NMR Restraints Grid
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NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
640082 |
6p6b   |
30613 | cing | 1-original | 1 | XPLOR/CNS | chemical shift |
# Restraints file 1: pea-15c13shifts_ded.tbl
!PEA-15
!CA and CB shifts
!! A2
assign (resid 1 and name c ) (resid 2 and name n )
(resid 2 and name ca) (resid 2 and name c )
(resid 3 and name n ) 54.65 18.39
!! E3
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 ) 59.40 29.56
!! Y4
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 ) 60.63 38.40
!! G5
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 ) 47.14 0.00
!! T6
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 ) 66.45 68.39
!! L7
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 ) 58.22 39.75
!! L8
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 ) 58.13 40.14
!! Q9
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 ) 58.78 28.93
!! D10
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 ) 57.68 39.94
!! L11
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 ) 58.49 43.25
!! T12
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 ) 67.83 68.52
!! N13
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 ) 54.65 38.26
!! N14
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 ) 53.36 41.46
!! I15
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 ) 60.88 41.34
!! T16
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 ) 60.80 71.26
!! L17
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 ) 58.69 41.33
!! E18
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 ) 59.99 29.15
!! D19
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 ) 56.59 41.31
!! L20
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 ) 56.91 41.10
!! E21
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 ) 59.27 28.92
!! E22
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 ) 58.59 28.24
!! L23
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 ) 57.79 39.62
!! K24
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 ) 60.55 31.81
!! S25
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 ) 61.56 62.57
!! A26
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 ) 54.25 18.71
!! C27
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 ) 59.38 28.63
!! K28
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 ) 58.42 31.55
!! E29
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 ) 58.24 28.86
!! D30
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 ) 55.88 41.53
!! I31
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 ) 58.03 38.77
!! P32
assign (resid 31 and name c ) (resid 32 and name n )
(resid 32 and name ca) (resid 32 and name c )
(resid 33 and name n ) 62.85 32.51
!! R33
assign (resid 32 and name c ) (resid 33 and name n )
(resid 33 and name ca) (resid 33 and name c )
(resid 34 and name n ) 61.13 63.00
!! E34
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 ) 58.70 28.71
!! K35
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 ) 55.46 32.26
!! S36
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 ) 61.45 62.82
!! E37
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 ) 58.11 29.54
!! E38
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 ) 56.49 30.10
!! I39
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 ) 60.92 37.40
!! T40
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 ) 61.17 69.91
!! T41
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 ) 59.12 73.44
!! G42
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 ) 47.51 0.00
!! S43
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 ) 61.52 62.45
!! A44
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 ) 54.53 19.33
!! W45
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 ) 61.63 27.52
!! F46
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 ) 61.69 37.85
!! S47
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 ) 61.72 62.77
!! F48
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 ) 61.79 38.93
!! L49
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 ) 58.23 41.53
!! E50
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 ) 59.18 30.62
!! S51
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 ) 60.58 62.88
!! H52
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 ) 56.42 28.42
!! N53
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 ) 54.81 36.76
!! K54
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 ) 54.26 33.55
!! L55
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 ) 55.27 46.38
!! D56
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 ) 53.67 42.32
!! K57
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 ) 58.65 31.32
!! D58
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 ) 54.28 43.06
!! N59
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 ) 52.73 38.88
!! L60
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 ) 54.25 42.19
!! S61
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 ) 62.00 62.99
!! Y62
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 ) 62.21 38.93
!! I63
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 ) 65.12 37.38
!! E64
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 ) 60.90 30.24
!! H65
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 ) 59.02 28.59
!! I66
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 ) 61.74 35.09
!! F67
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 ) 57.68 36.68
!! E68
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 ) 60.10 29.74
!! I69
assign (resid 68 and name c ) (resid 69 and name n )
(resid 69 and name ca) (resid 69 and name c )
(resid 70 and name n ) 64.23 37.63
!! S70
assign (resid 69 and name c ) (resid 70 and name n )
(resid 70 and name ca) (resid 70 and name c )
(resid 71 and name n ) 58.50 63.03
!! R71
assign (resid 70 and name c ) (resid 71 and name n )
(resid 71 and name ca) (resid 71 and name c )
(resid 72 and name n ) 56.45 26.35
!! R72
assign (resid 71 and name c ) (resid 72 and name n )
(resid 72 and name ca) (resid 72 and name c )
(resid 73 and name n ) 49.61 28.56
!! P73
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 ) 64.70 31.33
!! D74
assign (resid 73 and name c ) (resid 74 and name n )
(resid 74 and name ca) (resid 74 and name c )
(resid 75 and name n ) 55.99 38.04
!! L75
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 ) 56.36 38.64
!! L76
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 ) 58.85 42.61
!! T77
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 ) 66.88 68.99
!! M78
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 ) 59.84 32.70
!! V79
assign (resid 78 and name c ) (resid 79 and name n )
(resid 79 and name ca) (resid 79 and name c )
(resid 80 and name n ) 66.98 32.03
!! V80
assign (resid 79 and name c ) (resid 80 and name n )
(resid 80 and name ca) (resid 80 and name c )
(resid 81 and name n ) 67.11 31.85
!! D81
assign (resid 80 and name c ) (resid 81 and name n )
(resid 81 and name ca) (resid 81 and name c )
(resid 82 and name n ) 57.68 40.57
!! Y82
assign (resid 81 and name c ) (resid 82 and name n )
(resid 82 and name ca) (resid 82 and name c )
(resid 83 and name n ) 61.50 38.62
!! R83
assign (resid 82 and name c ) (resid 83 and name n )
(resid 83 and name ca) (resid 83 and name c )
(resid 84 and name n ) 59.88 30.38
!! T84
assign (resid 83 and name c ) (resid 84 and name n )
(resid 84 and name ca) (resid 84 and name c )
(resid 85 and name n ) 65.32 69.27
!! R85
assign (resid 84 and name c ) (resid 85 and name n )
(resid 85 and name ca) (resid 85 and name c )
(resid 86 and name n ) 58.91 30.81
!! V86
assign (resid 85 and name c ) (resid 86 and name n )
(resid 86 and name ca) (resid 86 and name c )
(resid 87 and name n ) 64.26 31.71
!! L87
assign (resid 86 and name c ) (resid 87 and name n )
(resid 87 and name ca) (resid 87 and name c )
(resid 88 and name n ) 56.06 41.73
!! K88
assign (resid 87 and name c ) (resid 88 and name n )
(resid 88 and name ca) (resid 88 and name c )
(resid 89 and name n ) 56.69 32.12
!! I89
assign (resid 88 and name c ) (resid 89 and name n )
(resid 89 and name ca) (resid 89 and name c )
(resid 90 and name n ) 61.87 38.66
!! S90
assign (resid 89 and name c ) (resid 90 and name n )
(resid 90 and name ca) (resid 90 and name c )
(resid 91 and name n ) 58.58 63.90
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