Probing the folding of mini-protein Beta3s by two-dimensional infrared spectroscopy; simulation study

PMC Biophysics

Table 1 Conformational Properties of Beta3s

Conformation	Q	Radius of Gyration	SASA	Backbone DSSP String
612 Helix	0.59	7.98	2084	~HHHHHHHHHHHS~~~~~
Ns-or	0.99	7.45	1993	EEEESTTEEEEESSEEEE
Cs-or	0.89	7.96	2004	EEEESSEEEEESSSEEEE
Ch-Curl	0.89	7.78	1951	~~SSGGG~~~EESSEETT
Native	1.00	7.50	1783	EEEESSEEEEEESSEEEE

Averaged conformational properties of investigated Beta3s conformations, DSSP assigned backbone configuration, Q, fraction of native contacts, radius of gyration, and SASA, solvent accessible surface area.