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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 2:

Number of Rotamer States for Each Amino Acid

Residue Total number of dihedral angles, χi Maximum number of states

Arg, Lys 4 81
Gln, Glu, Met 3 27
Asn, Asp, His, ILe, Leu, Trp 2 9
Phe, Tyr 2 6
Cys, Ser, Thr, Val 1 3