NMR Restraints Grid

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

image mrblock_id pdb_id cing in_recoord stage position program type
2291 1bnb cing recoord 1-original 5 XPLOR/CNS dihedral angle


!  -------------------------------------------------------------
!           Dihedral Constraints for BNBD-12
!  -------------------------------------------------------------
!
restraints dihedral reset
!
!--------------------------------------------------
! Phi angles:
!  Val 11
assign (resid 10 and name c )  (resid 11 and name n )
       (resid 11 and name ca)  (resid 11 and name c ) 10.0 -120.0 30.0 2
!  Ile 13
assign (resid 12 and name c )  (resid 13 and name n )
       (resid 13 and name ca)  (resid 13 and name c ) 10.0 -120.0 30.0 2
!  Arg 16
assign (resid 15 and name c )  (resid 16 and name n )
       (resid 16 and name ca)  (resid 16 and name c ) 10.0 -120.0 30.0 2
!  Arg 22
assign (resid 21 and name c )  (resid 22 and name n )
       (resid 22 and name ca)  (resid 22 and name c ) 10.0 -120.0 30.0 2
!  Ile 24
assign (resid 23 and name c )  (resid 24 and name n )
       (resid 24 and name ca)  (resid 24 and name c ) 10.0 -120.0 30.0 2
!  Thr 26
assign (resid 25 and name c )  (resid 26 and name n )
       (resid 26 and name ca)  (resid 26 and name c ) 10.0 -120.0 30.0 2
!  Cys 27
assign (resid 26 and name c )  (resid 27 and name n )
       (resid 27 and name ca)  (resid 27 and name c ) 10.0 -120.0 30.0 2
!  Val 32
assign (resid 31 and name c )  (resid 32 and name n )
       (resid 32 and name ca)  (resid 32 and name c ) 10.0 -120.0 30.0 2
!  Lys 33
assign (resid 32 and name c )  (resid 33 and name n )
       (resid 33 and name ca)  (resid 33 and name c ) 10.0 -120.0 30.0 2
!  Cys 34
assign (resid 33 and name c )  (resid 34 and name n )
       (resid 34 and name ca)  (resid 34 and name c ) 10.0 -120.0 30.0 2
!  Cys 35
assign (resid 34 and name c )  (resid 35 and name n )
       (resid 35 and name ca)  (resid 35 and name c ) 10.0 -120.0 30.0 2
!  Arg 36
assign (resid 35 and name c )  (resid 36 and name n )
       (resid 36 and name ca)  (resid 36 and name c ) 10.0 -120.0 30.0 2
!
!--------------------------------------------------
! Xhi angles:
!  Cys 5
!  Asn 8
assign (resid 8 and name n )  (resid 8 and name ca)
       (resid 8 and name cb)  (resid 8 and name cg) 10.0 -60.0 20.0 2
!  Cys 12
assign (resid 12 and name n )  (resid 12 and name ca)
       (resid 12 and name cb)  (resid 12 and name sg) 10.0 -60.0 20.0 2
!  Arg 16
assign (resid 16 and name n )  (resid 16 and name ca)
       (resid 16 and name cb)  (resid 16 and name cg) 10.0 60.0 20.0 2
!  Cys 17
!  Met 21
assign (resid 21 and name n )  (resid 21 and name ca)
       (resid 21 and name cb)  (resid 21 and name cg) 10.0 180.0 20.0 2
!  Cys 27
assign (resid 27 and name n )  (resid 27 and name ca)
       (resid 27 and name cb)  (resid 27 and name sg) 10.0 -60.0 20.0 2
!  Cys 34
assign (resid 34 and name n )  (resid 34 and name ca)
       (resid 34 and name cb)  (resid 34 and name sg) 10.0 -60.0 20.0 2
!  Cys 35
assign (resid 35 and name n )  (resid 35 and name ca)
       (resid 35 and name cb)  (resid 35 and name sg) 10.0 -60.0 20.0 2
!  Trp 38
assign (resid 38 and name n )  (resid 38 and name ca)
       (resid 38 and name cb)  (resid 38 and name cg) 10.0 60.0 20.0 2
!--------------------------------------------------


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