Table 3 Secondary structure evolution of the five α1AT structures with simulation time
Secondary structure of α1AT | 1 | 3 | 5 | 2 | 4 |
|---|---|---|---|---|---|
β sheet + turn | 13.8328 | 13.8328 | 13.7837 | 13.7837 | 13.7837 |
Coil | 72.6224 | 72.6224 | 72.7027 | 72.7027 | 72.7027 |
β sheet | 12.1037 | 12.1037 | 12.1621 | 12.1621 | 12.1621 |
Bend | 11.8155 | 11.8155 | 11.6216 | 11.6216 | 11.6216 |
Turn | 1.7291 | 1.7291 | 1.6216 | 1.6216 | 1.6216 |
3-Helix | 1.7291 | 1.7291 | 1.8918 | 1.8918 | 1.8918 |