NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
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4677 |
1fi5   |
cing | 1-original | 3 | XPLOR/CNS | dihedral angle |
assign ( resid 87 and name HN) ( resid 87 and name N)
( resid 87 and name CA) ( resid 87 and name HA) 1.0 -141.46 30.0 2
assign ( resid 88 and name HN) ( resid 88 and name N)
( resid 88 and name CA) ( resid 88 and name HA) 1.0 -143.02 30.0 2
assign ( resid 89 and name HN) ( resid 89 and name N)
( resid 89 and name CA) ( resid 89 and name HA) 1.0 -137.45 30.0 2
assign ( resid 90 and name HN) ( resid 90 and name N)
( resid 90 and name CA) ( resid 90 and name HA) 1.0 -149.33 30.0 2
assign ( resid 91 and name HN) ( resid 91 and name N)
( resid 91 and name CA) ( resid 91 and name HA2) 1.0 -138.65 30.0 2
assign ( resid 92 and name HN) ( resid 92 and name N)
( resid 92 and name CA) ( resid 92 and name HA) 1.0 -143.10 30.0 2
!Helix E
assign ( resid 93 and name HN) ( resid 93 and name N)
( resid 93 and name CA) ( resid 93 and name HA) 1.0 -141.23 20.0 2
assign ( resid 94 and name HN) ( resid 94 and name N)
( resid 94 and name CA) ( resid 94 and name HA) 1.0 -122.62 20.0 2
assign ( resid 95 and name HN) ( resid 95 and name N)
( resid 95 and name CA) ( resid 95 and name HA) 1.0 -124.00 20.0 2
assign ( resid 96 and name HN) ( resid 96 and name N)
( resid 96 and name CA) ( resid 96 and name HA) 1.0 -131.17 20.0 2
assign ( resid 97 and name HN) ( resid 97 and name N)
( resid 97 and name CA) ( resid 97 and name HA) 1.0 -117.0 20.0 2
assign ( resid 98 and name HN) ( resid 98 and name N)
( resid 98 and name CA) ( resid 98 and name HA) 1.0 -118.65 20.0 2
assign ( resid 99 and name HN) ( resid 99 and name N)
( resid 99 and name CA) ( resid 99 and name HA) 1.0 -126.20 20.0 2
assign ( resid 100 and name HN) ( resid 100 and name N)
( resid 100 and name CA) ( resid 100 and name HA) 1.0 -123.62 20.0 2
assign ( resid 101 and name HN) ( resid 101 and name N)
( resid 101 and name CA) ( resid 101 and name HA) 1.0 -112.53 20.0 2
assign ( resid 102 and name HN) ( resid 102 and name N)
( resid 102 and name CA) ( resid 102 and name HA) 1.0 -123.08 20.0 2
assign ( resid 103 and name HN) ( resid 103 and name N)
( resid 103 and name CA) ( resid 103 and name HA) 1.0 -132.50 20.0 2
!Ca2+ loop
assign ( resid 104 and name HN) ( resid 104 and name N)
( resid 104 and name CA) ( resid 104 and name HA) 1.0 -143.96 30.0 2
assign ( resid 105 and name HN) ( resid 105 and name N)
( resid 105 and name CA) ( resid 105 and name HA) 1.0 -139.48 30.0 2
assign ( resid 106 and name HN) ( resid 106 and name N)
( resid 106 and name CA) ( resid 106 and name HA) 1.0 -128.00 50.0 2
!!Lys106 value from x-ray
assign ( resid 107 and name HN) ( resid 107 and name N)
( resid 107 and name CA) ( resid 107 and name HA) 1.0 -150.56 30.0 2
assign ( resid 108 and name HN) ( resid 108 and name N)
( resid 108 and name CA) ( resid 108 and name HA) 1.0 +1.00 30.0 2
!!A108 value from x-ray
assign ( resid 109 and name HN) ( resid 109 and name N)
( resid 109 and name CA) ( resid 109 and name HA) 1.0 -142.32 30.0 2
assign ( resid 109 and name C) ( resid 110 and name N)
( resid 110 and name CA) ( resid 110 and name C) 1.0 +95.00 30.0 2
!!Gly110 Phi value from x-ray
!Beta-sheet
assign ( resid 111 and name HN) ( resid 111 and name N)
( resid 111 and name CA) ( resid 111 and name HA) 1.0 -210.9 20.0 2
assign ( resid 112 and name HN) ( resid 112 and name N)
( resid 112 and name CA) ( resid 112 and name HA) 1.0 -210.4 20.0 2
assign ( resid 113 and name HN) ( resid 113 and name N)
( resid 113 and name CA) ( resid 113 and name HA) 1.0 -214.1 20.0 2
!Helix F
assign ( resid 114 and name HN) ( resid 114 and name N)
( resid 114 and name CA) ( resid 114 and name HA) 1.0 -114.59 40.0 2
assign ( resid 115 and name HN) ( resid 115 and name N)
( resid 115 and name CA) ( resid 115 and name HA) 1.0 -129.84 20.0 2
assign ( resid 116 and name HN) ( resid 116 and name N)
( resid 116 and name CA) ( resid 116 and name HA) 1.0 -112.44 20.0 2
assign ( resid 117 and name HN) ( resid 117 and name N)
( resid 117 and name CA) ( resid 117 and name HA) 1.0 -120.82 20.0 2
assign ( resid 118 and name HN) ( resid 118 and name N)
( resid 118 and name CA) ( resid 118 and name HA) 1.0 -117.0 20.0 2
assign ( resid 119 and name HN) ( resid 119 and name N)
( resid 119 and name CA) ( resid 119 and name HA) 1.0 -115.38 20.0 2
assign ( resid 120 and name HN) ( resid 120 and name N)
( resid 120 and name CA) ( resid 120 and name HA) 1.0 -122.38 20.0 2
assign ( resid 121 and name HN) ( resid 121 and name N)
( resid 121 and name CA) ( resid 121 and name HA) 1.0 -117.0 20.0 2
assign ( resid 122 and name HN) ( resid 122 and name N)
( resid 122 and name CA) ( resid 122 and name HA) 1.0 -124.84 20.0 2
assign ( resid 123 and name HN) ( resid 123 and name N)
( resid 123 and name CA) ( resid 123 and name HA) 1.0 -120.97 20.0 2
assign ( resid 124 and name HN) ( resid 124 and name N)
( resid 124 and name CA) ( resid 124 and name HA) 1.0 -128.44 40.0 2
!Loop
assign ( resid 124 and name C) ( resid 125 and name N)
( resid 125 and name CA) ( resid 125 and name C) 1.0 -84.00 30.0 2
!! Gly125 Phi value from x-ray
assign ( resid 126 and name HN) ( resid 126 and name N)
( resid 126 and name CA) ( resid 126 and name HA) 1.0 -137.90 30.0 2
assign ( resid 127 and name HN) ( resid 127 and name N)
( resid 127 and name CA) ( resid 127 and name HA) 1.0 -140.09 40.0 2
assign ( resid 128 and name HN) ( resid 128 and name N)
( resid 128 and name CA) ( resid 128 and name HA) 1.0 -142.70 30.0 2
assign ( resid 129 and name HN) ( resid 129 and name N)
( resid 129 and name CA) ( resid 129 and name HA) 1.0 -159.38 40.0 2
!Helix G
assign ( resid 130 and name HN) ( resid 130 and name N)
( resid 130 and name CA) ( resid 130 and name HA) 1.0 -117.0 20.0 2
assign ( resid 131 and name HN) ( resid 131 and name N)
( resid 131 and name CA) ( resid 131 and name HA) 1.0 -120.18 20.0 2
assign ( resid 132 and name HN) ( resid 132 and name N)
( resid 132 and name CA) ( resid 132 and name HA) 1.0 -117.0 20.0 2
assign ( resid 133 and name HN) ( resid 133 and name N)
( resid 133 and name CA) ( resid 133 and name HA) 1.0 -117.0 20.0 2
assign ( resid 134 and name HN) ( resid 134 and name N)
( resid 134 and name CA) ( resid 134 and name HA) 1.0 -118.16 20.0 2
assign ( resid 135 and name HN) ( resid 135 and name N)
( resid 135 and name CA) ( resid 135 and name HA) 1.0 -123.46 20.0 2
assign ( resid 136 and name HN) ( resid 136 and name N)
( resid 136 and name CA) ( resid 136 and name HA) 1.0 -117.0 20.0 2
assign ( resid 137 and name HN) ( resid 137 and name N)
( resid 137 and name CA) ( resid 137 and name HA) 1.0 -128.96 20.0 2
assign ( resid 138 and name HN) ( resid 138 and name N)
( resid 138 and name CA) ( resid 138 and name HA) 1.0 -117.0 20.0 2
assign ( resid 139 and name HN) ( resid 139 and name N)
( resid 139 and name CA) ( resid 139 and name HA) 1.0 -126.05 20.0 2
!Ca2+ Loop
assign ( resid 140 and name HN) ( resid 140 and name N)
( resid 140 and name CA) ( resid 140 and name HA2) 1.0 -128.73 30.0 2
!stereo-assignt of G140 checked with xray
assign ( resid 141 and name HN) ( resid 141 and name N)
( resid 141 and name CA) ( resid 141 and name HA) 1.0 -129.70 30.0 2
assign ( resid 142 and name HN) ( resid 142 and name N)
( resid 142 and name CA) ( resid 142 and name HA) 1.0 -173.00 30.0 2
assign ( resid 143 and name HN) ( resid 143 and name N)
( resid 143 and name CA) ( resid 143 and name HA) 1.0 -154.88 30.0 2
assign ( resid 145 and name HN) ( resid 145 and name N)
( resid 145 and name CA) ( resid 145 and name HA) 1.0 -155.58 30.0 2
assign ( resid 145 and name C) ( resid 146 and name N)
( resid 146 and name CA) ( resid 146 and name C) 1.0 +91.00 30.0 2
!!Gly146 Phi value from x-ray
!Beta-sheet
assign ( resid 147 and name HN) ( resid 147 and name N)
( resid 147 and name CA) ( resid 147 and name HA) 1.0 -209.2 20.0 2
assign ( resid 148 and name HN) ( resid 148 and name N)
( resid 148 and name CA) ( resid 148 and name HA) 1.0 -198.8 20.0 2
assign ( resid 149 and name HN) ( resid 149 and name N)
( resid 149 and name CA) ( resid 149 and name HA) 1.0 -215.6 20.0 2
!Helix H
assign ( resid 150 and name HN) ( resid 150 and name N)
( resid 150 and name CA) ( resid 150 and name HA) 1.0 -114.0 20.0 2
!!Y150 value from x-ray
assign ( resid 151 and name HN) ( resid 151 and name N)
( resid 151 and name CA) ( resid 151 and name HA) 1.0 -125.60 20.0 2
assign ( resid 152 and name HN) ( resid 152 and name N)
( resid 152 and name CA) ( resid 152 and name HA) 1.0 -120.89 20.0 2
assign ( resid 153 and name HN) ( resid 153 and name N)
( resid 153 and name CA) ( resid 153 and name HA) 1.0 -129.77 20.0 2
assign ( resid 154 and name HN) ( resid 154 and name N)
( resid 154 and name CA) ( resid 154 and name HA) 1.0 -117.0 20.0 2
assign ( resid 155 and name HN) ( resid 155 and name N)
( resid 155 and name CA) ( resid 155 and name HA) 1.0 -134.27 20.0 2
assign ( resid 156 and name HN) ( resid 156 and name N)
( resid 156 and name CA) ( resid 156 and name HA) 1.0 -117.33 20.0 2
!C-term
assign ( resid 157 and name HN) ( resid 157 and name N)
( resid 157 and name CA) ( resid 157 and name HA) 1.0 -142.32 30.0 2
assign ( resid 158 and name HN) ( resid 158 and name N)
( resid 158 and name CA) ( resid 158 and name HA) 1.0 -121.37 30.0 2
assign ( resid 159 and name HN) ( resid 159 and name N)
( resid 159 and name CA) ( resid 159 and name HA1) 1.0 132.94 30.0 2
assign ( resid 159 and name HN) ( resid 159 and name N)
( resid 159 and name CA) ( resid 159 and name HA2) 1.0 38.32 30.0 2
assign ( resid 160 and name HN) ( resid 160 and name N)
( resid 160 and name CA) ( resid 160 and name HA) 1.0 -144.92 30.0 2
assign ( resid 161 and name HN) ( resid 161 and name N)
( resid 161 and name CA) ( resid 161 and name HA) 1.0 -149.59 30.0 2
!! CHI1's from HNHB
assign ( resid 100 and name N) ( resid 100 and name CA)
( resid 100 and name CB) ( resid 100 and name CG) 1.0 -91.11 30.0 2
assign ( resid 104 and name N) ( resid 104 and name CA)
( resid 104 and name CB) ( resid 104 and name CG) 1.0 -98.89 30.0 2
assign ( resid 127 and name N) ( resid 127 and name CA)
( resid 127 and name CB) ( resid 127 and name CG) 1.0 180.00 30.0 2
assign ( resid 131 and name N) ( resid 131 and name CA)
( resid 131 and name CB) ( resid 131 and name CG) 1.0 -128.89 30.0 2
assign ( resid 132 and name N) ( resid 132 and name CA)
( resid 132 and name CB) ( resid 132 and name CG) 1.0 -91.11 30.0 2
assign ( resid 134 and name N) ( resid 134 and name CA)
( resid 134 and name CB) ( resid 134 and name CG) 1.0 -90.0 30.0 2
assign ( resid 136 and name N) ( resid 136 and name CA)
( resid 136 and name CB) ( resid 136 and name CG) 1.0 -106.67 30.0 2
assign ( resid 139 and name N) ( resid 139 and name CA)
( resid 139 and name CB) ( resid 139 and name CG) 1.0 103.67 30.0 2
assign ( resid 141 and name N)( resid 141 and name CA)
( resid 141 and name CB) ( resid 141 and name CG) 1.0 -178.89 30.0 2
assign ( resid 145 and name N) ( resid 145 and name CA)
( resid 145 and name CB) ( resid 145 and name CG) 1.0 91.11 30.0 2
assign ( resid 149 and name N) ( resid 149 and name CA)
( resid 149 and name CB) ( resid 149 and name CG) 1.0 85.5 30.0 2
assign ( resid 150 and name N) ( resid 150 and name CA)
( resid 150 and name CB) ( resid 150 and name CG) 1.0 -176.67 30.0 2
assign ( resid 151 and name N) ( resid 151 and name CA)
( resid 151 and name CB) ( resid 151 and name CG) 1.0 -78.89 30.0 2
assign ( resid 154 and name N) ( resid 154 and name CA)
( resid 154 and name CB) ( resid 154 and name CG) 1.0 -91.11 30.0 2
assign ( resid 155 and name N) ( resid 155 and name CA)
( resid 155 and name CB) ( resid 155 and name CG) 1.0 -83.33 30.0 2
assign ( resid 156 and name N) ( resid 156 and name CA)
( resid 156 and name CB) ( resid 156 and name CG) 1.0 180.00 30.0 2
assign ( resid 157 and name N) ( resid 157 and name CA)
( resid 157 and name CB) ( resid 157 and name CG) 1.0 -96.67 30.0 2
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