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. 2019 Nov 6;9:16131. doi: 10.1038/s41598-019-52718-0

Table 2.

Differences in residue interaction network (RIN) analysis of SEPHS2 during MD simulations in water at neutral and acidic pH.

Neutral pH 0 ns Residue interaction network 10 ns
2 ns 4 ns 6 ns 8 ns
Ile 322 Lys 252 His 325 Phe 140 Phe 140 Phe 139
Phe 199 Phe 199 Leu 159 Tyr 163 Glu 369 Phe 140
Lys 252 Phe 199 Ile 322 Phe 199
Phe 199 Lys 252 Tyr 163
Tyr 163 Phe 199
Acidic pH Phe 320 Phe 199 Phe 199 Phe 199 Phe 199
Glu 283 His 325 Phe 320 Phe 140 Val 158
Lys 190 Met 295 Phe 140 Phe 320 Asn 157
Phe 140
Phe 360