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. Author manuscript; available in PMC: 2016 Feb 18.
Published in final edited form as: Phys Chem Chem Phys. 2016 Feb 17;18(8):5819–5831. doi: 10.1039/c5cp04556h

Table 1.

Parameters of Gaussian-shaped populations used to reconstruct distance profiles for clinical isolate, V6, Ki values of V6 and subtype B constructs and the relative ratio.

Samples Curled/Tucked
% (population)
Closed
%
(population)
Semi-open
%
(population)
Wide-open
%
(population)
Ki of
V6 a
(nM)
Ki of
B a
(nM)
Ratio
of Ki
V6/B a
25–30Å 30–35Å 35–40Å 40–50Å
Apo 10 21 61 8 -- -- --
CaP2 0 100 0 0 -- -- --
DRV 0 100 0 0 -- -- --
LPV 17 83 0 0 -- 0.11±0.03 --
TPV 0 100 0 0 -- 0.4±0.04 --
SQV 0 87 13 0 -- 2.2±0.3 --
APV 8 72 16 4 -- 0.4±0.1 --
RTV 15 34 51 0 30±2 0.7±0.1 42
ATV 7 30 63 0 -- 0.07±0.01 --
IDV 10 30 54 6 69±8 3.1±0.1 22
NFV 14 30 39 17 17±3 1.2±0.2 14

The error is estimated to be ± 5% in the percent population

a

The data is from references.36, 62