Table 3. Fitting Parameters Calculated from Figure 2A–C (H₂O) and Figure 2D–F (D₂O).

	50 nM		100 nM		250 nM
	Ippp	Issp	Ippp	Issp	Ippp	Issp
H2O
A0	–0.26	0.22	0.92	–0.11	–0.21	0.20
B0	0.14	–0.31	–1.11	–0.05	0.27	0.36
χ1	–0.38	0.35	0.52	0.15	0.19	0.00
ω1	1069.1		1057.1		1055.9
τ1	4.8		28.0		19.4
χ2	–0.56	1.06	0.15	–0.36	–0.05	0.24
ω2	1090.5		1094.6		1092.6
T2	9.1		9.1		9.1
χ3					0.62	–0.11
ω3					1156.1
τ3					54.1
χNR	–0.56	0.00	–0.08	0.02	–0.10	–0.03
D2O
A0	0.13	0.19	–0.10	–0.10	–0.03	–0.18
B0	0.01	–0.10	–0.05	–0.35	0.00	–0.03
χ1	0.22	–0.02	0.31	1.04	0.46	0.64
ω1	1045.1		1059.8		1057.5
τ1	6.7		6.9		10.1
χ2	0.23	0.61	–0.19	–0.36	0.10	–1.28
ω2	1094.0		1087.4		1092.8
T2	12.6		10.2		10.7
χ3	0.10	0.17	0.04	–0.04	–0.04	–0.13
ω3	1154.9		1134.2		1152.1
τ3	6.0		11.3		6.7
χNR	0.02	0.00	–0.01	–0.12	0.04	–0.01