NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | in_recoord | stage | position | program | type |
|
|
2239 |
1blj   |
cing | recoord | 1-original | 3 | XPLOR/CNS | dihedral angle |
! DIHEDRAL ANGLE RESTRAINTS restraints dihedral reset ! ! angle constraints for phi ! assign (resid 15 and name c ) (resid 16 and name n ) (resid 16 and name ca) (resid 16 and name c ) 10.0 -120.0 40.0 2 ! assign (resid 18 and name c ) (resid 19 and name n ) (resid 19 and name ca) (resid 19 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 19 and name c ) (resid 20 and name n ) (resid 20 and name ca) (resid 20 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 20 and name c ) (resid 21 and name n ) (resid 21 and name ca) (resid 21 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 21 and name c ) (resid 22 and name n ) (resid 22 and name ca) (resid 22 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 22 and name c ) (resid 23 and name n ) (resid 23 and name ca) (resid 23 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 23 and name c ) (resid 24 and name n ) (resid 24 and name ca) (resid 24 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 24 and name c ) (resid 25 and name n ) (resid 25 and name ca) (resid 25 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 25 and name c ) (resid 26 and name n ) (resid 26 and name ca) (resid 26 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 26 and name c ) (resid 27 and name n ) (resid 27 and name ca) (resid 27 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 27 and name c ) (resid 28 and name n ) (resid 28 and name ca) (resid 28 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 28 and name c ) (resid 29 and name n ) (resid 29 and name ca) (resid 29 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 29 and name c ) (resid 30 and name n ) (resid 30 and name ca) (resid 30 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 31 and name c ) (resid 32 and name n ) (resid 32 and name ca) (resid 32 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 39 and name c ) (resid 40 and name n ) (resid 40 and name ca) (resid 40 and name c ) 10.0 -120.0 40.0 2 ! assign (resid 40 and name c ) (resid 41 and name n ) (resid 41 and name ca) (resid 41 and name c ) 10.0 -120.0 50.0 2 ! assign (resid 42 and name c ) (resid 43 and name n ) (resid 43 and name ca) (resid 43 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 43 and name c ) (resid 44 and name n ) (resid 44 and name ca) (resid 44 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 44 and name c ) (resid 45 and name n ) (resid 45 and name ca) (resid 45 and name c ) 10.0 -120.0 50.0 2 ! assign (resid 45 and name c ) (resid 46 and name n ) (resid 46 and name ca) (resid 46 and name c ) 10.0 -120.0 50.0 2 ! assign (resid 46 and name c ) (resid 47 and name n ) (resid 47 and name ca) (resid 47 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 48 and name c ) (resid 49 and name n ) (resid 49 and name ca) (resid 49 and name c ) 10.0 -120.0 40.0 2 ! assign (resid 49 and name c ) (resid 50 and name n ) (resid 50 and name ca) (resid 50 and name c ) 10.0 -120.0 40.0 2 ! assign (resid 50 and name c ) (resid 51 and name n ) (resid 51 and name ca) (resid 51 and name c ) 10.0 -120.0 40.0 2 ! assign (resid 51 and name c ) (resid 52 and name n ) (resid 52 and name ca) (resid 52 and name c ) 10.0 -120.0 40.0 2 ! assign (resid 52 and name c ) (resid 53 and name n ) (resid 53 and name ca) (resid 53 and name c ) 10.0 -120.0 40.0 2 ! assign (resid 53 and name c ) (resid 54 and name n ) (resid 54 and name ca) (resid 54 and name c ) 10.0 -120.0 40.0 2 ! assign (resid 54 and name c ) (resid 55 and name n ) (resid 55 and name ca) (resid 55 and name c ) 10.0 -120.0 40.0 2 ! assign (resid 55 and name c ) (resid 56 and name n ) (resid 56 and name ca) (resid 56 and name c ) 10.0 -120.0 40.0 2 ! assign (resid 56 and name c ) (resid 57 and name n ) (resid 57 and name ca) (resid 57 and name c ) 10.0 -120.0 40.0 2 ! assign (resid 57 and name c ) (resid 58 and name n ) (resid 58 and name ca) (resid 58 and name c ) 10.0 -120.0 40.0 2 ! assign (resid 59 and name c ) (resid 60 and name n ) (resid 60 and name ca) (resid 60 and name c ) 10.0 -120.0 40.0 2 ! 8.9 assign (resid 62 and name c ) (resid 63 and name n ) (resid 63 and name ca) (resid 63 and name c ) 10.0 -120.0 40.0 2 ! 9.7 assign (resid 63 and name c ) (resid 64 and name n ) (resid 64 and name ca) (resid 64 and name c ) 10.0 -120.0 40.0 2 ! assign (resid 64 and name c ) (resid 65 and name n ) (resid 65 and name ca) (resid 65 and name c ) 10.0 -120.0 40.0 2 ! 9.5 assign (resid 65 and name c ) (resid 66 and name n ) (resid 66 and name ca) (resid 66 and name c ) 10.0 -120.0 40.0 2 ! 9.1 assign (resid 66 and name c ) (resid 67 and name n ) (resid 67 and name ca) (resid 67 and name c ) 10.0 -120.0 40.0 2 ! 9.7 assign (resid 69 and name c ) (resid 70 and name n ) (resid 70 and name ca) (resid 70 and name c ) 10.0 -120.0 40.0 2 ! 8.9 assign (resid 70 and name c ) (resid 71 and name n ) (resid 71 and name ca) (resid 71 and name c ) 10.0 -120.0 40.0 2 ! assign (resid 71 and name c ) (resid 72 and name n ) (resid 72 and name ca) (resid 72 and name c ) 10.0 -120.0 40.0 2 ! assign (resid 72 and name c ) (resid 73 and name n ) (resid 73 and name ca) (resid 73 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 78 and name c ) (resid 79 and name n ) (resid 79 and name ca) (resid 79 and name c ) 10.0 -120.0 40.0 2 ! assign (resid 79 and name c ) (resid 80 and name n ) (resid 80 and name ca) (resid 80 and name c ) 10.0 -120.0 40.0 2 ! assign (resid 84 and name c ) (resid 85 and name n ) (resid 85 and name ca) (resid 85 and name c ) 10.0 -120.0 40.0 2 ! assign (resid 87 and name c ) (resid 88 and name n ) (resid 88 and name ca) (resid 88 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 88 and name c ) (resid 89 and name n ) (resid 89 and name ca) (resid 89 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 89 and name c ) (resid 90 and name n ) (resid 90 and name ca) (resid 90 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 90 and name c ) (resid 91 and name n ) (resid 91 and name ca) (resid 91 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 91 and name c ) (resid 92 and name n ) (resid 92 and name ca) (resid 92 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 92 and name c ) (resid 93 and name n ) (resid 93 and name ca) (resid 93 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 93 and name c ) (resid 94 and name n ) (resid 94 and name ca) (resid 94 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 94 and name c ) (resid 95 and name n ) (resid 95 and name ca) (resid 95 and name c ) 10.0 -60.0 40.0 2 ! assign (resid 106 and name c ) (resid 107 and name n ) (resid 107 and name ca) (resid 107 and name c ) 10.0 -120.0 40.0 2 ! ! ! chi 1 restraints from HNHB, HNCOHB, CO-METHYL, N-METHYL ! assign (resid 12 and name n ) (resid 12 and name ca) (resid 12 and name cb) (resid 12 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 13 and name n ) (resid 13 and name ca) (resid 13 and name cb) (resid 13 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 14 and name n ) (resid 14 and name ca) (resid 14 and name cb) (resid 14 and name cg) 10.0 60.0 30.0 2 ! assign (resid 15 and name n ) (resid 15 and name ca) (resid 15 and name cb) (resid 15 and name cg) 10.0 180.0 30.0 2 ! !assign (resid 16 and name n ) (resid 16 and name ca) (resid 16 and name cb) (resid 16 and name cg) 10.0 180.0 30.0 2 ! assign (resid 17 and name n ) (resid 17 and name ca) (resid 17 and name cb) (resid 17 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 18 and name n ) (resid 18 and name ca) (resid 18 and name cb) (resid 18 and name og1) 10.0 180.0 30.0 2 ! assign (resid 19 and name n ) (resid 19 and name ca) (resid 19 and name cb) (resid 19 and name cg1) 10.0 180.0 30.0 2 ! assign (resid 20 and name n ) (resid 20 and name ca) (resid 20 and name cb) (resid 20 and name og) 10.0 180.0 30.0 2 ! assign (resid 21 and name n ) (resid 21 and name ca) (resid 21 and name cb) (resid 21 and name cg) 10.0 180.0 30.0 2 ! assign (resid 22 and name n ) (resid 22 and name ca) (resid 22 and name cb) (resid 22 and name cg) 10.0 60.0 30.0 2 ! assign (resid 23 and name n ) (resid 23 and name ca) (resid 23 and name cb) (resid 23 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 25 and name n ) (resid 25 and name ca) (resid 25 and name cb) (resid 25 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 26 and name n ) (resid 26 and name ca) (resid 26 and name cb) (resid 26 and name cg) 10.0 60.0 30.0 2 ! assign (resid 27 and name n ) (resid 27 and name ca) (resid 27 and name cb) (resid 27 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 28 and name n ) (resid 28 and name ca) (resid 28 and name cb) (resid 28 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 29 and name n ) (resid 29 and name ca) (resid 29 and name cb) (resid 29 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 32 and name n ) (resid 32 and name ca) (resid 32 and name cb) (resid 32 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 33 and name n ) (resid 33 and name ca) (resid 33 and name cb) (resid 33 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 34 and name n ) (resid 34 and name ca) (resid 34 and name cb) (resid 34 and name cg) 10.0 60.0 30.0 2 ! assign (resid 37 and name n ) (resid 37 and name ca) (resid 37 and name cb) (resid 37 and name og) 10.0 60.0 30.0 2 ! assign (resid 38 and name n ) (resid 38 and name ca) (resid 38 and name cb) (resid 38 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 39 and name n ) (resid 39 and name ca) (resid 39 and name cb) (resid 39 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 40 and name n ) (resid 40 and name ca) (resid 40 and name cb) (resid 40 and name cg1) 10.0 180.0 30.0 2 ! assign (resid 41 and name n ) (resid 41 and name ca) (resid 41 and name cb) (resid 41 and name cg) 10.0 60.0 30.0 2 ! assign (resid 42 and name n ) (resid 42 and name ca) (resid 42 and name cb) (resid 42 and name cg) 10.0 60.0 30.0 2 ! assign (resid 43 and name n ) (resid 43 and name ca) (resid 43 and name cb) (resid 43 and name og) 10.0 180.0 30.0 2 ! assign (resid 44 and name n ) (resid 44 and name ca) (resid 44 and name cb) (resid 44 and name cg) 10.0 60.0 30.0 2 ! assign (resid 45 and name n ) (resid 45 and name ca) (resid 45 and name cb) (resid 45 and name og) 10.0 60.0 30.0 2 ! assign (resid 46 and name n ) (resid 46 and name ca) (resid 46 and name cb) (resid 46 and name cg) 10.0 60.0 30.0 2 ! assign (resid 47 and name n ) (resid 47 and name ca) (resid 47 and name cb) (resid 47 and name cg) 10.0 60.0 30.0 2 ! assign (resid 50 and name n ) (resid 50 and name ca) (resid 50 and name cb) (resid 50 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 51 and name n ) (resid 51 and name ca) (resid 51 and name cb) (resid 51 and name og) 10.0 -60.0 30.0 2 ! assign (resid 52 and name n ) (resid 52 and name ca) (resid 52 and name cb) (resid 52 and name cg) 10.0 180.0 30.0 2 ! assign (resid 53 and name n ) (resid 53 and name ca) (resid 53 and name cb) (resid 53 and name og) 10.0 -60.0 30.0 2 ! assign (resid 54 and name n ) (resid 54 and name ca) (resid 54 and name cb) (resid 54 and name cg1) 10.0 180.0 30.0 2 ! assign (resid 55 and name n ) (resid 55 and name ca) (resid 55 and name cb) (resid 55 and name cg) 10.0 180.0 30.0 2 ! assign (resid 57 and name n ) (resid 57 and name ca) (resid 57 and name cb) (resid 57 and name cg1) 10.0 -60.0 30.0 2 ! assign (resid 58 and name n ) (resid 58 and name ca) (resid 58 and name cb) (resid 58 and name og1) 10.0 180.0 30.0 2 ! assign (resid 59 and name n ) (resid 59 and name ca) (resid 59 and name cb) (resid 59 and name og1) 10.0 180.0 30.0 2 ! assign (resid 60 and name n ) (resid 60 and name ca) (resid 60 and name cb) (resid 60 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 62 and name n ) (resid 62 and name ca) (resid 62 and name cb) (resid 62 and name cg) 10.0 180.0 30.0 2 ! assign (resid 64 and name n ) (resid 64 and name ca) (resid 64 and name cb) (resid 64 and name cg1) 10.0 180.0 30.0 2 ! assign (resid 65 and name n ) (resid 65 and name ca) (resid 65 and name cb) (resid 65 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 66 and name n ) (resid 66 and name ca) (resid 66 and name cb) (resid 66 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 67 and name n ) (resid 67 and name ca) (resid 67 and name cb) (resid 67 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 68 and name n ) (resid 68 and name ca) (resid 68 and name cb) (resid 68 and name cg) 10.0 60.0 30.0 2 ! assign (resid 69 and name n ) (resid 69 and name ca) (resid 69 and name cb) (resid 69 and name cg1) 10.0 60.0 30.0 2 ! assign (resid 70 and name n ) (resid 70 and name ca) (resid 70 and name cb) (resid 70 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 71 and name n ) (resid 71 and name ca) (resid 71 and name cb) (resid 71 and name og) 10.0 60.0 30.0 2 ! assign (resid 72 and name n ) (resid 72 and name ca) (resid 72 and name cb) (resid 72 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 73 and name n ) (resid 73 and name ca) (resid 73 and name cb) (resid 73 and name cg) 10.0 60.0 30.0 2 ! assign (resid 74 and name n ) (resid 74 and name ca) (resid 74 and name cb) (resid 74 and name cg) 10.0 60.0 30.0 2 ! assign (resid 79 and name n ) (resid 79 and name ca) (resid 79 and name cb) (resid 79 and name cg1) 10.0 60.0 30.0 2 ! assign (resid 82 and name n ) (resid 82 and name ca) (resid 82 and name cb) (resid 82 and name cg) 10.0 60.0 30.0 2 ! assign (resid 83 and name n ) (resid 83 and name ca) (resid 83 and name cb) (resid 83 and name cg1) 10.0 60.0 30.0 2 ! assign (resid 84 and name n ) (resid 84 and name ca) (resid 84 and name cb) (resid 84 and name og1) 10.0 -60.0 30.0 2 ! assign (resid 85 and name n ) (resid 85 and name ca) (resid 85 and name cb) (resid 85 and name cg) 10.0 0.0 90.0 2 ! assign (resid 87 and name n ) (resid 87 and name ca) (resid 87 and name cb) (resid 87 and name og1) 10.0 180.0 30.0 2 ! assign (resid 88 and name n ) (resid 88 and name ca) (resid 88 and name cb) (resid 88 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 89 and name n ) (resid 89 and name ca) (resid 89 and name cb) (resid 89 and name cg) 10.0 60.0 30.0 2 ! assign (resid 91 and name n ) (resid 91 and name ca) (resid 91 and name cb) (resid 91 and name cg) 10.0 180.0 30.0 2 ! assign (resid 92 and name n ) (resid 92 and name ca) (resid 92 and name cb) (resid 92 and name cg1) 10.0 180.0 30.0 2 ! assign (resid 93 and name n ) (resid 93 and name ca) (resid 93 and name cb) (resid 93 and name cg) 10.0 60.0 30.0 2 ! assign (resid 94 and name n ) (resid 94 and name ca) (resid 94 and name cb) (resid 94 and name cg) 10.0 180.0 30.0 2 ! assign (resid 95 and name n ) (resid 95 and name ca) (resid 95 and name cb) (resid 95 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 96 and name n ) (resid 96 and name ca) (resid 96 and name cb) (resid 96 and name og) 10.0 -60.0 30.0 2 ! assign (resid 97 and name n ) (resid 97 and name ca) (resid 97 and name cb) (resid 97 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 98 and name n ) (resid 98 and name ca) (resid 98 and name cb) (resid 98 and name cg) 10.0 120.0 90.0 2 ! assign (resid 100 and name n ) (resid 100 and name ca) (resid 100 and name cb) (resid 100 and name cg) 10.0 180.0 30.0 2 ! assign (resid 102 and name n ) (resid 102 and name ca) (resid 102 and name cb) (resid 102 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 103 and name n ) (resid 103 and name ca) (resid 103 and name cb) (resid 103 and name sg) 10.0 60.0 30.0 2 ! assign (resid 104 and name n ) (resid 104 and name ca) (resid 104 and name cb) (resid 104 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 105 and name n ) (resid 105 and name ca) (resid 105 and name cb) (resid 105 and name cg) 10.0 60.0 30.0 2 ! assign (resid 106 and name n ) (resid 106 and name ca) (resid 106 and name cb) (resid 106 and name cg) 10.0 -60.0 30.0 2 ! assign (resid 107 and name n ) (resid 107 and name ca) (resid 107 and name cb) (resid 107 and name og1) 10.0 60.0 30.0 2 ! assign (resid 108 and name n ) (resid 108 and name ca) (resid 108 and name cb) (resid 108 and name cg) 10.0 -60.0 30.0 2 !
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