NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
|
|
465937 |
2xeb   |
cing | 1-original | 3 | XPLOR/CNS | dihedral angle |
! alpha: derived on the basis of 31P chemical shifts derived with HCP-experiment
! beta: loose non-experimental restraints were added for helical region (180°± 60°)
! gamma: obtained with E-COSY
! epsilon: loose non-experimental restraints were added for helical region (-135° ± 60°)
! zeta: derived on the basis of 31P chemical shifts derived with HCP-experiment
!---------segidA----------------------------------------------
assign (segid A and resid 19 and name O5') (segid A and resid 19 and name C5')
(segid A and resid 19 and name C4') (segid A and resid 19 and name C3') 1.0 55.0 40.0 2 ! gamma
assign (segid A and resid 19 and name C3') (segid A and resid 19 and name O3')
(segid A and resid 20 and name P ) (segid A and resid 20 and name O5') 1.0 0.0 120.0 2 ! zeta
assign (segid A and resid 19 and name O3') (segid A and resid 20 and name P )
(segid A and resid 20 and name O5') (segid A and resid 20 and name C5') 1.0 0.0 120.0 2 ! alpha
assign (segid A and resid 20 and name P ) (segid A and resid 20 and name O5')
(segid A and resid 20 and name C5') (segid A and resid 20 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid A and resid 20 and name C4') (segid A and resid 20 and name C3')
(segid A and resid 20 and name O3') (segid A and resid 21 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid A and resid 20 and name C3') (segid A and resid 20 and name O3')
(segid A and resid 21 and name P ) (segid A and resid 21 and name O5') 1.0 0.0 120.0 2 ! zeta
assign (segid A and resid 20 and name O3') (segid A and resid 21 and name P )
(segid A and resid 21 and name O5') (segid A and resid 21 and name C5') 1.0 0.0 120.0 2 ! alpha
assign (segid A and resid 21 and name P ) (segid A and resid 21 and name O5')
(segid A and resid 21 and name C5') (segid A and resid 21 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid A and resid 21 and name C4') (segid A and resid 21 and name C3')
(segid A and resid 21 and name O3') (segid A and resid 22 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid A and resid 22 and name P ) (segid A and resid 22 and name O5')
(segid A and resid 22 and name C5') (segid A and resid 22 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid A and resid 22 and name C4') (segid A and resid 22 and name C3')
(segid A and resid 22 and name O3') (segid A and resid 23 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid A and resid 22 and name C3') (segid A and resid 22 and name O3')
(segid A and resid 23 and name P ) (segid A and resid 23 and name O5') 1.0 0.0 120.0 2 ! zeta
assign (segid A and resid 22 and name O3') (segid A and resid 23 and name P )
(segid A and resid 23 and name O5') (segid A and resid 23 and name C5') 1.0 0.0 120.0 2 ! alpha
assign (segid A and resid 23 and name P ) (segid A and resid 23 and name O5')
(segid A and resid 23 and name C5') (segid A and resid 23 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid A and resid 23 and name O5') (segid A and resid 23 and name C5')
(segid A and resid 23 and name C4') (segid A and resid 23 and name C3') 1.0 55.0 40.0 2 ! gamma
assign (segid A and resid 23 and name C4') (segid A and resid 23 and name C3')
(segid A and resid 23 and name O3') (segid A and resid 24 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid A and resid 24 and name P ) (segid A and resid 24 and name O5')
(segid A and resid 24 and name C5') (segid A and resid 24 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid A and resid 24 and name O5') (segid A and resid 24 and name C5')
(segid A and resid 24 and name C4') (segid A and resid 24 and name C3') 1.0 55.0 40.0 2 ! gamma
assign (segid A and resid 24 and name C4') (segid A and resid 24 and name C3')
(segid A and resid 24 and name O3') (segid A and resid 25 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid A and resid 25 and name O5') (segid A and resid 25 and name C5')
(segid A and resid 25 and name C4') (segid A and resid 25 and name C3') 1.0 55.0 40.0 2 ! gamma
assign (segid A and resid 26 and name P ) (segid A and resid 26 and name O5')
(segid A and resid 26 and name C5') (segid A and resid 26 and name C4') 1.0 180.0 120.0 2 ! beta
assign (segid A and resid 26 and name O5') (segid A and resid 26 and name C5')
(segid A and resid 26 and name C4') (segid A and resid 26 and name C3') 1.0 55.0 40.0 2 ! gamma
assign (segid A and resid 26 and name C4') (segid A and resid 26 and name C3')
(segid A and resid 26 and name O3') (segid A and resid 27 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid A and resid 27 and name P ) (segid A and resid 27 and name O5')
(segid A and resid 27 and name C5') (segid A and resid 27 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid A and resid 27 and name C4') (segid A and resid 27 and name C3')
(segid A and resid 27 and name O3') (segid A and resid 28 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid A and resid 28 and name P ) (segid A and resid 28 and name O5')
(segid A and resid 28 and name C5') (segid A and resid 28 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid A and resid 28 and name O5') (segid A and resid 28 and name C5')
(segid A and resid 28 and name C4') (segid A and resid 28 and name C3') 1.0 55.0 40.0 2 ! gamma
assign (segid A and resid 28 and name C3') (segid A and resid 28 and name O3')
(segid A and resid 29 and name P ) (segid A and resid 29 and name O5') 1.0 0.0 120.0 2 ! zeta
assign (segid A and resid 28 and name O3') (segid A and resid 29 and name P )
(segid A and resid 29 and name O5') (segid A and resid 29 and name C5') 1.0 0.0 120.0 2 ! alpha
assign (segid A and resid 31 and name O5') (segid A and resid 31 and name C5')
(segid A and resid 31 and name C4') (segid A and resid 31 and name C3') 1.0 55.0 40.0 2 ! gamma
assign (segid A and resid 32 and name C4') (segid A and resid 32 and name C3')
(segid A and resid 32 and name O3') (segid A and resid 33 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid A and resid 33 and name P ) (segid A and resid 33 and name O5')
(segid A and resid 33 and name C5') (segid A and resid 33 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid A and resid 33 and name C4') (segid A and resid 33 and name C3')
(segid A and resid 33 and name O3') (segid A and resid 34 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid A and resid 33 and name C3') (segid A and resid 33 and name O3')
(segid A and resid 34 and name P ) (segid A and resid 34 and name O5') 1.0 0.0 120.0 2 ! zeta
assign (segid A and resid 33 and name O3') (segid A and resid 34 and name P )
(segid A and resid 34 and name O5') (segid A and resid 34 and name C5') 1.0 0.0 120.0 2 ! alpha
assign (segid A and resid 34 and name P ) (segid A and resid 34 and name O5')
(segid A and resid 34 and name C5') (segid A and resid 34 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid A and resid 34 and name O5') (segid A and resid 34 and name C5')
(segid A and resid 34 and name C4') (segid A and resid 34 and name C3') 1.0 55.0 40.0 2 ! gamma
assign (segid A and resid 34 and name C4') (segid A and resid 34 and name C3')
(segid A and resid 34 and name O3') (segid A and resid 35 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid A and resid 34 and name C3') (segid A and resid 34 and name O3')
(segid A and resid 35 and name P ) (segid A and resid 35 and name O5') 1.0 0.0 120.0 2 ! zeta
assign (segid A and resid 34 and name O3') (segid A and resid 35 and name P )
(segid A and resid 35 and name O5') (segid A and resid 35 and name C5') 1.0 0.0 120.0 2 ! alpha
assign (segid A and resid 35 and name P ) (segid A and resid 35 and name O5')
(segid A and resid 35 and name C5') (segid A and resid 35 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid A and resid 35 and name C4') (segid A and resid 35 and name C3')
(segid A and resid 35 and name O3') (segid A and resid 36 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid A and resid 35 and name C3') (segid A and resid 35 and name O3')
(segid A and resid 36 and name P ) (segid A and resid 36 and name O5') 1.0 0.0 120.0 2 ! zeta
assign (segid A and resid 35 and name O3') (segid A and resid 36 and name P )
(segid A and resid 36 and name O5') (segid A and resid 36 and name C5') 1.0 0.0 120.0 2 ! alpha
assign (segid A and resid 36 and name P ) (segid A and resid 36 and name O5')
(segid A and resid 36 and name C5') (segid A and resid 36 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid A and resid 36 and name C4') (segid A and resid 36 and name C3')
(segid A and resid 36 and name O3') (segid A and resid 37 and name P ) 1.0 -135.0 60.0 2 ! epsilon
!---------segidB-----------------------------------------------
assign (segid B and resid 40 and name C3') (segid B and resid 40 and name O3')
(segid B and resid 41 and name P ) (segid B and resid 41 and name O5') 1.0 0.0 120.0 2 ! zeta
assign (segid B and resid 40 and name O3') (segid B and resid 41 and name P )
(segid B and resid 41 and name O5') (segid B and resid 41 and name C5') 1.0 0.0 120.0 2 ! alpha
assign (segid B and resid 41 and name P ) (segid B and resid 41 and name O5')
(segid B and resid 41 and name C5') (segid B and resid 41 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid B and resid 41 and name O5') (segid B and resid 41 and name C5')
(segid B and resid 41 and name C4') (segid B and resid 41 and name C3') 1.0 55.0 40.0 2 ! gamma
assign (segid B and resid 41 and name C4') (segid B and resid 41 and name C3')
(segid B and resid 41 and name O3') (segid B and resid 42 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid B and resid 41 and name C3') (segid B and resid 41 and name O3')
(segid B and resid 42 and name P ) (segid B and resid 42 and name O5') 1.0 0.0 120.0 2 ! zeta
assign (segid B and resid 41 and name O3') (segid B and resid 42 and name P )
(segid B and resid 42 and name O5') (segid B and resid 42 and name C5') 1.0 0.0 120.0 2 ! alpha
assign (segid B and resid 42 and name P ) (segid B and resid 42 and name O5')
(segid B and resid 42 and name C5') (segid B and resid 42 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid B and resid 42 and name C4') (segid B and resid 42 and name C3')
(segid B and resid 42 and name O3') (segid B and resid 43 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid B and resid 43 and name P ) (segid B and resid 43 and name O5')
(segid B and resid 43 and name C5') (segid B and resid 43 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid B and resid 43 and name O5') (segid B and resid 43 and name C5')
(segid B and resid 43 and name C4') (segid B and resid 43 and name C3') 1.0 55.0 40.0 2 ! gamma
assign (segid B and resid 43 and name C4') (segid B and resid 43 and name C3')
(segid B and resid 43 and name O3') (segid B and resid 44 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid B and resid 44 and name P ) (segid B and resid 44 and name O5')
(segid B and resid 44 and name C5') (segid B and resid 44 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid B and resid 44 and name O5') (segid B and resid 44 and name C5')
(segid B and resid 44 and name C4') (segid B and resid 44 and name C3') 1.0 55.0 40.0 2 ! gamma
assign (segid B and resid 44 and name C3') (segid B and resid 44 and name O3')
(segid B and resid 45 and name P ) (segid B and resid 45 and name O5') 1.0 0.0 120.0 2 ! zeta
assign (segid B and resid 44 and name O3') (segid B and resid 45 and name P )
(segid B and resid 45 and name O5') (segid B and resid 45 and name C5') 1.0 0.0 120.0 2 ! alpha
assign (segid B and resid 45 and name C4') (segid B and resid 45 and name C3')
(segid B and resid 45 and name O3') (segid B and resid 46 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid B and resid 45 and name C3') (segid B and resid 45 and name O3')
(segid B and resid 46 and name P ) (segid B and resid 46 and name O5') 1.0 0.0 120.0 2 ! zeta
assign (segid B and resid 45 and name O3') (segid B and resid 46 and name P )
(segid B and resid 46 and name O5') (segid B and resid 46 and name C5') 1.0 0.0 120.0 2 ! alpha
assign (segid B and resid 46 and name P ) (segid B and resid 46 and name O5')
(segid B and resid 46 and name C5') (segid B and resid 46 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid B and resid 46 and name C4') (segid B and resid 46 and name C3')
(segid B and resid 46 and name O3') (segid B and resid 47 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid B and resid 47 and name P ) (segid B and resid 47 and name O5')
(segid B and resid 47 and name C5') (segid B and resid 47 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid B and resid 47 and name O5') (segid B and resid 47 and name C5')
(segid B and resid 47 and name C4') (segid B and resid 47 and name C3') 1.0 55.0 40.0 2 ! gamma
assign (segid B and resid 47 and name C4') (segid B and resid 47 and name C3')
(segid B and resid 47 and name O3') (segid B and resid 48 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid B and resid 47 and name C3') (segid B and resid 47 and name O3')
(segid B and resid 48 and name P ) (segid B and resid 48 and name O5') 1.0 0.0 120.0 2 ! zeta
assign (segid B and resid 47 and name O3') (segid B and resid 48 and name P )
(segid B and resid 48 and name O5') (segid B and resid 48 and name C5') 1.0 0.0 120.0 2 ! alpha
assign (segid B and resid 48 and name P ) (segid B and resid 48 and name O5')
(segid B and resid 48 and name C5') (segid B and resid 48 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid B and resid 48 and name C4') (segid B and resid 48 and name C3')
(segid B and resid 48 and name O3') (segid B and resid 49 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid B and resid 49 and name P ) (segid B and resid 49 and name O5')
(segid B and resid 49 and name C5') (segid B and resid 49 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid B and resid 49 and name O5') (segid B and resid 49 and name C5')
(segid B and resid 49 and name C4') (segid B and resid 49 and name C3') 1.0 55.0 40.0 2 ! gamma
assign (segid B and resid 49 and name C4') (segid B and resid 49 and name C3')
(segid B and resid 49 and name O3') (segid B and resid 50 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid B and resid 49 and name C3') (segid B and resid 49 and name O3')
(segid B and resid 50 and name P ) (segid B and resid 50 and name O5') 1.0 0.0 120.0 2 ! zeta
assign (segid B and resid 49 and name O3') (segid B and resid 50 and name P )
(segid B and resid 50 and name O5') (segid B and resid 50 and name C5') 1.0 0.0 120.0 2 ! alpha
assign (segid B and resid 50 and name P ) (segid B and resid 50 and name O5')
(segid B and resid 50 and name C5') (segid B and resid 50 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid B and resid 50 and name C4') (segid B and resid 50 and name C3')
(segid B and resid 50 and name O3') (segid B and resid 51 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid B and resid 50 and name C3') (segid B and resid 50 and name O3')
(segid B and resid 51 and name P ) (segid B and resid 51 and name O5') 1.0 0.0 120.0 2 ! zeta
assign (segid B and resid 50 and name O3') (segid B and resid 51 and name P )
(segid B and resid 51 and name O5') (segid B and resid 51 and name C5') 1.0 0.0 120.0 2 ! alpha
assign (segid B and resid 51 and name P ) (segid B and resid 51 and name O5')
(segid B and resid 51 and name C5') (segid B and resid 51 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid B and resid 51 and name C4') (segid B and resid 51 and name C3')
(segid B and resid 51 and name O3') (segid B and resid 52 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid B and resid 51 and name C3') (segid B and resid 51 and name O3')
(segid B and resid 52 and name P ) (segid B and resid 52 and name O5') 1.0 0.0 120.0 2 ! zeta
assign (segid B and resid 51 and name O3') (segid B and resid 52 and name P )
(segid B and resid 52 and name O5') (segid B and resid 52 and name C5') 1.0 0.0 120.0 2 ! alpha
assign (segid B and resid 52 and name P ) (segid B and resid 52 and name O5')
(segid B and resid 52 and name C5') (segid B and resid 52 and name C4') 1.0 180.0 60.0 2 ! beta
assign (segid B and resid 52 and name O5') (segid B and resid 52 and name C5')
(segid B and resid 52 and name C4') (segid B and resid 52 and name C3') 1.0 55.0 40.0 2 ! gamma
assign (segid B and resid 52 and name C4') (segid B and resid 52 and name C3')
(segid B and resid 52 and name O3') (segid B and resid 53 and name P ) 1.0 -135.0 60.0 2 ! epsilon
assign (segid B and resid 53 and name O5') (segid B and resid 53 and name C5')
(segid B and resid 53 and name C4') (segid B and resid 53 and name C3') 1.0 55.0 40.0 2 ! gamma
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