0 B7R0.6 C(=C\C(=O)O)/C(=O)O FUM [0,0,0,0,0,0|1,0,2]=3 1 B7R0.6 C(=C\C(=O)O)\C(=O)O MAE [0,0,0,0,0,0|1,0,2]=3 2 B7R0.6 C(=C\C(=O)[O-])/C(=O)[O-] FMR [0,0,0,0,0,0|1,0,3]=4 3 B7R0.6 C(CC(=O)O)C(=O)O SIN [0,0,0,0,0,0|1,0,0]=1 4 B7R0.6 C(C[N+](=O)[O-])C(=O)O 3NP [0,0,0,0,0,0|2,0,0]=2 5 B7R0.6 CC(=O)CCC(=O)O SHF [0,0,0,0,0,0|0,0,0]=0 6 B7R0.6 CC(=O)NCC(=O)O AAC [0,0,0,0,0,0|1,0,0]=1 7 B7R0.6 CC(C)CCC(=O)O 4MV [0,0,0,0,0,0|1,0,1]=2 8 B7R0.6 CC(C)COC(=O)O IBU [0,0,0,0,0,0|2,0,1]=3 9 B7R0.6 CC(C)NCC(=O)O IPG [0,0,0,0,0,0|2,0,1]=3 10 B7R0.6 CS(C)CCC(=O)O DQY [0,0,0,0,0,0|2,0,0]=2 11 B7R0.6 C[C@@H](CCC(=O)O)N 0W6 [0,0,0,0,0,0|1,0,1]=2 12 B7R0.6 C[C@H](CC[C@@H](C)O)O HX2 [0,0,0,0,0,0|1,0,3]=4 13 B7R0.6 N=C(\N)/NCC(=O)O NMG [0,0,0,0,0,0|3,0,0]=3 14 B6R0.4 B(CCCC)(O)O BUB [1,0,0,0,0,0|1,0,2]=4 15 B6R0.4 C#CCCC(=O)O 54L [1,0,0,0,0,0|0,0,2]=3 16 B6R0.4 C(CC(=O)O)C=O SSN [1,0,0,0,0,0|0,0,0]=1 17 B6R0.4 C(CC(=O)O)CBr 0A5 [1,0,0,0,0,0|1,0,1]=3 18 B6R0.4 C(CC(=O)O)CN ABU [1,0,0,0,0,0|1,0,1]=3 19 B6R0.4 C(CSS)C(=O)O 3SS [1,0,0,0,0,0|1,1,0]=3 20 B6R0.4 CC(C)CCC=O MOP [1,0,0,0,0,0|1,0,1]=3 21 B6R0.4 CCCCC(=O)O LEA [1,0,0,0,0,0|0,0,1]=2 22 B6R0.4 CCCCC(=O)O PEI [1,0,0,0,0,0|0,0,1]=2 23 B6R0.4 CCCOC(=O)C 4PA [1,0,0,0,0,0|2,0,1]=4 24 B6R0.4 CCNCC(=O)O 2JC [1,0,0,0,0,0|1,0,1]=3 25 B8R0.9 C(CC(=O)N)[C@@H](CO)N ECC [0,1,0,0,0,0|2,0,1]=4 26 B8R0.9 C(CC(=O)N)[C@@H]([C-]=O)[NH-] GLN_LL [0,1,0,0,0,0|2,0,1]=4 27 B8R0.9 C(CC(=O)N)[C@@H]([C-]=O)[NH3+] GLN_LSN3 [0,1,0,0,0,0|2,0,1]=4 28 B8R0.9 C(CC(=O)O)C(=O)C=O HKV [0,1,0,0,0,0|0,0,1]=2 29 B8R0.9 C(CC(=O)O)C(=O)CCl TQ9 [0,1,0,0,0,0|0,0,0]=1 30 B8R0.9 C(CC(=O)O)C(=O)CF LAF [0,1,0,0,0,0|0,0,0]=1 31 B8R0.9 C(CC(=O)O)C(C=O)N GLQ [0,1,0,0,0,0|1,0,1]=3 32 B8R0.9 C(CC(=O)O)[C@@H](CN)N HOZ [0,1,0,0,0,0|1,0,1]=3 33 B8R0.9 C(CC(=O)O)[C@@H](CO)N GAU [0,1,0,0,0,0|1,0,1]=3 34 B8R0.9 C(CC(=O)O)[C@@H]([C-]=O)[NH-] GLU_LL [0,1,0,0,0,0|1,0,1]=3 35 B8R0.9 C(CC(=O)O)[C@@H]([C-]=O)[NH3+] GLU_LSN3 [0,1,0,0,0,0|1,0,1]=3 36 B8R0.9 C(CC(=O)[O-])[C@@H]([C-]=O)[NH-] GLU_LL_DHE2 [0,1,0,0,0,0|1,0,2]=4 37 B8R0.9 C(CC(=O)[O-])[C@@H]([C-]=O)[NH3+] GLU_LSN3_DHE2 [0,1,0,0,0,0|1,0,2]=4 38 B8R0.9 C/C=C(\CCC(=O)O)/N GEG [0,1,0,0,0,0|1,0,0]=2 39 B8R0.9 CC(=O)NC[C@@H](CO)N 1HD [0,1,0,0,0,0|2,0,1]=4 40 B8R0.9 CC(=O)OC[C@@H](CO)O JIM [0,1,0,0,0,0|1,0,2]=4 41 B8R0.9 CC[C@H](CCC(=O)O)N VIG [0,1,0,0,0,0|1,0,1]=3 42 B8R0.9 COC(=O)CCC(=O)O MSU [0,1,0,0,0,0|0,0,0]=1 43 B8R0.9 COC(CCC(=O)O)O HMB [0,1,0,0,0,0|0,0,2]=3 44 B8R0.23 *=C(*)C[C@@H](C(=O)O)N ASX [0,1,0,0,0,0|2,0,0]=3 45 B8R0.23 C(=C(/C(=O)O)\N)/C(=O)O 2KZ [0,1,0,0,0,0|1,0,2]=4 46 B8R0.23 C(=C(/O)\[O-])/[C@H](C(=O)[O-])O TEO [0,1,0,0,0,0|1,0,2]=4 47 B8R0.23 C(=C(\C(=O)O)/N)/C(=O)O DYA [0,1,0,0,0,0|1,0,2]=4 48 B8R0.23 C(C(=O)C(=O)O)C(=O)[O-] OAA [0,1,0,0,0,0|1,0,1]=3 49 B8R0.23 C(C(=O)N)N(C(=O)O)N ZSN [0,1,0,0,0,0|2,0,0]=3 50 B8R0.23 C(C(=O)O)N(C(=O)O)O HAD [0,1,0,0,0,0|2,0,0]=3 51 B8R0.23 C([C@@H](C(=O)N)N)C(=O)O XSN [0,1,0,0,0,0|1,0,0]=2 52 B8R0.23 C([C@@H](C(=O)O)N)C(=O)N ASN [0,1,0,0,0,0|1,0,0]=2 53 B8R0.23 C([C@@H](C(=O)O)N)C(=O)N ASN_LFOH [0,1,0,0,0,0|1,0,0]=2 54 B8R0.23 C([C@@H](C(=O)O)N)C(=O)O ASP [0,1,0,0,0,0|1,0,0]=2 55 B8R0.23 C([C@@H](C(=O)O)N)C(=O)O ASP_LFOH [0,1,0,0,0,0|1,0,0]=2 56 B8R0.23 C([C@@H](C(=O)O)N)C(=O)O IAS [0,1,0,0,0,0|1,0,0]=2 57 B8R0.23 C([C@@H](C(=O)O)N)C(=O)[O-] ASP_LFOH_DHD2 [0,1,0,0,0,0|1,0,0]=2 58 B8R0.23 C([C@@H](C(=O)O)N)C(F)F OBF [0,1,0,0,0,0|2,0,1]=4 59 B8R0.23 C([C@@H](C(=O)O)N)C(O)O UN2 [0,1,0,0,0,0|1,0,2]=4 60 B8R0.23 C([C@@H](C(=O)O)N)S(=O)O CSW [0,1,0,0,0,0|2,0,0]=3 61 B8R0.23 C([C@@H](C(=O)O)N)[S@@](=O)O CSD [0,1,0,0,0,0|2,0,0]=3 62 B8R0.23 C([C@@H](C(=O)O)N)[SeH](=O)=O SOC [0,1,0,0,0,0|2,0,0]=3 63 B8R0.23 C([C@@H](C(=O)O)N)[Se](=O)O SE7 [0,1,0,0,0,0|2,0,0]=3 64 B8R0.23 C([C@@H](C(=O)O)O)C(=O)O LMR [0,1,0,0,0,0|1,0,0]=2 65 B8R0.23 C([C@@H](C(=O)O)[NH-])C(=O)N ASN_LEO2H [0,1,0,0,0,0|1,0,0]=2 66 B8R0.23 C([C@@H](C(=O)O)[NH-])C(=O)O ASP_LEO2H [0,1,0,0,0,0|1,0,0]=2 67 B8R0.23 C([C@@H](C(=O)O)[NH-])C(=O)[O-] ASP_LEO2H_DHD2 [0,1,0,0,0,0|1,0,0]=2 68 B8R0.23 C([C@@H](C(=O)[O-])N)C(=O)O ASI [0,1,0,0,0,0|1,0,0]=2 69 B8R0.23 C([C@@H](C(=O)[O-])[NH-])C(=O)N ASN_LEO2 [0,1,0,0,0,0|1,0,1]=3 70 B8R0.23 C([C@@H](C(=O)[O-])[NH-])C(=O)O ASP_LEO2 [0,1,0,0,0,0|1,0,0]=2 71 B8R0.23 C([C@@H](C(=O)[O-])[NH-])C(=O)[O-] ASP_LEO2_DHD2 [0,1,0,0,0,0|1,0,1]=3 72 B8R0.23 C([C@@H](C(=O)[O-])[NH3+])C(=O)N ASN_LFZW [0,1,0,0,0,0|1,0,1]=3 73 B8R0.23 C([C@@H](C(=O)[O-])[NH3+])C(=O)O ASP_LFZW [0,1,0,0,0,0|1,0,0]=2 74 B8R0.23 C([C@@H](C(=O)[O-])[NH3+])C(=O)[O-] ASP_LFZW_DHD2 [0,1,0,0,0,0|1,0,1]=3 75 B8R0.23 C([C@@H](C(O)O)N)C(=O)O AKZ [0,1,0,0,0,0|1,0,2]=4 76 B8R0.23 C([C@H](C(=O)O)N)C(=O)N DSG [0,1,0,0,0,0|1,0,0]=2 77 B8R0.23 C([C@H](C(=O)O)N)C(=O)O DAS [0,1,0,0,0,0|1,0,0]=2 78 B8R0.23 C([C@H](C(=O)O)N)C(=O)O DSP [0,1,0,0,0,0|1,0,0]=2 79 B8R0.23 C([C@H](C(=O)O)O)C(=O)O DMR [0,1,0,0,0,0|1,0,0]=2 80 B8R0.23 C([C@H](C(=O)O)O)C(=O)O MLT [0,1,0,0,0,0|1,0,0]=2 81 B8R0.23 C=C(CC(=O)O)C(=O)O ITN [0,1,0,0,0,0|1,0,1]=3 82 B8R0.23 C=C(C[C@@H](C(=O)O)N)Br A8E [0,1,0,0,0,0|1,0,1]=3 83 B8R0.23 CC(=O)[C@H](CC(=O)O)N ASK [0,1,0,0,0,0|0,0,0]=1 84 B8R0.23 CC(C)CC(=O)C(=O)O COI [0,1,0,0,0,0|1,0,2]=4 85 B8R0.23 CC(C)CC(C(=O)O)Cl HRI [0,1,0,0,0,0|1,0,1]=3 86 B8R0.23 CC(C)C[C@@H](C(=O)C)N LEM [0,1,0,0,0,0|2,0,1]=4 87 B8R0.23 CC(C)C[C@@H](C(=O)N)N CLE [0,1,0,0,0,0|2,0,1]=4 88 B8R0.23 CC(C)C[C@@H](C(=O)N)N NLW [0,1,0,0,0,0|2,0,1]=4 89 B8R0.23 CC(C)C[C@@H](C(=O)O)Cl 03H [0,1,0,0,0,0|1,0,1]=3 90 B8R0.23 CC(C)C[C@@H](C(=O)O)N LEU [0,1,0,0,0,0|1,0,1]=3 91 B8R0.23 CC(C)C[C@@H](C(=O)O)N LEU_LFOH [0,1,0,0,0,0|1,0,1]=3 92 B8R0.23 CC(C)C[C@@H](C(=O)O)O 1LU [0,1,0,0,0,0|1,0,1]=3 93 B8R0.23 CC(C)C[C@@H](C(=O)O)O OLE [0,1,0,0,0,0|1,0,1]=3 94 B8R0.23 CC(C)C[C@@H](C(=O)O)[NH-] LEU_LEO2H [0,1,0,0,0,0|1,0,1]=3 95 B8R0.23 CC(C)C[C@@H](C(=O)[O-])[NH-] LEU_LEO2 [0,1,0,0,0,0|1,0,2]=4 96 B8R0.23 CC(C)C[C@@H](C(=O)[O-])[NH3+] LEU_LFZW [0,1,0,0,0,0|1,0,2]=4 97 B8R0.23 CC(C)C[C@H](C(=O)O)N DLE [0,1,0,0,0,0|1,0,1]=3 98 B8R0.23 CC(C)C[C@H](C(=O)O)O 2RH [0,1,0,0,0,0|1,0,1]=3 99 B8R0.23 CC(C)[C@@H](CC(=O)O)N 1VR [0,1,0,0,0,0|1,0,1]=3 100 B8R0.23 CC(CC(=O)O)C(=O)O JO3 [0,1,0,0,0,0|1,0,0]=2 101 B8R0.23 CN(CC(=O)O)C(=N)N CRN [0,1,0,0,0,0|3,0,0]=4 102 B8R0.23 CN(CC(=O)O)C(=O)N CMS [0,1,0,0,0,0|2,0,0]=3 103 B8R0.23 C[C@@H](C(=O)O)NC(=O)C AYA [0,1,0,0,0,0|1,0,0]=2 104 B8R0.23 C[C@@H](C(=O)O)NC(=O)O NXA [0,1,0,0,0,0|2,0,0]=3 105 B8R0.23 C[C@@H](CC(=O)O)C(=O)O SUH [0,1,0,0,0,0|1,0,0]=2 106 B8R0.23 C[C@@H](CC(C)C)C(=O)O 7GA [0,1,0,0,0,0|1,0,1]=3 107 B8R0.23 C[C@H](C(=O)O)NC(=O)N NCB [0,1,0,0,0,0|2,0,0]=3 108 B8R0.23 C[C@H]([C@@H](CC(=O)O)N)O B3T [0,1,0,0,0,0|0,0,2]=3 109 B8R0.23 C\C(=C/C(=O)O)\C(=O)O MEZ [0,1,0,0,0,0|1,0,2]=4 110 B8R0.23 C\C(=C\C(=O)O)\C(=O)O CIZ [0,1,0,0,0,0|1,0,2]=4 111 B8R0.23 N=C(\C[C@@H](C(=O)O)N)/O 41Q [0,1,0,0,0,0|1,0,1]=3 112 B8R0.23 [C@H](C(=O)O)(N)NC(=O)N UGY [0,1,0,0,0,0|2,0,0]=3 113 B8R0.23 [C@H](C(=O)O)(NC(=O)N)O UGC [0,1,0,0,0,0|2,0,0]=3 114 B8R0.29 C(C(=O)O)OP(=O)(O)O 2PL [0,1,0,0,0,0|3,0,0]=4 115 B8R0.29 C(C(=O)O)OP(=O)(O)O PGA [0,1,0,0,0,0|3,0,0]=4 116 B8R0.29 C(CP(=O)(O)O)C(=O)O 3PP [0,1,0,0,0,0|2,0,0]=3 117 B8R0.29 C(CS(=O)(=O)O)C(=O)O X1S [0,1,0,0,0,0|2,0,0]=3 118 B8R0.29 CC(C)CCP(=O)(O)O IPI [0,1,0,0,0,0|2,0,1]=4 119 B8R0.29 CN(C)CCS(=O)(=O)O ASZ [0,1,0,0,0,0|3,0,0]=4 120 B6R0.2 C(C(=O)N)C(=O)O MLM [0,0,0,0,1,0|1,0,0]=2 121 B6R0.2 C(C(=O)O)C(=O)Cl PR6 [0,0,0,0,1,0|1,0,0]=2 122 B6R0.2 C(C(=O)O)C(=O)O MLA [0,0,0,0,1,0|1,0,0]=2 123 B6R0.2 C(C(=O)[O-])C(=O)[O-] MLI [0,0,0,0,1,0|1,0,1]=3 124 B6R0.2 CC(=O)CC(=O)C P2D [0,0,0,0,1,0|1,0,0]=2 125 B6R0.2 CC(=O)CC(=O)O AAE [0,0,0,0,1,0|0,0,0]=1 126 B6R0.2 CC(=O)CC(=O)O LIN [0,0,0,0,1,0|0,0,0]=1 127 B6R0.2 CC(C)CC(=O)O IVA [0,0,0,0,1,0|1,0,1]=3 128 B6R0.2 CN(C)CC(=O)O DMG [0,0,0,0,1,0|2,0,0]=3 129 B6R0.2 CS(C)CC(=O)O 313 [0,0,0,0,1,0|2,0,0]=3 130 B6R0.2 C[C@@H](CC(=O)O)N B3A [0,0,0,0,1,0|1,0,1]=3 131 B6R0.2 C[C@@H](CC(=O)O)O 3HL [0,0,0,0,1,0|0,0,2]=3 132 B6R0.2 C[C@H](CC(=O)O)O 3HR [0,0,0,0,1,0|0,0,2]=3 133 B8R0.28 C(C(=O)O)OCC(=O)O OEG [0,0,0,0,0,1|1,0,0]=2 134 B8R0.28 C(C(=O)O)SCC(=O)O 9X6 [0,0,0,0,0,1|1,0,0]=2 135 B8R0.28 C(CC(=O)O)CC(=O)O GUA [0,0,0,0,0,1|1,0,0]=2 136 B8R0.28 C(CC(=O)O)C[N+](=O)[O-] 4NI [0,0,0,0,0,1|2,0,0]=3 137 B8R0.28 C(CNC(=O)N)C(=O)O URP [0,0,0,0,0,1|1,0,0]=2 138 B8R0.28 C(\C=C\C(=O)O)C(=O)O G9A [0,0,0,0,0,1|1,0,1]=3 139 B8R0.28 CC(=CCCC(=O)C)C 0VT [0,0,0,0,0,1|2,0,0]=3 140 B8R0.28 CC(=O)CCCC(=O)O 4AT [0,0,0,0,0,1|0,0,0]=1 141 B8R0.28 CC(C)CNCC(=O)O I4G [0,0,0,0,0,1|1,0,1]=3 142 B5R0.1 C(C(=O)O)ON AOA [2,0,0,0,0,0|2,0,0]=4 143 B5R0.1 C(CN)C(=O)O BAL [2,0,0,0,0,0|1,0,0]=3 144 B5R0.1 C(CO)C(=O)O 3OH [2,0,0,0,0,0|0,0,1]=3 145 B5R0.1 C(CS)C(=O)O MPT [2,0,0,0,0,0|0,1,0]=3 146 B5R0.1 C(C[SeH])C(=O)O SLP [2,0,0,0,0,0|0,1,0]=3 147 B5R0.1 C=C(CCO)Br 3BB [2,0,0,0,0,0|1,0,1]=4 148 B5R0.1 CC(=O)CCO BUQ [2,0,0,0,0,0|0,0,0]=2 149 B5R0.1 CC(C)CCO IP3 [2,0,0,0,0,0|1,0,1]=4 150 B5R0.1 CC=CC(=O)O BEO [2,0,0,0,0,0|0,0,1]=3 151 B5R0.1 CCCC(=O)C PNH [2,0,0,0,0,0|0,0,1]=3 152 B5R0.1 CCCC(=O)N BMD [2,0,0,0,0,0|1,0,0]=3 153 B5R0.1 CCCC(=O)O BUA [2,0,0,0,0,0|0,0,0]=2 154 B5R0.1 CCC[N+](=O)[O-] N1P [2,0,0,0,0,0|1,0,1]=4 155 B5R0.1 CCOC(=O)C EEE [2,0,0,0,0,0|1,0,1]=4 156 B5R0.1 CCOC(=O)O 01F [2,0,0,0,0,0|1,0,0]=3 157 B5R0.1 CCO[P@H](=O)O ATJ [2,0,0,0,0,0|2,0,0]=4 158 B5R0.1 CNCC(=O)O MGY [2,0,0,0,0,0|1,0,0]=3 159 B5R0.1 CNCC(=O)O SAR [2,0,0,0,0,0|1,0,0]=3 160 B5R0.1 CSCC(=O)[O-] MTG [2,0,0,0,0,0|1,0,1]=4 161 B5R0.1 C[C@@H](CCO)O BU2 [2,0,0,0,0,0|0,0,2]=4 162 B5R0.1 C[C@H](CC=O)O 5KO [2,0,0,0,0,0|0,0,2]=4 163 B5R0.1 C[C@H](CCO)O BU4 [2,0,0,0,0,0|0,0,2]=4 164 B5R0.1 C[Se]CC(=O)[O-] MSF [2,0,0,0,0,0|1,0,1]=4 165 B5R0.1 C[Te]CC(=O)[O-] MTD [2,0,0,0,0,0|1,0,1]=4 166 B5R0.2 C(=CC=O)C=O 2FU [2,0,0,0,0,0|0,0,2]=4 167 B5R0.2 CCCCC=O PTL [2,0,0,0,0,0|0,0,1]=3 168 B5R0.2 CCCCCO PE9 [2,0,0,0,0,0|0,0,2]=4 169 B7R0.2 C(C(=O)O)N(C=O)O HDA [1,1,0,0,0,0|1,0,0]=3 170 B7R0.2 C([C@@H](C=O)N)C(=O)O ASA [1,1,0,0,0,0|0,0,0]=2 171 B7R0.2 C([C@@H](CO)N)C(=O)O ASJ [1,1,0,0,0,0|0,0,2]=4 172 B7R0.2 C([C@@H]([C-]=O)[NH-])C(=O)N ASN_LL [1,1,0,0,0,0|1,0,1]=4 173 B7R0.2 C([C@@H]([C-]=O)[NH-])C(=O)O ASP_LL [1,1,0,0,0,0|0,0,1]=3 174 B7R0.2 C([C@@H]([C-]=O)[NH-])C(=O)[O-] ASP_LL_DHD2 [1,1,0,0,0,0|0,0,2]=4 175 B7R0.2 C([C@@H]([C-]=O)[NH3+])C(=O)N ASN_LSN3 [1,1,0,0,0,0|1,0,1]=4 176 B7R0.2 C([C@@H]([C-]=O)[NH3+])C(=O)O ASP_LSN3 [1,1,0,0,0,0|0,0,1]=3 177 B7R0.2 C([C@@H]([C-]=O)[NH3+])C(=O)[O-] ASP_LSN3_DHD2 [1,1,0,0,0,0|0,0,2]=4 178 B7R0.2 C([C@H](CO)N)C(=O)O B3S [1,1,0,0,0,0|0,0,2]=4 179 B7R0.2 C([C@H](CS)N)C(=O)O BCX [1,1,0,0,0,0|0,1,1]=4 180 B7R0.2 CC(C)C[C@@H](C=O)N LCZ [1,1,0,0,0,0|1,0,1]=4 181 B7R0.3 COC(=O)CCCN GVE [1,1,0,0,0,0|1,0,1]=4 182 B7R0.4 C(CCO)CC(=O)O SHO [1,1,0,0,0,0|0,0,1]=3 183 B7R0.4 C(CC[NH3+])CC(=O)O DAV [1,1,0,0,0,0|0,0,1]=3 184 B7R0.4 C(COCC(=O)O)O VKC [1,1,0,0,0,0|0,0,2]=4 185 B7R0.4 C(CSCC(=O)O)N ESD [1,1,0,0,0,0|1,0,1]=4 186 B7R0.4 C(\C=C\CN)C(=O)O FBE [1,1,0,0,0,0|0,0,1]=3 187 B7R0.4 CCCCCC(=O)C HTX [1,1,0,0,0,0|1,0,1]=4 188 B7R0.4 CCCCCC(=O)O 6NA [1,1,0,0,0,0|0,0,1]=3 189 B7R0.4 CCCCOC(=O)C 8JZ [1,1,0,0,0,0|1,0,1]=4 190 B7R0.5 C#CC[C@@H](C(=O)O)N LPH [1,1,0,0,0,0|0,0,2]=4 191 B7R0.5 C(C=O)[C@H](C(=O)O)N AS2 [1,1,0,0,0,0|0,0,0]=2 192 B7R0.5 C(CN)[C@@H](C(=O)O)N DAB [1,1,0,0,0,0|1,0,1]=4 193 B7R0.5 C(CN)[C@H](C(=O)O)N 4FO [1,1,0,0,0,0|1,0,1]=4 194 B7R0.5 C(CN)[C@H](C(=O)O)O 42B [1,1,0,0,0,0|1,0,1]=4 195 B7R0.5 C(CO)[C@@H](C(=O)O)N HSE [1,1,0,0,0,0|0,0,2]=4 196 B7R0.5 C(CS)[C@@H](C(=O)O)N HCS [1,1,0,0,0,0|0,1,1]=4 197 B7R0.5 C(CS)[C@H](C(=O)O)N KCY [1,1,0,0,0,0|0,1,1]=4 198 B7R0.5 C([C@@H](C(=O)O)N)SO CEA [1,1,0,0,0,0|1,0,1]=4 199 B7R0.5 C([C@@H](C(=O)O)N)SO CSO [1,1,0,0,0,0|1,0,1]=4 200 B7R0.5 C([C@@H](C(=O)O)N)SS CSS [1,1,0,0,0,0|1,1,0]=4 201 B7R0.5 C([C@@H](C(=O)O)N)S[Pb+] CSB [1,1,0,0,0,0|2,0,0]=4 202 B7R0.5 C([C@@H](C(=O)O)N)S[SeH] CSZ [1,1,0,0,0,0|1,1,0]=4 203 B7R0.5 C([C@@H](C(=O)O)N)[SH]=O CSX [1,1,0,0,0,0|1,0,0]=3 204 B7R0.5 C([C@@H](C(=O)O)N)[SeH]=O UOX [1,1,0,0,0,0|1,0,0]=3 205 B7R0.5 C([C@@H](C(=O)O)N)[Se]S PSW [1,1,0,0,0,0|1,1,0]=4 206 B7R0.5 C/C=C\C(=O)C(=O)O OXP [1,1,0,0,0,0|0,0,2]=4 207 B7R0.5 C=CC[C@@H](C(=O)O)N 2AG [1,1,0,0,0,0|0,0,1]=3 208 B7R0.5 C=CC[C@H](C(=O)O)N DYL [1,1,0,0,0,0|0,0,1]=3 209 B7R0.5 CCCC(=O)C(=O)O 69O [1,1,0,0,0,0|0,0,2]=4 210 B7R0.5 CCC[C@@H](C(=O)O)N 2PI [1,1,0,0,0,0|0,0,1]=3 211 B7R0.5 CCC[C@@H](C(=O)O)N BTA [1,1,0,0,0,0|0,0,1]=3 212 B7R0.5 CCC[C@@H](C(=O)O)N NVA [1,1,0,0,0,0|0,0,1]=3 213 B7R0.5 CCC[C@@H](C(=O)O)N RON [1,1,0,0,0,0|0,0,1]=3 214 B7R0.5 CCS[C@@H](C(=O)O)N GSC [1,1,0,0,0,0|1,0,1]=4 215 B7R0.5 COC[C@@H](C(=O)O)N 7C9 [1,1,0,0,0,0|1,0,0]=3 216 B7R0.5 CSC[C@@H](C(=O)O)N CYM [1,1,0,0,0,0|1,0,0]=3 217 B7R0.5 CSC[C@@H](C(=O)O)N SMC [1,1,0,0,0,0|1,0,0]=3 218 B7R0.5 CSC[C@H](C(=O)O)N 060 [1,1,0,0,0,0|1,0,0]=3 219 B7R0.8 CCCCP(=O)(O)O CCP [1,1,0,0,0,0|1,0,1]=4 220 B7R0.9 C(C(=O)N)P(=O)(O)O PCT [0,1,0,0,1,0|2,0,0]=4 221 B7R0.9 C(C(=O)O)P(=O)(O)O PAE [0,1,0,0,1,0|2,0,0]=4 222 B7R0.9 C(C(=O)O)S(=O)(=O)O SAT [0,1,0,0,1,0|2,0,0]=4 223 B7R0.9 CC(=O)CP(=O)(O)O 7VD [0,1,0,0,1,0|1,0,0]=3 224 B7R0.9 CC(=O)OP(=O)(O)O UVW [0,1,0,0,1,0|2,0,0]=4 225 B7R0.9 CC(=O)OS(=O)(=O)O AS8 [0,1,0,0,1,0|2,0,0]=4 226 B7R0.9 CC(C)(C)CC(=O)O DTG [0,1,0,0,1,0|1,0,1]=4 227 B7R0.9 C[N+](C)(C)CC(=O)O BET [0,1,0,0,1,0|2,0,0]=4 228 B7R0.16 C(=O)(C(=O)O)C(=O)O MAK [0,1,0,0,1,0|1,0,1]=4 229 B7R0.16 C(C(=O)O)(C(=O)O)N FGL [0,1,0,0,1,0|1,0,0]=3 230 B7R0.16 C(C(=O)[O-])(C(=O)[O-])O TTN [0,1,0,0,1,0|1,0,1]=4 231 B7R0.16 CC(=O)[C@@H](C(=O)O)N AKB [0,1,0,0,1,0|0,0,0]=2 232 B7R0.16 CC(C(=O)O)C(=O)O DXX [0,1,0,0,1,0|1,0,0]=3 233 B7R0.16 CC(C)[C@@H](C(=O)O)N VAL [0,1,0,0,1,0|1,0,1]=4 234 B7R0.16 CC(C)[C@@H](C(=O)O)N VAL_LFOH [0,1,0,0,1,0|1,0,1]=4 235 B7R0.16 CC(C)[C@@H](C(=O)O)O LHV [0,1,0,0,1,0|1,0,1]=4 236 B7R0.16 CC(C)[C@@H](C(=O)O)[NH-] VAL_LEO2H [0,1,0,0,1,0|1,0,1]=4 237 B7R0.16 CC(C)[C@H](C(=O)O)N DVA [0,1,0,0,1,0|1,0,1]=4 238 B7R0.16 CC(C)[C@H](C(=O)O)O VAD [0,1,0,0,1,0|1,0,1]=4 239 B7R0.16 C[C@@H](C(=O)O)N(C)C LAL [0,1,0,0,1,0|2,0,0]=4 240 B7R0.16 C[C@@H]([C@@H](C(=O)O)N)O ALO [0,1,0,0,1,0|0,0,2]=4 241 B7R0.16 C[C@@H]([C@H](C(=O)O)N)O DTH [0,1,0,0,1,0|0,0,2]=4 242 B7R0.16 C[C@H]([C@@H](C(=O)O)N)N VLL [0,1,0,0,1,0|1,0,1]=4 243 B7R0.16 C[C@H]([C@@H](C(=O)O)N)O THR [0,1,0,0,1,0|0,0,2]=4 244 B7R0.16 C[C@H]([C@@H](C(=O)O)N)O THR_LFOH [0,1,0,0,1,0|0,0,2]=4 245 B7R0.16 C[C@H]([C@@H](C(=O)O)N)S CG6 [0,1,0,0,1,0|0,1,1]=4 246 B7R0.16 C[C@H]([C@@H](C(=O)O)N)[O-] THR_LFOH_DHG1 [0,1,0,0,1,0|0,0,2]=4 247 B7R0.16 C[C@H]([C@@H](C(=O)O)[NH-])O THR_LEO2H [0,1,0,0,1,0|0,0,2]=4 248 B7R0.16 C[C@H]([C@@H](C(=O)O)[NH-])[O-] THR_LEO2H_DHG1 [0,1,0,0,1,0|0,0,2]=4 249 B7R0.16 C[C@H]([C@H](C(=O)O)N)N VDL [0,1,0,0,1,0|1,0,1]=4 250 B7R0.16 C[C@H]([C@H](C(=O)O)N)O 2TL [0,1,0,0,1,0|0,0,2]=4 251 B7R0.16 C\C(=C(/C(=O)O)\N)\O MOZ [0,1,0,0,1,0|0,0,2]=4 252 B7R0.16 C\C(=C(/C(=O)O)\N)\S BB6 [0,1,0,0,1,0|0,1,1]=4 253 B9R0.7 *=C(*)CC[C@@H](C(=O)O)N GLX [0,1,0,0,0,1|2,0,0]=4 254 B9R0.7 C(C(=O)O)NC(=O)C(=O)O OGA [0,1,0,0,0,1|1,0,1]=4 255 B9R0.7 C(CC(=O)N)[C@@H](C(=O)N)N 6E4 [0,1,0,0,0,1|2,0,0]=4 256 B9R0.7 C(CC(=O)N)[C@@H](C(=O)O)N GLN [0,1,0,0,0,1|1,0,0]=3 257 B9R0.7 C(CC(=O)N)[C@@H](C(=O)O)N GLN_LFOH [0,1,0,0,0,1|1,0,0]=3 258 B9R0.7 C(CC(=O)N)[C@@H](C(=O)O)[NH-] GLN_LEO2H [0,1,0,0,0,1|1,0,0]=3 259 B9R0.7 C(CC(=O)N)[C@@H](C(=O)[O-])[NH-] GLN_LEO2 [0,1,0,0,0,1|1,0,1]=4 260 B9R0.7 C(CC(=O)N)[C@@H](C(=O)[O-])[NH3+] GLN_LFZW [0,1,0,0,0,1|1,0,1]=4 261 B9R0.7 C(CC(=O)N)[C@H](C(=O)O)N DGN [0,1,0,0,0,1|1,0,0]=3 262 B9R0.7 C(CC(=O)O)C(=O)C(=O)O 2OG [0,1,0,0,0,1|1,0,0]=3 263 B9R0.7 C(CC(=O)O)C(=O)C(=O)O AKG [0,1,0,0,0,1|1,0,0]=3 264 B9R0.7 C(CC(=O)O)[C@@H](C(=O)N)N GMA [0,1,0,0,0,1|1,0,0]=3 265 B9R0.7 C(CC(=O)O)[C@@H](C(=O)O)N GGL [0,1,0,0,0,1|1,0,0]=3 266 B9R0.7 C(CC(=O)O)[C@@H](C(=O)O)N GLU [0,1,0,0,0,1|1,0,0]=3 267 B9R0.7 C(CC(=O)O)[C@@H](C(=O)O)N GLU_LFOH [0,1,0,0,0,1|1,0,0]=3 268 B9R0.7 C(CC(=O)O)[C@@H](C(=O)O)O S2G [0,1,0,0,0,1|1,0,0]=3 269 B9R0.7 C(CC(=O)O)[C@@H](C(=O)O)[NH-] GLU_LEO2H [0,1,0,0,0,1|1,0,0]=3 270 B9R0.7 C(CC(=O)O)[C@@H](C(=O)[O-])[NH-] GLU_LEO2 [0,1,0,0,0,1|1,0,0]=3 271 B9R0.7 C(CC(=O)O)[C@@H](C(=O)[O-])[NH3+] GLU_LFZW [0,1,0,0,0,1|1,0,0]=3 272 B9R0.7 C(CC(=O)O)[C@H](C(=O)N)N ZGL [0,1,0,0,0,1|1,0,0]=3 273 B9R0.7 C(CC(=O)O)[C@H](C(=O)O)N DGL [0,1,0,0,0,1|1,0,0]=3 274 B9R0.7 C(CC(=O)O)[C@H](C(=O)O)N FGA [0,1,0,0,0,1|1,0,0]=3 275 B9R0.7 C(CC(=O)O)[C@H](C(=O)O)O 2HG [0,1,0,0,0,1|1,0,0]=3 276 B9R0.7 C(CC(=O)[O-])[C@@H](C(=O)O)N GLU_LFOH_DHE2 [0,1,0,0,0,1|1,0,0]=3 277 B9R0.7 C(CC(=O)[O-])[C@@H](C(=O)O)[NH-] GLU_LEO2H_DHE2 [0,1,0,0,0,1|1,0,0]=3 278 B9R0.7 C(CC(=O)[O-])[C@@H](C(=O)[O-])[NH-] GLU_LEO2_DHE2 [0,1,0,0,0,1|1,0,1]=4 279 B9R0.7 C(CC(=O)[O-])[C@@H](C(=O)[O-])[NH3+] GLU_LFZW_DHE2 [0,1,0,0,0,1|1,0,1]=4 280 B9R0.7 C([C@@H](C(=O)O)N)SC(=O)N QCS [0,1,0,0,0,1|1,0,0]=3 281 B9R0.7 CC(=O)CC[C@@H](C(=O)O)N ONL [0,1,0,0,0,1|0,0,0]=2 282 B9R0.7 CC(=O)OC[C@@H](C(=O)O)N OAS [0,1,0,0,0,1|0,0,0]=2 283 B9R0.7 CC(=O)SC[C@@H](C(=O)O)N SCY [0,1,0,0,0,1|0,0,0]=2 284 B9R0.7 CC(=O)[C@H](CCC(=O)O)N MKE [0,1,0,0,0,1|0,0,0]=2 285 B9R0.7 CC(C)CC[C@@H](C(=O)O)N HLX [0,1,0,0,0,1|1,0,1]=4 286 B9R0.7 CC(C)[C@@H](CCC(=O)O)N 0JT [0,1,0,0,0,1|1,0,1]=4 287 B9R0.7 C[As](C)SC[C@@H](C(=O)O)N CAS [0,1,0,0,0,1|2,0,0]=4 288 B9R0.7 C[C@@H](CNC(=O)N)C(=O)O URQ [0,1,0,0,0,1|1,0,0]=3 289 B9R0.7 C[C@H]([C@@H](CCC(=O)O)O)N KAH [0,1,0,0,0,1|1,0,1]=4 290 B9R0.7 C[C@H]([C@H](CCC(=O)O)N)O EKE [0,1,0,0,0,1|0,0,2]=4 291 B9R0.7 C[S@@](=O)CC[C@@H](C(=O)O)N SME [0,1,0,0,0,1|1,0,0]=3 292 B9R0.7 C[S@](=O)CC[C@@H](C(=O)O)N MHO [0,1,0,0,0,1|1,0,0]=3 293 B9R0.7 C[Se@@](=O)CC[C@@H](C(=O)O)N MSO [0,1,0,0,0,1|1,0,0]=3 294 B9R0.7 N=C(\N)/NC[C@@H](C(=O)O)N GPA [0,1,0,0,0,1|2,0,0]=4 295 B9R0.53 C(C(CC(=O)O)N)C(=O)O B3D [0,1,0,0,0,1|1,0,0]=3 296 B9R0.53 C(C(CC(=O)O)O)C(=O)O 3HG [0,1,0,0,0,1|1,0,0]=3 297 B9R0.53 C([C@@H](CC(=O)O)N)C(=O)N B3X [0,1,0,0,0,1|1,0,0]=3 298 B9R0.53 CC(C)C[C@@H](CC(=O)O)N B3L [0,1,0,0,0,1|1,0,1]=4 299 B9R0.53 C[C@@H](CC(=O)CC(=O)O)N KMH [0,1,0,0,0,1|1,0,1]=4 300 B9R0.56 C(C(=O)O)NCP(=O)(O)O GPF [0,1,0,0,0,1|2,0,0]=4 301 B9R0.56 C(C(=O)O)[NH2+]CP(=O)(O)O GPJ [0,1,0,0,0,1|2,0,0]=4 302 B9R0.56 C(COP(=O)(O)O)C(=O)O 48X [0,1,0,0,0,1|2,0,0]=4 303 B9R0.56 CC(=C)CCOP(=O)(O)O IP8 [0,1,0,0,0,1|2,0,0]=4 304 B9R0.56 C[N+](C)(C)CCCC(=O)O NM2 [0,1,0,0,0,1|2,0,0]=4 305 B9R0.56 C[N+](C)(C)NCCC(=O)O REE [0,1,0,0,0,1|2,0,0]=4 306 B9R0.21 C(C(=O)CBr)OP(=O)(O)O BBR [0,2,0,0,0,0|2,0,0]=4 307 B9R0.21 C(C(=O)COP(=O)(O)O)O 13P [0,2,0,0,0,0|2,0,0]=4 308 B9R0.21 C=C(CCP(=O)(O)O)C=O CYX [0,2,0,0,0,0|1,0,1]=4 309 B9R0.21 CCC(=O)CCC(C)(C)O LTL [0,2,0,0,0,0|1,0,1]=4 310 B9R0.23 C([C@@H](C(=O)CCl)N)C(=O)O AKL [0,2,0,0,0,0|0,0,0]=2 311 B9R0.23 CC(C)C[C@@H](C(=O)CO)N LEX [0,2,0,0,0,0|1,0,1]=4 312 B9R0.23 CC(C)C[C@@H](C(=O)NO)N LNO [0,2,0,0,0,0|1,0,1]=4 313 B9R0.23 CC(C)C[C@@H](C(=O)OC)N MLL [0,2,0,0,0,0|1,0,1]=4 314 B9R0.23 CC[C@H](C)[C@@H](CC(=O)O)N BIL [0,2,0,0,0,0|1,0,1]=4 315 B9R0.42 C([C@@H](C(=O)O)N)C(=O)NO SD4 [0,2,0,0,0,0|1,0,0]=3 316 B9R0.42 C([C@@H](C(=O)O)N)N(N=O)O AL0 [0,2,0,0,0,0|2,0,0]=4 317 B9R0.42 C([C@@H](C(=O)O)N)[S@@](=O)OO 0CS [0,2,0,0,0,0|2,0,0]=4 318 B9R0.42 C([C@@H](CS)S)[C@@H](C(=O)O)N 81S [0,2,0,0,0,0|0,1,1]=4 319 B9R0.42 C([C@H](C(=O)O)N)C(=O)NO SD3 [0,2,0,0,0,0|1,0,0]=3 320 B9R0.42 C([C@H](CS)S)[C@@H](C(=O)O)N 81R [0,2,0,0,0,0|0,1,1]=4 321 B9R0.42 CNC(=O)C[C@@H](C(=O)O)N MEN [0,2,0,0,0,0|0,0,0]=2 322 B9R0.42 CNC(=O)C[C@H](C(=O)O)N MND [0,2,0,0,0,0|0,0,0]=2 323 B9R0.42 C[C@@H](C[C@@H](C(=O)O)N)CF LEF [0,2,0,0,0,0|1,0,1]=4 324 B9R0.42 C[C@H](C[C@@H](C(=O)O)N)C=O LED [0,2,0,0,0,0|0,0,1]=3 325 B9R0.11 CC(C)(CC(=O)O)C(=O)O WOC [0,2,0,0,0,0|1,0,0]=3 326 B9R0.11 CC(C)C[C@@](C)(C(=O)O)N 2ML [0,2,0,0,0,0|1,0,1]=4 327 B9R0.11 C[C@](CC(=O)O)(C(=O)O)N 0A0 [0,2,0,0,0,0|1,0,0]=3 328 B9R0.39 C([C@@H](C(=O)O)S[Au])C(=O)O MYQ [0,2,0,0,0,0|1,0,0]=3 329 B9R0.39 C([C@@H](CN)C(=O)O)C(=O)N B2N [0,2,0,0,0,0|1,0,0]=3 330 B9R0.39 CC(=O)N[C@@H](CO)C(=O)O SAC [0,2,0,0,0,0|1,0,0]=3 331 B9R0.39 CC(=O)N[C@@H](CS)C(=O)O 1ZT [0,2,0,0,0,0|1,0,0]=3 332 B9R0.39 CC(=O)N[C@@H](CS)C(=O)O SC2 [0,2,0,0,0,0|1,0,0]=3 333 B9R0.39 CC(C)C[C@@H](C(=O)O)NC MLE [0,2,0,0,0,0|1,0,1]=4 334 B9R0.39 CC(C)C[C@H](C(=O)O)NC MLU [0,2,0,0,0,0|1,0,1]=4 335 B9R0.39 CC(C)C[C@H](CN)C(=O)O 4L8 [0,2,0,0,0,0|1,0,1]=4 336 B9R0.39 CC(C)C[C@H](CS)C(=O)O SLE [0,2,0,0,0,0|1,0,1]=4 337 B9R0.39 CN[C@H](CC(=O)O)C(=O)O OEM [0,2,0,0,0,0|1,0,0]=3 338 B9R0.57 C([C@@H](C(=O)O)N)S(=O)(=O)O OCS [0,2,0,0,0,0|2,0,0]=4 339 B9R0.57 C([C@@H](C(=O)O)O)S(=O)(=O)O 3SL [0,2,0,0,0,0|2,0,0]=4 340 B9R0.57 C([C@H](C(=O)O)N)P(=O)(O)O APO [0,2,0,0,0,0|2,0,0]=4 341 B9R0.57 C([C@H](C(=O)O)N)S(=O)(=O)O 00C [0,2,0,0,0,0|2,0,0]=4 342 B9R0.57 CC(C)(C)C[C@@H](C(=O)O)N 0JY [0,2,0,0,0,0|1,0,1]=4 343 B9R0.57 CS(=O)(=O)C[C@@H](C(=O)O)N KNB [0,2,0,0,0,0|1,0,0]=3 344 B9R0.79 CC(C)[C@@H]([C@@H](C(=O)O)N)O HLU [0,2,0,0,0,0|1,0,1]=4 345 B9R0.79 CC(C)[C@H]([C@@H](C(=O)O)N)O HL2 [0,2,0,0,0,0|1,0,1]=4 346 B9R0.79 C[C@@H]([C@@H](C(=O)O)N)C(=O)O 3MD [0,2,0,0,0,0|1,0,0]=3 347 B9R0.79 C[C@@H]([C@H](C(=O)O)N)C(=O)O ACB [0,2,0,0,0,0|1,0,0]=3 348 B9R0.79 C[C@H]([C@@H](C(C)C)O)C(=O)O 28H [0,2,0,0,0,0|1,0,1]=4 349 B9R0.79 [C@@H]([C@@H](C(=O)O)O)(C(=O)O)N 999 [0,2,0,0,0,0|1,0,0]=3 350 B9R0.79 [C@@H]([C@H](C(=O)O)O)(C(=O)O)O TLA [0,2,0,0,0,0|1,0,0]=3 351 B9R0.79 [C@H]([C@@H](C(=O)N)O)(C(=O)O)N AHB [0,2,0,0,0,0|1,0,0]=3 352 B9R0.79 [C@H]([C@@H](C(=O)O)O)(C(=O)O)N BHD [0,2,0,0,0,0|1,0,0]=3 353 B9R0.79 [C@H]([C@@H](C(=O)O)O)(C(=O)O)N DOH [0,2,0,0,0,0|1,0,0]=3 354 B9R0.79 [C@H]([C@@H](C(=O)O)O)(C(=O)O)O TAR [0,2,0,0,0,0|1,0,0]=3 355 B9R0.79 [C@H]([C@H](C(=O)O)O)(C(=O)N)N LAA [0,2,0,0,0,0|1,0,0]=3 356 B9R0.79 [C@H]([C@H](C(=O)O)O)(C(=O)O)N BH2 [0,2,0,0,0,0|1,0,0]=3 357 B9R0.79 [C@H]([C@H](C(=O)O)O)(C(=O)O)O SRT [0,2,0,0,0,0|1,0,0]=3 358 B7R1.2 C1C(=O)NC(=O)N1 HYN [1,0,0,1,0,0|2,0,0]=4 359 B7R1.2 C1CC(=O)CC1=O CEJ [1,0,0,1,0,0|0,0,0]=2 360 B7R1.3 C1CCC(=O)CC1 CYH [1,0,0,1,0,0|1,0,1]=4 361 B7R1.12 C[C@H]1[C@H](N1)C(=O)O 3K4 [1,0,0,1,0,0|1,0,1]=4 362 B7R1.18 C1CN[C@@H]1C(=O)O 02A [1,0,0,1,0,0|1,0,1]=4 363 B9R1.35 C1CC(=O)N[C@@H]1C(=O)O 5HP [0,0,0,1,0,1|1,0,0]=3 364 B9R1.35 C1CC(=O)N[C@@H]1C(=O)O PCA [0,0,0,1,0,1|1,0,0]=3 365 B9R1.35 C1CC(=O)N[C@@H]1C(=O)O PCC [0,0,0,1,0,1|1,0,0]=3 366 B9R1.35 C1[C@@H](CN[C@@H]1C(=O)O)F 4FB [0,0,0,1,0,1|1,0,1]=4 367 B9R1.35 C1[C@@H](CN[C@@H]1C(=O)O)O HZP [0,0,0,1,0,1|0,0,2]=4 368 B9R1.35 C1[C@H](CN[C@@H]1C(=O)O)F FP9 [0,0,0,1,0,1|1,0,1]=4 369 B9R1.35 C1[C@H](CN[C@@H]1C(=O)O)O HYP [0,0,0,1,0,1|0,0,2]=4 370 B9R1.35 C1[C@H](CN[C@H]1C(=O)O)O 0AZ [0,0,0,1,0,1|0,0,2]=4 371 B9R1.35 C1[C@H](NCC1=O)C(=O)O DPL [0,0,0,1,0,1|0,0,0]=2 372 B9R1.35 C[C@@H]1C[C@H](NC1)C(=O)O MP8 [0,0,0,1,0,1|1,0,1]=4 373 B9R1.85 C1CC1CNCC(=O)O NMC [0,0,0,1,0,1|1,0,1]=4 374 B9R1.161 [C@@H]1(C(O1)C(=O)O)C(=O)O EPO [0,0,0,1,0,1|1,0,0]=3 375 B9R1.112 C1[C@@H](O1)C[C@@H](C(=O)O)N LIS [0,1,0,1,0,0|0,0,2]=4 376 B5R0.5 C(=O)(C(=O)O)N OXM [0,0,0,0,2,0|1,0,0]=3 377 B5R0.5 C(=O)(C(=O)O)O OXD [0,0,0,0,2,0|1,0,0]=3 378 B5R0.5 C(=O)(C(=O)[O-])[O-] OXL [0,0,0,0,2,0|1,0,1]=4 379 B5R0.5 C=C(C(=O)O)N DHA [0,0,0,0,2,0|1,0,1]=4 380 B5R0.5 CC(=O)C(=O)N PYM [0,0,0,0,2,0|1,0,0]=3 381 B5R0.5 CC(=O)C(=O)O PYR [0,0,0,0,2,0|0,0,0]=2 382 B5R0.5 CC(=[NH2+])C(=O)[O-] NAK [0,0,0,0,2,0|1,0,1]=4 383 B5R0.5 CC(C)C(=O)O ALQ [0,0,0,0,2,0|1,0,1]=4 384 B5R0.5 CC(C)C(=O)O ISB [0,0,0,0,2,0|1,0,1]=4 385 B5R0.5 C[C@@H](C(=O)C)O HBS [0,0,0,0,2,0|1,0,1]=4 386 B5R0.5 C[C@@H](C(=O)O)Cl CNR [0,0,0,0,2,0|1,0,1]=4 387 B5R0.5 C[C@@H](C(=O)O)N ALA [0,0,0,0,2,0|1,0,1]=4 388 B5R0.5 C[C@@H](C(=O)O)N ALA_LFOH [0,0,0,0,2,0|1,0,1]=4 389 B5R0.5 C[C@@H](C(=O)O)O 2OP [0,0,0,0,2,0|0,0,2]=4 390 B5R0.5 C[C@@H](C(=O)O)[NH-] ALA_LEO2H [0,0,0,0,2,0|1,0,1]=4 391 B5R0.5 C[C@H](C(=O)C)O HBR [0,0,0,0,2,0|1,0,1]=4 392 B5R0.5 C[C@H](C(=O)O)F 4LT [0,0,0,0,2,0|1,0,1]=4 393 B5R0.5 C[C@H](C(=O)O)N DAL [0,0,0,0,2,0|1,0,1]=4 394 B5R0.5 C[C@H](C(=O)O)O DLA [0,0,0,0,2,0|0,0,2]=4 395 B5R0.5 C[C@H](C(=O)O)O LAC [0,0,0,0,2,0|0,0,2]=4 396 B9R0.55 C(CCC(=O)O)CC(=O)O 0L1 [0,0,0,0,0,2|1,0,0]=3 397 B9R0.55 CC(C)CCCCC(=O)O 6F5 [0,0,0,0,0,2|1,0,1]=4 398 B9R0.55 N=C(/N)\NCCCC(=O)O ALG [0,0,0,0,0,2|2,0,0]=4