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 |
|
|
653838 |
6uz5   |
30687 | cing | 1-original | 3 | XPLOR/CNS | dihedral angle |
# Restraints file 3: KTI55DL_K2_TALOS.tbl
! Phi/Psi Angles From 'Strong' TALOS-N Predictions:
! error margins are set to conservative default values of double the
! standard deviation observed in TALOS-N capped at a minimum of +/-20 degree.
!assign (resid 13 and name C ) (resid 14 and name N )
! (resid 14 and name CA ) (resid 14 and name C ) 1.0 -66.4 20.0 2
!assign (resid 14 and name N ) (resid 14 and name CA )
! (resid 14 and name C ) (resid 15 and name N ) 1.0 -36.5 20.0 2
!assign (resid 14 and name C ) (resid 15 and name N )
! (resid 15 and name CA ) (resid 15 and name C ) 1.0 -68.1 20.0 2
!assign (resid 15 and name N ) (resid 15 and name CA )
! (resid 15 and name C ) (resid 16 and name N ) 1.0 -40.1 20.0 2
assign (resid 15 and name C ) (resid 16 and name N )
(resid 16 and name CA ) (resid 16 and name C ) 1.0 -63.5 20.0 2
assign (resid 16 and name N ) (resid 16 and name CA )
(resid 16 and name C ) (resid 17 and name N ) 1.0 -42.9 20.0 2
assign (resid 16 and name C ) (resid 17 and name N )
(resid 17 and name CA ) (resid 17 and name C ) 1.0 -66.4 20.0 2
assign (resid 17 and name N ) (resid 17 and name CA )
(resid 17 and name C ) (resid 18 and name N ) 1.0 -39.0 20.0 2
assign (resid 17 and name C ) (resid 18 and name N )
(resid 18 and name CA ) (resid 18 and name C ) 1.0 -65.0 20.0 2
assign (resid 18 and name N ) (resid 18 and name CA )
(resid 18 and name C ) (resid 19 and name N ) 1.0 -39.5 20.0 2
assign (resid 18 and name C ) (resid 19 and name N )
(resid 19 and name CA ) (resid 19 and name C ) 1.0 -66.6 20.0 2
assign (resid 19 and name N ) (resid 19 and name CA )
(resid 19 and name C ) (resid 20 and name N ) 1.0 -39.1 20.0 2
assign (resid 19 and name C ) (resid 20 and name N )
(resid 20 and name CA ) (resid 20 and name C ) 1.0 -67.4 20.0 2
assign (resid 20 and name N ) (resid 20 and name CA )
(resid 20 and name C ) (resid 21 and name N ) 1.0 -38.1 20.0 2
!assign (resid 20 and name C ) (resid 21 and name N )
! (resid 21 and name CA ) (resid 21 and name C ) 1.0 -69.7 20.0 2
!assign (resid 21 and name N ) (resid 21 and name CA )
! (resid 21 and name C ) (resid 22 and name N ) 1.0 -34.1 20.0 2
!assign (resid 21 and name C ) (resid 22 and name N )
! (resid 22 and name CA ) (resid 22 and name C ) 1.0 -68.3 20.0 2
!assign (resid 22 and name N ) (resid 22 and name CA )
! (resid 22 and name C ) (resid 23 and name N ) 1.0 -36.4 20.0 2
assign (resid 22 and name C ) (resid 23 and name N )
(resid 23 and name CA ) (resid 23 and name C ) 1.0 -67.7 20.0 2
assign (resid 23 and name N ) (resid 23 and name CA )
(resid 23 and name C ) (resid 24 and name N ) 1.0 -38.5 20.0 2
assign (resid 23 and name C ) (resid 24 and name N )
(resid 24 and name CA ) (resid 24 and name C ) 1.0 -65.3 20.0 2
assign (resid 24 and name N ) (resid 24 and name CA )
(resid 24 and name C ) (resid 25 and name N ) 1.0 -38.2 20.0 2
!assign (resid 24 and name C ) (resid 25 and name N )
! (resid 25 and name CA ) (resid 25 and name C ) 1.0 -66.8 20.0 2
!assign (resid 25 and name N ) (resid 25 and name CA )
! (resid 25 and name C ) (resid 26 and name N ) 1.0 -35.8 20.0 2
!assign (resid 25 and name C ) (resid 26 and name N )
! (resid 26 and name CA ) (resid 26 and name C ) 1.0 -67.7 20.0 2
!assign (resid 26 and name N ) (resid 26 and name CA )
! (resid 26 and name C ) (resid 27 and name N ) 1.0 -39.2 20.0 2
assign (resid 26 and name C ) (resid 27 and name N )
(resid 27 and name CA ) (resid 27 and name C ) 1.0 -66.8 20.0 2
assign (resid 27 and name N ) (resid 27 and name CA )
(resid 27 and name C ) (resid 28 and name N ) 1.0 -37.1 20.0 2
assign (resid 27 and name C ) (resid 28 and name N )
(resid 28 and name CA ) (resid 28 and name C ) 1.0 -65.2 20.0 2
assign (resid 28 and name N ) (resid 28 and name CA )
(resid 28 and name C ) (resid 29 and name N ) 1.0 -42.8 20.0 2
assign (resid 28 and name C ) (resid 29 and name N )
(resid 29 and name CA ) (resid 29 and name C ) 1.0 -65.2 20.0 2
assign (resid 29 and name N ) (resid 29 and name CA )
(resid 29 and name C ) (resid 30 and name N ) 1.0 -38.2 20.0 2
!assign (resid 29 and name C ) (resid 30 and name N )
! (resid 30 and name CA ) (resid 30 and name C ) 1.0 -67.8 20.0 2
!assign (resid 30 and name N ) (resid 30 and name CA )
! (resid 30 and name C ) (resid 31 and name N ) 1.0 -31.4 22.6 2
!assign (resid 30 and name C ) (resid 31 and name N )
! (resid 31 and name CA ) (resid 31 and name C ) 1.0 -75.1 23.6 2
!assign (resid 31 and name N ) (resid 31 and name CA )
! (resid 31 and name C ) (resid 32 and name N ) 1.0 -28.1 31.5 2
!assign (resid 31 and name C ) (resid 32 and name N )
! (resid 32 and name CA ) (resid 32 and name C ) 1.0 -68.2 20.0 2
!assign (resid 32 and name N ) (resid 32 and name CA )
! (resid 32 and name C ) (resid 33 and name N ) 1.0 -36.7 20.0 2
!assign (resid 32 and name C ) (resid 33 and name N )
! (resid 33 and name CA ) (resid 33 and name C ) 1.0 -67.9 20.0 2
!assign (resid 33 and name N ) (resid 33 and name CA )
! (resid 33 and name C ) (resid 34 and name N ) 1.0 -37.2 20.0 2
assign (resid 33 and name C ) (resid 34 and name N )
(resid 34 and name CA ) (resid 34 and name C ) 1.0 -65.5 20.0 2
assign (resid 34 and name N ) (resid 34 and name CA )
(resid 34 and name C ) (resid 35 and name N ) 1.0 -41.7 20.0 2
assign (resid 34 and name C ) (resid 35 and name N )
(resid 35 and name CA ) (resid 35 and name C ) 1.0 -65.9 20.0 2
assign (resid 35 and name N ) (resid 35 and name CA )
(resid 35 and name C ) (resid 36 and name N ) 1.0 -37.2 20.0 2
assign (resid 35 and name C ) (resid 36 and name N )
(resid 36 and name CA ) (resid 36 and name C ) 1.0 -65.5 20.0 2
assign (resid 36 and name N ) (resid 36 and name CA )
(resid 36 and name C ) (resid 37 and name N ) 1.0 -40.6 20.0 2
assign (resid 36 and name C ) (resid 37 and name N )
(resid 37 and name CA ) (resid 37 and name C ) 1.0 -67.1 20.0 2
assign (resid 37 and name N ) (resid 37 and name CA )
(resid 37 and name C ) (resid 38 and name N ) 1.0 -37.9 20.0 2
assign (resid 37 and name C ) (resid 38 and name N )
(resid 38 and name CA ) (resid 38 and name C ) 1.0 -65.8 20.0 2
assign (resid 38 and name N ) (resid 38 and name CA )
(resid 38 and name C ) (resid 39 and name N ) 1.0 -40.1 20.0 2
assign (resid 38 and name C ) (resid 39 and name N )
(resid 39 and name CA ) (resid 39 and name C ) 1.0 -65.7 20.0 2
assign (resid 39 and name N ) (resid 39 and name CA )
(resid 39 and name C ) (resid 40 and name N ) 1.0 -37.9 20.0 2
!assign (resid 39 and name C ) (resid 40 and name N )
! (resid 40 and name CA ) (resid 40 and name C ) 1.0 -69.7 20.0 2
!assign (resid 40 and name N ) (resid 40 and name CA )
! (resid 40 and name C ) (resid 41 and name N ) 1.0 -37.7 20.0 2
!assign (resid 40 and name C ) (resid 41 and name N )
! (resid 41 and name CA ) (resid 41 and name C ) 1.0 -69.6 20.0 2
!assign (resid 41 and name N ) (resid 41 and name CA )
! (resid 41 and name C ) (resid 42 and name N ) 1.0 -34.5 20.0 2
!assign (resid 41 and name C ) (resid 42 and name N )
! (resid 42 and name CA ) (resid 42 and name C ) 1.0 -69.2 20.0 2
!assign (resid 42 and name N ) (resid 42 and name CA )
! (resid 42 and name C ) (resid 43 and name N ) 1.0 -35.1 20.0 2
!assign (resid 45 and name C ) (resid 46 and name N )
! (resid 46 and name CA ) (resid 46 and name C ) 1.0 -69.2 20.0 2
!assign (resid 46 and name N ) (resid 46 and name CA )
! (resid 46 and name C ) (resid 47 and name N ) 1.0 -35.5 20.0 2
!assign (resid 46 and name C ) (resid 47 and name N )
! (resid 47 and name CA ) (resid 47 and name C ) 1.0 -74.6 20.0 2
!assign (resid 47 and name N ) (resid 47 and name CA )
! (resid 47 and name C ) (resid 48 and name N ) 1.0 -25.2 24.4 2
!assign (resid 51 and name C ) (resid 52 and name N )
! (resid 52 and name CA ) (resid 52 and name C ) 1.0 -62.1 20.0 2
!assign (resid 52 and name N ) (resid 52 and name CA )
! (resid 52 and name C ) (resid 53 and name N ) 1.0 133.0 20.0 2
!assign (resid 52 and name C ) (resid 53 and name N )
! (resid 53 and name CA ) (resid 53 and name C ) 1.0 86.9 20.0 2
!assign (resid 53 and name N ) (resid 53 and name CA )
! (resid 53 and name C ) (resid 54 and name N ) 1.0 -3.0 20.0 2
! Phi/Psi Angles From 'Generous' TALOS-N Predictions:
! error margins are set to default values of triple the standard
! deviation observed in TALOS-N capped at a minimum of +/-20 degree.
!assign (resid 12 and name C ) (resid 13 and name N )
! (resid 13 and name CA ) (resid 13 and name C ) 1.0 -73.8 31.7 2
!assign (resid 13 and name N ) (resid 13 and name CA )
! (resid 13 and name C ) (resid 14 and name N ) 1.0 159.6 30.0 2
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