NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
629432 |
6emr   |
34182 | cing | 4-filtered-FRED | Wattos | check | stereo assignment | distance |
data_6emr
save_assign_stereo
_Stereo_assign_list.Sf_category stereo_assignments
_Stereo_assign_list.Triplet_count 184
_Stereo_assign_list.Swap_count 1
_Stereo_assign_list.Swap_percentage 0.5
_Stereo_assign_list.Deassign_count 0
_Stereo_assign_list.Deassign_percentage 0.0
_Stereo_assign_list.Model_count 40
_Stereo_assign_list.Total_e_low_states 0.058
_Stereo_assign_list.Total_e_high_states 67.568
_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 5 SER QB 183 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 7 GLU QB 112 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.003 0 0
1 7 GLU QG 22 no 100.0 0.0 0.000 0.000 0.000 10 0 no 0.037 0 0
1 10 MET QB 182 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 10 MET QG 59 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.020 0 0
1 13 ARG QD 33 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 13 ARG QG 181 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.008 0 0
1 14 LEU QB 180 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 14 LEU QD 4 no 0.0 0.0 0.000 0.004 0.004 24 8 no 0.139 0 0
1 15 GLN QB 111 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 15 GLN QG 53 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.023 0 0
1 16 ARG QB 179 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 16 ARG QG 110 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 18 HIS QB 52 no 100.0 100.0 1.246 1.246 0.000 6 0 no 0.000 0 0
1 20 GLU QB 27 no 100.0 100.0 1.574 1.574 0.000 8 0 no 0.094 0 0
1 20 GLU QG 109 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 21 ILE QG 21 no 100.0 100.0 1.076 1.076 0.000 10 0 no 0.011 0 0
1 22 LYS QB 178 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 22 LYS QD 177 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.019 0 0
1 22 LYS QE 184 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.043 0 0
1 22 LYS QG 176 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 23 ASN QB 108 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 23 ASN QD 55 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.064 0 0
1 25 LEU QB 175 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 25 LEU QD 2 no 92.5 0.0 0.000 0.003 0.003 24 4 no 0.088 0 0
1 26 LYS QG 29 no 100.0 0.0 0.000 0.000 0.000 8 2 no 0.000 0 0
1 27 ILE QG 51 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.005 0 0
1 29 ASN QB 50 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.058 0 0
1 30 LEU QB 58 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.000 0 0
1 30 LEU QD 3 no 100.0 0.0 0.000 0.004 0.004 24 8 no 0.201 0 0
1 32 VAL QG 107 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.029 0 0
1 33 ASN QB 106 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.004 0 0
1 33 ASN QD 174 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.012 0 0
1 34 ARG QD 173 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 34 ARG QG 105 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 35 CYS QB 172 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 37 GLU QB 104 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 37 GLU QG 103 no 0.0 0.0 0.000 0.000 0.000 4 0 no 0.033 0 0
1 39 LEU QB 57 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.000 0 0
1 39 LEU QD 7 no 0.0 0.0 0.000 0.001 0.001 22 8 no 0.064 0 0
1 40 ASP QB 102 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 41 GLU QG 49 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.117 0 0
1 42 LEU QB 101 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 42 LEU QD 16 no 97.5 0.0 0.000 0.001 0.001 12 0 no 0.064 0 0
1 44 SER QB 171 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 45 LEU QB 32 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 45 LEU QD 6 no 100.0 0.0 0.000 0.000 0.000 22 8 no 0.042 0 0
1 46 GLN QB 100 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 46 GLN QG 24 no 100.0 100.0 0.721 0.721 0.000 9 0 no 0.025 0 0
1 47 VAL QG 10 no 95.0 0.0 0.000 0.004 0.004 18 4 no 0.139 0 0
1 49 MET QG 25 no 100.0 100.0 3.636 3.637 0.001 9 1 no 0.054 0 0
1 50 GLN QB 48 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.054 0 0
1 50 GLN QG 99 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.001 0 0
1 51 GLN QB 98 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 53 GLN QB 47 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 53 GLN QE 113 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.014 0 0
1 53 GLN QG 5 no 100.0 100.0 1.565 1.566 0.000 22 2 no 0.013 0 0
1 54 LYS QG 170 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.008 0 0
1 55 HIS QB 97 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 57 GLU QG 169 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 58 MET QB 168 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 59 ILE QG 96 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 62 LEU QD 26 no 0.0 0.0 0.000 0.000 0.000 8 0 no 0.038 0 0
1 63 LYS QB 167 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 63 LYS QG 166 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 64 LYS QB 46 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 64 LYS QD 15 no 100.0 0.0 0.000 0.000 0.000 12 0 no 0.030 0 0
1 64 LYS QE 165 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.018 0 0
1 64 LYS QG 95 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 65 ILE QG 164 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 67 ARG QG 94 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 69 LYS QB 163 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 69 LYS QG 93 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.036 0 0
1 70 VAL QG 11 no 0.0 0.0 0.000 0.001 0.001 16 0 no 0.068 0 0
1 71 SER QB 162 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 72 GLN QB 161 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 73 VAL QG 13 no 0.0 0.0 0.000 0.000 0.000 16 4 no 0.045 0 0
1 74 ILE QG 160 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 75 MET QG 92 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 76 GLU QB 91 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.010 0 0
1 76 GLU QG 159 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.004 0 0
1 77 LYS QE 31 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.068 0 0
1 77 LYS QG 158 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 78 SER QB 30 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 80 MET QG 45 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 81 LEU QB 157 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 81 LEU QD 9 no 100.0 0.0 0.000 0.000 0.000 18 0 no 0.017 0 0
1 83 ASN QB 90 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 83 ASN QD 156 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.045 0 0
1 84 LYS QD 89 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 84 LYS QG 19 no 100.0 100.0 1.189 1.189 0.000 11 0 no 0.015 0 0
1 85 PHE QB 88 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 86 LYS QB 87 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 86 LYS QE 155 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.021 0 0
1 88 MET QB 44 no 100.0 100.0 1.621 1.621 0.000 6 0 no 0.006 0 0
1 88 MET QG 17 no 100.0 100.0 1.952 1.953 0.001 12 1 no 0.066 0 0
1 89 PHE QB 43 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 90 LEU QB 34 no 100.0 100.0 1.280 1.280 0.000 7 1 no 0.017 0 0
1 90 LEU QD 8 no 100.0 99.9 16.719 16.739 0.020 19 1 no 0.222 0 0
1 93 GLU QB 154 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.030 0 0
1 96 SER QB 86 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.021 0 0
1 98 ILE QG 42 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.005 0 0
1 100 GLN QB 153 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.036 0 0
1 102 LEU QB 85 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.027 0 0
1 102 LEU QD 152 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.010 0 0
1 103 ASN QB 84 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.022 0 0
1 104 LYS QG 151 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.019 0 0
1 106 LEU QB 83 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.033 0 0
1 106 LEU QD 150 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 107 SER QB 149 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.002 0 0
1 111 ASN QB 56 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.038 0 0
1 111 ASN QD 115 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.018 0 0
1 112 GLU QB 148 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 114 LYS QB 147 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 114 LYS QG 82 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.021 0 0
1 115 ASP QB 81 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.007 0 0
1 116 LEU QB 80 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.054 0 0
1 116 LEU QD 41 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 117 PHE QB 79 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.038 0 0
1 119 SER QB 78 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 122 GLU QB 146 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.031 0 0
1 125 ASN QB 40 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.043 0 0
1 126 GLU QB 145 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 129 ASN QB 20 no 100.0 99.9 0.248 0.248 0.000 11 1 no 0.022 0 0
1 129 ASN QD 60 yes 100.0 99.9 0.497 0.497 0.001 5 1 no 0.061 0 0
1 130 LEU QB 12 no 100.0 100.0 2.608 2.609 0.001 16 2 no 0.070 0 0
1 130 LEU QD 23 no 100.0 0.0 0.000 0.000 0.000 10 2 no 0.000 0 0
1 131 ILE QG 18 no 100.0 100.0 1.770 1.770 0.000 11 0 no 0.016 0 0
1 134 ILE QG 77 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.026 0 0
1 135 PHE QB 76 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 137 GLU QG 144 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 138 SER QB 143 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 139 GLY QA 142 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.003 0 0
1 140 ASP QB 75 no 0.0 0.0 0.000 0.000 0.000 4 0 no 0.039 0 0
1 143 GLU QB 141 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.010 0 0
1 144 GLU QB 140 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.050 0 0
1 145 GLU QB 74 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.015 0 0
1 145 GLU QG 73 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.007 0 0
1 148 GLY QA 39 no 100.0 100.0 1.715 1.715 0.000 6 0 no 0.000 0 0
1 149 PHE QB 114 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.017 0 0
1 150 ASN QB 14 no 100.0 99.9 2.643 2.645 0.001 12 0 no 0.096 0 0
1 150 ASN QD 72 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.049 0 0
1 151 GLN QB 139 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 151 GLN QE 138 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 152 GLU QB 71 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.025 0 0
1 153 ASP QB 28 no 100.0 0.0 0.000 0.000 0.000 8 2 no 0.016 0 0
1 154 LEU QB 54 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.000 0 0
1 154 LEU QD 1 no 100.0 100.0 25.449 25.452 0.003 53 14 no 0.171 0 0
1 155 GLU QG 137 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.004 0 0
1 157 GLU QB 136 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.004 0 0
1 158 LYS QB 135 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.023 0 0
1 158 LYS QD 134 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.012 0 0
1 158 LYS QG 133 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 159 GLY QA 132 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 160 GLU QB 70 no 0.0 0.0 0.000 0.000 0.000 4 0 no 0.025 0 0
1 162 GLN QB 69 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.045 0 0
1 164 LYS QB 68 no 0.0 0.0 0.000 0.000 0.000 4 0 no 0.024 0 0
1 165 GLU QB 67 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.002 0 0
1 168 ASP QB 66 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.029 0 0
1 169 SER QB 131 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 171 SER QB 130 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 172 ASP QB 129 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 173 ASP QB 128 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 175 ILE QG 38 no 0.0 0.0 0.000 0.000 0.000 6 0 no 0.014 0 0
1 176 LYS QG 127 no 0.0 0.0 0.000 0.000 0.000 2 0 no 0.022 0 0
1 177 ARG QB 126 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 182 ASP QB 125 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 183 PHE QB 65 no 0.0 0.0 0.000 0.000 0.000 4 0 no 0.027 0 0
1 184 LEU QB 124 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.021 0 0
1 184 LEU QD 37 no 0.0 0.0 0.000 0.007 0.007 6 0 no 0.188 0 0
1 185 SER QB 123 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 187 PHE QB 64 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 188 GLU QB 122 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 188 GLU QG 121 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.043 0 0
1 189 MET QB 63 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 189 MET QG 36 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.007 0 0
1 190 MET QB 120 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 191 LEU QB 62 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.005 0 0
1 191 LEU QD 35 no 100.0 0.0 0.000 0.001 0.001 6 0 no 0.069 0 0
1 192 GLN QB 119 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.008 0 0
1 192 GLN QG 118 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.007 0 0
1 193 ARG QG 61 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 194 LYS QB 117 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 205 ARG QB 116 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.017 0 0
stop_
save_
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