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Average distances between Leu136-Ala193 (d1), Leu140-Ala193 (d2) and Leu140-Leu194 (d3).
| System | d1 (Å) | d2 (Å) | d3 (Å) |
|---|---|---|---|
| Wild type | 7 ± 1 | 11 ± 2 | 16 ± 2 |
| p.D104G | 4 ± 1 | 5 ± 1 | 7 ± 3 |
| p.A107V | 4 ± 1 | 5 ± 1 | 8 ± 2 |
| p.F109L | 5 ± 1 | 6 ± 1 | 10 ± 2 |
| p.Y123S | 6 ± 2 | 8 ± 2 | 15 ± 3 |
| p.S161I | 4 ± 1 | 5 ± 1 | 7 ± 2 |
| p.S181F | 6 ± 1 | 12 ± 2 | 17 ± 2 |
| p.S202F | 5 ± 1 | 5 ± 1 | 8 ± 2 |
Distances and errors were computed along the last 50 ns of the simulations at 300 K.
