Table II.
Averaged sheet-to-sheet interactions measured in angstroms for the last 100 ns of the simulation. The standard deviation (calculated from averaging over three trajectories) is shown in parentheses.
| Face to face interface | Distance | Distance | Distance | Distance | Distance |
|---|---|---|---|---|---|
| Antiparallel Iowa mutant | Start | Average | Run 1 | Run 2 | Run 3 |
| Q15-V36 | 8.4 | 9.3 (0.7) | 8.8 (0.7) | 9.4 (0.6) | 9.6 (0.7) |
| L17-L34 | 9.5 | 10.1 (0.5) | 10.1 (0.4) | 9.6 (0.5) | 10.8 (0.5) |
| F19-I32 | 9.5 | 10.4 (0.5) | 9.9 (0.4) | 10.2 (0.4) | 11.0 (0.6) |
| A21-A30 | 9.9 | 10.6 (0.5) | 10.0 (0.5) | 11.1 (0.5) | 10.8 (0.6) |
| Antiparallel wild type | Start | Average | Run 1 | Run 2 | Run 3 |
| Q15-V36 | 8.6 | 9.1 (0.6) | 8.8 (0.6) | 9.5 (0.6) | 9.1 (0.7) |
| L17-L34 | 9.6 | 9.8 (0.5) | 10.1 (0.5 | 9.7 (0.5) | 9.7 (0.4) |
| F19-I32 | 9.6 | 9.9 (0.4) | 10.3 (0.5) | 9.8 (0.4) | 9.7 (0.4) |
| A21-A30 | 10 | 10.6 (0.5) | 10.3 (0.5) | 11.1 (0.5) | 10.3 (0.5) |
| Parallel Iowa mutant | Start | Average | Run 1 | Run 2 | Run 3 |
| Q15-V36 | 14.7 | 12.9 (0.7) | 12.7 (0.8) | 13.9 (0.7) | 12 (0.6) |
| L17-L34 | 13.9 | 12.0 (0.5) | 12.9 (0.6) | 11.2 (0.5) | 11.9 (0.4) |
| F19-I32 | 12.3 | 12.0 (0.5) | 12.0 (0.6) | 11.7 (0.4) | 12.4 (0.5) |
| A21-A30 | 11.5 | 11.1 (0.6) | 10.4 (0.6) | 11.7 (0.5) | 11.3 (0.5) |
| Parallel wild type | Start | Average | Run 1 | Run 2 | Run 3 |
| Q15-V36 | 14.5 | 13.5 (0.8) | 13.8 (0.7) | 14.2 (0.9) | 12.5 (0.9) |
| L17-L34 | 13.3 | 12.1 (0.6) | 12.9 (0.5) | 12.5 (0.7) | 11 (0.5) |
| F19-I32 | 12.3 | 11.9 (0.5) | 12.1 (0.5) | 11.6 (0.5) | 12.1 (0.5) |
| A21-A30 | 11.5 | 10.5 (0.6) | 11.2 (0.6) | 9.2 (0.6) | 11.2 (0.8) |