Table 1.

Simulation of the relative conformational space available upon glycine mutation in a disordered peptide

Host–guest pentapeptide pair	Ω X-Gly	ΔΔSX-Gly (cal/(mol K))
[AAAAA]–[AAGAA]	3.03	2.20
[AAVAA]–[AAGAA]	4.28	2.89

All simulations were performed using MPMOD software [28, 51, 52]. Equal probabilities were assumed for all valine rotamers. Atomic radii were taken from published values [76–78]