NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
533726 |
2l3f   |
17191 | cing | 1-original | 2 | XPLOR/CNS | dihedral angle |
!
! Dihedral angle constraints from TALOSplus (+/- 30 deg; n=10)
! ACO file produced by PDBStat
! Version: 5.1-Exp Compiled 2008-08-11 on (europa)
!
dihedral
assign (resid 1 and name C ) (resid 2 and name N )
(resid 2 and name CA ) (resid 2 and name C ) 1.0 -95.24 30.00 2
assign (resid 2 and name N ) (resid 2 and name CA )
(resid 2 and name C ) (resid 3 and name N ) 1.0 124.26 30.00 2
assign (resid 2 and name C ) (resid 3 and name N )
(resid 3 and name CA ) (resid 3 and name C ) 1.0 -110.25 30.00 2
assign (resid 3 and name N ) (resid 3 and name CA )
(resid 3 and name C ) (resid 4 and name N ) 1.0 142.44 30.00 2
assign (resid 3 and name C ) (resid 4 and name N )
(resid 4 and name CA ) (resid 4 and name C ) 1.0 -102.14 30.00 2
assign (resid 4 and name N ) (resid 4 and name CA )
(resid 4 and name C ) (resid 5 and name N ) 1.0 151.85 30.00 2
assign (resid 5 and name C ) (resid 6 and name N )
(resid 6 and name CA ) (resid 6 and name C ) 1.0 -110.61 30.00 2
assign (resid 6 and name N ) (resid 6 and name CA )
(resid 6 and name C ) (resid 7 and name N ) 1.0 114.52 30.00 2
assign (resid 7 and name C ) (resid 8 and name N )
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assign (resid 8 and name N ) (resid 8 and name CA )
(resid 8 and name C ) (resid 9 and name N ) 1.0 120.40 30.00 2
assign (resid 10 and name C ) (resid 11 and name N )
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assign (resid 11 and name N ) (resid 11 and name CA )
(resid 11 and name C ) (resid 12 and name N ) 1.0 172.16 30.00 2
assign (resid 15 and name C ) (resid 16 and name N )
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assign (resid 16 and name N ) (resid 16 and name CA )
(resid 16 and name C ) (resid 17 and name N ) 1.0 139.14 30.00 2
assign (resid 16 and name C ) (resid 17 and name N )
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assign (resid 17 and name N ) (resid 17 and name CA )
(resid 17 and name C ) (resid 18 and name N ) 1.0 130.40 30.00 2
assign (resid 17 and name C ) (resid 18 and name N )
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assign (resid 18 and name N ) (resid 18 and name CA )
(resid 18 and name C ) (resid 19 and name N ) 1.0 124.09 30.00 2
assign (resid 18 and name C ) (resid 19 and name N )
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assign (resid 19 and name N ) (resid 19 and name CA )
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assign (resid 21 and name C ) (resid 22 and name N )
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assign (resid 22 and name N ) (resid 22 and name CA )
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assign (resid 23 and name N ) (resid 23 and name CA )
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assign (resid 23 and name C ) (resid 24 and name N )
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assign (resid 24 and name N ) (resid 24 and name CA )
(resid 24 and name C ) (resid 25 and name N ) 1.0 153.16 30.00 2
assign (resid 24 and name C ) (resid 25 and name N )
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assign (resid 25 and name N ) (resid 25 and name CA )
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assign (resid 25 and name C ) (resid 26 and name N )
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assign (resid 26 and name N ) (resid 26 and name CA )
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assign (resid 26 and name C ) (resid 27 and name N )
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assign (resid 27 and name N ) (resid 27 and name CA )
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assign (resid 27 and name C ) (resid 28 and name N )
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assign (resid 28 and name N ) (resid 28 and name CA )
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assign (resid 28 and name C ) (resid 29 and name N )
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assign (resid 29 and name N ) (resid 29 and name CA )
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assign (resid 29 and name C ) (resid 30 and name N )
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assign (resid 30 and name N ) (resid 30 and name CA )
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assign (resid 30 and name C ) (resid 31 and name N )
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assign (resid 31 and name N ) (resid 31 and name CA )
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assign (resid 31 and name C ) (resid 32 and name N )
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assign (resid 32 and name N ) (resid 32 and name CA )
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assign (resid 32 and name C ) (resid 33 and name N )
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assign (resid 33 and name N ) (resid 33 and name CA )
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assign (resid 33 and name C ) (resid 34 and name N )
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assign (resid 34 and name N ) (resid 34 and name CA )
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assign (resid 35 and name C ) (resid 36 and name N )
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assign (resid 36 and name N ) (resid 36 and name CA )
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assign (resid 39 and name C ) (resid 40 and name N )
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assign (resid 40 and name N ) (resid 40 and name CA )
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assign (resid 40 and name C ) (resid 41 and name N )
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assign (resid 41 and name N ) (resid 41 and name CA )
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assign (resid 41 and name C ) (resid 42 and name N )
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assign (resid 42 and name N ) (resid 42 and name CA )
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assign (resid 42 and name C ) (resid 43 and name N )
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assign (resid 43 and name N ) (resid 43 and name CA )
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assign (resid 43 and name C ) (resid 44 and name N )
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assign (resid 44 and name N ) (resid 44 and name CA )
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assign (resid 44 and name C ) (resid 45 and name N )
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assign (resid 45 and name N ) (resid 45 and name CA )
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assign (resid 45 and name C ) (resid 46 and name N )
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assign (resid 46 and name N ) (resid 46 and name CA )
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assign (resid 46 and name C ) (resid 47 and name N )
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assign (resid 47 and name N ) (resid 47 and name CA )
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assign (resid 47 and name C ) (resid 48 and name N )
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assign (resid 48 and name N ) (resid 48 and name CA )
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assign (resid 48 and name C ) (resid 49 and name N )
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assign (resid 49 and name N ) (resid 49 and name CA )
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assign (resid 51 and name C ) (resid 52 and name N )
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assign (resid 52 and name N ) (resid 52 and name CA )
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assign (resid 52 and name C ) (resid 53 and name N )
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assign (resid 53 and name N ) (resid 53 and name CA )
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assign (resid 53 and name C ) (resid 54 and name N )
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assign (resid 54 and name N ) (resid 54 and name CA )
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assign (resid 54 and name C ) (resid 55 and name N )
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assign (resid 55 and name N ) (resid 55 and name CA )
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assign (resid 56 and name C ) (resid 57 and name N )
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assign (resid 57 and name N ) (resid 57 and name CA )
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assign (resid 57 and name C ) (resid 58 and name N )
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assign (resid 58 and name N ) (resid 58 and name CA )
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assign (resid 58 and name C ) (resid 59 and name N )
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assign (resid 59 and name N ) (resid 59 and name CA )
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assign (resid 59 and name C ) (resid 60 and name N )
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assign (resid 60 and name N ) (resid 60 and name CA )
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assign (resid 60 and name C ) (resid 61 and name N )
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assign (resid 61 and name N ) (resid 61 and name CA )
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assign (resid 61 and name C ) (resid 62 and name N )
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assign (resid 62 and name N ) (resid 62 and name CA )
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assign (resid 62 and name C ) (resid 63 and name N )
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assign (resid 63 and name N ) (resid 63 and name CA )
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assign (resid 63 and name C ) (resid 64 and name N )
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assign (resid 64 and name N ) (resid 64 and name CA )
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assign (resid 64 and name C ) (resid 65 and name N )
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assign (resid 65 and name N ) (resid 65 and name CA )
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assign (resid 65 and name C ) (resid 66 and name N )
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assign (resid 66 and name N ) (resid 66 and name CA )
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assign (resid 66 and name C ) (resid 67 and name N )
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assign (resid 67 and name N ) (resid 67 and name CA )
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assign (resid 67 and name C ) (resid 68 and name N )
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assign (resid 68 and name N ) (resid 68 and name CA )
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assign (resid 68 and name C ) (resid 69 and name N )
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assign (resid 69 and name N ) (resid 69 and name CA )
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assign (resid 69 and name C ) (resid 70 and name N )
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assign (resid 70 and name N ) (resid 70 and name CA )
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assign (resid 71 and name C ) (resid 72 and name N )
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assign (resid 72 and name N ) (resid 72 and name CA )
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assign (resid 72 and name C ) (resid 73 and name N )
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assign (resid 73 and name N ) (resid 73 and name CA )
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assign (resid 74 and name C ) (resid 75 and name N )
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assign (resid 75 and name N ) (resid 75 and name CA )
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assign (resid 76 and name C ) (resid 77 and name N )
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assign (resid 77 and name N ) (resid 77 and name CA )
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assign (resid 77 and name C ) (resid 78 and name N )
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assign (resid 78 and name N ) (resid 78 and name CA )
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assign (resid 79 and name C ) (resid 80 and name N )
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assign (resid 80 and name N ) (resid 80 and name CA )
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assign (resid 80 and name C ) (resid 81 and name N )
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assign (resid 81 and name N ) (resid 81 and name CA )
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assign (resid 91 and name C ) (resid 92 and name N )
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assign (resid 92 and name N ) (resid 92 and name CA )
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assign (resid 92 and name C ) (resid 93 and name N )
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assign (resid 93 and name N ) (resid 93 and name CA )
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assign (resid 93 and name C ) (resid 94 and name N )
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assign (resid 94 and name N ) (resid 94 and name CA )
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assign (resid 97 and name C ) (resid 98 and name N )
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assign (resid 98 and name N ) (resid 98 and name CA )
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assign (resid 98 and name C ) (resid 99 and name N )
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assign (resid 99 and name N ) (resid 99 and name CA )
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assign (resid 99 and name C ) (resid 100 and name N )
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assign (resid 100 and name N ) (resid 100 and name CA )
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assign (resid 100 and name C ) (resid 101 and name N )
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assign (resid 101 and name N ) (resid 101 and name CA )
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assign (resid 101 and name C ) (resid 102 and name N )
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assign (resid 102 and name N ) (resid 102 and name CA )
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assign (resid 102 and name C ) (resid 103 and name N )
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assign (resid 103 and name N ) (resid 103 and name CA )
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assign (resid 105 and name N ) (resid 105 and name CA )
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assign (resid 105 and name C ) (resid 106 and name N )
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assign (resid 106 and name N ) (resid 106 and name CA )
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assign (resid 106 and name C ) (resid 107 and name N )
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assign (resid 107 and name N ) (resid 107 and name CA )
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assign (resid 108 and name C ) (resid 109 and name N )
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assign (resid 109 and name N ) (resid 109 and name CA )
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assign (resid 109 and name C ) (resid 110 and name N )
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assign (resid 110 and name N ) (resid 110 and name CA )
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assign (resid 110 and name C ) (resid 111 and name N )
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assign (resid 111 and name N ) (resid 111 and name CA )
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assign (resid 111 and name C ) (resid 112 and name N )
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assign (resid 112 and name N ) (resid 112 and name CA )
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assign (resid 112 and name C ) (resid 113 and name N )
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assign (resid 113 and name N ) (resid 113 and name CA )
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assign (resid 114 and name C ) (resid 115 and name N )
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assign (resid 115 and name N ) (resid 115 and name CA )
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assign (resid 115 and name C ) (resid 116 and name N )
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assign (resid 116 and name N ) (resid 116 and name CA )
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assign (resid 116 and name C ) (resid 117 and name N )
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assign (resid 117 and name N ) (resid 117 and name CA )
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assign (resid 117 and name C ) (resid 118 and name N )
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assign (resid 118 and name N ) (resid 118 and name CA )
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assign (resid 118 and name C ) (resid 119 and name N )
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assign (resid 119 and name N ) (resid 119 and name CA )
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assign (resid 119 and name C ) (resid 120 and name N )
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assign (resid 120 and name N ) (resid 120 and name CA )
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assign (resid 122 and name N ) (resid 122 and name CA )
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assign (resid 122 and name C ) (resid 123 and name N )
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assign (resid 123 and name N ) (resid 123 and name CA )
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assign (resid 123 and name C ) (resid 124 and name N )
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assign (resid 124 and name N ) (resid 124 and name CA )
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assign (resid 124 and name C ) (resid 125 and name N )
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assign (resid 125 and name N ) (resid 125 and name CA )
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assign (resid 125 and name C ) (resid 126 and name N )
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assign (resid 126 and name N ) (resid 126 and name CA )
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assign (resid 126 and name C ) (resid 127 and name N )
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assign (resid 127 and name N ) (resid 127 and name CA )
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assign (resid 127 and name C ) (resid 128 and name N )
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assign (resid 128 and name N ) (resid 128 and name CA )
(resid 128 and name C ) (resid 129 and name N ) 1.0 21.90 30.00 2
assign (resid 128 and name C ) (resid 129 and name N )
(resid 129 and name CA ) (resid 129 and name C ) 1.0 -79.93 30.00 2
assign (resid 129 and name N ) (resid 129 and name CA )
(resid 129 and name C ) (resid 130 and name N ) 1.0 141.28 30.00 2
assign (resid 130 and name C ) (resid 131 and name N )
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assign (resid 131 and name N ) (resid 131 and name CA )
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assign (resid 131 and name C ) (resid 132 and name N )
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assign (resid 132 and name N ) (resid 132 and name CA )
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assign (resid 132 and name C ) (resid 133 and name N )
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assign (resid 133 and name N ) (resid 133 and name CA )
(resid 133 and name C ) (resid 134 and name N ) 1.0 124.40 30.00 2
assign (resid 133 and name C ) (resid 134 and name N )
(resid 134 and name CA ) (resid 134 and name C ) 1.0 -96.66 30.00 2
assign (resid 134 and name N ) (resid 134 and name CA )
(resid 134 and name C ) (resid 135 and name N ) 1.0 122.44 30.00 2
assign (resid 135 and name N ) (resid 135 and name CA )
(resid 135 and name C ) (resid 136 and name N ) 1.0 152.46 30.00 2
assign (resid 137 and name C ) (resid 138 and name N )
(resid 138 and name CA ) (resid 138 and name C ) 1.0 -91.57 30.00 2
assign (resid 138 and name N ) (resid 138 and name CA )
(resid 138 and name C ) (resid 139 and name N ) 1.0 128.84 30.00 2
assign (resid 138 and name C ) (resid 139 and name N )
(resid 139 and name CA ) (resid 139 and name C ) 1.0 -65.78 30.00 2
assign (resid 139 and name N ) (resid 139 and name CA )
(resid 139 and name C ) (resid 140 and name N ) 1.0 -21.97 30.00 2
assign (resid 139 and name C ) (resid 140 and name N )
(resid 140 and name CA ) (resid 140 and name C ) 1.0 -78.06 30.00 2
assign (resid 140 and name N ) (resid 140 and name CA )
(resid 140 and name C ) (resid 141 and name N ) 1.0 -12.10 30.00 2
assign (resid 141 and name C ) (resid 142 and name N )
(resid 142 and name CA ) (resid 142 and name C ) 1.0 -57.40 30.00 2
assign (resid 142 and name N ) (resid 142 and name CA )
(resid 142 and name C ) (resid 143 and name N ) 1.0 -42.39 30.00 2
assign (resid 142 and name C ) (resid 143 and name N )
(resid 143 and name CA ) (resid 143 and name C ) 1.0 -69.72 30.00 2
assign (resid 143 and name N ) (resid 143 and name CA )
(resid 143 and name C ) (resid 144 and name N ) 1.0 -34.03 30.00 2
assign (resid 143 and name C ) (resid 144 and name N )
(resid 144 and name CA ) (resid 144 and name C ) 1.0 -90.71 30.00 2
assign (resid 144 and name N ) (resid 144 and name CA )
(resid 144 and name C ) (resid 145 and name N ) 1.0 -10.85 30.00 2
assign (resid 145 and name C ) (resid 146 and name N )
(resid 146 and name CA ) (resid 146 and name C ) 1.0 -62.64 30.00 2
assign (resid 146 and name N ) (resid 146 and name CA )
(resid 146 and name C ) (resid 147 and name N ) 1.0 -42.58 30.00 2
assign (resid 146 and name C ) (resid 147 and name N )
(resid 147 and name CA ) (resid 147 and name C ) 1.0 -70.35 30.00 2
assign (resid 147 and name N ) (resid 147 and name CA )
(resid 147 and name C ) (resid 148 and name N ) 1.0 -35.59 30.00 2
assign (resid 147 and name C ) (resid 148 and name N )
(resid 148 and name CA ) (resid 148 and name C ) 1.0 -55.48 30.00 2
assign (resid 148 and name N ) (resid 148 and name CA )
(resid 148 and name C ) (resid 149 and name N ) 1.0 -43.61 30.00 2
assign (resid 148 and name C ) (resid 149 and name N )
(resid 149 and name CA ) (resid 149 and name C ) 1.0 -60.92 30.00 2
assign (resid 149 and name N ) (resid 149 and name CA )
(resid 149 and name C ) (resid 150 and name N ) 1.0 -44.57 30.00 2
assign (resid 149 and name C ) (resid 150 and name N )
(resid 150 and name CA ) (resid 150 and name C ) 1.0 -61.02 30.00 2
assign (resid 150 and name N ) (resid 150 and name CA )
(resid 150 and name C ) (resid 151 and name N ) 1.0 -40.41 30.00 2
assign (resid 150 and name C ) (resid 151 and name N )
(resid 151 and name CA ) (resid 151 and name C ) 1.0 -61.63 30.00 2
assign (resid 151 and name N ) (resid 151 and name CA )
(resid 151 and name C ) (resid 152 and name N ) 1.0 -47.13 30.00 2
assign (resid 151 and name C ) (resid 152 and name N )
(resid 152 and name CA ) (resid 152 and name C ) 1.0 -65.95 30.00 2
assign (resid 152 and name N ) (resid 152 and name CA )
(resid 152 and name C ) (resid 153 and name N ) 1.0 -38.40 30.00 2
assign (resid 152 and name C ) (resid 153 and name N )
(resid 153 and name CA ) (resid 153 and name C ) 1.0 -59.27 30.00 2
assign (resid 153 and name N ) (resid 153 and name CA )
(resid 153 and name C ) (resid 154 and name N ) 1.0 -40.92 30.00 2
assign (resid 153 and name C ) (resid 154 and name N )
(resid 154 and name CA ) (resid 154 and name C ) 1.0 -61.77 30.00 2
assign (resid 154 and name N ) (resid 154 and name CA )
(resid 154 and name C ) (resid 155 and name N ) 1.0 -42.27 30.00 2
assign (resid 154 and name C ) (resid 155 and name N )
(resid 155 and name CA ) (resid 155 and name C ) 1.0 -71.08 30.00 2
assign (resid 155 and name N ) (resid 155 and name CA )
(resid 155 and name C ) (resid 156 and name N ) 1.0 -39.22 30.00 2
assign (resid 155 and name C ) (resid 156 and name N )
(resid 156 and name CA ) (resid 156 and name C ) 1.0 -93.04 30.00 2
assign (resid 156 and name N ) (resid 156 and name CA )
(resid 156 and name C ) (resid 157 and name N ) 1.0 -28.03 30.00 2
assign (resid 156 and name C ) (resid 157 and name N )
(resid 157 and name CA ) (resid 157 and name C ) 1.0 -77.47 30.00 2
assign (resid 157 and name N ) (resid 157 and name CA )
(resid 157 and name C ) (resid 158 and name N ) 1.0 -38.12 30.00 2
assign (resid 157 and name C ) (resid 158 and name N )
(resid 158 and name CA ) (resid 158 and name C ) 1.0 -72.06 30.00 2
assign (resid 158 and name N ) (resid 158 and name CA )
(resid 158 and name C ) (resid 159 and name N ) 1.0 -35.87 30.00 2
assign (resid 159 and name C ) (resid 160 and name N )
(resid 160 and name CA ) (resid 160 and name C ) 1.0 -68.70 30.00 2
assign (resid 160 and name N ) (resid 160 and name CA )
(resid 160 and name C ) (resid 161 and name N ) 1.0 -33.02 30.00 2
assign (resid 158 and name C ) (resid 159 and name N )
(resid 159 and name CA ) (resid 159 and name C ) 1.0 -69.52 30.00 2
assign (resid 159 and name N ) (resid 159 and name CA )
(resid 159 and name C ) (resid 160 and name N ) 1.0 -33.22 30.00 2
!
! additional chi1/chi2 for favourable rotamers (selected ordered leucine residues, based on CD1/CD2 chemical shifts)
! applied at final stage of structure refinement
!
assign (resid 62 and name N ) (resid 62 and name CA )
(resid 62 and name CB ) (resid 62 and name CG ) 1.0 -60.00 20.00 2
assign (resid 62 and name CA ) (resid 62 and name CB )
(resid 62 and name CG ) (resid 62 and name CD1 ) 1.0 180.00 20.00 2
assign (resid 124 and name N ) (resid 124 and name CA )
(resid 124 and name CB ) (resid 124 and name CG ) 1.0 -60.00 20.00 2
assign (resid 124 and name CA ) (resid 124 and name CB )
(resid 124 and name CG ) (resid 124 and name CD1 ) 1.0 180.00 20.00 2
assign (resid 10 and name N ) (resid 10 and name CA )
(resid 10 and name CB ) (resid 10 and name CG ) 1.0 180.00 20.00 2
assign (resid 10 and name CA ) (resid 10 and name CB )
(resid 10 and name CG ) (resid 10 and name CD1 ) 1.0 60.00 20.00 2
end
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