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 53.982 9.126 4.445 1.00 0.00 N ATOM 227 CA TRP A 45 55.367 9.366 4.796 1.00 0.00 C ATOM 228 C TRP A 45 56.043 7.998 4.931 1.00 0.00 C ATOM 229 O TRP A 45 55.563 7.092 5.624 1.00 0.00 O ATOM 230 CB TRP A 45 55.557 10.232 6.087 1.00 0.00 C ATOM 231 CG TRP A 45 57.008 10.526 6.481 1.00 0.00 C ATOM 232 CD1 TRP A 45 57.839 9.722 7.210 1.00 0.00 C ATOM 233 CD2 TRP A 45 57.788 11.695 6.143 1.00 0.00 C ATOM 234 NE1 TRP A 45 59.083 10.285 7.329 1.00 0.00 N ATOM 235 CE2 TRP A 45 59.078 11.497 6.684 1.00 0.00 C ATOM 236 CE3 TRP A 45 57.477 12.854 5.442 1.00 0.00 C ATOM 237 CZ2 TRP A 45 60.080 12.437 6.524 1.00 0.00 C ATOM 238 CZ3 TRP A 45 58.487 13.811 5.300 1.00 0.00 C ATOM 239 CH2 TRP A 45 59.769 13.601 5.820 1.00 0.00 C ATOM 0 HA TRP A 45 55.829 9.961 4.008 1.00 0.00 H new ATOM 0 HB2 TRP A 45 55.039 11.180 5.946 1.00 0.00 H new ATOM 0 HB3 TRP A 45 55.070 9.723 6.919 1.00 0.00 H new ATOM 0 HD1 TRP A 45 57.554 8.771 7.635 1.00 0.00 H new ATOM 0 HE1 TRP A 45 59.879 9.873 7.815 1.00 0.00 H new ATOM 0 HE3 TRP A 45 56.494 13.010 5.023 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 61.068 12.276 6.930 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 58.273 14.732 4.778 1.00 0.00 H new ATOM 0 HH2 TRP A 45 60.531 14.353 5.674 1.00 0.00 H new ATOM 250 N ARG A 46 57.221 7.874 4.258 1.00 0.00 N ATOM 251 CA ARG A 46 58.133 6.732 4.241 1.00 0.00 C ATOM 252 C ARG A 46 59.057 7.052 5.406 1.00 0.00 C ATOM 253 O ARG A 46 59.950 7.899 5.283 1.00 0.00 O ATOM 254 CB ARG A 46 58.885 6.524 2.871 1.00 0.00 C ATOM 255 CG ARG A 46 59.932 5.384 2.801 1.00 0.00 C ATOM 256 CD ARG A 46 60.609 5.269 1.416 1.00 0.00 C ATOM 257 NE ARG A 46 61.788 4.327 1.472 1.00 0.00 N ATOM 258 CZ ARG A 46 61.738 2.960 1.364 1.00 0.00 C ATOM 259 NH1 ARG A 46 60.571 2.256 1.315 1.00 0.00 N ATOM 260 NH2 ARG A 46 62.913 2.264 1.297 1.00 0.00 N ATOM 0 H ARG A 46 57.569 8.635 3.675 1.00 0.00 H new ATOM 0 HA ARG A 46 57.621 5.775 4.343 1.00 0.00 H new ATOM 0 HB2 ARG A 46 58.137 6.342 2.100 1.00 0.00 H new ATOM 0 HB3 ARG A 46 59.386 7.458 2.616 1.00 0.00 H new ATOM 0 HG2 ARG A 46 60.696 5.553 3.560 1.00 0.00 H new ATOM 0 HG3 ARG A 46 59.447 4.438 3.042 1.00 0.00 H new ATOM 0 HD2 ARG A 46 59.887 4.912 0.682 1.00 0.00 H new ATOM 0 HD3 ARG A 46 60.940 6.253 1.085 1.00 0.00 H new ATOM 0 HE ARG A 46 62.709 4.747 1.602 1.00 0.00 H new ATOM 0 HH11 ARG A 46 59.678 2.746 1.359 1.00 0.00 H new ATOM 0 HH12 ARG A 46 60.592 1.239 1.234 1.00 0.00 H new ATOM 0 HH21 ARG A 46 63.803 2.762 1.328 1.00 0.00 H new ATOM 0 HH22 ARG A 46 62.900 1.247 1.216 1.00 0.00 H new ATOM 274 N GLU A 47 58.819 6.366 6.573 1.00 0.00 N ATOM 275 CA GLU A 47 59.586 6.518 7.812 1.00 0.00 C ATOM 276 C GLU A 47 60.794 5.607 7.613 1.00 0.00 C ATOM 277 O GLU A 47 60.829 4.474 8.107 1.00 0.00 O ATOM 278 CB GLU A 47 58.780 6.232 9.132 1.00 0.00 C ATOM 279 CG GLU A 47 59.505 6.637 10.442 1.00 0.00 C ATOM 280 CD GLU A 47 58.630 6.340 11.665 1.00 0.00 C ATOM 281 OE1 GLU A 47 57.601 7.045 11.854 1.00 0.00 O ATOM 282 OE2 GLU A 47 58.990 5.411 12.436 1.00 0.00 O ATOM 0 H GLU A 47 58.067 5.682 6.657 1.00 0.00 H new ATOM 0 HA GLU A 47 59.874 7.557 7.973 1.00 0.00 H new ATOM 0 HB2 GLU A 47 57.829 6.762 9.082 1.00 0.00 H new ATOM 0 HB3 GLU A 47 58.549 5.168 9.176 1.00 0.00 H new ATOM 0 HG2 GLU A 47 60.447 6.095 10.524 1.00 0.00 H new ATOM 0 HG3 GLU A 47 59.750 7.699 10.414 1.00 0.00 H new ATOM 289 N ARG A 48 61.776 6.139 6.814 1.00 0.00 N ATOM 290 CA ARG A 48 63.042 5.573 6.312 1.00 0.00 C ATOM 291 C ARG A 48 63.150 4.055 6.523 1.00 0.00 C ATOM 292 O ARG A 48 63.933 3.568 7.347 1.00 0.00 O ATOM 293 CB ARG A 48 64.289 6.405 6.786 1.00 0.00 C ATOM 294 CG ARG A 48 65.585 6.228 5.959 1.00 0.00 C ATOM 295 CD ARG A 48 65.545 6.807 4.529 1.00 0.00 C ATOM 296 NE ARG A 48 66.823 6.400 3.836 1.00 0.00 N ATOM 297 CZ ARG A 48 67.449 7.063 2.811 1.00 0.00 C ATOM 298 NH1 ARG A 48 66.980 8.228 2.280 1.00 0.00 N ATOM 299 NH2 ARG A 48 68.599 6.524 2.302 1.00 0.00 N ATOM 0 H ARG A 48 61.669 7.095 6.474 1.00 0.00 H new ATOM 0 HA ARG A 48 63.035 5.678 5.227 1.00 0.00 H new ATOM 0 HB2 ARG A 48 64.019 7.461 6.778 1.00 0.00 H new ATOM 0 HB3 ARG A 48 64.504 6.139 7.821 1.00 0.00 H new ATOM 0 HG2 ARG A 48 66.407 6.697 6.499 1.00 0.00 H new ATOM 0 HG3 ARG A 48 65.812 5.164 5.895 1.00 0.00 H new ATOM 0 HD2 ARG A 48 64.678 6.429 3.987 1.00 0.00 H new ATOM 0 HD3 ARG A 48 65.454 7.893 4.558 1.00 0.00 H new ATOM 0 HE ARG A 48 67.267 5.543 4.164 1.00 0.00 H new ATOM 0 HH11 ARG A 48 66.125 8.647 2.645 1.00 0.00 H new ATOM 0 HH12 ARG A 48 67.485 8.681 1.518 1.00 0.00 H new ATOM 0 HH21 ARG A 48 68.967 5.653 2.685 1.00 0.00 H new ATOM 0 HH22 ARG A 48 69.088 6.993 1.540 1.00 0.00 H new