Table 1.

Coefficient of correlation between theoretical and experimental Φ values

Protein	Computed transition state with lowest free energy	Computed ensemble of all transition states	No. of points (Fig. 3) used for Φexp/Φteor comparison
C12	0.50	0.56	37
Barnase	0.19	0.54	29
CheY	0.59	0.50	17
Ser SH3	0.00	−0.02	14
α-sp.SH3	0.54	0.39	6
Average	0.36	0.46	21.2