NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
546319 |
2lul   |
18526 | cing | 4-filtered-FRED | Wattos | check | stereo assignment | distance |
data_2lul
save_assign_stereo
_Stereo_assign_list.Sf_category stereo_assignments
_Stereo_assign_list.Triplet_count 228
_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 20
_Stereo_assign_list.Total_e_low_states 0.140
_Stereo_assign_list.Total_e_high_states 175.846
_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 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 153 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 12 ASN QB 73 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 12 ASN QD 170 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.000 0 0
1 13 PHE QB 93 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 14 ASN QB 152 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 14 ASN QD 223 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 16 ILE QG 49 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.000 0 0
1 17 LEU QB 98 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.000 0 0
1 17 LEU QD 6 no 100.0 100.0 19.607 19.608 0.001 44 14 no 0.074 0 0
1 18 GLU QB 29 no 100.0 0.0 0.000 0.000 0.000 12 6 no 0.000 0 0
1 18 GLU QG 109 no 100.0 0.0 0.000 0.003 0.003 6 4 no 0.235 0 0
1 19 GLU QB 39 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.022 0 0
1 19 GLU QG 228 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.000 0 0
1 20 ILE QG 151 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 21 LEU QB 54 no 100.0 0.0 0.000 0.000 0.000 8 2 no 0.000 0 0
1 21 LEU QD 4 no 100.0 100.0 2.730 2.730 0.000 47 14 no 0.064 0 0
1 22 ILE QG 72 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 23 LYS QB 45 no 100.0 0.0 0.000 0.000 0.000 10 8 no 0.000 0 0
1 23 LYS QD 43 no 100.0 0.0 0.000 0.000 0.000 10 6 no 0.025 0 0
1 23 LYS QE 44 no 100.0 0.0 0.000 0.000 0.000 10 8 no 0.000 0 0
1 23 LYS QG 162 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.025 0 0
1 24 ARG QB 222 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.062 0 0
1 24 ARG QD 161 no 100.0 0.0 0.000 0.001 0.001 4 2 no 0.079 0 0
1 24 ARG QG 221 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 25 SER QB 108 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.077 0 0
1 27 GLN QB 110 no 100.0 0.0 0.000 0.003 0.003 6 6 no 0.151 0 0
1 27 GLN QE 227 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.002 0 0
1 27 GLN QG 169 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.051 0 0
1 30 LYS QB 150 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.038 0 0
1 30 LYS QD 220 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 32 SER QB 71 no 0.0 0.0 0.000 0.003 0.003 8 4 no 0.144 0 0
1 33 PRO QB 219 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 33 PRO QD 218 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 33 PRO QG 217 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 34 LEU QB 70 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 34 LEU QD 15 no 100.0 99.9 7.652 7.658 0.006 31 14 no 0.197 0 0
1 35 ASN QB 69 no 0.0 0.0 0.000 0.000 0.000 8 4 no 0.077 0 0
1 36 TYR QB 149 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 37 LYS QB 148 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 37 LYS QD 147 no 100.0 0.0 0.000 0.002 0.002 4 0 no 0.177 0 0
1 37 LYS QG 48 no 100.0 0.0 0.000 0.002 0.002 8 0 no 0.179 0 0
1 38 GLU QB 146 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 38 GLU QG 26 no 100.0 0.0 0.000 0.000 0.000 12 4 no 0.060 0 0
1 39 ARG QD 145 no 100.0 0.0 0.000 0.004 0.004 4 0 no 0.232 0 0
1 39 ARG QG 144 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 40 LEU QB 107 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.000 0 0
1 40 LEU QD 12 no 100.0 100.0 13.831 13.834 0.003 37 14 no 0.235 0 0
1 41 PHE QB 53 no 100.0 0.0 0.000 0.000 0.000 8 2 no 0.000 0 0
1 42 VAL QG 13 no 100.0 100.0 9.425 9.425 0.000 34 6 no 0.003 0 0
1 43 LEU QB 42 no 100.0 0.0 0.000 0.000 0.000 10 6 no 0.022 0 0
1 43 LEU QD 2 no 100.0 100.0 18.077 18.081 0.005 50 16 no 0.167 0 0
1 45 LYS QD 216 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.043 0 0
1 45 LYS QE 215 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 45 LYS QG 92 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.073 0 0
1 46 SER QB 160 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.000 0 0
1 47 MET QG 22 no 100.0 0.0 0.000 0.000 0.000 14 2 no 0.000 0 0
1 48 LEU QB 28 no 100.0 0.0 0.000 0.000 0.000 12 6 no 0.000 0 0
1 48 LEU QD 3 no 100.0 100.0 13.020 13.020 0.000 48 11 no 0.000 0 0
1 50 TYR QB 214 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 51 TYR QB 159 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.000 0 0
1 52 GLU QB 143 no 100.0 0.0 0.000 0.001 0.001 4 0 no 0.156 0 0
1 52 GLU QG 213 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 54 ARG QB 142 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.067 0 0
1 54 ARG QG 212 no 100.0 0.0 0.000 0.001 0.001 2 0 no 0.095 0 0
1 57 LYS QG 211 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 58 LYS QB 210 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 58 LYS QD 209 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 58 LYS QG 208 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 61 LYS QB 207 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 61 LYS QD 206 no 100.0 0.0 0.000 0.002 0.002 2 0 no 0.114 0 0
1 62 GLY QA 141 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.086 0 0
1 63 PHE QB 140 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 64 ILE QG 139 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 65 ASP QB 20 no 0.0 0.0 0.000 0.006 0.006 16 8 no 0.136 0 0
1 66 VAL QG 10 no 100.0 100.0 13.459 13.464 0.005 38 10 no 0.167 0 0
1 67 SER QB 138 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 68 LYS QB 68 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 68 LYS QD 31 no 0.0 0.0 0.000 0.006 0.006 12 8 no 0.136 0 0
1 68 LYS QE 106 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.000 0 0
1 68 LYS QG 30 no 100.0 0.0 0.000 0.000 0.000 12 8 no 0.029 0 0
1 69 ILE QG 137 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 70 LYS QB 41 no 100.0 0.0 0.000 0.000 0.000 10 6 no 0.025 0 0
1 70 LYS QD 205 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 70 LYS QE 136 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 70 LYS QG 204 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 71 CYS QB 135 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 72 VAL QG 9 no 100.0 100.0 11.027 11.029 0.002 41 7 no 0.098 0 0
1 73 GLU QB 203 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 73 GLU QG 91 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 74 ILE QG 97 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.000 0 0
1 75 VAL QG 8 no 100.0 100.0 6.678 6.679 0.000 42 4 no 0.058 0 0
1 76 LYS QB 105 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.000 0 0
1 76 LYS QD 202 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 76 LYS QE 168 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.000 0 0
1 76 LYS QG 134 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 77 ASN QB 67 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 77 ASN QD 104 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.035 0 0
1 79 ASP QB 133 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 80 GLY QA 158 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.000 0 0
1 81 VAL QG 21 no 100.0 100.0 4.492 4.493 0.001 15 4 no 0.116 0 0
1 82 ILE QG 132 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 83 PRO QB 201 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 83 PRO QD 23 no 100.0 0.0 0.000 0.000 0.000 12 2 no 0.000 0 0
1 83 PRO QG 200 no 100.0 0.0 0.000 0.002 0.002 2 0 no 0.195 0 0
1 84 CYS QB 33 no 100.0 0.0 0.000 0.000 0.000 10 0 no 0.000 0 0
1 85 GLN QB 131 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 85 GLN QE 199 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.028 0 0
1 85 GLN QG 32 no 100.0 0.0 0.000 0.000 0.000 10 0 no 0.000 0 0
1 86 ASN QD 130 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 89 PRO QB 198 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 89 PRO QD 197 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 89 PRO QG 157 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.000 0 0
1 90 PHE QB 96 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.000 0 0
1 91 GLN QB 90 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 91 GLN QE 156 no 100.0 0.0 0.000 0.001 0.001 4 2 no 0.115 0 0
1 91 GLN QG 129 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 92 VAL QG 11 no 100.0 100.0 11.799 11.799 0.000 37 10 no 0.000 0 0
1 93 VAL QG 17 no 100.0 99.9 3.786 3.789 0.003 26 2 no 0.104 0 0
1 94 HIS QB 52 no 100.0 0.0 0.000 0.000 0.000 8 2 no 0.000 0 0
1 95 ASP QB 128 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 97 ASN QB 196 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 99 LEU QB 25 no 100.0 0.0 0.000 0.000 0.000 12 4 no 0.000 0 0
1 99 LEU QD 5 no 100.0 100.0 4.518 4.519 0.002 45 13 no 0.098 0 0
1 100 TYR QB 195 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 101 ILE QG 89 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 104 PRO QD 155 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.011 0 0
1 105 SER QB 167 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.000 0 0
1 106 PRO QB 127 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 106 PRO QD 66 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 107 GLN QB 194 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 107 GLN QE 166 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.000 0 0
1 107 GLN QG 65 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 108 SER QB 51 no 100.0 0.0 0.000 0.000 0.000 8 2 no 0.000 0 0
1 109 ARG QB 126 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 109 ARG QD 193 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 109 ARG QG 226 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.000 0 0
1 110 ASP QB 88 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 111 LEU QB 64 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 111 LEU QD 16 no 100.0 100.0 19.921 19.922 0.001 30 9 no 0.079 0 0
1 112 TRP QB 47 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.000 0 0
1 113 VAL QG 7 no 100.0 100.0 7.197 7.197 0.000 43 10 no 0.043 0 0
1 114 LYS QB 38 no 100.0 0.0 0.000 0.004 0.004 10 4 no 0.277 0 0
1 114 LYS QD 40 no 100.0 0.0 0.000 0.001 0.001 10 6 no 0.105 0 0
1 114 LYS QG 87 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 115 LYS QB 37 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.000 0 0
1 115 LYS QD 50 no 100.0 0.0 0.000 0.005 0.005 8 2 no 0.306 0 0
1 115 LYS QE 225 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.072 0 0
1 115 LYS QG 95 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.074 0 0
1 116 LEU QB 63 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 116 LEU QD 14 no 100.0 100.0 1.372 1.372 0.000 32 10 no 0.077 0 0
1 117 LYS QB 125 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 117 LYS QG 192 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 118 GLU QB 124 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 118 GLU QG 86 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 119 GLU QB 94 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.037 0 0
1 119 GLU QG 85 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 120 ILE QG 35 no 100.0 0.0 0.000 0.002 0.002 10 2 no 0.111 0 0
1 121 LYS QB 154 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.088 0 0
1 121 LYS QD 165 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.000 0 0
1 121 LYS QE 62 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 121 LYS QG 27 no 100.0 0.0 0.000 0.000 0.000 12 6 no 0.000 0 0
1 122 ASN QB 61 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 122 ASN QD 60 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 123 ASN QB 191 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.071 0 0
1 123 ASN QD 123 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 124 ASN QB 190 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 125 ASN QB 59 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 125 ASN QD 103 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.000 0 0
1 126 ILE QG 34 no 100.0 0.0 0.000 0.000 0.000 10 2 no 0.000 0 0
1 127 MET QB 84 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 127 MET QG 36 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.000 0 0
1 128 ILE QG 83 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 129 LYS QB 58 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 129 LYS QD 19 no 0.0 0.0 0.000 0.009 0.009 16 4 no 0.203 0 0
1 129 LYS QE 82 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.044 0 0
1 129 LYS QG 81 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.021 0 0
1 130 TYR QB 122 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 131 HIS QB 189 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 132 PRO QB 188 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 132 PRO QD 121 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 132 PRO QG 120 no 100.0 0.0 0.000 0.001 0.001 4 0 no 0.093 0 0
1 133 LYS QB 80 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.021 0 0
1 133 LYS QD 187 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 133 LYS QG 79 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.045 0 0
1 134 PHE QB 186 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 137 ASP QB 185 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.059 0 0
1 139 SER QB 78 no 100.0 0.0 0.000 0.016 0.016 6 0 no 0.251 0 0
1 140 TYR QB 184 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 141 GLN QB 183 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.025 0 0
1 141 GLN QE 182 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.082 0 0
1 141 GLN QG 46 no 100.0 0.0 0.000 0.002 0.002 8 0 no 0.203 0 0
1 143 CYS QB 164 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.000 0 0
1 144 ARG QD 119 no 100.0 0.0 0.000 0.001 0.001 4 0 no 0.138 0 0
1 144 ARG QG 181 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 145 GLN QB 57 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 145 GLN QE 56 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.049 0 0
1 145 GLN QG 118 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 147 GLU QB 180 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 147 GLU QG 117 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 148 LYS QB 102 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.068 0 0
1 148 LYS QD 179 no 100.0 0.0 0.000 0.001 0.001 2 0 no 0.133 0 0
1 148 LYS QE 163 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.068 0 0
1 148 LYS QG 116 no 100.0 0.0 0.000 0.001 0.001 4 0 no 0.130 0 0
1 149 LEU QB 101 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.000 0 0
1 149 LEU QD 18 no 100.0 99.1 0.805 0.813 0.008 18 4 no 0.173 0 0
1 151 PRO QD 77 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 151 PRO QG 115 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 152 GLY QA 114 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 153 CYS QB 100 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.000 0 0
1 154 GLU QB 178 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 154 GLU QG 76 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.024 0 0
1 155 LYS QD 75 no 100.0 0.0 0.000 0.008 0.008 6 0 no 0.252 0 0
1 155 LYS QG 177 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 156 TYR QB 176 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 157 ASN QB 55 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 157 ASN QD 99 no 100.0 0.0 0.000 0.001 0.001 6 4 no 0.141 0 0
1 158 LEU QB 24 no 100.0 0.0 0.000 0.000 0.000 12 4 no 0.000 0 0
1 158 LEU QD 1 no 100.0 99.9 6.310 6.316 0.006 57 16 no 0.127 0 0
1 159 PHE QB 175 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 160 GLU QB 113 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 160 GLU QG 112 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 161 SER QB 174 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 162 SER QB 111 no 100.0 0.0 0.000 0.005 0.005 4 0 no 0.154 0 0
1 163 ILE QG 74 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 164 ARG QB 173 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 164 ARG QD 172 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 164 ARG QG 171 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.015 0 0
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