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Table 3 Deviation of Gibbs free energy values of the twenty pairs of amino acids from the ideal linear value

From: Development of a group contribution method for estimating free energy of peptides in a dodecane-water system via molecular dynamic simulations

Pair Deviation of the free energy value from the ideal linear value [KJ/mol]
Ala-Arg −179.06
Ala-Asp −138.72
Ala-Glu −135.82
Ala-Trp −123.25
Ala-Gln −113.15
Ala-Tyr −111.77
Ala-Gly −111.23
Ala-Phe −110.97
Ala-Ala −110.19
Ala-His −109.46
Ala-Val −106.13
Ala-Ile −106.09
Ala-Leu −104.81
Ala-Thr −103.93
Ala-Ser −101.42
Ala-Cys −97.25
Ala-Met −95.31
Ala-Pro −93.06
Ala-Asn −89.54
Ala-Lys −85.56