TABLE 2.
Some partial charges on lysozyme calculated by MFCC-FDPB
| Atom* | Residue | Charge | Atom* | Residue | Charge | Atom* | Residue | Charge |
|---|---|---|---|---|---|---|---|---|
| N | Asp18 | −0.414 | O | Ser24 | −0.603 | CG1 | Ile55 | 0.024 |
| N | Asp48 | −0.082 | O | Ser50 | −0.727 | CG1 | Ile58 | 0.165 |
| N | Asp52 | −0.641 | O | Ser72 | −0.588 | CG1 | Ile78 | 0.304 |
| N | Asp66 | −0.433 | O | Ser85 | −0.582 | CG1 | Ile88 | 0.024 |
| N | Asp87 | −0.309 | O | Ser86 | −0.604 | CG1 | Ile98 | 0.137 |
| N | Asp101 | −0.510 | O | Ser91 | −0.657 | CG1 | Ile124 | 0.063 |
| N | Asp119 | −0.484 | O | Ser100 | −0.604 | |||
| −0.558† | −0.580† | 0.022† |
Atom name in PDB nomenclature.
AMBER03 charge.