Table 3.
Standard view | Phys 1 | Phys 2 | Phys 3 | Exposed Rmax = 6.5 Å | Exposed Rmax = 10.0 Å |
Exposed Rmax = 4.5 Å |
Not in contact with hydro-phobic core | (Moel-bert et al. | Semanta et al. [22] A |
(Semanta et al. [22]) B |
|
---|---|---|---|---|---|---|---|---|---|---|---|
LYS | +/− | +1.8 | −1.5 | −3.0 | 5.9 | 5.6 | 7.3 | +2.0 | 0.61 | 9.8 | 85 |
GLU | +/− | +1.6 | −0.74 | −2.5 | 5.4 | 5.5 | 6.0 | +1.9 | 0.59 | 10.6 | 64 |
ARG | +/− | +1.0 | −2.5 | −3.0 | 5.1 | 4.6 | 6.5 | +0.9 | 0.54 | 16.3 | 77 |
ASP | +/− | +2.4 | −0.1 | −2.5 | 5.1 | 5.3 | 5.1 | +2.1 | 0.61 | 11.0 | 48 |
ASN | P | +0.4 | −0.8 | 0 | 5.1 | 5.7 | 5.4 | −0.3 | 0.57 | 12.0 | 48 |
HIS | +/− P | +1.4 | −0.4 | 0 | 4.5 | 4.5 | 5.8 | −0.05 | 0.42 | 15.2 | 47 |
GLN | P | +0.2 | −0.8 | 0 | 4.4 | 4.3 | 5.8 | −0.3 | 0.57 | 12.8 | 60 |
PRO | H | −0.3 | +0.12 | +1.4 | 4.2 | 4.4 | 4.9 | −1.8 | 0.50 | 10.6 | 43 |
THR | P | +0.1 | 0 | +0.4 | 4.0 | 4.4 | 4.3 | −0.5 | 0.48 | 11.3 | 36 |
SER | P | +0.3 | −0.2 | −0.3 | 3.8 | 4.5 | 4.1 | −0.2 | 0.57 | 9.3 | 28 |
TYR | P,H | +0.2 | 0 | +2.3 | 3.6 | 3.2 | 5.1 | −1.2 | 0.32 | 20.6 | 40 |
TRP | H | −0.2 | +0.8 | +3.4 | 3.2 | 3.0 | 4.5 | −1.4 | 0.28 | 24.8 | 38 |
GLY | – | +1.1 | +0.5 | 0 | 3.2 | 3.5 | 4.2 | 0 | 0.59 | – | – |
LEU | H | −0.7 | +1.5 | +1.8 | 3.2 | 3.0 | 5.6 | −1.2 | 0.32 | 14.8 | 23 |
VAL | H | −0.5 | +1.8 | +1.5 | 2.7 | 3.1 | 4.2 | −1.0 | 0.31 | 12.8 | 19 |
ILE | H | −0.8 | +1.4 | +1.8 | 2.7 | 2.6 | 4.5 | −1.25 | 0.27 | 15.3 | 21 |
PHE | H | −0.6 | +1.2 | +2.5 | 2.7 | 2.3 | 5.0 | −1.3 | 0.29 | 20.0 | 25 |
ALA | H | +0.3 | +0.6 | +0.5 | 2.6 | 3.3 | 3.8 | −0.6 | 0.40 | 7.2 | 18 |
MET | H | −0.4 | +0.6 | +1.3 | 2.3 | 1.6 | 5.5 | −1.0 | 0.37 | 16.5 | 29 |
CYS | H | +0.2 | +0.3 | +1.0 | 2.1 | 2.7 | 3.5 | −0.5 | 0.27 | 13.4 | 10 |