NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage position program type
528642 2lj2 17914 cing 1-original 2 XPLOR/CNS dipolar coupling


!! NH dipolar couplings for MerFt                         
!============================================================ 
!!  14 GLY
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  14  and name N   )
        ( resid  14  and name HN  )      -8.000      1.0
!!  15 THR
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  15  and name N   )
        ( resid  15  and name HN  )      -7.200      1.0 
!!  16 THR
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  16  and name N   )
        ( resid  16  and name HN  )      -4.800      1.0 
!!  17 LEU
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  17  and name N   )
        ( resid  17  and name HN  )      -6.600      1.0
!!  18 VAL
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  18  and name N   )
        ( resid  18  and name HN  )      -6.600      1.0 
!!  19 ALA
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  19  and name N   )
        ( resid  19  and name HN  )      -7.200      1.0
!!  21 SER
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  21  and name N   )
        ( resid  21  and name HN  )      13.000      1.0 
!!  22 SER
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  22  and name N   )
        ( resid  22  and name HN  )      -6.000      1.0 
!!  23 PHE
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  23  and name N   )
        ( resid  23  and name HN  )      -6.000      1.0 
!!  27 LEU
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  27  and name N   )
        ( resid  27  and name HN  )      17.200      1.0 
!!  28 VAL
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  28  and name N   )
        ( resid  28  and name HN  )      17.600      1.0 
!!  29 ILE
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  29  and name N   )
        ( resid  29  and name HN  )      14.200      1.0 
!!  30 LEU
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  30  and name N   )
        ( resid  30  and name HN  )      14.400      1.0 
!!  31 LEU
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  31  and name N   )
        ( resid  31  and name HN  )      18.800      1.0 
!!  32 GLY
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  32  and name N   )
        ( resid  32  and name HN  )      16.000      1.0 
!!  33 VAL
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  33  and name N   )
        ( resid  33  and name HN  )      12.200      1.0 
!!  34 VAL
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  34  and name N   )
        ( resid  34  and name HN  )      15.600      1.0 
!!  35 GLY
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  35  and name N   )
        ( resid  35  and name HN  )      18.000      1.0 
!!  36 LEU
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  36  and name N   )
        ( resid  36  and name HN  )      16.000      1.0 
!!  37 SER
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  37  and name N   )
        ( resid  37  and name HN  )      14.400      1.0 
!!  38 ALA
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  38  and name N   )
        ( resid  38  and name HN  )      17.600      1.0 
!!  39 LEU
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  39  and name N   )
        ( resid  39  and name HN  )      19.200      1.0 
!!  40 THR
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  40  and name N   )
        ( resid  40  and name HN  )      16.000      1.0 
!!  41 GLY
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  41  and name N   )
        ( resid  41  and name HN  )       1.600      1.0 
!!  42 TYR
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  42  and name N   )
        ( resid  42  and name HN  )      -8.400      1.0 
!!  43 LEU
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  43  and name N   )
        ( resid  43  and name HN  )       1.600      1.0
!!  44 ASP
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  44  and name N   )
        ( resid  44  and name HN  )       2.400      1.0
!!  45 TYR
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  45  and name N   )
        ( resid  45  and name HN  )      -4.000      1.0
!!  46 VAL
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  46  and name N   )
        ( resid  46  and name HN  )      -3.600      1.0 
!!  47 LEU
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  47  and name N   )
        ( resid  47  and name HN  )      16.000      1.0
!!  48 LEU
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  48  and name N   )
        ( resid  48  and name HN  )      14.800      1.0
!!  50 ALA
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  50  and name N   )
        ( resid  50  and name HN  )      16.600      1.0 
!!  51 LEU
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  51  and name N   )
        ( resid  51  and name HN  )      19.200      1.0 
!!  52 ALA
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  52  and name N   )
        ( resid  52  and name HN  )      14.600      1.0 
!!  53 ILE
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  53  and name N   )
        ( resid  53  and name HN  )      12.400      1.0 
!!  54 PHE
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  54  and name N   )
        ( resid  54  and name HN  )      18.800      1.0 
!!  55 ILE
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  55  and name N   )
        ( resid  55  and name HN  )      16.800      1.0 
!!  56 GLY
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  56  and name N   )
        ( resid  56  and name HN  )      12.800      1.0 
!!  57 LEU
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  57  and name N   )
        ( resid  57  and name HN  )      14.800      1.0 
!!  58 THR
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  58  and name N   )
        ( resid  58  and name HN  )      20.000      1.0 
!!  59 ILE
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  59  and name N   )
        ( resid  59  and name HN  )      15.600      1.0 
!!  60 TYR
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  60  and name N   )
        ( resid  60  and name HN  )      13.600      1.0 
!!  61 ALA
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  61  and name N   )
        ( resid  61  and name HN  )      16.400      1.0 
!!  62 ILE
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  62  and name N   )
        ( resid  62  and name HN  )      18.400      1.0 
!!  63 GLN
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  63  and name N   )
        ( resid  63  and name HN  )      12.800      1.0 
!!  64 ARG
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  64  and name N   )
        ( resid  64  and name HN  )      12.000      1.0
!!  65 LYS
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  65  and name N   )
        ( resid  65  and name HN  )      19.600      1.0 
!!  66 ARG
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  66  and name N   )
        ( resid  66  and name HN  )      16.000      1.0 
!!  67 GLN
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  67  and name N   )
        ( resid  67  and name HN  )      12.000      1.0 
!!  68 ALA
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  68  and name N   )
        ( resid  68  and name HN  )       4.400      1.0 
!!  69 ASP
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  69  and name N   )
        ( resid  69  and name HN  )       4.000      1.0 
!!  70 ALA
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  70  and name N   )
        ( resid  70  and name HN  )       2.000      1.0 



!! CaHa dipolar couplings for MerFt                         
!! Implement as absolute values (useSign=FALSE)
!============================================================ 

!!  16 THR
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  16  and name CA  )
        ( resid  16  and name HA* )      20.800      1.0
!!  17 LEU
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  17  and name CA  )
        ( resid  17  and name HA* )      16.000      1.0
!!  24 THR
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  24  and name CA  )
        ( resid  24  and name HA* )      20.400      1.0
!!  26 VAL
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  26  and name CA  )
        ( resid  26  and name HA* )      11.200      1.0
!!  27 LEU
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  27  and name CA  )
        ( resid  27  and name HA* )      20.800      1.0
!!  28 VAL
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  28  and name CA  )
        ( resid  28  and name HA* )       8.000      1.0
!!  30 LEU
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  30  and name CA  )
        ( resid  30  and name HA* )      10.200      1.0
!!  31 LEU
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  31  and name CA  )
        ( resid  31  and name HA* )       7.600      1.0
!!  33 VAL
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  33  and name CA  )
        ( resid  33  and name HA* )      17.900      1.0
!!  34 VAL
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  34  and name CA  )
        ( resid  34  and name HA* )      20.700      1.0
!!  37 SER
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  37  and name CA  )
        ( resid  37  and name HA* )       8.000      1.0
!!  38 ALA
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  38  and name CA  )
        ( resid  38  and name HA* )      12.800      1.0
!!  39 LEU
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  39  and name CA  )
        ( resid  39  and name HA* )      13.000      1.0
!!  43 LEU
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  43  and name CA  )
        ( resid  43  and name HA* )      16.400      1.0
!!  44 ASP
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  44  and name CA  )
        ( resid  44  and name HA* )      14.600      1.0
!!  47 LEU
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  47  and name CA  )
        ( resid  47  and name HA* )      11.000      1.0
!!  52 ALA
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  52  and name CA  )
        ( resid  52  and name HA* )      18.100      1.0
!!  53 ILE
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  53  and name CA  )
        ( resid  53  and name HA* )      14.700      1.0
!!  54 PHE
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  54  and name CA  )
        ( resid  54  and name HA* )       7.200      1.0
!!  55 ILE
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  55  and name CA  )
        ( resid  55  and name HA* )      10.000      1.0
!!  57 LEU
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  57  and name CA  )
        ( resid  57  and name HA* )      14.000      1.0
!!  59 ILE
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  59  and name CA  )
        ( resid  59  and name HA* )      14.400      1.0
!!  60 TYR
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  60  and name CA  )
        ( resid  60  and name HA* )      16.000      1.0
!!  61 ALA
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  61  and name CA  )
        ( resid  61  and name HA* )      14.000      1.0
!!  63 GLN
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  63  and name CA  )
        ( resid  63  and name HA* )      13.800      1.0
!!  64 ARG
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  64  and name CA  )
        ( resid  64  and name HA* )      22.000      1.0
!!  65 LYS
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  65  and name CA  )
        ( resid  65  and name HA* )       7.200      1.0
!!  68 ALA
assign  ( resid 600  and name OO  )
        ( resid 600  and name Z   )
        ( resid 600  and name X   )
        ( resid 600  and name Y   )
        ( resid  68  and name CA  )
        ( resid  68  and name HA* )      17.600      1.0





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