RESIDUE A1I1R 55 CONECT C5 3 C1 N4 N6 CONECT C8 3 C10 C1 H8 CONECT C10 3 C8 N11 H10 CONECT C13 4 C12 C14 H13B H13A CONECT C15 3 C14 C16 S18 CONECT C17 4 C12 C16 C2 C23 CONECT C20 3 C19 N21 S18 CONECT C22 2 C19 N24 CONECT C26 4 C27 C31 N25 H26 CONECT C1 3 C5 C8 N7 CONECT C12 4 C13 C17 H12B H12A CONECT C14 4 C13 C15 H14B H14A CONECT C16 3 C15 C17 C19 CONECT C19 3 C20 C22 C16 CONECT C2 3 C17 N6 O3 CONECT C23 4 C17 H23C H23A H23B CONECT C27 4 C26 N28 H27B H27A CONECT C29 4 C30 N28 H29A H29B CONECT C30 4 C29 N25 H30B H30A CONECT C31 4 C26 H31B H31C H31A CONECT C9 3 N11 N25 N7 CONECT N11 2 C10 C9 CONECT N21 3 C20 H21A H21B CONECT N24 1 C22 CONECT N25 3 C26 C30 C9 CONECT N28 3 C27 C29 H28A CONECT N4 2 C5 O3 CONECT N6 2 C5 C2 CONECT N7 2 C1 C9 CONECT O3 2 C2 N4 CONECT S18 2 C15 C20 CONECT H8 1 C8 CONECT H10 1 C10 CONECT H13B 1 C13 CONECT H13A 1 C13 CONECT H26 1 C26 CONECT H12B 1 C12 CONECT H12A 1 C12 CONECT H14B 1 C14 CONECT H14A 1 C14 CONECT H23C 1 C23 CONECT H23A 1 C23 CONECT H23B 1 C23 CONECT H27B 1 C27 CONECT H27A 1 C27 CONECT H29A 1 C29 CONECT H29B 1 C29 CONECT H30B 1 C30 CONECT H30A 1 C30 CONECT H31B 1 C31 CONECT H31C 1 C31 CONECT H31A 1 C31 CONECT H21A 1 N21 CONECT H21B 1 N21 CONECT H28A 1 N28 END HET A1I1R 55 HETNAM A1I1R (4~{S})-2-azanyl-4-methyl-4-[3-[2-[(2~{S})-2-methylpipe HETNAM 2 A1I1R razin-1-yl]pyrimidin-4-yl]-1,2,4-oxadiazol-5-yl]-6,7-di HETNAM 3 A1I1R hydro-5~{H}-1-benzothiophene-3-carbonitrile FORMUL A1I1R C21 H24 N8 O S