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
17796 2d1u 6803 cing 1-original 3 DYANA/DIANA distance hydrogen bond simple


####Hydrogen bond constraints###


# alpha-helix 47-54

assign (resid 46 and name o)(resid 50 and name h) 1.95 0.35 0.35
assign (resid 46 and name o)(resid 50 and name n) 2.9 0.4 0.4

assign (resid 47 and name o)(resid 51 and name h) 1.95 0.35 0.35
assign (resid 47 and name o)(resid 51 and name n) 2.9 0.4 0.4

assign (resid 48 and name o)(resid 52 and name h) 1.95 0.35 0.35
assign (resid 48 and name o)(resid 52 and name n) 2.9 0.4 0.4

assign (resid 49 and name o)(resid 53 and name h) 1.95 0.35 0.35
assign (resid 49 and name o)(resid 53 and name n) 2.9 0.4 0.4

assign (resid 50 and name o)(resid 54 and name h) 1.95 0.35 0.35
assign (resid 50 and name o)(resid 54 and name n) 2.9 0.4 0.4

#alpha_helix 11-22

assign (resid 9 and name o)(resid 13 and name h) 1.95 0.35 0.35
assign (resid 9 and name o)(resid 13 and name n) 2.9 0.4 0.4

assign (resid 10 and name o)(resid 14 and name h) 1.95 0.35 0.35
assign (resid 10 and name o)(resid 14 and name n) 2.9 0.4 0.4

assign (resid 11 and name o)(resid 15 and name h) 1.95 0.35 0.35
assign (resid 11 and name o)(resid 15 and name n) 2.9 0.4 0.4

assign (resid 12 and name o)(resid 16 and name h) 1.95 0.35 0.35
assign (resid 12 and name o)(resid 16 and name n) 2.9 0.4 0.4

assign (resid 13 and name o)(resid 17 and name h) 1.95 0.35 0.35
assign (resid 13 and name o)(resid 17 and name n) 2.9 0.4 0.4

assign (resid 14 and name o)(resid 18 and name h) 1.95 0.35 0.35
assign (resid 14 and name o)(resid 18 and name n) 2.9 0.4 0.4

assign (resid 15 and name o)(resid 19 and name h) 1.95 0.35 0.35
assign (resid 15 and name o)(resid 19 and name n) 2.9 0.4 0.4

assign (resid 17 and name o)(resid 20 and name h) 1.95 0.35 0.35
assign (resid 17 and name o)(resid 20 and name n) 2.9 0.4 0.4


#b-sheets

assign (resid 60 and name o)(resid 72 and name h) 1.95 0.35 0.35
assign (resid 60 and name o)(resid 72 and name n) 2.9 0.4 0.4

assign (resid 72 and name o)(resid 60 and name h) 1.95 0.35 0.35
assign (resid 72 and name o)(resid 60 and name n) 2.9 0.4 0.4

assign (resid 70 and name o)(resid 62 and name h) 1.95 0.35 0.35
assign (resid 70 and name o)(resid 62 and name n) 2.9 0.4 0.4

assign (resid 62 and name o)(resid 70 and name h) 1.95 0.35 0.35
assign (resid 62 and name o)(resid 70 and name n) 2.9 0.4 0.4

assign (resid 40 and name o)(resid 5 and name h) 1.95 0.35 0.35
assign (resid 40 and name o)(resid 5 and name n) 2.9 0.4 0.4

assogn (resid 5 and name o) (resid 40 and name h) 1.95 0.35 0.35
assign (resid 5 and name o) (resid 40 and name n) 2.9 0.4 0.4 




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