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The contributions were analyzed using a single MD-generated structure whose absorption wavelength is closest to the average value of the 10 MD-generated structures.
| Wild-type | D234N | |
|---|---|---|
| Glu68 | 0 | −20 |
| Asp234 | −28 | |
| Asn234 | 0 | |
| H2O | 0 | −7 |
| Total | −28 | −27 |
