Raman spectroscopy and normal vibrations of peptides

Abstract
Raman and infrared spectra have been recorded on the peptide Gly‐lPro‐Gly‐Gly in its zwitterionic form and on its protected homolog Z‐Gly‐lPro‐Gly‐Gly‐OMe (Z=N‐benzyloxycarbonyl and OMe = methyl ester). Both peptides adopt a type‐II β‐turn conformation into appropriate solvents, that is in dimethylsulfoxide and chloroform respectively.A normal coordinate treatment has been performed on Gly‐lPro‐Gly‐Gly using a modified Urey‐Bradley force field and the characteristic normal modes of vibrations. Their corresponding frequencies have been extracted from experimental investigations.