NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
|
|
5668 |
1hry   |
cing | 1-original | 15 | XPLOR/CNS | chemical shift |
!remark Ca and Cb shifts
!! 3
assign (resid 2 and name c ) (resid 3 and name n )
(resid 3 and name ca) (resid 3 and name c )
(resid 4 and name n ) 54.76 41.50
!! 4
assign (resid 3 and name c ) (resid 4 and name n )
(resid 4 and name ca) (resid 4 and name c )
(resid 5 and name n ) 55.99 31.37
!! 5
assign (resid 4 and name c ) (resid 5 and name n )
(resid 5 and name ca) (resid 5 and name c )
(resid 6 and name n ) 62.71 32.13
!! 6
assign (resid 5 and name c ) (resid 6 and name n )
(resid 6 and name ca) (resid 6 and name c )
(resid 7 and name n ) 56.31 34.66
!! 7
! assign (resid 6 and name c ) (resid 7 and name n )
! (resid 7 and name ca) (resid 7 and name c )
! (resid 8 and name n ) 55.17 29.52
!! 8
! assign (resid 7 and name c ) (resid 8 and name n )
! (resid 8 and name ca) (resid 8 and name c )
! (resid 9 and name n ) 61.93 31.57
!! 9
assign (resid 8 and name c ) (resid 9 and name n )
(resid 9 and name ca) (resid 9 and name c )
(resid 10 and name n ) 56.67 36.48
!! 10
assign (resid 9 and name c ) (resid 10 and name n )
(resid 10 and name ca) (resid 10 and name c )
(resid 11 and name n ) 51.48 38.35
!! 11
assign (resid 10 and name c ) (resid 11 and name n )
(resid 11 and name ca) (resid 11 and name c )
(resid 12 and name n ) 56.24 19.63
!! 12
assign (resid 11 and name c ) (resid 12 and name n )
(resid 12 and name ca) (resid 12 and name c )
(resid 13 and name n ) 59.86 38.43
!! 13
assign (resid 12 and name c ) (resid 13 and name n )
(resid 13 and name ca) (resid 13 and name c )
(resid 14 and name n ) 61.39 34.22
!! 14
assign (resid 13 and name c ) (resid 14 and name n )
(resid 14 and name ca) (resid 14 and name c )
(resid 15 and name n ) 67.07 32.29
!! 15
assign (resid 14 and name c ) (resid 15 and name n )
(resid 15 and name ca) (resid 15 and name c )
(resid 16 and name n ) 61.07 29.63
!! 16
assign (resid 15 and name c ) (resid 16 and name n )
(resid 16 and name ca) (resid 16 and name c )
(resid 17 and name n ) 61.27 63.09
!! 17
assign (resid 16 and name c ) (resid 17 and name n )
(resid 17 and name ca) (resid 17 and name c )
(resid 18 and name n ) 60.72 30.02
!! 18
assign (resid 17 and name c ) (resid 18 and name n )
(resid 18 and name ca) (resid 18 and name c )
(resid 19 and name n ) 56.07 41.05
!! 19
assign (resid 18 and name c ) (resid 19 and name n )
(resid 19 and name ca) (resid 19 and name c )
(resid 20 and name n ) 57.27 28.16
!! 20
assign (resid 19 and name c ) (resid 20 and name n )
(resid 20 and name ca) (resid 20 and name c )
(resid 21 and name n ) 60.34 30.60
!! 21
assign (resid 20 and name c ) (resid 21 and name n )
(resid 21 and name ca) (resid 21 and name c )
(resid 22 and name n ) 59.38 29.94
!! 22
assign (resid 21 and name c ) (resid 22 and name n )
(resid 22 and name ca) (resid 22 and name c )
(resid 23 and name n ) 59.64 32.81
!! 23
assign (resid 22 and name c ) (resid 23 and name n )
(resid 23 and name ca) (resid 23 and name c )
(resid 24 and name n ) 58.92 32.91
!! 24
assign (resid 23 and name c ) (resid 24 and name n )
(resid 24 and name ca) (resid 24 and name c )
(resid 25 and name n ) 54.75 19.05
!! 25
assign (resid 24 and name c ) (resid 25 and name n )
(resid 25 and name ca) (resid 25 and name c )
(resid 26 and name n ) 57.27 42.39
!! 26
assign (resid 25 and name c ) (resid 26 and name n )
(resid 26 and name ca) (resid 26 and name c )
(resid 27 and name n ) 57.77 30.81
!! 27
assign (resid 26 and name c ) (resid 27 and name n )
(resid 27 and name ca) (resid 27 and name c )
(resid 28 and name n ) 51.07 40.42
!! 28
assign (resid 27 and name c ) (resid 28 and name n )
(resid 28 and name ca) (resid 28 and name c )
(resid 29 and name n ) 64.78 32.51
!! 29
assign (resid 28 and name c ) (resid 29 and name n )
(resid 29 and name ca) (resid 29 and name c )
(resid 30 and name n ) 55.85 30.03
!! 30
assign (resid 29 and name c ) (resid 30 and name n )
(resid 30 and name ca) (resid 30 and name c )
(resid 31 and name n ) 56.89 34.64
!! 31
assign (resid 30 and name c ) (resid 31 and name n )
(resid 31 and name ca) (resid 31 and name c )
(resid 32 and name n ) 56.01 31.36
!! 34
assign (resid 33 and name c ) (resid 34 and name n )
(resid 34 and name ca) (resid 34 and name c )
(resid 35 and name n ) 58.69 29.89
!! 35
assign (resid 34 and name c ) (resid 35 and name n )
(resid 35 and name ca) (resid 35 and name c )
(resid 36 and name n ) 66.03 37.67
!! 36
assign (resid 35 and name c ) (resid 36 and name n )
(resid 36 and name ca) (resid 36 and name c )
(resid 37 and name n ) 63.00 63.04
!! 37
assign (resid 36 and name c ) (resid 37 and name n )
(resid 37 and name ca) (resid 37 and name c )
(resid 38 and name n ) 60.46 32.77
!! 38
assign (resid 37 and name c ) (resid 38 and name n )
(resid 38 and name ca) (resid 38 and name c )
(resid 39 and name n ) 58.90 28.23
!! 39
assign (resid 38 and name c ) (resid 39 and name n )
(resid 39 and name ca) (resid 39 and name c )
(resid 40 and name n ) 58.40 41.96
!! G40
assign (resid 39 and name c ) (resid 40 and name n )
(resid 40 and name ca) (resid 40 and name c )
(resid 41 and name n ) 48.60 0.00
!! 41
assign (resid 40 and name c ) (resid 41 and name n )
(resid 41 and name ca) (resid 41 and name c )
(resid 42 and name n ) 60.67 38.10
!! 42
assign (resid 41 and name c ) (resid 42 and name n )
(resid 42 and name ca) (resid 42 and name c )
(resid 43 and name n ) 59.29 29.15
!! 43
assign (resid 42 and name c ) (resid 43 and name n )
(resid 43 and name ca) (resid 43 and name c )
(resid 44 and name n ) 60.02 29.81
!! 44
assign (resid 43 and name c ) (resid 44 and name n )
(resid 44 and name ca) (resid 44 and name c )
(resid 45 and name n ) 58.75 32.36
!! 45
assign (resid 44 and name c ) (resid 45 and name n )
(resid 45 and name ca) (resid 45 and name c )
(resid 46 and name n ) 55.22 32.90
!! 46
assign (resid 45 and name c ) (resid 46 and name n )
(resid 46 and name ca) (resid 46 and name c )
(resid 47 and name n ) 55.25 42.77
!! 47
assign (resid 46 and name c ) (resid 47 and name n )
(resid 47 and name ca) (resid 47 and name c )
(resid 48 and name n ) 61.30 71.50
!! 48
assign (resid 47 and name c ) (resid 48 and name n )
(resid 48 and name ca) (resid 48 and name c )
(resid 49 and name n ) 60.52 29.30
!! 49
assign (resid 48 and name c ) (resid 49 and name n )
(resid 49 and name ca) (resid 49 and name c )
(resid 50 and name n ) 55.05 18.51
!! 50
assign (resid 49 and name c ) (resid 50 and name n )
(resid 50 and name ca) (resid 50 and name c )
(resid 51 and name n ) 58.56 31.50
!! 51
assign (resid 50 and name c ) (resid 51 and name n )
(resid 51 and name ca) (resid 51 and name c )
(resid 52 and name n ) 59.06 34.13
!! 52
assign (resid 51 and name c ) (resid 52 and name n )
(resid 52 and name ca) (resid 52 and name c )
(resid 53 and name n ) 62.80 27.67
!! 53
assign (resid 52 and name c ) (resid 53 and name n )
(resid 53 and name ca) (resid 53 and name c )
(resid 54 and name n ) 66.01 31.11
!! 54
assign (resid 53 and name c ) (resid 54 and name n )
(resid 54 and name ca) (resid 54 and name c )
(resid 55 and name n ) 61.76 38.28
!! 55
assign (resid 54 and name c ) (resid 55 and name n )
(resid 55 and name ca) (resid 55 and name c )
(resid 56 and name n ) 62.80 38.82
!! 56
assign (resid 55 and name c ) (resid 56 and name n )
(resid 56 and name ca) (resid 56 and name c )
(resid 57 and name n ) 59.40 28.43
!! 57
assign (resid 56 and name c ) (resid 57 and name n )
(resid 57 and name ca) (resid 57 and name c )
(resid 58 and name n ) 59.31 29.45
!! 58
assign (resid 57 and name c ) (resid 58 and name n )
(resid 58 and name ca) (resid 58 and name c )
(resid 59 and name n ) 55.63 17.91
!! 59
assign (resid 58 and name c ) (resid 59 and name n )
(resid 59 and name ca) (resid 59 and name c )
(resid 60 and name n ) 59.51 28.34
!! 60
assign (resid 59 and name c ) (resid 60 and name n )
(resid 60 and name ca) (resid 60 and name c )
(resid 61 and name n ) 59.80 32.15
!! 61
assign (resid 60 and name c ) (resid 61 and name n )
(resid 61 and name ca) (resid 61 and name c )
(resid 62 and name n ) 58.03 41.71
!! 62
assign (resid 61 and name c ) (resid 62 and name n )
(resid 62 and name ca) (resid 62 and name c )
(resid 63 and name n ) 59.47 28.34
!! 63
assign (resid 62 and name c ) (resid 63 and name n )
(resid 63 and name ca) (resid 63 and name c )
(resid 64 and name n ) 55.47 17.97
!! 64
assign (resid 63 and name c ) (resid 64 and name n )
(resid 64 and name ca) (resid 64 and name c )
(resid 65 and name n ) 58.73 33.28
!! 65
assign (resid 64 and name c ) (resid 65 and name n )
(resid 65 and name ca) (resid 65 and name c )
(resid 66 and name n ) 61.02 31.87
!! 66
assign (resid 65 and name c ) (resid 66 and name n )
(resid 66 and name ca) (resid 66 and name c )
(resid 67 and name n ) 58.38 30.40
!! 67
assign (resid 66 and name c ) (resid 67 and name n )
(resid 67 and name ca) (resid 67 and name c )
(resid 68 and name n ) 58.51 30.14
!! 68
assign (resid 67 and name c ) (resid 68 and name n )
(resid 68 and name ca) (resid 68 and name c )
(resid 69 and name n ) 58.13 33.45
!! 69
!! 70
!! 71
!! 72
!! 73
assign (resid 72 and name c ) (resid 73 and name n )
(resid 73 and name ca) (resid 73 and name c )
(resid 74 and name n ) 54.94 34.76
!! 74
!! 75
assign (resid 74 and name c ) (resid 75 and name n )
(resid 75 and name ca) (resid 75 and name c )
(resid 76 and name n ) 53.16 31.11
!! 76
assign (resid 75 and name c ) (resid 76 and name n )
(resid 76 and name ca) (resid 76 and name c )
(resid 77 and name n ) 62.92 32.34
!! 77
assign (resid 76 and name c ) (resid 77 and name n )
(resid 77 and name ca) (resid 77 and name c )
(resid 78 and name n ) 56.80 30.82
!! 78
assign (resid 77 and name c ) (resid 78 and name n )
(resid 78 and name ca) (resid 78 and name c )
(resid 79 and name n ) 57.32 32.04
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