1 6NA Hexanoic acid 1.000 2 DKF Hexane-1,1-diol 1.000 3 2DO (2s)-2-aminohexane-1,1-diol 0.889 4 4AT 5-oxohexanoic acid 0.889 5 7N5 2-ketohexanoic acid 0.889 6 7N6 (2r)-2-hydroxyhexanoic acid 0.889 7 ACA 6-aminohexanoic acid 0.889 8 DKL Heptane-1,1-diol 0.889 9 DNE D-norleucine 0.889 10 F7V (2s,4e)-2-aminohex-4-enoic acid 0.889 11 GEG (4e)-4-aminohex-4-enoic acid 0.889 12 IZO (2s)-2-aminohex-5-ynoic acid 0.889 13 NLE Norleucine 0.889 14 R0M (2e,4e)-hepta-2,4-dienoic acid 0.889 15 SHV Heptanoic acid 0.889 16 T79 (2s)-2-azanylhex-4-ynoic acid 0.889 17 VIG 4-amino hexanoic acid 0.889 18 54L Pent-4-ynoic acid 0.875 19 9TS (2e)-pent-2-enoic acid 0.875 20 DK9 Pentane-1,1-diol 0.875 21 HE2 Hexan-1-ol 0.875 22 LEA Pentanoic acid 0.875 23 O8Y Hexanal 0.875 24 011 7-aminoheptanoic acid 0.800 25 0JT (4r)-4-amino-5-methylhexanoic acid 0.800 26 0L1 Hexanedioic acid 0.800 27 2JN 2-methyl-D-norleucine 0.800 28 2K3 3-oxo-5-methylhexanoic acid 0.800 29 2VS (2z,4e)-2-hydroxy-6-oxohexa-2,4-dienoic acid 0.800 30 2XP (2z,4z)-2-imino-6-oxohex-4-enoic acid 0.800 31 39Y (2e,5s)-5-methylhept-2-enoic acid 0.800 32 6F5 6-methylheptanoic acid 0.800 33 6OA (2z,4e)-2,6-dihydroxyhexa-2,4-dienoic acid 0.800 34 6OD (2e,4e)-2-amino-6-oxohexa-2,4-dienoic acid 0.800 35 6OH (2e,4e)-2-hydroxy-6-oxohexa-2,4-dienoic acid 0.800 36 6UN (3~{E},5~{E})-6-oxidanyl-2-oxidanylidene-hexa-3,5-dienoic acid 0.800 37 7C3 6-azanyl-2-oxidanylidene-hexanoic acid 0.800 38 9KK N-methyl norleucine 0.800 39 AHP 2-amino-heptanoic acid 0.800 40 B3L (3s)-3-amino-5-methylhexanoic acid 0.800 41 BIL (3r,4s)-3-amino-4-methylhexanoic acid 0.800 42 BKA 3-oxoheptanoic acid 0.800 43 CCU (2z,4z)-hexa-2,4-dienedioic acid 0.800 44 DDO 6-hydroxy-D-norleucine 0.800 45 DKO Octane-1,1-diol 0.800 46 DLY D-lysine 0.800 47 DNM N-methyl-D-norleucine 0.800 48 HLX 5-methyl-L-norleucine 0.800 49 IC0 Fmoc-(S)-2-(4-pentenyl)-glycine 0.800 50 KAH 5-amino-4-hydroxyhexanoic acid 0.800 51 KBE Beta-lysine 0.800 52 KMH (5s)-5-amino-3-oxo-hexanoic acid 0.800 53 KW4 5-methyl-D-norleucine 0.800 54 LDO 6-hydroxy-L-norleucine 0.800 55 LYH 3,4 ene-lysine 0.800 56 LYK (2s)-2,6-diaminohexane-1,1-diol 0.800 57 LYS Lysine 0.800 58 MK8 2-methyl-L-norleucine 0.800 59 MKE (4s)-4-amino-5-oxohexanoic acid 0.800 60 OCA Octanoic acid (caprylic acid) 0.800 61 ONL 5-oxo-L-norleucine 0.800 62 OTT (2e,4e,6e)-octa-2,4,6-trienoic acid 0.800 63 QM8 6-sulfanyl-L-norleucine 0.800 64 RE6 (5r)-5-methylheptanoic acid 0.800 65 SKJ Beta-methylnorleucine 0.800 66 T2X (2r)-2-hydroxy-5-methylhexanoic acid 0.800 67 V1V (2s,3s)-3-amino-2-hydroxyhexanoic acid 0.800 68 0RE (2s)-hexane-1,2-diol 0.778 69 0W6 (4s)-4-aminopentanoic acid 0.778 70 217 (2s)-hex-5-ene-1,2-diol 0.778 71 2AG (2s)-2-aminopent-4-enoic acid 0.778 72 4MV 4-methyl valeric acid 0.778 73 69O 2-oxopentanoic acid 0.778 74 6AH 6-aminohexan-1-ol 0.778 75 7FB (2r)-hexane-1,2-diol 0.778 76 BHL 6-bromohexan-1-ol 0.778 77 DAV Delta-amino valeric acid 0.778 78 DYL (2r)-2-aminopent-4-enoic acid 0.778 79 EE0 (2~{R})-2-azanylpentanoic acid 0.778 80 EJM L-norleucine aldehyde 0.778 81 F9D (2r)-2-aminopent-4-ynoic acid 0.778 82 FBE (3e)-5-aminopent-3-enoic acid 0.778 83 HE4 Heptan-1-ol 0.778 84 HEZ Hexane-1,6-diol 0.778 85 HTX Heptan-2-one 0.778 86 KFB 5-aminovaleric acid 0.778 87 LPH L-propargylglycine 0.778 88 NVA Norvaline 0.778 89 OXP 2-oxo-3-pentenoic acid 0.778 90 QT8 3-oxidanylidenepentanoic acid 0.778 91 SHF Laevulinic acid 0.778 92 SHO 5-hydroxylaevulinic acid 0.778 93 SJ3 (4r)-4-hydroxypentanoic acid 0.778 94 UE3 (2r)-2-oxidanylpentanoic acid 0.778 95 BEO Butenoic acid 0.750 96 BUA Butanoic acid 0.750 97 HEX Hexane 0.750 98 PE9 Pentan-1-ol 0.750 99 PTL Pentanal 0.750 100 02G (3s,4e)-3-hydroxy-7-sulfanylhept-4-enoic acid 0.727 101 0XO 2-methyl-D-lysine 0.727 102 11C (2r)-2-aminohexanedioic acid 0.727 103 3HO (3s)-3-hydroxyoctanoic acid 0.727 104 3LR 3,6-dideoxy-L-arabino-hexonic acid 0.727 105 5GM (4s)-2,4-dimethyl-L-norleucine 0.727 106 66D (4r)-2,4-dimethyl-L-norleucine 0.727 107 6FH (6~{S})-6-methyloctanoic acid 0.727 108 7OD (2e,5r)-5-hydroxy-2-methylhept-2-enoic acid 0.727 109 8AC 8-aminooctanoic acid 0.727 110 8WY 5,5-dihydroxy-L-norleucine 0.727 111 A1BEB 2-methyllysine 0.727 112 A1BX4 N~6~-hydroxy-L-lysine 0.727 113 A1LUV (5s)-5-hydroxy-lysine 0.727 114 AHH Amino-hydroxyheptanoic acid 0.727 115 B3E (3s)-3-aminohexanedioic acid 0.727 116 B3K (3s)-3,7-diaminoheptanoic acid 0.727 117 B3Q (3s)-3,6-diamino-6-oxohexanoic acid 0.727 118 C9T (2~{R})-2-methyloctanoic acid 0.727 119 CFD (2r,3e,5r)-5-amino-2,4-dimethylhex-3-enal 0.727 120 CUW (2~{S},3~{R})-2,6-bis(azanyl)-3-oxidanyl-hexanoic acid 0.727 121 DNG N-formyl-D-norleucine 0.727 122 DUV (2r)-2-methanoylhept-6-ynoic acid 0.727 123 FA7 (2z,4e)-7-methylocta-2,4-dienoic acid 0.727 124 GVM (3r)-3-hydroxy-5,5-dimethylhexanoic acid 0.727 125 HOC (2s)-2-hydroxyoctanoic acid 0.727 126 KNA Nonanoic acid 0.727 127 L2O (2s,3r)-3-amino-2-hydroxy-5-methylhexanoic acid 0.727 128 L3O (2s,3s)-3-amino-2-hydroxy-5-methylhexanoic acid 0.727 129 LYO 4-hydroxy-lysine 0.727 130 LYZ 5-hydroxylysine 0.727 131 M1T 6,6-dihydroxy-1-methoxyhexan-2-one 0.727 132 M3P (2e,4e)-2-hydroxy-6-oxohepta-2,4-dienoic acid 0.727 133 MH8 (2s)-2-amino-2-methylhept-6-enoic acid 0.727 134 MHE 5,5-dimethyl-2-oxohexanoic acid 0.727 135 MLZ N-methyl-lysine 0.727 136 MNL 4,N-dimethylnorleucine 0.727 137 NMK N-methyl lysine 0.727 138 OOA 3-oxooctanoic acid 0.727 139 OOG 2-oxoadipic acid 0.727 140 PML Pimelic acid 0.727 141 SH6 8-bromooctanoic acid 0.727 142 SHU 4,6-dioxoheptanoic acid 0.727 143 T3R N,5-dimethyl-L-norleucine 0.727 144 U2M (2s)-2-amino-7-sulfanylheptanoic acid 0.727 145 UIT (2r)-2-oxidanyloctanoic acid 0.727 146 UN1 2-aminohexanedioic acid 0.727 147 UXY (4r)-4-hydroxy-L-lysine 0.727 148 WEH L-homoglutamine 0.727 149 WVL (2s,3r)-2-amino-3,5-dimethylhex-4-enoic acid 0.727 150 XC0 (2s)-2-aminooctanoic acid 0.727 151 YL0 (4r)-4-chloro-L-lysine 0.727 152 YVI 6-thiooctanoic acid 0.727 153 03H (2s)-2-chloro-4-methylpentanoic acid 0.700 154 0VT 6-methylhept-5-en-2-one 0.700 155 1JW (2s)-hexane-1,2,6-triol 0.700 156 1LU (2s)-2-hydroxy-4-methyl-pentanoic acid 0.700 157 1QQ (3s)-3-methyl-2-oxopentanoic acid 0.700 158 1VR (3r)-3-amino-4-methylpentanoic acid 0.700 159 28J D-alloisoleucine 0.700 160 2EH (2s)-2-ethylhexan-1-ol 0.700 161 2RH (2r)-2-hydroxy-4-methylpentanoic acid 0.700 162 3OL (3r)-oct-1-en-3-ol 0.700 163 3OM (3s)-1-octen-3-ol 0.700 164 6Y5 5-fluoranyl-2-oxidanylidene-pentanoic acid 0.700 165 7DH (3e)-5-hydroxy-2-oxopent-3-enoic acid 0.700 166 7GA 2,4-dimethylpentanal 0.700 167 98J 5-hydroxy-3-oxopentanoic acid 0.700 168 A1AJD (4z)-oct-4-en-1-ol 0.700 169 A1AUG 5-oxo-L-norvaline 0.700 170 A1EAJ (~{z},2~{S})-2-azanyl-3-methyl-pent-3-enoic acid 0.700 171 A1L3J (2~{R},3~{R})-3-methyl-2-oxidanyl-pentanoic acid 0.700 172 A1L7N N-methyl-L-norvaline 0.700 173 A8E (2s)-2-amino-4-bromopent-4-enoic acid 0.700 174 AA4 2-amino-5-hydroxypentanoic acid 0.700 175 B3T 3-amino-2,3,5-trideoxy-D-threo-pentonic acid 0.700 176 COI 2-oxo-4-methylpentanoic acid 0.700 177 DIL D-isoleucine 0.700 178 DLE D-leucine 0.700 179 DO4 2,5-dioxopentanoic acid 0.700 180 EO2 4,5-dehydro-L-leucine 0.700 181 FVT 5-azanyl-4-oxidanylidene-pentanoic acid 0.700 182 G9A (2e)-pent-2-enedioic acid 0.700 183 GAU (4s)-4-amino-5-hydroxypentanoic acid 0.700 184 GUA Glutaric acid 0.700 185 HKV 4,5-dioxopentanoic acid 0.700 186 HOZ (4s)-4,5-diaminopentanoic acid 0.700 187 HPN Heptanamide 0.700 188 HRI Alpha-chloroisocaproic acid 0.700 189 HYH (2r)-2-hydroxyhexanamide 0.700 190 IIL Iso-isoleucine 0.700 191 IL0 (2s,3s)-2-amino-3-methylpentane-1,1-diol 0.700 192 ILE Isoleucine 0.700 193 KQY 6-aminohexanamide 0.700 194 LAF 5-fluorolevulinic acid 0.700 195 LEU Leucine 0.700 196 LYJ (2s)-2,6-diaminohexan-1-ol 0.700 197 MHN 6-methylheptan-1-ol 0.700 198 NLN Norleucine amide 0.700 199 OC9 Octan-1-ol 0.700 200 OIL (2s,3s)-2-hydroxy-3-methylpentanoic acid 0.700 201 ORD D-ornithine 0.700 202 ORN L-ornithine 0.700 203 OYA Octanal 0.700 204 QMB 5-mercapto-norvaline 0.700 205 QRL S-methyl hexanethioate 0.700 206 RX9 Dehydroisoleucine 0.700 207 SZR (2r)-4-cyano-2-hydroxybutanoic acid 0.700 208 TQ9 5-chloro-4-oxopentanoic acid 0.700 209 UEI (2r,3s)-3-methyl-2-oxidanyl-pentanoic acid 0.700 210 VAH (3r)-3-hydroxy-L-norvaline 0.700