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 subtype subsubtype
26065 2kel 16153 cing 1-original 3 XPLOR/CNS distance hydrogen bond simple


!Intermonomer - strands and 12-22
assign  ( segid "   A" and resid  14  and name  HN ) ( segid "   B" and resid  20  and name   O ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  14  and name  HN ) ( segid "   A" and resid  20  and name   O ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  16  and name  HN ) ( segid "   B" and resid  18  and name   O ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  16  and name  HN ) ( segid "   A" and resid  18  and name   O ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  18  and name  HN ) ( segid "   B" and resid  16  and name   O ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  18  and name  HN ) ( segid "   A" and resid  16  and name   O ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  22  and name  HN ) ( segid "   B" and resid  12  and name   O ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  22  and name  HN ) ( segid "   A" and resid  12  and name   O ) 2.00 0.40 0.40
!1st helix 21-34 monomer A
assign  ( segid "   A" and resid  21  and name   O ) ( segid "   A" and resid  25  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  22  and name   O ) ( segid "   A" and resid  26  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  23  and name   O ) ( segid "   A" and resid  27  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  24  and name   O ) ( segid "   A" and resid  28  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  25  and name   O ) ( segid "   A" and resid  29  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  26  and name   O ) ( segid "   A" and resid  30  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  27  and name   O ) ( segid "   A" and resid  31  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  28  and name   O ) ( segid "   A" and resid  32  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  29  and name   O ) ( segid "   A" and resid  33  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  30  and name   O ) ( segid "   A" and resid  34  and name  HN ) 2.00 0.40 0.40
!2nd helix 39-53 monomer A
assign  ( segid "   A" and resid  39  and name   O ) ( segid "   A" and resid  43  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  40  and name   O ) ( segid "   A" and resid  44  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  41  and name   O ) ( segid "   A" and resid  45  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  42  and name   O ) ( segid "   A" and resid  46  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  43  and name   O ) ( segid "   A" and resid  47  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  44  and name   O ) ( segid "   A" and resid  48  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  45  and name   O ) ( segid "   A" and resid  49  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  46  and name   O ) ( segid "   A" and resid  50  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  47  and name   O ) ( segid "   A" and resid  51  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  48  and name   O ) ( segid "   A" and resid  52  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  49  and name   O ) ( segid "   A" and resid  53  and name  HN ) 2.00 0.40 0.40
!1st helix 21-34 monomer B
assign  ( segid "   B" and resid  21  and name   O ) ( segid "   B" and resid  25  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  22  and name   O ) ( segid "   B" and resid  26  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  23  and name   O ) ( segid "   B" and resid  27  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  24  and name   O ) ( segid "   B" and resid  28  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  25  and name   O ) ( segid "   B" and resid  29  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  26  and name   O ) ( segid "   B" and resid  30  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  27  and name   O ) ( segid "   B" and resid  31  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  28  and name   O ) ( segid "   B" and resid  32  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  29  and name   O ) ( segid "   B" and resid  33  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  30  and name   O ) ( segid "   B" and resid  34  and name  HN ) 2.00 0.40 0.40
!2nd helix 39-53 monomer B
assign  ( segid "   B" and resid  39  and name   O ) ( segid "   B" and resid  43  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  40  and name   O ) ( segid "   B" and resid  44  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  41  and name   O ) ( segid "   B" and resid  45  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  42  and name   O ) ( segid "   B" and resid  46  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  43  and name   O ) ( segid "   B" and resid  47  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  44  and name   O ) ( segid "   B" and resid  48  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  45  and name   O ) ( segid "   B" and resid  49  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  46  and name   O ) ( segid "   B" and resid  50  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  47  and name   O ) ( segid "   B" and resid  51  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  48  and name   O ) ( segid "   B" and resid  52  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  49  and name   O ) ( segid "   B" and resid  53  and name  HN ) 2.00 0.40 0.40
!Intramonomer involving sidechains
assign  ( segid "   A" and resid  31  and name   O ) ( segid "   A" and resid 35  and name HD21 ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  31  and name   O ) ( segid "   B" and resid 35  and name HD21 ) 2.00 0.40 0.40
assign  ( segid "   A" and resid  55  and name OD1 ) ( segid "   A" and resid  56  and name  HN ) 2.00 0.40 0.40
assign  ( segid "   B" and resid  55  and name OD1 ) ( segid "   B" and resid  56  and name  HN ) 2.00 0.40 0.40



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