NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
26220 |
2kgc   |
16201 | cing | 1-original | 3 | XPLOR/CNS | dihedral angle |
! phi and psi dihedral restraint file generated by Talos2Aria.py
!
! TALOS filename:
! /home/simon/structure_calcs/octanoyl/pred.tab
!
! settings: min phiError=20.0, min psiError=20.0, errorFactor=2.0
!
! Talos derived phi restraint:
assign (resid 2 and name C)
(resid 3 and name N)
(resid 3 and name CA)
(resid 3 and name C)
1.0 -118 44 2
! Talos derived phi restraint:
assign (resid 4 and name C)
(resid 5 and name N)
(resid 5 and name CA)
(resid 5 and name C)
1.0 -81 48 2
! Talos derived phi restraint:
assign (resid 5 and name C)
(resid 6 and name N)
(resid 6 and name CA)
(resid 6 and name C)
1.0 -99 40 2
! Talos derived phi restraint:
assign (resid 6 and name C)
(resid 7 and name N)
(resid 7 and name CA)
(resid 7 and name C)
1.0 -61 20 2
! Talos derived phi restraint:
assign (resid 7 and name C)
(resid 8 and name N)
(resid 8 and name CA)
(resid 8 and name C)
1.0 -62 20 2
! Talos derived phi restraint:
assign (resid 8 and name C)
(resid 9 and name N)
(resid 9 and name CA)
(resid 9 and name C)
1.0 -68 20 2
! Talos derived phi restraint:
assign (resid 9 and name C)
(resid 10 and name N)
(resid 10 and name CA)
(resid 10 and name C)
1.0 -66 20 2
! Talos derived phi restraint:
assign (resid 10 and name C)
(resid 11 and name N)
(resid 11 and name CA)
(resid 11 and name C)
1.0 -59 20 2
! Talos derived phi restraint:
assign (resid 11 and name C)
(resid 12 and name N)
(resid 12 and name CA)
(resid 12 and name C)
1.0 -60 20 2
! Talos derived phi restraint:
assign (resid 12 and name C)
(resid 13 and name N)
(resid 13 and name CA)
(resid 13 and name C)
1.0 -61 20 2
! Talos derived phi restraint:
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
! Talos derived phi restraint:
assign (resid 14 and name C)
(resid 15 and name N)
(resid 15 and name CA)
(resid 15 and name C)
1.0 -66 20 2
! Talos derived phi restraint:
assign (resid 15 and name C)
(resid 16 and name N)
(resid 16 and name CA)
(resid 16 and name C)
1.0 -68 20 2
! Talos derived phi restraint:
assign (resid 16 and name C)
(resid 17 and name N)
(resid 17 and name CA)
(resid 17 and name C)
1.0 -73 30 2
! Talos derived phi restraint:
assign (resid 30 and name C)
(resid 31 and name N)
(resid 31 and name CA)
(resid 31 and name C)
1.0 -65 24 2
! Talos derived phi restraint:
assign (resid 31 and name C)
(resid 32 and name N)
(resid 32 and name CA)
(resid 32 and name C)
1.0 -93 42 2
! Talos derived phi restraint:
assign (resid 33 and name C)
(resid 34 and name N)
(resid 34 and name CA)
(resid 34 and name C)
1.0 -91 54 2
! Talos derived phi restraint:
assign (resid 34 and name C)
(resid 35 and name N)
(resid 35 and name CA)
(resid 35 and name C)
1.0 -64 20 2
! Talos derived phi restraint:
assign (resid 35 and name C)
(resid 36 and name N)
(resid 36 and name CA)
(resid 36 and name C)
1.0 -66 20 2
! Talos derived phi restraint:
assign (resid 36 and name C)
(resid 37 and name N)
(resid 37 and name CA)
(resid 37 and name C)
1.0 -73 20 2
! Talos derived phi restraint:
assign (resid 37 and name C)
(resid 38 and name N)
(resid 38 and name CA)
(resid 38 and name C)
1.0 -88 22 2
! Talos derived phi restraint:
assign (resid 38 and name C)
(resid 39 and name N)
(resid 39 and name CA)
(resid 39 and name C)
1.0 83 26 2
! Talos derived phi restraint:
assign (resid 39 and name C)
(resid 40 and name N)
(resid 40 and name CA)
(resid 40 and name C)
1.0 -106 52 2
! Talos derived phi restraint:
assign (resid 42 and name C)
(resid 43 and name N)
(resid 43 and name CA)
(resid 43 and name C)
1.0 -66 20 2
! Talos derived phi restraint:
assign (resid 43 and name C)
(resid 44 and name N)
(resid 44 and name CA)
(resid 44 and name C)
1.0 -66 20 2
! Talos derived phi restraint:
assign (resid 44 and name C)
(resid 45 and name N)
(resid 45 and name CA)
(resid 45 and name C)
1.0 -65 20 2
! Talos derived phi restraint:
assign (resid 45 and name C)
(resid 46 and name N)
(resid 46 and name CA)
(resid 46 and name C)
1.0 -64 20 2
! Talos derived phi restraint:
assign (resid 46 and name C)
(resid 47 and name N)
(resid 47 and name CA)
(resid 47 and name C)
1.0 -68 20 2
! Talos derived phi restraint:
assign (resid 47 and name C)
(resid 48 and name N)
(resid 48 and name CA)
(resid 48 and name C)
1.0 -70 20 2
! Talos derived phi restraint:
assign (resid 48 and name C)
(resid 49 and name N)
(resid 49 and name CA)
(resid 49 and name C)
1.0 -62 20 2
! Talos derived phi restraint:
assign (resid 49 and name C)
(resid 50 and name N)
(resid 50 and name CA)
(resid 50 and name C)
1.0 -61 20 2
! Talos derived phi restraint:
assign (resid 50 and name C)
(resid 51 and name N)
(resid 51 and name CA)
(resid 51 and name C)
1.0 -66 20 2
! Talos derived phi restraint:
assign (resid 51 and name C)
(resid 52 and name N)
(resid 52 and name CA)
(resid 52 and name C)
1.0 -63 20 2
! Talos derived phi restraint:
assign (resid 52 and name C)
(resid 53 and name N)
(resid 53 and name CA)
(resid 53 and name C)
1.0 -67 20 2
! Talos derived phi restraint:
assign (resid 53 and name C)
(resid 54 and name N)
(resid 54 and name CA)
(resid 54 and name C)
1.0 -66 20 2
! Talos derived phi restraint:
assign (resid 54 and name C)
(resid 55 and name N)
(resid 55 and name CA)
(resid 55 and name C)
1.0 -72 20 2
! Talos derived phi restraint:
assign (resid 55 and name C)
(resid 56 and name N)
(resid 56 and name CA)
(resid 56 and name C)
1.0 -96 20 2
! Talos derived phi restraint:
assign (resid 56 and name C)
(resid 57 and name N)
(resid 57 and name CA)
(resid 57 and name C)
1.0 68 22 2
! Talos derived phi restraint:
assign (resid 57 and name C)
(resid 58 and name N)
(resid 58 and name CA)
(resid 58 and name C)
1.0 -117 62 2
! Talos derived phi restraint:
assign (resid 59 and name C)
(resid 60 and name N)
(resid 60 and name CA)
(resid 60 and name C)
1.0 -98 42 2
! Talos derived phi restraint:
assign (resid 60 and name C)
(resid 61 and name N)
(resid 61 and name CA)
(resid 61 and name C)
1.0 -61 20 2
! Talos derived phi restraint:
assign (resid 61 and name C)
(resid 62 and name N)
(resid 62 and name CA)
(resid 62 and name C)
1.0 -58 22 2
! Talos derived phi restraint:
assign (resid 62 and name C)
(resid 63 and name N)
(resid 63 and name CA)
(resid 63 and name C)
1.0 -74 34 2
! Talos derived phi restraint:
assign (resid 63 and name C)
(resid 64 and name N)
(resid 64 and name CA)
(resid 64 and name C)
1.0 -68 32 2
! Talos derived phi restraint:
assign (resid 64 and name C)
(resid 65 and name N)
(resid 65 and name CA)
(resid 65 and name C)
1.0 -68 22 2
! Talos derived phi restraint:
assign (resid 67 and name C)
(resid 68 and name N)
(resid 68 and name CA)
(resid 68 and name C)
1.0 -110 52 2
! Talos derived phi restraint:
assign (resid 69 and name C)
(resid 70 and name N)
(resid 70 and name CA)
(resid 70 and name C)
1.0 -113 50 2
! Talos derived phi restraint:
assign (resid 70 and name C)
(resid 71 and name N)
(resid 71 and name CA)
(resid 71 and name C)
1.0 -59 20 2
! Talos derived phi restraint:
assign (resid 71 and name C)
(resid 72 and name N)
(resid 72 and name CA)
(resid 72 and name C)
1.0 -61 20 2
! Talos derived phi restraint:
assign (resid 72 and name C)
(resid 73 and name N)
(resid 73 and name CA)
(resid 73 and name C)
1.0 -66 20 2
! Talos derived phi restraint:
assign (resid 73 and name C)
(resid 74 and name N)
(resid 74 and name CA)
(resid 74 and name C)
1.0 -62 20 2
! Talos derived phi restraint:
assign (resid 74 and name C)
(resid 75 and name N)
(resid 75 and name CA)
(resid 75 and name C)
1.0 -62 20 2
! Talos derived phi restraint:
assign (resid 75 and name C)
(resid 76 and name N)
(resid 76 and name CA)
(resid 76 and name C)
1.0 -64 20 2
! Talos derived phi restraint:
assign (resid 76 and name C)
(resid 77 and name N)
(resid 77 and name CA)
(resid 77 and name C)
1.0 -66 20 2
! Talos derived phi restraint:
assign (resid 77 and name C)
(resid 78 and name N)
(resid 78 and name CA)
(resid 78 and name C)
1.0 -64 20 2
! Talos derived phi restraint:
assign (resid 78 and name C)
(resid 79 and name N)
(resid 79 and name CA)
(resid 79 and name C)
1.0 -61 20 2
! Talos derived phi restraint:
assign (resid 79 and name C)
(resid 80 and name N)
(resid 80 and name CA)
(resid 80 and name C)
1.0 -70 20 2
! Talos derived phi restraint:
assign (resid 80 and name C)
(resid 81 and name N)
(resid 81 and name CA)
(resid 81 and name C)
1.0 -66 28 2
! Talos derived phi restraint:
assign (resid 81 and name C)
(resid 82 and name N)
(resid 82 and name CA)
(resid 82 and name C)
1.0 -66 20 2
! Talos derived phi restraint:
assign (resid 82 and name C)
(resid 83 and name N)
(resid 83 and name CA)
(resid 83 and name C)
1.0 -76 30 2
! Talos derived psi restraint:
assign (resid 3 and name N)
(resid 3 and name CA)
(resid 3 and name C)
(resid 4 and name N)
1.0 129 22 2
! Talos derived psi restraint:
assign (resid 5 and name N)
(resid 5 and name CA)
(resid 5 and name C)
(resid 6 and name N)
1.0 144 20 2
! Talos derived psi restraint:
assign (resid 6 and name N)
(resid 6 and name CA)
(resid 6 and name C)
(resid 7 and name N)
1.0 171 20 2
! Talos derived psi restraint:
assign (resid 7 and name N)
(resid 7 and name CA)
(resid 7 and name C)
(resid 8 and name N)
1.0 -36 20 2
! Talos derived psi restraint:
assign (resid 8 and name N)
(resid 8 and name CA)
(resid 8 and name C)
(resid 9 and name N)
1.0 -40 20 2
! Talos derived psi restraint:
assign (resid 9 and name N)
(resid 9 and name CA)
(resid 9 and name C)
(resid 10 and name N)
1.0 -40 20 2
! Talos derived psi restraint:
assign (resid 10 and name N)
(resid 10 and name CA)
(resid 10 and name C)
(resid 11 and name N)
1.0 -42 20 2
! Talos derived psi restraint:
assign (resid 11 and name N)
(resid 11 and name CA)
(resid 11 and name C)
(resid 12 and name N)
1.0 -46 20 2
! Talos derived psi restraint:
assign (resid 12 and name N)
(resid 12 and name CA)
(resid 12 and name C)
(resid 13 and name N)
1.0 -42 20 2
! Talos derived psi restraint:
assign (resid 13 and name N)
(resid 13 and name CA)
(resid 13 and name C)
(resid 14 and name N)
1.0 -45 20 2
! Talos derived psi restraint:
assign (resid 14 and name N)
(resid 14 and name CA)
(resid 14 and name C)
(resid 15 and name N)
1.0 -36 20 2
! Talos derived psi restraint:
assign (resid 15 and name N)
(resid 15 and name CA)
(resid 15 and name C)
(resid 16 and name N)
1.0 -37 22 2
! Talos derived psi restraint:
assign (resid 16 and name N)
(resid 16 and name CA)
(resid 16 and name C)
(resid 17 and name N)
1.0 -28 20 2
! Talos derived psi restraint:
assign (resid 17 and name N)
(resid 17 and name CA)
(resid 17 and name C)
(resid 18 and name N)
1.0 -33 30 2
! Talos derived psi restraint:
assign (resid 31 and name N)
(resid 31 and name CA)
(resid 31 and name C)
(resid 32 and name N)
1.0 -29 20 2
! Talos derived psi restraint:
assign (resid 32 and name N)
(resid 32 and name CA)
(resid 32 and name C)
(resid 33 and name N)
1.0 -13 56 2
! Talos derived psi restraint:
assign (resid 34 and name N)
(resid 34 and name CA)
(resid 34 and name C)
(resid 35 and name N)
1.0 149 36 2
! Talos derived psi restraint:
assign (resid 35 and name N)
(resid 35 and name CA)
(resid 35 and name C)
(resid 36 and name N)
1.0 -33 20 2
! Talos derived psi restraint:
assign (resid 36 and name N)
(resid 36 and name CA)
(resid 36 and name C)
(resid 37 and name N)
1.0 -43 20 2
! Talos derived psi restraint:
assign (resid 37 and name N)
(resid 37 and name CA)
(resid 37 and name C)
(resid 38 and name N)
1.0 -30 24 2
! Talos derived psi restraint:
assign (resid 38 and name N)
(resid 38 and name CA)
(resid 38 and name C)
(resid 39 and name N)
1.0 -3 36 2
! Talos derived psi restraint:
assign (resid 39 and name N)
(resid 39 and name CA)
(resid 39 and name C)
(resid 40 and name N)
1.0 15 34 2
! Talos derived psi restraint:
assign (resid 40 and name N)
(resid 40 and name CA)
(resid 40 and name C)
(resid 41 and name N)
1.0 134 36 2
! Talos derived psi restraint:
assign (resid 43 and name N)
(resid 43 and name CA)
(resid 43 and name C)
(resid 44 and name N)
1.0 -37 20 2
! Talos derived psi restraint:
assign (resid 44 and name N)
(resid 44 and name CA)
(resid 44 and name C)
(resid 45 and name N)
1.0 -39 20 2
! Talos derived psi restraint:
assign (resid 45 and name N)
(resid 45 and name CA)
(resid 45 and name C)
(resid 46 and name N)
1.0 -42 20 2
! Talos derived psi restraint:
assign (resid 46 and name N)
(resid 46 and name CA)
(resid 46 and name C)
(resid 47 and name N)
1.0 -41 20 2
! Talos derived psi restraint:
assign (resid 47 and name N)
(resid 47 and name CA)
(resid 47 and name C)
(resid 48 and name N)
1.0 -39 20 2
! Talos derived psi restraint:
assign (resid 48 and name N)
(resid 48 and name CA)
(resid 48 and name C)
(resid 49 and name N)
1.0 -40 20 2
! Talos derived psi restraint:
assign (resid 49 and name N)
(resid 49 and name CA)
(resid 49 and name C)
(resid 50 and name N)
1.0 -41 20 2
! Talos derived psi restraint:
assign (resid 50 and name N)
(resid 50 and name CA)
(resid 50 and name C)
(resid 51 and name N)
1.0 -41 20 2
! Talos derived psi restraint:
assign (resid 51 and name N)
(resid 51 and name CA)
(resid 51 and name C)
(resid 52 and name N)
1.0 -44 20 2
! Talos derived psi restraint:
assign (resid 52 and name N)
(resid 52 and name CA)
(resid 52 and name C)
(resid 53 and name N)
1.0 -42 20 2
! Talos derived psi restraint:
assign (resid 53 and name N)
(resid 53 and name CA)
(resid 53 and name C)
(resid 54 and name N)
1.0 -43 20 2
! Talos derived psi restraint:
assign (resid 54 and name N)
(resid 54 and name CA)
(resid 54 and name C)
(resid 55 and name N)
1.0 -42 20 2
! Talos derived psi restraint:
assign (resid 55 and name N)
(resid 55 and name CA)
(resid 55 and name C)
(resid 56 and name N)
1.0 -34 20 2
! Talos derived psi restraint:
assign (resid 56 and name N)
(resid 56 and name CA)
(resid 56 and name C)
(resid 57 and name N)
1.0 -1 20 2
! Talos derived psi restraint:
assign (resid 57 and name N)
(resid 57 and name CA)
(resid 57 and name C)
(resid 58 and name N)
1.0 30 36 2
! Talos derived psi restraint:
assign (resid 58 and name N)
(resid 58 and name CA)
(resid 58 and name C)
(resid 59 and name N)
1.0 152 38 2
! Talos derived psi restraint:
assign (resid 60 and name N)
(resid 60 and name CA)
(resid 60 and name C)
(resid 61 and name N)
1.0 136 36 2
! Talos derived psi restraint:
assign (resid 61 and name N)
(resid 61 and name CA)
(resid 61 and name C)
(resid 62 and name N)
1.0 143 24 2
! Talos derived psi restraint:
assign (resid 62 and name N)
(resid 62 and name CA)
(resid 62 and name C)
(resid 63 and name N)
1.0 -36 38 2
! Talos derived psi restraint:
assign (resid 63 and name N)
(resid 63 and name CA)
(resid 63 and name C)
(resid 64 and name N)
1.0 -35 36 2
! Talos derived psi restraint:
assign (resid 64 and name N)
(resid 64 and name CA)
(resid 64 and name C)
(resid 65 and name N)
1.0 -34 58 2
! Talos derived psi restraint:
assign (resid 65 and name N)
(resid 65 and name CA)
(resid 65 and name C)
(resid 66 and name N)
1.0 -28 26 2
! Talos derived psi restraint:
assign (resid 68 and name N)
(resid 68 and name CA)
(resid 68 and name C)
(resid 69 and name N)
1.0 143 36 2
! Talos derived psi restraint:
assign (resid 70 and name N)
(resid 70 and name CA)
(resid 70 and name C)
(resid 71 and name N)
1.0 153 24 2
! Talos derived psi restraint:
assign (resid 71 and name N)
(resid 71 and name CA)
(resid 71 and name C)
(resid 72 and name N)
1.0 -34 20 2
! Talos derived psi restraint:
assign (resid 72 and name N)
(resid 72 and name CA)
(resid 72 and name C)
(resid 73 and name N)
1.0 -44 20 2
! Talos derived psi restraint:
assign (resid 73 and name N)
(resid 73 and name CA)
(resid 73 and name C)
(resid 74 and name N)
1.0 -39 20 2
! Talos derived psi restraint:
assign (resid 74 and name N)
(resid 74 and name CA)
(resid 74 and name C)
(resid 75 and name N)
1.0 -42 20 2
! Talos derived psi restraint:
assign (resid 75 and name N)
(resid 75 and name CA)
(resid 75 and name C)
(resid 76 and name N)
1.0 -42 20 2
! Talos derived psi restraint:
assign (resid 76 and name N)
(resid 76 and name CA)
(resid 76 and name C)
(resid 77 and name N)
1.0 -38 20 2
! Talos derived psi restraint:
assign (resid 77 and name N)
(resid 77 and name CA)
(resid 77 and name C)
(resid 78 and name N)
1.0 -41 20 2
! Talos derived psi restraint:
assign (resid 78 and name N)
(resid 78 and name CA)
(resid 78 and name C)
(resid 79 and name N)
1.0 -42 20 2
! Talos derived psi restraint:
assign (resid 79 and name N)
(resid 79 and name CA)
(resid 79 and name C)
(resid 80 and name N)
1.0 -36 20 2
! Talos derived psi restraint:
assign (resid 80 and name N)
(resid 80 and name CA)
(resid 80 and name C)
(resid 81 and name N)
1.0 -41 20 2
! Talos derived psi restraint:
assign (resid 81 and name N)
(resid 81 and name CA)
(resid 81 and name C)
(resid 82 and name N)
1.0 -41 20 2
! Talos derived psi restraint:
assign (resid 82 and name N)
(resid 82 and name CA)
(resid 82 and name C)
(resid 83 and name N)
1.0 -32 46 2
! Talos derived psi restraint:
assign (resid 83 and name N)
(resid 83 and name CA)
(resid 83 and name C)
(resid 84 and name N)
1.0 -18 54 2
Contact the webmaster for help, if required. Tuesday, May 28, 2024 7:11:49 PM GMT (wattos1)