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. 2020 Mar 17;124(14):2961–2972. doi: 10.1021/acs.jpcb.0c01475

Table 3. Estimated Secondary Structure Content (%) of PGA Determined from Fitting to the CD Spectraa.

secondary structure
pH
    3.6 4.3 5.1 5.4 5.9 7.2 10.4
helix helix1 (regular) 30.9 58.4 56.8 48.5 20.1 0.0 0.0
  helix2 (distorted) 10.6 19.2 16.7 15.1 9.2 0.0 0.0
antiparallel anti1 (left-twisted) 2.7 0.0 0.0 0.0 0.0 0.0 0.0
  anti2 (relaxed) 8.0 0.0 0.0 0.0 0.0 0.0 0.0
  anti3 (right-twisted) 0.0 0.0 0.0 0.4 15.3 42.3 43.1
parallel   15.7 1.5 0.0 0.0 0.0 0.0 0.0
turn   16.5 9.5 7.4 10.1 13.1 14.0 13.3
others   15.7 11.4 19.1 26.0 42.4 43.8 43.6
RMSD   0.1114 0.1902 0.1442 0.0636 0.1435 0.728 0.89
NRMSD   0.00561 0.00589 0.0048 0.0026 0.01422 0.06347 0.07192
a

The fitting has been completed by dividing the spectrum into eight secondary structure elements following ref (83).