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 |
|
|
12014 |
1se7   |
6127 | cing | 1-original | 1 | XPLOR/CNS | dihedral angle |
! Talos Database predictions rerun by GM 030399
! Chemical shifts corrected for deuteration HVIL labeling
! Talos recompiled without mbp in database.
{* PHI restraints from Luginbuehl et al., JMR B 109(1995):229-233 *}
{* Helix: -120...-20 = -70.0 50.0 2 *}
{* Sheet: 160...180...-80 = -140.0 60.0 2 *}
{* PSI restraints --- see note above *}
{* Helix: -100...0 = -50.0 50.0 2 *}
{* Sheet: 40.0...180.0...-140.0 = 130.0 90.0 2 *}
!Talos predictions take precedance.
! Resdiue D 3 DATABASE
assign (resid 2 and name C )(resid 3 and name N )
(resid 3 and name CA )(resid 3 and name C ) 1.0 -81.23 32.88 2
assign (resid 3 and name N )(resid 3 and name CA )
(resid 3 and name C )(resid 4 and name N ) 1.0 133.07 37.40 2
! Resdiue Q 11 DATABASE
assign (resid 10 and name C )(resid 11 and name N )
(resid 11 and name CA )(resid 11 and name C ) 1.0 -64.00 20.00 2
assign (resid 11 and name N )(resid 11 and name CA )
(resid 11 and name C )(resid 12 and name N ) 1.0 -35.00 30.00 2
! Resdiue E 12 DATABASE
assign (resid 11 and name C )(resid 12 and name N )
(resid 12 and name CA )(resid 12 and name C ) 1.0 -66.00 20.00 2
assign (resid 12 and name N )(resid 12 and name CA )
(resid 12 and name C )(resid 13 and name N ) 1.0 -39.00 20.00 2
! Resdiue E 13 DATABASE
assign (resid 12 and name C )(resid 13 and name N )
(resid 13 and name CA )(resid 13 and name C ) 1.0 -63.00 20.00 2
assign (resid 13 and name N )(resid 13 and name CA )
(resid 13 and name C )(resid 14 and name N ) 1.0 -43.00 26.00 2
! Resdiue R 14 DATABASE
assign (resid 13 and name C )(resid 14 and name N )
(resid 14 and name CA )(resid 14 and name C ) 1.0 -65.00 20.00 2
assign (resid 14 and name N )(resid 14 and name CA )
(resid 14 and name C )(resid 15 and name N ) 1.0 -44.00 20.00 2
! Resdiue D 15 DATABASE
assign (resid 14 and name C )(resid 15 and name N )
(resid 15 and name CA )(resid 15 and name C ) 1.0 -62.00 20.00 2
assign (resid 15 and name N )(resid 15 and name CA )
(resid 15 and name C )(resid 16 and name N ) 1.0 -38.00 20.00 2
! Resdiue K 16 DATABASE
assign (resid 15 and name C )(resid 16 and name N )
(resid 16 and name CA )(resid 16 and name C ) 1.0 -65.00 20.00 2
assign (resid 16 and name N )(resid 16 and name CA )
(resid 16 and name C )(resid 17 and name N ) 1.0 -42.00 20.00 2
! Resdiue V 17 DATABASE
assign (resid 16 and name C )(resid 17 and name N )
(resid 17 and name CA )(resid 17 and name C ) 1.0 -63.00 26.00 2
assign (resid 17 and name N )(resid 17 and name CA )
(resid 17 and name C )(resid 18 and name N ) 1.0 -37.00 20.00 2
! Resdiue N 18 DATABASE
assign (resid 17 and name C )(resid 18 and name N )
(resid 18 and name CA )(resid 18 and name C ) 1.0 -65.13 20.00 2
assign (resid 18 and name N )(resid 18 and name CA )
(resid 18 and name C )(resid 19 and name N ) 1.0 -40.36 20.00 2
! Resdiue V 19 DATABASE
assign (resid 18 and name C )(resid 19 and name N )
(resid 19 and name CA )(resid 19 and name C ) 1.0 -70.74 20.00 2
assign (resid 19 and name N )(resid 19 and name CA )
(resid 19 and name C )(resid 20 and name N ) 1.0 -42.92 20.00 2
! Resdiue D 20 DATABASE
assign (resid 19 and name C )(resid 20 and name N )
(resid 20 and name CA )(resid 20 and name C ) 1.0 -64.27 20.00 2
assign (resid 20 and name N )(resid 20 and name CA )
(resid 20 and name C )(resid 21 and name N ) 1.0 -39.82 20.00 2
! Resdiue L 21 DATABASE
assign (resid 20 and name C )(resid 21 and name N )
(resid 21 and name CA )(resid 21 and name C ) 1.0 -66.81 20.00 2
assign (resid 21 and name N )(resid 21 and name CA )
(resid 21 and name C )(resid 22 and name N ) 1.0 -38.84 24.48 2
! Resdiue A 22 DATABASE
assign (resid 21 and name C )(resid 22 and name N )
(resid 22 and name CA )(resid 22 and name C ) 1.0 -67.18 20.00 2
assign (resid 22 and name N )(resid 22 and name CA )
(resid 22 and name C )(resid 23 and name N ) 1.0 -40.01 20.00 2
! Resdiue A 23 DATABASE
assign (resid 22 and name C )(resid 23 and name N )
(resid 23 and name CA )(resid 23 and name C ) 1.0 -63.73 20.00 2
assign (resid 23 and name N )(resid 23 and name CA )
(resid 23 and name C )(resid 24 and name N ) 1.0 -43.89 20.00 2
! Resdiue S 24 DATABASE
assign (resid 23 and name C )(resid 24 and name N )
(resid 24 and name CA )(resid 24 and name C ) 1.0 -64.33 20.00 2
assign (resid 24 and name N )(resid 24 and name CA )
(resid 24 and name C )(resid 25 and name N ) 1.0 -41.77 20.00 2
! Resdiue G 25 DATABASE
assign (resid 24 and name C )(resid 25 and name N )
(resid 25 and name CA )(resid 25 and name C ) 1.0 -68.00 20.00 2
assign (resid 25 and name N )(resid 25 and name CA )
(resid 25 and name C )(resid 26 and name N ) 1.0 -40.00 20.00 2
! Resdiue V 26 DATABASE
assign (resid 25 and name C )(resid 26 and name N )
(resid 26 and name CA )(resid 26 and name C ) 1.0 -60.00 22.00 2
assign (resid 26 and name N )(resid 26 and name CA )
(resid 26 and name C )(resid 27 and name N ) 1.0 -40.00 20.00 2
! Resdiue A 27 DATABASE
assign (resid 26 and name C )(resid 27 and name N )
(resid 27 and name CA )(resid 27 and name C ) 1.0 -67.00 20.00 2
assign (resid 27 and name N )(resid 27 and name CA )
(resid 27 and name C )(resid 28 and name N ) 1.0 -35.00 20.00 2
! Resdiue Y 28 DATABASE
assign (resid 27 and name C )(resid 28 and name N )
(resid 28 and name CA )(resid 28 and name C ) 1.0 -66.00 20.00 2
assign (resid 28 and name N )(resid 28 and name CA )
(resid 28 and name C )(resid 29 and name N ) 1.0 -44.00 20.00 2
! Resdiue K 29 DATABASE
assign (resid 28 and name C )(resid 29 and name N )
(resid 29 and name CA )(resid 29 and name C ) 1.0 -65.00 20.00 2
assign (resid 29 and name N )(resid 29 and name CA )
(resid 29 and name C )(resid 30 and name N ) 1.0 -40.00 20.00 2
! Resdiue I 34 DATABASE
assign (resid 33 and name C )(resid 34 and name N )
(resid 34 and name CA )(resid 34 and name C ) 1.0 -109.00 52.00 2
assign (resid 34 and name N )(resid 34 and name CA )
(resid 34 and name C )(resid 35 and name N ) 1.0 145.00 72.00 2
! Resdiue V 36 DATABASE
assign (resid 35 and name C )(resid 36 and name N )
(resid 36 and name CA )(resid 36 and name C ) 1.0 -112.00 68.00 2
assign (resid 36 and name N )(resid 36 and name CA )
(resid 36 and name C )(resid 37 and name N ) 1.0 120.00 42.00 2
! Resdiue I 37 DATABASE
assign (resid 36 and name C )(resid 37 and name N )
(resid 37 and name CA )(resid 37 and name C ) 1.0 -97.00 48.00 2
assign (resid 37 and name N )(resid 37 and name CA )
(resid 37 and name C )(resid 38 and name N ) 1.0 119.00 44.00 2
! Resdiue A 38 DATABASE
assign (resid 37 and name C )(resid 38 and name N )
(resid 38 and name CA )(resid 38 and name C ) 1.0 -62.00 20.00 2
assign (resid 38 and name N )(resid 38 and name CA )
(resid 38 and name C )(resid 39 and name N ) 1.0 -32.00 20.00 2
! Resdiue E 39 DATABASE
assign (resid 38 and name C )(resid 39 and name N )
(resid 39 and name CA )(resid 39 and name C ) 1.0 -64.00 20.00 2
assign (resid 39 and name N )(resid 39 and name CA )
(resid 39 and name C )(resid 40 and name N ) 1.0 -38.00 20.00 2
! Resdiue Q 40 DATABASE
assign (resid 39 and name C )(resid 40 and name N )
(resid 40 and name CA )(resid 40 and name C ) 1.0 -64.00 20.00 2
assign (resid 40 and name N )(resid 40 and name CA )
(resid 40 and name C )(resid 41 and name N ) 1.0 -47.00 20.00 2
! Resdiue V 41 DATABASE
assign (resid 40 and name C )(resid 41 and name N )
(resid 41 and name CA )(resid 41 and name C ) 1.0 -71.00 20.00 2
assign (resid 41 and name N )(resid 41 and name CA )
(resid 41 and name C )(resid 42 and name N ) 1.0 -39.00 20.00 2
! Resdiue A 42 DATABASE
assign (resid 41 and name C )(resid 42 and name N )
(resid 42 and name CA )(resid 42 and name C ) 1.0 -67.00 20.00 2
assign (resid 42 and name N )(resid 42 and name CA )
(resid 42 and name C )(resid 43 and name N ) 1.0 -36.00 20.00 2
! Resdiue R 43 DATABASE
assign (resid 42 and name C )(resid 43 and name N )
(resid 43 and name CA )(resid 43 and name C ) 1.0 -70.00 20.00 2
assign (resid 43 and name N )(resid 43 and name CA )
(resid 43 and name C )(resid 44 and name N ) 1.0 -27.00 20.00 2
! Resdiue E 44 DATABASE
assign (resid 43 and name C )(resid 44 and name N )
(resid 44 and name CA )(resid 44 and name C ) 1.0 -90.00 30.00 2
assign (resid 44 and name N )(resid 44 and name CA )
(resid 44 and name C )(resid 45 and name N ) 1.0 -24.00 44.00 2
! Resdiue E 47 DATABASE
assign (resid 46 and name C )(resid 47 and name N )
(resid 47 and name CA )(resid 47 and name C ) 1.0 -65.00 20.00 2
assign (resid 47 and name N )(resid 47 and name CA )
(resid 47 and name C )(resid 48 and name N ) 1.0 -32.00 20.00 2
! Resdiue R 50 DATABASE
assign (resid 49 and name C )(resid 50 and name N )
(resid 50 and name CA )(resid 50 and name C ) 1.0 -62.00 20.00 2
assign (resid 50 and name N )(resid 50 and name CA )
(resid 50 and name C )(resid 51 and name N ) 1.0 -39.00 20.00 2
! Resdiue T 51 DATABASE
assign (resid 50 and name C )(resid 51 and name N )
(resid 51 and name CA )(resid 51 and name C ) 1.0 -71.14 20.00 2
assign (resid 51 and name N )(resid 51 and name CA )
(resid 51 and name C )(resid 52 and name N ) 1.0 -36.01 20.00 2
! Resdiue Y 52 DATABASE
assign (resid 51 and name C )(resid 52 and name N )
(resid 52 and name CA )(resid 52 and name C ) 1.0 -67.30 20.00 2
assign (resid 52 and name N )(resid 52 and name CA )
(resid 52 and name C )(resid 53 and name N ) 1.0 -41.84 20.00 2
! Resdiue F 53 DATABASE
assign (resid 52 and name C )(resid 53 and name N )
(resid 53 and name CA )(resid 53 and name C ) 1.0 -66.59 20.00 2
assign (resid 53 and name N )(resid 53 and name CA )
(resid 53 and name C )(resid 54 and name N ) 1.0 -39.93 20.00 2
! Resdiue M 54 DATABASE
assign (resid 53 and name C )(resid 54 and name N )
(resid 54 and name CA )(resid 54 and name C ) 1.0 -62.04 20.00 2
assign (resid 54 and name N )(resid 54 and name CA )
(resid 54 and name C )(resid 55 and name N ) 1.0 -38.10 20.60 2
! Resdiue E 55 DATABASE
assign (resid 54 and name C )(resid 55 and name N )
(resid 55 and name CA )(resid 55 and name C ) 1.0 -64.34 20.00 2
assign (resid 55 and name N )(resid 55 and name CA )
(resid 55 and name C )(resid 56 and name N ) 1.0 -41.65 20.00 2
! Resdiue R 56 DATABASE
assign (resid 55 and name C )(resid 56 and name N )
(resid 56 and name CA )(resid 56 and name C ) 1.0 -67.00 20.00 2
assign (resid 56 and name N )(resid 56 and name CA )
(resid 56 and name C )(resid 57 and name N ) 1.0 -32.00 32.00 2
! Resdiue L 57 DATABASE
assign (resid 56 and name C )(resid 57 and name N )
(resid 57 and name CA )(resid 57 and name C ) 1.0 -66.00 20.00 2
assign (resid 57 and name N )(resid 57 and name CA )
(resid 57 and name C )(resid 58 and name N ) 1.0 -41.00 20.00 2
! Resdiue R 58 DATABASE
assign (resid 57 and name C )(resid 58 and name N )
(resid 58 and name CA )(resid 58 and name C ) 1.0 -64.62 20.00 2
assign (resid 58 and name N )(resid 58 and name CA )
(resid 58 and name C )(resid 59 and name N ) 1.0 -39.18 20.00 2
! Resdiue H 59 DATABASE
assign (resid 58 and name C )(resid 59 and name N )
(resid 59 and name CA )(resid 59 and name C ) 1.0 -65.12 20.00 2
assign (resid 59 and name N )(resid 59 and name CA )
(resid 59 and name C )(resid 60 and name N ) 1.0 -43.28 20.00 2
! Resdiue Y 60 DATABASE
assign (resid 59 and name C )(resid 60 and name N )
(resid 60 and name CA )(resid 60 and name C ) 1.0 -63.95 20.00 2
assign (resid 60 and name N )(resid 60 and name CA )
(resid 60 and name C )(resid 61 and name N ) 1.0 -36.50 20.00 2
! Resdiue R 61 DATABASE
assign (resid 60 and name C )(resid 61 and name N )
(resid 61 and name CA )(resid 61 and name C ) 1.0 -67.42 20.00 2
assign (resid 61 and name N )(resid 61 and name CA )
(resid 61 and name C )(resid 62 and name N ) 1.0 -38.98 20.00 2
! Resdiue Q 62 DATABASE
assign (resid 61 and name C )(resid 62 and name N )
(resid 62 and name CA )(resid 62 and name C ) 1.0 -67.83 20.00 2
assign (resid 62 and name N )(resid 62 and name CA )
(resid 62 and name C )(resid 63 and name N ) 1.0 -40.42 20.16 2
! Resdiue L 63 DATABASE
assign (resid 62 and name C )(resid 63 and name N )
(resid 63 and name CA )(resid 63 and name C ) 1.0 -67.00 20.00 2
assign (resid 63 and name N )(resid 63 and name CA )
(resid 63 and name C )(resid 64 and name N ) 1.0 -30.00 30.00 2
! Resdiue S 64 DATABASE
assign (resid 63 and name C )(resid 64 and name N )
(resid 64 and name CA )(resid 64 and name C ) 1.0 -67.00 20.00 2
assign (resid 64 and name N )(resid 64 and name CA )
(resid 64 and name C )(resid 65 and name N ) 1.0 -21.00 34.00 2
! Resdiue L 65 DATABASE
assign (resid 64 and name C )(resid 65 and name N )
(resid 65 and name CA )(resid 65 and name C ) 1.0 -80.00 32.00 2
assign (resid 65 and name N )(resid 65 and name CA )
(resid 65 and name C )(resid 66 and name N ) 1.0 -20.00 32.00 2
! Resdiue L 67 DATABASE
assign (resid 66 and name C )(resid 67 and name N )
(resid 67 and name CA )(resid 67 and name C ) 1.0 -94.00 50.00 2
assign (resid 67 and name N )(resid 67 and name CA )
(resid 67 and name C )(resid 68 and name N ) 1.0 131.00 72.00 2
! Resdiue Q 76 DATABASE
assign (resid 75 and name C )(resid 76 and name N )
(resid 76 and name CA )(resid 76 and name C ) 1.0 -88.00 32.00 2
assign (resid 76 and name N )(resid 76 and name CA )
(resid 76 and name C )(resid 77 and name N ) 1.0 139.00 46.00 2
! Resdiue K 77 DATABASE
assign (resid 76 and name C )(resid 77 and name N )
(resid 77 and name CA )(resid 77 and name C ) 1.0 -91.00 42.00 2
assign (resid 77 and name N )(resid 77 and name CA )
(resid 77 and name C )(resid 78 and name N ) 1.0 129.00 48.00 2
! Resdiue K 82 DATABASE
assign (resid 81 and name C )(resid 82 and name N )
(resid 82 and name CA )(resid 82 and name C ) 1.0 -97.00 50.00 2
assign (resid 82 and name N )(resid 82 and name CA )
(resid 82 and name C )(resid 83 and name N ) 1.0 110.00 40.00 2
set message=on echo=on end
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