Hi Henry,
> However, when I now export the chemical shift list from the
> Analysis project
> (in XEASY format for use in CYANA) using FormatConverter, the
> chemical shifts
> for the PCA are not present in the output .prot file.
It is ignored because there is no 'PCA' residue defined as part of
the default CYANA/XEASY libraries (at least the ones that I have).
This means the FC cannot find default serial numbers for the atoms,
and doesn't write out any information. Would you be able to use this
PCA residue in CYANA/XEASY if it's part of the .prot file?
Anyway if you really need it I can put in an option to come up with
some serial numbers for atoms in non-CYANA-recognised residues, but
this will only be from 2.0 onwards (so not any time soon).
Wim
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