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. 2016 Jun 13;12(6):e1004981. doi: 10.1371/journal.pcbi.1004981

Table 2. Hot spot list from PAS-A dimer models, with related scores from the PPI prediction tools herein adopted.

PASA.4F3L PASA.4M4X
Residue Robetta HotPoint KFC2-A Residue Robetta HotPoint KFC2-A
AhR:L116 1.26 26.53 0.73 AhR:L110 0.51 32.94 -0.34
AhR:L117 0.68 39.46 0.01 AhR:E112 0.72 9.65 0.19
AhR:A119 0.00 12.33 0.10 AhR:F115 2.53 17.12 -0.30
AhR:L120 1.97 39.34 1.35 AhR:L116 2.41 28.67 0.71
AhR:R236 0.38 16.35 0.14 AhR:L117 0.44 41.45 0.80
AhR:F260 0.48 25.43 0.03 AhR:L120 1.40 33.14 -0.01
AhR:I262 0.95 43.23 1.13 AhR:V124 0.53 38.39 0.17
ARNT:L159 0.81 37.38 -1.12 AhR:L240 na 28.51 -2.25
ARNT:E163 -0.45 11.28 0.74 AhR:F260 2.21 27.04 1.20
ARNT:L164 0.52 24.70 -0.51 AhR:I262 0.54 25.90 -1.48
ARNT:L167 1.89 38.70 1.13 ARNT:D161 -0.05 13.08 0.54
ARNT:I168 0.81 39.90 0.54 ARNT:L164 0.85 16.13 0.38
ARNT:A171 0.00 25.54 -0.07 ARNT:I168 2.18 23.52 0.81
ARNT:L176 0.26 29.65 -1.90 ARNT:L169 0.73 38.99 -0.01
ARNT:Y311 2.33 14.40 -0.34 ARNT:L176 0.48 48.69 -0.99
ARNT:I340 0.98 30.43 0.42 ARNT:V338 0.54 28.24 -0.44
ARNT:A339 na 22.49 -1.02
ARNT:I340 0.92 25.74 -0.80

na: residue not predicted as hot spot for the specific method

Residues highlighted in bold mostly contribute to the dimer stabilization according to the scores proposed by all methods