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
580155 4cio 18846 cing 1-original 4 XPLOR/CNS dipolar coupling


!!aligned with PEG/hexanol with splitting 35.5 Hz
!!
!!Da=-18
!!R=0.65

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  33  and name  HN  )
       ( resid  33  and name  N   )  -3.5 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  34  and name  HN  )
       ( resid  34  and name  N   )  7.0 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  35  and name  HN  )
       ( resid  35  and name  N   )  -5.2 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  36  and name  HN  )
       ( resid  36  and name  N   )  -12.2 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  40  and name  HN  )
       ( resid  40  and name  N   )  18.2 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  47  and name  HN  )
       ( resid  47  and name  N   )  15.8 0.50

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  48  and name  HN  )
       ( resid  48  and name  N   )  -11.9 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  49  and name  HN  )
       ( resid  49  and name  N   )  -4.6 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  52  and name  HN  )
       ( resid  52  and name  N   )  -9.8 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  53  and name  HN  )
       ( resid  53  and name  N   )  -4.2 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  54  and name  HN  )
       ( resid  54  and name  N   )  8.4 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  55  and name  HN  )
       ( resid  55  and name  N   )  -19.2 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  56  and name  HN  )
       ( resid  56  and name  N   )  -15.4 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  57  and name  HN  )
       ( resid  57  and name  N   )  3.8 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  58  and name  HN  )
       ( resid  58  and name  N   )  -2.1 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  59  and name  HN  )
       ( resid  59  and name  N   )  -11.2 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  60  and name  HN  )
       ( resid  60  and name  N   )  -8.4 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  61  and name  HN  )
       ( resid  61  and name  N   )  3.8 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  62  and name  HN  )
       ( resid  62  and name  N   )  -5.2 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  63  and name  HN  )
       ( resid  63  and name  N   )  -16.1 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  64  and name  HN  )
       ( resid  64  and name  N   )  -6.6 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  65  and name  HN  )
       ( resid  65  and name  N   )  -21.4 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  67  and name  HN  )
       ( resid  67  and name  N   )  -14.6 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  68  and name  HN  )
       ( resid  68  and name  N   )  6.6 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  69  and name  HN  )
       ( resid  69  and name  N   )  -4.2 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  70  and name  HN  )
       ( resid  70  and name  N   )  -3.9 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  71  and name  HN  )
       ( resid  71  and name  N   )  -7.7 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  72  and name  HN  )
       ( resid  72  and name  N   )  -13.3 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  74  and name  HN  )
       ( resid  74  and name  N   )  7.7 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  76  and name  HN  )
       ( resid  76  and name  N   )  -9.5 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  79  and name  HN  )
       ( resid  79  and name  N   )  -17.7 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  80  and name  HN  )
       ( resid  80  and name  N   )  0.7 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  82  and name  HN  )
       ( resid  82  and name  N   )  -14.0 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  83  and name  HN  )
       ( resid  83  and name  N   )  -4.2 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  84  and name  HN  )
       ( resid  84  and name  N   )  2.1 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  85  and name  HN  )
       ( resid  85  and name  N   )  -6.3 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  86  and name  HN  )
       ( resid  86  and name  N   )  -6.3 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  87  and name  HN  )
       ( resid  87  and name  N   )  4.2 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  89  and name  HN  )
       ( resid  89  and name  N   )  2.1 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  90  and name  HN  )
       ( resid  90  and name  N   )  2.1 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  91  and name  HN  )
       ( resid  91  and name  N   )  4.8 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  92  and name  HN  )
       ( resid  92  and name  N   )  -2.4 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  93  and name  HN  )
       ( resid  93  and name  N   )  -0.7 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  94  and name  HN  )
       ( resid  94  and name  N   )  8.0 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  95  and name  HN  )
       ( resid  95  and name  N   )  -2.4 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  97  and name  HN  )
       ( resid  97  and name  N   )  7.0 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  99  and name  HN  )
       ( resid  99  and name  N   )  11.6 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 100   and name  HN  )
       ( resid 100   and name  N   )  9.8 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 101   and name  HN  )
       ( resid 101   and name  N   )  11.6 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 102   and name  HN  )
       ( resid 102   and name  N   )  6.6 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 103   and name  HN  )
       ( resid 103   and name  N   )  2.4 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 104   and name  HN  )
       ( resid 104   and name  N   )  3.5 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 105   and name  HN  )
       ( resid 105   and name  N   )  6.3 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 107   and name  HN  )
       ( resid 107   and name  N   )  -3.5 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 108   and name  HN  )
       ( resid 108   and name  N   )  -15.30 1.05

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 109   and name  HN  )
       ( resid 109   and name  N   )  -19.3 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 110   and name  HN  )
       ( resid 110   and name  N   )  11.6 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 113   and name  HN  )
       ( resid 113   and name  N   )  4.9 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 114   and name  HN  )
       ( resid 114   and name  N   )  -8.8 0.5

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid 115   and name  HN  )
       ( resid 115   and name  N   )  -16.1 0.5






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