RESIDUE 1C4 106 CONECT N1A 2 C2A C6A CONECT C2A 3 N1A N3A H1 CONECT N3A 2 C2A C4A CONECT C4A 3 N3A C5A N9A CONECT C5A 3 C4A C6A N7A CONECT C6A 3 N1A C5A N6A CONECT N6A 3 C6A H2 H3 CONECT N7A 2 C5A C8A CONECT C8A 3 N7A N9A H4 CONECT N9A 3 C4A C8A C1B CONECT C1B 4 N9A C2B O4B H5 CONECT C2B 4 C1B O2B C3B H6 CONECT O2B 2 C2B H7 CONECT C3B 4 C2B O3B C4B H8 CONECT O3B 2 C3B P3B CONECT P3B 4 O3B O7A O8A O9A CONECT O7A 2 P3B H9 CONECT O8A 1 P3B CONECT O9A 2 P3B H10 CONECT C4B 4 C3B O4B C5B H11 CONECT O4B 2 C1B C4B CONECT C5B 4 C4B O5B H12 H13 CONECT O5B 2 C5B P1A CONECT P1A 4 O5B O1A O2A O3A CONECT O1A 2 P1A H14 CONECT O2A 1 P1A CONECT O3A 2 P1A P2A CONECT P2A 4 O3A O4A O5A O6A CONECT O4A 1 P2A CONECT O5A 2 P2A H15 CONECT O6A 2 P2A CCP CONECT CBP 4 CCP CDP CEP CAP CONECT CCP 4 O6A CBP H16 H17 CONECT CDP 4 CBP H18 H19 H20 CONECT CEP 4 CBP H21 H22 H23 CONECT CAP 4 CBP OAP C9P H24 CONECT OAP 2 CAP H25 CONECT C9P 3 CAP O9P N8P CONECT O9P 1 C9P CONECT N8P 3 C9P C7P H26 CONECT C7P 4 N8P C6P H27 H28 CONECT C6P 4 C7P C5P H29 H30 CONECT C5P 3 C6P O5P N4P CONECT O5P 1 C5P CONECT N4P 3 C5P C3P H31 CONECT C3P 4 N4P C2P H32 H33 CONECT C2P 4 C3P S1P H34 H35 CONECT S1P 2 C2P C8 CONECT CA 4 C CB N2 H36 CONECT C 3 CA OXT O CONECT OXT 2 C H37 CONECT O 1 C CONECT CB 4 CA CG H38 H39 CONECT CG 4 CB CD H40 H41 CONECT CD 3 CG OE1 OE2 CONECT OE1 2 CD H42 CONECT OE2 1 CD CONECT C7 3 C8 O7 N2 CONECT C8 4 S1P C7 H43 H44 CONECT O7 1 C7 CONECT N2 3 CA C7 H45 CONECT H1 1 C2A CONECT H2 1 N6A CONECT H3 1 N6A CONECT H4 1 C8A CONECT H5 1 C1B CONECT H6 1 C2B CONECT H7 1 O2B CONECT H8 1 C3B CONECT H9 1 O7A CONECT H10 1 O9A CONECT H11 1 C4B CONECT H12 1 C5B CONECT H13 1 C5B CONECT H14 1 O1A CONECT H15 1 O5A CONECT H16 1 CCP CONECT H17 1 CCP CONECT H18 1 CDP CONECT H19 1 CDP CONECT H20 1 CDP CONECT H21 1 CEP CONECT H22 1 CEP CONECT H23 1 CEP CONECT H24 1 CAP CONECT H25 1 OAP CONECT H26 1 N8P CONECT H27 1 C7P CONECT H28 1 C7P CONECT H29 1 C6P CONECT H30 1 C6P CONECT H31 1 N4P CONECT H32 1 C3P CONECT H33 1 C3P CONECT H34 1 C2P CONECT H35 1 C2P CONECT H36 1 CA CONECT H37 1 OXT CONECT H38 1 CB CONECT H39 1 CB CONECT H40 1 CG CONECT H41 1 CG CONECT H42 1 OE1 CONECT H43 1 C8 CONECT H44 1 C8 CONECT H45 1 N2 END HET 1C4 106 HETNAM 1C4 (2S)-2-({(3S,5R,9R)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-puri HETNAM 2 1C4 n-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl] HETNAM 3 1C4 -3,5,9-trihydroxy-8,8-dimethyl-3,5-dioxido-10,14,20-tri HETNAM 4 1C4 oxo-2,4,6-trioxa-18-thia-11,15-diaza-3lambda~5~,5lambda HETNAM 5 1C4 ~5~-diphosphaicosan-20-yl}amino)pentanedioic acid (non- HETNAM 6 1C4 preferred name) FORMUL 1C4 C28 H45 N8 O21 P3 S1