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
579086 2moz 19115 cing 1-original 3 XPLOR/CNS dipolar coupling


!! NH Dipolar coupling (kHz) Measured from MAS experiments.
!!     K5
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 5 and name N )
       (resid 5 and name HN ) 10.816  2.05
!!     L7
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 7 and name N )
       (resid 7 and name HN ) 16.656  2.05
!!     L8
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 8 and name N )
       (resid 8 and name HN ) 16.902  2.05
!!     S11
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 11 and name N )
       (resid 11 and name HN ) 15.092  2.05
!!     I12
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 12 and name N )
       (resid 12 and name HN ) 16.75  2.05
!!     I13
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 13 and name N )
       (resid 13 and name HN ) 13.768  2.05
!!     T15
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 15 and name N )
       (resid 15 and name HN ) 17.734  2.05
!!     V18
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 18 and name N )
       (resid 18 and name HN ) 15.384  2.05
!!     A19
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 19 and name N )
       (resid 19 and name HN ) 15.424  2.05
!!     L20
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 20 and name N )
       (resid 20 and name HN ) 13.572  2.05
!!     S21
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 21 and name N )
       (resid 21 and name HN ) 11.846  2.05
!!     S22
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 22 and name N )
       (resid 22 and name HN ) 18.52  2.05
!!     T24
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 24 and name N )
       (resid 24 and name HN ) 15.344  2.05
!!     V26
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 26 and name N )
       (resid 26 and name HN ) 12.956  2.05
!!     L27
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 27 and name N )
       (resid 27 and name HN ) 18.714  2.05
!!     V28
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 28 and name N )
       (resid 28 and name HN ) 14.894  2.05
!!     I29
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 29 and name N )
       (resid 29 and name HN ) 11.96  2.05
!!     L30
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 30 and name N )
       (resid 30 and name HN ) 15.620  2.05
!!     L31
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 31 and name N )
       (resid 31 and name HN ) 17.294  2.05
!!     V33
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 33 and name N )
       (resid 33 and name HN ) 16.51  2.05
!!     V34
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 34 and name N )
       (resid 34 and name HN ) 15.384  2.05
!!     L36
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 36 and name N )
       (resid 36 and name HN ) 12.2  2.05
!!     S37
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 37 and name N )
       (resid 37 and name HN ) 10.822  2.05
!!     A38
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 38 and name N )
       (resid 38 and name HN ) 18.246  2.05
!!     L39
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 39 and name N )
       (resid 39 and name HN ) 19.012  2.05
!!     T40
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 40 and name N )
       (resid 40 and name HN ) 18.268  2.05
!!     L47
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 47 and name N )
       (resid 47 and name HN ) 16.314  2.05
!!     L48
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 48 and name N )
       (resid 48 and name HN ) 14.906  2.05
!!     A50
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 50 and name N )
       (resid 50 and name HN ) 12.886  2.05
!!     L51
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 51 and name N )
       (resid 51 and name HN ) 17.244  2.05
!!     A52
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 52 and name N )
       (resid 52 and name HN ) 12.29  2.05
!!     I53
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 53 and name N )
       (resid 53 and name HN ) 13.67  2.05
!!     F54
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 54 and name N )
       (resid 54 and name HN ) 17.94  2.05
!!     I55
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 55 and name N )
       (resid 55 and name HN ) 14.692  2.05
!!     G56
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 56 and name N )
       (resid 56 and name HN ) 10.278  2.05
!!     L57
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 57 and name N )
       (resid 57 and name HN ) 15.236  2.05
!!     T58
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 58 and name N )
       (resid 58 and name HN ) 16.95  2.05
!!     I59
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 59 and name N )
       (resid 59 and name HN ) 15.33  2.05
!!     Y60
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 60 and name N )
       (resid 60 and name HN ) 15.294  2.05
!!     A61
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 61 and name N )
       (resid 61 and name HN ) 12.2  2.05
!!     I62
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 62 and name N )
       (resid 62 and name HN ) 15.97  2.05
!!     Q63
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 63 and name N )
       (resid 63 and name HN ) 13.768  2.05
!!     R64
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 64 and name N )
       (resid 64 and name HN ) 12.494  2.05
!!     K65
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 65 and name N )
       (resid 65 and name HN ) 14.256  2.05
!!     Q67
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 67 and name N )
       (resid 67 and name HN ) 14.600  2.05
!! NH Dipolar coupling (kHz) Measured from MAS experiments.
!! Implement as absolute values (useSign=FALSE)

!!     T6
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 6 and name N )
       (resid 6 and name HN ) 3.874  2.05
!!     R9
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 9 and name N )
       (resid 9 and name HN ) 9.066  2.05
!!     V10
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 10 and name N )
       (resid 10 and name HN ) 7.134  2.05
!!     T16
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 16 and name N )
       (resid 16 and name HN ) 6.34  2.05
!!     L17
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 17 and name N )
       (resid 17 and name HN ) 8.710  2.05
!!     F23
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 23 and name N )
       (resid 23 and name HN ) 7.254  2.05
!!     Y42
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 42 and name N )
       (resid 42 and name HN ) 1.648  2.05
!!     L43
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 43 and name N )
       (resid 43 and name HN ) 1.23  2.05
!!     D44
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 44 and name N )
       (resid 44 and name HN ) 3.456  2.05
!!     Y45
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 45 and name N )
       (resid 45 and name HN ) 1.574  2.05
!!     V46
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 46 and name N )
       (resid 46 and name HN ) 1.176  2.05
!!     R66
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 66 and name N )
       (resid 66 and name HN ) 8.038  2.05
!!     A68
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 68 and name N )
       (resid 68 and name HN ) 7.06  2.05
!!     D69
assign (resid 700 and name OO )
       (resid 700 and name Z  )
       (resid 700 and name X  )
       (resid 700 and name Y  )
       (resid 69 and name N )
       (resid 69 and name HN ) 4.196  2.05
!! NH Dipolar coupling (kHz) Measured from static aligned sample experiments.
!!     K5
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 5 and name N )
       (resid 5 and name HN ) 12.510  2.05
!!     T6
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 6 and name N )
       (resid 6 and name HN ) 18.645  2.05
!!     L7
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 7 and name N )
       (resid 7 and name HN ) 13.165  2.05
!!     L8
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 8 and name N )
       (resid 8 and name HN ) 15.120  2.05
!!     S11
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 11 and name N )
       (resid 11 and name HN ) 13.365  2.05
!!     I12
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 12 and name N )
       (resid 12 and name HN ) 18.360  2.05
!!     I13
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 13 and name N )
       (resid 13 and name HN ) 14.670  2.05
!!     G14
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 ) 10.530  2.05
!!     T15
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 ) 19.550  2.05
!!     V18
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 ) 10.620  2.05
!!     A19
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 ) 17.065  2.05
!!     L20
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 20 and name N )
       (resid 20 and name HN ) 12.210  2.05
!!     S21
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 ) 10.550  2.05
!!     S22
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 ) 18.075  2.05
!!     F23
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 ) 12.380  2.05
!!     T24
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 N )
       (resid 24 and name HN ) 12.870  2.05
!!     V26
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 N )
       (resid 26 and name HN ) 10.440  2.05
!!     L27
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 ) 15.405  2.05
!!     V28
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 ) 14.325  2.05
!!     I29
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 ) 12.800  2.05
!!     L30
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 ) 13.785  2.05
!!     L31
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 ) 17.570  2.05
!!     G32
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 ) 16.565  2.05
!!     V33
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 ) 12.270  2.05
!!     V34
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 ) 15.380  2.05
!!     G35
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 ) 19.340  2.05
!!     L36
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 ) 15.165  2.05
!!     S37
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 ) 11.910  2.05
!!     A38
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 ) 18.690  2.05
!!     L39
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 ) 18.660  2.05
!!     T40
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 ) 18.830  2.05
!!     L47
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 ) 15.905  2.05
!!     L48
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 ) 15.585  2.05
!!     A50
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 ) 17.595  2.05
!!     L51
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 ) 18.660  2.05
!!     A52
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 ) 12.795  2.05
!!     I53
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 ) 13.190  2.05
!!     F54
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 ) 17.340  2.05
!!     I55
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 ) 15.980  2.05
!!     G56
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 ) 12.575  2.05
!!     L57
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 ) 15.720  2.05
!!     T58
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 ) 19.520  2.05
!!     I59
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 ) 13.795  2.05
!!     Y60
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 ) 13.875  2.05
!!     A61
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 ) 17.595  2.05
!!     I62
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 ) 17.310  2.05
!!     Q63
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 ) 12.795  2.05
!!     R64
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 ) 12.875  2.05
!!     K65
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 ) 13.795  2.05
!!     Q67
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 ) 16.235  2.05
!! NH Dipolar coupling (kHz) Measured from aligned sample experiments.
!! Implement as absolute values (useSign=FALSE)
!!     R9
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 9 and name N )
       (resid 9 and name HN ) 8.250  2.05
!!     V10
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 10 and name N )
       (resid 10 and name HN ) 9.165  2.05
!!     T16
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 ) 7.740  2.05
!!     L17
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 ) 7.875  2.05
!!     F23 move to other list
!!     G41
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 ) 3.845  2.05
!!     Y42
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 ) 1.360  2.05
!!     L43
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 ) 0.800  2.05
!!     D44
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 ) 5.330  2.05
!!     Y45
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 ) 3.845  2.05
!!     V46
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 ) 1.925  2.05
!!     R66
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 ) 8.250  2.05
!!     A68
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 ) 5.025  2.05
!!     D69
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 ) 4.310  2.05
!!     A70
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 ) 1.750  2.05
!! Backbone N csa of non-Glys measured from static aligned sample experiments. 

!!     K5
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 4 and name C )
       (resid 5 and name N )
       (resid 5 and name HN ) 48.20  5
!!     T6
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 5 and name C )
       (resid 6 and name N )
       (resid 6 and name HN ) 65.81  5
!!     L7
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 6 and name C )
       (resid 7 and name N )
       (resid 7 and name HN ) 50.15   5
!!     L8
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 7 and name C )
       (resid 8 and name N )
       (resid 8 and name HN ) 88.59   5
!!     R9
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 8 and name C )
       (resid 9 and name N )
       (resid 9 and name HN ) 31.21   5
!!     V10
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 9 and name C )
       (resid 10 and name N )
       (resid 10 and name HN ) 63.47   5
!!     S11
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 10 and name C )
       (resid 11 and name N )
       (resid 11 and name HN ) 95.54   5
!!     I12
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 11 and name C )
       (resid 12 and name N )
       (resid 12 and name HN ) 64.27  5
!!     I13
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 12 and name C )
       (resid 13 and name N )
       (resid 13 and name HN ) 34.74  5
!!     T15
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 C )
       (resid 15 and name N )
       (resid 15 and name HN ) 65.46  5
!!     T16
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 C )
       (resid 16 and name N )
       (resid 16 and name HN ) 41.14  5
!!     L17
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 C )
       (resid 17 and name N )
       (resid 17 and name HN ) 72.07   5
!!     V18
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 C )
       (resid 18 and name N )
       (resid 18 and name HN ) 86.25   5
!!     A19
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 C )
       (resid 19 and name N )
       (resid 19 and name HN ) 78.47   5
!!     L20
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 C )
       (resid 20 and name N )
       (resid 20 and name HN ) 45.81   5
!!     S21
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 20 and name C )
       (resid 21 and name N )
       (resid 21 and name HN ) 76.79   5
!!     S22
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 C )
       (resid 22 and name N )
       (resid 22 and name HN ) 83.81   5
!!     F23
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 C )
       (resid 23 and name N )
       (resid 23 and name HN ) 44.81   5
!!     T24
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 C )
       (resid 24 and name N )
       (resid 24 and name HN ) 101.47   5
!!     V26
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 25 and name C )
       (resid 26 and name N )
       (resid 26 and name HN ) 76.80   5
!!     L27
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 C )
       (resid 27 and name N )
       (resid 27 and name HN ) 87.94    5
!!     V28
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 C )
       (resid 28 and name N )
       (resid 28 and name HN ) 69.64   5
!!     I29
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 C )
       (resid 29 and name N )
       (resid 29 and name HN ) 67.74    5
!!     L30
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 C )
       (resid 30 and name N )
       (resid 30 and name HN ) 91.82   5
!!     L31
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 C )
       (resid 31 and name N )
       (resid 31 and name HN ) 79.72    5
!!     V33
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 C )
       (resid 33 and name N )
       (resid 33 and name HN ) 67.24   5
!!     V34
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 C )
       (resid 34 and name N )
       (resid 34 and name HN ) 82.37   5
!!     L36
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 C )
       (resid 36 and name N )
       (resid 36 and name HN ) 57.68   5
!!     S37
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 C )
       (resid 37 and name N )
       (resid 37 and name HN ) 67.09   5
!!     A38
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 C )
       (resid 38 and name N )
       (resid 38 and name HN ) 91.16   5
!!     L39
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 C )
       (resid 39 and name N )
       (resid 39 and name HN ) 61.80   5
!!     T40
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 C )
       (resid 40 and name N )
       (resid 40 and name HN ) 65.92   5
!!     Y42
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 C )
       (resid 42 and name N )
       (resid 42 and name HN ) -26.59  5
!!     L43
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 C )
       (resid 43 and name N )
       (resid 43 and name HN ) -5.57    5
!!     D44
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 C )
       (resid 44 and name N )
       (resid 44 and name HN ) -20.92   5
!!     Y45
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 C )
       (resid 45 and name N )
       (resid 45 and name HN ) 7.21    5
!!     V46
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 C )
       (resid 46 and name N )
       (resid 46 and name HN ) 23.98   5
!!     L47
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 C )
       (resid 47 and name N )
       (resid 47 and name HN ) 59.92    5
!!     L48
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 C )
       (resid 48 and name N )
       (resid 48 and name HN ) 43.59     5
!!     A50
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 49 and name C )
       (resid 50 and name N )
       (resid 50 and name HN ) 97.66   5
!!     L51
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 C )
       (resid 51 and name N )
       (resid 51 and name HN ) 61.80   5
!!     A52
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 C )
       (resid 52 and name N )
       (resid 52 and name HN ) 59.12   5
!!     I53
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 C )
       (resid 53 and name N )
       (resid 53 and name HN ) 95.54   5
!!     F54
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 C )
       (resid 54 and name N )
       (resid 54 and name HN ) 80.06   5
!!     I55
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 C )
       (resid 55 and name N )
       (resid 55 and name HN ) 49.41   5
!!     L57
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 C )
       (resid 57 and name N )
       (resid 57 and name HN ) 97.91    5
!!     T58
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 C )
       (resid 58 and name N )
       (resid 58 and name HN ) 71.28   5
!!     I59
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 C )
       (resid 59 and name N )
       (resid 59 and name HN ) 58.45   5
!!     Y60
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 C )
       (resid 60 and name N )
       (resid 60 and name HN ) 91.03   5
!!     A61
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 C )
       (resid 61 and name N )
       (resid 61 and name HN ) 97.66   5
!!     I62
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 C )
       (resid 62 and name N )
       (resid 62 and name HN ) 62.90    5
!!     Q63
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 C )
       (resid 63 and name N )
       (resid 63 and name HN ) 59.12   5
!!     R64
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 C )
       (resid 64 and name N )
       (resid 64 and name HN ) 83.98   5
!!     K65
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 C )
       (resid 65 and name N )
       (resid 65 and name HN ) 58.45   5
!!     R66
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 C )
       (resid 66 and name N )
       (resid 66 and name HN ) 31.21   5
!!     Q67
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 C )
       (resid 67 and name N )
       (resid 67 and name HN ) 71.69   5
!!     A68
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 C )
       (resid 68 and name N )
       (resid 68 and name HN ) 13.84   5
!!     D69
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 C )
       (resid 69 and name N )
       (resid 69 and name HN ) 32.85    5
!!     A70
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 C )
       (resid 70 and name N )
       (resid 70 and name HN ) -7.71   5
!! Backbone N csa of Glys measured from static aligned sample experiments. 
!!     G14
assign (resid 600 and name OO )
       (resid 600 and name Z  )
       (resid 600 and name X  )
       (resid 600 and name Y  )
       (resid 13 and name C )
       (resid 14 and name N )
       (resid 14 and name HN ) 66.81   5
!!     G32
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 C )
       (resid 32 and name N )
       (resid 32 and name HN ) 49.94   5
!!     G35
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 C )
       (resid 35 and name N )
       (resid 35 and name HN ) 43.75   5
!!     G41
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 C )
       (resid 41 and name N )
       (resid 41 and name HN ) -30.37 5
!!     G56
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 C )
       (resid 56 and name N )
       (resid 56 and name HN ) 70.30    5




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