NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type
497574 2krl cing 1-original 6 XPLOR/CNS dipolar coupling


! RDC restraints

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  18  and name N3   )
       ( resid  18  and name H3   )  10.3370   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid   7  and name N3   )
       ( resid   7  and name H3   )   7.5900   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  49  and name N3   )
       ( resid  49  and name H3   )   0.0080   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  90  and name N3   )
       ( resid  90  and name H3   )  23.1740   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  99  and name N3   )
       ( resid  99  and name H3   )  12.9160   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid   6  and name N1   )
       ( resid   6  and name H1   )   9.6880   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  33  and name N3   )
       ( resid  33  and name H3   )  10.6010   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  29  and name N1   )
       ( resid  29  and name H1   )  16.1370   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  80  and name N1   )
       ( resid  80  and name H1   )  10.1620   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  92  and name N1   )
       ( resid  92  and name H1   )  -0.0780   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  58  and name N1   )
       ( resid  58  and name H1   )  28.5340   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  89  and name N1   )
       ( resid  89  and name H1   )  27.6670   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  17  and name N1   )
       ( resid  17  and name H1   )  10.3820   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  40  and name N1   )
       ( resid  40  and name H1   )  -1.3080   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  27  and name N1   )
       ( resid  27  and name H1   )   3.8210   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  59  and name N1   )
       ( resid  59  and name H1   )  25.6010   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  81  and name N1   )
       ( resid  81  and name H1   )  17.0500   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid   2  and name N1   )
       ( resid   2  and name H1   )   9.9490   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  50  and name N1   )
       ( resid  50  and name H1   )   9.0030   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  82  and name N1   )
       ( resid  82  and name H1   )   9.8450   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid   8  and name N1   )
       ( resid   8  and name H1   )   3.3890   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  91  and name N1   )
       ( resid  91  and name H1   )  17.5580   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  52  and name N3   )
       ( resid  52  and name H3   )  14.5700   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  16  and name N3   )
       ( resid  16  and name H3   )  10.5650   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  32  and name N3   )
       ( resid  32  and name H3   )   6.6740   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  20  and name N3   )
       ( resid  20  and name H3   )  10.1170   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  48  and name N1   )
       ( resid  48  and name H1   )   3.4910   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  28  and name N1   )
       ( resid  28  and name H1   )  16.4170   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid   5  and name N1   )
       ( resid   5  and name H1   )  11.6580   1.2000 1.2000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid   1  and name N1   )
       ( resid   1  and name H1   )  11.0890   1.2000 1.2000



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