0 B8R1.18 C1[C@@H](C(=O)NC1=O)N SNN [0,0,0,0,0,0|1,0,0]=1 1 B7R1.2 C1C(=O)NC(=O)N1 HYN [1,0,0,0,0,0|0,0,0]=1 2 B7R1.2 C1CC(=O)CC1=O CEJ [1,0,0,0,0,0|2,0,0]=3 3 B7R1.4 C1COC(=O)[C@H]1N HSL [1,0,0,0,0,0|2,0,1]=4 4 B7R1.4 C1[C@H](C(=O)NO1)N 4AX [1,0,0,0,0,0|2,0,0]=3 5 B7R1.4 CN1C=CNC1=S MMZ [1,0,0,0,0,0|1,1,1]=4 6 B7R1.4 CN1CCCC1=O MB3 [1,0,0,0,0,0|2,0,1]=4 7 B7R1.4 CN1CCOC1=O 3MO [1,0,0,0,0,0|2,0,1]=4 8 B7R0.2 C(C(=O)O)N(C=O)O HDA [0,0,1,0,0,0|2,0,0]=3 9 B7R0.2 C([C@@H](C=O)N)C(=O)O ASA [0,0,1,0,0,0|2,0,0]=3 10 B7R0.2 C([C@@H]([C-]=O)[NH-])C(=O)N ASN_LL [0,0,1,0,0,0|1,0,2]=4 11 B7R0.2 C([C@@H]([C-]=O)[NH3+])C(=O)N ASN_LSN3 [0,0,1,0,0,0|1,0,2]=4 12 B7R0.5 C(C=O)[C@H](C(=O)O)N AS2 [0,0,1,0,0,0|2,0,0]=3 13 B7R0.5 C([C@@H](C(=O)O)N)[SH]=O CSX [0,0,1,0,0,0|3,0,0]=4 14 B7R0.5 C([C@@H](C(=O)O)N)[SeH]=O UOX [0,0,1,0,0,0|3,0,0]=4 15 B7R0.5 C=CC[C@@H](C(=O)O)N 2AG [0,0,1,0,0,0|3,0,0]=4 16 B7R0.5 C=CC[C@H](C(=O)O)N DYL [0,0,1,0,0,0|3,0,0]=4 17 B9R1.34 C1C(=NC(=O)NC1=O)N 6UA [0,0,0,0,0,1|1,0,0]=2 18 B9R1.34 C1C(=O)NC(=O)NC1=O BR8 [0,0,0,0,0,1|2,0,0]=3 19 B9R1.69 C1=C(C(=NC(=O)N1)N)F 1LD [0,0,0,0,0,1|3,0,0]=4 20 B9R1.69 C1=C(C(=O)NC(=O)N1)Br URB [0,0,0,0,0,1|2,0,1]=4 21 B9R1.69 C1=C(C(=O)NC(=O)N1)Cl 5UC [0,0,0,0,0,1|2,0,1]=4 22 B9R1.69 C1=C(C(=O)NC(=O)N1)F URF [0,0,0,0,0,1|2,0,1]=4 23 B9R1.69 C1=C(C(=O)NC(=O)N1)I IUR [0,0,0,0,0,1|2,0,1]=4 24 B9R1.69 C1=C(C(=O)NC(=O)N1)N WBU [0,0,0,0,0,1|1,0,1]=3 25 B9R1.69 C1[C@@H](C(=O)NC(=O)N1)I IDH [0,0,0,0,0,1|2,0,0]=3 26 B9R1.69 CC1=CNC(=O)N=C1N 17E [0,0,0,0,0,1|3,0,0]=4 27 B9R1.69 CC1=CNC(=O)NC1=O TDR [0,0,0,0,0,1|2,0,1]=4 28 B6R0.2 C(C(=O)N)C(=O)O MLM [1,0,1,0,0,0|2,0,0]=4 29 B6R0.2 CC(=O)CC(=O)C P2D [1,0,1,0,0,0|2,0,0]=4 30 B6R0.2 CC(=O)CC(=O)O AAE [1,0,1,0,0,0|2,0,0]=4 31 B6R0.2 CC(=O)CC(=O)O LIN [1,0,1,0,0,0|2,0,0]=4 32 B6R0.4 C(CC(=O)O)C=O SSN [1,0,1,0,0,0|2,0,0]=4 33 B6R0.3 C([C@@H](C(=O)N)N)O SET [1,0,1,0,0,0|1,0,1]=4 34 B6R0.3 C([C@@H](C(=O)N)N)S CY3 [1,0,1,0,0,0|1,1,0]=4 35 B6R0.3 C[C@@H](C(=O)NC)N 0NC [1,0,1,0,0,0|1,0,1]=4 36 B6R0.3 C[C@@H](C(=O)NO)N HMA [1,0,1,0,0,0|1,0,1]=4 37 B6R1.2 C1=CNC(=S)N1 MZY [2,0,0,0,0,0|0,1,1]=4 38 B6R1.2 C1CC(=O)NC1 BAQ [2,0,0,0,0,0|1,0,1]=4 39 B8R0.19 N=C(/NC)\NC(=O)NC XRG [0,1,1,0,0,0|2,0,0]=4 40 B8R0.23 C(C(=O)N)N(C(=O)O)N ZSN [0,1,1,0,0,0|0,0,0]=2 41 B8R0.23 C(C(=O)O)N(C(=O)O)O HAD [0,1,1,0,0,0|2,0,0]=4 42 B8R0.23 C([C@@H](C(=O)N)N)C(=O)O XSN [0,1,1,0,0,0|2,0,0]=4 43 B8R0.23 C([C@@H](C(=O)O)N)C(=O)N ASN [0,1,1,0,0,0|1,0,0]=3 44 B8R0.23 C([C@@H](C(=O)O)N)C(=O)N ASN_LFOH [0,1,1,0,0,0|1,0,0]=3 45 B8R0.23 C([C@@H](C(=O)O)N)C(=O)O ASP [0,1,1,0,0,0|2,0,0]=4 46 B8R0.23 C([C@@H](C(=O)O)N)C(=O)O ASP_LFOH [0,1,1,0,0,0|2,0,0]=4 47 B8R0.23 C([C@@H](C(=O)O)N)C(=O)O IAS [0,1,1,0,0,0|2,0,0]=4 48 B8R0.23 C([C@@H](C(=O)O)N)C(=O)[O-] ASP_LFOH_DHD2 [0,1,1,0,0,0|2,0,0]=4 49 B8R0.23 C([C@@H](C(=O)O)[NH-])C(=O)N ASN_LEO2H [0,1,1,0,0,0|1,0,1]=4 50 B8R0.23 C([C@@H](C(=O)[O-])N)C(=O)O ASI [0,1,1,0,0,0|2,0,0]=4 51 B8R0.23 C([C@@H](C(=O)[O-])[NH-])C(=O)N ASN_LEO2 [0,1,1,0,0,0|1,0,1]=4 52 B8R0.23 C([C@@H](C(=O)[O-])[NH3+])C(=O)N ASN_LFZW [0,1,1,0,0,0|1,0,1]=4 53 B8R0.23 C([C@H](C(=O)O)N)C(=O)N DSG [0,1,1,0,0,0|1,0,0]=3 54 B8R0.23 C([C@H](C(=O)O)N)C(=O)O DAS [0,1,1,0,0,0|2,0,0]=4 55 B8R0.23 C([C@H](C(=O)O)N)C(=O)O DSP [0,1,1,0,0,0|2,0,0]=4 56 B8R0.23 CC(=O)[C@H](CC(=O)O)N ASK [0,1,1,0,0,0|2,0,0]=4 57 B8R0.23 CN(CC(=O)O)C(=O)N CMS [0,1,1,0,0,0|2,0,0]=4 58 B8R0.23 [C@H](C(=O)O)(N)NC(=O)N UGY [0,1,1,0,0,0|2,0,0]=4 59 B8R0.8 C([C@@H](C(=O)O)N)NC=O 0RJ [0,1,1,0,0,0|2,0,0]=4 60 B8R1.1 C1CC(=O)N[C@@H]1C=O CGN [1,1,0,0,0,0|1,0,1]=4 61 B8R1.50 CN1C(=O)CCC1=O LCY [1,1,0,0,0,0|1,0,0]=3 62 B10R1.8 CNC1=CC(=O)NC(=O)N1 S76 [0,1,0,0,0,1|1,0,1]=4 63 B10R1.22 C1(=C(NC(=O)NC1=O)N)Br JFD [0,1,0,0,0,1|1,0,1]=4 64 B10R1.22 C1(=C(NC(=O)NC1=O)N)N URN [0,1,0,0,0,1|1,0,1]=4 65 B10R1.339 CC1(C(=O)NC(=O)N1C)C 6HQ [0,2,0,0,0,0|1,0,0]=3 66 B8R1.4 C1=CNC(=O)NC1=O URA [0,0,1,1,0,0|1,0,1]=4 67 B8R1.4 C1CNC(=O)NC1=O DUC [0,0,1,1,0,0|1,0,0]=3 68 B8R0.9 C(CC(=O)O)C(C=O)N GLQ [0,0,1,0,0,1|2,0,0]=4 69 B8R0.9 N=C/[C@H](CCC(=O)N)N 0JU [0,0,1,0,0,1|2,0,0]=4