Spectral NRMSDs and structure predictions from lysozyme CD spectra as a function of temperature derived using the original data and derandomized spectra (where best fit requires >0% RC to be added). Column identity is as for Table 1. Bold indicates preferred values where more than one option gave a reasonable fit as discussed in the text.

Lysozyme (°C)	Best NRMSD	RC added	Derandomized			Regenerated original protein
			α-Helix	β-Sheet	Other	α-Helix	β-Sheet	Other
20	0.021 (0.019)	0%				0.39	0.16	0.45
		(60%)	(0.85)	(0)	(0.15)	0.34	0.00	0.66
30	0.021 (0.019)	0%				0.39	0.16	0.45
		(60%)	(0.85)	(0)	(0.15)	0.34	0.00	0.66
40	0.022 (0.019)	0%				0.39	0.16	0.45
		(60%)	(0.85)	(0)	(0.15)	0.34	0.00	0.66
50	0.023 (0.020)	0%				0.39	0.16	0.45
		(60%)	(0.85)	(0)	(0.15)	0.34	0.00	0.66
60	0.0234	0%				0.39	0.16	0.45
	(0.0237)	(60%)	(0.86)	(0)	(0.14)	(0.34)	(0)	(0.66)
70	0.023	10%	0.39	0.15	0.46	0.35	0.14	0.51
80	0.038	70%	0.64	0.02	0.34	0.19	0.00	0.80
	0.045	40%	0.27	0.20	0.52	0.16	0.12	0.71
90	0.036	0%				0.11	0.34	0.55
	0.044	(50%)	0.26	0.21	0.53	0.13	0.11	0.76
100	0.035	0%				0.11	0.34	0.55
	0.041	50%	0.26	0.21	0.53	0.13	0.11	0.76