NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position program type
9154 1nev cing 1-original 10 XPLOR/CNS dipolar coupling



! CH dipolar couplings for square well refinement

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 1 and name C1' )
       ( segid A and resid 1 and name H1' )
       19.91 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 2 and name C1' )
       ( segid A and resid 2 and name H1' )
       35.60 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 3 and name C1' )
       ( segid A and resid 3 and name H1' )
       19.19 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 4 and name C1' )
       ( segid A and resid 4 and name H1' )
       23.17 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 5 and name C1' )
       ( segid A and resid 5 and name H1' )
       22.42 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 6 and name C1' )
       ( segid A and resid 6 and name H1' )
       29.83 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 7 and name C1' )
       ( segid A and resid 7 and name H1' )
       37.47 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 8 and name C1' )
       ( segid A and resid 8 and name H1' )
       24.98 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 9 and name C1' )
       ( segid A and resid 9 and name H1' )
       12.36 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 10 and name C1' )
       ( segid A and resid 10 and name H1' )
       4.59 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 11 and name C1' )
       ( segid B and resid 11 and name H1' )
       -2.65 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 12 and name C1' )
       ( segid B and resid 12 and name H1' )
       28.89 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 13 and name C1' )
       ( segid B and resid 13 and name H1' )
       28.27 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 14 and name C1' )
       ( segid B and resid 14 and name H1' )
       18.39 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 15 and name C1' )
       ( segid B and resid 15 and name H1' )
       26.50 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 16 and name C1' )
       ( segid B and resid 16 and name H1' )
       34.77 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 17 and name C1' )
       ( segid B and resid 17 and name H1' )
       23.86 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 18 and name C1' )
       ( segid B and resid 18 and name H1' )
       36.90 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 19 and name C1' )
       ( segid B and resid 19 and name H1' )
       13.44 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 20 and name C1' )
       ( segid B and resid 20 and name H1' )
       13.62 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 4 and name C2 )
       ( segid A and resid 4 and name H2 )
       16.93 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 5 and name C2 )
       ( segid A and resid 5 and name H2 )
       31.80 2.58
 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 6 and name C2 )
       ( segid A and resid 6 and name H2 )
       38.25 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 7 and name C2 )
       ( segid A and resid 7 and name H2 )
       39.51 2.00
 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 1 and name C3' )
       ( segid A and resid 1 and name H3' )
       17.32 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 2 and name C3' )
       ( segid A and resid 2 and name H3' )
       24.95 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 3 and name C3' )
       ( segid A and resid 3 and name H3' )
       15.01 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 4 and name C3' )
       ( segid A and resid 4 and name H3' )
       11.31 2.05

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 5 and name C3' )
       ( segid A and resid 5 and name H3' )
       30.88 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 6 and name C3' )
       ( segid A and resid 6 and name H3' )
       27.65 3.48

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 7 and name C3' )
       ( segid A and resid 7 and name H3' )
       32.78 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 8 and name C3' )
       ( segid A and resid 8 and name H3' )
       22.74 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 9 and name C3' )
       ( segid A and resid 9 and name H3' )
       18.82 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 10 and name C3' )
       ( segid A and resid 10 and name H3' )
       18.45 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 11 and name C3' )
       ( segid B and resid 11 and name H3' )
       -7.64 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 12 and name C3' )
       ( segid B and resid 12 and name H3' )
       22.17 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 13 and name C3' )
       ( segid B and resid 13 and name H3' )
       21.41 2.35

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 14 and name C3' )
       ( segid B and resid 14 and name H3' )
       27.07 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 15 and name C3' )
       ( segid B and resid 15 and name H3' )
       30.02 2.24

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 16 and name C3' )
       ( segid B and resid 16 and name H3' )
       43.08 2.84

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 17 and name C3' )
       ( segid B and resid 17 and name H3' )
       33.50 2.00

!assign ( resid 500  and name OO  )
!       ( resid 500  and name Z   )
!       ( resid 500  and name X   )
!       ( resid 500  and name Y   )
!       ( segid B and resid 18 and name C3' )
!       ( segid B and resid 18 and name H3' )
!       25.50 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 19 and name C3' )
       ( segid B and resid 19 and name H3' )
       19.63 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 20 and name C3' )
       ( segid B and resid 20 and name H3' )
       13.39 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 1 and name C4' )
       ( segid A and resid 1 and name H4' )
       3.44 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 2 and name C4' )
       ( segid A and resid 2 and name H4' )
       8.44 2.23

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 3 and name C4' )
       ( segid A and resid 3 and name H4' )
       10.31 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 4 and name C4' )
       ( segid A and resid 4 and name H4' )
       5.35 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 5 and name C4' )
       ( segid A and resid 5 and name H4' )
       28.19 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 6 and name C4' )
       ( segid A and resid 6 and name H4' )
       2.17 2.81

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 7 and name C4' )
       ( segid A and resid 7 and name H4' )
       2.99 2.29

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 8 and name C4' )
       ( segid A and resid 8 and name H4' )
       22.05 4.12

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 9 and name C4' )
       ( segid A and resid 9 and name H4' )
       28.76 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 10 and name C4' )
       ( segid A and resid 10 and name H4' )
       15.47 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 11 and name C4' )
       ( segid B and resid 11 and name H4' )
       -11.81 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 12 and name C4' )
       ( segid B and resid 12 and name H4' )
       3.36 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 13 and name C4' )
       ( segid B and resid 13 and name H4' )
       4.20 2.46

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 14 and name C4' )
       ( segid B and resid 14 and name H4' )
       -0.12 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 15 and name C4' )
       ( segid B and resid 15 and name H4' )
       1.42 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 16 and name C4' )
       ( segid B and resid 16 and name H4' )
       5.27 2.62

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 17 and name C4' )
       ( segid B and resid 17 and name H4' )
       21.13 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 18 and name C4' )
       ( segid B and resid 18 and name H4' )
       6.96 2.48

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 19 and name C4' )
       ( segid B and resid 19 and name H4' )
       26.29 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 20 and name C4' )
       ( segid B and resid 20 and name H4' )
       21.07 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 3 and name C5 )
       ( segid A and resid 3 and name H5 )
       36.25 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 8 and name C5 )
       ( segid A and resid 8 and name H5 )
       36.77 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 11 and name C5 )
       ( segid B and resid 11 and name H5 )
       23.59 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 12 and name C5 )
       ( segid B and resid 12 and name H5 )
       24.23 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 19 and name C5 )
       ( segid B and resid 19 and name H5 )
       32.12 2.00

!assign ( resid 500  and name OO  )
!       ( resid 500  and name Z   )
!       ( resid 500  and name X   )
!       ( resid 500  and name Y   )
!       ( segid B and resid 20 and name C5 )
!       ( segid B and resid 20 and name H5 )
!      36.63 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 3 and name C6 )
       ( segid A and resid 3 and name H6 )
       31.57 2.22

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 8 and name C6 )
       ( segid A and resid 8 and name H6 )
       16.02 3.23

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 11 and name C6 )
       ( segid B and resid 11 and name H6 )
       39.53 2.22

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 12 and name C6 )
       ( segid B and resid 12 and name H6 )
       28.97 2.94

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 14 and name C6 )
       ( segid B and resid 14 and name H6 )
       31.20 2.99


assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 15 and name C6 )
       ( segid B and resid 15 and name H6 )
       40.02 2.03

!assign ( resid 500  and name OO  )
!       ( resid 500  and name Z   )
!       ( resid 500  and name X   )
!       ( resid 500  and name Y   )
!       ( segid B and resid 16 and name C6 )
!       ( segid B and resid 16 and name H6 )
!       48.81 2.48

!assign ( resid 500  and name OO  )
!       ( resid 500  and name Z   )
!       ( resid 500  and name X   )
!       ( resid 500  and name Y   )
!       ( segid B and resid 17 and name C6 )
!       ( segid B and resid 17 and name H6 )
!       14.53 2.38

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 19 and name C6 )
       ( segid B and resid 19 and name H6 )
       28.18 2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 20 and name C6 )
       ( segid B and resid 20 and name H6 )
       28.44 2.42

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 1 and name C8 )
       ( segid A and resid 1 and name H8 )
       41.98 2.16

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 2 and name C8 )
       ( segid A and resid 2 and name H8 )
       35.38 2.82

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 4 and name C8 )
       ( segid A and resid 4 and name H8 )
       26.44 3.05

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 5 and name C8 )
       ( segid A and resid 5 and name H8 )
       39.03 2.95

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 6 and name C8 )
       ( segid A and resid 6 and name H8 )
       45.13 2.01

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 7 and name C8 )
       ( segid A and resid 7 and name H8 )
       32.39 3.00


assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 9 and name C8 )
       ( segid A and resid 9 and name H8 )
       28.72 3.37

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 10 and name C8 )
       ( segid A and resid 10 and name H8 )
       29.13 3.28

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 13 and name C8 )
       ( segid B and resid 13 and name H8 )
       26.66 3.44

!assign ( resid 500  and name OO  )
!       ( resid 500  and name Z   )
!       ( resid 500  and name X   )
!       ( resid 500  and name Y   )
!       ( segid B and resid 18 and name C8 )
!       ( segid B and resid 18 and name H8 )
!       31.86 2.00



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