USER MOD reduce.3.24.130724 H: found=0, std=0, add=56, rem=0, adj=0 USER MOD reduce.3.24.130724 removed 59 hydrogens (46 hets) HETATM 1 C ACB A 1 -0.397 0.368 3.007 1.00 0.00 C HETATM 2 O ACB A 1 -0.877 1.194 3.792 1.00 0.00 O HETATM 3 OXT ACB A 1 -0.672 0.184 1.818 1.00 0.00 O HETATM 4 CA ACB A 1 0.735 -0.551 3.600 1.00 0.00 C HETATM 5 N ACB A 1 1.958 0.248 3.408 1.00 0.00 N HETATM 6 CB ACB A 1 0.731 -1.983 2.958 1.00 0.00 C HETATM 7 CG ACB A 1 1.421 -2.049 1.587 1.00 0.00 C HETATM 8 C4 ACB A 1 1.326 -3.114 3.817 1.00 0.00 C HETATM 9 OD2 ACB A 1 2.642 -1.914 1.484 1.00 0.00 O HETATM 0 HB3 ACB A 1 -0.341 -2.156 2.863 1.00 0.00 H new HETATM 0 HA ACB A 1 0.610 -0.797 4.655 1.00 0.00 H new HETATM 0 H43 ACB A 1 2.368 -2.889 4.044 1.00 0.00 H new HETATM 0 H42 ACB A 1 0.763 -3.200 4.746 1.00 0.00 H new HETATM 0 H41 ACB A 1 1.269 -4.055 3.270 1.00 0.00 H new ATOM 16 N ARG A 2 0.604 -2.311 0.502 1.00 0.00 N ATOM 17 CA ARG A 2 1.098 -2.388 -0.875 1.00 0.00 C ATOM 18 C ARG A 2 0.179 -1.425 -1.670 1.00 0.00 C ATOM 19 O ARG A 2 -0.490 -1.823 -2.622 1.00 0.00 O ATOM 20 CB ARG A 2 1.110 -3.822 -1.433 1.00 0.00 C ATOM 21 CG ARG A 2 2.105 -4.770 -0.734 1.00 0.00 C ATOM 22 CD ARG A 2 2.168 -6.192 -1.336 1.00 0.00 C ATOM 23 NE ARG A 2 0.928 -6.997 -1.177 1.00 0.00 N ATOM 24 CZ ARG A 2 -0.061 -7.204 -2.147 1.00 0.00 C ATOM 25 NH1 ARG A 2 0.042 -6.633 -3.448 1.00 0.00 N ATOM 26 NH2 ARG A 2 -1.193 -8.000 -1.826 1.00 0.00 N ATOM 0 HA ARG A 2 2.145 -2.095 -0.948 1.00 0.00 H new ATOM 0 HB2 ARG A 2 0.107 -4.240 -1.347 1.00 0.00 H new ATOM 0 HB3 ARG A 2 1.349 -3.783 -2.496 1.00 0.00 H new ATOM 0 HG2 ARG A 2 3.100 -4.327 -0.776 1.00 0.00 H new ATOM 0 HG3 ARG A 2 1.835 -4.847 0.319 1.00 0.00 H new ATOM 0 HD2 ARG A 2 2.397 -6.111 -2.399 1.00 0.00 H new ATOM 0 HD3 ARG A 2 2.995 -6.730 -0.872 1.00 0.00 H new ATOM 0 HE ARG A 2 0.783 -7.443 -0.271 1.00 0.00 H new ATOM 0 HH11 ARG A 2 0.849 -6.059 -3.690 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -0.692 -6.798 -4.137 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -1.279 -8.414 -0.898 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -1.920 -8.158 -2.524 1.00 0.00 H new HETATM 40 N3 MFD A 3 0.201 -0.103 -1.250 1.00 0.00 N HETATM 41 C2 MFD A 3 0.215 2.322 -1.830 1.00 0.00 C HETATM 42 C1 MFD A 3 1.709 2.176 -2.150 1.00 0.00 C HETATM 43 O1 MFD A 3 2.074 1.636 -3.196 1.00 0.00 O HETATM 44 C3 MFD A 3 -0.502 0.964 -1.976 1.00 0.00 C HETATM 45 CM2 MFD A 3 -0.341 3.431 -2.747 1.00 0.00 C HETATM 46 C7 MFD A 3 -5.449 0.660 -2.488 1.00 0.00 C HETATM 47 C6 MFD A 3 -4.430 1.068 -1.698 1.00 0.00 C HETATM 48 C5 MFD A 3 -3.053 0.925 -2.272 1.00 0.00 C HETATM 49 C4 MFD A 3 -1.944 1.093 -1.522 1.00 0.00 C HETATM 50 C' MFD A 3 -6.628 2.713 -4.199 1.00 0.00 C HETATM 51 C9 MFD A 3 -7.467 2.116 -3.025 1.00 0.00 C HETATM 52 C8 MFD A 3 -6.938 0.820 -2.316 1.00 0.00 C HETATM 53 C4' MFD A 3 -8.270 6.510 -5.525 1.00 0.00 C HETATM 54 C3' MFD A 3 -8.601 5.325 -6.193 1.00 0.00 C HETATM 55 C2' MFD A 3 -8.068 4.110 -5.763 1.00 0.00 C HETATM 56 C1' MFD A 3 -7.204 4.042 -4.665 1.00 0.00 C HETATM 57 C6' MFD A 3 -6.880 5.234 -4.010 1.00 0.00 C HETATM 58 C5' MFD A 3 -7.404 6.458 -4.427 1.00 0.00 C HETATM 59 O9 MFD A 3 -8.850 1.941 -3.365 1.00 0.00 O HETATM 60 CM9 MFD A 3 -9.769 2.796 -2.701 1.00 0.00 C HETATM 61 CM8 MFD A 3 -7.505 0.590 -0.872 1.00 0.00 C HETATM 62 CM6 MFD A 3 -4.761 1.870 -0.465 1.00 0.00 C HETATM 0 HN31 MFD A 3 1.055 0.108 -0.734 1.00 0.00 H new HETATM 0 HM93 MFD A 3 -9.701 2.638 -1.625 1.00 0.00 H new HETATM 0 HM92 MFD A 3 -9.531 3.835 -2.931 1.00 0.00 H new HETATM 0 HM91 MFD A 3 -10.782 2.573 -3.037 1.00 0.00 H new HETATM 0 HM83 MFD A 3 -7.276 -0.425 -0.549 1.00 0.00 H new HETATM 0 HM82 MFD A 3 -7.048 1.302 -0.184 1.00 0.00 H new HETATM 0 HM81 MFD A 3 -8.585 0.734 -0.878 1.00 0.00 H new HETATM 0 HM63 MFD A 3 -5.276 2.786 -0.754 1.00 0.00 H new HETATM 0 HM62 MFD A 3 -5.405 1.283 0.189 1.00 0.00 H new HETATM 0 HM61 MFD A 3 -3.841 2.122 0.063 1.00 0.00 H new HETATM 0 HM23 MFD A 3 0.186 4.364 -2.550 1.00 0.00 H new HETATM 0 HM22 MFD A 3 -0.198 3.147 -3.790 1.00 0.00 H new HETATM 0 HM21 MFD A 3 -1.405 3.567 -2.550 1.00 0.00 H new HETATM 0 H9 MFD A 3 -7.343 2.901 -2.279 1.00 0.00 H new HETATM 0 H8 MFD A 3 -7.368 -0.032 -2.843 1.00 0.00 H new HETATM 0 H7 MFD A 3 -5.146 0.132 -3.392 1.00 0.00 H new HETATM 0 H6' MFD A 3 -6.204 5.206 -3.156 1.00 0.00 H new HETATM 0 H5' MFD A 3 -7.139 7.373 -3.898 1.00 0.00 H new HETATM 0 H5 MFD A 3 -2.944 0.678 -3.328 1.00 0.00 H new HETATM 0 H4' MFD A 3 -8.682 7.463 -5.857 1.00 0.00 H new HETATM 0 H4 MFD A 3 -2.101 1.350 -0.474 1.00 0.00 H new HETATM 0 H3' MFD A 3 -9.275 5.352 -7.049 1.00 0.00 H new HETATM 0 H3 MFD A 3 -0.493 0.680 -3.028 1.00 0.00 H new HETATM 0 H2' MFD A 3 -8.330 3.195 -6.293 1.00 0.00 H new HETATM 0 H2 MFD A 3 0.044 2.618 -0.795 1.00 0.00 H new HETATM 0 H'2 MFD A 3 -5.596 2.853 -3.878 1.00 0.00 H new HETATM 0 H'1 MFD A 3 -6.610 2.009 -5.031 1.00 0.00 H new HETATM 90 N FGA A 4 2.589 2.669 -1.200 1.00 0.00 N HETATM 91 CA FGA A 4 4.047 2.483 -1.287 1.00 0.00 C HETATM 92 C FGA A 4 4.574 3.957 -1.360 1.00 0.00 C HETATM 93 O FGA A 4 4.973 4.461 -0.307 1.00 0.00 O HETATM 94 CB FGA A 4 4.621 1.544 -0.207 1.00 0.00 C HETATM 95 CG FGA A 4 4.407 1.851 1.289 1.00 0.00 C HETATM 96 CD FGA A 4 5.125 0.833 2.225 1.00 0.00 C HETATM 97 OE1 FGA A 4 5.926 0.037 1.744 1.00 0.00 O HETATM 0 HG3 FGA A 4 4.772 2.855 1.505 1.00 0.00 H new HETATM 0 HG2 FGA A 4 3.339 1.846 1.507 1.00 0.00 H new HETATM 0 HB3 FGA A 4 4.212 0.551 -0.394 1.00 0.00 H new HETATM 0 HB2 FGA A 4 5.697 1.482 -0.372 1.00 0.00 H new HETATM 0 HA FGA A 4 4.391 1.924 -2.157 1.00 0.00 H new HETATM 104 N MDH A 5 4.839 0.864 3.615 1.00 0.00 N HETATM 105 CM MDH A 5 5.403 -0.240 4.403 1.00 0.00 C HETATM 106 CA MDH A 5 3.798 1.675 4.161 1.00 0.00 C HETATM 107 C MDH A 5 2.460 1.039 4.459 1.00 0.00 C HETATM 108 O MDH A 5 1.899 1.225 5.534 1.00 0.00 O HETATM 109 CB MDH A 5 3.993 3.001 4.406 1.00 0.00 C HETATM 110 CG MDH A 5 5.242 3.823 4.209 1.00 0.00 C HETATM 0 HM3 MDH A 5 5.833 0.153 5.324 1.00 0.00 H new HETATM 0 HM2 MDH A 5 4.615 -0.953 4.646 1.00 0.00 H new HETATM 0 HM1 MDH A 5 6.180 -0.740 3.825 1.00 0.00 H new HETATM 0 HG3 MDH A 5 6.047 3.414 4.819 1.00 0.00 H new HETATM 0 HG2 MDH A 5 5.533 3.796 3.159 1.00 0.00 H new HETATM 0 HG1 MDH A 5 5.050 4.854 4.506 1.00 0.00 H new HETATM 0 HB MDH A 5 3.130 3.540 4.797 1.00 0.00 H new TER 118 MDH A 5