NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
586528 |
2muy   |
25235 | cing | 1-original | 3 | XPLOR/CNS | dihedral angle |
!!! DIHEDRAL RESTRAINTS n=264
!! Ordered n= 180
! Backbone n= 126
assign(resid 30 and name c )(resid 31 and name n )
(resid 31 and name ca )(resid 31 and name c ) 5 -91.8 23.2 2
assign(resid 31 and name n )(resid 31 and name ca )
(resid 31 and name c )(resid 32 and name n ) 5 129.1 21.8 2
assign(resid 31 and name c )(resid 32 and name n )
(resid 32 and name ca )(resid 32 and name c ) 5 -127.6 18.7 2
assign(resid 32 and name n )(resid 32 and name ca )
(resid 32 and name c )(resid 33 and name n ) 5 133.9 22.9 2
assign(resid 32 and name c )(resid 33 and name n )
(resid 33 and name ca )(resid 33 and name c ) 5 -63.3 14.9 2
assign(resid 33 and name n )(resid 33 and name ca )
(resid 33 and name c )(resid 34 and name n ) 5 129.4 18.9 2
assign(resid 33 and name c )(resid 34 and name n )
(resid 34 and name ca )(resid 34 and name c ) 5 -59.4 14.3 2
assign(resid 34 and name n )(resid 34 and name ca )
(resid 34 and name c )(resid 35 and name n ) 5 -38.1 17.8 2
assign(resid 34 and name c )(resid 35 and name n )
(resid 35 and name ca )(resid 35 and name c ) 5 -63.7 9.5 2
assign(resid 35 and name n )(resid 35 and name ca )
(resid 35 and name c )(resid 36 and name n ) 5 -38.5 11.7 2
assign(resid 35 and name c )(resid 36 and name n )
(resid 36 and name ca )(resid 36 and name c ) 5 -65.7 7.8 2
assign(resid 36 and name n )(resid 36 and name ca )
(resid 36 and name c )(resid 37 and name n ) 5 -41.9 8.4 2
assign(resid 36 and name c )(resid 37 and name n )
(resid 37 and name ca )(resid 37 and name c ) 5 -65.2 6.4 2
assign(resid 37 and name n )(resid 37 and name ca )
(resid 37 and name c )(resid 38 and name n ) 5 -44.4 7.2 2
assign(resid 37 and name c )(resid 38 and name n )
(resid 38 and name ca )(resid 38 and name c ) 5 -63.8 3.2 2
assign(resid 38 and name n )(resid 38 and name ca )
(resid 38 and name c )(resid 39 and name n ) 5 -40.0 6.8 2
assign(resid 38 and name c )(resid 39 and name n )
(resid 39 and name ca )(resid 39 and name c ) 5 -65.7 4.7 2
assign(resid 39 and name n )(resid 39 and name ca )
(resid 39 and name c )(resid 40 and name n ) 5 -41.1 8.1 2
assign(resid 39 and name c )(resid 40 and name n )
(resid 40 and name ca )(resid 40 and name c ) 5 -63.7 7.8 2
assign(resid 40 and name n )(resid 40 and name ca )
(resid 40 and name c )(resid 41 and name n ) 5 -41.7 7.7 2
assign(resid 40 and name c )(resid 41 and name n )
(resid 41 and name ca )(resid 41 and name c ) 5 -65.4 8.4 2
assign(resid 41 and name n )(resid 41 and name ca )
(resid 41 and name c )(resid 42 and name n ) 5 -40.7 12.3 2
assign(resid 41 and name c )(resid 42 and name n )
(resid 42 and name ca )(resid 42 and name c ) 5 -65.6 8.7 2
assign(resid 42 and name n )(resid 42 and name ca )
(resid 42 and name c )(resid 43 and name n ) 5 -27.9 8.2 2
assign(resid 42 and name c )(resid 43 and name n )
(resid 43 and name ca )(resid 43 and name c ) 5 -96.0 16.3 2
assign(resid 43 and name n )(resid 43 and name ca )
(resid 43 and name c )(resid 44 and name n ) 5 8.8 14.3 2
assign(resid 43 and name c )(resid 44 and name n )
(resid 44 and name ca )(resid 44 and name c ) 5 57.1 21.1 2
assign(resid 44 and name n )(resid 44 and name ca )
(resid 44 and name c )(resid 45 and name n ) 5 38.9 27.6 2
assign(resid 44 and name c )(resid 45 and name n )
(resid 45 and name ca )(resid 45 and name c ) 5 -98.1 11.7 2
assign(resid 45 and name n )(resid 45 and name ca )
(resid 45 and name c )(resid 46 and name n ) 5 -3.8 26.8 2
assign(resid 45 and name c )(resid 46 and name n )
(resid 46 and name ca )(resid 46 and name c ) 5 -66.4 14.0 2
assign(resid 46 and name n )(resid 46 and name ca )
(resid 46 and name c )(resid 47 and name n ) 5 128.0 15.1 2
assign(resid 46 and name c )(resid 47 and name n )
(resid 47 and name ca )(resid 47 and name c ) 5 -111.2 13.4 2
assign(resid 47 and name n )(resid 47 and name ca )
(resid 47 and name c )(resid 48 and name n ) 5 -35.0 13.6 2
assign(resid 47 and name c )(resid 48 and name n )
(resid 48 and name ca )(resid 48 and name c ) 5 -144.8 18.4 2
assign(resid 48 and name n )(resid 48 and name ca )
(resid 48 and name c )(resid 49 and name n ) 5 145.1 16.4 2
assign(resid 48 and name c )(resid 49 and name n )
(resid 49 and name ca )(resid 49 and name c ) 5 -126.2 19.1 2
assign(resid 49 and name n )(resid 49 and name ca )
(resid 49 and name c )(resid 50 and name n ) 5 128.6 13.0 2
assign(resid 49 and name c )(resid 50 and name n )
(resid 50 and name ca )(resid 50 and name c ) 5 -112.3 22.6 2
assign(resid 50 and name n )(resid 50 and name ca )
(resid 50 and name c )(resid 51 and name n ) 5 125.7 19.6 2
assign(resid 50 and name c )(resid 51 and name n )
(resid 51 and name ca )(resid 51 and name c ) 5 -106.1 18.2 2
assign(resid 51 and name n )(resid 51 and name ca )
(resid 51 and name c )(resid 52 and name n ) 5 120.8 13.4 2
assign(resid 51 and name c )(resid 52 and name n )
(resid 52 and name ca )(resid 52 and name c ) 5 -120.6 25.8 2
assign(resid 52 and name n )(resid 52 and name ca )
(resid 52 and name c )(resid 53 and name n ) 5 105.2 26.7 2
assign(resid 52 and name c )(resid 53 and name n )
(resid 53 and name ca )(resid 53 and name c ) 5 70.6 11.7 2
assign(resid 53 and name n )(resid 53 and name ca )
(resid 53 and name c )(resid 54 and name n ) 5 -118.2 12.6 2
assign(resid 53 and name c )(resid 54 and name n )
(resid 54 and name ca )(resid 54 and name c ) 5 -98.5 24.3 2
assign(resid 54 and name n )(resid 54 and name ca )
(resid 54 and name c )(resid 55 and name n ) 5 1.9 25.8 2
assign(resid 54 and name c )(resid 55 and name n )
(resid 55 and name ca )(resid 55 and name c ) 5 -107.1 26.2 2
assign(resid 55 and name n )(resid 55 and name ca )
(resid 55 and name c )(resid 56 and name n ) 5 138.1 25.5 2
assign(resid 55 and name c )(resid 56 and name n )
(resid 56 and name ca )(resid 56 and name c ) 5 -112.5 15.9 2
assign(resid 56 and name n )(resid 56 and name ca )
(resid 56 and name c )(resid 57 and name n ) 5 127.8 17.3 2
assign(resid 56 and name c )(resid 57 and name n )
(resid 57 and name ca )(resid 57 and name c ) 5 -108.9 45.3 2
assign(resid 57 and name n )(resid 57 and name ca )
(resid 57 and name c )(resid 58 and name n ) 5 157.1 30.8 2
assign(resid 57 and name c )(resid 58 and name n )
(resid 58 and name ca )(resid 58 and name c ) 5 -124.8 71.3 2
assign(resid 58 and name n )(resid 58 and name ca )
(resid 58 and name c )(resid 59 and name n ) 5 141.5 27.0 2
assign(resid 58 and name c )(resid 59 and name n )
(resid 59 and name ca )(resid 59 and name c ) 5 -89.7 31.1 2
assign(resid 59 and name n )(resid 59 and name ca )
(resid 59 and name c )(resid 60 and name n ) 5 130.7 21.1 2
assign(resid 59 and name c )(resid 60 and name n )
(resid 60 and name ca )(resid 60 and name c ) 5 -70.4 21.9 2
assign(resid 60 and name n )(resid 60 and name ca )
(resid 60 and name c )(resid 61 and name n ) 5 148.8 25.4 2
assign(resid 60 and name c )(resid 61 and name n )
(resid 61 and name ca )(resid 61 and name c ) 5 -61.8 10.5 2
assign(resid 61 and name n )(resid 61 and name ca )
(resid 61 and name c )(resid 62 and name n ) 5 -26.4 13.7 2
assign(resid 61 and name c )(resid 62 and name n )
(resid 62 and name ca )(resid 62 and name c ) 5 -90.4 18.9 2
assign(resid 62 and name n )(resid 62 and name ca )
(resid 62 and name c )(resid 63 and name n ) 5 7.7 14.6 2
assign(resid 62 and name c )(resid 63 and name n )
(resid 63 and name ca )(resid 63 and name c ) 5 72.5 10.7 2
assign(resid 63 and name n )(resid 63 and name ca )
(resid 63 and name c )(resid 64 and name n ) 5 9.1 13.5 2
assign(resid 63 and name c )(resid 64 and name n )
(resid 64 and name ca )(resid 64 and name c ) 5 -71.2 19.9 2
assign(resid 64 and name n )(resid 64 and name ca )
(resid 64 and name c )(resid 65 and name n ) 5 143.9 27.9 2
assign(resid 64 and name c )(resid 65 and name n )
(resid 65 and name ca )(resid 65 and name c ) 5 -129.0 15.9 2
assign(resid 65 and name n )(resid 65 and name ca )
(resid 65 and name c )(resid 66 and name n ) 5 146.9 18.0 2
assign(resid 65 and name c )(resid 66 and name n )
(resid 66 and name ca )(resid 66 and name c ) 5 -152.4 25.0 2
assign(resid 66 and name n )(resid 66 and name ca )
(resid 66 and name c )(resid 67 and name n ) 5 160.8 21.2 2
assign(resid 66 and name c )(resid 67 and name n )
(resid 67 and name ca )(resid 67 and name c ) 5 -121.7 19.0 2
assign(resid 67 and name n )(resid 67 and name ca )
(resid 67 and name c )(resid 68 and name n ) 5 134.8 22.9 2
assign(resid 67 and name c )(resid 68 and name n )
(resid 68 and name ca )(resid 68 and name c ) 5 -127.5 22.6 2
assign(resid 68 and name n )(resid 68 and name ca )
(resid 68 and name c )(resid 69 and name n ) 5 148.2 22.5 2
assign(resid 68 and name c )(resid 69 and name n )
(resid 69 and name ca )(resid 69 and name c ) 5 -118.3 22.7 2
assign(resid 69 and name n )(resid 69 and name ca )
(resid 69 and name c )(resid 70 and name n ) 5 132.7 20.4 2
assign(resid 69 and name c )(resid 70 and name n )
(resid 70 and name ca )(resid 70 and name c ) 5 -100.0 46.8 2
assign(resid 70 and name n )(resid 70 and name ca )
(resid 70 and name c )(resid 71 and name n ) 5 136.6 32.1 2
assign(resid 70 and name c )(resid 71 and name n )
(resid 71 and name ca )(resid 71 and name c ) 5 -66.3 21.4 2
assign(resid 71 and name n )(resid 71 and name ca )
(resid 71 and name c )(resid 72 and name n ) 5 -24.1 17.6 2
assign(resid 71 and name c )(resid 72 and name n )
(resid 72 and name ca )(resid 72 and name c ) 5 -114.0 29.0 2
assign(resid 72 and name n )(resid 72 and name ca )
(resid 72 and name c )(resid 73 and name n ) 5 138.0 30.0 2
assign(resid 72 and name c )(resid 73 and name n )
(resid 73 and name ca )(resid 73 and name c ) 5 -66.0 15.2 2
assign(resid 73 and name n )(resid 73 and name ca )
(resid 73 and name c )(resid 74 and name n ) 5 138.4 21.5 2
assign(resid 73 and name c )(resid 74 and name n )
(resid 74 and name ca )(resid 74 and name c ) 5 -81.7 37.0 2
assign(resid 74 and name n )(resid 74 and name ca )
(resid 74 and name c )(resid 75 and name n ) 5 121.8 31.6 2
assign(resid 74 and name c )(resid 75 and name n )
(resid 75 and name ca )(resid 75 and name c ) 5 -60.5 10.9 2
assign(resid 75 and name n )(resid 75 and name ca )
(resid 75 and name c )(resid 76 and name n ) 5 -27.4 11.1 2
assign(resid 75 and name c )(resid 76 and name n )
(resid 76 and name ca )(resid 76 and name c ) 5 -88.2 28.7 2
assign(resid 76 and name n )(resid 76 and name ca )
(resid 76 and name c )(resid 77 and name n ) 5 -3.0 39.8 2
assign(resid 76 and name c )(resid 77 and name n )
(resid 77 and name ca )(resid 77 and name c ) 5 -61.9 16.7 2
assign(resid 77 and name n )(resid 77 and name ca )
(resid 77 and name c )(resid 78 and name n ) 5 -46.9 11.8 2
assign(resid 77 and name c )(resid 78 and name n )
(resid 78 and name ca )(resid 78 and name c ) 5 -63.6 7.7 2
assign(resid 78 and name n )(resid 78 and name ca )
(resid 78 and name c )(resid 79 and name n ) 5 -42.1 11.0 2
assign(resid 78 and name c )(resid 79 and name n )
(resid 79 and name ca )(resid 79 and name c ) 5 -64.9 8.3 2
assign(resid 79 and name n )(resid 79 and name ca )
(resid 79 and name c )(resid 80 and name n ) 5 -40.8 9.0 2
assign(resid 79 and name c )(resid 80 and name n )
(resid 80 and name ca )(resid 80 and name c ) 5 -65.2 4.8 2
assign(resid 80 and name n )(resid 80 and name ca )
(resid 80 and name c )(resid 81 and name n ) 5 -40.2 9.2 2
assign(resid 80 and name c )(resid 81 and name n )
(resid 81 and name ca )(resid 81 and name c ) 5 -63.8 5.3 2
assign(resid 81 and name n )(resid 81 and name ca )
(resid 81 and name c )(resid 82 and name n ) 5 -43.1 6.3 2
assign(resid 81 and name c )(resid 82 and name n )
(resid 82 and name ca )(resid 82 and name c ) 5 -66.8 7.5 2
assign(resid 82 and name n )(resid 82 and name ca )
(resid 82 and name c )(resid 83 and name n ) 5 -38.0 13.4 2
assign(resid 82 and name c )(resid 83 and name n )
(resid 83 and name ca )(resid 83 and name c ) 5 -65.9 7.9 2
assign(resid 83 and name n )(resid 83 and name ca )
(resid 83 and name c )(resid 84 and name n ) 5 -24.8 8.1 2
assign(resid 83 and name c )(resid 84 and name n )
(resid 84 and name ca )(resid 84 and name c ) 5 -93.8 13.6 2
assign(resid 84 and name n )(resid 84 and name ca )
(resid 84 and name c )(resid 85 and name n ) 5 8.0 9.8 2
assign(resid 84 and name c )(resid 85 and name n )
(resid 85 and name ca )(resid 85 and name c ) 5 57.9 14.8 2
assign(resid 85 and name n )(resid 85 and name ca )
(resid 85 and name c )(resid 86 and name n ) 5 38.2 18.5 2
assign(resid 85 and name c )(resid 86 and name n )
(resid 86 and name ca )(resid 86 and name c ) 5 -84.0 18.1 2
assign(resid 86 and name n )(resid 86 and name ca )
(resid 86 and name c )(resid 87 and name n ) 5 134.3 15.3 2
assign(resid 86 and name c )(resid 87 and name n )
(resid 87 and name ca )(resid 87 and name c ) 5 -78.6 18.2 2
assign(resid 87 and name n )(resid 87 and name ca )
(resid 87 and name c )(resid 88 and name n ) 5 121.5 25.1 2
assign(resid 87 and name c )(resid 88 and name n )
(resid 88 and name ca )(resid 88 and name c ) 5 -105.5 25.0 2
assign(resid 88 and name n )(resid 88 and name ca )
(resid 88 and name c )(resid 89 and name n ) 5 124.8 21.4 2
assign(resid 88 and name c )(resid 89 and name n )
(resid 89 and name ca )(resid 89 and name c ) 5 -114.1 23.0 2
assign(resid 89 and name n )(resid 89 and name ca )
(resid 89 and name c )(resid 90 and name n ) 5 120.8 19.6 2
assign(resid 89 and name c )(resid 90 and name n )
(resid 90 and name ca )(resid 90 and name c ) 5 -113.7 80.2 2
assign(resid 90 and name n )(resid 90 and name ca )
(resid 90 and name c )(resid 91 and name n ) 5 162.2 33.2 2
assign(resid 90 and name c )(resid 91 and name n )
(resid 91 and name ca )(resid 91 and name c ) 5 -132.0 21.8 2
assign(resid 91 and name n )(resid 91 and name ca )
(resid 91 and name c )(resid 92 and name n ) 5 92.7 38.7 2
assign(resid 91 and name c )(resid 92 and name n )
(resid 92 and name ca )(resid 92 and name c ) 5 -65.7 18.4 2
assign(resid 92 and name n )(resid 92 and name ca )
(resid 92 and name c )(resid 93 and name n ) 5 143.7 19.7 2
assign(resid 92 and name c )(resid 93 and name n )
(resid 93 and name ca )(resid 93 and name c ) 5 -70.0 20.0 2
assign(resid 93 and name n )(resid 93 and name ca )
(resid 93 and name c )(resid 94 and name n ) 5 145.0 35.0 2
! Sidechain n= 54
assign(resid 34 and name n )(resid 34 and name ca )
(resid 34 and name cb )(resid 34 and name cg ) 10 180 30 2
assign(resid 36 and name n )(resid 36 and name ca )
(resid 36 and name cb )(resid 36 and name og1 ) 10 -60 30 2
assign(resid 38 and name n )(resid 38 and name ca )
(resid 38 and name cb )(resid 38 and name cg ) 10 -60 30 2
assign(resid 38 and name ca )(resid 38 and name cb )
(resid 38 and name cg )(resid 38 and name cd1 ) 10 180 30 2
assign(resid 41 and name n )(resid 41 and name ca )
(resid 41 and name cb )(resid 41 and name cg1 ) 10 180 30 2
assign(resid 43 and name n )(resid 43 and name ca )
(resid 43 and name cb )(resid 43 and name cg ) 10 -60 30 2
assign(resid 44 and name n )(resid 44 and name ca )
(resid 44 and name cb )(resid 44 and name cg ) 10 180 30 2
assign(resid 45 and name n )(resid 45 and name ca )
(resid 45 and name cb )(resid 45 and name cg ) 10 -60 30 2
assign(resid 46 and name n )(resid 46 and name ca )
(resid 46 and name cb )(resid 46 and name cg1 ) 10 180 30 2
assign(resid 48 and name n )(resid 48 and name ca )
(resid 48 and name cb )(resid 48 and name cg ) 10 180 30 2
assign(resid 50 and name n )(resid 50 and name ca )
(resid 50 and name cb )(resid 50 and name cg ) 10 -60 30 2
assign(resid 51 and name n )(resid 51 and name ca )
(resid 51 and name cb )(resid 51 and name cg1 ) 10 -60 30 2
assign(resid 51 and name ca )(resid 51 and name cb )
(resid 51 and name cg1 )(resid 51 and name cd1 ) 10 180 30 2
assign(resid 52 and name n )(resid 52 and name ca )
(resid 52 and name cb )(resid 52 and name cg ) 10 180 30 2
assign(resid 56 and name n )(resid 56 and name ca )
(resid 56 and name cb )(resid 56 and name cg1 ) 10 -60 30 2
assign(resid 56 and name ca )(resid 56 and name cb )
(resid 56 and name cg1 )(resid 56 and name cd1 ) 10 180 30 2
assign(resid 57 and name n )(resid 57 and name ca )
(resid 57 and name cb )(resid 57 and name cg ) 10 -60 30 2
assign(resid 58 and name n )(resid 58 and name ca )
(resid 58 and name cb )(resid 58 and name cg1 ) 10 180 30 2
assign(resid 60 and name n )(resid 60 and name ca )
(resid 60 and name cb )(resid 60 and name cg ) 10 0 90 2
assign(resid 60 and name ca )(resid 60 and name cb )
(resid 60 and name cg )(resid 60 and name cd ) 10 180 30 2
assign(resid 61 and name n )(resid 61 and name ca )
(resid 61 and name cb )(resid 61 and name cg ) 10 0 90 2
assign(resid 62 and name n )(resid 62 and name ca )
(resid 62 and name cb )(resid 62 and name cg ) 10 180 60 2
assign(resid 64 and name n )(resid 64 and name ca )
(resid 64 and name cb )(resid 64 and name cg ) 10 -60 30 2
assign(resid 65 and name n )(resid 65 and name ca )
(resid 65 and name cb )(resid 65 and name cg ) 10 -60 30 2
assign(resid 66 and name n )(resid 66 and name ca )
(resid 66 and name cb )(resid 66 and name cg ) 10 60 30 2
assign(resid 67 and name n )(resid 67 and name ca )
(resid 67 and name cb )(resid 67 and name og1 ) 10 -60 30 2
assign(resid 68 and name n )(resid 68 and name ca )
(resid 68 and name cb )(resid 68 and name og1 ) 10 180 30 2
assign(resid 69 and name n )(resid 69 and name ca )
(resid 69 and name cb )(resid 69 and name cg ) 10 -60 30 2
assign(resid 69 and name ca )(resid 69 and name cb )
(resid 69 and name cg )(resid 69 and name cd1 ) 10 90 15 2
assign(resid 70 and name n )(resid 70 and name ca )
(resid 70 and name cb )(resid 70 and name cg1 ) 10 -60 30 2
assign(resid 70 and name ca )(resid 70 and name cb )
(resid 70 and name cg1 )(resid 70 and name cd1 ) 10 180 30 2
assign(resid 74 and name n )(resid 74 and name ca )
(resid 74 and name cb )(resid 74 and name cg ) 10 180 30 2
assign(resid 75 and name n )(resid 75 and name ca )
(resid 75 and name cb )(resid 75 and name cg ) 10 -30 15 2
assign(resid 75 and name ca )(resid 75 and name cb )
(resid 75 and name cg )(resid 75 and name cd ) 10 45 10 2
assign(resid 76 and name n )(resid 76 and name ca )
(resid 76 and name cb )(resid 76 and name cg ) 10 180 30 2
assign(resid 77 and name n )(resid 77 and name ca )
(resid 77 and name cb )(resid 77 and name cg ) 10 180 30 2
assign(resid 77 and name ca )(resid 77 and name cb )
(resid 77 and name cg )(resid 77 and name cd1 ) 10 60 30 2
assign(resid 78 and name n )(resid 78 and name ca )
(resid 78 and name cb )(resid 78 and name cg ) 10 -60 30 2
assign(resid 78 and name ca )(resid 78 and name cb )
(resid 78 and name cg )(resid 78 and name cd1 ) 10 180 30 2
assign(resid 81 and name n )(resid 81 and name ca )
(resid 81 and name cb )(resid 81 and name cg ) 10 -60 30 2
assign(resid 81 and name ca )(resid 81 and name cb )
(resid 81 and name cg )(resid 81 and name cd1 ) 10 180 30 2
assign(resid 82 and name n )(resid 82 and name ca )
(resid 82 and name cb )(resid 82 and name cg ) 10 -60 30 2
assign(resid 82 and name ca )(resid 82 and name cb )
(resid 82 and name cg )(resid 82 and name cd1 ) 10 180 30 2
assign(resid 83 and name n )(resid 83 and name ca )
(resid 83 and name cb )(resid 83 and name og1 ) 10 -60 30 2
assign(resid 84 and name n )(resid 84 and name ca )
(resid 84 and name cb )(resid 84 and name cg ) 10 -60 30 2
assign(resid 85 and name n )(resid 85 and name ca )
(resid 85 and name cb )(resid 85 and name cg ) 10 -60 30 2
assign(resid 86 and name n )(resid 86 and name ca )
(resid 86 and name cb )(resid 86 and name cg1 ) 10 180 30 2
assign(resid 87 and name n )(resid 87 and name ca )
(resid 87 and name cb )(resid 87 and name cg ) 10 180 30 2
assign(resid 88 and name n )(resid 88 and name ca )
(resid 88 and name cb )(resid 88 and name cg1 ) 10 180 30 2
assign(resid 89 and name n )(resid 89 and name ca )
(resid 89 and name cb )(resid 89 and name cg1 ) 10 180 30 2
assign(resid 91 and name n )(resid 91 and name ca )
(resid 91 and name cb )(resid 91 and name cg ) 10 -60 30 2
assign(resid 91 and name ca )(resid 91 and name cb )
(resid 91 and name cg )(resid 91 and name cd ) 10 180 30 2
assign(resid 93 and name n )(resid 93 and name ca )
(resid 93 and name cb )(resid 93 and name cg ) 10 -30 30 2
assign(resid 93 and name ca )(resid 93 and name cb )
(resid 93 and name cg )(resid 93 and name cd ) 10 45 10 2
!! Disordered n= 67
assign (resid 23 and name N )(resid 23 and name CA )
(resid 23 and name CB )(resid 23 and name CG ) 10 -120 90 2
assign (resid 23 and name CA )(resid 23 and name CB )
(resid 23 and name CG )(resid 23 and name SD ) 10 -120 90 2
assign (resid 23 and name C )(resid 24 and name N )
(resid 24 and name CA )(resid 24 and name C ) 10 -105 55 2
assign (resid 23 and name CA )(resid 24 and name CA )
(resid 25 and name CA )(resid 26 and name CA ) 10 125 85 2
assign (resid 24 and name C )(resid 25 and name N )
(resid 25 and name CA )(resid 25 and name C ) 10 -105 55 2
assign (resid 25 and name N )(resid 25 and name CA )
(resid 25 and name CB )(resid 25 and name OG ) 10 60 150 2
assign (resid 25 and name N )(resid 25 and name CA )
(resid 25 and name CB )(resid 25 and name OG ) 10 -60 150 2
assign (resid 25 and name N )(resid 25 and name CA )
(resid 25 and name CB )(resid 25 and name OG ) 10 180 150 2
assign (resid 24 and name CA )(resid 25 and name CA )
(resid 26 and name CA )(resid 27 and name CA ) 10 125 85 2
assign (resid 25 and name C )(resid 26 and name N )
(resid 26 and name CA )(resid 26 and name C ) 10 -105 55 2
assign (resid 26 and name CA )(resid 26 and name CB )
(resid 26 and name CG )(resid 26 and name CD ) 10 -120 90 2
assign (resid 25 and name CA )(resid 26 and name CA )
(resid 27 and name CA )(resid 28 and name CA ) 10 125 85 2
assign (resid 26 and name C )(resid 27 and name N )
(resid 27 and name CA )(resid 27 and name C ) 10 -105 55 2
assign (resid 27 and name N )(resid 27 and name CA )
(resid 27 and name CB )(resid 27 and name OG ) 10 60 150 2
assign (resid 27 and name N )(resid 27 and name CA )
(resid 27 and name CB )(resid 27 and name OG ) 10 -60 150 2
assign (resid 27 and name N )(resid 27 and name CA )
(resid 27 and name CB )(resid 27 and name OG ) 10 180 150 2
assign (resid 26 and name CA )(resid 27 and name CA )
(resid 28 and name CA )(resid 29 and name CA ) 10 125 85 2
assign (resid 27 and name C )(resid 28 and name N )
(resid 28 and name CA )(resid 28 and name C ) 10 -105 55 2
assign (resid 28 and name CA )(resid 28 and name CB )
(resid 28 and name CG )(resid 28 and name OD1 ) 10 0 45 2
assign (resid 27 and name CA )(resid 28 and name CA )
(resid 29 and name CA )(resid 30 and name CA ) 10 125 85 2
assign (resid 28 and name C )(resid 29 and name N )
(resid 29 and name CA )(resid 29 and name C ) 10 180 135 2
assign (resid 93 and name CA )(resid 94 and name CA )
(resid 95 and name CA )(resid 96 and name CA ) 10 125 85 2
assign (resid 94 and name C )(resid 95 and name N )
(resid 95 and name CA )(resid 95 and name C ) 10 -120 40 2
assign (resid 95 and name N )(resid 95 and name CA )
(resid 95 and name C )(resid 96 and name N ) 10 110 50 2
assign (resid 95 and name CA )(resid 95 and name CB )
(resid 95 and name CG )(resid 95 and name CD ) 10 -120 90 2
assign (resid 94 and name CA )(resid 95 and name CA )
(resid 96 and name CA )(resid 97 and name CA ) 10 125 85 2
assign (resid 95 and name C )(resid 96 and name N )
(resid 96 and name CA )(resid 96 and name C ) 10 -65 25 2
assign (resid 96 and name N )(resid 96 and name CA )
(resid 96 and name CB )(resid 96 and name CG ) 10 0 45 2
assign (resid 96 and name N )(resid 96 and name CA )
(resid 96 and name CB )(resid 96 and name CG ) 10 180 160 2
assign (resid 96 and name CA )(resid 96 and name CB )
(resid 96 and name CG )(resid 96 and name CD ) 10 0 50 2
assign (resid 96 and name CA )(resid 96 and name CB )
(resid 96 and name CG )(resid 96 and name CD ) 10 180 155 2
assign (resid 95 and name CA )(resid 96 and name CA )
(resid 97 and name CA )(resid 98 and name CA ) 10 125 85 2
assign (resid 96 and name C )(resid 97 and name N )
(resid 97 and name CA )(resid 97 and name C ) 10 -105 55 2
assign (resid 97 and name N )(resid 97 and name CA )
(resid 97 and name CB )(resid 97 and name CG ) 10 -120 90 2
assign (resid 97 and name CA )(resid 97 and name CB )
(resid 97 and name CG )(resid 97 and name CD1 ) 10 120 90 2
assign (resid 96 and name CA )(resid 97 and name CA )
(resid 98 and name CA )(resid 99 and name CA ) 10 125 85 2
assign (resid 97 and name C )(resid 98 and name N )
(resid 98 and name CA )(resid 98 and name C ) 10 -105 55 2
assign (resid 98 and name CA )(resid 98 and name CB )
(resid 98 and name CG )(resid 98 and name CD ) 10 -120 90 2
assign (resid 97 and name CA )(resid 98 and name CA )
(resid 99 and name CA )(resid 100 and name CA ) 10 125 85 2
assign (resid 98 and name C )(resid 99 and name N )
(resid 99 and name CA )(resid 99 and name C ) 10 -105 55 2
assign (resid 99 and name N )(resid 99 and name CA )
(resid 99 and name CB )(resid 99 and name CG ) 10 -120 90 2
assign (resid 99 and name CA )(resid 99 and name CB )
(resid 99 and name CG )(resid 99 and name ND1 ) 10 0 120 2
assign (resid 99 and name CA )(resid 99 and name CB )
(resid 99 and name CG )(resid 99 and name ND1 ) 10 180 120 2
assign (resid 98 and name CA )(resid 99 and name CA )
(resid 100 and name CA )(resid 101 and name CA ) 10 125 85 2
assign (resid 99 and name C )(resid 100 and name N )
(resid 100 and name CA )(resid 100 and name C ) 10 -105 55 2
assign (resid 100 and name N )(resid 100 and name CA )
(resid 100 and name CB )(resid 100 and name CG ) 10 -120 90 2
assign (resid 100 and name CA )(resid 100 and name CB )
(resid 100 and name CG )(resid 100 and name ND1 ) 10 0 120 2
assign (resid 100 and name CA )(resid 100 and name CB )
(resid 100 and name CG )(resid 100 and name ND1 ) 10 180 120 2
assign (resid 99 and name CA )(resid 100 and name CA )
(resid 101 and name CA )(resid 102 and name CA ) 10 125 85 2
assign (resid 100 and name C )(resid 101 and name N )
(resid 101 and name CA )(resid 101 and name C ) 10 -105 55 2
assign (resid 101 and name N )(resid 101 and name CA )
(resid 101 and name CB )(resid 101 and name CG ) 10 -120 90 2
assign (resid 101 and name CA )(resid 101 and name CB )
(resid 101 and name CG )(resid 101 and name ND1 ) 10 0 120 2
assign (resid 101 and name CA )(resid 101 and name CB )
(resid 101 and name CG )(resid 101 and name ND1 ) 10 180 120 2
assign (resid 100 and name CA )(resid 101 and name CA )
(resid 102 and name CA )(resid 103 and name CA ) 10 125 85 2
assign (resid 101 and name C )(resid 102 and name N )
(resid 102 and name CA )(resid 102 and name C ) 10 -105 55 2
assign (resid 102 and name N )(resid 102 and name CA )
(resid 102 and name CB )(resid 102 and name CG ) 10 -120 90 2
assign (resid 102 and name CA )(resid 102 and name CB )
(resid 102 and name CG )(resid 102 and name ND1 ) 10 0 120 2
assign (resid 102 and name CA )(resid 102 and name CB )
(resid 102 and name CG )(resid 102 and name ND1 ) 10 180 120 2
assign (resid 101 and name CA )(resid 102 and name CA )
(resid 103 and name CA )(resid 104 and name CA ) 10 125 85 2
assign (resid 102 and name C )(resid 103 and name N )
(resid 103 and name CA )(resid 103 and name C ) 10 -105 55 2
assign (resid 103 and name N )(resid 103 and name CA )
(resid 103 and name CB )(resid 103 and name CG ) 10 -120 90 2
assign (resid 103 and name CA )(resid 103 and name CB )
(resid 103 and name CG )(resid 103 and name ND1 ) 10 0 120 2
assign (resid 103 and name CA )(resid 103 and name CB )
(resid 103 and name CG )(resid 103 and name ND1 ) 10 180 120 2
assign (resid 103 and name C )(resid 104 and name N )
(resid 104 and name CA )(resid 104 and name C ) 10 -105 55 2
assign (resid 104 and name N )(resid 104 and name CA )
(resid 104 and name CB )(resid 104 and name CG ) 10 -120 90 2
assign (resid 104 and name CA )(resid 104 and name CB )
(resid 104 and name CG )(resid 104 and name ND1 ) 10 0 120 2
assign (resid 104 and name CA )(resid 104 and name CB )
(resid 104 and name CG )(resid 104 and name ND1 ) 10 180 120 2
!! Nomenclature n= 17
assign (resid 26 and name CB )(resid 26 and name CG )
(resid 26 and name CD )(resid 26 and name OE1 ) 10 0 90 2
assign (resid 33 and name CA )(resid 33 and name CB )
(resid 33 and name CG )(resid 33 and name OD1 ) 10 0 90 2
assign (resid 34 and name CA )(resid 34 and name CB )
(resid 34 and name CG )(resid 34 and name CD1 ) 10 0 90 2
assign (resid 37 and name CA )(resid 37 and name CB )
(resid 37 and name CG )(resid 37 and name CD1 ) 10 0 90 2
assign (resid 40 and name CB )(resid 40 and name CG )
(resid 40 and name CD )(resid 40 and name OE1 ) 10 0 90 2
assign (resid 44 and name CA )(resid 44 and name CB )
(resid 44 and name CG )(resid 44 and name OD1 ) 10 0 90 2
assign (resid 48 and name CB )(resid 48 and name CG )
(resid 48 and name CD )(resid 48 and name OE1 ) 10 0 90 2
assign (resid 55 and name CB )(resid 55 and name CG )
(resid 55 and name CD )(resid 55 and name OE1 ) 10 0 90 2
assign (resid 62 and name CA )(resid 62 and name CB )
(resid 62 and name CG )(resid 62 and name OD1 ) 10 0 90 2
assign (resid 66 and name CA )(resid 66 and name CB )
(resid 66 and name CG )(resid 66 and name CD1 ) 10 0 90 2
assign (resid 69 and name CA )(resid 69 and name CB )
(resid 69 and name CG )(resid 69 and name CD1 ) 10 0 90 2
assign (resid 74 and name CA )(resid 74 and name CB )
(resid 74 and name CG )(resid 74 and name OD1 ) 10 0 90 2
assign (resid 79 and name CA )(resid 79 and name CB )
(resid 79 and name CG )(resid 79 and name OD1 ) 10 0 90 2
assign (resid 91 and name CB )(resid 91 and name CG )
(resid 91 and name CD )(resid 91 and name OE1 ) 10 0 90 2
assign (resid 94 and name CB )(resid 94 and name CG )
(resid 94 and name CD )(resid 94 and name OE1 ) 10 0 90 2
assign (resid 95 and name CB )(resid 95 and name CG )
(resid 95 and name CD )(resid 95 and name OE1 ) 10 0 90 2
assign (resid 98 and name CB )(resid 98 and name CG )
(resid 98 and name CD )(resid 98 and name OE1 ) 10 0 90 2
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