RESIDUE 1BT 50 CONECT N01 1 C02 CONECT C02 2 N01 C03 CONECT C03 3 C02 C04 H1 CONECT C04 3 C03 C05 H2 CONECT C05 3 C04 C06 C09 CONECT C06 3 C05 C07 H3 CONECT C07 3 C06 C08 C12 CONECT C08 4 C07 H4 H5 H6 CONECT C09 3 C05 C10 H7 CONECT C10 3 C09 C11 C12 CONECT C11 4 C10 H8 H9 H10 CONECT C12 3 C07 C10 N13 CONECT N13 3 C12 C14 H11 CONECT C14 3 N13 N15 N32 CONECT N15 2 C14 C16 CONECT C16 3 N15 N17 C20 CONECT N17 3 C16 C18 H12 CONECT C18 3 N17 N19 H13 CONECT N19 2 C18 C20 CONECT C20 3 C16 N19 C21 CONECT C21 3 C20 N22 N32 CONECT N22 3 C21 C23 H15 CONECT C23 3 N22 C24 C31 CONECT C24 3 C23 C25 H16 CONECT C25 3 C24 N26 C29 CONECT N26 2 C25 C27 CONECT C27 3 N26 S28 H17 CONECT S28 2 C27 C29 CONECT C29 3 C25 S28 C30 CONECT C30 3 C29 C31 H18 CONECT C31 3 C23 C30 H19 CONECT N32 2 C14 C21 CONECT H1 1 C03 CONECT H2 1 C04 CONECT H3 1 C06 CONECT H4 1 C08 CONECT H5 1 C08 CONECT H6 1 C08 CONECT H7 1 C09 CONECT H8 1 C11 CONECT H9 1 C11 CONECT H10 1 C11 CONECT H11 1 N13 CONECT H12 1 N17 CONECT H13 1 C18 CONECT H15 1 N22 CONECT H16 1 C24 CONECT H17 1 C27 CONECT H18 1 C30 CONECT H19 1 C31 END HET 1BT 50 HETNAM 1BT (2E)-3-(4-{[6-(1,3-benzothiazol-5-ylamino)-9H-purin-2-y HETNAM 2 1BT l]amino}-3,5-dimethylphenyl)prop-2-enenitrile FORMUL 1BT C23 H18 N8 S1