Fig. 4 | European Biophysics Journal

Fig. 4

From: Amino acid side chain contribution to protein FTIR spectra: impact on secondary structure evaluation

Fig. 4

ζ values for validation of the 8 DSSP-defined secondary structure element and “Others”, explained in the text. The left panel reports results for a leave-one-out cross-validation and the right panel the Kennard–Stone test set (1/3 of the protein spectra). For each structure, 3 prediction methods have been used, ASLR, PLS and SVM. For each method, raw spectra or spectra corrected for amino acid side chain contributions have been used. The color code is indicated in each of the panels. For PLS, the number of LVs has been determined as described on Fig. S3

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