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Abstract
The 15N and carbonyl 13C NMR chemical shifts of the Gly residue were calculated theoretically with FPT INDO method for the sequence model compounds, of Bombyx mori silk fibroin protein, Acetyl-Ala-Gly-NHMe, Acetyl-Ser-Gly-NHMe, Acetyl-Gly-Ala-NHMe and Acetyl-Gly-Ser-NHMe, in order to examine the origin of the 15N and carbonyl NMR sequence splittings previously observed. The order of the observed sequence splittings of B. mori silk fibroin was reproduced by the calculation although the width of the splittings was small.
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