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. Author manuscript; available in PMC: 2014 Oct 24.
Published in final edited form as: J Phys Chem B. 2013 Jun 13;117(42):10.1021/jp401962k. doi: 10.1021/jp401962k

Table 2.

MSM-REMD results: The overlap factor matrix Ω(α,β) involving the top folding tubes that account for ≥ 95 % of the total folding flux. The slow folding tubes are indicated by red.

(a) T = 465 K
Folding tube 1 2 3 4
1 1.00 0.24 0.00 0.33
2 0.24 1.00 0.00 0.62
3 0.00 0.00 1.00 0.00
4 0.33 0.62 0.00 1.00
(b) T = 539 K
Folding tube 1 2 3 4 5 6 7 8 9
1 1.00 0.65 0.87 0.73 0.61 0.79 0.26 0.82 0.78
2 0.65 1.00 0.37 0.85 0.25 0.29 0.35 0.28 0.89
3 0.87 0.37 1.00 0.56 0.71 0.97 0.15 0.95 0.50
4 0.73 0.85 0.56 1.00 0.46 0.55 0.38 0.37 0.80
5 0.61 0.25 0.71 0.46 1.00 0.75 0.11 0.61 0.40
6 0.79 0.29 0.97 0.55 0.75 1.00 0.09 0.88 0.38
7 0.26 0.35 0.15 0.38 0.11 0.09 1.00 0.02 0.31
8 0.82 0.28 0.95 0.37 0.61 0.88 0.02 1.00 0.47
9 0.78 0.89 0.50 0.80 0.40 0.38 0.31 0.47 1.00