25.646 7.039 35.823 1.00 0.00 O ATOM 215 OD2 ASP A 219 23.642 7.177 36.603 1.00 0.00 O ATOM 0 H ASP A 219 25.570 10.115 35.740 1.00 0.00 H new ATOM 0 HA ASP A 219 26.075 8.134 33.791 1.00 0.00 H new ATOM 0 HB2 ASP A 219 23.542 9.254 35.061 1.00 0.00 H new ATOM 0 HB3 ASP A 219 23.508 7.916 33.930 1.00 0.00 H new ATOM 220 N GLU A 220 24.576 10.884 32.764 1.00 0.00 N ATOM 221 CA GLU A 220 24.196 11.629 31.571 1.00 0.00 C ATOM 222 C GLU A 220 25.408 11.850 30.674 1.00 0.00 C ATOM 223 O GLU A 220 25.322 11.712 29.452 1.00 0.00 O ATOM 224 CB GLU A 220 23.603 12.986 31.969 1.00 0.00 C ATOM 225 CG GLU A 220 22.265 12.772 32.681 1.00 0.00 C ATOM 226 CD GLU A 220 21.701 14.110 33.146 1.00 0.00 C ATOM 227 OE1 GLU A 220 22.337 15.119 32.891 1.00 0.00 O ATOM 228 OE2 GLU A 220 20.641 14.105 33.749 1.00 0.00 O ATOM 0 H GLU A 220 24.466 11.395 33.640 1.00 0.00 H new ATOM 0 HA GLU A 220 23.450 11.051 31.025 1.00 0.00 H new ATOM 0 HB2 GLU A 220 24.294 13.518 32.623 1.00 0.00 H new ATOM 0 HB3 GLU A 220 23.460 13.606 31.084 1.00 0.00 H new ATOM 0 HG2 GLU A 220 21.559 12.285 32.008 1.00 0.00 H new ATOM 0 HG3 GLU A 220 22.400 12.109 33.535 1.00 0.00 H new ATOM 235 N ILE A 221 26.537 12.186 31.289 1.00 0.00 N ATOM 236 CA ILE A 221 27.766 12.416 30.541 1.00 0.00 C ATOM 237 C ILE A 221 28.223 11.136 29.845 1.00 0.00 C ATOM 238 O ILE A 221 28.635 11.166 28.687 1.00 0.00 O ATOM 239 CB ILE A 221 28.868 12.911 31.486 1.00 0.00 C ATOM 240 CG1 ILE A 221 28.510 14.312 31.992 1.00 0.00 C ATOM 241 CG2 ILE A 221 30.202 12.969 30.736 1.00 0.00 C ATOM 242 CD1 ILE A 221 29.445 14.692 33.140 1.00 0.00 C ATOM 0 H ILE A 221 26.626 12.304 32.298 1.00 0.00 H new ATOM 0 HA ILE A 221 27.570 13.174 29.783 1.00 0.00 H new ATOM 0 HB ILE A 221 28.956 12.226 32.329 1.00 0.00 H new ATOM 0 HG12 ILE A 221 28.598 15.036 31.182 1.00 0.00 H new ATOM 0 HG13 ILE A 221 27.474 14.335 32.330 1.00 0.00 H new ATOM 0 HG21 ILE A 221 30.983 13.321 31.410 1.00 0.00 H new ATOM 0 HG22 ILE A 221 30.458 11.974 30.372 1.00 0.00 H new ATOM 0 HG23 ILE A 221 30.115 13.653 29.892 1.00 0.00 H new ATOM 0 HD11 ILE A 221 29.191 15.689 33.501 1.00 0.00 H new ATOM 0 HD12 ILE A 221 29.335 13.973 33.952 1.00 0.00 H new ATOM 0 HD13 ILE A 221 30.476 14.686 32.787 1.00 0.00 H new ATOM 254 N LYS A 222 28.156 10.022 30.564 1.00 0.00 N ATOM 255 CA LYS A 222 28.572 8.741 30.008 1.00 0.00 C ATOM 256 C LYS A 222 27.693 8.360 28.821 1.00 0.00 C ATOM 257 O LYS A 222 28.189 7.921 27.784 1.00 0.00 O ATOM 258 CB LYS A 222 28.479 7.655 31.080 1.00 0.00 C ATOM 259 CG LYS A 222 29.030 6.339 30.526 1.00 0.00 C ATOM 260 CD LYS A 222 28.992 5.268 31.619 1.00 0.00 C ATOM 261 CE LYS A 222 29.562 3.958 31.072 1.00 0.00 C ATOM 262 NZ LYS A 222 29.543 2.922 32.143 1.00 0.00 N ATOM 0 H LYS A 222 27.820 9.980 31.526 1.00 0.00 H new ATOM 0 HA LYS A 222 29.603 8.832 29.667 1.00 0.00 H new ATOM 0 HB2 LYS A 222 29.042 7.953 31.964 1.00 0.00 H new ATOM 0 HB3 LYS A 222 27.443 7.525 31.391 1.00 0.00 H new ATOM 0 HG2 LYS A 222 28.440 6.018 29.667 1.00 0.00 H new ATOM 0 HG3 LYS A 222 30.052 6.480 30.175 1.00 0.00 H new ATOM 0 HD2 LYS A 222 29.570 5.595 32.483 1.00 0.00 H new ATOM 0 HD3 LYS A 222 27.967 5.117 31.959 1.00 0.00 H new ATOM 0 HE2 LYS A 222 28.975 3.623 30.217 1.00 0.00 H new ATOM 0 HE3 LYS A 222 30.581 4.112 30.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 222 29.930 2.031 31.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 222 30.121 3.242 32.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 222 28.564 2.768 32.460 1.00 0.00 H new ATOM 276 N ARG A 223 26.385 8.533 28.979 1.00 0.00 N ATOM 277 CA ARG A 223 25.443 8.204 27.915 1.00 0.00 C ATOM 278 C ARG A 223 25.665 9.102 26.703 1.00 0.00 C ATOM 279 O ARG A 223 25.544 8.659 25.560 1.00 0.00 O ATOM 280 CB ARG A 223 24.009 8.364 28.419 1.00 0.00 C ATOM 281 CG ARG A 223 23.688 7.244 29.409 1.00 0.00 C ATOM 282 CD ARG A 223 22.268 7.428 29.947 1.00 0.00 C ATOM 283 NE ARG A 223 21.942 6.361 30.888 1.00 0.00 N ATOM 284 CZ ARG A 223 20.685 6.120 31.242 1.00 0.00 C ATOM 285 NH1 ARG A 223 19.718 6.842 30.746 1.00 0.00 N ATOM 286 NH2 ARG A 223 20.418 5.161 32.085 1.00 0.00 N ATOM 0 H ARG A 223 25.955 8.897 29.829 1.00 0.00 H new ATOM 0 HA ARG A 223 25.608 7.169 27.617 1.00 0.00 H new ATOM 0 HB2 ARG A 223 23.888 9.335 28.900 1.00 0.00 H new ATOM 0 HB3 ARG A 223 23.312 8.334 27.581 1.00 0.00 H new ATOM 0 HG2 ARG A 223 23.780 6.274 28.919 1.00 0.00 H new ATOM 0 HG3 ARG A 223 24.404 7.255 30.231 1.00 0.00 H new ATOM 0 HD2 ARG A 223 22.181 8.396 30.440 1.00 0.00 H new ATOM 0 HD3 ARG A 223 21.556 7.425 29.122 1.00 0.00 H new ATOM 0 HE ARG A 223 22.692 5.791 31.280 1.00 0.00 H new ATOM 0 HH11 ARG A 223 19.928 7.591 30.086 1.00 0.00 H new ATOM 0 HH12 ARG A 223 18.752 6.657 31.018 1.00 0.00 H new ATOM 0 HH21 ARG A 223 21.175 4.597 32.472 1.00 0.00 H new ATOM 0 HH22 ARG A 223 19.453 4.975 32.357 1.00 0.00 H new ATOM 300 N GLU A 224 25.983 10.365 26.962 1.00 0.00 N ATOM 301 CA GLU A 224 26.211 11.321 25.884 1.00 0.00 C ATOM 302 C GLU A 224 27.120 10.719 24.820 1.00 0.00 C ATOM 303 O GLU A 224 26.822 10.787 23.627 1.00 0.00 O ATOM 304 CB GLU A 224 26.857 12.592 26.446 1.00 0.00 C ATOM 305 CG GLU A 224 26.975 13.639 25.337 1.00 0.00 C ATOM 306 CD GLU A 224 27.569 14.926 25.898 1.00 0.00 C ATOM 307 OE1 GLU A 224 28.051 14.894 27.018 1.00 0.00 O ATOM 308 OE2 GLU A 224 27.534 15.926 25.198 1.00 0.00 O ATOM 0 H GLU A 224 26.088 10.749 27.901 1.00 0.00 H new ATOM 0 HA GLU A 224 25.251 11.567 25.430 1.00 0.00 H new ATOM 0 HB2 GLU A 224 26.258 12.984 27.268 1.00 0.00 H new ATOM 0 HB3 GLU A 224 27.843 12.363 26.851 1.00 0.00 H new ATOM 0 HG2 GLU A 224 27.604 13.259 24.532 1.00 0.00 H new ATOM 0 HG3 GLU A 224 25.993 13.839 24.908 1.00 0.00 H new ATOM 315 N TYR A 225 28.223 10.124 25.258 1.00 0.00 N ATOM 316 CA TYR A 225 29.164 9.506 24.333 1.00 0.00 C ATOM 317 C TYR A 225 28.507 8.342 23.597 1.00 0.00 C ATOM 318 O TYR A 225 28.697 8.170 22.395 1.00 0.00 O ATOM 319 CB TYR A 225 30.393 9.004 25.094 1.00 0.00 C ATOM 320 CG TYR A 225 31.182 10.184 25.610 1.00 0.00 C ATOM 321 CD1 TYR A 225 32.023 10.897 24.746 1.00 0.00 C ATOM 322 CD2 TYR A 225 31.074 10.566 26.953 1.00 0.00 C ATOM 323 CE1 TYR A 225 32.754 11.990 25.225 1.00 0.00 C ATOM 324 CE2 TYR A 225 31.805 11.660 27.431 1.00 0.00 C ATOM 325 CZ TYR A 225 32.645 12.371 26.567 1.00 0.00 C ATOM 326 OH TYR A 225 33.367 13.449 27.038 1.00 0.00 O ATOM 0 H TYR A 225 28.486 10.057 26.241 1.00 0.00 H new ATOM 0 HA TYR A 225 29.471 10.255 23.603 1.00 0.00 H new ATOM 0 HB2 TYR A 225 30.085 8.368 25.924 1.00 0.00 H new ATOM 0 HB3 TYR A 225 31.016 8.395 24.439 1.00 0.00 H new ATOM 0 HD1 TYR A 225 32.107 10.603 23.710 1.00 0.00 H new ATOM 0 HD2 TYR A 225 30.427 10.016 27.620 1.00 0.00 H new ATOM 0 HE1 TYR A 225 33.402 12.540 24.559 1.00 0.00 H new ATOM 0 HE2 TYR A 225 31.721 11.955 28.466 1.00 0.00 H new ATOM 0 HH TYR A 225 33.176 13.580 27.990 1.00 0.00 H new ATOM 336 N LYS A 226 27.733 7.546 24.327 1.00 0.00 N ATOM 337 CA LYS A 226 27.052 6.403 23.730 1.00 0.00 C ATOM 338 C LYS A 226 26.038 6.866 22.688 1.00 0.00 C ATOM 339 O LYS A 226 25.913 6.266 21.620 1.00 0.00 O ATOM 340 CB LYS A 226 26.338 5.595 24.814 1.00 0.00 C ATOM 341 CG LYS A 226 27.374 4.911 25.709 1.00 0.00 C ATOM 342 CD LYS A 226 26.664 4.210 26.871 1.00 0.00 C ATOM 343 CE LYS A 226 25.989 2.931 26.367 1.00 0.00 C ATOM 344 NZ LYS A 226 25.609 2.081 27.528 1.00 0.00 N ATOM 0 H LYS A 226 27.562 7.669 25.325 1.00 0.00 H new ATOM 0 HA LYS A 226 27.798 5.776 23.241 1.00 0.00 H new ATOM 0 HB2 LYS A 226 25.702 6.249 25.411 1.00 0.00 H new ATOM 0 HB3 LYS A 226 25.688 4.849 24.357 1.00 0.00 H new ATOM 0 HG2 LYS A 226 27.948 4.187 25.131 1.00 0.00 H new ATOM 0 HG3 LYS A 226 28.081 5.647 26.092 1.00 0.00 H new ATOM 0 HD2 LYS A 226 27.381 3.969 27.656 1.00 0.00 H new ATOM 0 HD3 LYS A 226 25.921 4.876 27.311 1.00 0.00 H new ATOM 0 HE2 LYS A 226 25.105 3.180 25.780 1.00 0.00 H new ATOM 0 HE3 LYS A 226 26.665 2.385 25.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 226 25.150 1.212 27.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 226 26.461 1.833 28.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 226 24.949 2.603 28.139 1.00 0.00 H new ATOM 358 N GLU A 227 25.315 7.935 23.006 1.00 0.00 N ATOM 359 CA GLU A 227 24.314 8.469 22.090 1.00 0.00 C ATOM 360 C GLU A 227 24.979 9.008 20.828 1.00 0.00 C ATOM 361 O GLU A 227 24.439 8.878 19.728 1.00 0.00 O ATOM 362 CB GLU A 227 23.529 9.590 22.778 1.00 0.00 C ATOM 363 CG GLU A 227 22.735 9.013 23.952 1.00 0.00 C ATOM 364 CD GLU A 227 21.651 8.072 23.437 1.00 0.00 C ATOM 365 OE1 GLU A 227 21.297 8.186 22.276 1.00 0.00 O ATOM 366 OE2 GLU A 227 21.192 7.249 24.211 1.00 0.00 O ATOM 0 H GLU A 227 25.402 8.445 23.885 1.00 0.00 H new ATOM 0 HA GLU A 227 23.632 7.666 21.811 1.00 0.00 H new ATOM 0 HB2 GLU A 227 24.212 10.362 23.132 1.00 0.00 H new ATOM 0 HB3 GLU A 227 22.853 10.064 22.067 1.00 0.00 H new ATOM 0 HG2 GLU A 227 23.404 8.477 24.625 1.00 0.00 H new ATOM 0 HG3 GLU A 227 22.283 9.821 24.528 1.00 0.00 H new ATOM 373 N MET A 228 26.148 9.620 20.992 1.00 0.00 N ATOM 374 CA MET A 228 26.869 10.181 19.852 1.00 0.00 C ATOM 375 C MET A 228 27.194 9.088 18.835 1.00 0.00 C ATOM 376 O MET A 228 26.878 9.218 17.652 1.00 0.00 O ATOM 377 CB MET A 228 28.171 10.830 20.331 1.00 0.00 C ATOM 378 CG MET A 228 28.841 11.554 19.161 1.00 0.00 C ATOM 379 SD MET A 228 30.407 12.275 19.714 1.00 0.00 S ATOM 380 CE MET A 228 29.777 13.927 20.099 1.00 0.00 C ATOM 0 H MET A 228 26.613 9.740 21.892 1.00 0.00 H new ATOM 0 HA MET A 228 26.237 10.931 19.377 1.00 0.00 H new ATOM 0 HB2 MET A 228 27.964 11.534 21.137 1.00 0.00 H new ATOM 0 HB3 MET A 228 28.841 10.071 20.735 1.00 0.00 H new ATOM 0 HG2 MET A 228 29.018 10.857 18.342 1.00 0.00 H new ATOM 0 HG3 MET A 228 28.184 12.335 18.778 1.00 0.00 H new ATOM 0 HE1 MET A 228 30.592 14.551 20.465 1.00 0.00 H new ATOM 0 HE2 MET A 228 29.353 14.374 19.199 1.00 0.00 H new ATOM 0 HE3 MET A 228 29.005 13.853 20.865 1.00 0.00 H new ATOM 390 N GLU A 229 27.819 8.012 19.302 1.00 0.00 N ATOM 391 CA GLU A 229 28.172 6.906 18.416 1.00 0.00 C ATOM 392 C GLU A 229 26.921 6.165 17.957 1.00 0.00 C ATOM 393 O GLU A 229 26.734 5.928 16.764 1.00 0.00 O ATOM 394 CB GLU A 229 29.106 5.934 19.146 1.00 0.00 C ATOM 395 CG GLU A 229 30.526 6.504 19.171 1.00 0.00 C ATOM 396 CD GLU A 229 30.559 7.783 19.998 1.00 0.00 C ATOM 397 OE1 GLU A 229 30.774 7.687 21.194 1.00 0.00 O ATOM 398 OE2 GLU A 229 30.362 8.841 19.422 1.00 0.00 O ATOM 0 H GLU A 229 28.089 7.882 20.277 1.00 0.00 H new ATOM 0 HA GLU A 229 28.679 7.312 17.541 1.00 0.00 H new ATOM 0 HB2 GLU A 229 28.752 5.769 20.164 1.00 0.00 H new ATOM 0 HB3 GLU A 229 29.101 4.965 18.646 1.00 0.00 H new ATOM 0 HG2 GLU A 229 31.214 5.771 19.592 1.00 0.00 H new ATOM 0 HG3 GLU A 229 30.862 6.709 18.155 1.00 0.00 H new ATOM 405 N GLY A 230 26.070 5.801 18.911 1.00 0.00 N ATOM 406 CA GLY A 230 24.838 5.086 18.591 1.00 0.00 C ATOM 407 C GLY A 230 25.095 3.980 17.573 1.00 0.00 C ATOM 408 O GLY A 230 24.776 4.120 16.395 1.00 0.00 O ATOM 0 H GLY A 230 26.208 5.987 19.904 1.00 0.00 H new ATOM 0 HA2 GLY A 230 24.416 4.657 19.500 1.00 0.00 H new ATOM 0 HA3 GLY A 230 24.100 5.784 18.196 1.00 0.00 H new ATOM 437 N GLU A 233 27.348 -1.512 20.931 1.00 0.00 N ATOM 438 CA GLU A 233 26.694 -1.948 22.158 1.00 0.00 C ATOM 439 C GLU A 233 27.723 -2.366 23.197 1.00 0.00 C ATOM 440 O GLU A 233 27.663 -1.950 24.355 1.00 0.00 O ATOM 441 CB GLU A 233 25.760 -3.124 21.861 1.00 0.00 C ATOM 442 CG GLU A 233 24.590 -2.639 21.002 1.00 0.00 C ATOM 443 CD GLU A 233 23.695 -3.816 20.627 1.00 0.00 C ATOM 444 OE1 GLU A 233 23.936 -4.901 21.129 1.00 0.00 O ATOM 445 OE2 GLU A 233 22.789 -3.616 19.835 1.00 0.00 O ATOM 0 HA GLU A 233 26.116 -1.113 22.554 1.00 0.00 H new ATOM 0 HB2 GLU A 233 26.304 -3.913 21.342 1.00 0.00 H new ATOM 0 HB3 GLU A 233 25.389 -3.552 22.792 1.00 0.00 H new ATOM 0 HG2 GLU A 233 24.013 -1.892 21.547 1.00 0.00 H new ATOM 0 HG3 GLU A 233 24.966 -2.156 20.100 1.00 0.00 H new ATOM 452 N ILE A 234 28.677 -3.196 22.778 1.00 0.00 N ATOM 453 CA ILE A 234 29.725 -3.668 23.682 1.00 0.00 C ATOM 454 C ILE A 234 31.044 -2.962 23.390 1.00 0.00 C ATOM 455 O ILE A 234 31.869 -2.775 24.285 1.00 0.00 O ATOM 456 CB ILE A 234 29.903 -5.179 23.524 1.00 0.00 C ATOM 457 CG1 ILE A 234 28.617 -5.891 23.953 1.00 0.00 C ATOM 458 CG2 ILE A 234 31.062 -5.651 24.407 1.00 0.00 C ATOM 459 CD1 ILE A 234 28.687 -7.361 23.540 1.00 0.00 C ATOM 0 H ILE A 234 28.746 -3.554 21.825 1.00 0.00 H new ATOM 0 HA ILE A 234 29.428 -3.442 24.706 1.00 0.00 H new ATOM 0 HB ILE A 234 30.120 -5.412 22.481 1.00 0.00 H new ATOM 0 HG12 ILE A 234 28.487 -5.811 25.032 1.00 0.00 H new ATOM 0 HG13 ILE A 234 27.753 -5.413 23.492 1.00 0.00 H new ATOM 0 HG21 ILE A 234 31.190 -6.728 24.295 1.00 0.00 H new ATOM 0 HG22 ILE A 234 31.979 -5.144 24.106 1.00 0.00 H new ATOM 0 HG23 ILE A 234 30.844 -5.418 25.449 1.00 0.00 H new ATOM 0 HD11 ILE A 234 27.772 -7.869 23.845 1.00 0.00 H new ATOM 0 HD12 ILE A 234 28.797 -7.430 22.458 1.00 0.00 H new ATOM 0 HD13 ILE A 234 29.542 -7.834 24.022 1.00 0.00 H new ATOM 471 N LYS A 235 31.239 -2.575 22.134 1.00 0.00 N ATOM 472 CA LYS A 235 32.464 -1.896 21.737 1.00 0.00 C ATOM 473 C LYS A 235 32.536 -0.510 22.369 1.00 0.00 C ATOM 474 O LYS A 235 33.568 0.160 22.307 1.00 0.00 O ATOM 475 CB LYS A 235 32.525 -1.769 20.213 1.00 0.00 C ATOM 476 CG LYS A 235 32.634 -3.160 19.587 1.00 0.00 C ATOM 477 CD LYS A 235 32.896 -3.025 18.085 1.00 0.00 C ATOM 478 CE LYS A 235 31.654 -2.458 17.392 1.00 0.00 C ATOM 479 NZ LYS A 235 31.758 -2.685 15.925 1.00 0.00 N ATOM 0 H LYS A 235 30.569 -2.719 21.379 1.00 0.00 H new ATOM 0 HA LYS A 235 33.312 -2.487 22.084 1.00 0.00 H new ATOM 0 HB2 LYS A 235 31.633 -1.262 19.844 1.00 0.00 H new ATOM 0 HB3 LYS A 235 33.381 -1.160 19.923 1.00 0.00 H new ATOM 0 HG2 LYS A 235 33.441 -3.720 20.059 1.00 0.00 H new ATOM 0 HG3 LYS A 235 31.715 -3.720 19.758 1.00 0.00 H new ATOM 0 HD2 LYS A 235 33.751 -2.371 17.913 1.00 0.00 H new ATOM 0 HD3 LYS A 235 33.148 -3.997 17.662 1.00 0.00 H new ATOM 0 HE2 LYS A 235 30.756 -2.937 17.782 1.00 0.00 H new ATOM 0 HE3 LYS A 235 31.563 -1.392 17.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 235 30.915 -2.300 15.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 235 32.607 -2.208 15.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 235 31.825 -3.705 15.736 1.00 0.00 H new ATOM 493 N SER A 236 31.433 -0.089 22.977 1.00 0.00 N ATOM 494 CA SER A 236 31.379 1.218 23.622 1.00 0.00 C ATOM 495 C SER A 236 32.334 1.274 24.808 1.00 0.00 C ATOM 496 O SER A 236 32.945 2.308 25.074 1.00 0.00 O ATOM 497 CB SER A 236 29.955 1.505 24.099 1.00 0.00 C ATOM 498 OG SER A 236 29.553 0.492 25.011 1.00 0.00 O ATOM 0 H SER A 236 30.570 -0.629 23.037 1.00 0.00 H new ATOM 0 HA SER A 236 31.679 1.972 22.894 1.00 0.00 H new ATOM 0 HB2 SER A 236 29.910 2.482 24.580 1.00 0.00 H new ATOM 0 HB3 SER A 236 29.274 1.536 23.249 1.00 0.00 H new ATOM 0 HG SER A 236 28.953 -0.137 24.558 1.00 0.00 H new ATOM 504 N LYS A 237 32.459 0.158 25.517 1.00 0.00 N ATOM 505 CA LYS A 237 33.345 0.093 26.674 1.00 0.00 C ATOM 506 C LYS A 237 34.793 0.318 26.251 1.00 0.00 C ATOM 507 O LYS A 237 35.542 1.021 26.923 1.00 0.00 O ATOM 508 CB LYS A 237 33.212 -1.266 27.358 1.00 0.00 C ATOM 509 CG LYS A 237 34.049 -1.276 28.640 1.00 0.00 C ATOM 510 CD LYS A 237 33.789 -2.571 29.412 1.00 0.00 C ATOM 511 CE LYS A 237 34.381 -3.758 28.647 1.00 0.00 C ATOM 512 NZ LYS A 237 34.516 -4.923 29.564 1.00 0.00 N ATOM 0 H LYS A 237 31.962 -0.709 25.313 1.00 0.00 H new ATOM 0 HA LYS A 237 33.058 0.878 27.374 1.00 0.00 H new ATOM 0 HB2 LYS A 237 32.166 -1.467 27.592 1.00 0.00 H new ATOM 0 HB3 LYS A 237 33.546 -2.057 26.687 1.00 0.00 H new ATOM 0 HG2 LYS A 237 35.108 -1.193 28.396 1.00 0.00 H new ATOM 0 HG3 LYS A 237 33.796 -0.415 29.258 1.00 0.00 H new ATOM 0 HD2 LYS A 237 34.233 -2.509 30.405 1.00 0.00 H new ATOM 0 HD3 LYS A 237 32.717 -2.714 29.551 1.00 0.00 H new ATOM 0 HE2 LYS A 237 33.740 -4.017 27.804 1.00 0.00 H new ATOM 0 HE3 LYS A 237 35.355 -3.490 28.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 237 34.918 -5.729 29.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 237 35.144 -4.672 30.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 237 33.580 -5.183 29.935 1.00 0.00 H new ATOM 526 N ARG A 238 35.180 -0.285 25.135 1.00 0.00 N ATOM 527 CA ARG A 238 36.539 -0.146 24.633 1.00 0.00 C ATOM 528 C ARG A 238 36.821 1.307 24.253 1.00 0.00 C ATOM 529 O ARG A 238 37.923 1.811 24.469 1.00 0.00 O ATOM 530 CB ARG A 238 36.744 -1.047 23.413 1.00 0.00 C ATOM 531 CG ARG A 238 38.206 -0.980 22.963 1.00 0.00 C ATOM 532 CD ARG A 238 38.389 -1.820 21.701 1.00 0.00 C ATOM 533 NE ARG A 238 38.122 -3.226 21.985 1.00 0.00 N ATOM 534 CZ ARG A 238 39.058 -4.014 22.507 1.00 0.00 C ATOM 535 NH1 ARG A 238 40.242 -3.530 22.776 1.00 0.00 N ATOM 536 NH2 ARG A 238 38.794 -5.266 22.750 1.00 0.00 N ATOM 0 H ARG A 238 34.574 -0.873 24.562 1.00 0.00 H new ATOM 0 HA ARG A 238 37.230 -0.446 25.421 1.00 0.00 H new ATOM 0 HB2 ARG A 238 36.475 -2.075 23.658 1.00 0.00 H new ATOM 0 HB3 ARG A 238 36.089 -0.731 22.601 1.00 0.00 H new ATOM 0 HG2 ARG A 238 38.491 0.054 22.769 1.00 0.00 H new ATOM 0 HG3 ARG A 238 38.859 -1.347 23.755 1.00 0.00 H new ATOM 0 HD2 ARG A 238 37.717 -1.466 20.920 1.00 0.00 H new ATOM 0 HD3 ARG A 238 39.405 -1.705 21.324 1.00 0.00 H new ATOM 0 HE ARG A 238 37.200 -3.612 21.779 1.00 0.00 H new ATOM 0 HH11 ARG A 238 40.447 -2.549 22.586 1.00 0.00 H new ATOM 0 HH12 ARG A 238 40.961 -4.133 23.176 1.00 0.00 H new ATOM 0 HH21 ARG A 238 37.870 -5.642 22.540 1.00 0.00 H new ATOM 0 HH22 ARG A 238 39.512 -5.870 23.150 1.00 0.00 H new ATOM 550 N ARG A 239 35.829 1.968 23.674 1.00 0.00 N ATOM 551 CA ARG A 239 35.991 3.356 23.254 1.00 0.00 C ATOM 552 C ARG A 239 36.348 4.236 24.441 1.00 0.00 C ATOM 553 O ARG A 239 37.089 5.207 24.299 1.00 0.00 O ATOM 554 CB ARG A 239 34.689 3.856 22.621 1.00 0.00 C ATOM 555 CG ARG A 239 34.407 3.085 21.326 1.00 0.00 C ATOM 556 CD ARG A 239 35.174 3.722 20.163 1.00 0.00 C ATOM 557 NE ARG A 239 34.961 2.962 18.943 1.00 0.00 N ATOM 558 CZ ARG A 239 35.766 3.107 17.897 1.00 0.00 C ATOM 559 NH1 ARG A 239 36.766 3.944 17.957 1.00 0.00 N ATOM 560 NH2 ARG A 239 35.558 2.415 16.813 1.00 0.00 N ATOM 0 H ARG A 239 34.909 1.571 23.484 1.00 0.00 H new ATOM 0 HA ARG A 239 36.799 3.407 22.525 1.00 0.00 H new ATOM 0 HB2 ARG A 239 33.862 3.726 23.319 1.00 0.00 H new ATOM 0 HB3 ARG A 239 34.763 4.923 22.410 1.00 0.00 H new ATOM 0 HG2 ARG A 239 34.704 2.042 21.441 1.00 0.00 H new ATOM 0 HG3 ARG A 239 33.338 3.091 21.114 1.00 0.00 H new ATOM 0 HD2 ARG A 239 34.844 4.751 20.021 1.00 0.00 H new ATOM 0 HD3 ARG A 239 36.238 3.758 20.396 1.00 0.00 H new ATOM 0 HE ARG A 239 34.181 2.307 18.889 1.00 0.00 H new ATOM 0 HH11 ARG A 239 36.928 4.485 18.806 1.00 0.00 H new ATOM 0 HH12 ARG A 239 37.386 4.057 17.155 1.00 0.00 H new ATOM 0 HH21 ARG A 239 34.776 1.761 16.767 1.00 0.00 H new ATOM 0 HH22 ARG A 239 36.177 2.527 16.010 1.00 0.00 H new ATOM 574 N GLN A 240 35.815 3.894 25.607 1.00 0.00 N ATOM 575 CA GLN A 240 36.086 4.674 26.810 1.00 0.00 C ATOM 576 C GLN A 240 37.579 4.954 26.939 1.00 0.00 C ATOM 577 O GLN A 240 37.982 6.073 27.254 1.00 0.00 O ATOM 578 CB GLN A 240 35.602 3.909 28.045 1.00 0.00 C ATOM 579 CG GLN A 240 34.087 3.703 27.960 1.00 0.00 C ATOM 580 CD GLN A 240 33.369 5.045 28.036 1.00 0.00 C ATOM 581 OE1 GLN A 240 33.598 5.819 28.965 1.00 0.00 O ATOM 582 NE2 GLN A 240 32.512 5.370 27.107 1.00 0.00 N ATOM 0 H GLN A 240 35.200 3.092 25.746 1.00 0.00 H new ATOM 0 HA GLN A 240 35.554 5.622 26.736 1.00 0.00 H new ATOM 0 HB2 GLN A 240 36.107 2.945 28.110 1.00 0.00 H new ATOM 0 HB3 GLN A 240 35.854 4.462 28.950 1.00 0.00 H new ATOM 0 HG2 GLN A 240 33.833 3.199 27.028 1.00 0.00 H new ATOM 0 HG3 GLN A 240 33.754 3.058 28.773 1.00 0.00 H new ATOM 0 HE21 GLN A 240 32.324 4.726 26.338 1.00 0.00 H new ATOM 0 HE22 GLN A 240 32.030 6.268 27.150 1.00 0.00 H new ATOM 591 N PHE A 241 38.393 3.937 26.687 1.00 0.00 N ATOM 592 CA PHE A 241 39.841 4.094 26.771 1.00 0.00 C ATOM 593 C PHE A 241 40.345 5.071 25.714 1.00 0.00 C ATOM 594 O PHE A 241 41.238 5.877 25.976 1.00 0.00 O ATOM 595 CB PHE A 241 40.528 2.740 26.584 1.00 0.00 C ATOM 596 CG PHE A 241 40.229 1.853 27.771 1.00 0.00 C ATOM 597 CD1 PHE A 241 40.998 1.960 28.935 1.00 0.00 C ATOM 598 CD2 PHE A 241 39.184 0.924 27.705 1.00 0.00 C ATOM 599 CE1 PHE A 241 40.723 1.139 30.035 1.00 0.00 C ATOM 600 CE2 PHE A 241 38.908 0.102 28.803 1.00 0.00 C ATOM 601 CZ PHE A 241 39.678 0.209 29.969 1.00 0.00 C ATOM 0 H PHE A 241 38.080 3.002 26.425 1.00 0.00 H new ATOM 0 HA PHE A 241 40.082 4.492 27.757 1.00 0.00 H new ATOM 0 HB2 PHE A 241 40.179 2.267 25.666 1.00 0.00 H new ATOM 0 HB3 PHE A 241 41.604 2.878 26.482 1.00 0.00 H new ATOM 0 HD1 PHE A 241 41.804 2.677 28.985 1.00 0.00 H new ATOM 0 HD2 PHE A 241 38.591 0.842 26.806 1.00 0.00 H new ATOM 0 HE1 PHE A 241 41.316 1.223 30.934 1.00 0.00 H new ATOM 0 HE2 PHE A 241 38.102 -0.615 28.752 1.00 0.00 H new ATOM 0 HZ PHE A 241 39.466 -0.426 30.817 1.00 0.00 H new ATOM 611 N HIS A 242 39.770 4.998 24.519 1.00 0.00 N ATOM 612 CA HIS A 242 40.174 5.883 23.432 1.00 0.00 C ATOM 613 C HIS A 242 39.799 7.328 23.751 1.00 0.00 C ATOM 614 O HIS A 242 40.487 8.264 23.343 1.00 0.00 O ATOM 615 CB HIS A 242 39.506 5.455 22.123 1.00 0.00 C ATOM 616 CG HIS A 242 40.084 4.142 21.667 1.00 0.00 C ATOM 617 ND1 HIS A 242 39.289 3.112 21.189 1.00 0.00 N ATOM 618 CD2 HIS A 242 41.374 3.675 21.609 1.00 0.00 C ATOM 619 CE1 HIS A 242 40.099 2.088 20.866 1.00 0.00 C ATOM 620 NE2 HIS A 242 41.381 2.379 21.103 1.00 0.00 N ATOM 0 H HIS A 242 39.028 4.341 24.279 1.00 0.00 H new ATOM 0 HA HIS A 242 41.256 5.815 23.320 1.00 0.00 H new ATOM 0 HB2 HIS A 242 38.430 5.360 22.266 1.00 0.00 H new ATOM 0 HB3 HIS A 242 39.660 6.217 21.359 1.00 0.00 H new ATOM 0 HD2 HIS A 242 42.250 4.230 21.910 1.00 0.00 H new ATOM 0 HE1 HIS A 242 39.755 1.146 20.464 1.00 0.00 H new ATOM 0 HE2 HIS A 242 42.191 1.780 20.947 1.00 0.00 H new ATOM 628 N GLN A 243 38.700 7.502 24.479 1.00 0.00 N ATOM 629 CA GLN A 243 38.237 8.836 24.844 1.00 0.00 C ATOM 630 C GLN A 243 39.225 9.510 25.789 1.00 0.00 C ATOM 631 O GLN A 243 39.314 10.738 25.837 1.00 0.00 O ATOM 632 CB GLN A 243 36.866 8.748 25.515 1.00 0.00 C ATOM 633 CG GLN A 243 35.824 8.295 24.491 1.00 0.00 C ATOM 634 CD GLN A 243 34.468 8.123 25.165 1.00 0.00 C ATOM 635 OE1 GLN A 243 34.324 8.418 26.353 1.00 0.00 O ATOM 636 NE2 GLN A 243 33.460 7.660 24.480 1.00 0.00 N ATOM 0 H GLN A 243 38.117 6.741 24.826 1.00 0.00 H new ATOM 0 HA GLN A 243 38.159 9.432 23.935 1.00 0.00 H new ATOM 0 HB2 GLN A 243 36.902 8.046 26.348 1.00 0.00 H new ATOM 0 HB3 GLN A 243 36.588 9.718 25.927 1.00 0.00 H new ATOM 0 HG2 GLN A 243 35.749 9.028 23.688 1.00 0.00 H new ATOM 0 HG3 GLN A 243 36.135 7.354 24.036 1.00 0.00 H new ATOM 0 HE21 GLN A 243 33.580 7.416 23.497 1.00 0.00 H new ATOM 0 HE22 GLN A 243 32.551 7.542 24.927 1.00 0.00 H new ATOM 645 N GLU A 244 39.960 8.703 26.545 1.00 0.00 N ATOM 646 CA GLU A 244 40.935 9.238 27.489 1.00 0.00 C ATOM 647 C GLU A 244 42.075 9.928 26.745 1.00 0.00 C ATOM 648 O GLU A 244 42.515 11.011 27.132 1.00 0.00 O ATOM 649 CB GLU A 244 41.497 8.106 28.350 1.00 0.00 C ATOM 650 CG GLU A 244 40.382 7.527 29.222 1.00 0.00 C ATOM 651 CD GLU A 244 39.921 8.563 30.241 1.00 0.00 C ATOM 652 OE1 GLU A 244 40.767 9.088 30.945 1.00 0.00 O ATOM 653 OE2 GLU A 244 38.730 8.822 30.298 1.00 0.00 O ATOM 0 H GLU A 244 39.901 7.685 26.524 1.00 0.00 H new ATOM 0 HA GLU A 244 40.437 9.969 28.127 1.00 0.00 H new ATOM 0 HB2 GLU A 244 41.919 7.327 27.715 1.00 0.00 H new ATOM 0 HB3 GLU A 244 42.307 8.479 28.977 1.00 0.00 H new ATOM 0 HG2 GLU A 244 39.543 7.222 28.597 1.00 0.00 H new ATOM 0 HG3 GLU A 244 40.738 6.634 29.736 1.00 0.00 H new ATOM 660 N ILE A 245 42.548 9.295 25.677 1.00 0.00 N ATOM 661 CA ILE A 245 43.635 9.862 24.889 1.00 0.00 C ATOM 662 C ILE A 245 43.203 11.179 24.252 1.00 0.00 C ATOM 663 O ILE A 245 43.954 12.152 24.249 1.00 0.00 O ATOM 664 CB ILE A 245 44.058 8.875 23.796 1.00 0.00 C ATOM 665 CG1 ILE A 245 44.698 7.644 24.442 1.00 0.00 C ATOM 666 CG2 ILE A 245 45.074 9.544 22.864 1.00 0.00 C ATOM 667 CD1 ILE A 245 44.863 6.544 23.394 1.00 0.00 C ATOM 0 H ILE A 245 42.200 8.398 25.340 1.00 0.00 H new ATOM 0 HA ILE A 245 44.480 10.053 25.551 1.00 0.00 H new ATOM 0 HB ILE A 245 43.182 8.574 23.222 1.00 0.00 H new ATOM 0 HG12 ILE A 245 45.668 7.906 24.865 1.00 0.00 H new ATOM 0 HG13 ILE A 245 44.077 7.287 25.264 1.00 0.00 H new ATOM 0 HG21 ILE A 245 45.374 8.840 22.087 1.00 0.00 H new ATOM 0 HG22 ILE A 245 44.622 10.422 22.403 1.00 0.00 H new ATOM 0 HG23 ILE A 245 45.950 9.846 23.438 1.00 0.00 H new ATOM 0 HD11 ILE A 245 45.319 5.668 23.855 1.00 0.00 H new ATOM 0 HD12 ILE A 245 43.886 6.276 22.991 1.00 0.00 H new ATOM 0 HD13 ILE A 245 45.502 6.903 22.587 1.00 0.00 H new ATOM 679 N GLN A 246 41.993 11.196 23.705 1.00 0.00 N ATOM 680 CA GLN A 246 41.476 12.395 23.059 1.00 0.00 C ATOM 681 C GLN A 246 41.308 13.519 24.077 1.00 0.00 C ATOM 682 O GLN A 246 41.342 14.697 23.725 1.00 0.00 O ATOM 683 CB GLN A 246 40.129 12.095 22.399 1.00 0.00 C ATOM 684 CG GLN A 246 39.754 13.240 21.456 1.00 0.00 C ATOM 685 CD GLN A 246 40.683 13.240 20.245 1.00 0.00 C ATOM 686 OE1 GLN A 246 40.986 12.180 19.695 1.00 0.00 O ATOM 687 NE2 GLN A 246 41.157 14.370 19.798 1.00 0.00 N ATOM 0 H GLN A 246 41.356 10.399 23.696 1.00 0.00 H new ATOM 0 HA GLN A 246 42.189 12.712 22.298 1.00 0.00 H new ATOM 0 HB2 GLN A 246 40.184 11.158 21.845 1.00 0.00 H new ATOM 0 HB3 GLN A 246 39.359 11.970 23.160 1.00 0.00 H new ATOM 0 HG2 GLN A 246 38.719 13.132 21.132 1.00 0.00 H new ATOM 0 HG3 GLN A 246 39.825 14.193 21.980 1.00 0.00 H new ATOM 0 HE21 GLN A 246 40.904 15.246 20.256 1.00 0.00 H new ATOM 0 HE22 GLN A 246 41.780 14.378 18.991 1.00 0.00 H new ATOM 696 N SER A 247 41.118 13.148 25.340 1.00 0.00 N ATOM 697 CA SER A 247 40.939 14.136 26.397 1.00 0.00 C ATOM 698 C SER A 247 42.232 14.911 26.634 1.00 0.00 C ATOM 699 O SER A 247 42.221 15.986 27.234 1.00 0.00 O ATOM 700 CB SER A 247 40.512 13.447 27.691 1.00 0.00 C ATOM 701 OG SER A 247 41.652 12.872 28.316 1.00 0.00 O ATOM 0 H SER A 247 41.084 12.178 25.654 1.00 0.00 H new ATOM 0 HA SER A 247 40.163 14.834 26.085 1.00 0.00 H new ATOM 0 HB2 SER A 247 40.040 14.166 28.361 1.00 0.00 H new ATOM 0 HB3 SER A 247 39.772 12.676 27.479 1.00 0.00 H new ATOM 0 HG SER A 247 41.701 11.919 28.093 1.00 0.00 H new ATOM 707 N ARG A 248 43.342 14.356 26.160 1.00 0.00 N ATOM 708 CA ARG A 248 44.638 15.003 26.330 1.00 0.00 C ATOM 709 C ARG A 248 44.782 16.177 25.366 1.00 0.00 C ATOM 710 O ARG A 248 45.893 16.599 25.048 1.00 0.00 O ATOM 711 CB ARG A 248 45.762 13.995 26.082 1.00 0.00 C ATOM 712 CG ARG A 248 45.716 12.905 27.154 1.00 0.00 C ATOM 713 CD ARG A 248 46.771 11.841 26.847 1.00 0.00 C ATOM 714 NE ARG A 248 48.108 12.415 26.942 1.00 0.00 N ATOM 715 CZ ARG A 248 49.185 11.712 26.605 1.00 0.00 C ATOM 716 NH1 ARG A 248 49.056 10.486 26.180 1.00 0.00 N ATOM 717 NH2 ARG A 248 50.371 12.249 26.697 1.00 0.00 N ATOM 0 H ARG A 248 43.371 13.468 25.659 1.00 0.00 H new ATOM 0 HA ARG A 248 44.705 15.377 27.352 1.00 0.00 H new ATOM 0 HB2 ARG A 248 45.655 13.551 25.092 1.00 0.00 H new ATOM 0 HB3 ARG A 248 46.728 14.499 26.102 1.00 0.00 H new ATOM 0 HG2 ARG A 248 45.898 13.339 28.137 1.00 0.00 H new ATOM 0 HG3 ARG A 248 44.725 12.452 27.184 1.00 0.00 H new ATOM 0 HD2 ARG A 248 46.674 11.010 27.546 1.00 0.00 H new ATOM 0 HD3 ARG A 248 46.611 11.437 25.847 1.00 0.00 H new ATOM 0 HE ARG A 248 48.219 13.373 27.273 1.00 0.00 H new ATOM 0 HH11 ARG A 248 48.129 10.067 26.106 1.00 0.00 H new ATOM 0 HH12 ARG A 248 49.882 9.946 25.921 1.00 0.00 H new ATOM 0 HH21 ARG A 248 50.472 13.209 27.028 1.00 0.00 H new ATOM 0 HH22 ARG A 248 51.197 11.709 26.438 1.00 0.00 H new