Model type | ΔG | ΔG | ΔG | ΔG | ΔΔG | ΔΔG | ΔG | ΔG | ΔΔG | ΔΔG |
---|---|---|---|---|---|---|---|---|---|---|
ΔG ROT-TRANS | 0 | 10 | 0 | 10 | - | - | 0 | 0 | - | - |
Un/Locked | L | L | U | U | L | U | L | U | L | U |
Packing Scheme | Minimal-HighSA | Complete-LowSA | ||||||||
ASA-NP | 0.73 | 0.79 | 0.60 | 0.65 | 0.07 | -0.04 | 0.58 | 0.56 | -0.31 | -0.23 |
ASA-P | -0.04 | 0.04 | -0.08 | 0.02 | -0.73 | -0.67 | -0.05 | -0.11 | -0.65 | 0.04 |
IONIS-FDDH | -0.01 | -0.04 | 0.15 | 0.13 | 0.21 | 0.08 | 0.10 | 0.10 | 0.17 | 0.16 |
IONIS-DESOLV | 0.15 | 0.09 | 0.06 | 0.01 | 1.29 | 0.97 | 0.20 | 0.19 | 0.67 | 0.61 |
SC-ROT | 0.12 | 0.10 | -0.22 | -0.30 | -0.02 | -1.61 | 0.03 | -0.02 | -0.50 | -0.61 |
R 2 correlation | 0.69 | 0.64 | 0.61 | 0.58 | 0.61 | 0.64 | 0.69 | 0.68 | 0.54 | 0.55 |
Figure/Panel | 1a | - | 1d | - | 2a | 2b | 6 | - | - | - |