When loading a PDB and applying CY2 parameters (using CysS-.off, CysS-.frcmod) Amber tleap does not connect the CY2 to neighbouring residues and instead places a "TER" so that CY2 is floating in space, unconnected in the protein chain.
Fixing the connectivity array inside CysS-.off corrects this:
(lines 33,34,35):
!entry.CY2.unit.connect array int
1
9
(lines 71,72):
!entry.CY2.unit.residueconnect table int c1x int c2x int c3x int c4x int c5x int c6x
1 9 0 0 0 0
When loading a PDB and applying CY2 parameters (using CysS-.off, CysS-.frcmod) Amber tleap does not connect the CY2 to neighbouring residues and instead places a "TER" so that CY2 is floating in space, unconnected in the protein chain.
Fixing the connectivity array inside CysS-.off corrects this:
(lines 33,34,35):
(lines 71,72):