Table 4.
ΔΔH | ΔΔGsolv | −TΔΔS | ΔΔG80/65 | ΔΔGcrowding | |
---|---|---|---|---|---|
BSA | −21.3 (1.6) | 22.9 (1.54) | 0.3 (0.1) | 4.2 (0.9) | 6.1 (0.3) |
Lys | −194.0 (2.0) | 186.2 (1.95) | 0.5 (0.1) | 4.3 (0.6) | −3.0 (0.5) |
[kcal/mol] with statistical errors given in parentheses; T=298K. Averages over the trajectories exclude the first 30 ns.