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 -0.394 0.385 3.001 1.00 0.00 C HETATM 2 O ACB A 1 -0.874 1.216 3.780 1.00 0.00 O HETATM 3 OXT ACB A 1 -0.664 0.199 1.810 1.00 0.00 O HETATM 4 CA ACB A 1 0.729 -0.539 3.602 1.00 0.00 C HETATM 5 N ACB A 1 1.957 0.251 3.412 1.00 0.00 N HETATM 6 CB ACB A 1 0.720 -1.972 2.963 1.00 0.00 C HETATM 7 CG ACB A 1 1.420 -2.045 1.598 1.00 0.00 C HETATM 8 C4 ACB A 1 1.301 -3.107 3.827 1.00 0.00 C HETATM 9 OD2 ACB A 1 2.642 -1.913 1.504 1.00 0.00 O HETATM 0 HB3 ACB A 1 -0.353 -2.137 2.861 1.00 0.00 H new HETATM 0 HA ACB A 1 0.597 -0.781 4.657 1.00 0.00 H new HETATM 0 H43 ACB A 1 2.343 -2.889 4.061 1.00 0.00 H new HETATM 0 H42 ACB A 1 0.731 -3.188 4.753 1.00 0.00 H new HETATM 0 H41 ACB A 1 1.240 -4.048 3.280 1.00 0.00 H new ATOM 16 N ARG A 2 0.612 -2.306 0.505 1.00 0.00 N ATOM 17 CA ARG A 2 1.119 -2.381 -0.866 1.00 0.00 C ATOM 18 C ARG A 2 0.198 -1.427 -1.670 1.00 0.00 C ATOM 19 O ARG A 2 -0.464 -1.832 -2.624 1.00 0.00 O ATOM 20 CB ARG A 2 1.150 -3.816 -1.421 1.00 0.00 C ATOM 21 CG ARG A 2 2.144 -4.753 -0.704 1.00 0.00 C ATOM 22 CD ARG A 2 2.209 -6.178 -1.301 1.00 0.00 C ATOM 23 NE ARG A 2 2.667 -6.259 -2.712 1.00 0.00 N ATOM 24 CZ ARG A 2 3.994 -6.176 -3.148 1.00 0.00 C ATOM 25 NH1 ARG A 2 5.069 -6.015 -2.227 1.00 0.00 N ATOM 26 NH2 ARG A 2 4.275 -6.254 -4.538 1.00 0.00 N ATOM 0 HA ARG A 2 2.164 -2.079 -0.931 1.00 0.00 H new ATOM 0 HB2 ARG A 2 0.150 -4.243 -1.348 1.00 0.00 H new ATOM 0 HB3 ARG A 2 1.404 -3.778 -2.480 1.00 0.00 H new ATOM 0 HG2 ARG A 2 3.139 -4.309 -0.743 1.00 0.00 H new ATOM 0 HG3 ARG A 2 1.867 -4.823 0.348 1.00 0.00 H new ATOM 0 HD2 ARG A 2 2.876 -6.781 -0.685 1.00 0.00 H new ATOM 0 HD3 ARG A 2 1.218 -6.628 -1.232 1.00 0.00 H new ATOM 0 HE ARG A 2 1.950 -6.386 -3.427 1.00 0.00 H new ATOM 0 HH11 ARG A 2 4.879 -5.958 -1.226 1.00 0.00 H new ATOM 0 HH12 ARG A 2 6.028 -5.957 -2.568 1.00 0.00 H new ATOM 0 HH21 ARG A 2 3.513 -6.369 -5.207 1.00 0.00 H new ATOM 0 HH22 ARG A 2 5.238 -6.195 -4.868 1.00 0.00 H new HETATM 40 N3 MFD A 3 0.211 -0.104 -1.253 1.00 0.00 N HETATM 41 C2 MFD A 3 0.209 2.320 -1.832 1.00 0.00 C HETATM 42 C1 MFD A 3 1.704 2.185 -2.153 1.00 0.00 C HETATM 43 O1 MFD A 3 2.073 1.658 -3.203 1.00 0.00 O HETATM 44 C3 MFD A 3 -0.497 0.957 -1.983 1.00 0.00 C HETATM 45 CM2 MFD A 3 -0.356 3.427 -2.747 1.00 0.00 C HETATM 46 C7 MFD A 3 -5.406 0.537 -2.565 1.00 0.00 C HETATM 47 C6 MFD A 3 -4.437 1.022 -1.756 1.00 0.00 C HETATM 48 C5 MFD A 3 -3.044 0.895 -2.296 1.00 0.00 C HETATM 49 C4 MFD A 3 -1.942 1.073 -1.537 1.00 0.00 C HETATM 50 C' MFD A 3 -7.294 2.621 -3.795 1.00 0.00 C HETATM 51 C9 MFD A 3 -7.396 1.089 -3.902 1.00 0.00 C HETATM 52 C8 MFD A 3 -6.915 0.486 -2.547 1.00 0.00 C HETATM 53 C4' MFD A 3 -8.418 4.680 -7.445 1.00 0.00 C HETATM 54 C3' MFD A 3 -9.401 4.162 -6.594 1.00 0.00 C HETATM 55 C2' MFD A 3 -9.031 3.503 -5.422 1.00 0.00 C HETATM 56 C1' MFD A 3 -7.687 3.343 -5.070 1.00 0.00 C HETATM 57 C6' MFD A 3 -6.716 3.867 -5.929 1.00 0.00 C HETATM 58 C5' MFD A 3 -7.069 4.529 -7.105 1.00 0.00 C HETATM 59 O9 MFD A 3 -6.740 0.649 -5.108 1.00 0.00 O HETATM 60 CM9 MFD A 3 -7.128 -0.641 -5.552 1.00 0.00 C HETATM 61 CM8 MFD A 3 -7.679 1.015 -1.295 1.00 0.00 C HETATM 62 CM6 MFD A 3 -4.801 1.726 -0.464 1.00 0.00 C HETATM 0 HN31 MFD A 3 1.061 0.115 -0.733 1.00 0.00 H new HETATM 0 HM93 MFD A 3 -6.898 -1.376 -4.780 1.00 0.00 H new HETATM 0 HM92 MFD A 3 -8.199 -0.650 -5.753 1.00 0.00 H new HETATM 0 HM91 MFD A 3 -6.585 -0.890 -6.464 1.00 0.00 H new HETATM 0 HM83 MFD A 3 -7.378 0.444 -0.417 1.00 0.00 H new HETATM 0 HM82 MFD A 3 -7.442 2.068 -1.142 1.00 0.00 H new HETATM 0 HM81 MFD A 3 -8.752 0.904 -1.450 1.00 0.00 H new HETATM 0 HM63 MFD A 3 -5.416 2.599 -0.686 1.00 0.00 H new HETATM 0 HM62 MFD A 3 -5.358 1.043 0.178 1.00 0.00 H new HETATM 0 HM61 MFD A 3 -3.892 2.043 0.046 1.00 0.00 H new HETATM 0 HM23 MFD A 3 0.165 4.364 -2.549 1.00 0.00 H new HETATM 0 HM22 MFD A 3 -0.212 3.146 -3.790 1.00 0.00 H new HETATM 0 HM21 MFD A 3 -1.420 3.554 -2.549 1.00 0.00 H new HETATM 0 H9 MFD A 3 -8.413 0.717 -4.027 1.00 0.00 H new HETATM 0 H8 MFD A 3 -7.192 -0.563 -2.439 1.00 0.00 H new HETATM 0 H7 MFD A 3 -4.993 0.063 -3.455 1.00 0.00 H new HETATM 0 H6' MFD A 3 -5.662 3.756 -5.675 1.00 0.00 H new HETATM 0 H5' MFD A 3 -6.294 4.929 -7.759 1.00 0.00 H new HETATM 0 H5 MFD A 3 -2.915 0.648 -3.350 1.00 0.00 H new HETATM 0 H4' MFD A 3 -8.700 5.196 -8.363 1.00 0.00 H new HETATM 0 H4 MFD A 3 -2.109 1.328 -0.490 1.00 0.00 H new HETATM 0 H3' MFD A 3 -10.455 4.274 -6.847 1.00 0.00 H new HETATM 0 H3 MFD A 3 -0.481 0.675 -3.036 1.00 0.00 H new HETATM 0 H2' MFD A 3 -9.805 3.104 -4.767 1.00 0.00 H new HETATM 0 H2 MFD A 3 0.036 2.613 -0.796 1.00 0.00 H new HETATM 0 H'2 MFD A 3 -7.932 2.964 -2.981 1.00 0.00 H new HETATM 0 H'1 MFD A 3 -6.271 2.892 -3.534 1.00 0.00 H new HETATM 90 N FGA A 4 2.580 2.674 -1.197 1.00 0.00 N HETATM 91 CA FGA A 4 4.039 2.494 -1.284 1.00 0.00 C HETATM 92 C FGA A 4 4.560 3.971 -1.341 1.00 0.00 C HETATM 93 O FGA A 4 4.500 4.490 -2.463 1.00 0.00 O HETATM 94 CB FGA A 4 4.613 1.545 -0.212 1.00 0.00 C HETATM 95 CG FGA A 4 4.397 1.840 1.286 1.00 0.00 C HETATM 96 CD FGA A 4 5.112 0.812 2.214 1.00 0.00 C HETATM 97 OE1 FGA A 4 5.898 0.007 1.726 1.00 0.00 O HETATM 0 HG3 FGA A 4 4.764 2.842 1.511 1.00 0.00 H new HETATM 0 HG2 FGA A 4 3.329 1.836 1.502 1.00 0.00 H new HETATM 0 HB3 FGA A 4 4.205 0.553 -0.407 1.00 0.00 H new HETATM 0 HB2 FGA A 4 5.689 1.485 -0.377 1.00 0.00 H new HETATM 0 HA FGA A 4 4.388 1.946 -2.159 1.00 0.00 H new HETATM 104 N MDH A 5 4.839 0.845 3.607 1.00 0.00 N HETATM 105 CM MDH A 5 5.398 -0.265 4.389 1.00 0.00 C HETATM 106 CA MDH A 5 3.809 1.666 4.161 1.00 0.00 C HETATM 107 C MDH A 5 2.465 1.042 4.460 1.00 0.00 C HETATM 108 O MDH A 5 1.904 1.236 5.534 1.00 0.00 O HETATM 109 CB MDH A 5 4.020 2.989 4.412 1.00 0.00 C HETATM 110 CG MDH A 5 5.278 3.797 4.213 1.00 0.00 C HETATM 0 HM3 MDH A 5 5.838 0.123 5.308 1.00 0.00 H new HETATM 0 HM2 MDH A 5 4.605 -0.971 4.636 1.00 0.00 H new HETATM 0 HM1 MDH A 5 6.166 -0.772 3.804 1.00 0.00 H new HETATM 0 HG3 MDH A 5 6.081 3.375 4.818 1.00 0.00 H new HETATM 0 HG2 MDH A 5 5.564 3.772 3.162 1.00 0.00 H new HETATM 0 HG1 MDH A 5 5.099 4.829 4.516 1.00 0.00 H new HETATM 0 HB MDH A 5 3.165 3.536 4.810 1.00 0.00 H new TER 118 MDH A 5