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. Author manuscript; available in PMC: 2022 Nov 14.
Published in final edited form as: J Phys Chem B. 2021 Oct 20;125(43):11927–11942. doi: 10.1021/acs.jpcb.1c07547

Figure 7:

Figure 7:

Comparison of χ2 side chain conformational preferences: results obtained with ff99SB (left) and FB18 (right). Lines represent the average between two halves of the simulations. Shaded regions represent the differences between the two halves.