NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
1581 | 1aq5 | 4054 | cing | 1-original | 3 | XPLOR/CNS | dihedral angle |
!!!! DIHEDRAL ANGLE RESTRAINTS ! ! !! Phi = (65 +/- 25)degrees if 3J(HN-HA)< 5.5 HZ !! Phi = (120 +/- 30)degrees if 3J(HN-HA)> 8 HZ ! !! 13 assign (resid 12 and name c and segid "A") (resid 13 and name n and segid "A") (resid 13 and name ca and segid "A") (resid 13 and name c and segid "A") 1.0 -65.0 25.0 2 !! 14 assign (resid 13 and name c and segid "A") (resid 14 and name n and segid "A") (resid 14 and name ca and segid "A") (resid 14 and name c and segid "A") 1.0 -65.0 25.0 2 !! 19 assign (resid 18 and name c and segid "A") (resid 19 and name n and segid "A") (resid 19 and name ca and segid "A") (resid 19 and name c and segid "A") 1.0 -65.0 25.0 2 !! 20 assign (resid 19 and name c and segid "A") (resid 20 and name n and segid "A") (resid 20 and name ca and segid "A") (resid 20 and name c and segid "A") 1.0 -65.0 25.0 2 !! 22 assign (resid 21 and name c and segid "A") (resid 22 and name n and segid "A") (resid 22 and name ca and segid "A") (resid 22 and name c and segid "A") 1.0 -65.0 25.0 2 !! 23 assign (resid 22 and name c and segid "A") (resid 23 and name n and segid "A") (resid 23 and name ca and segid "A") (resid 23 and name c and segid "A") 1.0 -65.0 25.0 2 !! 26 assign (resid 25 and name c and segid "A") (resid 26 and name n and segid "A") (resid 26 and name ca and segid "A") (resid 26 and name c and segid "A") 1.0 -65.0 25.0 2 !! 27 assign (resid 26 and name c and segid "A") (resid 27 and name n and segid "A") (resid 27 and name ca and segid "A") (resid 27 and name c and segid "A") 1.0 -65.0 25.0 2 !! 28 assign (resid 27 and name c and segid "A") (resid 28 and name n and segid "A") (resid 28 and name ca and segid "A") (resid 28 and name c and segid "A") 1.0 -65.0 25.0 2 !! 30 assign (resid 29 and name c and segid "A") (resid 30 and name n and segid "A") (resid 30 and name ca and segid "A") (resid 30 and name c and segid "A") 1.0 -65.0 25.0 2 !! 32 assign (resid 31 and name c and segid "A") (resid 32 and name n and segid "A") (resid 32 and name ca and segid "A") (resid 32 and name c and segid "A") 1.0 -65.0 25.0 2 !! 33 assign (resid 32 and name c and segid "A") (resid 33 and name n and segid "A") (resid 33 and name ca and segid "A") (resid 33 and name c and segid "A") 1.0 -65.0 25.0 2 !! 34 assign (resid 33 and name c and segid "A") (resid 34 and name n and segid "A") (resid 34 and name ca and segid "A") (resid 34 and name c and segid "A") 1.0 -65.0 25.0 2 !! 35 assign (resid 34 and name c and segid "A") (resid 35 and name n and segid "A") (resid 35 and name ca and segid "A") (resid 35 and name c and segid "A") 1.0 -65.0 25.0 2 !! 37 assign (resid 36 and name c and segid "A") (resid 37 and name n and segid "A") (resid 37 and name ca and segid "A") (resid 37 and name c and segid "A") 1.0 -65.0 25.0 2 !! 38 assign (resid 37 and name c and segid "A") (resid 38 and name n and segid "A") (resid 38 and name ca and segid "A") (resid 38 and name c and segid "A") 1.0 -65.0 25.0 2 !! 39 assign (resid 38 and name c and segid "A") (resid 39 and name n and segid "A") (resid 39 and name ca and segid "A") (resid 39 and name c and segid "A") 1.0 -65.0 25.0 2 !! 40 assign (resid 39 and name c and segid "A") (resid 40 and name n and segid "A") (resid 40 and name ca and segid "A") (resid 40 and name c and segid "A") 1.0 -65.0 25.0 2 !! 41 assign (resid 40 and name c and segid "A") (resid 41 and name n and segid "A") (resid 41 and name ca and segid "A") (resid 41 and name c and segid "A") 1.0 -65.0 25.0 2 !! 42 assign (resid 41 and name c and segid "A") (resid 42 and name n and segid "A") (resid 42 and name ca and segid "A") (resid 42 and name c and segid "A") 1.0 -65.0 25.0 2 !! 44 assign (resid 43 and name c and segid "A") (resid 44 and name n and segid "A") (resid 44 and name ca and segid "A") (resid 44 and name c and segid "A") 1.0 -65.0 25.0 2 ! !! 13 assign (resid 12 and name c and segid "B") (resid 13 and name n and segid "B") (resid 13 and name ca and segid "B") (resid 13 and name c and segid "B") 1.0 -65.0 25.0 2 !! 14 assign (resid 13 and name c and segid "B") (resid 14 and name n and segid "B") (resid 14 and name ca and segid "B") (resid 14 and name c and segid "B") 1.0 -65.0 25.0 2 !! 19 assign (resid 18 and name c and segid "B") (resid 19 and name n and segid "B") (resid 19 and name ca and segid "B") (resid 19 and name c and segid "B") 1.0 -65.0 25.0 2 !! 20 assign (resid 19 and name c and segid "B") (resid 20 and name n and segid "B") (resid 20 and name ca and segid "B") (resid 20 and name c and segid "B") 1.0 -65.0 25.0 2 !! 22 assign (resid 21 and name c and segid "B") (resid 22 and name n and segid "B") (resid 22 and name ca and segid "B") (resid 22 and name c and segid "B") 1.0 -65.0 25.0 2 !! 23 assign (resid 22 and name c and segid "B") (resid 23 and name n and segid "B") (resid 23 and name ca and segid "B") (resid 23 and name c and segid "B") 1.0 -65.0 25.0 2 !! 26 assign (resid 25 and name c and segid "B") (resid 26 and name n and segid "B") (resid 26 and name ca and segid "B") (resid 26 and name c and segid "B") 1.0 -65.0 25.0 2 !! 27 assign (resid 26 and name c and segid "B") (resid 27 and name n and segid "B") (resid 27 and name ca and segid "B") (resid 27 and name c and segid "B") 1.0 -65.0 25.0 2 !! 28 assign (resid 27 and name c and segid "B") (resid 28 and name n and segid "B") (resid 28 and name ca and segid "B") (resid 28 and name c and segid "B") 1.0 -65.0 25.0 2 !! 30 assign (resid 29 and name c and segid "B") (resid 30 and name n and segid "B") (resid 30 and name ca and segid "B") (resid 30 and name c and segid "B") 1.0 -65.0 25.0 2 !! 32 assign (resid 31 and name c and segid "B") (resid 32 and name n and segid "B") (resid 32 and name ca and segid "B") (resid 32 and name c and segid "B") 1.0 -65.0 25.0 2 !! 33 assign (resid 32 and name c and segid "B") (resid 33 and name n and segid "B") (resid 33 and name ca and segid "B") (resid 33 and name c and segid "B") 1.0 -65.0 25.0 2 !! 34 assign (resid 33 and name c and segid "B") (resid 34 and name n and segid "B") (resid 34 and name ca and segid "B") (resid 34 and name c and segid "B") 1.0 -65.0 25.0 2 !! 35 assign (resid 34 and name c and segid "B") (resid 35 and name n and segid "B") (resid 35 and name ca and segid "B") (resid 35 and name c and segid "B") 1.0 -65.0 25.0 2 !! 37 assign (resid 36 and name c and segid "B") (resid 37 and name n and segid "B") (resid 37 and name ca and segid "B") (resid 37 and name c and segid "B") 1.0 -65.0 25.0 2 !! 38 assign (resid 37 and name c and segid "B") (resid 38 and name n and segid "B") (resid 38 and name ca and segid "B") (resid 38 and name c and segid "B") 1.0 -65.0 25.0 2 !! 39 assign (resid 38 and name c and segid "B") (resid 39 and name n and segid "B") (resid 39 and name ca and segid "B") (resid 39 and name c and segid "B") 1.0 -65.0 25.0 2 !! 40 assign (resid 39 and name c and segid "B") (resid 40 and name n and segid "B") (resid 40 and name ca and segid "B") (resid 40 and name c and segid "B") 1.0 -65.0 25.0 2 !! 41 assign (resid 40 and name c and segid "B") (resid 41 and name n and segid "B") (resid 41 and name ca and segid "B") (resid 41 and name c and segid "B") 1.0 -65.0 25.0 2 !! 42 assign (resid 41 and name c and segid "B") (resid 42 and name n and segid "B") (resid 42 and name ca and segid "B") (resid 42 and name c and segid "B") 1.0 -65.0 25.0 2 !! 44 assign (resid 43 and name c and segid "B") (resid 44 and name n and segid "B") (resid 44 and name ca and segid "B") (resid 44 and name c and segid "B") 1.0 -65.0 25.0 2 ! !! 13 assign (resid 12 and name c and segid "C") (resid 13 and name n and segid "C") (resid 13 and name ca and segid "C") (resid 13 and name c and segid "C") 1.0 -65.0 25.0 2 !! 14 assign (resid 13 and name c and segid "C") (resid 14 and name n and segid "C") (resid 14 and name ca and segid "C") (resid 14 and name c and segid "C") 1.0 -65.0 25.0 2 !! 19 assign (resid 18 and name c and segid "C") (resid 19 and name n and segid "C") (resid 19 and name ca and segid "C") (resid 19 and name c and segid "C") 1.0 -65.0 25.0 2 !! 20 assign (resid 19 and name c and segid "C") (resid 20 and name n and segid "C") (resid 20 and name ca and segid "C") (resid 20 and name c and segid "C") 1.0 -65.0 25.0 2 !! 22 assign (resid 21 and name c and segid "C") (resid 22 and name n and segid "C") (resid 22 and name ca and segid "C") (resid 22 and name c and segid "C") 1.0 -65.0 25.0 2 !! 23 assign (resid 22 and name c and segid "C") (resid 23 and name n and segid "C") (resid 23 and name ca and segid "C") (resid 23 and name c and segid "C") 1.0 -65.0 25.0 2 !! 26 assign (resid 25 and name c and segid "C") (resid 26 and name n and segid "C") (resid 26 and name ca and segid "C") (resid 26 and name c and segid "C") 1.0 -65.0 25.0 2 !! 27 assign (resid 26 and name c and segid "C") (resid 27 and name n and segid "C") (resid 27 and name ca and segid "C") (resid 27 and name c and segid "C") 1.0 -65.0 25.0 2 !! 28 assign (resid 27 and name c and segid "C") (resid 28 and name n and segid "C") (resid 28 and name ca and segid "C") (resid 28 and name c and segid "C") 1.0 -65.0 25.0 2 !! 30 assign (resid 29 and name c and segid "C") (resid 30 and name n and segid "C") (resid 30 and name ca and segid "C") (resid 30 and name c and segid "C") 1.0 -65.0 25.0 2 !! 32 assign (resid 31 and name c and segid "C") (resid 32 and name n and segid "C") (resid 32 and name ca and segid "C") (resid 32 and name c and segid "C") 1.0 -65.0 25.0 2 !! 33 assign (resid 32 and name c and segid "C") (resid 33 and name n and segid "C") (resid 33 and name ca and segid "C") (resid 33 and name c and segid "C") 1.0 -65.0 25.0 2 !! 34 assign (resid 33 and name c and segid "C") (resid 34 and name n and segid "C") (resid 34 and name ca and segid "C") (resid 34 and name c and segid "C") 1.0 -65.0 25.0 2 !! 35 assign (resid 34 and name c and segid "C") (resid 35 and name n and segid "C") (resid 35 and name ca and segid "C") (resid 35 and name c and segid "C") 1.0 -65.0 25.0 2 !! 37 assign (resid 36 and name c and segid "C") (resid 37 and name n and segid "C") (resid 37 and name ca and segid "C") (resid 37 and name c and segid "C") 1.0 -65.0 25.0 2 !! 38 assign (resid 37 and name c and segid "C") (resid 38 and name n and segid "C") (resid 38 and name ca and segid "C") (resid 38 and name c and segid "C") 1.0 -65.0 25.0 2 !! 39 assign (resid 38 and name c and segid "C") (resid 39 and name n and segid "C") (resid 39 and name ca and segid "C") (resid 39 and name c and segid "C") 1.0 -65.0 25.0 2 !! 40 assign (resid 39 and name c and segid "C") (resid 40 and name n and segid "C") (resid 40 and name ca and segid "C") (resid 40 and name c and segid "C") 1.0 -65.0 25.0 2 !! 41 assign (resid 40 and name c and segid "C") (resid 41 and name n and segid "C") (resid 41 and name ca and segid "C") (resid 41 and name c and segid "C") 1.0 -65.0 25.0 2 !! 42 assign (resid 41 and name c and segid "C") (resid 42 and name n and segid "C") (resid 42 and name ca and segid "C") (resid 42 and name c and segid "C") 1.0 -65.0 25.0 2 !! 44 assign (resid 43 and name c and segid "C") (resid 44 and name n and segid "C") (resid 44 and name ca and segid "C") (resid 44 and name c and segid "C") 1.0 -65.0 25.0 2 ! !!!! chi1 angle restraints ! assign (resid 7 and name n and segid "A")(resid 7 and name ca and segid "A") (resid 7 and name cb and segid "A")(resid 7 and name cg and segid "A") 1.0 180.0 30.0 2 assign (resid 9 and name n and segid "A")(resid 9 and name ca and segid "A") (resid 9 and name cb and segid "A")(resid 9 and name sg and segid "A") 1.0 -60 30.0 2 assign (resid 10 and name n and segid "A")(resid 10 and name ca and segid "A") (resid 10 and name cb and segid "A")(resid 10 and name cg and segid "A") 1.0 -60 30.0 2 assign (resid 11 and name n and segid "A")(resid 11 and name ca and segid "A") (resid 11 and name cb and segid "A")(resid 11 and name sg and segid "A") 1.0 -60 30.0 2 assign (resid 13 and name n and segid "A")(resid 13 and name ca and segid "A") (resid 13 and name cb and segid "A")(resid 13 and name og and segid "A") 1.0 -60 30.0 2 assign (resid 17 and name n and segid "A")(resid 17 and name ca and segid "A") (resid 17 and name cb and segid "A")(resid 17 and name cg and segid "A") 1.0 180 30.0 2 assign (resid 18 and name n and segid "A")(resid 18 and name ca and segid "A") (resid 18 and name cb and segid "A")(resid 18 and name cg and segid "A") 1.0 -60 30.0 2 assign (resid 22 and name n and segid "A")(resid 22 and name ca and segid "A") (resid 22 and name cb and segid "A")(resid 22 and name cg and segid "A") 1.0 -60 30.0 2 assign (resid 24 and name n and segid "A")(resid 24 and name ca and segid "A") (resid 24 and name cb and segid "A")(resid 24 and name cg and segid "A") 1.0 180 30.0 2 assign (resid 26 and name n and segid "A")(resid 26 and name ca and segid "A") (resid 26 and name cb and segid "A")(resid 26 and name cg and segid "A") 1.0 180 30.0 2 assign (resid 28 and name n and segid "A")(resid 28 and name ca and segid "A") (resid 28 and name cb and segid "A")(resid 28 and name cg and segid "A") 1.0 -60 30.0 2 assign (resid 30 and name n and segid "A")(resid 30 and name ca and segid "A") (resid 30 and name cb and segid "A")(resid 30 and name cg and segid "A") 1.0 -60 30.0 2 assign (resid 32 and name n and segid "A")(resid 32 and name ca and segid "A") (resid 32 and name cb and segid "A")(resid 32 and name cg and segid "A") 1.0 180 30.0 2 assign (resid 38 and name n and segid "A")(resid 38 and name ca and segid "A") (resid 38 and name cb and segid "A")(resid 38 and name cg and segid "A") 1.0 -60 30.0 2 assign (resid 42 and name n and segid "A")(resid 42 and name ca and segid "A") (resid 42 and name cb and segid "A")(resid 42 and name cg and segid "A") 1.0 -60 30.0 2 assign (resid 43 and name n and segid "A")(resid 43 and name ca and segid "A") (resid 43 and name cb and segid "A")(resid 43 and name cg and segid "A") 1.0 -60 30.0 2 assign (resid 44 and name n and segid "A")(resid 44 and name ca and segid "A") (resid 44 and name cb and segid "A")(resid 44 and name cg and segid "A") 1.0 -60 30.0 2 ! assign (resid 7 and name n and segid "B")(resid 7 and name ca and segid "B") (resid 7 and name cb and segid "B")(resid 7 and name cg and segid "B") 1.0 180.0 30.0 2 assign (resid 9 and name n and segid "B")(resid 9 and name ca and segid "B") (resid 9 and name cb and segid "B")(resid 9 and name sg and segid "B") 1.0 -60 30.0 2 assign (resid 10 and name n and segid "B")(resid 10 and name ca and segid "B") (resid 10 and name cb and segid "B")(resid 10 and name cg and segid "B") 1.0 -60 30.0 2 assign (resid 11 and name n and segid "B")(resid 11 and name ca and segid "B") (resid 11 and name cb and segid "B")(resid 11 and name sg and segid "B") 1.0 -60 30.0 2 assign (resid 13 and name n and segid "B")(resid 13 and name ca and segid "B") (resid 13 and name cb and segid "B")(resid 13 and name og and segid "B") 1.0 -60 30.0 2 assign (resid 17 and name n and segid "B")(resid 17 and name ca and segid "B") (resid 17 and name cb and segid "B")(resid 17 and name cg and segid "B") 1.0 180 30.0 2 assign (resid 18 and name n and segid "B")(resid 18 and name ca and segid "B") (resid 18 and name cb and segid "B")(resid 18 and name cg and segid "B") 1.0 -60 30.0 2 assign (resid 22 and name n and segid "B")(resid 22 and name ca and segid "B") (resid 22 and name cb and segid "B")(resid 22 and name cg and segid "B") 1.0 -60 30.0 2 assign (resid 24 and name n and segid "B")(resid 24 and name ca and segid "B") (resid 24 and name cb and segid "B")(resid 24 and name cg and segid "B") 1.0 180 30.0 2 assign (resid 26 and name n and segid "B")(resid 26 and name ca and segid "B") (resid 26 and name cb and segid "B")(resid 26 and name cg and segid "B") 1.0 180 30.0 2 assign (resid 28 and name n and segid "B")(resid 28 and name ca and segid "B") (resid 28 and name cb and segid "B")(resid 28 and name cg and segid "B") 1.0 -60 30.0 2 assign (resid 30 and name n and segid "B")(resid 30 and name ca and segid "B") (resid 30 and name cb and segid "B")(resid 30 and name cg and segid "B") 1.0 -60 30.0 2 assign (resid 32 and name n and segid "B")(resid 32 and name ca and segid "B") (resid 32 and name cb and segid "B")(resid 32 and name cg and segid "B") 1.0 180 30.0 2 assign (resid 38 and name n and segid "B")(resid 38 and name ca and segid "B") (resid 38 and name cb and segid "B")(resid 38 and name cg and segid "B") 1.0 -60 30.0 2 assign (resid 42 and name n and segid "B")(resid 42 and name ca and segid "B") (resid 42 and name cb and segid "B")(resid 42 and name cg and segid "B") 1.0 -60 30.0 2 assign (resid 43 and name n and segid "B")(resid 43 and name ca and segid "B") (resid 43 and name cb and segid "B")(resid 43 and name cg and segid "B") 1.0 -60 30.0 2 assign (resid 44 and name n and segid "B")(resid 44 and name ca and segid "B") (resid 44 and name cb and segid "B")(resid 44 and name cg and segid "B") 1.0 -60 30.0 2 ! assign (resid 7 and name n and segid "C")(resid 7 and name ca and segid "C") (resid 7 and name cb and segid "C")(resid 7 and name cg and segid "C") 1.0 180.0 30.0 2 assign (resid 9 and name n and segid "C")(resid 9 and name ca and segid "C") (resid 9 and name cb and segid "C")(resid 9 and name sg and segid "C") 1.0 -60 30.0 2 assign (resid 10 and name n and segid "C")(resid 10 and name ca and segid "C") (resid 10 and name cb and segid "C")(resid 10 and name cg and segid "C") 1.0 -60 30.0 2 assign (resid 11 and name n and segid "C")(resid 11 and name ca and segid "C") (resid 11 and name cb and segid "C")(resid 11 and name sg and segid "C") 1.0 -60 30.0 2 assign (resid 13 and name n and segid "C")(resid 13 and name ca and segid "C") (resid 13 and name cb and segid "C")(resid 13 and name og and segid "C") 1.0 -60 30.0 2 assign (resid 17 and name n and segid "C")(resid 17 and name ca and segid "C") (resid 17 and name cb and segid "C")(resid 17 and name cg and segid "C") 1.0 180 30.0 2 assign (resid 18 and name n and segid "C")(resid 18 and name ca and segid "C") (resid 18 and name cb and segid "C")(resid 18 and name cg and segid "C") 1.0 -60 30.0 2 assign (resid 22 and name n and segid "C")(resid 22 and name ca and segid "C") (resid 22 and name cb and segid "C")(resid 22 and name cg and segid "C") 1.0 -60 30.0 2 assign (resid 24 and name n and segid "C")(resid 24 and name ca and segid "C") (resid 24 and name cb and segid "C")(resid 24 and name cg and segid "C") 1.0 180 30.0 2 assign (resid 26 and name n and segid "C")(resid 26 and name ca and segid "C") (resid 26 and name cb and segid "C")(resid 26 and name cg and segid "C") 1.0 180 30.0 2 assign (resid 28 and name n and segid "C")(resid 28 and name ca and segid "C") (resid 28 and name cb and segid "C")(resid 28 and name cg and segid "C") 1.0 -60 30.0 2 assign (resid 30 and name n and segid "C")(resid 30 and name ca and segid "C") (resid 30 and name cb and segid "C")(resid 30 and name cg and segid "C") 1.0 -60 30.0 2 assign (resid 32 and name n and segid "C")(resid 32 and name ca and segid "C") (resid 32 and name cb and segid "C")(resid 32 and name cg and segid "C") 1.0 180 30.0 2 assign (resid 38 and name n and segid "C")(resid 38 and name ca and segid "C") (resid 38 and name cb and segid "C")(resid 38 and name cg and segid "C") 1.0 -60 30.0 2 assign (resid 42 and name n and segid "C")(resid 42 and name ca and segid "C") (resid 42 and name cb and segid "C")(resid 42 and name cg and segid "C") 1.0 -60 30.0 2 assign (resid 43 and name n and segid "C")(resid 43 and name ca and segid "C") (resid 43 and name cb and segid "C")(resid 43 and name cg and segid "C") 1.0 -60 30.0 2 assign (resid 44 and name n and segid "C")(resid 44 and name ca and segid "C") (resid 44 and name cb and segid "C")(resid 44 and name cg and segid "C") 1.0 -60 30.0 2
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