0 B6R0.1 C(CO)[C@H](C[O])O BGQ [0,0,0,0,0,0|2,0,2]=4 1 B6R0.1 C([C@@H](C=O)[NH3+])S[SeH] EYS [0,0,0,0,0,0|3,0,0]=3 2 B6R0.1 CCC[C@@H](CO)O 1SP [0,0,0,0,0,0|1,0,2]=3 3 B6R0.1 CCS[C@H](C)SC 0AJ [0,0,0,0,0,0|3,0,0]=3 4 B5R0.1 C(CN)C(=O)O BAL [1,0,0,0,0,0|2,0,1]=4 5 B5R0.1 C(CO)C(=O)O 3OH [1,0,0,0,0,0|2,0,1]=4 6 B5R0.1 C(CS)C(=O)O MPT [1,0,0,0,0,0|2,0,1]=4 7 B5R0.1 C(C[SeH])C(=O)O SLP [1,0,0,0,0,0|2,0,1]=4 8 B5R0.1 C=C(CCO)Br 3BB [1,0,0,0,0,0|2,0,1]=4 9 B5R0.1 CC(=O)CCO BUQ [1,0,0,0,0,0|1,0,1]=3 10 B5R0.1 CC(C)CCN LEN [1,0,0,0,0,0|1,0,1]=3 11 B5R0.1 CC(C)CCO IP3 [1,0,0,0,0,0|1,0,1]=3 12 B5R0.1 CCCC(=O)C PNH [1,0,0,0,0,0|0,0,1]=2 13 B5R0.1 CCCC(=O)N BMD [1,0,0,0,0,0|1,0,1]=3 14 B5R0.1 CCCC(=O)O BUA [1,0,0,0,0,0|1,0,1]=3 15 B5R0.1 CCC[N+](=O)[O-] N1P [1,0,0,0,0,0|2,0,0]=3 16 B5R0.1 CCOC(=O)C EEE [1,0,0,0,0,0|1,0,1]=3 17 B5R0.1 CCOC(=O)O 01F [1,0,0,0,0,0|2,0,1]=4 18 B5R0.1 CCO[P@H](=O)O ATJ [1,0,0,0,0,0|3,0,0]=4 19 B5R0.1 CNCC(=O)O MGY [1,0,0,0,0,0|2,0,1]=4 20 B5R0.1 CNCC(=O)O SAR [1,0,0,0,0,0|2,0,1]=4 21 B5R0.1 CSCC(=O)[O-] MTG [1,0,0,0,0,0|2,0,1]=4 22 B5R0.1 CSC[S@@](=O)C DSS [1,0,0,0,0,0|2,0,0]=3 23 B5R0.1 C[C@@H](CCO)O BU2 [1,0,0,0,0,0|1,0,1]=3 24 B5R0.1 C[C@H](CC=O)O 5KO [1,0,0,0,0,0|1,0,2]=4 25 B5R0.1 C[C@H](CCO)O BU4 [1,0,0,0,0,0|1,0,1]=3 26 B5R0.1 C[Se]CC(=O)[O-] MSF [1,0,0,0,0,0|2,0,1]=4 27 B5R0.1 C[Te]CC(=O)[O-] MTD [1,0,0,0,0,0|2,0,1]=4 28 B5R0.2 C(CCN)CN PUT [1,0,0,0,0,0|2,0,1]=4 29 B5R0.2 C(CCO)CO BU1 [1,0,0,0,0,0|1,0,2]=4 30 B5R0.2 C(CCO)C[NH3+] 4HA [1,0,0,0,0,0|1,0,2]=4 31 B5R0.2 C(CCl)NC=O CEC [1,0,0,0,0,0|2,0,0]=3 32 B5R0.2 C(CN)CON XAP [1,0,0,0,0,0|3,0,0]=4 33 B5R0.2 CCC/C=N\O BXO [1,0,0,0,0,0|1,0,2]=4 34 B5R0.2 CCCCC=O PTL [1,0,0,0,0,0|0,0,0]=1 35 B5R0.2 CCCCCBr 5BR [1,0,0,0,0,0|1,0,1]=3 36 B5R0.2 CCCCCC HEX [1,0,0,0,0,0|1,0,1]=3 37 B5R0.2 CCCCCCl 7CL [1,0,0,0,0,0|1,0,1]=3 38 B5R0.2 CCCCCN AML [1,0,0,0,0,0|1,0,1]=3 39 B5R0.2 CCCCCO PE9 [1,0,0,0,0,0|0,0,2]=3 40 B5R0.2 CCCC[N+]#[C-] NBN [1,0,0,0,0,0|2,0,0]=3 41 B5R0.2 CCOCCO ETX [1,0,0,0,0,0|1,0,2]=4 42 B5R0.2 CNCCCN N3D [1,0,0,0,0,0|2,0,1]=4 43 B5R0.2 COCCOC DXE [1,0,0,0,0,0|3,0,0]=4 44 B5R0.3 C(C(C=O)O)O GXV [1,0,0,0,0,0|2,0,0]=3 45 B5R0.3 C([C@@H]([C-]=O)[NH-])O SER_LL [1,0,0,0,0,0|2,0,1]=4 46 B5R0.3 C([C@@H]([C-]=O)[NH-])S CYS_LL [1,0,0,0,0,0|2,0,1]=4 47 B5R0.3 C([C@@H]([C-]=O)[NH-])[O-] SER_LL_DHG [1,0,0,0,0,0|2,0,1]=4 48 B5R0.3 C([C@@H]([C-]=O)[NH-])[S-] CYS_LL_DHG [1,0,0,0,0,0|2,0,1]=4 49 B5R0.3 C([C@@H]([C-]=O)[NH3+])O SER_LSN3 [1,0,0,0,0,0|2,0,1]=4 50 B5R0.3 C([C@@H]([C-]=O)[NH3+])S CYS_LSN3 [1,0,0,0,0,0|2,0,1]=4 51 B5R0.3 C([C@@H]([C-]=O)[NH3+])[O-] SER_LSN3_DHG [1,0,0,0,0,0|2,0,1]=4 52 B5R0.3 C([C@@H]([C-]=O)[NH3+])[S-] CYS_LSN3_DHG [1,0,0,0,0,0|2,0,1]=4 53 B5R0.3 C([C@H](C=O)O)O 3GR [1,0,0,0,0,0|2,0,0]=3 54 B5R0.3 CCC(CC)N D0M [1,0,0,0,0,0|2,0,1]=4 55 B5R0.3 CC[C@H](C)CN DCI [1,0,0,0,0,0|1,0,1]=3 56 B5R0.3 CC[C@H](C)CN MBA [1,0,0,0,0,0|1,0,1]=3 57 B7R0.2 C([C@@H](C=O)N)C(=O)O ASA [0,1,0,0,0,0|2,0,1]=4 58 B7R0.2 CC(C)C[C@@H](C=O)N LCZ [0,1,0,0,0,0|1,0,0]=2 59 B7R0.2 CC(C)C[C@@H](CO)N DCL [0,1,0,0,0,0|1,0,2]=4 60 B7R0.2 CC(C)C[C@@H]([C-]=O)[NH-] LEU_LL [0,1,0,0,0,0|1,0,1]=3 61 B7R0.2 CC(C)C[C@@H]([C-]=O)[NH3+] LEU_LSN3 [0,1,0,0,0,0|1,0,1]=3 62 B7R0.3 C(C[C@@H](CO)O)CO XXD [0,1,0,0,0,0|1,0,2]=4 63 B7R0.3 CCCC[C@@H](C=O)N LYW [0,1,0,0,0,0|1,0,0]=2 64 B7R0.3 CCCC[C@@H](CO)N 2AO [0,1,0,0,0,0|1,0,2]=4 65 B7R0.3 CCCC[C@@H](CO)O 0RE [0,1,0,0,0,0|1,0,2]=4 66 B7R0.3 CCCC[C@H](CO)O 7FB [0,1,0,0,0,0|1,0,2]=4 67 B7R0.3 CSCC[C@@H]([C-]=O)[NH-] MET_LL [0,1,0,0,0,0|1,0,1]=3 68 B7R0.3 CSCC[C@@H]([C-]=O)[NH3+] MET_LSN3 [0,1,0,0,0,0|1,0,1]=3 69 B7R0.5 C#CC[C@@H](C(=O)O)N LPH [0,1,0,0,0,0|1,0,2]=4 70 B7R0.5 C(C=O)[C@H](C(=O)O)N AS2 [0,1,0,0,0,0|2,0,1]=4 71 B7R0.5 C(CN)[C@@H](C(=O)O)N DAB [0,1,0,0,0,0|2,0,0]=3 72 B7R0.5 C(CN)[C@H](C(=O)O)N 4FO [0,1,0,0,0,0|2,0,0]=3 73 B7R0.5 C(CN)[C@H](C(=O)O)O 42B [0,1,0,0,0,0|2,0,0]=3 74 B7R0.5 C(CO)C(=O)C(=O)O VGX [0,1,0,0,0,0|2,0,1]=4 75 B7R0.5 C(CO)[C@@H](C(=O)O)N HSE [0,1,0,0,0,0|2,0,0]=3 76 B7R0.5 C(CS)[C@@H](C(=O)O)N HCS [0,1,0,0,0,0|2,0,0]=3 77 B7R0.5 C(CS)[C@H](C(=O)O)N KCY [0,1,0,0,0,0|2,0,0]=3 78 B7R0.5 C([C@@H](C(=O)O)N)SO CEA [0,1,0,0,0,0|3,0,0]=4 79 B7R0.5 C([C@@H](C(=O)O)N)SO CSO [0,1,0,0,0,0|3,0,0]=4 80 B7R0.5 C([C@@H](C(=O)O)N)SS CSS [0,1,0,0,0,0|3,0,0]=4 81 B7R0.5 C([C@@H](C(=O)O)N)S[Pb+] CSB [0,1,0,0,0,0|3,0,0]=4 82 B7R0.5 C([C@@H](C(=O)O)N)S[SeH] CSZ [0,1,0,0,0,0|3,0,0]=4 83 B7R0.5 C([C@@H](C(=O)O)N)[SH]=O CSX [0,1,0,0,0,0|3,0,0]=4 84 B7R0.5 C([C@@H](C(=O)O)N)[SeH]=O UOX [0,1,0,0,0,0|3,0,0]=4 85 B7R0.5 C([C@@H](C(=O)O)N)[Se]S PSW [0,1,0,0,0,0|3,0,0]=4 86 B7R0.5 C=CC[C@@H](C(=O)O)N 2AG [0,1,0,0,0,0|1,0,2]=4 87 B7R0.5 C=CC[C@H](C(=O)O)N DYL [0,1,0,0,0,0|1,0,2]=4 88 B7R0.5 CCCC(=O)C(=O)O 69O [0,1,0,0,0,0|1,0,1]=3 89 B7R0.5 CCC[C@@H](C(=O)O)N 2PI [0,1,0,0,0,0|1,0,0]=2 90 B7R0.5 CCC[C@@H](C(=O)O)N BTA [0,1,0,0,0,0|1,0,0]=2 91 B7R0.5 CCC[C@@H](C(=O)O)N NVA [0,1,0,0,0,0|1,0,0]=2 92 B7R0.5 CCC[C@@H](C(=O)O)N RON [0,1,0,0,0,0|1,0,0]=2 93 B7R0.5 CCS[C@@H](C(=O)O)N GSC [0,1,0,0,0,0|2,0,0]=3 94 B7R0.5 COC[C@@H](C(=O)O)N 7C9 [0,1,0,0,0,0|2,0,0]=3 95 B7R0.5 CSC[C@@H](C(=O)O)N CYM [0,1,0,0,0,0|2,0,0]=3 96 B7R0.5 CSC[C@@H](C(=O)O)N SMC [0,1,0,0,0,0|2,0,0]=3 97 B7R0.5 CSC[C@H](C(=O)O)N 060 [0,1,0,0,0,0|2,0,0]=3 98 B7R0.7 CC(CCO)CCO 40S [0,1,0,0,0,0|1,0,2]=4 99 B7R0.10 CC[C@H](C)[C@@H]([C-]=O)[NH-] ILE_LL [0,1,0,0,0,0|1,0,1]=3 100 B7R0.10 CC[C@H](C)[C@@H]([C-]=O)[NH3+] ILE_LSN3 [0,1,0,0,0,0|1,0,1]=3 101 B7R1.1 C1CCN(C1)C=O FP6 [0,0,0,1,0,0|1,0,0]=2 102 B7R1.1 C1C[C@H](NC1)C#N QEJ [0,0,0,1,0,0|2,0,1]=4 103 B7R1.1 C1C[C@H](NC1)C=O PRI [0,0,0,1,0,0|1,0,0]=2 104 B7R1.1 C1C[C@H](NC1)CN P2Y [0,0,0,1,0,0|2,0,1]=4 105 B7R1.1 C1C[C@H]([N-]C1)[C-]=O PRO_LL [0,0,0,1,0,0|1,0,1]=3 106 B7R1.1 C1C[C@H]([NH2+]C1)[C-]=O PRO_LSN3 [0,0,0,1,0,0|1,0,1]=3 107 B7R1.3 C1CC=CC(=O)C1 A2Q [0,0,0,1,0,0|2,0,1]=4 108 B7R1.3 C1CCC(CC1)O CXL [0,0,0,1,0,0|2,0,1]=4 109 B7R1.3 C1CCC(CC1)[NH3+] HAI [0,0,0,1,0,0|2,0,1]=4 110 B7R1.4 C1COC(=O)[C@H]1N HSL [0,0,0,1,0,0|2,0,0]=3 111 B7R1.4 C1C[C@H]([C@H](C1)O)O 17Y [0,0,0,1,0,0|1,0,2]=4 112 B7R1.4 C1[C@H](C(=O)NO1)N 4AX [0,0,0,1,0,0|3,0,0]=4 113 B7R1.4 CN1CCCC1=O MB3 [0,0,0,1,0,0|1,0,0]=2 114 B7R1.4 CN1CCOC1=O 3MO [0,0,0,1,0,0|2,0,0]=3 115 B4R0.1 CC(=C)CN IRS [2,0,0,0,0,0|1,0,1]=4 116 B4R0.1 CC(=O)C=O PVL [2,0,0,0,0,0|1,0,1]=4 117 B4R0.1 CC(=O)CCl ATO [2,0,0,0,0,0|1,0,1]=4 118 B4R0.1 CC(=O)CN GCM [2,0,0,0,0,0|1,0,1]=4 119 B4R0.1 CC(=O)CN GLM [2,0,0,0,0,0|1,0,1]=4 120 B4R0.1 CC(=O)CO 4Y8 [2,0,0,0,0,0|1,0,1]=4 121 B4R0.1 CC(=O)NC NML [2,0,0,0,0,0|1,0,1]=4 122 B4R0.1 CC(C)C=O 5OZ [2,0,0,0,0,0|0,0,0]=2 123 B4R0.1 CC(C)CN IBN [2,0,0,0,0,0|1,0,1]=4 124 B4R0.1 CC=C(C)C 2MB [2,0,0,0,0,0|1,0,1]=4 125 B4R0.1 CCC(=O)N ROP [2,0,0,0,0,0|1,0,1]=4 126 B4R0.1 CCC(=O)O PPI [2,0,0,0,0,0|1,0,1]=4 127 B4R0.1 CC[C@H](C)O SBT [2,0,0,0,0,0|0,0,1]=3 128 B4R0.1 CC[N+](=O)[O-] NIE [2,0,0,0,0,0|2,0,0]=4 129 B4R0.1 CN(C)C=O DMF [2,0,0,0,0,0|1,0,0]=3 130 B4R0.1 C[C@@H](C=O)N 5XU [2,0,0,0,0,0|1,0,0]=3 131 B4R0.1 C[C@@H](CBr)O EBH [2,0,0,0,0,0|1,0,1]=4 132 B4R0.1 C[C@@H](CCl)Cl CP2 [2,0,0,0,0,0|2,0,0]=4 133 B4R0.1 C[C@@H](CO)N 2A1 [2,0,0,0,0,0|2,0,0]=4 134 B4R0.1 C[C@@H](CO)O PGO [2,0,0,0,0,0|1,0,1]=4 135 B4R0.1 C[C@@H](CO)O PGQ [2,0,0,0,0,0|1,0,1]=4 136 B4R0.1 C[C@@H]([C-]=O)[NH-] ALA_LL [2,0,0,0,0,0|1,0,1]=4 137 B4R0.1 C[C@@H]([C-]=O)[NH3+] ALA_LSN3 [2,0,0,0,0,0|1,0,1]=4 138 B4R0.1 C[C@H](CBr)O 1BP [2,0,0,0,0,0|1,0,1]=4 139 B4R0.1 C[C@H](CO)N 2A3 [2,0,0,0,0,0|2,0,0]=4 140 B4R0.1 C[C@H](CO)O HP3 [2,0,0,0,0,0|1,0,1]=4 141 B4R0.1 C[C@H](CO)O PGR [2,0,0,0,0,0|1,0,1]=4 142 B4R0.1 C[C@H](C[NH3+])O FOP [2,0,0,0,0,0|1,0,1]=4 143 B4R0.2 C(C=O)C=O MDD [2,0,0,0,0,0|1,0,1]=4 144 B4R0.2 C(CCl)CCl 0CL [2,0,0,0,0,0|2,0,0]=4 145 B4R0.2 C(CN)CBr 4LJ [2,0,0,0,0,0|2,0,0]=4 146 B4R0.2 C(CN)CN 13D [2,0,0,0,0,0|2,0,0]=4 147 B4R0.2 C(CN)CO 0D8 [2,0,0,0,0,0|1,0,1]=4 148 B4R0.2 C(CO)CCl 3CL [2,0,0,0,0,0|1,0,1]=4 149 B4R0.2 C(CO)CO HPG [2,0,0,0,0,0|1,0,1]=4 150 B4R0.2 C(CO)CO PDO [2,0,0,0,0,0|1,0,1]=4 151 B4R0.2 C(CS)C=O MPR [2,0,0,0,0,0|1,0,0]=3 152 B4R0.2 C(CS)CS PDT [2,0,0,0,0,0|1,1,0]=4 153 B4R0.2 C/C=C/C=O CRD [2,0,0,0,0,0|0,0,2]=4 154 B4R0.2 CCCCBr BBU [2,0,0,0,0,0|1,0,0]=3 155 B4R0.2 CCCCC LNK [2,0,0,0,0,0|0,0,0]=2 156 B4R0.2 CCCCN LYT [2,0,0,0,0,0|1,0,0]=3 157 B4R0.2 CCCCO 1BO [2,0,0,0,0,0|0,0,1]=3 158 B4R0.2 CCC[N+]#[C-] NPN [2,0,0,0,0,0|1,0,1]=4 159 B4R0.2 CCOC=O ETO [2,0,0,0,0,0|1,0,0]=3 160 B4R0.2 CCOCC ETZ [2,0,0,0,0,0|1,0,0]=3 161 B4R0.2 CCOC[O-] EOM [2,0,0,0,0,0|1,0,1]=4 162 B4R0.2 COCCO MXE [2,0,0,0,0,0|1,0,1]=4 163 B4R0.2 COCC[O-] MOE [2,0,0,0,0,0|1,0,1]=4 164 B6R0.2 CC(=O)CC(=O)C P2D [1,1,0,0,0,0|0,0,2]=4 165 B6R0.2 CC(C)CC(=O)O IVA [1,1,0,0,0,0|1,0,1]=4 166 B6R0.2 CC(C)C[C@@H](C)N 2LU [1,1,0,0,0,0|0,0,1]=3 167 B6R0.2 C[C@@H](CC(=O)O)N B3A [1,1,0,0,0,0|1,0,1]=4 168 B6R0.2 C[C@@H](CC(=O)O)O 3HL [1,1,0,0,0,0|1,0,1]=4 169 B6R0.2 C[C@H](CC(=O)O)O 3HR [1,1,0,0,0,0|1,0,1]=4 170 B6R0.3 CC(=O)[C@H](CO)O DE2 [1,1,0,0,0,0|1,0,1]=4 171 B6R0.3 CC(C)[C@@H](CO)N VOL [1,1,0,0,0,0|1,0,1]=4 172 B6R0.3 CCC(C(=O)O)N AA3 [1,1,0,0,0,0|1,0,1]=4 173 B6R0.3 CC[C@@H](C(=O)O)Cl 39J [1,1,0,0,0,0|1,0,1]=4 174 B6R0.3 CC[C@@H](C(=O)O)N AB7 [1,1,0,0,0,0|1,0,1]=4 175 B6R0.3 CC[C@@H](C(=O)O)N ABA [1,1,0,0,0,0|1,0,1]=4 176 B6R0.3 CC[C@@H](C(=O)O)N UNK [1,1,0,0,0,0|1,0,1]=4 177 B6R0.3 CC[C@H](C(=O)O)N DBB [1,1,0,0,0,0|1,0,1]=4 178 B6R0.3 CC[C@H](C)C(=O)O SMB [1,1,0,0,0,0|1,0,1]=4 179 B6R0.3 CC[C@H](C)[N+](=O)[O-] NBT [1,1,0,0,0,0|2,0,0]=4 180 B6R0.3 C[C@H]([C@@H](CO)N)O THO [1,1,0,0,0,0|1,0,1]=4 181 B6R0.3 C[C@H]([C@@H](CS)N)O B27 [1,1,0,0,0,0|1,0,1]=4 182 B6R0.4 C(CC(=O)O)CBr 0A5 [1,1,0,0,0,0|1,0,1]=4 183 B6R0.4 C(CC(=O)O)CN ABU [1,1,0,0,0,0|1,0,1]=4 184 B6R0.4 CC(C)CCC=O MOP [1,1,0,0,0,0|0,0,2]=4 185 B6R0.4 CCCCC(=O)O LEA [1,1,0,0,0,0|1,0,1]=4 186 B6R0.4 CCCCC(=O)O PEI [1,1,0,0,0,0|1,0,1]=4 187 B6R0.4 CCCOC(=O)C 4PA [1,1,0,0,0,0|0,0,1]=3 188 B6R0.4 CCNCC(=O)O 2JC [1,1,0,0,0,0|1,0,1]=4 189 B6R0.4 CN(C)CCCN DIB [1,1,0,0,0,0|1,0,1]=4 190 B6R0.5 CC(C)(C)CCN 2G3 [1,1,0,0,0,0|1,0,1]=4 191 B6R0.5 CC(C)(C)CCO 33D [1,1,0,0,0,0|1,0,1]=4 192 B6R0.5 CCO[P@](=O)(C)O VX [1,1,0,0,0,0|2,0,0]=4 193 B6R0.6 C(CC=N)CC=O ARN [1,1,0,0,0,0|0,0,1]=3 194 B6R0.6 C(CC=O)CC=O PTD [1,1,0,0,0,0|0,0,1]=3 195 B6R0.6 C(CCN)CCN N2P [1,1,0,0,0,0|1,0,1]=4 196 B6R0.6 C(CCNN)CN 01H [1,1,0,0,0,0|2,0,0]=4 197 B6R0.6 C(CCO)CC=O GAQ [1,1,0,0,0,0|0,0,0]=2 198 B6R0.6 C(COCC=O)O 1KA [1,1,0,0,0,0|1,0,0]=3 199 B6R0.6 CCCCCCC HP6 [1,1,0,0,0,0|1,0,1]=4 200 B6R0.6 CCCCCCO HE2 [1,1,0,0,0,0|0,0,2]=4 201 B6R0.6 CCCCNC=O YIV [1,1,0,0,0,0|0,0,0]=2 202 B6R0.6 CCCSCCO 266 [1,1,0,0,0,0|0,0,2]=4 203 B8R0.2 C([C@@H]([C@H](C(=O)O)O)O)O LTH [0,2,0,0,0,0|2,0,0]=4 204 B8R0.2 C([C@H]([C@@H](C(=O)O)N)O)Cl CTH [0,2,0,0,0,0|2,0,0]=4 205 B8R0.2 C([C@H]([C@@H](C(=O)O)N)O)O TH6 [0,2,0,0,0,0|2,0,0]=4 206 B8R0.2 C([C@H]([C@@H](C(=O)[O-])O)O)O THE [0,2,0,0,0,0|2,0,0]=4 207 B8R0.2 C([C@H]([C@H](C(=O)O)O)O)N PRW [0,2,0,0,0,0|2,0,0]=4 208 B8R0.2 C([C@H]([C@H](C(=O)O)O)O)O EAX [0,2,0,0,0,0|2,0,0]=4 209 B8R0.2 CC([C@H](C(=O)O)N)OC XDT [0,2,0,0,0,0|2,0,0]=4 210 B8R0.2 CC([C@H](C(=O)O)N)SC 1ME [0,2,0,0,0,0|2,0,0]=4 211 B8R0.2 CC[C@@H](C)[C@@H](C(=O)O)N IIL [0,2,0,0,0,0|1,0,0]=3 212 B8R0.2 CC[C@@H](C)[C@H](C(=O)O)N DIL [0,2,0,0,0,0|1,0,0]=3 213 B8R0.2 CC[C@H](C)C(=O)C(=O)O 1QQ [0,2,0,0,0,0|1,0,1]=4 214 B8R0.2 CC[C@H](C)[C@@H](C(=O)O)N ILE [0,2,0,0,0,0|1,0,0]=3 215 B8R0.2 CC[C@H](C)[C@@H](C(=O)O)N ILE_LFOH [0,2,0,0,0,0|1,0,0]=3 216 B8R0.2 CC[C@H](C)[C@@H](C(=O)O)O OIL [0,2,0,0,0,0|1,0,0]=3 217 B8R0.2 CC[C@H](C)[C@@H](C(=O)O)[NH-] ILE_LEO2H [0,2,0,0,0,0|1,0,0]=3 218 B8R0.2 CC[C@H](C)[C@@H](C(=O)[O-])[NH-] ILE_LEO2 [0,2,0,0,0,0|1,0,0]=3 219 B8R0.2 CC[C@H](C)[C@@H](C(=O)[O-])[NH3+] ILE_LFZW [0,2,0,0,0,0|1,0,0]=3 220 B8R0.2 CC[C@H](C)[C@H](C(=O)O)N 28J [0,2,0,0,0,0|1,0,0]=3 221 B8R0.2 CC[C@H]([C@@H](C(=O)O)N)O VAH [0,2,0,0,0,0|1,0,0]=3 222 B8R0.2 C[C@H](C=O)[C@@H](C(=O)O)N LVN [0,2,0,0,0,0|1,0,1]=4 223 B8R0.2 C[C@H]([C@@H](C(=O)O)N)OC OLT [0,2,0,0,0,0|2,0,0]=4 224 B8R0.2 C[C@H]([C@H](C=O)O)C(O)O OPL [0,2,0,0,0,0|2,0,0]=4 225 B8R0.23 C([C@@H](C(=O)O)N)C(F)F OBF [0,2,0,0,0,0|2,0,0]=4 226 B8R0.23 C([C@@H](C(=O)O)N)C(O)O UN2 [0,2,0,0,0,0|2,0,0]=4 227 B8R0.23 CC(C)CC(=O)C(=O)O COI [0,2,0,0,0,0|1,0,1]=4 228 B8R0.23 CC(C)CC(C(=O)O)Cl HRI [0,2,0,0,0,0|1,0,0]=3 229 B8R0.23 CC(C)C[C@@H](C(=O)C)N LEM [0,2,0,0,0,0|1,0,0]=3 230 B8R0.23 CC(C)C[C@@H](C(=O)N)N CLE [0,2,0,0,0,0|1,0,0]=3 231 B8R0.23 CC(C)C[C@@H](C(=O)N)N NLW [0,2,0,0,0,0|1,0,0]=3 232 B8R0.23 CC(C)C[C@@H](C(=O)O)Cl 03H [0,2,0,0,0,0|1,0,0]=3 233 B8R0.23 CC(C)C[C@@H](C(=O)O)N LEU [0,2,0,0,0,0|1,0,0]=3 234 B8R0.23 CC(C)C[C@@H](C(=O)O)N LEU_LFOH [0,2,0,0,0,0|1,0,0]=3 235 B8R0.23 CC(C)C[C@@H](C(=O)O)O 1LU [0,2,0,0,0,0|1,0,0]=3 236 B8R0.23 CC(C)C[C@@H](C(=O)O)O OLE [0,2,0,0,0,0|1,0,0]=3 237 B8R0.23 CC(C)C[C@@H](C(=O)O)[NH-] LEU_LEO2H [0,2,0,0,0,0|1,0,0]=3 238 B8R0.23 CC(C)C[C@@H](C(=O)[O-])[NH-] LEU_LEO2 [0,2,0,0,0,0|1,0,0]=3 239 B8R0.23 CC(C)C[C@@H](C(=O)[O-])[NH3+] LEU_LFZW [0,2,0,0,0,0|1,0,0]=3 240 B8R0.23 CC(C)C[C@H](C(=O)O)N DLE [0,2,0,0,0,0|1,0,0]=3 241 B8R0.23 CC(C)C[C@H](C(=O)O)O 2RH [0,2,0,0,0,0|1,0,0]=3 242 B8R0.23 CC(CC(=O)O)C(=O)O JO3 [0,2,0,0,0,0|1,0,1]=4 243 B8R0.23 C[C@@H](C(=O)O)NC(=O)C AYA [0,2,0,0,0,0|1,0,1]=4 244 B8R0.23 C[C@@H](CC(=O)O)C(=O)O SUH [0,2,0,0,0,0|1,0,1]=4 245 B8R0.23 C[C@@H](CC(C)C)C(=O)O 7GA [0,2,0,0,0,0|0,0,0]=2 246 B8R0.34 C[C@@H](C[C@@](C)(CO)O)O MQD [0,2,0,0,0,0|0,0,2]=4 247 B8R0.6 C(CCN)C[C@@H]([C-]=O)[NH-] LYS_LL_DHZ3 [0,2,0,0,0,0|1,0,1]=4 248 B8R0.6 C(CCN)C[C@@H]([C-]=O)[NH3+] LYS_LSN3_DHZ3 [0,2,0,0,0,0|1,0,1]=4 249 B8R0.6 C(CC[NH3+])C[C@@H]([C-]=O)[NH-] LYS_LL [0,2,0,0,0,0|1,0,1]=4 250 B8R0.6 C(CC[NH3+])C[C@@H]([C-]=O)[NH3+] LYS_LSN3 [0,2,0,0,0,0|1,0,1]=4 251 B8R0.6 CCCCC[C@@H](C=C)O 3OM [0,2,0,0,0,0|2,0,0]=4 252 B8R0.6 CCCCC[C@H](C=C)O 3OL [0,2,0,0,0,0|2,0,0]=4 253 B8R0.8 C#CCC[C@@H](C(=O)O)N IZO [0,2,0,0,0,0|1,0,1]=4 254 B8R0.8 C(CON)[C@@H](C(=O)O)N CAN [0,2,0,0,0,0|2,0,0]=4 255 B8R0.8 C(C[C@@H](C(=O)O)N)CN ORN [0,2,0,0,0,0|1,0,0]=3 256 B8R0.8 C(C[C@@H](C(=O)O)N)CO AA4 [0,2,0,0,0,0|1,0,0]=3 257 B8R0.8 C(C[C@@H](C(=O)O)N)CO DHN [0,2,0,0,0,0|1,0,0]=3 258 B8R0.8 C(C[C@@H](C(=O)O)[NH3+])C=O ILG [0,2,0,0,0,0|1,0,1]=4 259 B8R0.8 C(C[C@H](C(=O)O)N)CN ORD [0,2,0,0,0,0|1,0,0]=3 260 B8R0.8 C([C@@H](C(=O)O)N)SCO M0H [0,2,0,0,0,0|2,0,0]=4 261 B8R0.8 CCCC[C@@H](C(=O)N)N NLN [0,2,0,0,0,0|1,0,0]=3 262 B8R0.8 CCCC[C@@H](C(=O)O)N NLE [0,2,0,0,0,0|1,0,0]=3 263 B8R0.8 CCCC[C@H](C(=O)N)O HYH [0,2,0,0,0,0|1,0,0]=3 264 B8R0.8 CCCC[C@H](C(=O)O)N DNE [0,2,0,0,0,0|1,0,0]=3 265 B8R0.8 CCSC[C@@H](C(=O)O)N ECX [0,2,0,0,0,0|1,0,0]=3 266 B8R0.8 CSCCC(=O)C(=O)O KMT [0,2,0,0,0,0|1,0,1]=4 267 B8R0.8 CSCC[C@@H](C(=O)O)N MET [0,2,0,0,0,0|1,0,0]=3 268 B8R0.8 CSCC[C@@H](C(=O)O)N MET_LFOH [0,2,0,0,0,0|1,0,0]=3 269 B8R0.8 CSCC[C@@H](C(=O)O)[NH-] MET_LEO2H [0,2,0,0,0,0|1,0,0]=3 270 B8R0.8 CSCC[C@@H](C(=O)[O-])[NH-] MET_LEO2 [0,2,0,0,0,0|1,0,0]=3 271 B8R0.8 CSCC[C@@H](C(=O)[O-])[NH3+] MET_LFZW [0,2,0,0,0,0|1,0,0]=3 272 B8R0.8 CSCC[C@H](C(=O)O)N MED [0,2,0,0,0,0|1,0,0]=3 273 B8R0.8 CSCC[C@H](N)[P@H](=O)O MPJ [0,2,0,0,0,0|2,0,0]=4 274 B8R0.8 CSSC[C@@H](C(=O)O)N SCH [0,2,0,0,0,0|2,0,0]=4 275 B8R0.8 C[Hg]SC[C@@H](C(=O)O)N CMH [0,2,0,0,0,0|2,0,0]=4 276 B8R0.8 C[Se]CC[C@@H](C(=O)O)N MSE [0,2,0,0,0,0|1,0,0]=3 277 B8R0.8 C[Se]SC[C@@H](C(=O)O)N CSK [0,2,0,0,0,0|2,0,0]=4 278 B8R0.8 N=C(/CCSC)\C(=O)O 0XD [0,2,0,0,0,0|1,0,1]=4 279 B8R0.9 C(CC(=O)O)C(C=O)N GLQ [0,2,0,0,0,0|1,0,1]=4 280 B8R0.11 CCCC[C@H](CC)CO 2EH [0,2,0,0,0,0|0,0,2]=4 281 B8R0.15 CN[C@@H](CSC)C(=O)O N2C [0,2,0,0,0,0|1,0,0]=3 282 B6R1.2 C1CC(=O)NC1 BAQ [1,0,0,1,0,0|1,0,1]=4 283 B6R1.2 C1CC(=O)OC1 GBL [1,0,0,1,0,0|1,0,1]=4 284 B6R1.2 C1CCC(=O)C1 MFW [1,0,0,1,0,0|0,0,1]=3 285 B6R1.2 C1CCC(C1)N 1CB [1,0,0,1,0,0|1,0,0]=3 286 B6R1.2 C1CCC(C1)O YEG [1,0,0,1,0,0|0,0,1]=3 287 B6R1.2 C1CNC[C@@H]1N 04S [1,0,0,1,0,0|2,0,0]=4 288 B6R1.2 C1CNC[C@H]1O 6SP [1,0,0,1,0,0|1,0,1]=4 289 B6R1.3 COCC1CC1 09U [1,0,0,1,0,0|1,0,1]=4 290 B6R1.1 C1CCCCC1 CHX [1,0,0,1,0,0|1,0,1]=4 291 B6R1.1 C1CCNCC1 PIP [1,0,0,1,0,0|1,0,1]=4 292 B6R1.1 C1CCOCC1 PYE [1,0,0,1,0,0|0,0,2]=4 293 B8R1.1 C1CC(=O)N[C@@H]1C=O CGN [0,1,0,1,0,0|1,0,1]=4 294 B8R1.4 C[C@H]1CCNC(=C1)N 284 [0,1,0,1,0,0|2,0,0]=4 295 B8R1.40 C[C@@H](CC1CC1)C=O CPP [0,1,0,1,0,0|0,0,0]=2 296 B8R1.2 C1CCC(CC1)C[NH3+] AMC [0,1,0,1,0,0|1,0,1]=4 297 B8R1.2 C1CCN(CC1)C=O FPI [0,1,0,1,0,0|1,0,0]=3 298 B8R1.2 C1CN(CCN1)C=O 1FP [0,1,0,1,0,0|1,0,0]=3 299 B8R1.2 CCC1CCNCC1 EPI [0,1,0,1,0,0|1,0,1]=4 300 B8R1.2 CC[C@H]1CCCCN1 2EP [0,1,0,1,0,0|1,0,1]=4 301 B8R1.2 [C-]#[N+]C1CCCCC1 CYI [0,1,0,1,0,0|2,0,0]=4 302 B8R1.3 CC1CCC(CC1)N 2MH [0,1,0,1,0,0|1,0,1]=4 303 B8R1.3 CC1CCC(CC1)N 4JU [0,1,0,1,0,0|1,0,1]=4 304 B8R1.5 C1CCC(=O)C(=O)C1 CXO [0,1,0,1,0,0|1,0,1]=4 305 B8R1.5 C1C[C@@H](C(=O)NC1)O XDL [0,1,0,1,0,0|1,0,0]=3 306 B8R1.5 C[C@H]1CCCC[C@@H]1O 4DX [0,1,0,1,0,0|0,0,2]=4 307 B8R1.50 CN1C(=O)CCC1=O LCY [0,1,0,1,0,0|1,0,1]=4 308 B8R1.7 C1CC(=[NH+]C1)C(=O)[O-] 2PC [0,1,0,1,0,0|1,0,1]=4 309 B8R1.7 C1CCC(C1)C(=O)O IQ0 [0,1,0,1,0,0|0,0,0]=2 310 B8R1.7 C1C[C@@H](NC1)C(=O)N PR9 [0,1,0,1,0,0|1,0,0]=3 311 B8R1.7 C1C[C@@H](NC1)C(=O)O DPR [0,1,0,1,0,0|1,0,0]=3 312 B8R1.7 C1C[C@H](C=C1)C(=O)O C54 [0,1,0,1,0,0|0,0,2]=4 313 B8R1.7 C1C[C@H](NC1)C(=O)N LPD [0,1,0,1,0,0|1,0,0]=3 314 B8R1.7 C1C[C@H](NC1)C(=O)O PRO [0,1,0,1,0,0|1,0,0]=3 315 B8R1.7 C1C[C@H](NC1)C(=O)O PRO_LFOH [0,1,0,1,0,0|1,0,0]=3 316 B8R1.7 C1C[C@H](OC1)C(=O)O TFB [0,1,0,1,0,0|1,0,0]=3 317 B8R1.7 C1C[C@H]([N-]C1)C(=O)O PRO_LEO2H [0,1,0,1,0,0|1,0,0]=3 318 B8R1.7 C1C[C@H]([N-]C1)C(=O)[O-] PRO_LEO2 [0,1,0,1,0,0|1,0,0]=3 319 B8R1.7 C1C[C@H]([NH2+]C1)C(=O)[O-] PRO_LFZW [0,1,0,1,0,0|1,0,0]=3 320 B8R1.7 C1[C@H](NCS1)C(=O)O PRS [0,1,0,1,0,0|2,0,0]=4 321 B8R1.7 N=C(/C1CCCC1)\N 273 [0,1,0,1,0,0|1,0,0]=3 322 B8R1.7 N=C(\[C@@H]1CCCN1)/O 04V [0,1,0,1,0,0|1,0,1]=4 323 B8R1.78 C1CC(C1)(C(=O)O)N 192 [0,1,0,1,0,0|1,0,0]=3 324 B8R1.11 C1CC(=O)C(=C1)CO 3RN [0,1,0,1,0,0|0,0,2]=4