Table S1.
Heme | Post-MD structure | Crystal structure | ||
Oxidized | Reduced | Oxidized | Reduced | |
1 | −112 | −231 | −113 | −231 |
2 | −94 | −176 | −64 | −176 |
3 | −47 | −246 | −5 | −246 |
4 | −141 | −290 | −132 | −290 |
5 | −178 | −252 | −177 | −252 |
6 | −137 | −274 | −135 | −272 |
7 | −169 | −185 | −169 | −185 |
8 | −214 | −322 | −210 | −320 |
9 | −336 | −392 | −332 | −390 |
10 | −296 | −277 | −297 | −277 |