USER MOD reduce.3.24.130724 H: found=0, std=0, add=41, rem=0, adj=0 USER MOD reduce.3.24.130724 removed 42 hydrogens (0 hets) ATOM 226 N TRP A 45 52.813 9.623 4.750 1.00 0.00 N ATOM 227 CA TRP A 45 54.219 9.717 5.125 1.00 0.00 C ATOM 228 C TRP A 45 54.642 8.335 5.601 1.00 0.00 C ATOM 229 O TRP A 45 54.213 7.846 6.653 1.00 0.00 O ATOM 230 CB TRP A 45 54.615 10.795 6.193 1.00 0.00 C ATOM 231 CG TRP A 45 56.130 10.892 6.498 1.00 0.00 C ATOM 232 CD1 TRP A 45 56.895 10.082 7.299 1.00 0.00 C ATOM 233 CD2 TRP A 45 57.047 11.865 5.948 1.00 0.00 C ATOM 234 NE1 TRP A 45 58.210 10.467 7.270 1.00 0.00 N ATOM 235 CE2 TRP A 45 58.330 11.562 6.454 1.00 0.00 C ATOM 236 CE3 TRP A 45 56.857 12.933 5.085 1.00 0.00 C ATOM 237 CZ2 TRP A 45 59.439 12.315 6.109 1.00 0.00 C ATOM 238 CZ3 TRP A 45 57.976 13.699 4.739 1.00 0.00 C ATOM 239 CH2 TRP A 45 59.246 13.395 5.244 1.00 0.00 C ATOM 0 HA TRP A 45 54.744 10.062 4.234 1.00 0.00 H new ATOM 0 HB2 TRP A 45 54.266 11.769 5.850 1.00 0.00 H new ATOM 0 HB3 TRP A 45 54.087 10.576 7.121 1.00 0.00 H new ATOM 0 HD1 TRP A 45 56.512 9.252 7.875 1.00 0.00 H new ATOM 0 HE1 TRP A 45 58.973 10.014 7.772 1.00 0.00 H new ATOM 0 HE3 TRP A 45 55.878 13.166 4.693 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 60.419 12.076 6.495 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 57.858 14.539 4.071 1.00 0.00 H new ATOM 0 HH2 TRP A 45 60.090 14.006 4.960 1.00 0.00 H new ATOM 250 N ARG A 46 55.539 7.713 4.796 1.00 0.00 N ATOM 251 CA ARG A 46 56.168 6.420 5.026 1.00 0.00 C ATOM 252 C ARG A 46 57.382 6.801 5.859 1.00 0.00 C ATOM 253 O ARG A 46 58.340 7.364 5.324 1.00 0.00 O ATOM 254 CB ARG A 46 56.455 5.599 3.715 1.00 0.00 C ATOM 255 CG ARG A 46 57.421 4.386 3.803 1.00 0.00 C ATOM 256 CD ARG A 46 58.879 4.659 3.369 1.00 0.00 C ATOM 257 NE ARG A 46 58.969 4.873 1.879 1.00 0.00 N ATOM 258 CZ ARG A 46 59.649 5.891 1.260 1.00 0.00 C ATOM 259 NH1 ARG A 46 60.323 6.859 1.948 1.00 0.00 N ATOM 260 NH2 ARG A 46 59.628 5.957 -0.104 1.00 0.00 N ATOM 0 H ARG A 46 55.850 8.138 3.923 1.00 0.00 H new ATOM 0 HA ARG A 46 55.530 5.703 5.542 1.00 0.00 H new ATOM 0 HB2 ARG A 46 55.500 5.237 3.334 1.00 0.00 H new ATOM 0 HB3 ARG A 46 56.854 6.289 2.971 1.00 0.00 H new ATOM 0 HG2 ARG A 46 57.429 4.025 4.831 1.00 0.00 H new ATOM 0 HG3 ARG A 46 57.022 3.581 3.186 1.00 0.00 H new ATOM 0 HD2 ARG A 46 59.258 5.538 3.890 1.00 0.00 H new ATOM 0 HD3 ARG A 46 59.511 3.820 3.658 1.00 0.00 H new ATOM 0 HE ARG A 46 58.483 4.204 1.281 1.00 0.00 H new ATOM 0 HH11 ARG A 46 60.335 6.845 2.968 1.00 0.00 H new ATOM 0 HH12 ARG A 46 60.814 7.596 1.442 1.00 0.00 H new ATOM 0 HH21 ARG A 46 59.114 5.258 -0.641 1.00 0.00 H new ATOM 0 HH22 ARG A 46 60.126 6.705 -0.586 1.00 0.00 H new ATOM 274 N GLU A 47 57.340 6.507 7.203 1.00 0.00 N ATOM 275 CA GLU A 47 58.419 6.797 8.155 1.00 0.00 C ATOM 276 C GLU A 47 59.405 5.665 7.920 1.00 0.00 C ATOM 277 O GLU A 47 59.338 4.615 8.568 1.00 0.00 O ATOM 278 CB GLU A 47 57.985 6.964 9.655 1.00 0.00 C ATOM 279 CG GLU A 47 59.081 7.505 10.616 1.00 0.00 C ATOM 280 CD GLU A 47 59.477 8.951 10.289 1.00 0.00 C ATOM 281 OE1 GLU A 47 58.648 9.870 10.529 1.00 0.00 O ATOM 282 OE2 GLU A 47 60.622 9.155 9.802 1.00 0.00 O ATOM 0 H GLU A 47 56.535 6.056 7.639 1.00 0.00 H new ATOM 0 HA GLU A 47 58.847 7.783 7.976 1.00 0.00 H new ATOM 0 HB2 GLU A 47 57.129 7.637 9.694 1.00 0.00 H new ATOM 0 HB3 GLU A 47 57.647 5.997 10.026 1.00 0.00 H new ATOM 0 HG2 GLU A 47 58.719 7.453 11.643 1.00 0.00 H new ATOM 0 HG3 GLU A 47 59.962 6.866 10.555 1.00 0.00 H new ATOM 289 N ARG A 48 60.289 5.902 6.901 1.00 0.00 N ATOM 290 CA ARG A 48 61.302 5.021 6.285 1.00 0.00 C ATOM 291 C ARG A 48 61.124 3.532 6.631 1.00 0.00 C ATOM 292 O ARG A 48 61.879 2.951 7.416 1.00 0.00 O ATOM 293 CB ARG A 48 62.769 5.566 6.349 1.00 0.00 C ATOM 294 CG ARG A 48 63.751 4.960 5.307 1.00 0.00 C ATOM 295 CD ARG A 48 63.470 5.292 3.816 1.00 0.00 C ATOM 296 NE ARG A 48 64.241 6.516 3.367 1.00 0.00 N ATOM 297 CZ ARG A 48 65.499 6.515 2.813 1.00 0.00 C ATOM 298 NH1 ARG A 48 66.250 5.382 2.672 1.00 0.00 N ATOM 299 NH2 ARG A 48 66.021 7.703 2.382 1.00 0.00 N ATOM 0 H ARG A 48 60.300 6.818 6.452 1.00 0.00 H new ATOM 0 HA ARG A 48 61.090 5.057 5.216 1.00 0.00 H new ATOM 0 HB2 ARG A 48 62.743 6.647 6.213 1.00 0.00 H new ATOM 0 HB3 ARG A 48 63.165 5.380 7.347 1.00 0.00 H new ATOM 0 HG2 ARG A 48 64.758 5.301 5.549 1.00 0.00 H new ATOM 0 HG3 ARG A 48 63.745 3.876 5.422 1.00 0.00 H new ATOM 0 HD2 ARG A 48 63.744 4.440 3.194 1.00 0.00 H new ATOM 0 HD3 ARG A 48 62.402 5.460 3.674 1.00 0.00 H new ATOM 0 HE ARG A 48 63.786 7.421 3.486 1.00 0.00 H new ATOM 0 HH11 ARG A 48 65.882 4.484 2.985 1.00 0.00 H new ATOM 0 HH12 ARG A 48 67.179 5.435 2.254 1.00 0.00 H new ATOM 0 HH21 ARG A 48 65.479 8.562 2.475 1.00 0.00 H new ATOM 0 HH22 ARG A 48 66.952 7.730 1.967 1.00 0.00 H new