RESIDUE A1BET 196 CONECT C4 3 C3 C5 N21 CONECT C3 4 C4 C2 C30 H2 CONECT C2 4 C3 C11 C25 C26 CONECT C1 3 C C12 H3 CONECT C 3 C1 C13 C17 CONECT NB1 3 CB2 CB8 CR1 CONECT CB2 3 NB1 NB3 H5 CONECT NB3 2 CB2 CB9 CONECT C10 3 C18 C9 H6 CONECT C11 4 C2 C1G C20 N21 CONECT C12 3 C1 C2L S CONECT C13 3 C C14 S CONECT C14 3 C13 C15 H9 CONECT C15 3 C14 C16 H10 CONECT C16 3 C15 C17 H12 CONECT C17 3 C C16 H13 CONECT C18 3 C10 C19 N23 CONECT C19 4 C18 C1A C46 C47 CONECT C1A 4 C19 C1B C48 H15 CONECT C1B 3 C1A C1C N23 CONECT C1C 3 C1B C1D C53 CONECT C1D 3 C1C C1E N24 CONECT C1E 4 C1D C1F C54 C55 CONECT C1F 4 C1E C1G C60 H17 CONECT C1G 4 C11 C1F N24 H18 CONECT C1L 2 C2L CO1 CONECT C20 4 C11 H19 H20 H21 CONECT C25 4 C2 H22 H23 H24 CONECT C26 4 C2 C27 H25 H26 CONECT C27 3 C26 N29 O28 CONECT C2L 2 C12 C1L CONECT C30 4 C3 C31 H27 H28 CONECT C31 4 C30 C32 H29 H30 CONECT C32 3 C31 N34 O33 CONECT C35 4 C5 H31 H32 H33 CONECT C36 4 C7 H34 H35 H36 CONECT C37 4 C38 C7 H37 H38 CONECT C38 3 C37 N40 O39 CONECT C41 4 C42 C8 H39 H40 CONECT C42 4 C41 C43 H41 H42 CONECT C43 3 C42 N45 O44 CONECT C46 4 C19 H43 H44 H45 CONECT C47 4 C19 H46 H47 H48 CONECT C48 4 C1A C49 H49 H50 CONECT C49 4 C48 C50 H51 H52 CONECT C5 3 C4 C35 C6 CONECT C50 3 C49 N52 O51 CONECT C53 4 C1C H53 H54 H55 CONECT C54 4 C1E H56 H57 H58 CONECT C55 4 C1E C56 H59 H60 CONECT C56 4 C55 C57 H61 H62 CONECT C57 3 C56 N59 O58 CONECT C6 3 C5 C7 N22 CONECT C60 4 C1F C61 H63 H64 CONECT C61 3 C60 N63 O62 CONECT C7 4 C36 C37 C6 C8 CONECT C8 4 C41 C7 C9 H65 CONECT C9 3 C10 C8 N22 CONECT CB4 3 CB5 CB9 H67 CONECT CB5 3 CB4 CB6 CB10 CONECT CB6 3 CB5 CB7 CB11 CONECT CB7 3 CB6 CB8 H68 CONECT CB8 3 NB1 CB7 CB9 CONECT CB9 3 NB3 CB4 CB8 CONECT CR1 4 NB1 CR2 OR6 H69 CONECT CR2 4 CR1 CR3 OR7 H70 CONECT CR3 4 CR2 CR4 OP2 H71 CONECT CR4 4 CR3 CR5 OR6 H72 CONECT CR5 4 CR4 OR8 H73 H74 CONECT N21 3 C4 C11 CO1 CONECT N22 3 C6 C9 CO1 CONECT N23 3 C18 C1B CO1 CONECT N24 3 C1D C1G CO1 CONECT N29 3 C27 H75 H76 CONECT N34 3 C32 H77 H78 CONECT N40 3 C38 H79 H80 CONECT N45 3 C43 H81 H82 CONECT N52 3 C50 H83 H84 CONECT N59 3 C57 CPR1 H85 CONECT N63 3 C61 H86 H87 CONECT O28 1 C27 CONECT O33 1 C32 CONECT O39 1 C38 CONECT O44 1 C43 CONECT O51 1 C50 CONECT O58 1 C57 CONECT O62 1 C61 CONECT OP2 2 CR3 P1 CONECT OP3 2 P1 CPR2 CONECT OP4 1 P1 CONECT OP5 2 P1 H88 CONECT OR6 2 CR1 CR4 CONECT OR7 2 CR2 H89 CONECT OR8 2 CR5 H90 CONECT P1 4 OP2 OP3 OP4 OP5 CONECT S 2 C12 C13 CONECT CB10 4 CB5 H91 H92 H93 CONECT CB11 4 CB6 H94 H95 H96 CONECT CO1 5 C1L N21 N22 N23 CONECT CO1 5 N24 CONECT CPR1 4 N59 CPR2 H8 H11 CONECT CPR2 4 OP3 CPR1 CPR3 H14 CONECT CPR3 4 CPR2 H1 H7 H4 CONECT H2 1 C3 CONECT H3 1 C1 CONECT H5 1 CB2 CONECT H6 1 C10 CONECT H9 1 C14 CONECT H10 1 C15 CONECT H12 1 C16 CONECT H13 1 C17 CONECT H15 1 C1A CONECT H17 1 C1F CONECT H18 1 C1G CONECT H19 1 C20 CONECT H20 1 C20 CONECT H21 1 C20 CONECT H22 1 C25 CONECT H23 1 C25 CONECT H24 1 C25 CONECT H25 1 C26 CONECT H26 1 C26 CONECT H27 1 C30 CONECT H28 1 C30 CONECT H29 1 C31 CONECT H30 1 C31 CONECT H31 1 C35 CONECT H32 1 C35 CONECT H33 1 C35 CONECT H34 1 C36 CONECT H35 1 C36 CONECT H36 1 C36 CONECT H37 1 C37 CONECT H38 1 C37 CONECT H39 1 C41 CONECT H40 1 C41 CONECT H41 1 C42 CONECT H42 1 C42 CONECT H43 1 C46 CONECT H44 1 C46 CONECT H45 1 C46 CONECT H46 1 C47 CONECT H47 1 C47 CONECT H48 1 C47 CONECT H49 1 C48 CONECT H50 1 C48 CONECT H51 1 C49 CONECT H52 1 C49 CONECT H53 1 C53 CONECT H54 1 C53 CONECT H55 1 C53 CONECT H56 1 C54 CONECT H57 1 C54 CONECT H58 1 C54 CONECT H59 1 C55 CONECT H60 1 C55 CONECT H61 1 C56 CONECT H62 1 C56 CONECT H63 1 C60 CONECT H64 1 C60 CONECT H65 1 C8 CONECT H67 1 CB4 CONECT H68 1 CB7 CONECT H69 1 CR1 CONECT H70 1 CR2 CONECT H71 1 CR3 CONECT H72 1 CR4 CONECT H73 1 CR5 CONECT H74 1 CR5 CONECT H75 1 N29 CONECT H76 1 N29 CONECT H77 1 N34 CONECT H78 1 N34 CONECT H79 1 N40 CONECT H80 1 N40 CONECT H81 1 N45 CONECT H82 1 N45 CONECT H83 1 N52 CONECT H84 1 N52 CONECT H85 1 N59 CONECT H86 1 N63 CONECT H87 1 N63 CONECT H88 1 OP5 CONECT H89 1 OR7 CONECT H90 1 OR8 CONECT H91 1 CB10 CONECT H92 1 CB10 CONECT H93 1 CB10 CONECT H94 1 CB11 CONECT H95 1 CB11 CONECT H96 1 CB11 CONECT H8 1 CPR1 CONECT H11 1 CPR1 CONECT H14 1 CPR2 CONECT H1 1 CPR3 CONECT H7 1 CPR3 CONECT H4 1 CPR3 END HET A1BET 196 HETSYN A1BET 1-[3-[(3~{R},4~{R},5~{R},9~{S},14~{S},15~{S},19~{S},20~ HETSYN 2 A1BET {S},21~{R})-1-[2-(2,3,3~{a},6-tetrahydro-1-benzothiophe HETSYN 3 A1BET n-2-yl)ethynyl]-4,15,20-tris(2-azanyl-2-oxidanylidene-e HETSYN 4 A1BET thyl)-9,14,19-tris(3-azanyl-3-oxidanylidene-propyl)-5,7 HETSYN 5 A1BET ,10,10,15,17,20,21-octamethyl-22-aza-2,23,24-triazonia- HETSYN 6 A1BET 1$l^{5}-cobaltaoctacyclo[11.9.1.1^{1,8}.0^{2,6}.0^{3,21 HETSYN 7 A1BET }.0^{16,23}.0^{18,22}.0^{11,24}]tetracosa-2(6),7,11(24) HETSYN 8 A1BET ,12,16(23),17-hexaen-5-yl]propanoylamino]propan-2-yl [( HETSYN 9 A1BET 2~{R},3~{S},4~{R},5~{S})-5-(5,6-dimethylbenzimidazol-1- HETSYN 10 A1BET yl)-2-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl] hydrogen HETSYN 11 A1BET phosphate HETNAM A1BET ethynyl-benzothiophene-cobalamin FORMUL A1BET C72 H94 Co N13 O14 P S