@MOLECULE FMNH.pdb 51 53 1 0 0 SMALL NO_CHARGES @ATOM 1 N1 -8.7788 33.7794 18.7857 N.2 1 FMN1 0.0000 2 C2 -9.9636 34.4623 18.8585 C.3 1 FMN1 0.0000 3 O2 -11.1511 33.8331 19.0523 O.3 1 FMN1 0.0000 4 N3 -9.9763 35.8543 18.7992 N.pl3 1 FMN1 0.0000 5 C4 -8.8133 36.5829 18.6269 C.3 1 FMN1 0.0000 6 O4 -8.8646 37.9457 18.5181 O.3 1 FMN1 0.0000 7 C3 -7.5760 35.8504 18.5285 C.3 1 FMN1 0.0000 8 C5A -5.2178 35.8445 18.3744 C.ar 1 FMN1 0.0000 9 C6 -4.0147 36.5912 18.3238 C.ar 1 FMN1 0.0000 10 C7 -2.8316 35.8465 18.3810 C.ar 1 FMN1 0.0000 11 C7M -1.5987 36.5635 18.3381 C.3 1 FMN1 0.0000 12 C8 -2.8382 34.4545 18.4874 C.ar 1 FMN1 0.0000 13 C8M -1.6112 33.7090 18.5497 C.3 1 FMN1 0.0000 14 C9 -4.0448 33.7176 18.5242 C.ar 1 FMN1 0.0000 15 C9A -5.2659 34.4338 18.4528 C.ar 1 FMN1 0.0000 16 N10 -6.4382 33.6967 18.5116 N.pl3 1 FMN1 0.0000 17 C10 -7.6025 34.4392 18.6098 C.2 1 FMN1 0.0000 18 P -5.7848 28.5176 12.4786 P.3 1 FMN1 0.0000 19 C1* -6.5581 32.2953 18.5909 C.3 1 FMN1 0.0000 20 C2* -6.4235 31.7496 17.1652 C.3 1 FMN1 0.0000 21 C3* -6.4327 30.1967 17.2909 C.3 1 FMN1 0.0000 22 C4* -6.8178 29.3990 16.1073 C.3 1 FMN1 0.0000 23 C5* -5.9977 29.5758 14.9486 C.3 1 FMN1 0.0000 24 H1 -6.4281 37.4593 18.2033 H 1 FMN1 0.0000 25 H1*1 -7.5237 32.0411 19.0196 H 1 FMN1 0.0000 26 H1*2 -5.7664 31.9012 19.2340 H 1 FMN1 0.0000 27 H2* -5.4913 32.0736 16.7158 H 1 FMN1 0.0000 28 H2*1 -7.5262 33.0900 16.2136 H 1 FMN1 0.0000 29 H3 -10.8582 36.3457 18.8631 H 1 FMN1 0.0000 30 H3* -7.1230 29.9448 18.1024 H 1 FMN1 0.0000 31 H3*1 -5.0256 28.9319 17.8697 H 1 FMN1 0.0000 32 H4* -7.8206 29.7370 15.8386 H 1 FMN1 0.0000 33 H4*1 -7.0054 27.8972 17.3836 H 1 FMN1 0.0000 34 H5*1 -5.0047 29.1694 15.1387 H 1 FMN1 0.0000 35 H5*2 -5.9218 30.6402 14.6926 H 1 FMN1 0.0000 36 H6 -4.0176 37.6733 18.2428 H 1 FMN1 0.0000 37 H7M1 -1.7818 37.6255 18.2581 H 1 FMN1 0.0000 38 H7M2 -1.0307 36.3753 19.2568 H 1 FMN1 0.0000 39 H7M3 -1.0195 36.2363 17.4816 H 1 FMN1 0.0000 40 H8M1 -1.3286 33.5402 19.5929 H 1 FMN1 0.0000 41 H8M2 -1.7444 32.7375 18.0540 H 1 FMN1 0.0000 42 H8M3 -0.8123 34.2754 18.0531 H 1 FMN1 0.0000 43 H9 -4.0247 32.6465 18.6163 H 1 FMN1 0.0000 44 N2 -6.4165 36.5597 18.3414 N.pl3 1 FMN1 0.0000 45 O1P -5.2171 29.9175 11.8434 O.co2 1 FMN1 0.0000 46 O2* -7.5414 32.1379 16.3443 O.3 1 FMN1 0.0000 47 O2P -6.8587 27.7690 11.4551 O.co2 1 FMN1 0.0000 48 O3* -5.1151 29.8840 17.7539 O.3 1 FMN1 0.0000 49 O3P -4.6068 27.4185 12.7908 O.co2 1 FMN1 0.0000 50 O4* -6.8914 28.0031 16.4446 O.3 1 FMN1 0.0000 51 O5* -6.6174 28.8763 13.8879 O.3 1 FMN1 0.0000 @BOND 1 17 1 2 2 17 16 1 3 19 16 1 4 19 26 1 5 19 25 1 6 19 20 1 7 20 46 1 8 28 46 1 9 20 27 1 10 20 21 1 11 21 48 1 12 31 48 1 13 21 30 1 14 21 22 1 15 22 50 1 16 33 50 1 17 22 32 1 18 22 23 1 19 23 51 1 20 51 18 1 21 49 18 1 22 47 18 1 23 45 18 2 24 23 35 1 25 23 34 1 26 15 16 1 27 14 15 ar 28 14 43 1 29 12 14 ar 30 12 13 1 31 13 42 1 32 13 41 1 33 13 40 1 34 10 12 ar 35 10 11 1 36 11 39 1 37 11 38 1 38 11 37 1 39 9 10 ar 40 9 36 1 41 8 9 ar 42 8 44 1 43 24 44 1 44 7 44 1 45 17 7 1 46 5 7 1 47 5 6 2 48 5 4 1 49 29 4 1 50 2 4 1 51 2 3 2 52 2 1 1 53 8 15 ar @SUBSTRUCTURE 1 FMN1 22 RESIDUE 4 A FMN 0 ROOT