RESIDUE 44K 67 CONECT CBI 4 NAU CBF CBH H1 CONECT NAU 3 CBI CBA H2 CONECT CBA 3 NAU OAC NAT CONECT OAC 1 CBA CONECT NAT 3 CBA CBF H3 CONECT CBF 4 CBI NAT CAO H4 CONECT CAO 4 CBF SAY H5 H6 CONECT SAY 2 CAO CBH CONECT CBH 4 CBI SAY CAK H7 CONECT CAK 4 CBH CAI H8 H9 CONECT CAI 4 CAK CAH H10 H11 CONECT CAH 4 CAI CAJ H12 H13 CONECT CAJ 4 CAH CAZ H14 H15 CONECT CAZ 3 CAJ OAB NAV CONECT OAB 1 CAZ CONECT NAV 3 CAZ SBK H16 CONECT SBK 4 NAV OAD OAE NAW CONECT OAD 1 SBK CONECT OAE 1 SBK CONECT NAW 3 SBK CAN H17 CONECT CAN 4 NAW CBE H18 H19 CONECT CBE 4 CAN CAX CAL H20 CONECT CAX 4 CBE CBG H21 H22 CONECT CAL 4 CBE CAM H23 H24 CONECT CAM 4 CAL CBG H25 H26 CONECT CBG 4 CAX CAM N9 H27 CONECT N9 3 CBG C8 C4 CONECT C8 3 N9 N7 H28 CONECT N7 2 C8 C5 CONECT C5 3 N7 C4 C6 CONECT C4 3 N9 C5 N3 CONECT N3 2 C4 C2 CONECT C2 3 N3 N1 H29 CONECT N1 2 C2 C6 CONECT C6 3 C5 N1 N6 CONECT N6 3 C6 H30 H31 CONECT H1 1 CBI CONECT H2 1 NAU CONECT H3 1 NAT CONECT H4 1 CBF CONECT H5 1 CAO CONECT H6 1 CAO CONECT H7 1 CBH CONECT H8 1 CAK CONECT H9 1 CAK CONECT H10 1 CAI CONECT H11 1 CAI CONECT H12 1 CAH CONECT H13 1 CAH CONECT H14 1 CAJ CONECT H15 1 CAJ CONECT H16 1 NAV CONECT H17 1 NAW CONECT H18 1 CAN CONECT H19 1 CAN CONECT H20 1 CBE CONECT H21 1 CAX CONECT H22 1 CAX CONECT H23 1 CAL CONECT H24 1 CAL CONECT H25 1 CAM CONECT H26 1 CAM CONECT H27 1 CBG CONECT H28 1 C8 CONECT H29 1 C2 CONECT H30 1 N6 CONECT H31 1 N6 END HET 44K 67 HETNAM 44K N-({[(1R,3S)-3-(6-amino-9H-purin-9-yl)cyclopentyl]methy HETNAM 2 44K l}sulfamoyl)-5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3 HETNAM 3 44K ,4-d]imidazol-4-yl]pentanamide FORMUL 44K C21 H31 N9 O4 S2