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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641347 |
6j3l   |
cing | 1-original | 4 | XPLOR/CNS | dihedral angle |
# Restraints file 4: talos.tbl
!!Restraint file created by talos2xplor.pl
!!phi/psi angles predicted from TALOS using errfactor=3
!! L 119 - Good: based on both ppm(TALOS) + Jhnha; errfactor=3
assign (resid 118 and name c and segid " A") (resid 119 and name n and segid " A")
(resid 119 and name ca and segid " A") (resid 119 and name c and segid " A") 1.0 -129.8 58.2 2
assign (resid 119 and name n and segid " A") (resid 119 and name ca and segid " A")
(resid 119 and name c and segid " A") (resid 120 and name n and segid " A") 1.0 169.9 9.9 2
!! P 124 - Good: based on both ppm(TALOS) + Jhnha; errfactor=3
assign (resid 123 and name c and segid " A") (resid 124 and name n and segid " A")
(resid 124 and name ca and segid " A") (resid 124 and name c and segid " A") 1.0 -61.6 22.8 2
assign (resid 124 and name n and segid " A") (resid 124 and name ca and segid " A")
(resid 124 and name c and segid " A") (resid 125 and name n and segid " A") 1.0 148.4 57.4 2
!! T 128 - Good: based on both ppm(TALOS) + Jhnha; errfactor=3
assign (resid 127 and name c and segid " A") (resid 128 and name n and segid " A")
(resid 128 and name ca and segid " A") (resid 128 and name c and segid " A") 1.0 -86.6 87.1 2
assign (resid 128 and name n and segid " A") (resid 128 and name ca and segid " A")
(resid 128 and name c and segid " A") (resid 129 and name n and segid " A") 1.0 -13.4 59.3 2
!! P 132 - Good: based on both ppm(TALOS) + Jhnha; errfactor=3
assign (resid 131 and name c and segid " A") (resid 132 and name n and segid " A")
(resid 132 and name ca and segid " A") (resid 132 and name c and segid " A") 1.0 -88.3 75.6 2
assign (resid 132 and name n and segid " A") (resid 132 and name ca and segid " A")
(resid 132 and name c and segid " A") (resid 133 and name n and segid " A") 1.0 2.2 77.9 2
!! S 136 - Good: based on both ppm(TALOS) + Jhnha; errfactor=3
assign (resid 135 and name c and segid " A") (resid 136 and name n and segid " A")
(resid 136 and name ca and segid " A") (resid 136 and name c and segid " A") 1.0 -60.3 25.9 2
assign (resid 136 and name n and segid " A") (resid 136 and name ca and segid " A")
(resid 136 and name c and segid " A") (resid 137 and name n and segid " A") 1.0 -33.1 36.5 2
!! F 137 - Good: based on both ppm(TALOS) + Jhnha; errfactor=3
assign (resid 136 and name c and segid " A") (resid 137 and name n and segid " A")
(resid 137 and name ca and segid " A") (resid 137 and name c and segid " A") 1.0 -62.9 24.8 2
assign (resid 137 and name n and segid " A") (resid 137 and name ca and segid " A")
(resid 137 and name c and segid " A") (resid 138 and name n and segid " A") 1.0 -26.9 45.4 2
!! F 138 - Good: based on both ppm(TALOS) + Jhnha; errfactor=3
assign (resid 137 and name c and segid " A") (resid 138 and name n and segid " A")
(resid 138 and name ca and segid " A") (resid 138 and name c and segid " A") 1.0 -67.8 56.1 2
assign (resid 138 and name n and segid " A") (resid 138 and name ca and segid " A")
(resid 138 and name c and segid " A") (resid 139 and name n and segid " A") 1.0 -24.4 80.7 2
!! T 145 - Good: based on both ppm(TALOS) + Jhnha; errfactor=3
assign (resid 144 and name c and segid " A") (resid 145 and name n and segid " A")
(resid 145 and name ca and segid " A") (resid 145 and name c and segid " A") 1.0 -125.0 58.5 2
assign (resid 145 and name n and segid " A") (resid 145 and name ca and segid " A")
(resid 145 and name c and segid " A") (resid 146 and name n and segid " A") 1.0 167.0 34.7 2
!! K 146 - Good: based on both ppm(TALOS) + Jhnha; errfactor=3
assign (resid 145 and name c and segid " A") (resid 146 and name n and segid " A")
(resid 146 and name ca and segid " A") (resid 146 and name c and segid " A") 1.0 -125.0 62.8 2
assign (resid 146 and name n and segid " A") (resid 146 and name ca and segid " A")
(resid 146 and name c and segid " A") (resid 147 and name n and segid " A") 1.0 162.1 27.4 2
!! T 151 - Good: based on both ppm(TALOS) + Jhnha; errfactor=3
assign (resid 150 and name c and segid " A") (resid 151 and name n and segid " A")
(resid 151 and name ca and segid " A") (resid 151 and name c and segid " A") 1.0 -118.9 46.8 2
assign (resid 151 and name n and segid " A") (resid 151 and name ca and segid " A")
(resid 151 and name c and segid " A") (resid 152 and name n and segid " A") 1.0 174.1 23.8 2
!! I 155 - Good: based on both ppm(TALOS) + Jhnha; errfactor=3
assign (resid 154 and name c and segid " A") (resid 155 and name n and segid " A")
(resid 155 and name ca and segid " A") (resid 155 and name c and segid " A") 1.0 -70.5 37.8 2
assign (resid 155 and name n and segid " A") (resid 155 and name ca and segid " A")
(resid 155 and name c and segid " A") (resid 156 and name n and segid " A") 1.0 -30.5 68.5 2
!! I 160 - Good: based on both ppm(TALOS) + Jhnha; errfactor=3
assign (resid 159 and name c and segid " A") (resid 160 and name n and segid " A")
(resid 160 and name ca and segid " A") (resid 160 and name c and segid " A") 1.0 -95.3 50.1 2
assign (resid 160 and name n and segid " A") (resid 160 and name ca and segid " A")
(resid 160 and name c and segid " A") (resid 161 and name n and segid " A") 1.0 -13.6 77.1 2
!! A 172 - Good: based on both ppm(TALOS) + Jhnha; errfactor=3
assign (resid 171 and name c and segid " A") (resid 172 and name n and segid " A")
(resid 172 and name ca and segid " A") (resid 172 and name c and segid " A") 1.0 -63.8 59.4 2
assign (resid 172 and name n and segid " A") (resid 172 and name ca and segid " A")
(resid 172 and name c and segid " A") (resid 173 and name n and segid " A") 1.0 -32.3 83.9 2
!! L 174 - Good: based on both ppm(TALOS) + Jhnha; errfactor=3
assign (resid 173 and name c and segid " A") (resid 174 and name n and segid " A")
(resid 174 and name ca and segid " A") (resid 174 and name c and segid " A") 1.0 -67.8 56.3 2
assign (resid 174 and name n and segid " A") (resid 174 and name ca and segid " A")
(resid 174 and name c and segid " A") (resid 175 and name n and segid " A") 1.0 -25.0 83.1 2
!! L 175 - Good: based on both ppm(TALOS) + Jhnha; errfactor=3
assign (resid 174 and name c and segid " A") (resid 175 and name n and segid " A")
(resid 175 and name ca and segid " A") (resid 175 and name c and segid " A") 1.0 -68.3 55.6 2
assign (resid 175 and name n and segid " A") (resid 175 and name ca and segid " A")
(resid 175 and name c and segid " A") (resid 176 and name n and segid " A") 1.0 -24.7 81.1 2
!! L 178 - Good: based on both ppm(TALOS) + Jhnha; errfactor=3
assign (resid 177 and name c and segid " A") (resid 178 and name n and segid " A")
(resid 178 and name ca and segid " A") (resid 178 and name c and segid " A") 1.0 -102.0 43.6 2
assign (resid 178 and name n and segid " A") (resid 178 and name ca and segid " A")
(resid 178 and name c and segid " A") (resid 179 and name n and segid " A") 1.0 3.5 68.6 2
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