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Nan coordinates of mutated residues #512
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call:
martinize2 -f 6OR3_open_wt.pdb -x 6OR3_open_hybrid_CG.pdb -o 6OR3_open_hybrid.top -cys auto -scfix -mutate GLU87:THR -mutate GLY91:LEU -mutate ASN92:ASP -mutate PHE95:TYR -mutate ASP96:THR -mutate LEU97:PRO -mutate LYS98:GLN
result in 6OR3_open_hybrid_CG.pdb:
....
ATOM 206 BB LEU A 91 32.897 4.811 98.138 1.00 0.00
ATOM 207 SC1 LEU A 91 nan nan nan 1.00 0.00
....
test.zip
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