RESIDUE A1EJS 83 CONECT C22 3 C17 N21 N24 CONECT C25 3 C30 C26 N24 CONECT C30 3 C25 C29 H301 CONECT C29 3 C30 C28 F48 CONECT C28 3 C29 C27 H281 CONECT C27 3 C28 C26 H271 CONECT C26 3 C25 C27 C31 CONECT C18 3 C17 N19 H181 CONECT C17 3 C22 C18 N16 CONECT O15 1 C12 CONECT O14 1 C11 CONECT C13 3 C10 C12 N16 CONECT C10 3 C13 C11 NZ CONECT CE 4 CD NZ HE2 HE3 CONECT CD 4 CE CG HD3 HD2 CONECT CG 4 CD CB HG2 HG3 CONECT CB 4 CG CA HB2 HB3 CONECT CA 4 CB C N HA CONECT C 3 CA O OXT CONECT C11 3 O14 C10 C12 CONECT C12 3 O15 C13 C11 CONECT C20 3 N19 N21 N23 CONECT C31 3 C26 O32 O33 CONECT C34 4 O32 H341 H343 H342 CONECT C35 4 C36 N23 H352 H351 CONECT C36 3 C35 C37 C41 CONECT C37 3 C36 C38 H371 CONECT C38 3 C37 C39 H381 CONECT C39 3 C38 C40 H391 CONECT C40 3 C39 C41 C42 CONECT C41 3 C36 C40 H411 CONECT C42 3 C40 N43 N46 CONECT C44 3 C45 N43 H441 CONECT C45 3 C44 N46 H451 CONECT C47 4 N46 H472 H473 H471 CONECT F48 1 C29 CONECT NZ 3 C10 CE HZ1 CONECT N 3 CA H H2 CONECT N16 3 C17 C13 H161 CONECT N19 2 C18 C20 CONECT N21 2 C22 C20 CONECT N23 3 C20 C35 H231 CONECT N24 3 C22 C25 H241 CONECT N43 2 C42 C44 CONECT N46 3 C42 C45 C47 CONECT O 1 C CONECT O32 2 C31 C34 CONECT O33 1 C31 CONECT H301 1 C30 CONECT H281 1 C28 CONECT H271 1 C27 CONECT H181 1 C18 CONECT HE2 1 CE CONECT HE3 1 CE CONECT HD3 1 CD CONECT HD2 1 CD CONECT HG2 1 CG CONECT HG3 1 CG CONECT HB2 1 CB CONECT HB3 1 CB CONECT HA 1 CA CONECT H341 1 C34 CONECT H343 1 C34 CONECT H342 1 C34 CONECT H352 1 C35 CONECT H351 1 C35 CONECT H371 1 C37 CONECT H381 1 C38 CONECT H391 1 C39 CONECT H411 1 C41 CONECT H441 1 C44 CONECT H451 1 C45 CONECT H472 1 C47 CONECT H473 1 C47 CONECT H471 1 C47 CONECT HZ1 1 NZ CONECT H 1 N CONECT H2 1 N CONECT H161 1 N16 CONECT H231 1 N23 CONECT H241 1 N24 CONECT OXT 2 C H1 CONECT H1 1 OXT END HET A1EJS 83 HETNAM A1EJS (2S)-2-azanyl-6-[[2-[[4-[(5-fluoranyl-2-methoxycarbonyl HETNAM 2 A1EJS -phenyl)amino]-2-[[3-(1-methylimidazol-2-yl)phenyl]meth HETNAM 3 A1EJS ylamino]pyrimidin-5-yl]amino]-3,4-bis(oxidanylidene)cyc HETNAM 4 A1EJS lobuten-1-yl]amino]hexanoic acid FORMUL A1EJS C33 H34 F N9 O6