NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
|
|
1499 |
1ao8   |
cing | 1-original | 3 | XPLOR/CNS | dihedral angle |
! dihedral angle restraints
!
! phi restraints
!
assign (resid 1 and name c ) (resid 2 and name n )
(resid 2 and name ca ) (resid 2 and name c ) 1.0 -120.0 50.0 2
assign (resid 2 and name c ) (resid 3 and name n )
(resid 3 and name ca ) (resid 3 and name c ) 1.0 -120.0 50.0 2
assign (resid 3 and name c ) (resid 4 and name n )
(resid 4 and name ca ) (resid 4 and name c ) 1.0 -144.0 30.0 2
assign (resid 4 and name c ) (resid 5 and name n )
(resid 5 and name ca ) (resid 5 and name c ) 1.0 -156.0 30.0 2
assign (resid 5 and name c ) (resid 6 and name n )
(resid 6 and name ca ) (resid 6 and name c ) 1.0 -120.0 30.0 2
assign (resid 6 and name c ) (resid 7 and name n )
(resid 7 and name ca ) (resid 7 and name c ) 1.0 -120.0 50.0 2
assign (resid 7 and name c ) (resid 8 and name n )
(resid 8 and name ca ) (resid 8 and name c ) 1.0 -117.0 30.0 2
assign (resid 10 and name c ) (resid 11 and name n )
(resid 11 and name ca ) (resid 11 and name c ) 1.0 96.0 40.0 2
assign (resid 11 and name c ) (resid 12 and name n )
(resid 12 and name ca ) (resid 12 and name c ) 1.0 -69.0 30.0 2
assign (resid 12 and name c ) (resid 13 and name n )
(resid 13 and name ca ) (resid 13 and name c ) 1.0 -120.0 30.0 2
assign (resid 14 and name c ) (resid 15 and name n )
(resid 15 and name ca ) (resid 15 and name c ) 1.0 -150.0 30.0 2
assign (resid 15 and name c ) (resid 16 and name n )
(resid 16 and name ca ) (resid 16 and name c ) 1.0 60.0 30.0 2
assign (resid 16 and name c ) (resid 17 and name n )
(resid 17 and name ca ) (resid 17 and name c ) 1.0 60.0 50.0 2
assign (resid 17 and name c ) (resid 18 and name n )
(resid 18 and name ca ) (resid 18 and name c ) 1.0 -120.0 30.0 2
assign (resid 20 and name c ) (resid 21 and name n )
(resid 21 and name ca ) (resid 21 and name c ) 1.0 -96.0 30.0 2
assign (resid 21 and name c ) (resid 22 and name n )
(resid 22 and name ca ) (resid 22 and name c ) 1.0 -130.0 30.0 2
assign (resid 22 and name c ) (resid 23 and name n )
(resid 23 and name ca ) (resid 23 and name c ) 1.0 -144.0 30.0 2
assign (resid 24 and name c ) (resid 25 and name n )
(resid 25 and name ca ) (resid 25 and name c ) 1.0 -51.0 50.0 2
assign (resid 25 and name c ) (resid 26 and name n )
(resid 26 and name ca ) (resid 26 and name c ) 1.0 -87.0 40.0 2
assign (resid 26 and name c ) (resid 27 and name n )
(resid 27 and name ca ) (resid 27 and name c ) 1.0 -66.0 30.0 2
assign (resid 27 and name c ) (resid 28 and name n )
(resid 28 and name ca ) (resid 28 and name c ) 1.0 -60.0 30.0 2
assign (resid 28 and name c ) (resid 29 and name n )
(resid 29 and name ca ) (resid 29 and name c ) 1.0 -66.0 30.0 2
assign (resid 29 and name c ) (resid 30 and name n )
(resid 30 and name ca ) (resid 30 and name c ) 1.0 -54.0 50.0 2
assign (resid 30 and name c ) (resid 31 and name n )
(resid 31 and name ca ) (resid 31 and name c ) 1.0 -57.0 50.0 2
assign (resid 31 and name c ) (resid 32 and name n )
(resid 32 and name ca ) (resid 32 and name c ) 1.0 -57.0 50.0 2
assign (resid 32 and name c ) (resid 33 and name n )
(resid 33 and name ca ) (resid 33 and name c ) 1.0 -78.0 50.0 2
assign (resid 33 and name c ) (resid 34 and name n )
(resid 34 and name ca ) (resid 34 and name c ) 1.0 -120.0 30.0 2
assign (resid 34 and name c ) (resid 35 and name n )
(resid 35 and name ca ) (resid 35 and name c ) 1.0 -57.0 30.0 2
assign (resid 37 and name c ) (resid 38 and name n )
(resid 38 and name ca ) (resid 38 and name c ) 1.0 -120.0 50.0 2
assign (resid 38 and name c ) (resid 39 and name n )
(resid 39 and name ca ) (resid 39 and name c ) 1.0 -93.0 50.0 2
assign (resid 39 and name c ) (resid 40 and name n )
(resid 40 and name ca ) (resid 40 and name c ) 1.0 -120.0 30.0 2
assign (resid 40 and name c ) (resid 41 and name n )
(resid 41 and name ca ) (resid 41 and name c ) 1.0 -111.0 50.0 2
assign (resid 42 and name c ) (resid 43 and name n )
(resid 43 and name ca ) (resid 43 and name c ) 1.0 -57.0 50.0 2
assign (resid 43 and name c ) (resid 44 and name n )
(resid 44 and name ca ) (resid 44 and name c ) 1.0 -69.0 30.0 2
assign (resid 44 and name c ) (resid 45 and name n )
(resid 45 and name ca ) (resid 45 and name c ) 1.0 -69.0 30.0 2
assign (resid 45 and name c ) (resid 46 and name n )
(resid 46 and name ca ) (resid 46 and name c ) 1.0 -51.0 30.0 2
assign (resid 46 and name c ) (resid 47 and name n )
(resid 47 and name ca ) (resid 47 and name c ) 1.0 -75.0 30.0 2
assign (resid 47 and name c ) (resid 48 and name n )
(resid 48 and name ca ) (resid 48 and name c ) 1.0 -93.0 30.0 2
assign (resid 48 and name c ) (resid 49 and name n )
(resid 49 and name ca ) (resid 49 and name c ) 1.0 -66.0 50.0 2
assign (resid 50 and name c ) (resid 51 and name n )
(resid 51 and name ca ) (resid 51 and name c ) 1.0 -120.0 30.0 2
assign (resid 51 and name c ) (resid 52 and name n )
(resid 52 and name ca ) (resid 52 and name c ) 1.0 -120.0 50.0 2
assign (resid 53 and name c ) (resid 54 and name n )
(resid 54 and name ca ) (resid 54 and name c ) 1.0 -78.0 50.0 2
assign (resid 55 and name c ) (resid 56 and name n )
(resid 56 and name ca ) (resid 56 and name c ) 1.0 60.0 30.0 2
assign (resid 56 and name c ) (resid 57 and name n )
(resid 57 and name ca ) (resid 57 and name c ) 1.0 -168.0 30.0 2
assign (resid 57 and name c ) (resid 58 and name n )
(resid 58 and name ca ) (resid 58 and name c ) 1.0 -108.0 50.0 2
assign (resid 58 and name c ) (resid 59 and name n )
(resid 59 and name ca ) (resid 59 and name c ) 1.0 -120.0 50.0 2
assign (resid 59 and name c ) (resid 60 and name n )
(resid 60 and name ca ) (resid 60 and name c ) 1.0 -120.0 30.0 2
assign (resid 60 and name c ) (resid 61 and name n )
(resid 61 and name ca ) (resid 61 and name c ) 1.0 -120.0 50.0 2
assign (resid 61 and name c ) (resid 62 and name n )
(resid 62 and name ca ) (resid 62 and name c ) 1.0 -120.0 30.0 2
assign (resid 62 and name c ) (resid 63 and name n )
(resid 63 and name ca ) (resid 63 and name c ) 1.0 -126.0 30.0 2
assign (resid 64 and name c ) (resid 65 and name n )
(resid 65 and name ca ) (resid 65 and name c ) 1.0 -120.0 30.0 2
assign (resid 66 and name c ) (resid 67 and name n )
(resid 67 and name ca ) (resid 67 and name c ) 1.0 -135.0 30.0 2
assign (resid 67 and name c ) (resid 68 and name n )
(resid 68 and name ca ) (resid 68 and name c ) 1.0 -63.0 30.0 2
assign (resid 68 and name c ) (resid 69 and name n )
(resid 69 and name ca ) (resid 69 and name c ) 1.0 -117.0 30.0 2
assign (resid 70 and name c ) (resid 71 and name n )
(resid 71 and name ca ) (resid 71 and name c ) 1.0 -54.0 50.0 2
assign (resid 71 and name c ) (resid 72 and name n )
(resid 72 and name ca ) (resid 72 and name c ) 1.0 111.0 50.0 2
assign (resid 72 and name c ) (resid 73 and name n )
(resid 73 and name ca ) (resid 73 and name c ) 1.0 -120.0 50.0 2
assign (resid 73 and name c ) (resid 74 and name n )
(resid 74 and name ca ) (resid 74 and name c ) 1.0 -120.0 50.0 2
assign (resid 74 and name c ) (resid 75 and name n )
(resid 75 and name ca ) (resid 75 and name c ) 1.0 -120.0 50.0 2
assign (resid 75 and name c ) (resid 76 and name n )
(resid 76 and name ca ) (resid 76 and name c ) 1.0 -117.0 50.0 2
assign (resid 76 and name c ) (resid 77 and name n )
(resid 77 and name ca ) (resid 77 and name c ) 1.0 -120.0 30.0 2
assign (resid 77 and name c ) (resid 78 and name n )
(resid 78 and name ca ) (resid 78 and name c ) 1.0 -165.0 30.0 2
assign (resid 79 and name c ) (resid 80 and name n )
(resid 80 and name ca ) (resid 80 and name c ) 1.0 -57.0 30.0 2
assign (resid 80 and name c ) (resid 81 and name n )
(resid 81 and name ca ) (resid 81 and name c ) 1.0 -63.0 30.0 2
assign (resid 81 and name c ) (resid 82 and name n )
(resid 82 and name ca ) (resid 82 and name c ) 1.0 -78.0 30.0 2
assign (resid 82 and name c ) (resid 83 and name n )
(resid 83 and name ca ) (resid 83 and name c ) 1.0 -63.0 30.0 2
assign (resid 83 and name c ) (resid 84 and name n )
(resid 84 and name ca ) (resid 84 and name c ) 1.0 -63.0 30.0 2
assign (resid 84 and name c ) (resid 85 and name n )
(resid 85 and name ca ) (resid 85 and name c ) 1.0 -69.0 30.0 2
assign (resid 85 and name c ) (resid 86 and name n )
(resid 86 and name ca ) (resid 86 and name c ) 1.0 -57.0 30.0 2
assign (resid 86 and name c ) (resid 87 and name n )
(resid 87 and name ca ) (resid 87 and name c ) 1.0 -63.0 30.0 2
assign (resid 87 and name c ) (resid 88 and name n )
(resid 88 and name ca ) (resid 88 and name c ) 1.0 -84.0 30.0 2
assign (resid 88 and name c ) (resid 89 and name n )
(resid 89 and name ca ) (resid 89 and name c ) 1.0 -120.0 50.0 2
assign (resid 90 and name c ) (resid 91 and name n )
(resid 91 and name ca ) (resid 91 and name c ) 1.0 -90.0 30.0 2
assign (resid 91 and name c ) (resid 92 and name n )
(resid 92 and name ca ) (resid 92 and name c ) 1.0 -120.0 30.0 2
assign (resid 92 and name c ) (resid 93 and name n )
(resid 93 and name ca ) (resid 93 and name c ) 1.0 -120.0 30.0 2
assign (resid 93 and name c ) (resid 94 and name n )
(resid 94 and name ca ) (resid 94 and name c ) 1.0 -120.0 50.0 2
assign (resid 94 and name c ) (resid 95 and name n )
(resid 95 and name ca ) (resid 95 and name c ) 1.0 -117.0 30.0 2
assign (resid 96 and name c ) (resid 97 and name n )
(resid 97 and name ca ) (resid 97 and name c ) 1.0 -120.0 50.0 2
assign (resid 99 and name c ) (resid 100 and name n )
(resid 100 and name ca ) (resid 100 and name c ) 1.0 -48.0 40.0 2
assign (resid 100 and name c ) (resid 101 and name n )
(resid 101 and name ca ) (resid 101 and name c ) 1.0 -69.0 30.0 2
assign (resid 101 and name c ) (resid 102 and name n )
(resid 102 and name ca ) (resid 102 and name c ) 1.0 -87.0 30.0 2
assign (resid 102 and name c ) (resid 103 and name n )
(resid 103 and name ca ) (resid 103 and name c ) 1.0 -60.0 30.0 2
assign (resid 103 and name c ) (resid 104 and name n )
(resid 104 and name ca ) (resid 104 and name c ) 1.0 -57.0 50.0 2
assign (resid 104 and name c ) (resid 105 and name n )
(resid 105 and name ca ) (resid 105 and name c ) 1.0 -63.0 30.0 2
assign (resid 105 and name c ) (resid 106 and name n )
(resid 106 and name ca ) (resid 106 and name c ) 1.0 -120.0 30.0 2
assign (resid 106 and name c ) (resid 107 and name n )
(resid 107 and name ca ) (resid 107 and name c ) 1.0 -48.0 50.0 2
assign (resid 107 and name c ) (resid 108 and name n )
(resid 108 and name ca ) (resid 108 and name c ) 1.0 -90.0 30.0 2
assign (resid 110 and name c ) (resid 111 and name n )
(resid 111 and name ca ) (resid 111 and name c ) 1.0 -111.0 30.0 2
assign (resid 111 and name c ) (resid 112 and name n )
(resid 112 and name ca ) (resid 112 and name c ) 1.0 -120.0 50.0 2
assign (resid 112 and name c ) (resid 113 and name n )
(resid 113 and name ca ) (resid 113 and name c ) 1.0 -120.0 30.0 2
assign (resid 113 and name c ) (resid 114 and name n )
(resid 114 and name ca ) (resid 114 and name c ) 1.0 -120.0 50.0 2
assign (resid 114 and name c ) (resid 115 and name n )
(resid 115 and name ca ) (resid 115 and name c ) 1.0 -120.0 30.0 2
assign (resid 115 and name c ) (resid 116 and name n )
(resid 116 and name ca ) (resid 116 and name c ) 1.0 -120.0 30.0 2
assign (resid 116 and name c ) (resid 117 and name n )
(resid 117 and name ca ) (resid 117 and name c ) 1.0 -120.0 50.0 2
assign (resid 117 and name c ) (resid 118 and name n )
(resid 118 and name ca ) (resid 118 and name c ) 1.0 -84.0 30.0 2
assign (resid 119 and name c ) (resid 120 and name n )
(resid 120 and name ca ) (resid 120 and name c ) 1.0 -78.0 50.0 2
assign (resid 120 and name c ) (resid 121 and name n )
(resid 121 and name ca ) (resid 121 and name c ) 1.0 -120.0 50.0 2
assign (resid 121 and name c ) (resid 122 and name n )
(resid 122 and name ca ) (resid 122 and name c ) 1.0 -120.0 30.0 2
assign (resid 122 and name c ) (resid 123 and name n )
(resid 123 and name ca ) (resid 123 and name c ) 1.0 -120.0 40.0 2
assign (resid 123 and name c ) (resid 124 and name n )
(resid 124 and name ca ) (resid 124 and name c ) 1.0 -180.0 30.0 2
assign (resid 124 and name c ) (resid 125 and name n )
(resid 125 and name ca ) (resid 125 and name c ) 1.0 -120.0 30.0 2
assign (resid 125 and name c ) (resid 126 and name n )
(resid 126 and name ca ) (resid 126 and name c ) 1.0 -111.0 40.0 2
assign (resid 126 and name c ) (resid 127 and name n )
(resid 127 and name ca ) (resid 127 and name c ) 1.0 -120.0 30.0 2
assign (resid 127 and name c ) (resid 128 and name n )
(resid 128 and name ca ) (resid 128 and name c ) 1.0 -63.0 50.0 2
assign (resid 128 and name c ) (resid 129 and name n )
(resid 129 and name ca ) (resid 129 and name c ) 1.0 -69.0 50.0 2
assign (resid 130 and name c ) (resid 131 and name n )
(resid 131 and name ca ) (resid 131 and name c ) 1.0 -120.0 30.0 2
assign (resid 131 and name c ) (resid 132 and name n )
(resid 132 and name ca ) (resid 132 and name c ) 1.0 -114.0 50.0 2
assign (resid 132 and name c ) (resid 133 and name n )
(resid 133 and name ca ) (resid 133 and name c ) 1.0 -57.0 50.0 2
assign (resid 133 and name c ) (resid 134 and name n )
(resid 134 and name ca ) (resid 134 and name c ) 1.0 -75.0 30.0 2
assign (resid 134 and name c ) (resid 135 and name n )
(resid 135 and name ca ) (resid 135 and name c ) 1.0 -102.0 30.0 2
assign (resid 135 and name c ) (resid 136 and name n )
(resid 136 and name ca ) (resid 136 and name c ) 1.0 -120.0 50.0 2
assign (resid 136 and name c ) (resid 137 and name n )
(resid 137 and name ca ) (resid 137 and name c ) 1.0 -120.0 30.0 2
assign (resid 137 and name c ) (resid 138 and name n )
(resid 138 and name ca ) (resid 138 and name c ) 1.0 -87.0 30.0 2
assign (resid 138 and name c ) (resid 139 and name n )
(resid 139 and name ca ) (resid 139 and name c ) 1.0 -99.0 30.0 2
assign (resid 139 and name c ) (resid 140 and name n )
(resid 140 and name ca ) (resid 140 and name c ) 1.0 -120.0 30.0 2
assign (resid 140 and name c ) (resid 141 and name n )
(resid 141 and name ca ) (resid 141 and name c ) 1.0 -120.0 50.0 2
assign (resid 141 and name c ) (resid 142 and name n )
(resid 142 and name ca ) (resid 142 and name c ) 1.0 -120.0 50.0 2
assign (resid 142 and name c ) (resid 143 and name n )
(resid 143 and name ca ) (resid 143 and name c ) 1.0 -90.0 30.0 2
assign (resid 143 and name c ) (resid 144 and name n )
(resid 144 and name ca ) (resid 144 and name c ) 1.0 -120.0 50.0 2
assign (resid 145 and name c ) (resid 146 and name n )
(resid 146 and name ca ) (resid 146 and name c ) 1.0 -132.0 50.0 2
assign (resid 146 and name c ) (resid 147 and name n )
(resid 147 and name ca ) (resid 147 and name c ) 1.0 -81.0 30.0 2
assign (resid 149 and name c ) (resid 150 and name n )
(resid 150 and name ca ) (resid 150 and name c ) 1.0 -75.0 30.0 2
assign (resid 151 and name c ) (resid 152 and name n )
(resid 152 and name ca ) (resid 152 and name c ) 1.0 -63.0 30.0 2
assign (resid 152 and name c ) (resid 153 and name n )
(resid 153 and name ca ) (resid 153 and name c ) 1.0 -141.0 30.0 2
assign (resid 153 and name c ) (resid 154 and name n )
(resid 154 and name ca ) (resid 154 and name c ) 1.0 -120.0 30.0 2
assign (resid 155 and name c ) (resid 156 and name n )
(resid 156 and name ca ) (resid 156 and name c ) 1.0 -120.0 30.0 2
assign (resid 156 and name c ) (resid 157 and name n )
(resid 157 and name ca ) (resid 157 and name c ) 1.0 -120.0 30.0 2
assign (resid 157 and name c ) (resid 158 and name n )
(resid 158 and name ca ) (resid 158 and name c ) 1.0 -120.0 50.0 2
assign (resid 158 and name c ) (resid 159 and name n )
(resid 159 and name ca ) (resid 159 and name c ) 1.0 -120.0 30.0 2
assign (resid 159 and name c ) (resid 160 and name n )
(resid 160 and name ca ) (resid 160 and name c ) 1.0 -63.0 30.0 2
assign (resid 160 and name c ) (resid 161 and name n )
(resid 161 and name ca ) (resid 161 and name c ) 1.0 -78.0 30.0 2
!
! psi
!
assign (resid 4 and name n ) (resid 4 and name ca )
(resid 4 and name c ) (resid 5 and name n ) 1.0 120.0 50.0 2
assign (resid 5 and name n ) (resid 5 and name ca )
(resid 5 and name c ) (resid 6 and name n ) 1.0 120.0 50.0 2
assign (resid 6 and name n ) (resid 6 and name ca )
(resid 6 and name c ) (resid 7 and name n ) 1.0 111.0 50.0 2
assign (resid 8 and name n ) (resid 8 and name ca )
(resid 8 and name c ) (resid 9 and name n ) 1.0 180.0 50.0 2
assign (resid 9 and name n ) (resid 9 and name ca )
(resid 9 and name c ) (resid 10 and name n ) 1.0 -57.0 50.0 2
assign (resid 11 and name n ) (resid 11 and name ca )
(resid 11 and name c ) (resid 12 and name n ) 1.0 0.0 50.0 2
assign (resid 12 and name n ) (resid 12 and name ca )
(resid 12 and name c ) (resid 13 and name n ) 1.0 165.0 50.0 2
assign (resid 13 and name n ) (resid 13 and name ca )
(resid 13 and name c ) (resid 14 and name n ) 1.0 -18.0 50.0 2
assign (resid 14 and name n ) (resid 14 and name ca )
(resid 14 and name c ) (resid 15 and name n ) 1.0 180.0 50.0 2
assign (resid 15 and name n ) (resid 15 and name ca )
(resid 15 and name c ) (resid 16 and name n ) 1.0 123.0 50.0 2
assign (resid 16 and name n ) (resid 16 and name ca )
(resid 16 and name c ) (resid 17 and name n ) 1.0 60.0 50.0 2
assign (resid 17 and name n ) (resid 17 and name ca )
(resid 17 and name c ) (resid 18 and name n ) 1.0 6.0 50.0 2
assign (resid 22 and name n ) (resid 22 and name ca )
(resid 22 and name c ) (resid 23 and name n ) 1.0 135.0 50.0 2
assign (resid 25 and name n ) (resid 25 and name ca )
(resid 25 and name c ) (resid 26 and name n ) 1.0 -69.0 50.0 2
assign (resid 26 and name n ) (resid 26 and name ca )
(resid 26 and name c ) (resid 27 and name n ) 1.0 -48.0 50.0 2
assign (resid 27 and name n ) (resid 27 and name ca )
(resid 27 and name c ) (resid 28 and name n ) 1.0 -36.0 50.0 2
assign (resid 28 and name n ) (resid 28 and name ca )
(resid 28 and name c ) (resid 29 and name n ) 1.0 -57.0 50.0 2
assign (resid 29 and name n ) (resid 29 and name ca )
(resid 29 and name c ) (resid 30 and name n ) 1.0 -51.0 50.0 2
assign (resid 30 and name n ) (resid 30 and name ca )
(resid 30 and name c ) (resid 31 and name n ) 1.0 -63.0 50.0 2
assign (resid 31 and name n ) (resid 31 and name ca )
(resid 31 and name c ) (resid 32 and name n ) 1.0 -57.0 50.0 2
assign (resid 32 and name n ) (resid 32 and name ca )
(resid 32 and name c ) (resid 33 and name n ) 1.0 -45.0 50.0 2
assign (resid 34 and name n ) (resid 34 and name ca )
(resid 34 and name c ) (resid 35 and name n ) 1.0 -18.0 50.0 2
assign (resid 35 and name n ) (resid 35 and name ca )
(resid 35 and name c ) (resid 36 and name n ) 1.0 150.0 50.0 2
assign (resid 36 and name n ) (resid 36 and name ca )
(resid 36 and name c ) (resid 37 and name n ) 1.0 0.0 50.0 2
assign (resid 37 and name n ) (resid 37 and name ca )
(resid 37 and name c ) (resid 38 and name n ) 1.0 -129.0 50.0 2
assign (resid 38 and name n ) (resid 38 and name ca )
(resid 38 and name c ) (resid 39 and name n ) 1.0 117.0 50.0 2
assign (resid 39 and name n ) (resid 39 and name ca )
(resid 39 and name c ) (resid 40 and name n ) 1.0 117.0 50.0 2
assign (resid 40 and name n ) (resid 40 and name ca )
(resid 40 and name c ) (resid 41 and name n ) 1.0 135.0 50.0 2
assign (resid 41 and name n ) (resid 41 and name ca )
(resid 41 and name c ) (resid 42 and name n ) 1.0 162.0 50.0 2
assign (resid 42 and name n ) (resid 42 and name ca )
(resid 42 and name c ) (resid 43 and name n ) 1.0 -120.0 50.0 2
assign (resid 43 and name n ) (resid 43 and name ca )
(resid 43 and name c ) (resid 44 and name n ) 1.0 -39.0 50.0 2
assign (resid 44 and name n ) (resid 44 and name ca )
(resid 44 and name c ) (resid 45 and name n ) 1.0 -60.0 50.0 2
assign (resid 45 and name n ) (resid 45 and name ca )
(resid 45 and name c ) (resid 46 and name n ) 1.0 -57.0 50.0 2
assign (resid 46 and name n ) (resid 46 and name ca )
(resid 46 and name c ) (resid 47 and name n ) 1.0 -60.0 50.0 2
assign (resid 47 and name n ) (resid 47 and name ca )
(resid 47 and name c ) (resid 48 and name n ) 1.0 -48.0 50.0 2
assign (resid 48 and name n ) (resid 48 and name ca )
(resid 48 and name c ) (resid 49 and name n ) 1.0 -24.0 50.0 2
assign (resid 51 and name n ) (resid 51 and name ca )
(resid 51 and name c ) (resid 52 and name n ) 1.0 141.0 50.0 2
assign (resid 52 and name n ) (resid 52 and name ca )
(resid 52 and name c ) (resid 53 and name n ) 1.0 144.0 50.0 2
assign (resid 55 and name n ) (resid 55 and name ca )
(resid 55 and name c ) (resid 56 and name n ) 1.0 144.0 50.0 2
assign (resid 56 and name n ) (resid 56 and name ca )
(resid 56 and name c ) (resid 57 and name n ) 1.0 39.0 50.0 2
assign (resid 57 and name n ) (resid 57 and name ca )
(resid 57 and name c ) (resid 58 and name n ) 1.0 159.0 50.0 2
assign (resid 58 and name n ) (resid 58 and name ca )
(resid 58 and name c ) (resid 59 and name n ) 1.0 138.0 50.0 2
assign (resid 59 and name n ) (resid 59 and name ca )
(resid 59 and name c ) (resid 60 and name n ) 1.0 117.0 50.0 2
assign (resid 60 and name n ) (resid 60 and name ca )
(resid 60 and name c ) (resid 61 and name n ) 1.0 120.0 50.0 2
assign (resid 61 and name n ) (resid 61 and name ca )
(resid 61 and name c ) (resid 62 and name n ) 1.0 123.0 50.0 2
assign (resid 62 and name n ) (resid 62 and name ca )
(resid 62 and name c ) (resid 63 and name n ) 1.0 123.0 50.0 2
assign (resid 65 and name n ) (resid 65 and name ca )
(resid 65 and name c ) (resid 66 and name n ) 1.0 141.0 50.0 2
assign (resid 66 and name n ) (resid 66 and name ca )
(resid 66 and name c ) (resid 67 and name n ) 1.0 45.0 50.0 2
assign (resid 68 and name n ) (resid 68 and name ca )
(resid 68 and name c ) (resid 69 and name n ) 1.0 123.0 50.0 2
assign (resid 70 and name n ) (resid 70 and name ca )
(resid 70 and name c ) (resid 71 and name n ) 1.0 102.0 50.0 2
assign (resid 71 and name n ) (resid 71 and name ca )
(resid 71 and name c ) (resid 72 and name n ) 1.0 117.0 50.0 2
assign (resid 72 and name n ) (resid 72 and name ca )
(resid 72 and name c ) (resid 73 and name n ) 1.0 -39.0 50.0 2
assign (resid 73 and name n ) (resid 73 and name ca )
(resid 73 and name c ) (resid 74 and name n ) 1.0 144.0 50.0 2
assign (resid 74 and name n ) (resid 74 and name ca )
(resid 74 and name c ) (resid 75 and name n ) 1.0 111.0 50.0 2
assign (resid 75 and name n ) (resid 75 and name ca )
(resid 75 and name c ) (resid 76 and name n ) 1.0 120.0 50.0 2
assign (resid 76 and name n ) (resid 76 and name ca )
(resid 76 and name c ) (resid 77 and name n ) 1.0 159.0 50.0 2
assign (resid 77 and name n ) (resid 77 and name ca )
(resid 77 and name c ) (resid 78 and name n ) 1.0 30.0 50.0 2
assign (resid 80 and name n ) (resid 80 and name ca )
(resid 80 and name c ) (resid 81 and name n ) 1.0 -45.0 50.0 2
assign (resid 81 and name n ) (resid 81 and name ca )
(resid 81 and name c ) (resid 82 and name n ) 1.0 -45.0 50.0 2
assign (resid 82 and name n ) (resid 82 and name ca )
(resid 82 and name c ) (resid 83 and name n ) 1.0 -45.0 50.0 2
assign (resid 83 and name n ) (resid 83 and name ca )
(resid 83 and name c ) (resid 84 and name n ) 1.0 -39.0 50.0 2
assign (resid 84 and name n ) (resid 84 and name ca )
(resid 84 and name c ) (resid 85 and name n ) 1.0 -45.0 50.0 2
assign (resid 85 and name n ) (resid 85 and name ca )
(resid 85 and name c ) (resid 86 and name n ) 1.0 -39.0 50.0 2
assign (resid 86 and name n ) (resid 86 and name ca )
(resid 86 and name c ) (resid 87 and name n ) 1.0 -45.0 50.0 2
assign (resid 87 and name n ) (resid 87 and name ca )
(resid 87 and name c ) (resid 88 and name n ) 1.0 -51.0 50.0 2
assign (resid 88 and name n ) (resid 88 and name ca )
(resid 88 and name c ) (resid 89 and name n ) 1.0 9.0 50.0 2
assign (resid 91 and name n ) (resid 91 and name ca )
(resid 91 and name c ) (resid 92 and name n ) 1.0 -24.0 50.0 2
assign (resid 92 and name n ) (resid 92 and name ca )
(resid 92 and name c ) (resid 93 and name n ) 1.0 111.0 50.0 2
assign (resid 93 and name n ) (resid 93 and name ca )
(resid 93 and name c ) (resid 94 and name n ) 1.0 168.0 50.0 2
assign (resid 94 and name n ) (resid 94 and name ca )
(resid 94 and name c ) (resid 95 and name n ) 1.0 114.0 50.0 2
assign (resid 95 and name n ) (resid 95 and name ca )
(resid 95 and name c ) (resid 96 and name n ) 1.0 123.0 50.0 2
assign (resid 96 and name n ) (resid 96 and name ca )
(resid 96 and name c ) (resid 97 and name n ) 1.0 120.0 50.0 2
assign (resid 97 and name n ) (resid 97 and name ca )
(resid 97 and name c ) (resid 98 and name n ) 1.0 -60.0 50.0 2
assign (resid 100 and name n ) (resid 100 and name ca )
(resid 100 and name c ) (resid 101 and name n ) 1.0 -36.0 50.0 2
assign (resid 101 and name n ) (resid 101 and name ca )
(resid 101 and name c ) (resid 102 and name n ) 1.0 -42.0 50.0 2
assign (resid 102 and name n ) (resid 102 and name ca )
(resid 102 and name c ) (resid 103 and name n ) 1.0 -60.0 50.0 2
assign (resid 103 and name n ) (resid 103 and name ca )
(resid 103 and name c ) (resid 104 and name n ) 1.0 -60.0 50.0 2
assign (resid 104 and name n ) (resid 104 and name ca )
(resid 104 and name c ) (resid 105 and name n ) 1.0 -54.0 50.0 2
assign (resid 105 and name n ) (resid 105 and name ca )
(resid 105 and name c ) (resid 106 and name n ) 1.0 -45.0 50.0 2
assign (resid 106 and name n ) (resid 106 and name ca )
(resid 106 and name c ) (resid 107 and name n ) 1.0 36.0 50.0 2
assign (resid 107 and name n ) (resid 107 and name ca )
(resid 107 and name c ) (resid 108 and name n ) 1.0 -30.0 40.0 2
assign (resid 108 and name n ) (resid 108 and name ca )
(resid 108 and name c ) (resid 109 and name n ) 1.0 3.0 50.0 2
assign (resid 109 and name n ) (resid 109 and name ca )
(resid 109 and name c ) (resid 110 and name n ) 1.0 27.0 50.0 2
assign (resid 110 and name n ) (resid 110 and name ca )
(resid 110 and name c ) (resid 111 and name n ) 1.0 120.0 50.0 2
assign (resid 111 and name n ) (resid 111 and name ca )
(resid 111 and name c ) (resid 112 and name n ) 1.0 -27.0 50.0 2
assign (resid 112 and name n ) (resid 112 and name ca )
(resid 112 and name c ) (resid 113 and name n ) 1.0 141.0 50.0 2
assign (resid 113 and name n ) (resid 113 and name ca )
(resid 113 and name c ) (resid 114 and name n ) 1.0 120.0 50.0 2
assign (resid 114 and name n ) (resid 114 and name ca )
(resid 114 and name c ) (resid 115 and name n ) 1.0 120.0 50.0 2
assign (resid 115 and name n ) (resid 115 and name ca )
(resid 115 and name c ) (resid 116 and name n ) 1.0 156.0 50.0 2
assign (resid 116 and name n ) (resid 116 and name ca )
(resid 116 and name c ) (resid 117 and name n ) 1.0 144.0 50.0 2
assign (resid 117 and name n ) (resid 117 and name ca )
(resid 117 and name c ) (resid 118 and name n ) 1.0 138.0 50.0 2
assign (resid 118 and name n ) (resid 118 and name ca )
(resid 118 and name c ) (resid 119 and name n ) 1.0 144.0 50.0 2
assign (resid 120 and name n ) (resid 120 and name ca )
(resid 120 and name c ) (resid 121 and name n ) 1.0 162.0 50.0 2
assign (resid 121 and name n ) (resid 121 and name ca )
(resid 121 and name c ) (resid 122 and name n ) 1.0 120.0 50.0 2
assign (resid 122 and name n ) (resid 122 and name ca )
(resid 122 and name c ) (resid 123 and name n ) 1.0 120.0 50.0 2
assign (resid 123 and name n ) (resid 123 and name ca )
(resid 123 and name c ) (resid 124 and name n ) 1.0 120.0 50.0 2
assign (resid 124 and name n ) (resid 124 and name ca )
(resid 124 and name c ) (resid 125 and name n ) 1.0 180.0 50.0 2
assign (resid 125 and name n ) (resid 125 and name ca )
(resid 125 and name c ) (resid 126 and name n ) 1.0 -21.0 50.0 2
assign (resid 126 and name n ) (resid 126 and name ca )
(resid 126 and name c ) (resid 127 and name n ) 1.0 120.0 50.0 2
assign (resid 127 and name n ) (resid 127 and name ca )
(resid 127 and name c ) (resid 128 and name n ) 1.0 120.0 50.0 2
assign (resid 128 and name n ) (resid 128 and name ca )
(resid 128 and name c ) (resid 129 and name n ) 1.0 120.0 50.0 2
assign (resid 131 and name n ) (resid 131 and name ca )
(resid 131 and name c ) (resid 132 and name n ) 1.0 153.0 50.0 2
assign (resid 132 and name n ) (resid 132 and name ca )
(resid 132 and name c ) (resid 133 and name n ) 1.0 120.0 50.0 2
assign (resid 133 and name n ) (resid 133 and name ca )
(resid 133 and name c ) (resid 134 and name n ) 1.0 -42.0 50.0 2
assign (resid 134 and name n ) (resid 134 and name ca )
(resid 134 and name c ) (resid 135 and name n ) 1.0 -24.0 50.0 2
assign (resid 135 and name n ) (resid 135 and name ca )
(resid 135 and name c ) (resid 136 and name n ) 1.0 21.0 50.0 2
assign (resid 136 and name n ) (resid 136 and name ca )
(resid 136 and name c ) (resid 137 and name n ) 1.0 150.0 50.0 2
assign (resid 137 and name n ) (resid 137 and name ca )
(resid 137 and name c ) (resid 138 and name n ) 1.0 162.0 50.0 2
assign (resid 138 and name n ) (resid 138 and name ca )
(resid 138 and name c ) (resid 139 and name n ) 1.0 117.0 50.0 2
assign (resid 139 and name n ) (resid 139 and name ca )
(resid 139 and name c ) (resid 140 and name n ) 1.0 -57.0 50.0 2
assign (resid 140 and name n ) (resid 140 and name ca )
(resid 140 and name c ) (resid 141 and name n ) 1.0 159.0 50.0 2
assign (resid 141 and name n ) (resid 141 and name ca )
(resid 141 and name c ) (resid 142 and name n ) 1.0 120.0 50.0 2
assign (resid 142 and name n ) (resid 142 and name ca )
(resid 142 and name c ) (resid 143 and name n ) 1.0 120.0 50.0 2
assign (resid 144 and name n ) (resid 144 and name ca )
(resid 144 and name c ) (resid 145 and name n ) 1.0 120.0 50.0 2
assign (resid 145 and name n ) (resid 145 and name ca )
(resid 145 and name c ) (resid 146 and name n ) 1.0 120.0 50.0 2
assign (resid 147 and name n ) (resid 147 and name ca )
(resid 147 and name c ) (resid 148 and name n ) 1.0 -51.0 50.0 2
assign (resid 148 and name n ) (resid 148 and name ca )
(resid 148 and name c ) (resid 149 and name n ) 1.0 120.0 50.0 2
assign (resid 150 and name n ) (resid 150 and name ca )
(resid 150 and name c ) (resid 151 and name n ) 1.0 -15.0 50.0 2
assign (resid 151 and name n ) (resid 151 and name ca )
(resid 151 and name c ) (resid 152 and name n ) 1.0 9.0 50.0 2
assign (resid 152 and name n ) (resid 152 and name ca )
(resid 152 and name c ) (resid 153 and name n ) 1.0 120.0 50.0 2
assign (resid 153 and name n ) (resid 153 and name ca )
(resid 153 and name c ) (resid 154 and name n ) 1.0 168.0 50.0 2
assign (resid 154 and name n ) (resid 154 and name ca )
(resid 154 and name c ) (resid 155 and name n ) 1.0 132.0 50.0 2
assign (resid 155 and name n ) (resid 155 and name ca )
(resid 155 and name c ) (resid 156 and name n ) 1.0 120.0 50.0 2
assign (resid 156 and name n ) (resid 156 and name ca )
(resid 156 and name c ) (resid 157 and name n ) 1.0 123.0 50.0 2
assign (resid 157 and name n ) (resid 157 and name ca )
(resid 157 and name c ) (resid 158 and name n ) 1.0 123.0 50.0 2
assign (resid 158 and name n ) (resid 158 and name ca )
(resid 158 and name c ) (resid 159 and name n ) 1.0 114.0 50.0 2
assign (resid 159 and name n ) (resid 159 and name ca )
(resid 159 and name c ) (resid 160 and name n ) 1.0 144.0 50.0 2
assign (resid 160 and name n ) (resid 160 and name ca )
(resid 160 and name c ) (resid 161 and name n ) 1.0 120.0 50.0 2
!
! chi-1
!
assign (resid 3 and name n ) (resid 3 and name ca )
(resid 3 and name cb ) (resid 3 and name cg ) 1.0 -93.0 40.0 2
assign (resid 4 and name n ) (resid 4 and name ca )
(resid 4 and name cb ) (resid 4 and name cg ) 1.0 -153.0 40.0 2
assign (resid 5 and name n ) (resid 5 and name ca )
(resid 5 and name cb ) (resid 5 and name cg ) 1.0 60.0 40.0 2
assign (resid 7 and name n ) (resid 7 and name ca )
(resid 7 and name cb ) (resid 7 and name cg ) 1.0 60.0 40.0 2
assign (resid 8 and name n ) (resid 8 and name ca )
(resid 8 and name cb ) (resid 8 and name cg ) 1.0 63.0 40.0 2
assign (resid 9 and name n ) (resid 9 and name ca )
(resid 9 and name cb ) (resid 9 and name cg ) 1.0 42.0 40.0 2
assign (resid 10 and name n ) (resid 10 and name ca )
(resid 10 and name cb ) (resid 10 and name cg ) 1.0 -81.0 40.0 2
assign (resid 12 and name n ) (resid 12 and name ca )
(resid 12 and name cb ) (resid 12 and name cg ) 1.0 -165.0 40.0 2
assign (resid 13 and name n ) (resid 13 and name ca )
(resid 13 and name cb ) (resid 13 and name cg1) 1.0 51.0 40.0 2
assign (resid 15 and name n ) (resid 15 and name ca )
(resid 15 and name cb ) (resid 15 and name cg ) 1.0 180.0 40.0 2
assign (resid 16 and name n ) (resid 16 and name ca )
(resid 16 and name cb ) (resid 16 and name cg ) 1.0 -81.0 40.0 2
assign (resid 18 and name n ) (resid 18 and name ca )
(resid 18 and name cb ) (resid 18 and name cg ) 1.0 60.0 40.0 2
assign (resid 21 and name n ) (resid 21 and name ca )
(resid 21 and name cb ) (resid 21 and name cg ) 1.0 60.0 40.0 2
assign (resid 22 and name n ) (resid 22 and name ca )
(resid 22 and name cb ) (resid 22 and name cg ) 1.0 168.0 40.0 2
assign (resid 23 and name n ) (resid 23 and name ca )
(resid 23 and name cb ) (resid 23 and name cg ) 1.0 -162.0 40.0 2
assign (resid 25 and name n ) (resid 25 and name ca )
(resid 25 and name cb ) (resid 25 and name cg ) 1.0 -159.0 40.0 2
assign (resid 26 and name n ) (resid 26 and name ca )
(resid 26 and name cb ) (resid 26 and name cg ) 1.0 180.0 40.0 2
assign (resid 27 and name n ) (resid 27 and name ca )
(resid 27 and name cb ) (resid 27 and name cg ) 1.0 -75.0 40.0 2
assign (resid 28 and name n ) (resid 28 and name ca )
(resid 28 and name cb ) (resid 28 and name cg ) 1.0 -60.0 40.0 2
assign (resid 29 and name n ) (resid 29 and name ca )
(resid 29 and name cb ) (resid 29 and name cg ) 1.0 186.0 40.0 2
assign (resid 30 and name n ) (resid 30 and name ca )
(resid 30 and name cb ) (resid 30 and name cg ) 1.0 180.0 40.0 2
assign (resid 31 and name n ) (resid 31 and name ca )
(resid 31 and name cb ) (resid 31 and name cg ) 1.0 180.0 40.0 2
assign (resid 33 and name n ) (resid 33 and name ca )
(resid 33 and name cb ) (resid 33 and name cg ) 1.0 -75.0 40.0 2
assign (resid 34 and name n ) (resid 34 and name ca )
(resid 34 and name cb ) (resid 34 and name og1) 1.0 54.0 40.0 2
assign (resid 35 and name n ) (resid 35 and name ca )
(resid 35 and name cb ) (resid 35 and name cg1) 1.0 -60.0 40.0 2
assign (resid 37 and name n ) (resid 37 and name ca )
(resid 37 and name cb ) (resid 37 and name cg ) 1.0 -75.0 40.0 2
assign (resid 38 and name n ) (resid 38 and name ca )
(resid 38 and name cb ) (resid 38 and name cg1) 1.0 -57.0 40.0 2
assign (resid 39 and name n ) (resid 39 and name ca )
(resid 39 and name cb ) (resid 39 and name cg ) 1.0 180.0 40.0 2
assign (resid 40 and name n ) (resid 40 and name ca )
(resid 40 and name cb ) (resid 40 and name cg1) 1.0 180.0 40.0 2
assign (resid 41 and name n ) (resid 41 and name ca )
(resid 41 and name cb ) (resid 41 and name cg1) 1.0 -60.0 40.0 2
assign (resid 45 and name n ) (resid 45 and name ca )
(resid 45 and name cb ) (resid 45 and name og1) 1.0 -81.0 50.0 2
assign (resid 46 and name n ) (resid 46 and name ca )
(resid 46 and name cb ) (resid 46 and name cg ) 1.0 180.0 40.0 2
assign (resid 47 and name n ) (resid 47 and name ca )
(resid 47 and name cb ) (resid 47 and name cg ) 1.0 -66.0 40.0 2
assign (resid 49 and name n ) (resid 49 and name ca )
(resid 49 and name cb ) (resid 49 and name cg ) 1.0 -60.0 40.0 2
assign (resid 57 and name n ) (resid 57 and name ca )
(resid 57 and name cb ) (resid 57 and name cg ) 1.0 57.0 40.0 2
assign (resid 58 and name n ) (resid 58 and name ca )
(resid 58 and name cb ) (resid 58 and name og1) 1.0 -72.0 40.0 2
assign (resid 59 and name n ) (resid 59 and name ca )
(resid 59 and name cb ) (resid 59 and name cg ) 1.0 -60.0 40.0 2
assign (resid 60 and name n ) (resid 60 and name ca )
(resid 60 and name cb ) (resid 60 and name cg1 ) 1.0 186.0 40.0 2
assign (resid 61 and name n ) (resid 61 and name ca )
(resid 61 and name cb ) (resid 61 and name cg1 ) 1.0 183.0 40.0 2
assign (resid 62 and name n ) (resid 62 and name ca )
(resid 62 and name cb ) (resid 62 and name cg ) 1.0 165.0 40.0 2
assign (resid 63 and name n ) (resid 63 and name ca )
(resid 63 and name cb ) (resid 63 and name og1 ) 1.0 171.0 40.0 2
assign (resid 68 and name n ) (resid 68 and name ca )
(resid 68 and name cb ) (resid 68 and name cg ) 1.0 -177.0 40.0 2
assign (resid 69 and name n ) (resid 69 and name ca )
(resid 69 and name cb ) (resid 69 and name cg ) 1.0 -66.0 40.0 2
assign (resid 71 and name n ) (resid 71 and name ca )
(resid 71 and name cb ) (resid 71 and name cg ) 1.0 -60.0 40.0 2
assign (resid 74 and name n ) (resid 74 and name ca )
(resid 74 and name cb ) (resid 74 and name cg1) 1.0 168.0 40.0 2
assign (resid 75 and name n ) (resid 75 and name ca )
(resid 75 and name cb ) (resid 75 and name cg1) 1.0 171.0 40.0 2
assign (resid 76 and name n ) (resid 76 and name ca )
(resid 76 and name cb ) (resid 76 and name cg1) 1.0 -60.0 40.0 2
assign (resid 77 and name n ) (resid 77 and name ca )
(resid 77 and name cb ) (resid 77 and name cg ) 1.0 -60.0 40.0 2
assign (resid 79 and name n ) (resid 79 and name ca )
(resid 79 and name cb ) (resid 79 and name cg1) 1.0 180.0 40.0 2
assign (resid 82 and name n ) (resid 82 and name ca )
(resid 82 and name cb ) (resid 82 and name cg1) 1.0 159.0 40.0 2
assign (resid 83 and name n ) (resid 83 and name ca )
(resid 83 and name cb ) (resid 83 and name cg ) 1.0 -63.0 40.0 2
assign (resid 85 and name n ) (resid 85 and name ca )
(resid 85 and name cb ) (resid 85 and name cg ) 1.0 -160.0 40.0 2
assign (resid 89 and name n ) (resid 89 and name ca )
(resid 89 and name cb ) (resid 89 and name cg ) 1.0 -78.0 40.0 2
assign (resid 92 and name n ) (resid 92 and name ca )
(resid 92 and name cb ) (resid 92 and name cg ) 1.0 -78.0 40.0 2
assign (resid 93 and name n ) (resid 93 and name ca )
(resid 93 and name cb ) (resid 93 and name cg ) 1.0 -51.0 40.0 2
assign (resid 94 and name n ) (resid 94 and name ca )
(resid 94 and name cb ) (resid 94 and name cg ) 1.0 -180.0 40.0 2
assign (resid 95 and name n ) (resid 95 and name ca )
(resid 95 and name cb ) (resid 95 and name cg1) 1.0 168.0 40.0 2
assign (resid 96 and name n ) (resid 96 and name ca )
(resid 96 and name cb ) (resid 96 and name cg1) 1.0 -57.0 40.0 2
assign (resid 102 and name n ) (resid 102 and name ca )
(resid 102 and name cb ) (resid 102 and name cg1) 1.0 -78.0 40.0 2
assign (resid 103 and name n ) (resid 103 and name ca )
(resid 103 and name cb ) (resid 103 and name cg ) 1.0 -75.0 40.0 2
assign (resid 104 and name n ) (resid 104 and name ca )
(resid 104 and name cb ) (resid 104 and name og1) 1.0 -60.0 40.0 2
assign (resid 106 and name n ) (resid 106 and name ca )
(resid 106 and name cb ) (resid 106 and name cg ) 1.0 -66.0 40.0 2
assign (resid 108 and name n ) (resid 108 and name ca )
(resid 108 and name cb ) (resid 108 and name cg ) 1.0 -72.0 40.0 2
assign (resid 109 and name n ) (resid 109 and name ca )
(resid 109 and name cb ) (resid 109 and name cg ) 1.0 -75.0 40.0 2
assign (resid 110 and name n ) (resid 110 and name ca )
(resid 110 and name cb ) (resid 110 and name cg1) 1.0 78.0 40.0 2
assign (resid 112 and name n ) (resid 112 and name ca )
(resid 112 and name cb ) (resid 112 and name og1) 1.0 -45.0 40.0 2
assign (resid 113 and name n ) (resid 113 and name ca )
(resid 113 and name cb ) (resid 113 and name cg ) 1.0 -57.0 40.0 2
assign (resid 114 and name n ) (resid 114 and name ca )
(resid 114 and name cb ) (resid 114 and name cg ) 1.0 -60.0 40.0 2
assign (resid 117 and name n ) (resid 117 and name ca )
(resid 117 and name cb ) (resid 117 and name cg ) 1.0 -60.0 40.0 2
assign (resid 118 and name n ) (resid 118 and name ca )
(resid 118 and name cb ) (resid 118 and name cg ) 1.0 -81.0 40.0 2
assign (resid 122 and name n ) (resid 122 and name ca )
(resid 122 and name cb ) (resid 122 and name cg ) 1.0 -57.0 40.0 2
assign (resid 126 and name n ) (resid 126 and name ca )
(resid 126 and name cb ) (resid 126 and name og1) 1.0 -72.0 40.0 2
assign (resid 127 and name n ) (resid 127 and name ca )
(resid 127 and name cb ) (resid 127 and name cg ) 1.0 -66.0 40.0 2
assign (resid 128 and name n ) (resid 128 and name ca )
(resid 128 and name cb ) (resid 128 and name cg ) 1.0 180.0 40.0 2
assign (resid 129 and name n ) (resid 129 and name ca )
(resid 129 and name cb ) (resid 129 and name cg1) 1.0 66.0 40.0 2
assign (resid 131 and name n ) (resid 131 and name ca )
(resid 131 and name cb ) (resid 131 and name cg ) 1.0 -75.0 40.0 2
assign (resid 132 and name n ) (resid 132 and name ca )
(resid 132 and name cb ) (resid 132 and name cg ) 1.0 -165.0 40.0 2
assign (resid 136 and name n ) (resid 136 and name ca )
(resid 136 and name cb ) (resid 136 and name cg ) 1.0 -57.0 40.0 2
assign (resid 137 and name n ) (resid 137 and name ca )
(resid 137 and name cb ) (resid 137 and name og1) 1.0 -57.0 40.0 2
assign (resid 138 and name n ) (resid 138 and name ca )
(resid 138 and name cb ) (resid 138 and name cg ) 1.0 -165.0 40.0 2
assign (resid 141 and name n ) (resid 141 and name ca )
(resid 141 and name cb ) (resid 141 and name og ) 1.0 180.0 40.0 2
assign (resid 142 and name n ) (resid 142 and name ca )
(resid 142 and name cb ) (resid 142 and name cg ) 1.0 180.0 40.0 2
assign (resid 143 and name n ) (resid 143 and name ca )
(resid 143 and name cb ) (resid 143 and name og1) 1.0 -60.0 40.0 2
assign (resid 144 and name n ) (resid 144 and name ca )
(resid 144 and name cb ) (resid 144 and name cg1) 1.0 183.0 40.0 2
assign (resid 146 and name n ) (resid 146 and name ca )
(resid 146 and name cb ) (resid 146 and name cg ) 1.0 -165.0 40.0 2
assign (resid 147 and name n ) (resid 147 and name ca )
(resid 147 and name cb ) (resid 147 and name og1) 1.0 60.0 40.0 2
assign (resid 151 and name n ) (resid 151 and name ca )
(resid 151 and name cb ) (resid 151 and name cg ) 1.0 -75.0 40.0 2
assign (resid 153 and name n ) (resid 153 and name ca )
(resid 153 and name cb ) (resid 153 and name cg ) 1.0 60.0 40.0 2
assign (resid 154 and name n ) (resid 154 and name ca )
(resid 154 and name cb ) (resid 154 and name og1) 1.0 -60.0 40.0 2
assign (resid 155 and name n ) (resid 155 and name ca )
(resid 155 and name cb ) (resid 155 and name cg ) 1.0 -60.0 40.0 2
assign (resid 156 and name n ) (resid 156 and name ca )
(resid 156 and name cb ) (resid 156 and name cg ) 1.0 -57.0 40.0 2
assign (resid 157 and name n ) (resid 157 and name ca )
(resid 157 and name cb ) (resid 157 and name cg1) 1.0 177.0 40.0 2
assign (resid 158 and name n ) (resid 158 and name ca )
(resid 158 and name cb ) (resid 158 and name cg ) 1.0 -57.0 40.0 2
assign (resid 159 and name n ) (resid 159 and name ca )
(resid 159 and name cb ) (resid 159 and name cg ) 1.0 -63.0 40.0 2
assign (resid 160 and name n ) (resid 160 and name ca )
(resid 160 and name cb ) (resid 160 and name cg ) 1.0 180.0 40.0 2
!
! chi-2
!
assign (resid 19 and name ca ) (resid 19 and name cb )
(resid 19 and name cg ) (resid 19 and name cd1) 1.0 180.0 40.0 2
assign (resid 38 and name ca ) (resid 38 and name cb )
(resid 38 and name cg1) (resid 38 and name cd1) 1.0 180.0 40.0 2
assign (resid 54 and name ca ) (resid 54 and name cb )
(resid 54 and name cg ) (resid 54 and name cd1) 1.0 180.0 40.0 2
assign (resid 96 and name ca ) (resid 96 and name cb )
(resid 96 and name cg1) (resid 96 and name cd1) 1.0 -60.0 40.0 2
assign (resid 102 and name ca ) (resid 102 and name cb )
(resid 102 and name cg1) (resid 102 and name cd1) 1.0 -60.0 40.0 2
assign (resid 114 and name ca ) (resid 114 and name cb )
(resid 114 and name cg ) (resid 114 and name cd1) 1.0 180.0 40.0 2
!
! chi-3
!
assign (resid 39 and name cb ) (resid 39 and name cg )
(resid 39 and name sd ) (resid 39 and name ce ) 1.0 60.0 40.0 2
!
! dihedral restraints to keep MTX PAGB substituents almost planar
!
assign (resid 170 and name cm ) (resid 170 and name n10)
(resid 170 and name c11) (resid 170 and name c12) 2.0 0.0 30.0 2
assign (resid 170 and name c9 ) (resid 170 and name n10)
(resid 170 and name c11) (resid 170 and name c16) 2.0 0.0 30.0 2
assign (resid 170 and name n ) (resid 170 and name c )
(resid 170 and name c14) (resid 170 and name c15) 2.0 0.0 50.0 2
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