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. Author manuscript; available in PMC: 2008 Nov 3.
Published in final edited form as: Int J Quantum Chem. 2008;108(4):814–819. doi: 10.1002/qua.21521

Table II.

Energies (kcal · mol-1) of non-bonded interactions which stabilize tertiary structure.

Interactions ΔEint
Pro8Gly9-Ala12 -8.71
Phe20-Pro5Thr6 -6.05
Phe20-Tyr7Pro8 -5.25
Tyr27-Pro2Ser3 -7.43
Tyr27-Gln4Pro5 -5.53
Phe20-PB6a 3.42
Tyr27-PB3a 2.22
          Total -27.33
a

For doubly counted peptide bonds (PB), see methods.