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. 2022 Aug 24;88(17):e01046-22. doi: 10.1128/aem.01046-22

TABLE 3.

Hydrogen bond or salt bridge propensities at 340K across all simulations for residues of AnCel5A, T300P/D307P, and N193A/T300P/D307P

WT
T300P/D307P
N193A/T300P/D307P
Acceptor/donor % Acceptor/donor % Acceptor/donor %
D307/R258 90.20 P307/T303 3.92 P307/T303 1.89
I291/T300 64.71 P300/G304 19.61 P300/G304 9.73
T300/G304 56.86
T300/S293 3.92
Y290/W281 5.88 Y290/W281 37.76 Y290/W281 41.36
Y249/W281 50.94 Y249/W281 75.29 Y249/W281 68.91
W287/S293 54.12 W287/S293 88.24 W287/S293 89.67
G284/W287 27.45 G284/W287 39.22 G284/W287 32.98
W287/Y290 5.88 W287/Y290 37.76 W287/Y290 41.53