1 9TS (2e)-pent-2-enoic acid 1.000 2 54L Pent-4-ynoic acid 1.000 3 DK9 Pentane-1,1-diol 1.000 4 LEA Pentanoic acid 1.000 5 0W6 (4s)-4-aminopentanoic acid 0.875 6 2AG (2s)-2-aminopent-4-enoic acid 0.875 7 4MV 4-methyl valeric acid 0.875 8 69O 2-oxopentanoic acid 0.875 9 6NA Hexanoic acid 0.875 10 DAV Delta-amino valeric acid 0.875 11 DKF Hexane-1,1-diol 0.875 12 DYL (2r)-2-aminopent-4-enoic acid 0.875 13 EE0 (2~{R})-2-azanylpentanoic acid 0.875 14 F9D (2r)-2-aminopent-4-ynoic acid 0.875 15 FBE (3e)-5-aminopent-3-enoic acid 0.875 16 KFB 5-aminovaleric acid 0.875 17 LPH L-propargylglycine 0.875 18 NVA Norvaline 0.875 19 OXP 2-oxo-3-pentenoic acid 0.875 20 QT8 3-oxidanylidenepentanoic acid 0.875 21 SHF Laevulinic acid 0.875 22 SHO 5-hydroxylaevulinic acid 0.875 23 SJ3 (4r)-4-hydroxypentanoic acid 0.875 24 UE3 (2r)-2-oxidanylpentanoic acid 0.875 25 BEO Butenoic acid 0.857 26 BUA Butanoic acid 0.857 27 PE9 Pentan-1-ol 0.857 28 PTL Pentanal 0.857 29 03H (2s)-2-chloro-4-methylpentanoic acid 0.778 30 1LU (2s)-2-hydroxy-4-methyl-pentanoic acid 0.778 31 1QQ (3s)-3-methyl-2-oxopentanoic acid 0.778 32 1VR (3r)-3-amino-4-methylpentanoic acid 0.778 33 28J D-alloisoleucine 0.778 34 2DO (2s)-2-aminohexane-1,1-diol 0.778 35 2RH (2r)-2-hydroxy-4-methylpentanoic acid 0.778 36 4AT 5-oxohexanoic acid 0.778 37 6Y5 5-fluoranyl-2-oxidanylidene-pentanoic acid 0.778 38 7DH (3e)-5-hydroxy-2-oxopent-3-enoic acid 0.778 39 7GA 2,4-dimethylpentanal 0.778 40 7N5 2-ketohexanoic acid 0.778 41 7N6 (2r)-2-hydroxyhexanoic acid 0.778 42 98J 5-hydroxy-3-oxopentanoic acid 0.778 43 A1AUG 5-oxo-L-norvaline 0.778 44 A1EAJ (~{z},2~{S})-2-azanyl-3-methyl-pent-3-enoic acid 0.778 45 A1L3J (2~{R},3~{R})-3-methyl-2-oxidanyl-pentanoic acid 0.778 46 A1L7N N-methyl-L-norvaline 0.778 47 A8E (2s)-2-amino-4-bromopent-4-enoic acid 0.778 48 AA4 2-amino-5-hydroxypentanoic acid 0.778 49 ACA 6-aminohexanoic acid 0.778 50 B3T 3-amino-2,3,5-trideoxy-D-threo-pentonic acid 0.778 51 COI 2-oxo-4-methylpentanoic acid 0.778 52 DIL D-isoleucine 0.778 53 DKL Heptane-1,1-diol 0.778 54 DLE D-leucine 0.778 55 DNE D-norleucine 0.778 56 DO4 2,5-dioxopentanoic acid 0.778 57 EO2 4,5-dehydro-L-leucine 0.778 58 F7V (2s,4e)-2-aminohex-4-enoic acid 0.778 59 FVT 5-azanyl-4-oxidanylidene-pentanoic acid 0.778 60 G9A (2e)-pent-2-enedioic acid 0.778 61 GAU (4s)-4-amino-5-hydroxypentanoic acid 0.778 62 GEG (4e)-4-aminohex-4-enoic acid 0.778 63 GUA Glutaric acid 0.778 64 HKV 4,5-dioxopentanoic acid 0.778 65 HOZ (4s)-4,5-diaminopentanoic acid 0.778 66 HRI Alpha-chloroisocaproic acid 0.778 67 IIL Iso-isoleucine 0.778 68 IL0 (2s,3s)-2-amino-3-methylpentane-1,1-diol 0.778 69 ILE Isoleucine 0.778 70 IZO (2s)-2-aminohex-5-ynoic acid 0.778 71 LAF 5-fluorolevulinic acid 0.778 72 LEU Leucine 0.778 73 NLE Norleucine 0.778 74 OIL (2s,3s)-2-hydroxy-3-methylpentanoic acid 0.778 75 ORD D-ornithine 0.778 76 ORN L-ornithine 0.778 77 QMB 5-mercapto-norvaline 0.778 78 R0M (2e,4e)-hepta-2,4-dienoic acid 0.778 79 RX9 Dehydroisoleucine 0.778 80 SHV Heptanoic acid 0.778 81 SZR (2r)-4-cyano-2-hydroxybutanoic acid 0.778 82 T79 (2s)-2-azanylhex-4-ynoic acid 0.778 83 TQ9 5-chloro-4-oxopentanoic acid 0.778 84 UEI (2r,3s)-3-methyl-2-oxidanyl-pentanoic acid 0.778 85 VAH (3r)-3-hydroxy-L-norvaline 0.778 86 VIG 4-amino hexanoic acid 0.778 87 1SP (2s)-pentane-1,2-diol 0.750 88 2KT 2-ketobutyric acid 0.750 89 39J (2s)-2-chlorobutanoic acid 0.750 90 3HL (3s)-3-hydroxybutanoic acid 0.750 91 3HR (3r)-3-hydroxybutanoic acid 0.750 92 9JE Pentane-1,5-diol 0.750 93 A3B D-vinylglycine 0.750 94 AAE Acetoacetic acid 0.750 95 ABA Alpha-aminobutyric acid 0.750 96 ABU Gamma-amino-butanoic acid 0.750 97 ARN 1-imino-5-pentanone 0.750 98 B3A (3s)-3-aminobutanoic acid 0.750 99 DBB D-alpha-aminobutyric acid 0.750 100 DBU (2z)-2-aminobut-2-enoic acid 0.750 101 GAQ 5-hydroxypentanal 0.750 102 H00 4-sulfanylbutanoic acid 0.750 103 HE2 Hexan-1-ol 0.750 104 IVA Isovaleric acid 0.750 105 LPG (2s)-2-aminobut-3-ynoic acid 0.750 106 LVG L-vinylglycine 0.750 107 MB8 (2z)-2-methylbut-2-enoic acid 0.750 108 O8Y Hexanal 0.750 109 PTD Pentanedial 0.750 110 SMB 2-methylbutanoic acid 0.750 111 SSN 4-oxobutanoic acid 0.750 112 UCU (2r)-2-oxidanylbutanoic acid 0.750 113 WHX 5-aminopentan-1-ol 0.750 114 YWF Gamma-aminobutenoic acid 0.750 115 1BO 1-butanol 0.714 116 9A4 (2z)-but-2-en-1-ol 0.714 117 9A7 (2e)-but-2-en-1-ol 0.714 118 A1BXY Prop-2-ynoic acid 0.714 119 AKR Acrylic acid 0.714 120 CRD (2e)-but-2-enal 0.714 121 DK6 Propane-1,1-diol 0.714 122 LNK Pentane 0.714 123 PPI Propanoic acid 0.714 124 011 7-aminoheptanoic acid 0.700 125 0E5 (2s,3r)-2-azanyl-3-methyl-3-oxidanyl-pentanoic acid 0.700 126 0JT (4r)-4-amino-5-methylhexanoic acid 0.700 127 0JY 4-methyl-L-leucine 0.700 128 0L1 Hexanedioic acid 0.700 129 19W 5-(aminooxy)-L-norvaline 0.700 130 1CO (3s)-3-hydroxy-3-methyl-5-sulfanylpentanoic acid 0.700 131 28H (2r,3r)-3-hydroxy-2,4-dimethylpentanoic acid 0.700 132 2HG (2r)-2-hydroxypentanedioic acid 0.700 133 2IT (2z)-2-iminopentanedioic acid 0.700 134 2JN 2-methyl-D-norleucine 0.700 135 2K3 3-oxo-5-methylhexanoic acid 0.700 136 2ML 2-methylleucine 0.700 137 2PP 2-propyl-pentanoic acid 0.700 138 2VS (2z,4e)-2-hydroxy-6-oxohexa-2,4-dienoic acid 0.700 139 2XP (2z,4z)-2-imino-6-oxohex-4-enoic acid 0.700 140 39Y (2e,5s)-5-methylhept-2-enoic acid 0.700 141 3HG 3-hydroxypentanedioic acid 0.700 142 4L8 (2r)-2-(aminomethyl)-4-methylpentanoic acid 0.700 143 6F5 6-methylheptanoic acid 0.700 144 6JN 3-oxopentanedioic acid 0.700 145 6OA (2z,4e)-2,6-dihydroxyhexa-2,4-dienoic acid 0.700 146 6OD (2e,4e)-2-amino-6-oxohexa-2,4-dienoic acid 0.700 147 6OH (2e,4e)-2-hydroxy-6-oxohexa-2,4-dienoic acid 0.700 148 6UN (3~{E},5~{E})-6-oxidanyl-2-oxidanylidene-hexa-3,5-dienoic acid 0.700 149 7C3 6-azanyl-2-oxidanylidene-hexanoic acid 0.700 150 81R (4r)-4,5-disulfanyl-L-norvaline 0.700 151 81S (4s)-4,5-disulfanyl-L-norvaline 0.700 152 8EW 3-methylpent-2-enedioic acid 0.700 153 9KK N-methyl norleucine 0.700 154 9ON (2~{S})-2-methylpentanedioic acid 0.700 155 A1ADO (4r)-5-fluoro-L-leucine 0.700 156 A1AFY (R)-mevaldehyde 0.700 157 A1AMC (2s)-2-(methylamino)pentane-1,1,5-triol 0.700 158 AHP 2-amino-heptanoic acid 0.700 159 AKG 2-oxoglutaric acid 0.700 160 B3D 3-aminopentanedioic acid 0.700 161 B3L (3s)-3-amino-5-methylhexanoic acid 0.700 162 B3M (3r)-3-amino-5-(methylsulfanyl)pentanoic acid 0.700 163 B3X (3s)-3,5-diamino-5-oxopentanoic acid 0.700 164 BIL (3r,4s)-3-amino-4-methylhexanoic acid 0.700 165 BKA 3-oxoheptanoic acid 0.700 166 CCU (2z,4z)-hexa-2,4-dienedioic acid 0.700 167 DDO 6-hydroxy-D-norleucine 0.700 168 DGL D-glutamic acid 0.700 169 DGN D-glutamine 0.700 170 DKO Octane-1,1-diol 0.700 171 DLY D-lysine 0.700 172 DMV 2,3-dihydroxy-valerianic acid 0.700 173 DNM N-methyl-D-norleucine 0.700 174 E5N (2~{R})-2-methylpentanedioic acid 0.700 175 FGA Gamma-D-glutamic acid 0.700 176 GGL Gamma-L-glutamic acid 0.700 177 GLJ 5,5-dihydroxy-L-norvaline 0.700 178 GLK (4s)-4-amino-5,5-dihydroxypentanoic acid 0.700 179 GLN Glutamine 0.700 180 GLU Glutamic acid 0.700 181 GMA 4-amido-4-carbamoyl-butyric acid 0.700 182 GXP (4s)-4-hydroxy-2,5-dioxopentanoic acid 0.700 183 GXS (4r)-4-hydroxy-2,5-dioxopentanoic acid 0.700 184 HL2 (2s,3r)-2-amino-3-hydroxy-4-methylpentanoic acid 0.700 185 HL5 (2s,4r)-5-hydroxyleucine 0.700 186 HLU Beta-hydroxyleucine 0.700 187 HLX 5-methyl-L-norleucine 0.700 188 I2M 3-methyl-L-alloisoleucine 0.700 189 IC0 Fmoc-(S)-2-(4-pentenyl)-glycine 0.700 190 IML N-methyl-isoleucine 0.700 191 KAH 5-amino-4-hydroxyhexanoic acid 0.700 192 KBE Beta-lysine 0.700 193 KJW (D)3-hydroxy-leucine 0.700 194 KMH (5s)-5-amino-3-oxo-hexanoic acid 0.700 195 KW4 5-methyl-D-norleucine 0.700 196 LDO 6-hydroxy-L-norleucine 0.700 197 LED (4r)-5-oxo-L-leucine 0.700 198 LEF (4s)-5-fluoro-L-leucine 0.700 199 LYH 3,4 ene-lysine 0.700 200 LYK (2s)-2,6-diaminohexane-1,1-diol 0.700 201 LYS Lysine 0.700 202 MD0 5-amino-D-isoleucine 0.700 203 MEV (R)-mevalonate 0.700 204 MK8 2-methyl-L-norleucine 0.700 205 MKE (4s)-4-amino-5-oxohexanoic acid 0.700 206 MLE N-methylleucine 0.700 207 MLU N-methyl-D-leucine 0.700 208 OCA Octanoic acid (caprylic acid) 0.700 209 ONH N~5~-hydroxy-L-ornithine 0.700 210 ONL 5-oxo-L-norleucine 0.700 211 OTT (2e,4e,6e)-octa-2,4,6-trienoic acid 0.700 212 QM8 6-sulfanyl-L-norleucine 0.700 213 RE6 (5r)-5-methylheptanoic acid 0.700 214 S2G (2s)-2-hydroxypentanedioic acid 0.700 215 SKG 4-methylisoleucine 0.700 216 SKJ Beta-methylnorleucine 0.700 217 T2X (2r)-2-hydroxy-5-methylhexanoic acid 0.700 218 V1V (2s,3s)-3-amino-2-hydroxyhexanoic acid 0.700 219 WZJ N-methyl-L-alloisoleucine 0.700 220 X60 2-ethyl-L-norvaline 0.700 221 X6E 2-ethyl-D-norvaline 0.700 222 XFW (2s)-2,5,5-tris(azanyl)pentanoic acid 0.700 223 Y1V (4r)-5-amino-L-leucine 0.700 224 ZGL D-alpha-glutamine 0.700