NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image	mrblock_id	pdb_id	cing	stage	position	program	type
	2586	1c4e	cing	1-original	1	XPLOR/CNS	dihedral angle

!gurmarin angle constraints for XPLOR
!set message=norm echo=on  end
!restraints dihedral reset
! Phi restraints: minimum deviation = 20 degrees
!   8 Glu
 assign (resid   7 and name c )   (resid   8 and name n )
        (resid   8 and name ca)   (resid   8 and name c )  1.0 -120.0 30.0 2
!  11 Ile
 assign (resid   10 and name c )   (resid   11 and name n )
        (resid   11 and name ca)   (resid   11 and name c )  1.0 -120.0 30.0 2
!  16 Asp
 assign (resid   15 and name c )   (resid   16 and name n )
        (resid   16 and name ca)   (resid   16 and name c )  1.0 -120.0 30.0 2
!  17 Cys
 assign (resid   16 and name c )   (resid   17 and name n )
        (resid   17 and name ca)   (resid   17 and name c )  1.0 -120.0 30.0 2
!  22 Glu
 assign (resid   21 and name c )   (resid   22 and name n )
        (resid   22 and name ca)   (resid   22 and name c )  1.0 -120.0 30.0 2
!  24 Lys
 assign (resid   23 and name c )   (resid   24 and name n )
        (resid   24 and name ca)   (resid   24 and name c )  1.0 -120.0 30.0 2
!  26 Val
 assign (resid   25 and name c )   (resid   26 and name n )
        (resid   26 and name ca)   (resid   26 and name c )  1.0 -120.0 30.0 2
!  29 Trp
 assign (resid   28 and name c )   (resid   29 and name n )
        (resid   29 and name ca)   (resid   29 and name c )  1.0 -120.0 30.0 2
!  30 Asn
 assign (resid   29 and name c )   (resid   30 and name n )
        (resid   30 and name ca)   (resid   30 and name c )  1.0 -120.0 30.0 2
!  31 His
 assign (resid   30 and name c )   (resid   31 and name n )
        (resid   31 and name ca)   (resid   31 and name c )  1.0 -120.0 30.0 2
!  32 Lys
 assign (resid   31 and name c )   (resid   32 and name n )
        (resid   32 and name ca)   (resid   32 and name c )  1.0 -120.0 30.0 2
!  34 Ile
 assign (resid   33 and name c )   (resid   34 and name n )
        (resid   34 and name ca)   (resid   34 and name c )  1.0 -120.0 30.0 2


!chi 1
!   3 Cys
 assign (resid 3 and name n)    (resid 3 and name ca)
        (resid 3 and name cb)   (resid 3 and name sg) 1.0 60.0 30.0 2
!  10 Cys
 assign (resid 10 and name n)    (resid 10 and name ca)
        (resid 10 and name cb)   (resid 10 and name sg) 1.0 -120.0 90.0 2
!  14 Tyr
 assign (resid 14 and name n)    (resid 14 and name ca)
        (resid 14 and name cb)   (resid 14 and name cg) 1.0 -120.0 90.0 2
!  17 Cys
 assign (resid 17 and name n)    (resid 17 and name ca)
        (resid 17 and name cb)   (resid 17 and name sg) 1.0 -120.0 90.0 2
!  18 Cys
 assign (resid 18 and name n)    (resid 18 and name ca)
        (resid 18 and name cb)   (resid 18 and name sg) 1.0 -60.0 30.0 2
!  31 His
 assign (resid 31 and name n)    (resid 31 and name ca)
        (resid 31 and name cb)   (resid 31 and name cg) 1.0 -60.0 30.0 2
!  33 Cys
 assign (resid 33 and name n)    (resid 33 and name ca)
        (resid 33 and name cb)   (resid 33 and name sg) 1.0 -120.0 90.0 2
!end

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