NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
545632 |
1ud7   |
4493 | cing | 1-original | 3 | XPLOR/CNS | dihedral angle |
!Dihedral restraints from dihedrals.pl.inp.ft
!
! extended structure or beta sheet with J = 8.1
assi (resid 1 and name C) (resid 2 and name N)
(resid 2 and name CA) (resid 2 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 9.8
assi (resid 2 and name C) (resid 3 and name N)
(resid 3 and name CA) (resid 3 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 9.8
assi (resid 3 and name C) (resid 4 and name N)
(resid 4 and name CA) (resid 4 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 9.6
assi (resid 4 and name C) (resid 5 and name N)
(resid 5 and name CA) (resid 5 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 9.7
assi (resid 5 and name C) (resid 6 and name N)
(resid 6 and name CA) (resid 6 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 8.4
assi (resid 6 and name C) (resid 7 and name N)
(resid 7 and name CA) (resid 7 and name C) 1 -120.0 20.0 2
! alpha helix with J = 4.4
assi (resid 7 and name C) (resid 8 and name N)
(resid 8 and name CA) (resid 8 and name C) 1 -60.0 20.0 2
! extended structure or beta sheet with J = 9.4
assi (resid 8 and name C) (resid 9 and name N)
(resid 9 and name CA) (resid 9 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 9.8
assi (resid 11 and name C) (resid 12 and name N)
(resid 12 and name CA) (resid 12 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 10.3
assi (resid 12 and name C) (resid 13 and name N)
(resid 13 and name CA) (resid 13 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 9.2
assi (resid 13 and name C) (resid 14 and name N)
(resid 14 and name CA) (resid 14 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 9.9
assi (resid 14 and name C) (resid 15 and name N)
(resid 15 and name CA) (resid 15 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 8.9
assi (resid 15 and name C) (resid 16 and name N)
(resid 16 and name CA) (resid 16 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 9.6
assi (resid 16 and name C) (resid 17 and name N)
(resid 17 and name CA) (resid 17 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 9.8
assi (resid 17 and name C) (resid 18 and name N)
(resid 18 and name CA) (resid 18 and name C) 1 -120.0 20.0 2
! alpha helix with J = 3.4
assi (resid 22 and name C) (resid 23 and name N)
(resid 23 and name CA) (resid 23 and name C) 1 -60.0 20.0 2
! alpha helix with J = 3.3
assi (resid 23 and name C) (resid 24 and name N)
(resid 24 and name CA) (resid 24 and name C) 1 -60.0 20.0 2
! alpha helix with J = 4.8
assi (resid 25 and name C) (resid 26 and name N)
(resid 26 and name CA) (resid 26 and name C) 1 -60.0 20.0 2
! alpha helix with J = 3.9
assi (resid 26 and name C) (resid 27 and name N)
(resid 27 and name CA) (resid 27 and name C) 1 -60.0 20.0 2
! alpha helix with J = 4.1
assi (resid 30 and name C) (resid 31 and name N)
(resid 31 and name CA) (resid 31 and name C) 1 -60.0 20.0 2
! alpha helix with J = 3.9
assi (resid 31 and name C) (resid 32 and name N)
(resid 32 and name CA) (resid 32 and name C) 1 -60.0 20.0 2
! extended structure or beta sheet with J = 9.8
assi (resid 33 and name C) (resid 34 and name N)
(resid 34 and name CA) (resid 34 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 8.7
assi (resid 35 and name C) (resid 36 and name N)
(resid 36 and name CA) (resid 36 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 10.1
assi (resid 39 and name C) (resid 40 and name N)
(resid 40 and name CA) (resid 40 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 8.1
assi (resid 40 and name C) (resid 41 and name N)
(resid 41 and name CA) (resid 41 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 9.9
assi (resid 41 and name C) (resid 42 and name N)
(resid 42 and name CA) (resid 42 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 9.7
assi (resid 42 and name C) (resid 43 and name N)
(resid 43 and name CA) (resid 43 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 10.3
assi (resid 43 and name C) (resid 44 and name N)
(resid 44 and name CA) (resid 44 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 9.0
assi (resid 44 and name C) (resid 45 and name N)
(resid 45 and name CA) (resid 45 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 9.3
assi (resid 50 and name C) (resid 51 and name N)
(resid 51 and name CA) (resid 51 and name C) 1 -120.0 20.0 2
! alpha helix with J = 3.4
assi (resid 51 and name C) (resid 52 and name N)
(resid 52 and name CA) (resid 52 and name C) 1 -60.0 20.0 2
! extended structure or beta sheet with J = 10.1
assi (resid 53 and name C) (resid 54 and name N)
(resid 54 and name CA) (resid 54 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 10.0
assi (resid 54 and name C) (resid 55 and name N)
(resid 55 and name CA) (resid 55 and name C) 1 -120.0 20.0 2
! alpha helix with J = 3.8
assi (resid 55 and name C) (resid 56 and name N)
(resid 56 and name CA) (resid 56 and name C) 1 -60.0 20.0 2
! alpha helix with J = 3.6
assi (resid 56 and name C) (resid 57 and name N)
(resid 57 and name CA) (resid 57 and name C) 1 -60.0 20.0 2
! alpha helix with J = 4.9
assi (resid 57 and name C) (resid 58 and name N)
(resid 58 and name CA) (resid 58 and name C) 1 -60.0 20.0 2
! extended structure or beta sheet with J = 10.2
assi (resid 58 and name C) (resid 59 and name N)
(resid 59 and name CA) (resid 59 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 10.1
assi (resid 61 and name C) (resid 62 and name N)
(resid 62 and name CA) (resid 62 and name C) 1 -120.0 20.0 2
! alpha helix with J = 2.3
assi (resid 62 and name C) (resid 63 and name N)
(resid 63 and name CA) (resid 63 and name C) 1 -60.0 20.0 2
! extended structure or beta sheet with J = 10.0
assi (resid 65 and name C) (resid 66 and name N)
(resid 66 and name CA) (resid 66 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 10.1
assi (resid 66 and name C) (resid 67 and name N)
(resid 67 and name CA) (resid 67 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 9.5
assi (resid 67 and name C) (resid 68 and name N)
(resid 68 and name CA) (resid 68 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 9.1
assi (resid 68 and name C) (resid 69 and name N)
(resid 69 and name CA) (resid 69 and name C) 1 -120.0 20.0 2
! extended structure or beta sheet with J = 10.1
assi (resid 69 and name C) (resid 70 and name N)
(resid 70 and name CA) (resid 70 and name C) 1 -120.0 20.0 2
! ********** The following constraints added because the sequential
! (i-1)HA - (i)HN noe's and roe's are greater than the intraresidue
! (i)HA - (i)HN noe/roe.
assi (resid 48 and name C) (resid 49 and name N)
(resid 49 and name CA) (resid 49 and name C) 1 -90.0 90.0 2
assi (resid 49 and name C) (resid 50 and name N)
(resid 50 and name CA) (resid 50 and name C) 1 -90.0 90.0 2
assi (resid 52 and name C) (resid 53 and name N)
(resid 53 and name CA) (resid 53 and name C) 1 -90.0 90.0 2
assi (resid 70 and name C) (resid 71 and name N)
(resid 71 and name CA) (resid 71 and name C) 1 -90.0 90.0 2
{chi1_071197.tbl}
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