0 B11R0.29 C(=O)([C@@H](N)CCCNC(=N)N)O T0670 [0,0,0,0,0,0|0,0,2]=2 1 B11R0.29 CC(=N)NCCC[C@H](N)C(O)=O T11806 [0,0,0,0,0,0|1,0,2]=3 2 B11R0.29 CC(C)=CCSC[C@H](N)C(O)=O T34129 [0,0,0,0,0,0|4,0,0]=4 3 B11R0.29 NC(=N)NCCC[C@H](O)C(O)=O T19197 [0,0,0,0,0,0|1,0,2]=3 4 B11R0.29 NC(CCCN=C(N)N)C(O)=O T19288 [0,0,0,0,0,0|0,0,0]=0 5 B11R0.29 NC(CCCNC(N)=O)C(O)=O T2931 [0,0,0,0,0,0|1,0,1]=2 6 B11R0.29 N[C@@H](CCCNC(N)=N)C(N)=O T23754 [0,0,0,0,0,0|1,0,2]=3 7 B11R0.29 N[C@@H](CCCNC(N)=N)C(N)=O T4023 [0,0,0,0,0,0|1,0,2]=3 8 B11R0.29 N[C@@H](CCCNC(N)=N)C(O)=O T20262 [0,0,0,0,0,0|0,0,2]=2 9 B11R0.29 N[C@@H](CCCNC(N)=N)C(O)=O T30125 [0,0,0,0,0,0|0,0,2]=2 10 B11R0.29 N[C@@H](CCCNC(N)=N)C(O)=O T3S0364 [0,0,0,0,0,0|0,0,2]=2 11 B11R0.29 N[C@@H](CCCNC(N)=O)C(O)=O T20200 [0,0,0,0,0,0|1,0,1]=2 12 B11R0.29 N[C@@H](CCCNC(N)=O)C(O)=O T4813 [0,0,0,0,0,0|1,0,1]=2 13 B11R0.29 N[C@@H](CCONC(N)=N)C(O)=O T5838 [0,0,0,0,0,0|1,0,2]=3 14 B11R0.29 O=C(O)C(N)CCONC(N)=N T24957 [0,0,0,0,0,0|1,0,2]=3 15 B11R0.29 O=C(O)[C@@H](N)CCCCB(O)O T26516 [0,0,0,0,0,0|4,0,0]=4 16 B10R0.75 CCCCCCC(N)C(O)=O T9493 [1,0,0,0,0,0|2,0,1]=4 17 B10R0.75 NCCCSC[C@H](N)C(O)=O T29988 [1,0,0,0,0,0|2,0,1]=4 18 B10R0.75 NCCC[Se]C[C@H](N)C(O)=O T34606 [1,0,0,0,0,0|2,0,1]=4 19 B10R0.97 OC(=O)CCCCCC(O)=O T4795 [1,0,0,0,0,0|3,0,0]=4 20 B12R0.186 CNC(=N)NCCC[C@H](N)C(O)=O T15697 [0,1,0,0,0,0|0,0,2]=3 21 B12R0.186 CNC(=N)NCCC[C@H](N)C(O)=O T24982 [0,1,0,0,0,0|0,0,2]=3 22 B12R0.186 CNC(=N)NCCC[C@H](N)C(O)=O T26277 [0,1,0,0,0,0|0,0,2]=3 23 B12R0.186 CSC(=N)NCCC[C@H](N)C(O)=O T16830 [0,1,0,0,0,0|1,0,2]=4 24 B12R0.186 N[C@@H](CCCNC(NC)=N)C(O)=O T26277L [0,1,0,0,0,0|0,0,2]=3 25 B12R0.238 CN[C@@H](CCCN=C(N)N)C(O)=O T23047 [0,1,0,0,0,0|0,0,0]=1 26 B12R0.238 NC(N)=NCCCC(CS)C(O)=O T28842 [0,1,0,0,0,0|1,0,0]=2 27 B12R0.627 NC(CCCC(N)C(O)=O)C(O)=O T4889 [0,1,0,0,0,0|3,0,0]=4 28 B10R0.98 NC(CCCC(O)=O)C(O)=O T4705 [0,0,0,0,1,0|2,0,0]=3 29 B10R0.98 NC(CSCC(O)=O)C(O)=O T13440 [0,0,0,0,1,0|3,0,0]=4 30 B10R0.98 N[C@@H](CSCC(O)=O)C(O)=O T20124 [0,0,0,0,1,0|3,0,0]=4 31 B10R0.98 N[C@@H](CSCC(O)=O)C(O)=O T3612 [0,0,0,0,1,0|3,0,0]=4 32 B10R0.98 OC(CCCC(O)=O)C(O)=O T19102 [0,0,0,0,1,0|3,0,0]=4 33 B12R0.42 C/C(N)=N\CCCC[C@H](N)C(O)=O T22914 [0,0,0,0,0,1|1,0,0]=2 34 B12R0.42 CC(=N)NCCCC[C@H](N)C(O)=O T11805 [0,0,0,0,0,1|1,0,2]=4 35 B12R0.42 CC(=O)NCCCC[C@H](N)C(O)=O T8101 [0,0,0,0,0,1|2,0,1]=4 36 B12R0.42 N[C@@H](CCCCNC(N)=N)C(O)=O T3938 [0,0,0,0,0,1|0,0,2]=3 37 B12R0.42 N[C@@H](CCCCNC(N)=O)C(O)=O T5257 [0,0,0,0,0,1|1,0,1]=3 38 B12R0.42 N[C@@H](CSCCCC(O)=O)C(O)=O T34471 [0,0,0,0,0,1|3,0,0]=4 39 B9R0.2 NOCCCCCC(O)=O T18489 [2,0,0,0,0,0|2,0,0]=4 40 B9R0.47 NCCCCC(N)C(O)=O T19290 [2,0,0,0,0,0|0,0,1]=3 41 B9R0.47 NCCCC[C@@H](N)C(O)=O T21054 [2,0,0,0,0,0|0,0,1]=3 42 B9R0.47 NCCCC[C@@H](N)C(O)=O T33065 [2,0,0,0,0,0|0,0,1]=3 43 B9R0.47 NCCCC[C@H](N)C(N)=O T32814 [2,0,0,0,0,0|1,0,1]=4 44 B9R0.47 NCCCC[C@H](N)C(O)=O T21053 [2,0,0,0,0,0|0,0,1]=3 45 B9R0.47 NCCCC[C@H](N)C(O)=O T21055 [2,0,0,0,0,0|0,0,1]=3 46 B9R0.47 NCCCC[C@H](N)C(O)=O T2A2498 [2,0,0,0,0,0|0,0,1]=3 47 B9R0.47 NCCCC[C@H](N)C(O)=O T2A2498L2 [2,0,0,0,0,0|0,0,1]=3 48 B9R0.47 NCCCC[C@H](N)C(O)=O T32815 [2,0,0,0,0,0|0,0,1]=3 49 B9R0.47 NCCCC[C@H](N)C(O)=O T32819 [2,0,0,0,0,0|0,0,1]=3 50 B9R0.47 NCCCC[C@H](N)C(O)=O T33047 [2,0,0,0,0,0|0,0,1]=3 51 B9R0.47 NCCCC[C@H](N)C(O)=O T33050 [2,0,0,0,0,0|0,0,1]=3 52 B9R0.47 NCCCC[C@H](N)C(O)=O T33051 [2,0,0,0,0,0|0,0,1]=3 53 B9R0.47 NCCCC[C@H](N)C(O)=O T33054 [2,0,0,0,0,0|0,0,1]=3 54 B9R0.47 NCCCC[C@H](N)C(O)=O T33056 [2,0,0,0,0,0|0,0,1]=3 55 B9R0.47 NCCCC[C@H](N)C(O)=O T33057 [2,0,0,0,0,0|0,0,1]=3 56 B9R0.47 NCCCC[C@H](N)C(O)=O T33060 [2,0,0,0,0,0|0,0,1]=3 57 B9R0.47 NCCCC[C@H](N)C(O)=O T33061 [2,0,0,0,0,0|0,0,1]=3 58 B9R0.47 NCCCC[C@H](N)C(O)=O T33063 [2,0,0,0,0,0|0,0,1]=3 59 B9R0.47 NCCCC[C@H](N)C(O)=O T33089 [2,0,0,0,0,0|0,0,1]=3 60 B9R0.47 NCCCC[C@H](N)C(O)=O T8071 [2,0,0,0,0,0|0,0,1]=3 61 B9R0.47 NCCCC[C@H]([NH3+])C(O)=O T2A2498L [2,0,0,0,0,0|0,0,2]=4 62 B9R0.47 NCCOC[C@H](N)C(O)=O T11795 [2,0,0,0,0,0|1,0,1]=4 63 B9R0.47 NCC[Se]C[C@H](N)C(O)=O T26183 [2,0,0,0,0,0|1,0,1]=4 64 B9R0.47 N[C@@H](CCCCN)C(O)=O T24153 [2,0,0,0,0,0|0,0,1]=3 65 B9R0.47 N[C@@H](CCCCN)C(O)=O T2A2498L3 [2,0,0,0,0,0|0,0,1]=3 66 B9R0.47 N[C@@H](CCN=[N+]=[N-])C(O)=O T15693 [2,0,0,0,0,0|1,0,1]=4 67 B9R0.47 N[C@@H](CCSC=C)C(O)=O T35061 [2,0,0,0,0,0|2,0,0]=4 68 B9R0.47 N[C@@H](CCSN=O)C(O)=O T26199 [2,0,0,0,0,0|2,0,0]=4 69 B9R0.47 N[C@@H](CSCCN)C(O)=O T34844 [2,0,0,0,0,0|1,0,1]=4 70 B9R0.47 OC(=O)[C@@H](N)CSCC=C T2772 [2,0,0,0,0,0|2,0,0]=4 71 B13R0.1121 N[C@@H](CCC/N=C(\NC)NC)C(=O)O T7344 [0,2,0,0,0,0|0,0,0]=2 72 B11R1.704 NC(C1CC1C(O)=O)C(O)=O T23864 [0,0,0,1,1,0|2,0,0]=4 73 B11R1.704 N[C@@H]([C@H]1C[C@@H]1C(O)=O)C(O)=O T22912 [0,0,0,1,1,0|2,0,0]=4 74 B11R1.704 [C@@H](N)(C(O)=O)[C@H]1C[C@H]1C(O)=O T22913 [0,0,0,1,1,0|2,0,0]=4 75 B9R0.7 C(=O)([C@@H](N)CCC(=O)N)O T0326L [0,0,0,0,2,0|1,0,0]=3 76 B9R0.7 NC(CCC(N)=O)C(O)=O T0326 [0,0,0,0,2,0|1,0,0]=3 77 B9R0.7 NC(CC[C@H](N)C(O)=O)=O T34105 [0,0,0,0,2,0|1,0,0]=3 78 B9R0.7 N[C@@H](CCC(N)=O)C(N)=O T25454 [0,0,0,0,2,0|2,0,0]=4 79 B9R0.7 N[C@@H](CCC(O)=O)C(O)=O T24594 [0,0,0,0,2,0|2,0,0]=4 80 B9R0.7 N[C@@H](CCC(O)=O)C(O)=O T2A2497 [0,0,0,0,2,0|2,0,0]=4 81 B9R0.7 N[C@@H](CCC(O)=O)C(O)=O T31266 [0,0,0,0,2,0|2,0,0]=4 82 B9R0.7 N[C@@H](CCC(O)=O)C(O)=O T34937 [0,0,0,0,2,0|2,0,0]=4 83 B9R0.7 N[C@@H](CC[14C](O)=O)C(O)=O T32734 [0,0,0,0,2,0|2,0,0]=4 84 B9R0.7 N[C@@H](CNC(N)=O)C(O)=O T20121 [0,0,0,0,2,0|1,0,1]=4 85 B9R0.7 N[C@H](CCC(N)=O)C(O)=O T6468 [0,0,0,0,2,0|1,0,0]=3 86 B9R0.7 N[C@H](CCC(O)=O)C(O)=O T10935 [0,0,0,0,2,0|2,0,0]=4