0 B9R0.39 CC(=O)NC(CS)C(=O)N S5804 [0,0,0,0,0,0|1,0,0]=1 1 B9R0.39 CC(=O)NC(CS)C(=O)N S5804 [0,0,0,0,0,0|1,0,0]=1 2 B9R0.39 CC(=O)NC(CS)C(=O)O S1623 [0,0,0,0,0,0|0,0,0]=0 3 B9R0.39 CC(=O)NC(CS)C(=O)O S1623 [0,0,0,0,0,0|0,0,0]=0 4 B9R0.39 CC(=O)NC(CS)C(=O)O S1623 [0,0,0,0,0,0|0,0,0]=0 5 B9R0.39 CC(=O)NC(CS)C(=O)O S1623 [0,0,0,0,0,0|0,0,0]=0 6 B9R0.39 CNC(CC(=O)O)C(=O)O S7072 [0,0,0,0,0,0|4,0,0]=4 7 B9R0.39 CNC(CC(=O)O)C(=O)O S7072 [0,0,0,0,0,0|4,0,0]=4 8 B8R0.23 C(C(C(=O)O)N)C(=O)N S4950 [1,0,0,0,0,0|3,0,0]=4 9 B8R0.23 C(C(C(=O)O)N)C(=O)N S5571 [1,0,0,0,0,0|3,0,0]=4 10 B8R0.23 C(C(C(=O)O)N)C(=O)O S5129 [1,0,0,0,0,0|3,0,0]=4 11 B8R0.23 C(C(C(=O)O)N)C(=O)O S5632 [1,0,0,0,0,0|3,0,0]=4 12 B8R0.23 C(C(C(=O)O)O)C(=O)O S6292 [1,0,0,0,0,0|2,1,0]=4 13 B8R0.23 C(C(C(=O)O)O)C(=O)O S9001 [1,0,0,0,0,0|2,1,0]=4 14 B8R0.23 CC(CC(=O)O)C(=O)O S6356 [1,0,0,0,0,0|2,0,0]=3 15 B10R1.64 CC(=O)NC1CCSC1=O S4558 [0,0,0,1,0,0|1,1,0]=3 16 B10R1.64 CC(=O)NC1CCSC1=O S4558 [0,0,0,1,0,0|1,1,0]=3 17 B10R1.113 CC1=NCCC(N1)C(=O)O S5591 [0,0,0,1,0,0|2,0,0]=3 18 B7R0.5 CC(CC=C)C(=O)O S6167 [2,0,0,0,0,0|1,0,1]=4 19 B7R0.15 CCC(CC)C(=O)O S6057 [2,0,0,0,0,0|1,0,1]=4 20 B7R0.6 C(CC(=O)O)C(=O)O S3791 [2,0,0,0,0,0|2,0,0]=4 21 B7R0.6 CC(=O)CCC(=O)O S6207 [2,0,0,0,0,0|1,0,0]=3 22 B9R0.79 C(C(C(=O)O)S)(C(=O)O)S S4692 [1,1,0,0,0,0|2,0,0]=4 23 B11R0.160 CC(=O)NC(CCCN)C(=O)O S6116 [0,2,0,0,0,0|1,0,0]=3 24 B11R0.160 CC(=O)NC(CCCN)C(=O)O S6116 [0,2,0,0,0,0|1,0,0]=3 25 B11R0.160 CC(=O)NC(CCSC)C(=O)O S6205 [0,2,0,0,0,0|0,0,0]=2 26 B11R0.108 CC(C)C(C(=O)O)NC(=O)CN S6120 [0,2,0,0,0,0|1,0,0]=3 27 B9R1.6 C1CCNC(C1)C(=O)O S6302 [1,0,0,1,0,0|1,0,1]=4 28 B9R1.6 C1CCNC(C1)C(=O)O S6322 [1,0,0,1,0,0|1,0,1]=4 29 B9R1.35 C1CC(=O)NC1C(=O)O S5823 [1,0,0,1,0,0|1,0,0]=3 30 B11R1.74 C1C(NC(=O)NC1=O)C(=O)O S6111 [0,1,0,1,0,0|1,1,0]=4 31 B7R0.16 C(C(=O)O)(C(=O)O)N S6129 [1,0,0,0,1,0|2,0,0]=4 32 B7R0.16 C(C(=O)O)(C(=O)O)N S6129 [1,0,0,0,1,0|2,0,0]=4 33 B7R0.16 CC(C(=O)O)C(=O)O S3683 [1,0,0,0,1,0|1,0,0]=3 34 B9R0.7 CC(=O)OCC(C(=O)O)N S6144 [1,0,0,0,0,1|2,0,0]=4 35 B9R0.7 CC(=O)OCC(C(=O)O)N S6144 [1,0,0,0,0,1|2,0,0]=4 36 B9R0.7 CC(CCC(=O)O)C(=O)O S6110 [1,0,0,0,0,1|2,0,0]=4