Figure 8
Overlay of the averaged conformations of sAnTx observed in the simulations showing the movement of the N terminal and the N terminal loop around the C4-C24 disulphide bond and its effect on the conformation of the β strand connected via the bridge.
(A) for 100 ns simulation, averaged between 40–75 ns (light green) and 80–100 ns (dark green) (B). 1 μs, averaged between 0.5–2 μs (light green) and 4–10 μs (dark green), (C). 10 μs, averaged between 4–6 μs (light green) and 7.3–7.6 μs (dark green).
