NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
280956 |
2kqp   |
16608 | cing | 1-original | 2 | XPLOR/CNS | dihedral angle |
!@ END_XPLR_NOE_FILE
! Talos output file pred_aa.tab converted to Xplor dihedral angle
! restraints file on Wed Nov 5 12:25:49 EST 2008 .
! For a given residue, first angle assigned is phi, second - psi.
! Restraining range is taken to be 20 if a standard deviation
! as reported by Talos is <10 or 2 * standard deviation rounded to
! next higher multiple of 10 otherwise.
! V2
assign (resid 1 and name c ) (resid 2 and name n)
(resid 2 and name ca) (resid 2 and name c) 1.0 -125 50 2
assign (resid 2 and name n) (resid 2 and name ca)
(resid 2 and name c) (resid 3 and name n ) 1.0 143 50 2
! N3
assign (resid 2 and name c ) (resid 3 and name n)
(resid 3 and name ca) (resid 3 and name c) 1.0 -104 70 2
assign (resid 3 and name n) (resid 3 and name ca)
(resid 3 and name c) (resid 4 and name n ) 1.0 141 30 2
! Q4
assign (resid 3 and name c ) (resid 4 and name n)
(resid 4 and name ca) (resid 4 and name c) 1.0 -104 50 2
assign (resid 4 and name n) (resid 4 and name ca)
(resid 4 and name c) (resid 5 and name n ) 1.0 137 50 2
! H5
assign (resid 4 and name c ) (resid 5 and name n)
(resid 5 and name ca) (resid 5 and name c) 1.0 -75 20 2
assign (resid 5 and name n) (resid 5 and name ca)
(resid 5 and name c) (resid 6 and name n ) 1.0 133 30 2
! L6
assign (resid 5 and name c ) (resid 6 and name n)
(resid 6 and name ca) (resid 6 and name c) 1.0 -100 30 2
assign (resid 6 and name n) (resid 6 and name ca)
(resid 6 and name c) (resid 7 and name n ) 1.0 136 20 2
! C7
assign (resid 6 and name c ) (resid 7 and name n)
(resid 7 and name ca) (resid 7 and name c) 1.0 -95 30 2
assign (resid 7 and name n) (resid 7 and name ca)
(resid 7 and name c) (resid 8 and name n ) 1.0 133 70 2
! G8
assign (resid 7 and name c ) (resid 8 and name n)
(resid 8 and name ca) (resid 8 and name c) 1.0 -61 20 2
assign (resid 8 and name n) (resid 8 and name ca)
(resid 8 and name c) (resid 9 and name n ) 1.0 -35 20 2
! S9
assign (resid 8 and name c ) (resid 9 and name n)
(resid 9 and name ca) (resid 9 and name c) 1.0 -63 20 2
assign (resid 9 and name n) (resid 9 and name ca)
(resid 9 and name c) (resid 10 and name n ) 1.0 -43 20 2
! D10
assign (resid 9 and name c ) (resid 10 and name n)
(resid 10 and name ca) (resid 10 and name c) 1.0 -68 20 2
assign (resid 10 and name n) (resid 10 and name ca)
(resid 10 and name c) (resid 11 and name n ) 1.0 -35 20 2
! L11
assign (resid 10 and name c ) (resid 11 and name n)
(resid 11 and name ca) (resid 11 and name c) 1.0 -69 20 2
assign (resid 11 and name n) (resid 11 and name ca)
(resid 11 and name c) (resid 12 and name n ) 1.0 -38 20 2
! V12
assign (resid 11 and name c ) (resid 12 and name n)
(resid 12 and name ca) (resid 12 and name c) 1.0 -61 20 2
assign (resid 12 and name n) (resid 12 and name ca)
(resid 12 and name c) (resid 13 and name n ) 1.0 -45 20 2
! E13
assign (resid 12 and name c ) (resid 13 and name n)
(resid 13 and name ca) (resid 13 and name c) 1.0 -60 20 2
assign (resid 13 and name n) (resid 13 and name ca)
(resid 13 and name c) (resid 14 and name n ) 1.0 -40 20 2
! A14
assign (resid 13 and name c ) (resid 14 and name n)
(resid 14 and name ca) (resid 14 and name c) 1.0 -66 20 2
assign (resid 14 and name n) (resid 14 and name ca)
(resid 14 and name c) (resid 15 and name n ) 1.0 -39 20 2
! L15
assign (resid 14 and name c ) (resid 15 and name n)
(resid 15 and name ca) (resid 15 and name c) 1.0 -63 20 2
assign (resid 15 and name n) (resid 15 and name ca)
(resid 15 and name c) (resid 16 and name n ) 1.0 -42 20 2
! Y16
assign (resid 15 and name c ) (resid 16 and name n)
(resid 16 and name ca) (resid 16 and name c) 1.0 -63 20 2
assign (resid 16 and name n) (resid 16 and name ca)
(resid 16 and name c) (resid 17 and name n ) 1.0 -43 30 2
! L17
assign (resid 16 and name c ) (resid 17 and name n)
(resid 17 and name ca) (resid 17 and name c) 1.0 -63 20 2
assign (resid 17 and name n) (resid 17 and name ca)
(resid 17 and name c) (resid 18 and name n ) 1.0 -43 20 2
! V18
assign (resid 17 and name c ) (resid 18 and name n)
(resid 18 and name ca) (resid 18 and name c) 1.0 -75 30 2
assign (resid 18 and name n) (resid 18 and name ca)
(resid 18 and name c) (resid 19 and name n ) 1.0 -33 30 2
! E21
assign (resid 20 and name c ) (resid 21 and name n)
(resid 21 and name ca) (resid 21 and name c) 1.0 -67 30 2
assign (resid 21 and name n) (resid 21 and name ca)
(resid 21 and name c) (resid 22 and name n ) 1.0 -38 30 2
! R22
assign (resid 21 and name c ) (resid 22 and name n)
(resid 22 and name ca) (resid 22 and name c) 1.0 -78 30 2
assign (resid 22 and name n) (resid 22 and name ca)
(resid 22 and name c) (resid 23 and name n ) 1.0 -22 30 2
! G23
assign (resid 22 and name c ) (resid 23 and name n)
(resid 23 and name ca) (resid 23 and name c) 1.0 78 30 2
assign (resid 23 and name n) (resid 23 and name ca)
(resid 23 and name c) (resid 24 and name n ) 1.0 24 30 2
! F24
assign (resid 23 and name c ) (resid 24 and name n)
(resid 24 and name ca) (resid 24 and name c) 1.0 -114 30 2
assign (resid 24 and name n) (resid 24 and name ca)
(resid 24 and name c) (resid 25 and name n ) 1.0 147 30 2
! F25
assign (resid 24 and name c ) (resid 25 and name n)
(resid 25 and name ca) (resid 25 and name c) 1.0 -95 50 2
assign (resid 25 and name n) (resid 25 and name ca)
(resid 25 and name c) (resid 26 and name n ) 1.0 135 30 2
! Y26
assign (resid 25 and name c ) (resid 26 and name n)
(resid 26 and name ca) (resid 26 and name c) 1.0 -84 50 2
assign (resid 26 and name n) (resid 26 and name ca)
(resid 26 and name c) (resid 27 and name n ) 1.0 138 30 2
! T27
assign (resid 26 and name c ) (resid 27 and name n)
(resid 27 and name ca) (resid 27 and name c) 1.0 -109 50 2
assign (resid 27 and name n) (resid 27 and name ca)
(resid 27 and name c) (resid 28 and name n ) 1.0 129 30 2
! K28
!assign (resid 27 and name c ) (resid 28 and name n)
! (resid 28 and name ca) (resid 28 and name c) 1.0 -83 50 2
!assign (resid 28 and name n) (resid 28 and name ca)
! (resid 28 and name c) (resid 29 and name n ) 1.0 135 50 2
! P29
!assign (resid 28 and name c ) (resid 29 and name n)
! (resid 29 and name ca) (resid 29 and name c) 1.0 -61 20 2
!assign (resid 29 and name n) (resid 29 and name ca)
! (resid 29 and name c) (resid 30 and name n ) 1.0 150 30 2
! T30
!assign (resid 29 and name c ) (resid 30 and name n)
! (resid 30 and name ca) (resid 30 and name c) 1.0 -139 30 2
!assign (resid 30 and name n) (resid 30 and name ca)
! (resid 30 and name c) (resid 31 and name n ) 1.0 142 50 2
! E35
!assign (resid 34 and name c ) (resid 35 and name n)
! (resid 35 and name ca) (resid 35 and name c) 1.0 -76 30 2
!assign (resid 35 and name n) (resid 35 and name ca)
! (resid 35 and name c) (resid 36 and name n ) 1.0 -28 50 2
! L37
!assign (resid 36 and name c ) (resid 37 and name n)
! (resid 37 and name ca) (resid 37 and name c) 1.0 -74 30 2
!assign (resid 37 and name n) (resid 37 and name ca)
! (resid 37 and name c) (resid 38 and name n ) 1.0 -29 50 2
! Q41
!assign (resid 40 and name c ) (resid 41 and name n)
! (resid 41 and name ca) (resid 41 and name c) 1.0 -107 90 2
!assign (resid 41 and name n) (resid 41 and name ca)
! (resid 41 and name c) (resid 42 and name n ) 1.0 144 50 2
! P48
!assign (resid 47 and name c ) (resid 48 and name n)
! (resid 48 and name ca) (resid 48 and name c) 1.0 -61 20 2
!assign (resid 48 and name n) (resid 48 and name ca)
! (resid 48 and name c) (resid 49 and name n ) 1.0 -26 20 2
! A50
!assign (resid 49 and name c ) (resid 50 and name n)
! (resid 50 and name ca) (resid 50 and name c) 1.0 -74 30 2
!assign (resid 50 and name n) (resid 50 and name ca)
! (resid 50 and name c) (resid 51 and name n ) 1.0 -14 50 2
! Q54
assign (resid 53 and name c ) (resid 54 and name n)
(resid 54 and name ca) (resid 54 and name c) 1.0 -83 30 2
assign (resid 54 and name n) (resid 54 and name ca)
(resid 54 and name c) (resid 55 and name n ) 1.0 147 30 2
! P55
assign (resid 54 and name c ) (resid 55 and name n)
(resid 55 and name ca) (resid 55 and name c) 1.0 -61 20 2
!assign (resid 55 and name n) (resid 55 and name ca)
! (resid 55 and name c) (resid 56 and name n ) 1.0 150 30 2
! L56
assign (resid 55 and name c ) (resid 56 and name n)
(resid 56 and name ca) (resid 56 and name c) 1.0 -75 30 2
assign (resid 56 and name n) (resid 56 and name ca)
(resid 56 and name c) (resid 57 and name n ) 1.0 -29 50 2
! A57
assign (resid 56 and name c ) (resid 57 and name n)
(resid 57 and name ca) (resid 57 and name c) 1.0 -75 30 2
assign (resid 57 and name n) (resid 57 and name ca)
(resid 57 and name c) (resid 58 and name n ) 1.0 -24 70 2
! L58
assign (resid 57 and name c ) (resid 58 and name n)
(resid 58 and name ca) (resid 58 and name c) 1.0 -74 30 2
assign (resid 58 and name n) (resid 58 and name ca)
(resid 58 and name c) (resid 59 and name n ) 1.0 -23 50 2
! E59
assign (resid 58 and name c ) (resid 59 and name n)
(resid 59 and name ca) (resid 59 and name c) 1.0 -68 30 2
assign (resid 59 and name n) (resid 59 and name ca)
(resid 59 and name c) (resid 60 and name n ) 1.0 -31 50 2
! G60
assign (resid 59 and name c ) (resid 60 and name n)
(resid 60 and name ca) (resid 60 and name c) 1.0 -67 20 2
assign (resid 60 and name n) (resid 60 and name ca)
(resid 60 and name c) (resid 61 and name n ) 1.0 -37 50 2
! S61
assign (resid 60 and name c ) (resid 61 and name n)
(resid 61 and name ca) (resid 61 and name c) 1.0 -68 30 2
assign (resid 61 and name n) (resid 61 and name ca)
(resid 61 and name c) (resid 62 and name n ) 1.0 -38 30 2
! L62
assign (resid 61 and name c ) (resid 62 and name n)
(resid 62 and name ca) (resid 62 and name c) 1.0 -69 30 2
assign (resid 62 and name n) (resid 62 and name ca)
(resid 62 and name c) (resid 63 and name n ) 1.0 -33 50 2
! Q63
assign (resid 62 and name c ) (resid 63 and name n)
(resid 63 and name ca) (resid 63 and name c) 1.0 -75 30 2
assign (resid 63 and name n) (resid 63 and name ca)
(resid 63 and name c) (resid 64 and name n ) 1.0 -25 50 2
! K64
!assign (resid 63 and name c ) (resid 64 and name n)
! (resid 64 and name ca) (resid 64 and name c) 1.0 -92 30 2
!assign (resid 64 and name n) (resid 64 and name ca)
! (resid 64 and name c) (resid 65 and name n ) 1.0 -9 50 2
! G66
!assign (resid 65 and name c ) (resid 66 and name n)
! (resid 66 and name ca) (resid 66 and name c) 1.0 90 20 2
!assign (resid 66 and name n) (resid 66 and name ca)
! (resid 66 and name c) (resid 67 and name n ) 1.0 -2 30 2
! V68
assign (resid 67 and name c ) (resid 68 and name n)
(resid 68 and name ca) (resid 68 and name c) 1.0 -79 30 2
assign (resid 68 and name n) (resid 68 and name ca)
(resid 68 and name c) (resid 69 and name n ) 1.0 -38 30 2
! E69
assign (resid 68 and name c ) (resid 69 and name n)
(resid 69 and name ca) (resid 69 and name c) 1.0 -95 50 2
assign (resid 69 and name n) (resid 69 and name ca)
(resid 69 and name c) (resid 70 and name n ) 1.0 -21 30 2
! Q70
assign (resid 69 and name c ) (resid 70 and name n)
(resid 70 and name ca) (resid 70 and name c) 1.0 -111 30 2
assign (resid 70 and name n) (resid 70 and name ca)
(resid 70 and name c) (resid 71 and name n ) 1.0 4 20 2
! C72
assign (resid 71 and name c ) (resid 72 and name n)
(resid 72 and name ca) (resid 72 and name c) 1.0 -74 30 2
assign (resid 72 and name n) (resid 72 and name ca)
(resid 72 and name c) (resid 73 and name n ) 1.0 -24 70 2
! T73
assign (resid 72 and name c ) (resid 73 and name n)
(resid 73 and name ca) (resid 73 and name c) 1.0 -82 30 2
assign (resid 73 and name n) (resid 73 and name ca)
(resid 73 and name c) (resid 74 and name n ) 1.0 -12 30 2
! C76
assign (resid 75 and name c ) (resid 76 and name n)
(resid 76 and name ca) (resid 76 and name c) 1.0 -112 30 2
assign (resid 76 and name n) (resid 76 and name ca)
(resid 76 and name c) (resid 77 and name n ) 1.0 151 30 2
! S77
assign (resid 76 and name c ) (resid 77 and name n)
(resid 77 and name ca) (resid 77 and name c) 1.0 -82 30 2
assign (resid 77 and name n) (resid 77 and name ca)
(resid 77 and name c) (resid 78 and name n ) 1.0 157 50 2
! L78
assign (resid 77 and name c ) (resid 78 and name n)
(resid 78 and name ca) (resid 78 and name c) 1.0 -60 20 2
assign (resid 78 and name n) (resid 78 and name ca)
(resid 78 and name c) (resid 79 and name n ) 1.0 -39 30 2
! Y79
assign (resid 78 and name c ) (resid 79 and name n)
(resid 79 and name ca) (resid 79 and name c) 1.0 -68 30 2
assign (resid 79 and name n) (resid 79 and name ca)
(resid 79 and name c) (resid 80 and name n ) 1.0 -40 20 2
! Q80
assign (resid 79 and name c ) (resid 80 and name n)
(resid 80 and name ca) (resid 80 and name c) 1.0 -67 20 2
assign (resid 80 and name n) (resid 80 and name ca)
(resid 80 and name c) (resid 81 and name n ) 1.0 -39 20 2
! L81
assign (resid 80 and name c ) (resid 81 and name n)
(resid 81 and name ca) (resid 81 and name c) 1.0 -67 20 2
assign (resid 81 and name n) (resid 81 and name ca)
(resid 81 and name c) (resid 82 and name n ) 1.0 -40 20 2
! E82
assign (resid 81 and name c ) (resid 82 and name n)
(resid 82 and name ca) (resid 82 and name c) 1.0 -64 20 2
assign (resid 82 and name n) (resid 82 and name ca)
(resid 82 and name c) (resid 83 and name n ) 1.0 -41 20 2
! N83
assign (resid 82 and name c ) (resid 83 and name n)
(resid 83 and name ca) (resid 83 and name c) 1.0 -66 20 2
assign (resid 83 and name n) (resid 83 and name ca)
(resid 83 and name c) (resid 84 and name n ) 1.0 -34 20 2
! Y84
assign (resid 83 and name c ) (resid 84 and name n)
(resid 84 and name ca) (resid 84 and name c) 1.0 -91 50 2
assign (resid 84 and name n) (resid 84 and name ca)
(resid 84 and name c) (resid 85 and name n ) 1.0 -19 30 2
! C85
assign (resid 84 and name c ) (resid 85 and name n)
(resid 85 and name ca) (resid 85 and name c) 1.0 -128 50 2
assign (resid 85 and name n) (resid 85 and name ca)
(resid 85 and name c) (resid 86 and name n ) 1.0 154 30 2
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