Dear all,
How can I use belly and ntr at the same time? And how to restrain the backbone of the protein.
My input file like:
nmropt=1,
.....
ibelly=1,ntr=1,
&end
&wt
type='TEMP0',istep1=0,istep2=200,
value1=100,value2=300.0,
&end
&......
&end
Restrain heavy atoms
5.0
FIND
* CT * *
* CA * *
* CB * *
* OS * *
SEARCH
RES 1 529
----belly =residues 15a
RES 1 1
RES 61 171
END
END
the out file gives:
RESTRAINTS:
No valid redirection requests found
** No restraint defined **
Done reading weight changes/NMR restraints
Can you give explanation about it.
Many thanks
sxzheng
Received on Wed Oct 16 2002 - 08:21:10 PDT