Table 3.

EIN with experimental NOE data set from BMRB

Case	Trial # Table S3	N peaks	Runtime	T NOE	Additional data	(%)	(%)	Accuracy (%)
1	–	243	18 h	2		28	53	99.2
2	4	243	107 h	3	CS	19	34	100
3	5	243	6 h	2	CS	30	53	99.2
4	6	243	6 days	2	CS	31	70	99.2
5	26	243	50 min	3	CS + RDC	63	84	100
6	30	243	5 min	3	CS + CScarbon	42	80	100
7	31	243	1 s	3	–“–, refined	66	83	99.6
8	33	243	5 min	3	CS + CScarbon + RDC	67	84	100
9	34	243	1 s	3	–”–, refined	80	85	99.2
10	–	253	–	–	CA(i → i − 1) with MARS	7	–	100
11	–	253	–	–	NOE + CS with NOEnet and CA(i → i − 1) with MARS	97.2	–	99.2

N _NOEs = 407 experimental unambiguous NOEs have been used. The X-ray structure 1ZYM was used, yielding N _dist = 1034 distances below NOE classes and NOE outliers have been used. Two sets of RDCs were simulated from 1ZYM as described in material and methods. T _NOE: maximum number of allowed NOE outliers for an arbitrary matching. Case 1 was reported in (Stratmann et al. 2009)