Hi,
Im trying to use the phi-psi prediction with Talos, tl command.For some projects files it works fine but not for others. The output files is generated but no chemical shift inside, just the first lines
--------------REMARK NMRFAM-SPARKY generated TALOS input file
DATA FIRST_RESID 1
DATA SEQUENCE xxxxxxxxxx yyyyyyyyyy
VARS RESID RESNAME ATOMNAME SHIFT
FORMAT %4d %1s %4s %8.3f
----------------------------
The reason is not clear to me...Does the data come from the .proj project file?ThanksMarco