NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
632527 |
5yoz   |
cing | 4-filtered-FRED | Wattos | check | stereo assignment | distance |
data_5yoz
save_assign_stereo
_Stereo_assign_list.Sf_category stereo_assignments
_Stereo_assign_list.Triplet_count 229
_Stereo_assign_list.Swap_count 0
_Stereo_assign_list.Swap_percentage 0.0
_Stereo_assign_list.Deassign_count 0
_Stereo_assign_list.Deassign_percentage 0.0
_Stereo_assign_list.Model_count 10
_Stereo_assign_list.Total_e_low_states 0.121
_Stereo_assign_list.Total_e_high_states 87.993
_Stereo_assign_list.Crit_abs_e_diff 0.100
_Stereo_assign_list.Crit_rel_e_diff 0.000
_Stereo_assign_list.Crit_mdls_favor_pct 75.0
_Stereo_assign_list.Crit_sing_mdl_viol 1.000
_Stereo_assign_list.Crit_multi_mdl_viol 0.500
_Stereo_assign_list.Crit_multi_mdl_pct 50.0
_Stereo_assign_list.Details
;
Description of the tags in this list:
* 1 * NMR-STAR 3 administrative tag
* 2 * NMR-STAR 3 administrative tag
* 3 * NMR-STAR 3 administrative tag
* 4 * Number of triplets (atom-group pair and pseudo)
* 5 * Number of triplets that were swapped
* 6 * Percentage of triplets that were swapped
* 7 * Number of deassigned triplets
* 8 * Percentage of deassigned triplets
* 9 * Number of models in ensemble
* 10 * Energy of the states with the lower energies summed for all triplets (Ang.**2)
* 11 * Energy of the states with the higher energies summed for all triplets (Ang.**2)
* 12 * Item 9-8
* 13 * Criterium for swapping assignment on the absolute energy difference (Ang.**2)
* 14 * Criterium for swapping assignment on the relative energy difference (Ang.**2)
* 15 * Criterium for swapping assignment on the percentage of models favoring a swap
* 16 * Criterium for deassignment on a single model violation (Ang.)
* 17 * Criterium for deassignment on a multiple model violation (Ang.)
* 18 * Criterium for deassignment on a percentage of models
* 19 * this tag
Description of the tags in the table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Name of pseudoatom representing the triplet
* 5 * Ordinal number of assignment (1 is assigned first)
* 6 * 'yes' if assignment state is swapped with respect to restraint file
* 7 * Percentage of models in which the assignment with the lowest
overall energy is favoured
* 8 * Percentage of difference between lowest and highest overall energy
with respect to the highest overall energy
* 9 * Difference between lowest and highest overall energy
* 10 * Energy of the highest overall energy state (Ang.**2)
* 11 * Energy of the lowest overall energy state (Ang.**2)
* 12 * Number of restraints involved with the triplet. The highest ranking
triplet on this number, is assigned first
* 13 * Number of restraints involved with the triplet that are ambiguous
besides the ambiguity from this triplet
* 14 * 'yes' if restraints included in this triplet are deassigned
* 15 * Maximum unaveraged violation before deassignment (Ang.)
* 16 * Number of violated restraints above threshold for a single model
before deassignment (given by Single_mdl_crit_count)
* 17 * Number of violated restraints above threshold for a multiple models
before deassignment (given by Multi_mdl_crit_count)
* 18 * NMR-STAR 3.0 administrative tag
* 19 * NMR-STAR 3.0 administrative tag
;
loop_
_Stereo_assign.Entity_assembly_ID
_Stereo_assign.Comp_index_ID
_Stereo_assign.Comp_ID
_Stereo_assign.Pseudo_Atom_ID
_Stereo_assign.Num
_Stereo_assign.Swapped
_Stereo_assign.Models_favoring_pct
_Stereo_assign.Energy_difference_pct
_Stereo_assign.Energy_difference
_Stereo_assign.Energy_high_state
_Stereo_assign.Energy_low_state
_Stereo_assign.Constraint_count
_Stereo_assign.Constraint_ambi_count
_Stereo_assign.Deassigned
_Stereo_assign.Violation_max
_Stereo_assign.Single_mdl_crit_count
_Stereo_assign.Multi_mdl_crit_count
1 3 MET QG 228 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 4 ASN QD 180 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 9 GLN QG 227 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 10 LEU QB 226 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 10 LEU QD 225 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 11 MET QB 224 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 11 MET QG 223 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 12 GLU QB 179 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 15 SER QB 18 no 0.0 0.0 0.000 0.001 0.001 16 8 no 0.065 0 0
1 17 LYS QB 21 no 50.0 100.0 0.215 0.216 0.000 15 0 no 0.027 0 0
1 17 LYS QD 103 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 17 LYS QG 52 no 40.0 99.5 0.163 0.163 0.001 10 2 no 0.074 0 0
1 19 VAL QG 1 no 100.0 0.0 0.000 0.001 0.001 37 15 no 0.067 0 0
1 20 MET QB 187 no 100.0 99.9 0.599 0.599 0.000 3 0 no 0.043 0 0
1 20 MET QG 29 no 20.0 98.7 0.040 0.041 0.001 13 4 no 0.053 0 0
1 21 LEU QB 75 no 100.0 0.0 0.000 0.000 0.000 9 0 no 0.059 0 0
1 21 LEU QD 142 no 100.0 0.0 0.000 0.000 0.000 5 3 no 0.000 0 0
1 22 GLY QA 222 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 23 GLU QB 221 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 23 GLU QG 107 no 80.0 99.4 0.227 0.228 0.001 7 0 no 0.058 0 0
1 24 SER QB 178 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 27 GLY QA 177 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 28 LYS QB 74 no 100.0 99.9 0.453 0.453 0.000 9 0 no 0.058 0 0
1 28 LYS QD 6 no 80.0 91.6 0.113 0.124 0.010 21 10 no 0.236 0 0
1 28 LYS QG 65 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.031 0 0
1 29 SER QB 176 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.026 0 0
1 30 SER QB 140 no 100.0 0.0 0.000 0.000 0.000 5 0 no 0.017 0 0
1 31 ILE QG 35 no 100.0 0.0 0.000 0.006 0.006 12 0 no 0.128 0 0
1 33 LEU QB 73 no 100.0 0.0 0.000 0.000 0.000 9 0 no 0.005 0 0
1 33 LEU QD 72 no 80.0 100.0 0.019 0.019 0.000 9 0 no 0.000 0 0
1 34 ARG QB 220 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 35 PHE QB 175 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 35 PHE QD 219 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 37 ARG QB 218 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 37 ARG QD 174 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 37 ARG QG 217 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 38 ASN QB 173 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 39 GLU QB 216 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 39 GLU QG 128 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.026 0 0
1 40 PHE QB 139 no 70.0 100.0 0.071 0.071 0.000 5 0 no 0.000 0 0
1 40 PHE QD 127 no 100.0 100.0 3.584 3.585 0.001 6 0 no 0.056 0 0
1 40 PHE QE 229 no 100.0 0.0 0.000 0.000 0.000 1 0 no 0.000 0 0
1 41 LEU QB 106 no 20.0 99.6 0.322 0.324 0.001 7 0 no 0.102 0 0
1 41 LEU QD 51 no 50.0 98.6 0.071 0.072 0.001 10 0 no 0.093 0 0
1 43 ASN QB 126 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 44 GLN QB 125 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 44 GLN QG 215 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 45 GLU QB 172 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 45 GLU QG 171 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 49 GLY QA 170 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 52 PHE QB 138 no 100.0 99.3 0.185 0.186 0.001 5 0 no 0.053 0 0
1 52 PHE QD 186 no 100.0 100.0 3.788 3.788 0.000 3 0 no 0.000 0 0
1 52 PHE QE 169 no 100.0 100.0 5.787 5.787 0.000 4 0 no 0.000 0 0
1 53 LEU QB 124 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 53 LEU QD 168 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 54 SER QB 64 no 20.0 63.5 0.000 0.000 0.000 10 4 no 0.032 0 0
1 55 LYS QB 50 no 80.0 99.9 0.384 0.384 0.000 10 0 no 0.065 0 0
1 55 LYS QD 102 no 100.0 0.0 0.000 0.001 0.001 8 4 no 0.082 0 0
1 55 LYS QE 214 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 55 LYS QG 213 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 57 VAL QG 40 no 100.0 0.0 0.000 0.001 0.001 12 6 no 0.082 0 0
1 58 MET QB 212 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 58 MET QG 211 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 59 ILE QG 123 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 60 ASP QB 122 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 61 GLY QA 167 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 62 ARG QB 166 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.033 0 0
1 62 ARG QD 121 no 100.0 0.0 0.000 0.001 0.001 6 0 no 0.063 0 0
1 62 ARG QG 120 no 100.0 0.0 0.000 0.001 0.001 6 0 no 0.084 0 0
1 64 LEU QB 119 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 64 LEU QD 20 no 50.0 98.2 0.186 0.190 0.003 15 0 no 0.095 0 0
1 65 LYS QB 23 no 100.0 0.0 0.000 0.001 0.001 15 4 no 0.065 0 0
1 65 LYS QD 63 no 100.0 0.0 0.000 0.001 0.001 10 4 no 0.058 0 0
1 65 LYS QE 131 no 100.0 0.0 0.000 0.005 0.005 6 4 no 0.163 0 0
1 66 TYR QB 118 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 66 TYR QD 185 no 90.0 100.0 1.725 1.725 0.000 3 0 no 0.000 0 0
1 66 TYR QE 165 no 100.0 100.0 7.721 7.721 0.000 4 0 no 0.060 0 0
1 67 GLU QB 137 no 80.0 100.0 0.082 0.082 0.000 5 0 no 0.000 0 0
1 67 GLU QG 92 no 100.0 0.0 0.000 0.000 0.000 8 2 no 0.000 0 0
1 68 ILE QG 136 no 70.0 100.0 0.057 0.057 0.000 5 0 no 0.003 0 0
1 69 TRP QB 38 no 100.0 0.0 0.000 0.000 0.000 12 4 no 0.000 0 0
1 70 ASP QB 53 no 20.0 13.9 0.001 0.010 0.008 10 3 no 0.236 0 0
1 77 PHE QB 210 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 78 ARG QG 209 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 79 SER QB 208 no 100.0 0.0 0.000 0.003 0.003 2 0 no 0.111 0 0
1 80 LEU QB 101 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 82 PRO QB 135 no 90.0 100.0 0.279 0.279 0.000 5 0 no 0.000 0 0
1 82 PRO QD 207 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 83 ILE QG 44 no 50.0 71.8 0.007 0.009 0.003 11 4 no 0.129 0 0
1 84 TYR QB 79 no 100.0 0.0 0.000 0.000 0.000 9 4 no 0.000 0 0
1 84 TYR QD 164 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 85 TYR QB 183 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.000 0 0
1 85 TYR QD 206 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 85 TYR QE 134 no 100.0 0.0 0.000 0.000 0.000 5 0 no 0.045 0 0
1 86 ARG QB 163 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 86 ARG QD 205 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 86 ARG QG 162 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 87 GLY QA 182 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.000 0 0
1 89 SER QB 117 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 90 GLY QA 5 no 100.0 0.0 0.000 0.000 0.000 22 10 no 0.000 0 0
1 92 LEU QB 71 no 100.0 0.0 0.000 0.000 0.000 9 0 no 0.000 0 0
1 92 LEU QD 26 no 100.0 0.0 0.000 0.000 0.000 14 7 no 0.000 0 0
1 93 VAL QG 105 no 20.0 99.8 0.001 0.001 0.000 7 0 no 0.005 0 0
1 94 VAL QG 2 no 90.0 99.8 0.505 0.506 0.001 32 14 no 0.054 0 0
1 95 TYR QB 62 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.000 0 0
1 95 TYR QD 39 no 100.0 100.0 16.522 16.522 0.000 12 5 no 0.011 0 0
1 95 TYR QE 108 no 100.0 100.0 6.185 6.185 0.000 7 2 no 0.000 0 0
1 96 ASP QB 70 no 20.0 100.0 0.031 0.031 0.000 9 0 no 0.000 0 0
1 97 ILE QG 34 no 100.0 0.0 0.000 0.000 0.000 12 0 no 0.053 0 0
1 99 ASN QB 116 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 100 SER QB 66 no 100.0 0.0 0.000 0.000 0.000 10 6 no 0.023 0 0
1 101 GLU QB 91 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.000 0 0
1 101 GLU QG 78 no 100.0 98.0 0.094 0.096 0.002 9 4 no 0.077 0 0
1 103 LEU QB 22 no 100.0 100.0 1.054 1.054 0.000 15 3 no 0.011 0 0
1 103 LEU QD 12 no 90.0 100.0 0.491 0.491 0.000 17 12 no 0.000 0 0
1 104 LYS QB 90 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.000 0 0
1 104 LYS QD 100 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.060 0 0
1 104 LYS QE 161 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.024 0 0
1 104 LYS QG 160 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 105 LYS QB 42 no 20.0 100.0 0.001 0.001 0.000 11 0 no 0.000 0 0
1 105 LYS QD 133 no 100.0 100.0 0.533 0.533 0.000 5 0 no 0.000 0 0
1 105 LYS QE 132 no 80.0 99.9 1.319 1.320 0.001 5 0 no 0.066 0 0
1 107 GLN QB 11 no 100.0 0.0 0.000 0.000 0.000 17 8 no 0.000 0 0
1 107 GLN QE 41 no 100.0 0.0 0.000 0.000 0.000 12 8 no 0.000 0 0
1 107 GLN QG 61 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.000 0 0
1 109 TRP QB 49 no 100.0 0.0 0.000 0.000 0.000 10 0 no 0.000 0 0
1 110 ILE QG 115 no 100.0 0.0 0.000 0.001 0.001 6 0 no 0.070 0 0
1 111 LYS QB 204 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 111 LYS QD 69 no 100.0 99.9 0.347 0.347 0.000 9 0 no 0.046 0 0
1 112 GLU QB 89 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.000 0 0
1 112 GLU QG 159 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 113 LEU QB 76 no 100.0 0.0 0.000 0.000 0.000 9 2 no 0.001 0 0
1 113 LEU QD 4 no 100.0 0.0 0.000 0.001 0.001 22 4 no 0.053 0 0
1 114 ARG QB 33 no 100.0 0.0 0.000 0.005 0.005 12 0 no 0.158 0 0
1 114 ARG QD 88 no 100.0 0.0 0.000 0.001 0.001 8 0 no 0.074 0 0
1 114 ARG QG 203 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 116 ASN QB 99 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 116 ASN QD 60 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.000 0 0
1 118 ASP QB 114 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 119 PRO QB 158 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 119 PRO QG 157 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 120 SER QB 156 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 121 LEU QB 87 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.000 0 0
1 121 LEU QD 3 no 80.0 100.0 1.531 1.531 0.000 24 10 no 0.008 0 0
1 122 ILE QG 37 no 100.0 0.0 0.000 0.003 0.003 12 4 no 0.083 0 0
1 123 ILE QG 113 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 124 VAL QG 28 no 100.0 0.0 0.000 0.000 0.000 13 4 no 0.000 0 0
1 125 LEU QB 155 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.009 0 0
1 125 LEU QD 36 no 100.0 0.0 0.000 0.000 0.000 12 4 no 0.030 0 0
1 126 VAL QG 10 no 90.0 100.0 0.305 0.305 0.000 17 4 no 0.020 0 0
1 127 GLY QA 154 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 128 ASN QB 25 no 100.0 0.0 0.000 0.000 0.000 14 6 no 0.054 0 0
1 129 LYS QG 86 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.000 0 0
1 130 LYS QB 59 no 40.0 100.0 0.088 0.088 0.000 10 4 no 0.000 0 0
1 130 LYS QD 153 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 130 LYS QE 130 no 100.0 0.0 0.000 0.011 0.011 6 4 no 0.140 0 0
1 130 LYS QG 30 no 100.0 0.0 0.000 0.001 0.001 13 8 no 0.094 0 0
1 131 ASP QB 112 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 132 LEU QB 58 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.000 0 0
1 132 LEU QD 85 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.036 0 0
1 134 SER QB 202 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 135 LEU QB 201 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 135 LEU QD 98 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 137 GLN QB 8 no 100.0 0.0 0.000 0.001 0.001 20 8 no 0.080 0 0
1 137 GLN QE 97 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 137 GLN QG 84 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.000 0 0
1 138 VAL QG 17 no 30.0 98.7 0.068 0.069 0.001 16 8 no 0.062 0 0
1 139 SER QB 48 no 100.0 0.0 0.000 0.000 0.000 10 0 no 0.033 0 0
1 140 PHE QB 152 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 140 PHE QD 190 no 100.0 100.0 4.912 4.913 0.001 3 2 no 0.067 0 0
1 140 PHE QE 189 no 80.0 100.0 1.343 1.343 0.000 3 2 no 0.000 0 0
1 141 GLU QB 104 no 100.0 0.0 0.000 0.000 0.000 7 0 no 0.000 0 0
1 141 GLU QG 47 no 100.0 0.0 0.000 0.000 0.000 10 0 no 0.031 0 0
1 142 ASP QB 129 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.048 0 0
1 143 GLY QA 96 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 144 GLN QB 57 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.000 0 0
1 144 GLN QE 95 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 144 GLN QG 83 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.042 0 0
1 145 ARG QB 14 no 100.0 0.0 0.000 0.001 0.001 16 4 no 0.063 0 0
1 145 ARG QD 151 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 145 ARG QG 200 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 146 LEU QB 150 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 146 LEU QD 43 no 30.0 100.0 0.008 0.008 0.000 11 4 no 0.000 0 0
1 149 GLU QB 56 no 100.0 0.0 0.000 0.001 0.001 10 4 no 0.063 0 0
1 149 GLU QG 111 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 150 GLU QB 149 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 150 GLU QG 148 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 151 GLN QB 94 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 151 GLN QE 109 no 100.0 0.0 0.000 0.000 0.000 7 4 no 0.000 0 0
1 152 LEU QB 199 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 152 LEU QD 147 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 155 PHE QB 184 no 100.0 0.0 0.000 0.000 0.000 3 0 no 0.000 0 0
1 155 PHE QD 198 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 155 PHE QE 197 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 156 TYR QB 45 no 100.0 0.0 0.000 0.000 0.000 11 6 no 0.000 0 0
1 156 TYR QD 141 no 100.0 100.0 3.360 3.360 0.000 5 2 no 0.000 0 0
1 156 TYR QE 188 no 100.0 100.0 5.719 5.719 0.000 3 1 no 0.010 0 0
1 157 GLU QB 27 no 100.0 0.0 0.000 0.000 0.000 14 12 no 0.012 0 0
1 157 GLU QG 55 no 100.0 0.0 0.000 0.001 0.001 10 4 no 0.094 0 0
1 159 SER QB 13 no 100.0 0.0 0.000 0.001 0.001 16 4 no 0.071 0 0
1 161 LYS QB 181 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.020 0 0
1 161 LYS QD 146 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 161 LYS QE 145 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 161 LYS QG 196 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 162 ASP QB 195 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 163 ASN QB 194 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 164 ASN QB 16 no 100.0 0.0 0.000 0.011 0.011 16 8 no 0.140 0 0
1 164 ASN QD 93 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 165 ASN QB 9 no 90.0 100.0 0.318 0.318 0.000 19 8 no 0.021 0 0
1 165 ASN QD 54 no 60.0 99.8 0.732 0.734 0.002 10 4 no 0.116 0 0
1 166 VAL QG 19 no 10.0 99.8 0.178 0.179 0.000 15 0 no 0.047 0 0
1 167 GLU QB 110 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 167 GLU QG 32 no 100.0 0.0 0.000 0.002 0.002 12 0 no 0.079 0 0
1 168 GLN QB 77 no 90.0 99.7 0.297 0.298 0.001 9 3 no 0.063 0 0
1 168 GLN QG 31 no 100.0 0.0 0.000 0.001 0.001 12 0 no 0.082 0 0
1 169 VAL QG 24 no 100.0 0.0 0.000 0.000 0.000 14 3 no 0.003 0 0
1 170 PHE QB 46 no 100.0 0.0 0.000 0.000 0.000 10 0 no 0.000 0 0
1 170 PHE QD 193 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 170 PHE QE 144 no 100.0 100.0 14.313 14.313 0.000 4 0 no 0.032 0 0
1 171 LEU QB 82 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.000 0 0
1 171 LEU QD 15 no 100.0 99.9 1.453 1.455 0.002 16 5 no 0.063 0 0
1 172 ASP QB 68 no 20.0 9.1 0.000 0.000 0.000 9 0 no 0.036 0 0
1 173 LEU QB 81 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.000 0 0
1 173 LEU QD 7 no 100.0 0.0 0.000 0.004 0.004 20 2 no 0.105 0 0
1 176 LYS QB 67 no 50.0 99.2 0.086 0.087 0.001 9 0 no 0.060 0 0
1 176 LYS QD 192 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 176 LYS QE 143 no 100.0 0.0 0.000 0.003 0.003 4 0 no 0.171 0 0
1 176 LYS QG 80 no 100.0 0.0 0.000 0.001 0.001 8 0 no 0.104 0 0
1 177 LEU QB 191 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
stop_
save_
Contact the webmaster for help, if required. Thursday, May 2, 2024 3:50:08 PM GMT (wattos1)