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. Author manuscript; available in PMC: 2021 Dec 1.
Published in final edited form as: Biophys Chem. 2020 Sep 16;267:106476. doi: 10.1016/j.bpc.2020.106476

Figure 4:

Figure 4:

Calculated vs. observed shifts for ubiquitin. Calculated values are the average shift for the ten models in PDB ID 1d3z, at the OLYP/pcSseg-0 level. Observed shifts are from BMRB entry bmr17769. Solid line is y = x ; dashed line is a least-squares best-fit line,whose slope is shown. R is the Pearson correlation coefficient.