NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
536438 |
2lb6   |
17447 | cing | 4-filtered-FRED | Wattos | check | stereo assignment | distance |
data_2lb6
save_assign_stereo
_Stereo_assign_list.Sf_category stereo_assignments
_Stereo_assign_list.Triplet_count 190
_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 0.340
_Stereo_assign_list.Total_e_high_states 190.120
_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 10 HIS QB 189 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 11 ILE QG 155 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 12 GLU QB 107 no 95.0 98.3 0.337 0.343 0.006 7 0 no 0.186 0 0
1 14 ARG QB 154 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.027 0 0
1 15 GLU QB 188 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.035 0 0
1 16 GLU QB 121 no 100.0 100.0 2.561 2.562 0.000 6 1 no 0.032 0 0
1 18 SER QB 54 no 100.0 0.0 0.000 0.000 0.000 12 0 no 0.033 0 0
1 19 SER QB 81 no 100.0 0.0 0.000 0.000 0.000 10 2 no 0.030 0 0
1 21 GLY QA 156 no 100.0 100.0 1.334 1.334 0.000 4 1 no 0.000 0 0
1 23 ASN QD 187 no 0.0 0.0 0.000 0.001 0.001 2 0 no 0.090 0 0
1 24 PHE QB 92 no 100.0 100.0 0.642 0.642 0.000 9 1 no 0.014 0 0
1 25 ASN QB 87 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.000 0 0
1 25 ASN QD 46 no 100.0 0.0 0.000 0.000 0.000 14 14 no 0.000 0 0
1 26 VAL QG 53 no 100.0 0.0 0.000 0.000 0.000 12 0 no 0.043 0 0
1 27 GLU QB 103 no 100.0 100.0 2.453 2.453 0.000 8 2 no 0.000 0 0
1 27 GLU QG 89 no 100.0 0.0 0.000 0.000 0.000 10 6 no 0.005 0 0
1 28 LYS QB 32 no 100.0 100.0 1.042 1.042 0.000 16 6 no 0.003 0 0
1 28 LYS QD 27 no 100.0 100.0 1.583 1.584 0.001 17 9 no 0.036 0 0
1 28 LYS QE 153 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 28 LYS QG 45 no 100.0 99.9 2.670 2.673 0.003 14 6 no 0.081 0 0
1 29 ILE QG 24 no 100.0 100.0 3.620 3.620 0.001 17 3 no 0.108 0 0
1 30 ASN QB 6 no 100.0 99.9 3.152 3.153 0.002 22 3 no 0.068 0 0
1 30 ASN QD 190 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.000 0 0
1 31 GLY QA 186 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 32 GLU QG 152 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 33 TRP QB 126 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.000 0 0
1 34 HIS QB 91 no 100.0 100.0 1.903 1.903 0.000 9 0 no 0.015 0 0
1 36 ILE QG 23 no 100.0 99.4 2.698 2.715 0.017 17 2 no 0.151 0 0
1 37 ILE QG 97 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.040 0 0
1 38 LEU QB 34 no 100.0 100.0 1.416 1.416 0.000 15 4 no 0.000 0 0
1 38 LEU QD 63 no 100.0 0.0 0.000 0.000 0.000 12 4 no 0.000 0 0
1 40 SER QB 62 no 0.0 0.0 0.000 0.004 0.004 12 4 no 0.181 0 0
1 41 ASP QB 159 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.032 0 0
1 42 LYS QB 8 no 100.0 100.0 8.385 8.388 0.003 22 4 no 0.096 0 0
1 42 LYS QD 82 no 100.0 100.0 2.849 2.849 0.000 10 3 no 0.000 0 0
1 42 LYS QG 61 no 100.0 100.0 1.303 1.303 0.000 12 4 no 0.051 0 0
1 43 ARG QB 79 no 100.0 100.0 1.723 1.723 0.000 10 1 no 0.000 0 0
1 43 ARG QD 68 no 100.0 100.0 2.986 2.986 0.001 11 1 no 0.062 0 0
1 43 ARG QG 120 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 44 GLU QB 162 no 100.0 100.0 0.917 0.917 0.000 3 0 no 0.005 0 0
1 44 GLU QG 102 no 100.0 0.0 0.000 0.000 0.000 8 2 no 0.000 0 0
1 45 LYS QB 40 no 100.0 100.0 2.784 2.784 0.001 14 2 no 0.091 0 0
1 47 GLU QB 185 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 47 GLU QG 78 no 100.0 0.0 0.000 0.002 0.002 10 0 no 0.065 0 0
1 50 GLY QA 184 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 51 ASN QB 125 no 0.0 0.0 0.000 0.001 0.001 6 4 no 0.076 0 0
1 51 ASN QD 161 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.000 0 0
1 52 PHE QB 5 no 100.0 100.0 7.812 7.815 0.003 23 4 no 0.123 0 0
1 53 ARG QB 96 no 0.0 0.0 0.000 0.007 0.007 8 0 no 0.219 0 0
1 54 LEU QD 39 no 100.0 0.0 0.000 0.000 0.000 14 0 no 0.060 0 0
1 56 LEU QD 4 no 100.0 0.0 0.000 0.037 0.037 24 8 no 0.250 0 0
1 57 GLU QB 151 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 57 GLU QG 183 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 58 GLN QG 150 no 100.0 0.0 0.000 0.002 0.002 4 0 no 0.194 0 0
1 59 ILE QG 160 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.000 0 0
1 60 HIS QB 18 no 100.0 99.8 1.442 1.446 0.003 19 4 no 0.097 0 0
1 62 LEU QB 50 no 100.0 100.0 5.178 5.179 0.001 13 5 no 0.055 0 0
1 62 LEU QD 21 no 100.0 0.0 0.000 0.002 0.002 18 6 no 0.095 0 0
1 63 GLU QB 44 no 100.0 99.7 2.984 2.992 0.008 14 4 no 0.149 0 0
1 64 ASN QB 149 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 64 ASN QD 86 no 100.0 99.9 0.250 0.250 0.000 10 4 no 0.052 0 0
1 65 SER QB 2 no 100.0 100.0 3.904 3.906 0.002 27 4 no 0.061 0 0
1 66 LEU QB 30 no 100.0 100.0 1.256 1.256 0.000 16 3 no 0.044 0 0
1 66 LEU QD 101 no 100.0 0.0 0.000 0.000 0.000 8 2 no 0.038 0 0
1 67 VAL QG 59 no 0.0 0.0 0.000 0.004 0.004 12 2 no 0.154 0 0
1 68 LEU QB 105 no 0.0 0.0 0.000 0.005 0.005 8 6 no 0.090 0 0
1 68 LEU QD 31 no 100.0 0.0 0.000 0.010 0.010 16 6 no 0.154 0 0
1 69 LYS QB 148 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 70 PHE QB 182 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 73 VAL QG 119 no 0.0 0.0 0.000 0.000 0.000 6 0 no 0.043 0 0
1 74 ARG QG 147 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.034 0 0
1 75 ASP QB 146 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.033 0 0
1 77 GLU QG 181 no 0.0 0.0 0.000 0.000 0.000 2 0 no 0.063 0 0
1 78 CYS QB 145 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 79 SER QB 118 no 0.0 0.0 0.000 0.000 0.000 6 0 no 0.022 0 0
1 80 GLU QB 144 no 100.0 100.0 1.068 1.068 0.000 4 0 no 0.043 0 0
1 80 GLU QG 180 no 0.0 0.0 0.000 0.000 0.000 2 0 no 0.061 0 0
1 81 LEU QB 110 no 100.0 99.9 1.738 1.739 0.001 7 2 no 0.061 0 0
1 81 LEU QD 80 no 100.0 0.0 0.000 0.021 0.021 10 2 no 0.316 0 0
1 83 MET QB 11 no 100.0 100.0 6.018 6.019 0.001 21 6 no 0.044 0 0
1 83 MET QG 117 no 0.0 0.0 0.000 0.000 0.000 6 0 no 0.055 0 0
1 84 VAL QG 143 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 86 ASP QB 116 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.035 0 0
1 87 LYS QB 66 no 100.0 100.0 0.905 0.905 0.000 11 0 no 0.013 0 0
1 87 LYS QG 142 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.005 0 0
1 89 GLU QB 141 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.024 0 0
1 89 GLU QG 179 no 0.0 0.0 0.000 0.003 0.003 2 0 no 0.152 0 0
1 90 LYS QB 95 no 100.0 100.0 0.999 0.999 0.000 8 0 no 0.027 0 0
1 90 LYS QG 77 no 100.0 99.9 1.613 1.614 0.001 10 0 no 0.100 0 0
1 92 GLY QA 48 no 100.0 100.0 1.432 1.432 0.000 13 2 no 0.008 0 0
1 93 GLU QB 178 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.010 0 0
1 93 GLU QG 94 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.000 0 0
1 94 TYR QB 76 no 100.0 100.0 2.198 2.198 0.000 10 0 no 0.023 0 0
1 95 SER QB 177 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 96 VAL QG 29 no 100.0 0.0 0.000 0.009 0.009 16 2 no 0.228 0 0
1 98 TYR QB 158 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.000 0 0
1 99 ASP QB 140 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.014 0 0
1 100 GLY QA 13 no 100.0 99.9 1.181 1.182 0.001 21 12 no 0.067 0 0
1 102 ASN QB 52 no 100.0 99.8 1.677 1.680 0.004 12 0 no 0.157 0 0
1 102 ASN QD 20 no 100.0 100.0 0.674 0.674 0.000 18 4 no 0.008 0 0
1 104 PHE QB 38 no 100.0 99.6 1.502 1.508 0.006 14 0 no 0.118 0 0
1 107 PRO QB 93 no 100.0 99.9 2.378 2.380 0.002 9 3 no 0.088 0 0
1 107 PRO QD 28 no 100.0 100.0 1.343 1.343 0.000 16 2 no 0.025 0 0
1 107 PRO QG 56 no 100.0 100.0 1.246 1.247 0.000 12 1 no 0.040 0 0
1 108 LYS QB 55 no 100.0 99.8 2.893 2.898 0.006 12 1 no 0.115 0 0
1 108 LYS QD 176 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.016 0 0
1 108 LYS QE 127 no 100.0 0.0 0.000 0.000 0.000 6 6 no 0.017 0 0
1 108 LYS QG 69 no 100.0 100.0 2.321 2.321 0.000 11 2 no 0.024 0 0
1 110 ASP QB 58 no 100.0 100.0 3.260 3.260 0.001 12 2 no 0.041 0 0
1 111 TYR QB 37 no 100.0 99.9 3.467 3.470 0.003 15 9 no 0.081 0 0
1 112 ASP QB 139 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 113 ASN QB 47 no 100.0 100.0 0.631 0.631 0.000 13 1 no 0.000 0 0
1 113 ASN QD 109 no 100.0 100.0 3.253 3.253 0.000 7 2 no 0.000 0 0
1 114 PHE QB 26 no 100.0 100.0 3.440 3.441 0.000 17 8 no 0.050 0 0
1 115 LEU QB 36 no 100.0 100.0 3.617 3.617 0.000 15 5 no 0.016 0 0
1 115 LEU QD 1 no 0.0 0.0 0.000 0.032 0.032 30 4 no 0.161 0 0
1 118 HIS QB 60 no 100.0 100.0 1.165 1.165 0.000 12 3 no 0.049 0 0
1 119 LEU QD 57 no 0.0 0.0 0.000 0.006 0.006 12 2 no 0.121 0 0
1 120 ILE QG 22 no 100.0 100.0 3.982 3.983 0.001 17 2 no 0.075 0 0
1 121 ASN QB 138 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 122 GLU QB 90 no 100.0 100.0 3.600 3.601 0.001 9 0 no 0.098 0 0
1 122 GLU QG 137 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.007 0 0
1 123 LYS QB 14 no 100.0 100.0 2.591 2.591 0.000 20 10 no 0.035 0 0
1 123 LYS QD 104 no 100.0 0.0 0.000 0.000 0.000 8 6 no 0.000 0 0
1 123 LYS QE 65 no 100.0 0.0 0.000 0.000 0.000 12 10 no 0.058 0 0
1 123 LYS QG 64 no 100.0 0.0 0.000 0.000 0.000 12 6 no 0.058 0 0
1 124 ASP QB 136 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.012 0 0
1 125 GLY QA 99 no 100.0 100.0 0.454 0.454 0.000 8 1 no 0.008 0 0
1 126 GLU QB 108 no 100.0 100.0 4.894 4.894 0.000 7 1 no 0.010 0 0
1 126 GLU QG 75 no 100.0 100.0 1.981 1.981 0.000 10 0 no 0.001 0 0
1 128 PHE QB 51 no 100.0 99.8 2.659 2.665 0.007 13 7 no 0.164 0 0
1 129 GLN QB 85 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.033 0 0
1 129 GLN QE 70 no 100.0 99.9 0.270 0.270 0.000 11 3 no 0.029 0 0
1 129 GLN QG 115 no 100.0 0.0 0.000 0.001 0.001 6 0 no 0.080 0 0
1 130 LEU QB 17 no 100.0 99.8 2.599 2.603 0.004 19 4 no 0.148 0 0
1 130 LEU QD 10 no 100.0 0.0 0.000 0.002 0.002 22 10 no 0.123 0 0
1 131 MET QB 128 no 100.0 100.0 1.853 1.854 0.000 5 0 no 0.030 0 0
1 132 GLY QA 135 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 133 LEU QB 84 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.026 0 0
1 133 LEU QD 3 no 95.0 0.0 0.000 0.016 0.016 26 14 no 0.236 0 0
1 134 TYR QB 19 no 100.0 100.0 1.505 1.505 0.000 19 5 no 0.035 0 0
1 135 GLY QA 12 no 100.0 99.3 2.025 2.040 0.015 21 9 no 0.236 0 0
1 136 ARG QB 175 no 100.0 0.0 0.000 0.009 0.009 2 0 no 0.185 0 0
1 137 GLU QB 88 no 100.0 100.0 1.856 1.856 0.001 10 6 no 0.114 0 0
1 137 GLU QG 134 no 100.0 0.0 0.000 0.001 0.001 4 0 no 0.108 0 0
1 138 PRO QB 174 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 138 PRO QD 71 no 100.0 99.8 0.538 0.538 0.001 11 4 no 0.114 0 0
1 138 PRO QG 123 no 100.0 100.0 1.082 1.082 0.000 6 2 no 0.000 0 0
1 139 ASP QB 133 no 0.0 0.0 0.000 0.002 0.002 4 0 no 0.149 0 0
1 140 LEU QB 16 no 100.0 100.0 4.101 4.101 0.000 19 3 no 0.039 0 0
1 140 LEU QD 9 no 100.0 0.0 0.000 0.001 0.001 22 6 no 0.060 0 0
1 141 SER QB 74 no 100.0 0.0 0.000 0.000 0.000 10 0 no 0.004 0 0
1 143 ASP QB 100 no 100.0 0.0 0.000 0.000 0.000 8 2 no 0.001 0 0
1 144 ILE QG 42 no 100.0 100.0 2.311 2.312 0.000 14 3 no 0.050 0 0
1 145 LYS QB 98 no 100.0 100.0 1.189 1.189 0.000 8 1 no 0.077 0 0
1 146 GLU QB 114 no 100.0 100.0 2.505 2.505 0.000 6 0 no 0.000 0 0
1 146 GLU QG 49 no 100.0 100.0 1.857 1.857 0.000 13 4 no 0.022 0 0
1 147 ARG QB 41 no 100.0 100.0 3.894 3.894 0.000 14 3 no 0.013 0 0
1 147 ARG QD 132 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.005 0 0
1 147 ARG QG 67 no 100.0 100.0 4.343 4.343 0.000 11 1 no 0.015 0 0
1 148 PHE QB 35 no 100.0 99.9 1.661 1.663 0.002 15 5 no 0.087 0 0
1 150 GLN QB 163 no 100.0 100.0 1.296 1.296 0.000 3 1 no 0.030 0 0
1 150 GLN QE 72 no 100.0 100.0 3.976 3.976 0.000 11 9 no 0.022 0 0
1 150 GLN QG 25 no 100.0 100.0 0.472 0.472 0.000 17 5 no 0.023 0 0
1 151 LEU QB 83 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.062 0 0
1 151 LEU QD 33 no 100.0 0.0 0.000 0.000 0.000 16 10 no 0.038 0 0
1 152 CYS QB 73 no 100.0 0.0 0.000 0.000 0.000 10 0 no 0.044 0 0
1 153 GLU QB 131 no 100.0 100.0 0.593 0.593 0.000 4 0 no 0.052 0 0
1 153 GLU QG 173 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 154 GLU QB 113 no 100.0 0.0 0.000 0.005 0.005 6 0 no 0.327 0 0
1 154 GLU QG 172 no 100.0 0.0 0.000 0.001 0.001 2 0 no 0.132 0 0
1 155 HIS QB 112 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 156 GLY QA 171 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 157 ILE QG 15 no 100.0 100.0 6.162 6.163 0.001 19 3 no 0.069 0 0
1 158 LEU QB 7 no 100.0 99.9 2.715 2.718 0.003 22 4 no 0.131 0 0
1 158 LEU QD 157 no 100.0 0.0 0.000 0.007 0.007 4 2 no 0.097 0 0
1 159 ARG QB 170 no 100.0 0.0 0.000 0.014 0.014 2 0 no 0.359 0 0
1 159 ARG QD 169 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.043 0 0
1 161 ASN QB 111 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 161 ASN QD 122 no 100.0 0.0 0.000 0.001 0.001 6 2 no 0.131 0 0
1 162 ILE QG 106 no 100.0 100.0 1.616 1.616 0.001 7 0 no 0.062 0 0
1 163 ILE QG 168 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 164 ASP QB 130 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.026 0 0
1 165 LEU QB 124 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.000 0 0
1 165 LEU QD 43 no 100.0 0.0 0.000 0.000 0.000 14 4 no 0.040 0 0
1 167 ASN QB 129 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.042 0 0
1 171 CYS QB 167 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 172 LEU QD 166 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 173 GLN QB 165 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.008 0 0
1 175 ARG QB 164 no 100.0 0.0 0.000 0.010 0.010 2 0 no 0.320 0 0
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