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. 2020 Sep 13;24:100802. doi: 10.1016/j.bbrep.2020.100802

Table 2.

Inductive index (ii) values calculated for each side-chain on the Cα of all 15 non-aromatic α-amino acids and experimentally determined pKa values of their α-NH3+ groups (ranked from highest to lowest). The pKa values of non-ionizable α-amino groups are the same as in Table 1 and are included for comparison. The state of ionizable side-chain groups (used for calculations) are indicated in parentheses.

Side chain ii of side-chain
on Cα (x 103)
α-NH3+ pKa
Cys (thiol ionized) −339.6 10.33 ± 0.02
Asp (β-carboxyl ionized) −162.5 9.76 ± 0.02
Ala −134.0 9.80 ± 0.02
Val −127.1 9.55 ± 0.01
Ile −96.8 9.69 ± 0.01
Glu (γ-carboxyl ionized) −91.3 9.74 ± 0.01
Leu −72.8 9.64 ± 0.01
Gly −53.2 9.68 ± 0.01
Met 19.7 9.15 ± 0.02
Arg (guanidinium ionized) 46.5 9.08 ± 0.01
Lys (ε-amino ionized) 62.8 9.16 ± 0.01
Ser 81.5 9.11 ± 0.02
Gln 89.3 9.15 ± 0.01
Thr 92.3 9.01 ± 0.01
Asn 180.8 8.80 ± 0.02