0 B11R0.29 N=C(N)NCCC[C@H](N)C(=O)O 95720 [0,0,0,0,0,0|0,0,2]=2 1 B11R0.29 N=C(N)NCCC[C@H](N)C(=O)O AC8019 [0,0,0,0,0,0|0,0,2]=2 2 B11R0.29 N=C(N)NCCC[C@H](N)C(=O)O C10586 [0,0,0,0,0,0|0,0,2]=2 3 B11R0.29 N=C(N)NCCC[C@H](N)C(=O)O D70773 [0,0,0,0,0,0|0,0,2]=2 4 B11R0.29 N=C(N)NCCC[C@H](N)C(=O)O D88273 [0,0,0,0,0,0|0,0,2]=2 5 B11R0.29 N=C(N)NCCC[C@H](N)C(=O)O F10938 [0,0,0,0,0,0|0,0,2]=2 6 B11R0.29 N=C(N)NCCC[C@H](N)C(=O)O F11039 [0,0,0,0,0,0|0,0,2]=2 7 B11R0.29 N=C(N)NCCC[C@H](N)C(N)=O H11978 [0,0,0,0,0,0|1,0,2]=3 8 B11R0.29 NC(=O)NCCC[C@H](N)C(=O)O 22412 [0,0,0,0,0,0|1,0,1]=2 9 B11R0.29 NC(=O)NCCC[C@H](N)C(=O)O 27644 [0,0,0,0,0,0|1,0,1]=2 10 B11R0.29 NC(=O)NCCC[C@H](N)C(=O)O D71216 [0,0,0,0,0,0|1,0,1]=2 11 B11R0.29 NC(=O)NCCC[C@H](N)C(=O)O D89239 [0,0,0,0,0,0|1,0,1]=2 12 B11R0.29 NC(N)=NCCC[C@H](N)C(=O)O 39368 [0,0,0,0,0,0|0,0,0]=0 13 B11R0.29 N[C@@H](CCCCC(=O)O)C(=O)O F16285 [0,0,0,0,0,0|3,0,0]=3 14 B10R0.75 CCCCCC[C@H](N)C(=O)O C14122 [1,0,0,0,0,0|2,0,1]=4 15 B10R0.75 CCCCCC[C@H](N)C(=O)O D86759 [1,0,0,0,0,0|2,0,1]=4 16 B10R0.75 CCCCCC[C@H](N)C(=O)O S10911 [1,0,0,0,0,0|2,0,1]=4 17 B10R0.75 CNCCCC[C@H](N)C(=O)O F11031 [1,0,0,0,0,0|3,0,0]=4 18 B10R0.97 CC(=O)CCCCCC(=O)O W15940 [1,0,0,0,0,0|3,0,0]=4 19 B10R0.97 O=C(O)CCCCCC(=O)O D70876 [1,0,0,0,0,0|3,0,0]=4 20 B12R0.86 COC(=O)[C@@H](N)CCCN=C(N)N D88497 [0,1,0,0,0,0|0,0,0]=1 21 B12R0.86 COC(=O)[C@@H](N)CCCNC(=N)N H11979 [0,1,0,0,0,0|0,0,2]=3 22 B12R0.627 NC(CCCC(N)C(=O)O)C(=O)O D89595 [0,1,0,0,0,0|3,0,0]=4 23 B12R1.258 O=C(O)[C@@H]1CCC[C@H](C(=O)O)N1 D83887 [0,0,0,1,0,0|3,0,0]=4 24 B10R0.98 N[C@@H](CCCC(=O)O)C(=O)O 46018 [0,0,0,0,1,0|2,0,0]=3 25 B10R0.98 N[C@@H](CCCC(=O)O)C(=O)O 46020 [0,0,0,0,1,0|2,0,0]=3 26 B10R0.98 N[C@@H](CCCC(=O)O)C(=O)O 51942 [0,0,0,0,1,0|2,0,0]=3 27 B10R0.98 N[C@@H](CSCC(=O)O)C(=O)O H11928 [0,0,0,0,1,0|3,0,0]=4 28 B12R0.42 CC(=O)NCCCC[C@H](N)C(=O)O F10994 [0,0,0,0,0,1|2,0,1]=4 29 B12R0.42 N=C(N)NCCCC[C@H](N)C(=O)O 33667 [0,0,0,0,0,1|0,0,2]=3 30 B12R0.42 N=C(N)NCCCC[C@H](N)C(=O)O AC2507 [0,0,0,0,0,1|0,0,2]=3 31 B12R0.42 NC(=O)NCCCC[C@H](N)C(=O)O 25800 [0,0,0,0,0,1|1,0,1]=3 32 B12R0.42 N[C@@H](CCCCCC(=O)O)C(=O)O D88405 [0,0,0,0,0,1|3,0,0]=4 33 B9R0.2 NCCCCCCC(=O)O 33797 [2,0,0,0,0,0|1,0,1]=4 34 B9R0.2 NCCCCCCC(=O)O F11866 [2,0,0,0,0,0|1,0,1]=4 35 B9R0.47 C=CCSC[C@H](N)C(=O)O D70846 [2,0,0,0,0,0|2,0,0]=4 36 B9R0.47 C=CCSC[C@H](N)C(=O)O F10957 [2,0,0,0,0,0|2,0,0]=4 37 B9R0.47 CCCCC[C@H](N)C(=O)O C71385 [2,0,0,0,0,0|1,0,1]=4 38 B9R0.47 NCCCC[C@H](N)C(=O)O 23029 [2,0,0,0,0,0|0,0,1]=3 39 B9R0.47 NCCCC[C@H](N)C(=O)O 26700 [2,0,0,0,0,0|0,0,1]=3 40 B9R0.47 NCCCC[C@H](N)C(=O)O 70041 [2,0,0,0,0,0|0,0,1]=3 41 B9R0.47 NCCCC[C@H](N)C(=O)O AC7885 [2,0,0,0,0,0|0,0,1]=3 42 B9R0.47 NCCCC[C@H](N)C(=O)O D70557 [2,0,0,0,0,0|0,0,1]=3 43 B9R0.47 NCCCC[C@H](N)C(=O)O D70613 [2,0,0,0,0,0|0,0,1]=3 44 B9R0.47 NCCCC[C@H](N)C(=O)O F11082 [2,0,0,0,0,0|0,0,1]=3 45 B9R0.47 NCCCC[C@H](N)C(=O)O FD20004 [2,0,0,0,0,0|0,0,1]=3 46 B9R0.47 NCCCC[C@H](N)C(=O)O S10365 [2,0,0,0,0,0|0,0,1]=3 47 B9R0.47 NCCCC[C@H](N)C(N)=O F10910 [2,0,0,0,0,0|1,0,1]=4 48 B11R1.35 N[C@@H](CC1=CN=CN1)C(=O)O D86696 [1,0,0,1,0,0|0,0,2]=4 49 B11R1.35 N[C@@H](CC1=CN=CN1)C(=O)O FD20036 [1,0,0,1,0,0|0,0,2]=4 50 B11R1.178 NC(=O)N1CCC[C@H]1C(=O)O D85727 [1,0,0,1,0,0|1,0,1]=4 51 B9R0.7 NC(=O)CC[C@H](N)C(=O)O 23178 [0,0,0,0,2,0|1,0,0]=3 52 B9R0.7 NC(=O)CC[C@H](N)C(=O)O 28640 [0,0,0,0,2,0|1,0,0]=3 53 B9R0.7 NC(=O)CC[C@H](N)C(=O)O D70833 [0,0,0,0,2,0|1,0,0]=3 54 B9R0.7 NC(=O)NC[C@H](N)C(=O)O C90278 [0,0,0,0,2,0|1,0,1]=4 55 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O 28645 [0,0,0,0,2,0|2,0,0]=4 56 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O AC7831 [0,0,0,0,2,0|2,0,0]=4 57 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O D70530 [0,0,0,0,2,0|2,0,0]=4