0 B6R0.3 C#C[C@@H](C(=O)O)N LPG [0,0,0,0,0,0|1,0,3]=4 1 B6R0.3 C(=C(/C(=O)O)\N)\S BB9 [0,0,0,0,0,0|2,0,0]=2 2 B6R0.3 C(=C(\C(=O)O)/N)/[SeH] 30F [0,0,0,0,0,0|2,0,0]=2 3 B6R0.3 C(C(=O)C(=O)O)Br BPV [0,0,0,0,0,0|2,0,1]=3 4 B6R0.3 C(C(=O)C(=O)O)F 65S [0,0,0,0,0,0|2,0,1]=3 5 B6R0.3 C(C(=O)C(=O)O)O 3PY [0,0,0,0,0,0|2,0,1]=3 6 B6R0.3 C([C@@H](C(=O)O)N)Cl C22 [0,0,0,0,0,0|2,0,2]=4 7 B6R0.3 C([C@@H](C(=O)O)N)N DPP [0,0,0,0,0,0|2,0,2]=4 8 B6R0.3 C([C@@H](C(=O)O)N)O SEG [0,0,0,0,0,0|2,0,2]=4 9 B6R0.3 C([C@@H](C(=O)O)N)O SER [0,0,0,0,0,0|2,0,2]=4 10 B6R0.3 C([C@@H](C(=O)O)N)O SER_LFOH [0,0,0,0,0,0|2,0,2]=4 11 B6R0.3 C([C@@H](C(=O)O)N)S BTC [0,0,0,0,0,0|2,0,2]=4 12 B6R0.3 C([C@@H](C(=O)O)N)S CYS [0,0,0,0,0,0|2,0,2]=4 13 B6R0.3 C([C@@H](C(=O)O)N)S CYS_LFOH [0,0,0,0,0,0|2,0,2]=4 14 B6R0.3 C([C@@H](C(=O)O)N)S FCY [0,0,0,0,0,0|2,0,2]=4 15 B6R0.3 C([C@@H](C(=O)O)N)[NH3+] DNP [0,0,0,0,0,0|2,0,2]=4 16 B6R0.3 C([C@@H](C(=O)O)N)[O-] SER_LFOH_DHG [0,0,0,0,0,0|2,0,2]=4 17 B6R0.3 C([C@@H](C(=O)O)N)[S-] CYS_LFOH_DHG [0,0,0,0,0,0|2,0,2]=4 18 B6R0.3 C([C@@H](C(=O)O)N)[SeH] CSE [0,0,0,0,0,0|2,0,2]=4 19 B6R0.3 C([C@@H](C(=O)O)N)[SeH] SEC [0,0,0,0,0,0|2,0,2]=4 20 B6R0.3 C([C@@H](C(=O)O)[NH-])O SER_LEO2H [0,0,0,0,0,0|2,0,2]=4 21 B6R0.3 C([C@@H](C(=O)O)[NH-])S CYS_LEO2H [0,0,0,0,0,0|2,0,2]=4 22 B6R0.3 C([C@@H](C(=O)O)[NH-])[O-] SER_LEO2H_DHG [0,0,0,0,0,0|2,0,2]=4 23 B6R0.3 C([C@@H](C(=O)O)[NH-])[S-] CYS_LEO2H_DHG [0,0,0,0,0,0|2,0,2]=4 24 B6R0.3 C([C@H](C(=O)O)N)Cl C2N [0,0,0,0,0,0|2,0,2]=4 25 B6R0.3 C([C@H](C(=O)O)N)N 2RA [0,0,0,0,0,0|2,0,2]=4 26 B6R0.3 C([C@H](C(=O)O)N)O DSN [0,0,0,0,0,0|2,0,2]=4 27 B6R0.3 C([C@H](C(=O)O)N)S DCY [0,0,0,0,0,0|2,0,2]=4 28 B6R0.3 C([C@H](C(=O)O)O)N 0QZ [0,0,0,0,0,0|2,0,2]=4 29 B6R0.3 C([C@H](C(=O)O)O)O DGY [0,0,0,0,0,0|2,0,2]=4 30 B6R0.3 C/C=C(/C(=O)O)\N DBU [0,0,0,0,0,0|1,0,0]=1 31 B6R0.3 C=C(C[SeH])C(=O)O CC4 [0,0,0,0,0,0|1,0,2]=3 32 B6R0.3 C=CC(=O)C(=C)N 6R3 [0,0,0,0,0,0|3,0,1]=4 33 B6R0.3 C=C[C@@H](C(=O)O)N LVG [0,0,0,0,0,0|1,0,2]=3 34 B6R0.3 C=C[C@H](C(=O)[O-])[NH3+] A3B [0,0,0,0,0,0|1,0,3]=4 35 B6R0.3 CCC(=O)C(=O)O 2KT [0,0,0,0,0,0|1,0,1]=2 36 B6R0.3 CCC(C(=O)O)N AA3 [0,0,0,0,0,0|1,0,2]=3 37 B6R0.3 CC[C@@H](C(=O)O)Cl 39J [0,0,0,0,0,0|1,0,2]=3 38 B6R0.3 CC[C@@H](C(=O)O)N AB7 [0,0,0,0,0,0|1,0,2]=3 39 B6R0.3 CC[C@@H](C(=O)O)N ABA [0,0,0,0,0,0|1,0,2]=3 40 B6R0.3 CC[C@@H](C(=O)O)N UNK [0,0,0,0,0,0|1,0,2]=3 41 B6R0.3 CC[C@H](C(=O)O)N DBB [0,0,0,0,0,0|1,0,2]=3 42 B6R0.3 CC[C@H](C)C(=O)O SMB [0,0,0,0,0,0|0,0,2]=2 43 B6R0.3 CC[C@H](C)[N+](=O)[O-] NBT [0,0,0,0,0,0|1,0,3]=4 44 B6R0.3 CN(C=C)C(=O)O EMM [0,0,0,0,0,0|1,0,1]=2 45 B6R0.3 CNC(=C)C(=O)O DAM [0,0,0,0,0,0|1,0,1]=2 46 B6R0.3 C[C@@H](C(=O)N)NC ZZJ [0,0,0,0,0,0|2,0,1]=3 47 B6R0.3 C[C@@H](C(=O)O)NC MAA [0,0,0,0,0,0|1,0,1]=2 48 B6R0.3 C[C@@H](CN)C(=O)O 62H [0,0,0,0,0,0|1,0,2]=3 49 B6R0.3 C[C@@H](CN)C(=O)[O-] BIB [0,0,0,0,0,0|1,0,3]=4 50 B6R0.3 C[C@H](C(=O)O)NC 33X [0,0,0,0,0,0|1,0,1]=2 51 B6R0.3 C[C@H](CO)C(=O)O HIU [0,0,0,0,0,0|1,0,2]=3 52 B6R0.3 C[C@H](CS)C(=O)O CC8 [0,0,0,0,0,0|1,0,2]=3 53 B6R0.3 C\C=C(\C)/C(=O)O MB8 [0,0,0,0,0,0|0,0,0]=0 54 B6R0.3 N=C(/CO)\C(=O)O MH6 [0,0,0,0,0,0|2,0,1]=3 55 B6R0.3 N=C(/CO)\C(=O)O SRI [0,0,0,0,0,0|2,0,1]=3 56 B5R0.1 C(C(=O)O)ON AOA [1,0,0,0,0,0|2,0,1]=4 57 B5R0.1 C(CN)C(=O)O BAL [1,0,0,0,0,0|1,0,2]=4 58 B5R0.1 C(CO)C(=O)O 3OH [1,0,0,0,0,0|1,0,2]=4 59 B5R0.1 C(CS)C(=O)O MPT [1,0,0,0,0,0|1,0,2]=4 60 B5R0.1 C(C[SeH])C(=O)O SLP [1,0,0,0,0,0|1,0,2]=4 61 B5R0.1 CC=CC(=O)O BEO [1,0,0,0,0,0|0,0,0]=1 62 B5R0.1 CCCC(=O)C PNH [1,0,0,0,0,0|1,0,2]=4 63 B5R0.1 CCCC(=O)N BMD [1,0,0,0,0,0|1,0,2]=4 64 B5R0.1 CCCC(=O)O BUA [1,0,0,0,0,0|0,0,2]=3 65 B5R0.1 CCOC(=O)C EEE [1,0,0,0,0,0|2,0,1]=4 66 B5R0.1 CCOC(=O)O 01F [1,0,0,0,0,0|1,0,1]=3 67 B5R0.1 CCO[P@H](=O)O ATJ [1,0,0,0,0,0|2,0,1]=4 68 B5R0.1 CNCC(=O)O MGY [1,0,0,0,0,0|1,0,1]=3 69 B5R0.1 CNCC(=O)O SAR [1,0,0,0,0,0|1,0,1]=3 70 B5R0.1 CSCC(=O)[O-] MTG [1,0,0,0,0,0|1,0,2]=4 71 B5R0.1 C[Se]CC(=O)[O-] MSF [1,0,0,0,0,0|1,0,2]=4 72 B5R0.1 C[Te]CC(=O)[O-] MTD [1,0,0,0,0,0|1,0,2]=4 73 B5R0.5 C(=O)(C(=O)O)N OXM [1,0,0,0,0,0|2,0,0]=3 74 B5R0.5 C(=O)(C(=O)O)O OXD [1,0,0,0,0,0|2,0,0]=3 75 B5R0.5 C(=O)(C(=O)[O-])[O-] OXL [1,0,0,0,0,0|2,0,1]=4 76 B5R0.5 C(C(=O)O)(Cl)Cl TF4 [1,0,0,0,0,0|2,0,1]=4 77 B5R0.5 C=C(C(=O)N)N PYT [1,0,0,0,0,0|2,0,0]=3 78 B5R0.5 C=C(C(=O)O)N DHA [1,0,0,0,0,0|1,0,0]=2 79 B5R0.5 CC(=O)C(=O)N PYM [1,0,0,0,0,0|2,0,0]=3 80 B5R0.5 CC(=O)C(=O)O PYR [1,0,0,0,0,0|1,0,0]=2 81 B5R0.5 CC(=O)N(C)C 5Y9 [1,0,0,0,0,0|2,0,0]=3 82 B5R0.5 CC(=[NH2+])C(=O)[O-] NAK [1,0,0,0,0,0|1,0,1]=3 83 B5R0.5 CC(C)C(=O)N IBO [1,0,0,0,0,0|1,0,1]=3 84 B5R0.5 CC(C)C(=O)O ALQ [1,0,0,0,0,0|0,0,1]=2 85 B5R0.5 CC(C)C(=O)O ISB [1,0,0,0,0,0|0,0,1]=2 86 B5R0.5 CC(C)[N+](=O)[O-] NIS [1,0,0,0,0,0|1,0,2]=4 87 B5R0.5 C[C@@H](C(=O)C)N ALM [1,0,0,0,0,0|2,0,1]=4 88 B5R0.5 C[C@@H](C(=O)C)O HBS [1,0,0,0,0,0|2,0,1]=4 89 B5R0.5 C[C@@H](C(=O)N)N 66N [1,0,0,0,0,0|2,0,1]=4 90 B5R0.5 C[C@@H](C(=O)O)Cl CNR [1,0,0,0,0,0|1,0,1]=3 91 B5R0.5 C[C@@H](C(=O)O)N ALA [1,0,0,0,0,0|1,0,1]=3 92 B5R0.5 C[C@@H](C(=O)O)N ALA_LFOH [1,0,0,0,0,0|1,0,1]=3 93 B5R0.5 C[C@@H](C(=O)O)O 2OP [1,0,0,0,0,0|1,0,1]=3 94 B5R0.5 C[C@@H](C(=O)O)[NH-] ALA_LEO2H [1,0,0,0,0,0|1,0,1]=3 95 B5R0.5 C[C@@H](C(=O)[O-])[NH-] ALA_LEO2 [1,0,0,0,0,0|1,0,2]=4 96 B5R0.5 C[C@@H](C(=O)[O-])[NH3+] ALA_LFZW [1,0,0,0,0,0|1,0,2]=4 97 B5R0.5 C[C@@H](C(=S)O)N ALT [1,0,0,0,0,0|1,1,1]=4 98 B5R0.5 C[C@H](C(=O)C)O HBR [1,0,0,0,0,0|2,0,1]=4 99 B5R0.5 C[C@H](C(=O)O)F 4LT [1,0,0,0,0,0|1,0,1]=3 100 B5R0.5 C[C@H](C(=O)O)N DAL [1,0,0,0,0,0|1,0,1]=3 101 B5R0.5 C[C@H](C(=O)O)O DLA [1,0,0,0,0,0|1,0,1]=3 102 B5R0.5 C[C@H](C(=O)O)O LAC [1,0,0,0,0,0|1,0,1]=3 103 B5R0.5 [C@H](C(=O)O)(N)O HGY [1,0,0,0,0,0|2,0,1]=4 104 B7R0.5 C(C=O)[C@H](C(=O)O)N AS2 [0,1,0,0,0,0|2,0,1]=4 105 B7R0.5 C(CN)[C@@H](C(=O)O)N DAB [0,1,0,0,0,0|1,0,2]=4 106 B7R0.5 C(CN)[C@H](C(=O)O)N 4FO [0,1,0,0,0,0|1,0,2]=4 107 B7R0.5 C(CN)[C@H](C(=O)O)O 42B [0,1,0,0,0,0|1,0,2]=4 108 B7R0.5 C(CO)C(=O)C(=O)O VGX [0,1,0,0,0,0|1,0,1]=3 109 B7R0.5 C(CO)[C@@H](C(=O)O)N HSE [0,1,0,0,0,0|1,0,2]=4 110 B7R0.5 C(CS)[C@@H](C(=O)O)N HCS [0,1,0,0,0,0|1,0,2]=4 111 B7R0.5 C(CS)[C@H](C(=O)O)N KCY [0,1,0,0,0,0|1,0,2]=4 112 B7R0.5 C/C=C\C(=O)C(=O)O OXP [0,1,0,0,0,0|1,0,0]=2 113 B7R0.5 C=CC[C@@H](C(=O)O)N 2AG [0,1,0,0,0,0|1,0,2]=4 114 B7R0.5 C=CC[C@H](C(=O)O)N DYL [0,1,0,0,0,0|1,0,2]=4 115 B7R0.5 CCCC(=O)C(=O)O 69O [0,1,0,0,0,0|1,0,1]=3 116 B7R0.5 CCC[C@@H](C(=O)O)N 2PI [0,1,0,0,0,0|1,0,2]=4 117 B7R0.5 CCC[C@@H](C(=O)O)N BTA [0,1,0,0,0,0|1,0,2]=4 118 B7R0.5 CCC[C@@H](C(=O)O)N NVA [0,1,0,0,0,0|1,0,2]=4 119 B7R0.5 CCC[C@@H](C(=O)O)N RON [0,1,0,0,0,0|1,0,2]=4 120 B7R0.5 CCS[C@@H](C(=O)O)N GSC [0,1,0,0,0,0|1,0,2]=4 121 B7R0.5 COC[C@@H](C(=O)O)N 7C9 [0,1,0,0,0,0|1,0,2]=4 122 B7R0.5 CS/C=C(/C(=O)O)\O DEI [0,1,0,0,0,0|1,0,0]=2 123 B7R0.5 CSC[C@@H](C(=O)O)N CYM [0,1,0,0,0,0|1,0,2]=4 124 B7R0.5 CSC[C@@H](C(=O)O)N SMC [0,1,0,0,0,0|1,0,2]=4 125 B7R0.5 CSC[C@H](C(=O)O)N 060 [0,1,0,0,0,0|1,0,2]=4 126 B7R0.10 COC(=O)C(=C)CO 23W [0,1,0,0,0,0|1,0,2]=4 127 B7R0.13 CC(C)(C(=O)O)NC 3WS [0,1,0,0,0,0|1,0,1]=3 128 B7R0.13 CC[C@](C)(C(=O)O)N DIV [0,1,0,0,0,0|0,0,2]=3 129 B7R0.13 C[C@](CO)(C(=O)O)O 8A1 [0,1,0,0,0,0|1,0,2]=4 130 B7R0.13 C[C@](CS)(C(=O)O)N 03Y [0,1,0,0,0,0|1,0,2]=4 131 B7R0.15 C([C@@H](CO)C(=O)O)N BSE [0,1,0,0,0,0|1,0,2]=4 132 B7R0.15 C/C=C(/C(=O)O)\NC MDH [0,1,0,0,0,0|0,0,0]=1 133 B7R0.15 CN[C@@H](C(=O)O)SC MSA [0,1,0,0,0,0|1,0,1]=3 134 B7R0.15 CN[C@@H](CO)C(=O)O 5JP [0,1,0,0,0,0|1,0,1]=3 135 B7R0.15 CN[C@@H](CS)C(=O)O NCY [0,1,0,0,0,0|1,0,1]=3 136 B7R0.15 CN[C@H](CO)C(=O)O DSE [0,1,0,0,0,0|1,0,1]=3 137 B7R0.16 C(=O)(C(=O)O)C(=O)O MAK [0,1,0,0,0,0|2,0,0]=3 138 B7R0.16 C(C(=O)O)(C(=O)O)N FGL [0,1,0,0,0,0|2,0,1]=4 139 B7R0.16 CC(=O)[C@@H](C(=O)O)N AKB [0,1,0,0,0,0|1,0,1]=3 140 B7R0.16 CC(C(=O)O)C(=O)O DXX [0,1,0,0,0,0|1,0,1]=3 141 B7R0.16 CC(C)C(=O)C(=O)O KIV [0,1,0,0,0,0|1,0,1]=3 142 B7R0.16 CC(C)[C@@H](C(=O)O)N VAL [0,1,0,0,0,0|1,0,2]=4 143 B7R0.16 CC(C)[C@@H](C(=O)O)N VAL_LFOH [0,1,0,0,0,0|1,0,2]=4 144 B7R0.16 CC(C)[C@@H](C(=O)O)O LHV [0,1,0,0,0,0|1,0,2]=4 145 B7R0.16 CC(C)[C@@H](C(=O)O)[NH-] VAL_LEO2H [0,1,0,0,0,0|1,0,2]=4 146 B7R0.16 CC(C)[C@H](C(=O)O)N DVA [0,1,0,0,0,0|1,0,2]=4 147 B7R0.16 CC(C)[C@H](C(=O)O)O VAD [0,1,0,0,0,0|1,0,2]=4 148 B7R0.16 C[C@@H](C(=O)O)N(C)C LAL [0,1,0,0,0,0|1,0,1]=3 149 B7R0.16 C[C@@H]([C@@H](C(=O)O)N)O ALO [0,1,0,0,0,0|1,0,2]=4 150 B7R0.16 C[C@@H]([C@H](C(=O)O)N)O DTH [0,1,0,0,0,0|1,0,2]=4 151 B7R0.16 C[C@H]([C@@H](C(=O)O)N)N VLL [0,1,0,0,0,0|1,0,2]=4 152 B7R0.16 C[C@H]([C@@H](C(=O)O)N)O THR [0,1,0,0,0,0|1,0,2]=4 153 B7R0.16 C[C@H]([C@@H](C(=O)O)N)O THR_LFOH [0,1,0,0,0,0|1,0,2]=4 154 B7R0.16 C[C@H]([C@@H](C(=O)O)N)S CG6 [0,1,0,0,0,0|1,0,2]=4 155 B7R0.16 C[C@H]([C@@H](C(=O)O)N)[O-] THR_LFOH_DHG1 [0,1,0,0,0,0|1,0,2]=4 156 B7R0.16 C[C@H]([C@@H](C(=O)O)[NH-])O THR_LEO2H [0,1,0,0,0,0|1,0,2]=4 157 B7R0.16 C[C@H]([C@@H](C(=O)O)[NH-])[O-] THR_LEO2H_DHG1 [0,1,0,0,0,0|1,0,2]=4 158 B7R0.16 C[C@H]([C@H](C(=O)O)N)N VDL [0,1,0,0,0,0|1,0,2]=4 159 B7R0.16 C[C@H]([C@H](C(=O)O)N)O 2TL [0,1,0,0,0,0|1,0,2]=4 160 B7R0.16 C\C(=C(/C(=O)O)\N)\O MOZ [0,1,0,0,0,0|1,0,0]=2 161 B7R0.16 C\C(=C(/C(=O)O)\N)\S BB6 [0,1,0,0,0,0|1,0,0]=2 162 B7R1.4 C1COC(=O)[C@H]1N HSL [0,0,0,1,0,0|1,0,2]=4 163 B7R1.4 CN1CCCC1=O MB3 [0,0,0,1,0,0|2,0,1]=4 164 B7R1.4 CN1CCOC1=O 3MO [0,0,0,1,0,0|1,0,1]=3 165 B7R1.12 C[C@H]1[C@H](N1)C(=O)O 3K4 [0,0,0,1,0,0|1,0,2]=4 166 B7R1.18 C1CN[C@@H]1C(=O)O 02A [0,0,0,1,0,0|1,0,1]=3 167 B7R1.19 C1CC1(C(=O)O)N 1AC [0,0,0,1,0,0|1,0,2]=4 168 B7R0.2 C(C(=O)O)N(C=O)O HDA [0,0,0,0,0,1|3,0,0]=4 169 B7R0.2 C([C@@H](C=O)N)C(=O)O ASA [0,0,0,0,0,1|2,0,1]=4 170 B4R0.1 C(=O)C(=O)O GLV [2,0,0,0,0,0|1,0,0]=3 171 B4R0.1 C(C(=O)O)Br BRM [2,0,0,0,0,0|1,0,1]=4 172 B4R0.1 C(C(=O)O)Br BXA [2,0,0,0,0,0|1,0,1]=4 173 B4R0.1 C(C(=O)O)Cl R3W [2,0,0,0,0,0|1,0,1]=4 174 B4R0.1 C(C(=O)O)F FAH [2,0,0,0,0,0|1,0,1]=4 175 B4R0.1 C(C(=O)O)I 04E [2,0,0,0,0,0|1,0,1]=4 176 B4R0.1 C(C(=O)O)N GLY [2,0,0,0,0,0|1,0,1]=4 177 B4R0.1 C(C(=O)O)N GLY_LFOH [2,0,0,0,0,0|1,0,1]=4 178 B4R0.1 C(C(=O)O)O GOA [2,0,0,0,0,0|1,0,1]=4 179 B4R0.1 C(C(=O)O)S MCR [2,0,0,0,0,0|1,0,1]=4 180 B4R0.1 C(C(=O)O)[NH-] GLY_LEO2H [2,0,0,0,0,0|1,0,1]=4 181 B4R0.1 C=C(CO)Br BRP [2,0,0,0,0,0|1,0,1]=4 182 B4R0.1 C=CC(=O)N 1HC [2,0,0,0,0,0|1,0,0]=3 183 B4R0.1 C=CC(=O)O AKR [2,0,0,0,0,0|0,0,0]=2 184 B4R0.1 CC(=C)C=C 61G [2,0,0,0,0,0|0,0,1]=3 185 B4R0.1 CC(=C)CN IRS [2,0,0,0,0,0|1,0,1]=4 186 B4R0.1 CC(=O)C=O PVL [2,0,0,0,0,0|1,0,0]=3 187 B4R0.1 CC(=O)CCl ATO [2,0,0,0,0,0|1,0,1]=4 188 B4R0.1 CC(=O)CN GCM [2,0,0,0,0,0|1,0,1]=4 189 B4R0.1 CC(=O)CN GLM [2,0,0,0,0,0|1,0,1]=4 190 B4R0.1 CC(=O)CO 4Y8 [2,0,0,0,0,0|1,0,1]=4 191 B4R0.1 CC(=O)NC NML [2,0,0,0,0,0|1,0,0]=3 192 B4R0.1 CC(=O)NO HAE [2,0,0,0,0,0|2,0,0]=4 193 B4R0.1 CC(=O)OO F50 [2,0,0,0,0,0|2,0,0]=4 194 B4R0.1 CC(=O)O[Hg+] MAC [2,0,0,0,0,0|2,0,0]=4 195 B4R0.1 CC(C)C=O 5OZ [2,0,0,0,0,0|0,0,1]=3 196 B4R0.1 CC=C(C)C 2MB [2,0,0,0,0,0|0,0,1]=3 197 B4R0.1 CCC(=O)N ROP [2,0,0,0,0,0|1,0,1]=4 198 B4R0.1 CCC(=O)O PPI [2,0,0,0,0,0|0,0,1]=3 199 B4R0.1 CC[C@H](C)O SBT [2,0,0,0,0,0|0,0,2]=4 200 B4R0.1 CN(C)C=O DMF [2,0,0,0,0,0|1,0,0]=3 201 B4R0.1 CN(C)[Zn]O DOZ [2,0,0,0,0,0|2,0,0]=4 202 B4R0.1 CNC(=O)N NMU [2,0,0,0,0,0|2,0,0]=4 203 B4R0.1 CNC(=O)O RGI [2,0,0,0,0,0|1,0,0]=3 204 B4R0.1 COC(=O)O 000 [2,0,0,0,0,0|1,0,0]=3 205 B4R0.1 C[C@@H](C=O)N 5XU [2,0,0,0,0,0|1,0,1]=4 206 B4R0.2 C(C=O)C=O MDD [2,0,0,0,0,0|1,0,1]=4 207 B4R0.2 C/C=C/C=O CRD [2,0,0,0,0,0|0,0,0]=2 208 B4R0.2 CC/C=N\O PXO [2,0,0,0,0,0|1,0,1]=4 209 B4R0.2 CCOC=O ETO [2,0,0,0,0,0|1,0,1]=4 210 B6R0.1 CCNC(=O)OC MEC [1,1,0,0,0,0|1,0,1]=4 211 B6R0.2 C(C(=O)N)C(=O)O MLM [1,1,0,0,0,0|1,0,1]=4 212 B6R0.2 C(C(=O)O)C(=O)Cl PR6 [1,1,0,0,0,0|1,0,1]=4 213 B6R0.2 C(C(=O)O)C(=O)O MLA [1,1,0,0,0,0|1,0,1]=4 214 B6R0.2 CC(=O)CC(=O)C P2D [1,1,0,0,0,0|1,0,1]=4 215 B6R0.2 CC(=O)CC(=O)O AAE [1,1,0,0,0,0|0,0,1]=3 216 B6R0.2 CC(=O)CC(=O)O LIN [1,1,0,0,0,0|0,0,1]=3 217 B6R0.2 CC(C)CC(=O)O IVA [1,1,0,0,0,0|0,0,2]=4 218 B6R0.2 CN(C)CC(=O)O DMG [1,1,0,0,0,0|1,0,1]=4 219 B6R0.2 CS(C)CC(=O)O 313 [1,1,0,0,0,0|1,0,1]=4 220 B6R0.2 C[C@@H](CC(=O)O)N B3A [1,1,0,0,0,0|0,0,2]=4 221 B6R0.2 C[C@@H](CC(=O)O)O 3HL [1,1,0,0,0,0|0,0,2]=4 222 B6R0.2 C[C@H](CC(=O)O)O 3HR [1,1,0,0,0,0|0,0,2]=4 223 B6R0.4 C(CC(=O)O)C=O SSN [1,1,0,0,0,0|1,0,1]=4 224 B6R0.4 C(CC(=O)O)CBr 0A5 [1,1,0,0,0,0|0,0,2]=4 225 B6R0.4 C(CC(=O)O)CN ABU [1,1,0,0,0,0|0,0,2]=4 226 B6R0.4 CCCCC(=O)O LEA [1,1,0,0,0,0|0,0,2]=4 227 B6R0.4 CCCCC(=O)O PEI [1,1,0,0,0,0|0,0,2]=4 228 B6R0.4 CCNCC(=O)O 2JC [1,1,0,0,0,0|0,0,2]=4 229 B6R0.7 CC(C)(C(=O)O)Br B2P [1,1,0,0,0,0|0,0,1]=3 230 B6R0.7 CC(C)(C(=O)O)N AIB [1,1,0,0,0,0|0,0,1]=3 231 B6R0.7 CC(C)(C)C(=O)N TAY [1,1,0,0,0,0|1,0,1]=4 232 B6R0.7 CC(C)(C)C(=O)O PIV [1,1,0,0,0,0|0,0,1]=3 233 B6R0.7 CN(C)S(=O)(=O)O MAS [1,1,0,0,0,0|2,0,0]=4 234 B8R0.2 CC([C@H](C(=O)O)N)OC XDT [0,1,0,0,0,1|1,0,1]=4 235 B8R0.2 CC([C@H](C(=O)O)N)SC 1ME [0,1,0,0,0,1|1,0,1]=4 236 B8R0.2 CC[C@@H](C)[C@@H](C(=O)O)N IIL [0,1,0,0,0,1|0,0,2]=4 237 B8R0.2 CC[C@@H](C)[C@H](C(=O)O)N DIL [0,1,0,0,0,1|0,0,2]=4 238 B8R0.2 CC[C@H](C)C(=O)C(=O)O 1QQ [0,1,0,0,0,1|0,0,2]=4 239 B8R0.2 CC[C@H](C)[C@@H](C(=O)O)N ILE [0,1,0,0,0,1|0,0,2]=4 240 B8R0.2 CC[C@H](C)[C@@H](C(=O)O)N ILE_LFOH [0,1,0,0,0,1|0,0,2]=4 241 B8R0.2 CC[C@H](C)[C@@H](C(=O)O)O OIL [0,1,0,0,0,1|0,0,2]=4 242 B8R0.2 CC[C@H](C)[C@@H](C(=O)O)[NH-] ILE_LEO2H [0,1,0,0,0,1|0,0,2]=4 243 B8R0.2 CC[C@H](C)[C@H](C(=O)O)N 28J [0,1,0,0,0,1|0,0,2]=4 244 B8R0.2 C[C@H](C=O)[C@@H](C(=O)O)N LVN [0,1,0,0,0,1|1,0,1]=4 245 B8R0.2 C[C@H]([C@@H](C(=O)O)N)OC OLT [0,1,0,0,0,1|1,0,1]=4 246 B8R0.5 C(CO)C(=O)CC(=O)O 98J [0,1,0,0,0,1|1,0,1]=4 247 B8R0.23 C(=C(/C(=O)O)\N)/C(=O)O 2KZ [0,1,0,0,0,1|2,0,0]=4 248 B8R0.23 C(=C(\C(=O)O)/N)/C(=O)O DYA [0,1,0,0,0,1|2,0,0]=4 249 B8R0.23 C=C(CC(=O)O)C(=O)O ITN [0,1,0,0,0,1|1,0,1]=4 250 B8R0.23 CC(=O)[C@H](CC(=O)O)N ASK [0,1,0,0,0,1|1,0,1]=4 251 B8R0.23 CC(CC(=O)O)C(=O)O JO3 [0,1,0,0,0,1|1,0,1]=4 252 B8R0.23 CN(CC(=O)O)C(=N)N CRN [0,1,0,0,0,1|2,0,0]=4 253 B8R0.23 CN(CC(=O)O)C(=O)N CMS [0,1,0,0,0,1|2,0,0]=4 254 B8R0.23 C[C@@H](C(=O)O)NC(=O)O NXA [0,1,0,0,0,1|1,0,1]=4 255 B8R0.23 C[C@@H](CC(=O)O)C(=O)O SUH [0,1,0,0,0,1|1,0,1]=4 256 B8R0.23 C\C(=C/C(=O)O)\C(=O)O MEZ [0,1,0,0,0,1|1,0,0]=3 257 B8R0.23 C\C(=C\C(=O)O)\C(=O)O CIZ [0,1,0,0,0,1|1,0,0]=3 258 B8R0.8 C(CC(=O)C(=O)O)C=O DO4 [0,2,0,0,0,0|1,0,1]=4 259 B8R0.8 CO/C=C\[C@@H](C(=O)O)N AMB [0,2,0,0,0,0|1,0,1]=4 260 B8R0.8 CSCCC(=O)C(=O)O KMT [0,2,0,0,0,0|1,0,1]=4 261 B8R0.8 N=C(/CCSC)\C(=O)O 0XD [0,2,0,0,0,0|1,0,1]=4 262 B8R0.15 C([C@@H](C(=O)O)NC=O)N 0FL [0,2,0,0,0,0|1,0,1]=4 263 B8R0.15 CN[C@@H](CSC)C(=O)O N2C [0,2,0,0,0,0|0,0,2]=4 264 B8R0.36 CCC(CC)(C(=O)O)N 0XL [0,2,0,0,0,0|0,0,2]=4 265 B8R0.37 CC(=O)[C@@](C)(C(=O)O)O X2X [0,2,0,0,0,0|0,0,1]=3 266 B8R0.37 C[C@@H]([C@@](C)(C(=O)O)O)O QFH [0,2,0,0,0,0|0,0,2]=4 267 B8R0.37 C[C@H]([C@@](C)(C(=O)O)O)O 23B [0,2,0,0,0,0|0,0,2]=4 268 B8R0.37 C[C@H]([C@](C)(C(=O)O)O)O WTZ [0,2,0,0,0,0|0,0,2]=4 269 B8R0.18 CC(C)[C@@H](C(=O)O)NC MVA [0,2,0,0,0,0|0,0,2]=4 270 B8R0.18 CC(C)[C@H](C(=O)O)NC MV9 [0,2,0,0,0,0|0,0,2]=4 271 B8R0.18 C[C@H]([C@@H](C(=O)O)NC)O NZC [0,2,0,0,0,0|0,0,2]=4 272 B6R1.2 C1CC(=O)OC1 GBL [1,0,0,1,0,0|0,0,2]=4 273 B8R1.4 Cc1cccc(c1)O CRS [0,0,0,1,0,1|1,0,1]=4 274 B8R1.5 Cc1ccccc1O JZ0 [0,1,0,1,0,0|1,0,1]=4 275 B8R1.7 C1CC(=[NH+]C1)C(=O)[O-] 2PC [0,1,0,1,0,0|0,0,2]=4 276 B8R1.7 C1CCC(C1)C(=O)O IQ0 [0,1,0,1,0,0|0,0,2]=4 277 B8R1.7 C1C[C@@H](NC1)C(=O)O DPR [0,1,0,1,0,0|0,0,2]=4 278 B8R1.7 C1C[C@H](C=C1)C(=O)O C54 [0,1,0,1,0,0|0,0,1]=3 279 B8R1.7 C1C[C@H](NC1)C(=O)O PRO [0,1,0,1,0,0|0,0,2]=4 280 B8R1.7 C1C[C@H](NC1)C(=O)O PRO_LFOH [0,1,0,1,0,0|0,0,2]=4 281 B8R1.7 C1C[C@H](OC1)C(=O)O TFB [0,1,0,1,0,0|0,0,2]=4 282 B8R1.7 C1C[C@H]([N-]C1)C(=O)O PRO_LEO2H [0,1,0,1,0,0|0,0,2]=4 283 B8R1.7 C1[C@H](NCS1)C(=O)O PRS [0,1,0,1,0,0|1,0,1]=4 284 B8R1.7 c1c(ncs1)C(=O)O TZO [0,1,0,1,0,0|1,0,1]=4 285 B8R1.7 c1cc(oc1)C(=O)O FOA [0,1,0,1,0,0|0,0,2]=4 286 B8R1.7 c1cc(sc1)C(=O)O C21 [0,1,0,1,0,0|0,0,2]=4 287 B8R1.78 C1CC(C1)(C(=O)O)N 192 [0,1,0,1,0,0|0,0,2]=4 288 B8R1.11 C1CC(=O)C(=C1)CO 3RN [0,1,0,1,0,0|1,0,0]=3 289 B8R1.50 CC1=C(C(=O)CO1)O 4XX [0,1,0,1,0,0|1,0,0]=3 290 B8R1.50 CN1C(=O)CCC1=O LCY [0,1,0,1,0,0|2,0,0]=4 291 B8R0.9 C(CC(=O)O)C(=O)C=O HKV [0,0,0,0,0,2|2,0,0]=4 292 B8R0.9 C/C=C(\CCC(=O)O)/N GEG [0,0,0,0,0,2|1,0,0]=3 293 B8R0.9 COC(=O)CCC(=O)O MSU [0,0,0,0,0,2|2,0,0]=4