TABLE 2.

Residues that interact with cellulose in the MD simulations

Residue	Average interaction energy
	kcal/mol
His-1	−5.42
Tyr-28	−10.86
Ser-29	−6.79
Tyr-75	−10.17
Asn-114	−3.81
Gly-115	−3.21
Gln-116	−7.40
His-149	−4.56
Val-150	−5.23
Tyr-198	−9.50
Asn-199	−5.03