0 0 2 This is a remark line molecule.res FAD XYZ 0 CORRECT OMIT DU BEG 0.0000 1 DUMM DU M 0 -1 -2 0.000 .0 .0 .00000 2 DUMM DU M 1 0 -1 1.449 .0 .0 .00000 3 DUMM DU M 2 1 0 1.522 111.1 .0 .00000 4 O4 o M 3 2 1 1.540 111.208 180.000 0.000 5 C4 c M 4 3 2 1.229 158.568 -88.979 0.000 6 N3 nb M 5 4 3 1.401 119.542 -149.304 0.000 7 C2 c M 6 5 4 1.361 126.919 -178.952 0.000 8 O2 o E 7 6 5 1.234 124.252 175.283 0.000 9 N1 nb M 7 6 5 1.344 114.256 -1.495 0.000 10 C10 ca M 9 7 6 1.360 122.856 0.852 0.000 11 C4A ca M 10 9 7 1.388 123.769 -0.196 0.000 12 N5 nb M 11 10 9 1.373 127.854 179.610 0.000 13 C5A ca M 12 11 10 1.363 112.722 -0.207 0.000 14 C6 c1 M 13 12 11 1.395 115.373 176.634 0.000 15 C7 c2 M 14 13 12 1.357 123.330 -176.650 0.000 16 C7M c3 E 15 14 13 1.509 120.318 176.719 0.000 17 C8 c2 M 15 14 13 1.399 120.379 -0.857 0.000 18 C8M c3 E 17 15 14 1.517 117.888 178.625 0.000 19 C9 c1 M 17 15 14 1.380 118.890 0.186 0.000 20 C9A ca M 19 17 15 1.428 120.590 0.615 0.000 21 N10 na M 20 19 17 1.428 124.253 175.238 0.000 22 C1* c1 M 21 20 19 1.451 122.514 5.260 0.000 23 C2* c M 22 21 20 1.524 105.049 92.129 0.000 24 O2* o E 23 22 21 1.454 110.075 -66.824 0.000 25 C3* c M 23 22 21 1.533 110.457 171.568 0.000 26 O3* o E 25 23 22 1.413 114.489 37.687 0.000 27 C4* c M 25 23 22 1.516 112.404 -82.430 0.000 28 O4* o E 27 25 23 1.414 107.513 -52.519 0.000 29 C5* c1 M 27 25 23 1.536 109.778 -173.751 0.000 30 O5* os M 29 27 25 1.453 115.065 49.403 0.000 31 P p5 M 30 29 27 1.587 122.577 147.561 0.000 32 O1P o E 31 30 29 1.470 110.613 -176.170 0.000 33 O2P o E 31 30 29 1.464 107.315 -45.216 0.000 34 O3P os M 31 30 29 1.525 105.382 67.329 0.000 35 PA p5 M 34 31 30 1.515 130.951 93.903 0.000 36 O1A o E 35 34 31 1.463 107.917 87.844 0.000 37 O2A o E 35 34 31 1.472 111.021 -48.071 0.000 38 O5A* os M 35 34 31 1.578 101.964 -161.663 0.000 39 C5A* c1 M 38 35 34 1.404 118.065 74.171 0.000 40 C4A* ca M 39 38 35 1.522 111.693 144.134 0.000 41 C3A* c B 40 39 38 1.521 110.052 175.587 0.000 42 O3A* o E 41 40 39 1.450 108.425 72.495 0.000 43 C2A* c S 41 40 39 1.530 95.089 -171.364 0.000 44 O2A* o E 43 41 40 1.451 105.261 -66.962 0.000 45 O4A* os M 40 39 38 1.428 112.476 61.512 0.000 46 C1A* ca M 45 40 39 1.432 107.950 152.740 0.000 47 N9A nh M 46 45 40 1.529 106.565 -130.426 0.000 48 C8A c1 M 47 46 45 1.394 130.989 36.066 0.000 49 N7A n2 M 48 47 46 1.320 115.776 -169.748 0.000 50 C5A cd M 49 48 47 1.393 103.351 -0.168 0.000 51 C6A cd M 50 49 48 1.407 132.687 -179.717 0.000 52 N6A n2 E 51 50 49 1.327 124.589 -4.427 0.000 53 N1A n2 M 51 50 49 1.336 117.283 179.841 0.000 54 C2A c1 M 53 51 50 1.328 119.960 -0.005 0.000 55 N3A n2 M 54 53 51 1.324 129.017 -0.683 0.000 56 C4A cd M 55 54 53 1.355 110.774 0.571 0.000 LOOP C4A C4 N10 C10 C9A C5A C1A* C2A* C4A N9A C4A C5A IMPROPER C4A N3 C4 O4 N3 N1 C2 O2 C4A N10 C10 N1 C4 C10 C4A N5 C6 C9A C5A N5 C7M C6 C7 C8 C8M C9 C8 C7 C9 C5A C9A N10 C1* C9A N10 C10 C1* C3* C2* O2* C2* C4* C3* O3* C5* C3* C4* O4* C5A* C3A* C4A* O4A* C2A* C4A* C3A* O3A* C3A* C1A* C2A* O2A* C2A* N9A C1A* O4A* C8A C1A* N9A C4A C6A C4A C5A N7A N6A C5A C6A N1A C5A N3A C4A N9A DONE STOP