Systems
The 41 amino acid long tau sequence from residue number 340 to 380,
along with coordinates were extracted from protein with PDB-ID 6TJX,
chain A [69]. The structure was energy minimized, equilibrated and
the random coil conformation was used for running the production
simulations. The N-glycosylation, with selected glycan, was added to the
asparagine amino acid at residue number 359 using CHARMMGUI web server
[70]. Likewise, the phosphorylation was also added through the
CHARMMGUI webserver.