#code stringlengths 9 9 | inputs stringlengths 101 495 |
|---|---|
3qqs_3g31 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C [ C @ H ] ( C ( = O ) [ O - ] ) N 1 C ( = O ) [ C @ @ H ] 2 [ C @ @ H ] 3 C C [ C @ @ H ] ( C 3 ) [ C @ @ H ] 2 C 1 = O |
3qqs_3gbb | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> [ N H 3 + ] [ C @ @ H ] ( C [ C @ ] 1 ( C ( = O ) [ O - ] ) C [ C @ H ] 2 O C C C [ C @ H ] 2 O 1 ) C ( = O ) [ O - ] |
3qqs_3gc5 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C N c 1 n c 2 c ( C C [ N H 3 + ] ) c 3 n c ( N ) [ n H ] c ( = O ) c 3 c c 2 [ n H ] 1 |
3qqs_3ge7 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C N c 1 n c 2 c ( C C [ N H 2 + ] C C 3 C C C C 3 ) c 3 [ n H ] c ( = [ N H 2 + ] ) [ n H ] c ( = O ) c 3 c c 2 [ n H ] 1 |
3qqs_3gnw | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C c 1 c c c c ( C ( = O ) N 2 c 3 c c c c ( O ) c 3 N C 3 = C ( [ C @ @ H ] 2 c 2 c c c ( O C c 4 c c c c c 4 ) c c 2 F ) S ( = O ) ( = O ) C C ( C ) ( C ) C 3 ) n 1 |
3qqs_3gr2 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C C 1 C ( = O ) N ( c 2 n n n [ n H ] 2 ) N = C 1 C |
3qqs_3gv9 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C ( = O ) N c 1 c c s c 1 C ( = O ) [ O - ] |
3qqs_3gy4 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> N C ( = [ N H 2 + ] ) c 1 c c c ( N ) c c 1 |
3qqs_3ivg | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C O c 1 c c c 2 c ( c 1 ) c c ( C N S ( = O ) ( = O ) c 1 c c 3 c c c c c 3 o 1 ) n 2 C C ( = O ) [ O - ] |
3qqs_3jvr | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C [ C @ H ] ( O C ( = O ) N c 1 c c c ( C l ) c ( C l ) c 1 ) c 1 n c 2 c c c c c 2 [ n H ] 1 |
3qqs_3jvs | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C ( C ) ( C ) c 1 c c c ( C ( = O ) N N C ( = O ) N c 2 c c c c 3 c c c c c 2 3 ) c c 1 [ N + ] ( = O ) [ O - ] |
3qqs_3jya | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = c 1 [ n H ] c n c 2 c 1 s c 1 c ( C l ) c c c ( C l ) c 1 2 |
3qqs_3k5v | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> N C ( = O ) c 1 c c c c ( - c 2 c c ( N c 3 c c c ( O C ( F ) ( F ) F ) c c 3 ) n c n 2 ) c 1 |
3qqs_3kgp | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> [ N H 3 + ] C c 1 c c c ( C ( = O ) [ O - ] ) c c 1 |
3qqs_3kr8 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = c 1 [ n H ] c ( - c 2 c c c ( C ( F ) ( F ) F ) c c 2 ) n c 2 c 1 C S C C 2 |
3qqs_3kwa | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> [ N H 3 + ] C C C [ N H 2 + ] C C C C [ N H 2 + ] C C C [ N H 3 + ] |
3qqs_3l7b | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> N c 1 c c n ( [ C @ @ H ] 2 O [ C @ H ] ( C O ) [ C @ @ H ] ( O ) [ C @ H ] ( F ) [ C @ H ] 2 O ) c ( = O ) n 1 |
3qqs_3lka | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C O c 1 c c c ( S ( N ) ( = O ) = O ) c c 1 |
3qqs_3mss | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C N C ( = O ) [ C @ @ H ] ( [ N H 3 + ] ) C c 1 c c c ( O C c 2 c c c c c 2 ) c c 1 |
3qqs_3myg | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C [ N @ H + ] ( C c 1 c c ( N c 2 n c ( C ) c n 3 c ( - c 4 c n [ n H ] c 4 ) c n c 2 3 ) s n 1 ) C ( C ) ( C ) C O |
3qqs_3n76 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C ( [ O - ] ) [ C @ ] 1 ( O ) C = C ( / C = C / C O c 2 c c c c c 2 ) [ C @ @ H ] ( O ) [ C @ H ] ( O ) C 1 |
3qqs_3n7a | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C ( [ O - ] ) [ C @ ] 1 ( O ) C = C [ C @ @ H ] ( O ) [ C @ H ] ( O ) C 1 |
3qqs_3n86 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C ( C C C 1 = C [ C @ @ ] ( O ) ( C ( = O ) [ O - ] ) C [ C @ @ H ] ( O ) [ C @ @ H ] 1 O ) N c 1 c c c c c 1 |
3qqs_3nq9 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C C C C C C C ( = O ) [ O - ] |
3qqs_3nw9 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C c 1 n c n c 2 c 1 n c n 2 [ C @ @ H ] 1 O [ C @ H ] ( / C = C / C N C ( = O ) c 2 c c ( - c 3 c c c ( F ) c c 3 ) c c ( O ) c 2 O ) [ C @ @ H ] ( O ) [ C @ H ] 1 O |
3qqs_3nx7 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C O c 1 c c c ( S ( = O ) ( = O ) N ( C C O ) C C ( = O ) N O ) c c 1 |
3qqs_3o9i | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C C ( C C ) C N ( C [ C @ @ H ] ( O ) [ C @ H ] ( C c 1 c c c c c 1 ) N C ( = O ) O [ C @ H ] 1 C O [ C @ H ] 2 O C C [ C @ H ] 2 1 ) S ( = O ) ( = O ) c 1 c c c 2 n c s c 2 c 1 |
3qqs_3oe4 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C ( N C / C = C / [ C @ H ] 1 O [ C @ @ H ] ( n 2 c n c 3 c n c n c 3 2 ) [ C @ H ] ( O ) [ C @ @ H ] 1 O ) c 1 c c ( [ N + ] ( = O ) [ O - ] ) c c ( O ) c 1 O |
3qqs_3oe5 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C ( N C / C = C / [ C @ H ] 1 O [ C @ @ H ] ( S c 2 c c n c c 2 ) [ C @ H ] ( O ) [ C @ @ H ] 1 O ) c 1 c c ( [ N + ] ( = O ) [ O - ] ) c c ( O ) c 1 O |
3qqs_3ozs | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C ( N C / C = C / [ C @ H ] 1 O [ C @ @ H ] ( n 2 c n c ( C ( F ) ( F ) F ) c 2 ) [ C @ H ] ( O ) [ C @ @ H ] 1 O ) c 1 c c ( [ N + ] ( = O ) [ O - ] ) c c ( O ) c 1 O |
3qqs_3ozt | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C ( N C / C = C / [ C @ H ] 1 O [ C @ @ H ] ( n 2 c c c ( = O ) c c 2 ) [ C @ H ] ( O ) [ C @ @ H ] 1 O ) c 1 c c ( [ N + ] ( = O ) [ O - ] ) c c ( O ) c 1 O |
3qqs_3p5o | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C N C ( = O ) C [ C @ @ H ] 1 N = C ( c 2 c c c ( C l ) c c 2 ) c 2 c c ( O C ) c c c 2 - n 2 c ( C ) n n c 2 1 |
3qqs_3prs | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C ( C ) c 1 n c ( C N ( C ) C ( = O ) N [ C @ H ] ( C ( = O ) N [ C @ @ H ] ( C c 2 c c c c c 2 ) C [ C @ H ] ( O ) [ C @ H ] ( C c 2 c c c c c 2 ) N C ( = O ) O C c 2 c n c s 2 ) C ( C ) C ) c s 1 |
3qqs_3pww | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C ( C ) ( C ) N C ( = O ) [ C @ @ H ] 1 C [ C @ @ H ] 2 C C C C [ C @ @ H ] 2 C [ N @ @ H + ] 1 C [ C @ @ H ] ( O ) [ C @ H ] ( C c 1 c c c c c 1 ) N C ( = O ) [ C @ H ] ( C C ( N ) = O ) N C ( = O ) c 1 c c c 2 c c c c c 2 n 1 |
3qqs_3pxf | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = S ( = O ) ( [ O - ] ) c 1 c c c c 2 c c c c ( N c 3 c c c c c 3 ) c 1 2 |
3qqs_3pyy | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C 1 N C ( = O ) [ C @ @ H ] ( c 2 c n ( - c 3 c c c c c 3 ) n c 2 - c 2 c c c ( F ) c c 2 ) N 1 |
3qqs_3qgy | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> N S ( = O ) ( = O ) c 1 c c c c ( N c 2 n c c 3 c c c 4 s c ( - c 5 c c c c c 5 ) c c 4 c 3 n 2 ) c 1 |
3qqs_3qqs | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C ( [ O - ] ) c 1 c c c c c 1 N c 1 c c c c c 1 C ( = O ) [ O - ] |
3qqs_3r88 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C O c 1 c c ( N ) c ( C ( = O ) [ O - ] ) c c 1 O C |
3qqs_3rlr | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C O c 1 c c ( - c 2 n c ( C ) n c 3 [ n H ] c ( C ) c ( C # N ) c 2 3 ) c ( C l ) c c 1 C l |
3qqs_3rr4 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C N c 1 n c 2 c c 3 [ n H ] c ( N C ) n c 3 c c 2 c ( = O ) [ n H ] 1 |
3qqs_3rsx | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> N c 1 c c c 2 c c ( - c 3 c c s c 3 ) c c c 2 n 1 |
3qqs_3ryj | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> N S ( = O ) ( = O ) c 1 c c c ( C ( = O ) N C C ( F ) ( F ) F ) c c 1 |
3qqs_3syr | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = c 1 [ n H ] c ( = O ) n ( [ C @ @ H ] 2 O [ C @ H ] ( C O ) [ C @ @ H ] ( O ) [ C @ H ] ( O ) [ C @ H ] 2 O ) c c 1 F |
3qqs_3tsk | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> N C ( = O ) C C [ C @ H ] ( N C ( = O ) C C c 1 c c c ( - c 2 c c ( - c 3 c c c c c 3 ) c s 2 ) c c 1 ) C ( = O ) N [ C @ @ H ] ( C C C ( = O ) [ O - ] ) C ( N ) = O |
3qqs_3twp | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C ( [ O - ] ) c 1 c c c c c 1 O |
3qqs_3u5j | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C c 1 n n c 2 n 1 - c 1 c c c ( C l ) c c 1 C ( c 1 c c c c c 1 ) = N C 2 |
3qqs_3u8k | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C O c 1 c n c c ( N 2 C C C [ N H 2 + ] C C 2 ) c 1 |
3qqs_3u8n | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C O c 1 c c ( N 2 C C C [ N H 2 + ] C C 2 ) c n c 1 B r |
3qqs_3u9q | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C C C C C C C C C ( = O ) [ O - ] |
3qqs_3udh | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C 1 N c 2 c c c c c 2 [ C @ ] 1 2 C C [ N H 2 + ] C 2 |
3qqs_3ueu | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C C C C C C C C C C C ( = O ) [ O - ] |
3qqs_3uev | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C C C C C C C C C C C C C ( = O ) [ O - ] |
3qqs_3uew | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C C C C C C C C C C C C C C C ( = O ) [ O - ] |
3qqs_3uex | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C C C C C C C C C C C C C C C C C ( = O ) [ O - ] |
3qqs_3ui7 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C O c 1 c c ( C ) c 2 n c 3 n [ n H ] c ( C ) c 3 c ( C [ N H + ] 3 C C O C C 3 ) c 2 c 1 |
3qqs_3uo4 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C ( [ O - ] ) c 1 c c c ( N c 2 n c c c ( N c 3 c c c c c 3 - c 3 c c c c c 3 ) n 2 ) c c 1 |
3qqs_3up2 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C ( [ O - ] ) c 1 c c c ( N c 2 n c c c ( N c 3 c c c c c 3 O C ( F ) ( F ) F ) n 2 ) c c 1 |
3qqs_3uri | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C S C C [ C @ H ] ( [ N H 2 + ] C [ C @ H ] ( C c 1 c c c c c 1 ) N C ( = O ) [ C @ H ] ( C O ) N C ( = O ) [ C @ H ] ( C C ( C ) C ) N C ( = O ) [ C @ H ] ( C c 1 c n c [ n H ] 1 ) N C ( = O ) [ C @ @ H ] 1 C C C [ N H 2 + ] 1 ) C ( = O ) N [ C @ @ H ] ( C ) C ( = O ) N [ C @ @ H ] ( C c 1 c n c [ n H ] 1 ) C ( = O ) [ O - ] |
3qqs_3utu | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C O c 1 c c c ( S ( = O ) ( = O ) N [ C @ @ H ] ( C C ( = O ) N C c 2 c c c ( C # N ) c c 2 ) C ( = O ) N 2 C C C [ C @ H ] 2 C ( = O ) N C c 2 c c c ( C ( N ) = [ N H 2 + ] ) c c 2 ) c c 1 C l |
3qqs_3uuo | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C O c 1 c c ( C ) c 2 n c 3 [ n H ] n c ( C ) c 3 c ( N 3 C C [ N H 2 + ] C C 3 ) c 2 c 1 |
3qqs_3wtj | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> N # C / N = C 1 \ S C C N 1 C c 1 c c c ( C l ) n c 1 |
3qqs_3wz8 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C ( C C N c 1 c c c c c 1 ) N c 1 s c c ( - c 2 c c c c c 2 ) c 1 C ( = O ) N C c 1 c c c c c 1 |
3qqs_3zdg | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C [ C @ H ] ( C C O C ( = O ) N ( C ) C ) [ N H + ] ( C ) C |
3qqs_3zso | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C = C C [ N @ H + ] ( C c 1 c c c c c 1 C ( = O ) N C ( c 1 c c c ( O C ) c c 1 ) c 1 c c c ( O C ) c c 1 ) C c 1 c c c 2 c ( c 1 C ( = O ) [ O - ] ) O C O 2 |
3qqs_3zsx | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C = C C [ N @ H + ] ( C c 1 c c c c c 1 C ( = O ) N C c 1 c c c c c 1 ) C c 1 c c c 2 c ( c 1 C ( = O ) [ O - ] ) O C O 2 |
3qqs_3zt2 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C 1 C c 2 c c c c c 2 / C 1 = C \ c 1 c c c 2 c ( c 1 C ( = O ) [ O - ] ) O C O 2 |
3qqs_4abg | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C [ N H + ] 1 C C N ( c 2 c c c c ( C [ N H 3 + ] ) c 2 ) C C 1 |
3qqs_4agn | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C [ N H + ] ( C C ) C 1 C C [ N H + ] ( C c 2 c c ( C # C C O ) c c ( I ) c 2 O ) C C 1 |
3qqs_4agp | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C [ N H + ] ( C C ) C 1 C C [ N H + ] ( C c 2 c c ( C # C C O c 3 c c c c c 3 ) c c ( I ) c 2 O ) C C 1 |
3qqs_4agq | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C [ N H + ] ( C C ) C 1 C C [ N H + ] ( C c 2 c c ( C # C C N c 3 c c c c c 3 ) c c ( I ) c 2 O ) C C 1 |
3qqs_4bkt | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C N C ( = O ) [ C @ @ H ] 1 C [ C @ @ H ] ( O ) C N 1 C ( = O ) C c 1 c c ( C ) n o 1 |
3qqs_4cig | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C O c 1 c c c ( C N C ( = O ) c 2 c c 3 c c c c c 3 c c 2 C [ N @ @ H + ] ( C ) C c 2 c c c c ( O C ) c 2 C ( = O ) [ O - ] ) c c 1 |
3qqs_4ciw | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C ( [ O - ] ) [ C @ ] 1 ( O ) C = C ( C C O ) [ C @ @ H ] ( O ) [ C @ H ] ( O ) C 1 |
3qqs_4cr9 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C c 1 c c ( N ) n c 2 c c c ( N ) c c 1 2 |
3qqs_4cra | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> N c 1 c c c 2 c ( C N C ( = O ) [ C @ H ] ( C c 3 c c c c c 3 ) N C ( = O ) c 3 c c c 4 [ n H ] c ( = O ) c c ( O ) c 4 c 3 ) c c c c 2 n 1 |
3qqs_4crc | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C ( / C = C / c 1 c c ( C l ) c c c 1 - n 1 c n n n 1 ) N [ C @ @ H ] ( C c 1 c c c c c 1 ) C ( = O ) N c 1 c c c ( - c 2 n n [ n H ] n 2 ) c c 1 |
3qqs_4ddh | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C O c 1 c c c 2 c ( C C ( = O ) [ O - ] ) c o c 2 c 1 |
3qqs_4ddk | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C ( [ O - ] ) c 1 c c c 2 c ( c 1 ) O C O 2 |
3qqs_4de1 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C ( N c 1 c c c c ( - c 2 n n n [ n H ] 2 ) c 1 ) c 1 c c c 2 n [ n H ] c c 2 c 1 |
3qqs_4de2 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C [ N H + ] ( C ) C c 1 c c c c ( C ( = O ) N c 2 c c c c ( - c 3 n n [ n H ] n 3 ) c 2 ) c 1 |
3qqs_4de3 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C ( N c 1 c c c c ( - c 2 n n [ n H ] n 2 ) c 1 ) c 1 c c c c ( B r ) c 1 |
3qqs_4djv | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C O c 1 c c c c ( - c 2 c c c c ( [ C @ @ ] 3 ( c 4 c c c c c 4 ) N C ( = [ N H 2 + ] ) N ( C ) C 3 = O ) c 2 ) c 1 |
3qqs_4dld | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> [ N H 3 + ] [ C @ @ H ] ( C c 1 c c ( C l ) c ( [ N + ] ( = O ) [ O - ] ) c c 1 C C C ( = O ) [ O - ] ) C ( = O ) [ O - ] |
3qqs_4dli | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> N c 1 c c c 2 c ( N C 3 C C 3 ) n c ( - c 3 c c c c c 3 ) n c 2 c 1 |
3qqs_4e5w | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C ( C ) [ N @ @ H + ] 1 C C C [ C @ H ] 1 C ( = O ) N 1 C C C ( n 2 c n c 3 c n c 4 [ n H ] c c c 4 c 3 2 ) C C 1 |
3qqs_4e6q | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> c 1 c c c ( C [ N H + ] 2 C C C ( n 3 c n c 4 c n c 5 [ n H ] c c c 5 c 4 3 ) C C 2 ) c c 1 |
3qqs_4ea2 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C ( C ) = C C C / C ( C ) = C \ C [ N H 2 + ] C C [ N H 2 + ] [ C @ H ] 1 [ C @ H ] 2 C [ C @ @ H ] 3 C [ C @ H ] ( C 2 ) C [ C @ H ] 1 C 3 |
3qqs_4eky | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C C C # C c 1 c n ( [ C @ @ H ] 2 O [ C @ H ] ( C O ) [ C @ @ H ] ( O ) [ C @ H ] ( O ) [ C @ H ] 2 O ) c ( = O ) [ n H ] c 1 = O |
3qqs_4eo8 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C [ C @ @ H ] 1 C C [ C @ @ H ] ( C ( = O ) N ( c 2 c c ( C # C C ( C ) ( C ) C ) s c 2 C ( = O ) [ O - ] ) [ N H + ] ( C ) C ) C C 1 |
3qqs_4eor | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> N S ( = O ) ( = O ) c 1 c c c ( N c 2 n c ( O C C 3 C C C C C 3 ) c 3 n c [ n H ] c 3 n 2 ) c c 1 |
3qqs_4f09 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C c 1 n c 2 c n c 3 [ n H ] c c c 3 c 2 n 1 C 1 C C [ N H 2 + ] C C 1 |
3qqs_4f2w | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C S C [ C @ H ] 1 C [ N @ @ H + ] ( C c 2 c [ n H ] c 3 c ( N ) n c n c 2 3 ) C [ C @ @ H ] 1 O |
3qqs_4f3c | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C C C S C [ C @ H ] 1 C [ N @ @ H + ] ( C c 2 c [ n H ] c 3 c ( N ) n c n c 2 3 ) C [ C @ @ H ] 1 O |
3qqs_4f9w | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C N ( C ) c 1 c c ( - c 2 c c n c c 2 ) c ( - c 2 c c c 3 c c c c c 3 c 2 ) n n 1 |
3qqs_4gfm | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> O = C 1 C C ( N C ( = O ) c 2 c ( C l ) c c c c 2 C l ) = C C = N 1 |
3qqs_4gid | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C C ( C ) C N C ( = O ) [ C @ @ H ] ( [ N H 2 + ] C [ C @ H ] ( C c 1 c c c c c 1 ) N C ( = O ) c 1 c c ( C ( = O ) N [ C @ H ] ( C ) c 2 c c c c c 2 ) c c ( N ( C ) S ( C ) ( = O ) = O ) c 1 ) [ C @ @ H ] ( C ) O |
3qqs_4gkm | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C c 1 c c c ( N c 2 c c c c c 2 C ( = O ) [ O - ] ) c ( C ( = O ) [ O - ] ) c 1 |
3qqs_4gr0 | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C [ C @ H ] ( N C ( = O ) [ C @ H ] ( C ) N C ( = O ) [ C @ H ] ( C c 1 c c ( - c 2 c c c ( - c 3 c c c c ( C l ) c 3 ) c c 2 ) n o 1 ) C [ P @ @ ] ( = O ) ( [ O - ] ) c 1 c c c ( B r ) c c 1 ) C ( N ) = O |
3qqs_4hge | <PKT> M M T H G N R A A F A P R F H P S Y R H A A A V R R T F N L L G P L T N P <SMI> C c 1 c c ( N C ( = O ) c 2 c n n 3 c c c n c 2 3 ) n ( - c 2 c c c c ( C l ) c 2 ) n 1 |
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