NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type
9155 1nev cing 1-original 11 XPLOR/CNS planarity


! BASE PLANARITY RESTRINT FILE
! hereby set to all aromatic heteroatoms of each base to be planar

! GUA 1
group
selection=((segid A and resid 1 and name N1) or
    (segid A and resid 1 and name H1) or 
           (segid A and resid 1 and name C2) or
    (segid A and resid 1 and name N3) or
    (segid A and resid 1 and name C4) or
    (segid A and resid 1 and name C5) or
    (segid A and resid 1 and name C6) or
    (segid A and resid 1 and name N7) or
    (segid A and resid 1 and name C8) or
    (segid A and resid 1 and name H8) or
    (segid A and resid 1 and name N9) or
    (segid A and resid 1 and name N2) or
    (segid A and resid 1 and name O6) or
    (segid A and resid 1 and name H21) or
    (segid A and resid 1 and name H22))
weight=$pscale end

! GUA 2
group
selection=((segid A and resid 2 and name N1) or
    (segid A and resid 2 and name H1) or 
           (segid A and resid 2 and name C2) or
    (segid A and resid 2 and name N3) or
    (segid A and resid 2 and name C4) or
    (segid A and resid 2 and name C5) or
    (segid A and resid 2 and name C6) or
    (segid A and resid 2 and name N7) or
    (segid A and resid 2 and name C8) or
    (segid A and resid 2 and name H8) or
    (segid A and resid 2 and name N9) or
    (segid A and resid 2 and name N2) or
    (segid A and resid 2 and name O6) or
    (segid A and resid 2 and name H21) or
    (segid A and resid 2 and name H22))
weight=$pscale end

  
! CYT 3
group
selection=((segid A and resid 3 and name N1) or
    (segid A and resid 3 and name C2) or
    (segid A and resid 3 and name N3) or
    (segid A and resid 3 and name C4) or
    (segid A and resid 3 and name C5) or
    (segid A and resid 3 and name H5) or
    (segid A and resid 3 and name C6) or
    (segid A and resid 3 and name H6) or 
           (segid A and resid 3 and name N4) or
    (segid A and resid 3 and name O2) or
    (segid A and resid 3 and name H41) or
    (segid A and resid 3 and name H42))
weight=$pscale end

! ADE 4
group
selection=((segid A and resid 4 and name N1) or
    (segid A and resid 4 and name C2) or
    (segid A and resid 4 and name H2) or
    (segid A and resid 4 and name N3) or
    (segid A and resid 4 and name C4) or
    (segid A and resid 4 and name C5) or
    (segid A and resid 4 and name C6) or
    (segid A and resid 4 and name N7) or
    (segid A and resid 4 and name C8) or
    (segid A and resid 4 and name H8) or
    (segid A and resid 4 and name N9) or
    (segid A and resid 4 and name N6) or
    (segid A and resid 4 and name H61) or
    (segid A and resid 4 and name H62))
    
weight=$pscale end

! ADE 5
group
selection=((segid A and resid 5 and name N1) or
    (segid A and resid 5 and name C2) or
    (segid A and resid 5 and name H2) or
    (segid A and resid 5 and name N3) or
    (segid A and resid 5 and name C4) or
    (segid A and resid 5 and name C5) or
    (segid A and resid 5 and name C6) or
    (segid A and resid 5 and name N7) or
    (segid A and resid 5 and name C8) or
    (segid A and resid 5 and name H8) or
    (segid A and resid 5 and name N9) or
    (segid A and resid 5 and name N6) or
    (segid A and resid 5 and name H61) or
    (segid A and resid 5 and name H62))
    
weight=$pscale end

! ADE 6
group
selection=((segid A and resid 6 and name N1) or
    (segid A and resid 6 and name C2) or
    (segid A and resid 6 and name H2) or
    (segid A and resid 6 and name N3) or
    (segid A and resid 6 and name C4) or
    (segid A and resid 6 and name C5) or
    (segid A and resid 6 and name C6) or
    (segid A and resid 6 and name N7) or
    (segid A and resid 6 and name C8) or
    (segid A and resid 6 and name H8) or
    (segid A and resid 6 and name N9) or
    (segid A and resid 6 and name N6) or
    (segid A and resid 6 and name H61) or
    (segid A and resid 6 and name H62))
    
weight=$pscale end

! ADE 7
group
selection=((segid A and resid 7 and name N1) or
    (segid A and resid 7 and name C2) or
    (segid A and resid 7 and name H2) or
    (segid A and resid 7 and name N3) or
    (segid A and resid 7 and name C4) or
    (segid A and resid 7 and name C5) or
    (segid A and resid 7 and name C6) or
    (segid A and resid 7 and name N7) or
    (segid A and resid 7 and name C8) or
    (segid A and resid 7 and name H8) or
    (segid A and resid 7 and name N9) or
    (segid A and resid 7 and name N6) or
    (segid A and resid 7 and name H61) or
    (segid A and resid 7 and name H62))
    
weight=$pscale end

! CYT 8
group
selection=((segid A and resid 8 and name N1) or
    (segid A and resid 8 and name C2) or
    (segid A and resid 8 and name N3) or
    (segid A and resid 8 and name C4) or
    (segid A and resid 8 and name C5) or
    (segid A and resid 8 and name H5) or
    (segid A and resid 8 and name H6) or 
           (segid A and resid 8 and name C6) or
    (segid A and resid 8 and name N4) or
    (segid A and resid 8 and name O2) or
    (segid A and resid 8 and name H41) or
    (segid A and resid 8 and name H42))
weight=$pscale end

! GUA 9
group
selection=((segid A and resid 9 and name N1) or
    (segid A and resid 9 and name H1) or 
           (segid A and resid 9 and name C2) or
    (segid A and resid 9 and name N3) or
    (segid A and resid 9 and name C4) or
    (segid A and resid 9 and name C5) or
    (segid A and resid 9 and name C6) or
    (segid A and resid 9 and name N7) or
    (segid A and resid 9 and name C8) or
    (segid A and resid 9 and name H8) or
    (segid A and resid 9 and name N9) or
    (segid A and resid 9 and name N2) or
    (segid A and resid 9 and name O6) or
    (segid A and resid 9 and name H21) or
    (segid A and resid 9 and name H22))
weight=$pscale end

! GUA 10
group
selection=((segid A and resid 10 and name N1) or
    (segid A and resid 10 and name H1) or 
           (segid A and resid 10 and name C2) or
    (segid A and resid 10 and name N3) or
    (segid A and resid 10 and name C4) or
    (segid A and resid 10 and name C5) or
    (segid A and resid 10 and name C6) or
    (segid A and resid 10 and name N7) or
    (segid A and resid 10 and name C8) or
    (segid A and resid 10 and name H8) or
    (segid A and resid 10 and name N9) or
    (segid A and resid 10 and name N2) or
    (segid A and resid 10 and name O6) or
    (segid A and resid 10 and name H21) or
    (segid A and resid 10 and name H22))
weight=$pscale end

! CYT 11
group
selection=((segid B and resid 11 and name N1) or
    (segid B and resid 11 and name C2) or
    (segid B and resid 11 and name N3) or
    (segid B and resid 11 and name C4) or
    (segid B and resid 11 and name C5) or
    (segid B and resid 11 and name H5) or
    (segid B and resid 11 and name H6) or 
           (segid B and resid 11 and name C6) or
    (segid B and resid 11 and name N4) or
    (segid B and resid 11 and name O2) or
    (segid B and resid 11 and name H41) or
    (segid B and resid 11 and name H42))
weight=$pscale end

! CYT 12
group
selection=((segid B and resid 12 and name N1) or
    (segid B and resid 12 and name C2) or
    (segid B and resid 12 and name N3) or
    (segid B and resid 12 and name C4) or
    (segid B and resid 12 and name C5) or
    (segid B and resid 12 and name H5) or
    (segid B and resid 12 and name C6) or
    (segid B and resid 12 and name H6) or 
           (segid B and resid 12 and name N4) or
    (segid B and resid 12 and name O2) or
    (segid B and resid 12 and name H41) or
    (segid B and resid 12 and name H42))
weight=$pscale end

! GUA 13
group
selection=((segid B and resid 13 and name N1) or
    (segid B and resid 13 and name H1) or 
           (segid B and resid 13 and name C2) or
    (segid B and resid 13 and name N3) or
    (segid B and resid 13 and name C4) or
    (segid B and resid 13 and name C5) or
    (segid B and resid 13 and name C6) or
    (segid B and resid 13 and name N7) or
    (segid B and resid 13 and name C8) or
    (segid B and resid 13 and name H8) or
    (segid B and resid 13 and name N9) or
    (segid B and resid 13 and name N2) or
    (segid B and resid 13 and name O6) or
    (segid B and resid 13 and name H21) or
    (segid B and resid 13 and name H22))
weight=$pscale end

! THY 14
group
selection=((segid B and resid 14 and name N1) or
    (segid B and resid 14 and name C2) or
    (segid B and resid 14 and name N3) or
    (segid B and resid 14 and name H3) or 
           (segid B and resid 14 and name C4) or
    (segid B and resid 14 and name C5) or
    (segid B and resid 14 and name C6) or
    (segid B and resid 14 and name H6) or
    (segid B and resid 14 and name O2) or
    (segid B and resid 14 and name O4) or
    (segid B and resid 14 and name C7))
weight=$pscale end

! THY 15
group
selection=((segid B and resid 15 and name N1) or
    (segid B and resid 15 and name C2) or
    (segid B and resid 15 and name N3) or
    (segid B and resid 15 and name H3) or 
           (segid B and resid 15 and name C4) or
    (segid B and resid 15 and name C5) or
    (segid B and resid 15 and name C6) or
    (segid B and resid 15 and name H6) or
    (segid B and resid 15 and name O2) or
    (segid B and resid 15 and name O4) or
    (segid B and resid 15 and name C7))
weight=$pscale end

! THY 16
group
selection=((segid B and resid 16 and name N1) or
    (segid B and resid 16 and name C2) or
    (segid B and resid 16 and name N3) or
    (segid B and resid 16 and name H3) or 
           (segid B and resid 16 and name C4) or
    (segid B and resid 16 and name C5) or
    (segid B and resid 16 and name C6) or
    (segid B and resid 16 and name H6) or
    (segid B and resid 16 and name O2) or
    (segid B and resid 16 and name O4) or
    (segid B and resid 16 and name C7))
weight=$pscale end

! THY 15
group
selection=((segid B and resid 17 and name N1) or
    (segid B and resid 17 and name C2) or
    (segid B and resid 17 and name N3) or
    (segid B and resid 17 and name H3) or 
           (segid B and resid 17 and name C4) or
    (segid B and resid 17 and name C5) or
    (segid B and resid 17 and name C6) or
    (segid B and resid 17 and name H6) or
    (segid B and resid 17 and name O2) or
    (segid B and resid 17 and name O4) or
    (segid B and resid 17 and name C7))
weight=$pscale end

! GUA 18
group
selection=((segid B and resid 18 and name N1) or
    (segid B and resid 18 and name H1) or 
           (segid B and resid 18 and name C2) or
    (segid B and resid 18 and name N3) or
    (segid B and resid 18 and name C4) or
    (segid B and resid 18 and name C5) or
    (segid B and resid 18 and name C6) or
    (segid B and resid 18 and name N7) or
    (segid B and resid 18 and name C8) or
    (segid B and resid 18 and name H8) or
    (segid B and resid 18 and name N9) or
    (segid B and resid 18 and name N2) or
    (segid B and resid 18 and name O6) or
    (segid B and resid 18 and name H21) or
    (segid B and resid 18 and name H22))
weight=$pscale end

! CYT 19
group
selection=((segid B and resid 19 and name N1) or
    (segid B and resid 19 and name C2) or
    (segid B and resid 19 and name N3) or
    (segid B and resid 19 and name C4) or
    (segid B and resid 19 and name C5) or
    (segid B and resid 19 and name H5) or
    (segid B and resid 19 and name C6) or
    (segid B and resid 19 and name H6) or 
           (segid B and resid 19 and name N4) or
    (segid B and resid 19 and name O2) or
    (segid B and resid 19 and name H41) or
    (segid B and resid 19 and name H42))
weight=$pscale end

! CYT 20
group
selection=((segid B and resid 20 and name N1) or
    (segid B and resid 20 and name C2) or
    (segid B and resid 20 and name N3) or
    (segid B and resid 20 and name C4) or
    (segid B and resid 20 and name C5) or
    (segid B and resid 20 and name H5) or
    (segid B and resid 20 and name C6) or
    (segid B and resid 20 and name H6) or 
           (segid B and resid 20 and name N4) or
    (segid B and resid 20 and name O2) or
    (segid B and resid 20 and name H41) or
    (segid B and resid 20 and name H42))
weight=$pscale end



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