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. Author manuscript; available in PMC: 2022 Oct 22.
Published in final edited form as: J Chem Inf Model. 2021 Oct 27;61(11):5535–5549. doi: 10.1021/acs.jcim.1c01078

Table 3:

Conformational State Determined by Dihedral Angle, χ

Nucleotide monophsphate State 1 State 2

ADE, GUA −91 ∼ 175° −180 ∼ −91° or 75 ∼ 180°
URA, CYT −170 ∼ 137° −180 ∼ −170° or 137 ∼ 180°