NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type

16648 2ain cing 1-original 2 XPLOR/CNS dihedral angle

!REMARKS dihedral angles restraints
!
  assign (resid 5 and name c)  (resid 6 and name n)
         (resid 6 and name ca) (resid 6 and name c)     1.0  -120.0 40.0 2
  assign (resid 6 and name n)  (resid 6 and name ca)
         (resid 6 and name c)  (resid 7 and name n)     1.0  130.0 50.0 2
!
  assign (resid 6 and name c)  (resid 7 and name n)
         (resid 7 and name ca) (resid 7 and name c)     1.0  -120.0 40.0 2
  assign (resid 7 and name n)  (resid 7 and name ca)
         (resid 7 and name c)  (resid 8 and name n)     1.0  130.0 50.0 2
!
  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 40.0 2
  assign (resid 8 and name n)  (resid 8 and name ca)
         (resid 8 and name c)  (resid 9 and name n)     1.0  130.0 50.0 2
!
  assign (resid 8 and name c)  (resid 9 and name n)
         (resid 9 and name ca) (resid 9 and name c)     1.0  -120.0 40.0 2
  assign (resid 9 and name n)  (resid 9 and name ca)
         (resid 9 and name c)  (resid 10 and name n)     1.0  130.0 50.0 2
!
  assign (resid 9 and name c)  (resid 10 and name n)
         (resid 10 and name ca) (resid 10 and name c)     1.0  -120.0 40.0 2
  assign (resid 10 and name n)  (resid 10 and name ca)
         (resid 10 and name c)  (resid 11 and name n)     1.0  130.0 50.0 2
!
  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 40.0 2
  assign (resid 11 and name n)  (resid 11 and name ca)
         (resid 11 and name c)  (resid 12 and name n)     1.0  130.0 50.0 2
!
  assign (resid 11 and name c)  (resid 12 and name n)
         (resid 12 and name ca) (resid 12 and name c)     1.0  -120.0 40.0 2
  assign (resid 12 and name n)  (resid 12 and name ca)
         (resid 12 and name c)  (resid 13 and name n)     1.0  130.0 50.0 2
!
  assign (resid 18 and name c)  (resid 19 and name n)
         (resid 19 and name ca) (resid 19 and name c)     1.0  -120.0 40.0 2
  assign (resid 19 and name n)  (resid 19 and name ca)
         (resid 19 and name c)  (resid 20 and name n)     1.0  130.0 50.0 2
!
  assign (resid 19 and name c)  (resid 20 and name n)
         (resid 20 and name ca) (resid 20 and name c)     1.0  -120.0 40.0 2
  assign (resid 20 and name n)  (resid 20 and name ca)
         (resid 20 and name c)  (resid 21 and name n)     1.0  130.0 50.0 2
!
  assign (resid 20 and name c)  (resid 21 and name n)
         (resid 21 and name ca) (resid 21 and name c)     1.0  -120.0 40.0 2
  assign (resid 21 and name n)  (resid 21 and name ca)
         (resid 21 and name c)  (resid 22 and name n)     1.0  130.0 50.0 2
!
  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 40.0 2
  assign (resid 22 and name n)  (resid 22 and name ca)
         (resid 22 and name c)  (resid 23 and name n)     1.0  130.0 50.0 2
!
  assign (resid 22 and name c)  (resid 23 and name n)
         (resid 23 and name ca) (resid 23 and name c)     1.0  -120.0 40.0 2
  assign (resid 23 and name n)  (resid 23 and name ca)
         (resid 23 and name c)  (resid 24 and name n)     1.0  130.0 50.0 2
!
  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 40.0 2
  assign (resid 24 and name n)  (resid 24 and name ca)
         (resid 24 and name c)  (resid 25 and name n)     1.0  130.0 50.0 2
!
  assign (resid 24 and name c)  (resid 25 and name n)
         (resid 25 and name ca) (resid 25 and name c)     1.0  -120.0 40.0 2
  assign (resid 25 and name n)  (resid 25 and name ca)
         (resid 25 and name c)  (resid 26 and name n)     1.0  130.0 50.0 2
!
  assign (resid 43 and name c)  (resid 44 and name n)
         (resid 44 and name ca) (resid 44 and name c)     1.0  -60.0 40.0 2
  assign (resid 44 and name n)  (resid 44 and name ca)
         (resid 44 and name c)  (resid 45 and name n)     1.0  -50.0 50.0 2
!
  assign (resid 44 and name c)  (resid 45 and name n)
         (resid 45 and name ca) (resid 45 and name c)     1.0  -60.0 40.0 2
  assign (resid 45 and name n)  (resid 45 and name ca)
         (resid 45 and name c)  (resid 46 and name n)     1.0  -50.0 50.0 2
!
  assign (resid 45 and name c)  (resid 46 and name n)
         (resid 46 and name ca) (resid 46 and name c)     1.0  -60.0 40.0 2
  assign (resid 46 and name n)  (resid 46 and name ca)
         (resid 46 and name c)  (resid 47 and name n)     1.0  -50.0 50.0 2
!
  assign (resid 46 and name c)  (resid 47 and name n)
         (resid 47 and name ca) (resid 47 and name c)     1.0  -60.0 40.0 2
  assign (resid 47 and name n)  (resid 47 and name ca)
         (resid 47 and name c)  (resid 48 and name n)     1.0  -50.0 50.0 2
!
  assign (resid 47 and name c)  (resid 48 and name n)
         (resid 48 and name ca) (resid 48 and name c)     1.0  -60.0 40.0 2
  assign (resid 48 and name n)  (resid 48 and name ca)
         (resid 48 and name c)  (resid 49 and name n)     1.0  -50.0 50.0 2
!
  assign (resid 55 and name c)  (resid 56 and name n)
         (resid 56 and name ca) (resid 56 and name c)     1.0  -120.0 40.0 2
  assign (resid 56 and name n)  (resid 56 and name ca)
         (resid 56 and name c)  (resid 57 and name n)     1.0  130.0 50.0 2
!
  assign (resid 56 and name c)  (resid 57 and name n)
         (resid 57 and name ca) (resid 57 and name c)     1.0  -120.0 40.0 2
  assign (resid 57 and name n)  (resid 57 and name ca)
         (resid 57 and name c)  (resid 58 and name n)     1.0  130.0 50.0 2
!
  assign (resid 58 and name c)  (resid 59 and name n)
         (resid 59 and name ca) (resid 59 and name c)     1.0  -120.0 40.0 2
  assign (resid 59 and name n)  (resid 59 and name ca)
         (resid 59 and name c)  (resid 60 and name n)     1.0  130.0 50.0 2
!
  assign (resid 59 and name c)  (resid 60 and name n)
         (resid 60 and name ca) (resid 60 and name c)     1.0  -120.0 40.0 2
  assign (resid 60 and name n)  (resid 60 and name ca)
         (resid 60 and name c)  (resid 61 and name n)     1.0  130.0 50.0 2
!
  assign (resid 70 and name c)  (resid 71 and name n)
         (resid 71 and name ca) (resid 71 and name c)     1.0  -60.0 40.0 2
  assign (resid 71 and name n)  (resid 71 and name ca)
         (resid 71 and name c)  (resid 72 and name n)     1.0  -50.0 50.0 2
!
  assign (resid 71 and name c)  (resid 72 and name n)
         (resid 72 and name ca) (resid 72 and name c)     1.0  -60.0 40.0 2
  assign (resid 72 and name n)  (resid 72 and name ca)
         (resid 72 and name c)  (resid 73 and name n)     1.0  -50.0 50.0 2
!
  assign (resid 72 and name c)  (resid 73 and name n)
         (resid 73 and name ca) (resid 73 and name c)     1.0  -60.0 40.0 2
  assign (resid 73 and name n)  (resid 73 and name ca)
         (resid 73 and name c)  (resid 74 and name n)     1.0  -50.0 50.0 2
!
  assign (resid 73 and name c)  (resid 74 and name n)
         (resid 74 and name ca) (resid 74 and name c)     1.0  -60.0 40.0 2
  assign (resid 74 and name n)  (resid 74 and name ca)
         (resid 74 and name c)  (resid 75 and name n)     1.0  -50.0 50.0 2
!
  assign (resid 74 and name c)  (resid 75 and name n)
         (resid 75 and name ca) (resid 75 and name c)     1.0  -60.0 40.0 2
  assign (resid 75 and name n)  (resid 75 and name ca)
         (resid 75 and name c)  (resid 76 and name n)     1.0  -50.0 50.0 2
!
  assign (resid 75 and name c)  (resid 76 and name n)
         (resid 76 and name ca) (resid 76 and name c)     1.0  -60.0 40.0 2
  assign (resid 76 and name n)  (resid 76 and name ca)
         (resid 76 and name c)  (resid 77 and name n)     1.0  -50.0 50.0 2
!
  assign (resid 76 and name c)  (resid 77 and name n)
         (resid 77 and name ca) (resid 77 and name c)     1.0  -60.0 40.0 2
  assign (resid 77 and name n)  (resid 77 and name ca)
         (resid 77 and name c)  (resid 78 and name n)     1.0  -50.0 50.0 2
!
  assign (resid 82 and name c)  (resid 83 and name n)
         (resid 83 and name ca) (resid 83 and name c)     1.0  -120.0 40.0 2
  assign (resid 83 and name n)  (resid 83 and name ca)
         (resid 83 and name c)  (resid 84 and name n)     1.0  130.0 50.0 2
!
  assign (resid 83 and name c)  (resid 84 and name n)
         (resid 84 and name ca) (resid 84 and name c)     1.0  -120.0 40.0 2
  assign (resid 84 and name n)  (resid 84 and name ca)
         (resid 84 and name c)  (resid 85 and name n)     1.0  130.0 50.0 2
!
  assign (resid 84 and name c)  (resid 85 and name n)
         (resid 85 and name ca) (resid 85 and name c)     1.0  -120.0 40.0 2
  assign (resid 85 and name n)  (resid 85 and name ca)
         (resid 85 and name c)  (resid 86 and name n)     1.0  130.0 50.0 2
!
  assign (resid 85 and name c)  (resid 86 and name n)
         (resid 86 and name ca) (resid 86 and name c)     1.0  -120.0 40.0 2
  assign (resid 86 and name n)  (resid 86 and name ca)
         (resid 86 and name c)  (resid 87 and name n)     1.0  130.0 50.0 2
!
  assign (resid 86 and name c)  (resid 87 and name n)
         (resid 87 and name ca) (resid 87 and name c)     1.0  -120.0 40.0 2
  assign (resid 87 and name n)  (resid 87 and name ca)
         (resid 87 and name c)  (resid 88 and name n)     1.0  130.0 50.0 2
!
  assign (resid 87 and name c)  (resid 88 and name n)
         (resid 88 and name ca) (resid 88 and name c)     1.0  -120.0 40.0 2
  assign (resid 88 and name n)  (resid 88 and name ca)
         (resid 88 and name c)  (resid 89 and name n)     1.0  130.0 50.0 2
!
  assign (resid 88 and name c)  (resid 89 and name n)
         (resid 89 and name ca) (resid 89 and name c)     1.0  -120.0 40.0 2
  assign (resid 89 and name n)  (resid 89 and name ca)
         (resid 89 and name c)  (resid 90 and name n)     1.0  130.0 50.0 2
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Contact the webmaster for help, if required. Thursday, May 16, 2024 2:52:52 AM GMT (wattos1)
image	mrblock_id	pdb_id	cing	stage	position	program	type
	16648	2ain	cing	1-original	2	XPLOR/CNS	dihedral angle