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Probability of Aβ42 dimer to form β-hairpins only at Nter (HPNter–Nter), between Nter and CHC (HPNter–CHC), at Cter (HPCter–CHC), and between CHC and Cter (HPCHC–Cter). The populations of intramolecular three-stranded β-sheets formed at Nter–CHC–Cter (βSNter–CH–Cter) and CHC–Cter–Cter (βSCHC–Cter–Cter) are also shown. Error bars are calculated using two independent time windows (100–425 ns and 425–750 ns).
