HEADER Model coordinates for PDB-CCD FAD COMPND FAD AUTHOR pdbccdutils 0.8.6 AUTHOR RDKit 2023.09.6 HETATM 1 PA FAD A 1 21.838 0.805 23.170 1.00 20.00 P HETATM 2 O1A FAD A 1 21.303 -0.519 22.722 1.00 20.00 O HETATM 3 O2A FAD A 1 21.242 1.938 22.745 1.00 20.00 O HETATM 4 O5B FAD A 1 21.519 0.682 24.644 1.00 20.00 O HETATM 5 C5B FAD A 1 21.897 1.643 25.685 1.00 20.00 C HETATM 6 C4B FAD A 1 20.997 1.330 26.945 1.00 20.00 C HETATM 7 O4B FAD A 1 21.460 2.224 28.053 1.00 20.00 O HETATM 8 C3B FAD A 1 19.460 1.622 26.806 1.00 20.00 C HETATM 9 O3B FAD A 1 18.671 0.579 27.290 1.00 20.00 O HETATM 10 C2B FAD A 1 19.298 2.973 27.574 1.00 20.00 C HETATM 11 O2B FAD A 1 18.004 3.122 28.103 1.00 20.00 O HETATM 12 C1B FAD A 1 20.276 2.783 28.699 1.00 20.00 C HETATM 13 N9A FAD A 1 20.801 4.020 29.267 1.00 20.00 N HETATM 14 C8A FAD A 1 21.154 5.153 28.575 1.00 20.00 C HETATM 15 N7A FAD A 1 21.668 6.097 29.360 1.00 20.00 N HETATM 16 C5A FAD A 1 21.563 5.585 30.631 1.00 20.00 C HETATM 17 C6A FAD A 1 21.927 6.147 31.932 1.00 20.00 C HETATM 18 N6A FAD A 1 22.352 7.373 32.098 1.00 20.00 N HETATM 19 N1A FAD A 1 21.585 5.362 32.997 1.00 20.00 N HETATM 20 C2A FAD A 1 21.028 4.127 32.847 1.00 20.00 C HETATM 21 N3A FAD A 1 20.758 3.492 31.695 1.00 20.00 N HETATM 22 C4A FAD A 1 21.094 4.244 30.607 1.00 20.00 C HETATM 23 N1 FAD A 1 21.113 -2.231 14.334 1.00 20.00 N HETATM 24 C2 FAD A 1 21.370 -3.317 13.619 1.00 20.00 C HETATM 25 O2 FAD A 1 22.472 -3.795 13.558 1.00 20.00 O HETATM 26 N3 FAD A 1 20.335 -4.062 12.992 1.00 20.00 N HETATM 27 C4 FAD A 1 19.064 -3.545 12.870 1.00 20.00 C HETATM 28 O4 FAD A 1 18.201 -4.199 12.324 1.00 20.00 O HETATM 29 C4X FAD A 1 18.842 -2.220 13.431 1.00 20.00 C HETATM 30 N5 FAD A 1 17.621 -1.643 13.324 1.00 20.00 N HETATM 31 C5X FAD A 1 17.401 -0.507 14.054 1.00 20.00 C HETATM 32 C6 FAD A 1 16.092 0.030 14.034 1.00 20.00 C HETATM 33 C7 FAD A 1 15.729 1.049 14.879 1.00 20.00 C HETATM 34 C7M FAD A 1 14.319 1.587 14.859 1.00 20.00 C HETATM 35 C8 FAD A 1 16.666 1.547 15.852 1.00 20.00 C HETATM 36 C8M FAD A 1 16.334 2.718 16.739 1.00 20.00 C HETATM 37 C9 FAD A 1 17.942 0.981 15.928 1.00 20.00 C HETATM 38 C9A FAD A 1 18.331 0.020 14.992 1.00 20.00 C HETATM 39 N10 FAD A 1 19.633 -0.566 14.994 1.00 20.00 N HETATM 40 C10 FAD A 1 19.892 -1.653 14.271 1.00 20.00 C HETATM 41 C1' FAD A 1 20.685 0.069 15.813 1.00 20.00 C HETATM 42 C2' FAD A 1 21.054 -0.797 17.045 1.00 20.00 C HETATM 43 O2' FAD A 1 19.858 -1.073 17.768 1.00 20.00 O HETATM 44 C3' FAD A 1 21.986 0.046 17.903 1.00 20.00 C HETATM 45 O3' FAD A 1 23.172 0.294 17.145 1.00 20.00 O HETATM 46 C4' FAD A 1 22.378 -0.732 19.167 1.00 20.00 C HETATM 47 O4' FAD A 1 21.231 -1.036 19.962 1.00 20.00 O HETATM 48 C5' FAD A 1 23.375 0.117 19.918 1.00 20.00 C HETATM 49 O5' FAD A 1 23.884 -0.652 21.183 1.00 20.00 O HETATM 50 P FAD A 1 24.507 0.103 22.345 1.00 20.00 P HETATM 51 O1P FAD A 1 24.982 -0.991 23.309 1.00 20.00 O HETATM 52 O2P FAD A 1 25.437 1.054 21.950 1.00 20.00 O HETATM 53 O3P FAD A 1 23.473 0.866 23.032 1.00 20.00 O HETATM 54 HOA2 FAD A 1 21.581 2.778 23.029 1.00 20.00 H HETATM 55 H51A FAD A 1 22.988 1.637 25.912 1.00 20.00 H HETATM 56 H52A FAD A 1 21.828 2.704 25.349 1.00 20.00 H HETATM 57 H4B FAD A 1 21.108 0.232 27.108 1.00 20.00 H HETATM 58 H3B FAD A 1 19.108 1.700 25.750 1.00 20.00 H HETATM 59 HO3A FAD A 1 17.741 0.755 27.205 1.00 20.00 H HETATM 60 H2B FAD A 1 19.466 3.869 26.932 1.00 20.00 H HETATM 61 HO2A FAD A 1 17.905 3.943 28.570 1.00 20.00 H HETATM 62 H1B FAD A 1 19.760 2.196 29.494 1.00 20.00 H HETATM 63 H8A FAD A 1 21.035 5.292 27.487 1.00 20.00 H HETATM 64 H61A FAD A 1 22.605 7.764 33.004 1.00 20.00 H HETATM 65 H62A FAD A 1 21.653 7.992 31.686 1.00 20.00 H HETATM 66 H2A FAD A 1 20.764 3.576 33.766 1.00 20.00 H HETATM 67 HN3 FAD A 1 20.509 -4.995 12.618 1.00 20.00 H HETATM 68 H6 FAD A 1 15.330 -0.358 13.337 1.00 20.00 H HETATM 69 HM71 FAD A 1 14.024 2.414 15.545 1.00 20.00 H HETATM 70 HM72 FAD A 1 14.074 1.892 13.815 1.00 20.00 H HETATM 71 HM73 FAD A 1 13.616 0.735 15.013 1.00 20.00 H HETATM 72 HM81 FAD A 1 17.059 3.103 17.492 1.00 20.00 H HETATM 73 HM82 FAD A 1 16.034 3.569 16.084 1.00 20.00 H HETATM 74 HM83 FAD A 1 15.380 2.487 17.268 1.00 20.00 H HETATM 75 H9 FAD A 1 18.639 1.291 16.723 1.00 20.00 H HETATM 76 H1'1 FAD A 1 21.585 0.310 15.201 1.00 20.00 H HETATM 77 H1'2 FAD A 1 20.396 1.103 16.114 1.00 20.00 H HETATM 78 H2' FAD A 1 21.540 -1.757 16.755 1.00 20.00 H HETATM 79 HO2' FAD A 1 20.084 -1.603 18.522 1.00 20.00 H HETATM 80 H3' FAD A 1 21.479 0.996 18.193 1.00 20.00 H HETATM 81 HO3' FAD A 1 23.753 0.820 17.680 1.00 20.00 H HETATM 82 H4' FAD A 1 22.834 -1.714 18.902 1.00 20.00 H HETATM 83 HO4' FAD A 1 21.473 -1.517 20.744 1.00 20.00 H HETATM 84 H5'1 FAD A 1 24.215 0.451 19.265 1.00 20.00 H HETATM 85 H5'2 FAD A 1 22.960 1.119 20.176 1.00 20.00 H HETATM 86 HOP2 FAD A 1 25.826 1.526 22.676 1.00 20.00 H CONECT 1 2 2 3 4 53 CONECT 3 54 CONECT 4 5 CONECT 5 6 55 56 CONECT 6 7 8 57 CONECT 7 12 CONECT 8 9 10 58 CONECT 9 59 CONECT 10 11 12 60 CONECT 11 61 CONECT 12 13 62 CONECT 13 14 22 CONECT 14 15 15 63 CONECT 15 16 CONECT 16 17 22 22 CONECT 17 18 19 19 CONECT 18 64 65 CONECT 19 20 CONECT 20 21 21 66 CONECT 21 22 CONECT 23 24 40 40 CONECT 24 25 25 26 CONECT 26 27 67 CONECT 27 28 28 29 CONECT 29 30 30 40 CONECT 30 31 CONECT 31 32 38 38 CONECT 32 33 33 68 CONECT 33 34 35 CONECT 34 69 70 71 CONECT 35 36 37 37 CONECT 36 72 73 74 CONECT 37 38 75 CONECT 38 39 CONECT 39 40 41 CONECT 41 42 76 77 CONECT 42 43 44 78 CONECT 43 79 CONECT 44 45 46 80 CONECT 45 81 CONECT 46 47 48 82 CONECT 47 83 CONECT 48 49 84 85 CONECT 49 50 CONECT 50 51 51 52 53 CONECT 52 86 END