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 |
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630414 |
6coo   |
30427 | cing | 1-original | 2 | XPLOR/CNS | dihedral angle |
# Restraints file 2: CSP1E1A_phi_psi_dihe.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 3 and name C ) (resid 4 and name N )
(resid 4 and name CA ) (resid 4 and name C ) 1.0 -67.0 20.0 2
assign (resid 4 and name N ) (resid 4 and name CA )
(resid 4 and name C ) (resid 5 and name N ) 1.0 -37.6 20.0 2
assign (resid 4 and name C ) (resid 5 and name N )
(resid 5 and name CA ) (resid 5 and name C ) 1.0 -64.5 20.0 2
assign (resid 5 and name N ) (resid 5 and name CA )
(resid 5 and name C ) (resid 6 and name N ) 1.0 -37.8 20.0 2
assign (resid 5 and name C ) (resid 6 and name N )
(resid 6 and name CA ) (resid 6 and name C ) 1.0 -67.1 20.0 2
assign (resid 6 and name N ) (resid 6 and name CA )
(resid 6 and name C ) (resid 7 and name N ) 1.0 -39.8 20.0 2
assign (resid 6 and name C ) (resid 7 and name N )
(resid 7 and name CA ) (resid 7 and name C ) 1.0 -65.1 20.0 2
assign (resid 7 and name N ) (resid 7 and name CA )
(resid 7 and name C ) (resid 8 and name N ) 1.0 -44.9 20.0 2
assign (resid 7 and name C ) (resid 8 and name N )
(resid 8 and name CA ) (resid 8 and name C ) 1.0 -65.0 20.0 2
assign (resid 8 and name N ) (resid 8 and name CA )
(resid 8 and name C ) (resid 9 and name N ) 1.0 -38.5 20.0 2
assign (resid 8 and name C ) (resid 9 and name N )
(resid 9 and name CA ) (resid 9 and name C ) 1.0 -62.5 20.0 2
assign (resid 9 and name N ) (resid 9 and name CA )
(resid 9 and name C ) (resid 10 and name N ) 1.0 -41.5 20.0 2
assign (resid 9 and name C ) (resid 10 and name N )
(resid 10 and name CA ) (resid 10 and name C ) 1.0 -65.2 20.0 2
assign (resid 10 and name N ) (resid 10 and name CA )
(resid 10 and name C ) (resid 11 and name N ) 1.0 -38.3 20.0 2
assign (resid 10 and name C ) (resid 11 and name N )
(resid 11 and name CA ) (resid 11 and name C ) 1.0 -66.1 20.0 2
assign (resid 11 and name N ) (resid 11 and name CA )
(resid 11 and name C ) (resid 12 and name N ) 1.0 -42.0 20.0 2
assign (resid 11 and name C ) (resid 12 and name N )
(resid 12 and name CA ) (resid 12 and name C ) 1.0 -66.0 20.0 2
assign (resid 12 and name N ) (resid 12 and name CA )
(resid 12 and name C ) (resid 13 and name N ) 1.0 -38.0 20.0 2
assign (resid 12 and name C ) (resid 13 and name N )
(resid 13 and name CA ) (resid 13 and name C ) 1.0 -65.2 20.0 2
assign (resid 13 and name N ) (resid 13 and name CA )
(resid 13 and name C ) (resid 14 and name N ) 1.0 -37.3 20.0 2
assign (resid 13 and name C ) (resid 14 and name N )
(resid 14 and name CA ) (resid 14 and name C ) 1.0 -69.5 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 -29.8 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 -85.0 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 -12.7 24.6 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 15 and name C ) (resid 16 and name N )
(resid 16 and name CA ) (resid 16 and name C ) 1.0 -69.7 30.0 2
assign (resid 16 and name N ) (resid 16 and name CA )
(resid 16 and name C ) (resid 17 and name N ) 1.0 138.2 32.7 2
assign (resid 3 and name N ) (resid 3 and name CA )
(resid 3 and name CB ) (resid 3 and name CG ) 1.0 -60.0 30.0 2
assign (resid 4 and name N ) (resid 4 and name CA )
(resid 4 and name CB ) (resid 4 and name CG ) 1.0 -60.0 30.0 2
assign (resid 7 and name N ) (resid 7 and name CA )
(resid 7 and name CB ) (resid 7 and name CG ) 1.0 -60.0 30.0 2
assign (resid 8 and name N ) (resid 8 and name CA )
(resid 8 and name CB ) (resid 8 and name CG ) 1.0 -60.0 30.0 2
assign (resid 10 and name N ) (resid 10 and name CA )
(resid 10 and name CB ) (resid 10 and name CG ) 1.0 -60.0 30.0 2
assign (resid 11 and name N ) (resid 11 and name CA )
(resid 11 and name CB ) (resid 11 and name CG ) 1.0 -60.0 30.0 2
assign (resid 12 and name N ) (resid 12 and name CA )
(resid 12 and name CB ) (resid 12 and name CG ) 1.0 -60.0 30.0 2
assign (resid 13 and name N ) (resid 13 and name CA )
(resid 13 and name CB ) (resid 13 and name CG ) 1.0 -60.0 30.0 2
assign (resid 14 and name N ) (resid 14 and name CA )
(resid 14 and name CB ) (resid 14 and name CG ) 1.0 -60.0 30.0 2
assign (resid 15 and name N ) (resid 15 and name CA )
(resid 15 and name CB ) (resid 15 and name CG ) 1.0 -60.0 30.0 2
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