0 B13R0.353 NC(=O)[C@@H](N)CSSC[C@H](N)C(N)=O Amb22800226 [0,0,0,0,0,0|2,0,0]=2 1 B13R0.353 NC(CCCCC(N)C(=O)O)C(=O)O Amb533594 [0,0,0,0,0,0|2,0,0]=2 2 B13R0.353 NC(CCSCC(N)C(=O)O)C(=O)O Amb2099550 [0,0,0,0,0,0|1,0,0]=1 3 B13R0.353 NC(CCSCC(N)C(=O)O)C(=O)O Amb32662836 [0,0,0,0,0,0|1,0,0]=1 4 B13R0.353 NC(CSSCC(N)C(=O)O)C(=O)O Amb22352084 [0,0,0,0,0,0|0,0,0]=0 5 B13R0.353 NC(CSSCC(N)C(=O)O)C(=O)O Amb33512771 [0,0,0,0,0,0|0,0,0]=0 6 B13R0.353 NC(CSSCC(N)C(=O)O)C(=O)O Amb9702848 [0,0,0,0,0,0|0,0,0]=0 7 B13R0.353 NC(CSSCC(N)C(=O)[O-])C(=O)[O-] Amb22732714 [0,0,0,0,0,0|0,0,2]=2 8 B13R0.353 NC(CSSC[C@@H](N)C(=O)O)C(=O)O Amb17678827 [0,0,0,0,0,0|0,0,0]=0 9 B13R0.353 NC(CSSC[C@H](N)C(=O)O)C(=O)O Amb16232227 [0,0,0,0,0,0|0,0,0]=0 10 B13R0.353 NC(C[Se][Se]C[C@H](N)C(=O)O)C(=O)O Amb22800420 [0,0,0,0,0,0|0,2,0]=2 11 B13R0.353 N[C@@H](CSSC[C@H](N)C(=O)O)C(=O)O Amb22168479 [0,0,0,0,0,0|0,0,0]=0 12 B13R0.353 N[C@@H](CSSC[C@H](N)C(=O)O)C(=O)O Amb22799683 [0,0,0,0,0,0|0,0,0]=0 13 B13R0.353 N[C@@H](CSSC[C@H](N)C(=O)O)C(=O)O Amb2725610 [0,0,0,0,0,0|0,0,0]=0 14 B13R0.353 N[C@@H](CSSC[C@H](N)C(=O)[O-])C(=O)[O-] Amb22735895 [0,0,0,0,0,0|0,0,2]=2 15 B13R0.353 N[C@H](CSSC[C@@H](N)C(=O)O)C(=O)O Amb8513331 [0,0,0,0,0,0|0,0,0]=0 16 B13R0.353 [NH3+]C(CSSCC([NH3+])C(=O)O)C(=O)O Amb9787414 [0,0,0,0,0,0|0,0,2]=2 17 B12R0.42 NC(CCCCCC(=O)O)C(=O)O Amb10807509 [1,0,0,0,0,0|2,0,0]=3 18 B12R0.42 N[C@@H](CCCCCC(=O)O)C(=O)O Amb17678794 [1,0,0,0,0,0|2,0,0]=3 19 B12R0.42 N[C@H](CCCCCC(=O)O)C(=O)O Amb33757551 [1,0,0,0,0,0|2,0,0]=3 20 B12R0.42 O=C(O)CCCSCC(=O)C(=O)O Amb33069687 [1,0,0,0,0,0|2,0,1]=4 21 B14R1.16325 O=C(O)[C@@H]1CCCC[C@H](C(=O)O)NN1 Amb27754047 [0,0,0,1,0,0|2,0,0]=3 22 B12R0.627 CC(CSCC(=O)C(=O)O)C(=O)O Amb33069694 [0,0,0,0,1,0|2,0,1]=4 23 B12R0.627 CC(CSC[C@@H](N)C(=O)O)C(=O)O Amb24117976 [0,0,0,0,1,0|1,0,0]=2 24 B12R0.627 NC(=O)C(N)CSCC(=O)C(=O)O Amb33069695 [0,0,0,0,1,0|2,0,1]=4 25 B12R0.627 NC(CCCC(N)C(=O)O)C(=O)O Amb533293 [0,0,0,0,1,0|1,0,0]=2 26 B12R0.627 NC(CSCC(=O)C(=O)O)C(=O)O Amb33069702 [0,0,0,0,1,0|1,0,1]=3 27 B12R0.627 N[C@@H](CCC[C@@H](N)C(=O)O)C(=O)O Amb33524015 [0,0,0,0,1,0|1,0,0]=2 28 B12R0.627 O=C(O)C(=O)CSCC(Cl)C(=O)O Amb33069705 [0,0,0,0,1,0|2,0,1]=4 29 B12R0.627 O=C(O)C(=O)CSCC(O)C(=O)O Amb33069688 [0,0,0,0,1,0|2,0,1]=4 30 B14R0.405 NC(CCCCCC(N)C(=O)O)C(=O)O Amb1054832 [0,0,0,0,0,1|2,0,0]=3 31 B14R0.405 N[C@@H](CCCCC[C@@H](N)C(=O)O)C(=O)O Amb22745443 [0,0,0,0,0,1|2,0,0]=3 32 B11R0.30 NC(=O)CCSSCCC(N)=O Amb2405304 [2,0,0,0,0,0|2,0,0]=4 33 B11R0.30 O=C(Cl)CCSSCCC(=O)Cl Amb24090125 [2,0,0,0,0,0|2,0,0]=4 34 B11R0.30 O=C(O)CCCCCCC(=O)O Amb533225 [2,0,0,0,0,0|2,0,0]=4 35 B11R0.30 O=C(O)CCCSCCC(=O)O Amb17501237 [2,0,0,0,0,0|1,0,0]=3 36 B11R0.30 O=C(O)CCSSCCC(=O)O Amb3941592 [2,0,0,0,0,0|0,0,0]=2 37 B11R0.30 O=C(O)CC\C=C\CCC(=O)O Amb33986633 [2,0,0,0,0,0|2,0,0]=4 38 B13R0.1238 C[C@H](SC[C@H](N)C(=O)O)[C@@H](N)C(=O)O Amb33756830 [0,1,0,0,1,0|0,0,0]=2 39 B15R0.118 COC(=O)C(C)CSSCC(C)C(=O)OC Amb19148012 [0,2,0,0,0,0|2,0,0]=4 40 B15R0.118 COC(=O)C(N)CSSCC(N)C(=O)OC Amb8630316 [0,2,0,0,0,0|0,0,0]=2 41 B15R0.118 COC(=O)[C@@H](N)CSSC[C@H](N)C(=O)OC Amb8514731 [0,2,0,0,0,0|0,0,0]=2 42 B15R0.118 COC(=O)[C@H](N)CSSC[C@@H](N)C(=O)OC Amb33812687 [0,2,0,0,0,0|0,0,0]=2 43 B13R1.587 NC(=O)CC1NC(C(=O)O)CCS1 Amb27794303 [1,0,0,1,0,0|2,0,0]=4 44 B13R1.587 O=C(O)CC1CCC[C@@H](C(=O)O)N1 Amb27405039 [1,0,0,1,0,0|2,0,0]=4 45 B13R1.587 O=C(O)C[C@@H]1CCC[C@@H](C(=O)O)N1 Amb27632402 [1,0,0,1,0,0|2,0,0]=4 46 B13R1.2025 NC1(C(=O)O)CCCC1CC(=O)O Amb27754811 [1,0,0,1,0,0|2,0,0]=4 47 B13R1.2025 N[C@]1(C(=O)O)CCC[C@H]1CC(=O)O Amb28140671 [1,0,0,1,0,0|2,0,0]=4 48 B13R1.1078 N[C@H](C(=O)O)[C@@H]1CC[C@H](C(=O)O)C1 Amb27865480 [0,0,0,1,1,0|2,0,0]=4 49 B13R1.8652 O=C(O)[C@@H]1CCC[C@H](C(=O)O)NN1 Amb28193432 [0,0,0,1,1,0|1,0,0]=3 50 B13R1.8780 N[C@]1(C(=O)O)CCC[C@@H](C(=O)O)C1 Amb27228976 [0,0,0,1,1,0|2,0,0]=4 51 B13R1.8780 N[C@]1(C(=O)O)CCC[C@H](C(=O)O)C1 Amb27490058 [0,0,0,1,1,0|2,0,0]=4 52 B11R0.150 NC(CCC(N)C(=O)O)C(=O)O Amb10602546 [0,0,0,0,2,0|0,0,0]=2 53 B11R0.150 O=C(O)C(Br)CCC(Br)C(=O)O Amb4036374 [0,0,0,0,2,0|2,0,0]=4 54 B15R0.3275 NC(CCCCNCC(N)C(=O)O)C(=O)O Amb22731707 [0,0,0,0,0,2|2,0,0]=4 55 B15R0.3275 NC(CCSSCCC(N)C(=O)O)C(=O)O Amb4005058 [0,0,0,0,0,2|0,0,0]=2 56 B15R0.3275 NC(CCSSCC[C@H](N)C(=O)O)C(=O)O Amb16232668 [0,0,0,0,0,2|0,0,0]=2 57 B15R0.3275 NC(CSCCSCC(N)C(=O)O)C(=O)O Amb9787840 [0,0,0,0,0,2|0,0,0]=2 58 B15R0.3275 N[C@@H](CCSSCC[C@@H](N)C(=O)O)C(=O)O Amb33758068 [0,0,0,0,0,2|0,0,0]=2 59 B15R0.3275 N[C@@H](CCSSCC[C@H](N)C(=O)O)C(=O)O Amb9813715 [0,0,0,0,0,2|0,0,0]=2 60 B15R0.3275 N[C@H](CCSSCC[C@@H](N)C(=O)O)C(=O)O Amb33788867 [0,0,0,0,0,2|0,0,0]=2