NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
630088 | 6alk | 25590 | cing | 4-filtered-FRED | Wattos | check | stereo assignment | distance |
data_6alk save_assign_stereo _Stereo_assign_list.Sf_category stereo_assignments _Stereo_assign_list.Triplet_count 181 _Stereo_assign_list.Swap_count 33 _Stereo_assign_list.Swap_percentage 18.2 _Stereo_assign_list.Deassign_count 43 _Stereo_assign_list.Deassign_percentage 23.8 _Stereo_assign_list.Model_count 20 _Stereo_assign_list.Total_e_low_states 41.265 _Stereo_assign_list.Total_e_high_states 199.284 _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 2 VAL QG 2 no 95.0 93.0 3.764 4.047 0.283 17 3 yes 1.668 1 5 1 3 PHE QB 64 no 100.0 87.6 1.941 2.216 0.275 7 1 no 0.084 0 0 1 5 TYR QB 33 yes 95.0 98.0 0.183 0.186 0.004 10 2 no 0.245 0 0 1 6 GLU QB 70 no 65.0 94.1 0.214 0.228 0.014 7 4 no 0.245 0 0 1 6 GLU QG 58 no 75.0 94.8 0.850 0.896 0.046 8 4 no 0.793 0 1 1 8 GLU QB 126 no 5.0 100.0 0.011 0.011 0.000 3 1 no 0.000 0 0 1 8 GLU QG 14 no 65.0 2.5 0.035 1.409 1.374 12 3 yes 1.792 13 15 1 12 VAL QG 29 no 95.0 92.1 2.450 2.660 0.211 10 1 yes 1.400 3 3 1 13 ILE QG 169 no 100.0 100.0 0.026 0.026 0.000 1 0 no 0.721 0 1 1 15 PRO QB 81 yes 100.0 100.0 0.125 0.125 0.000 6 2 no 0.000 0 0 1 15 PRO QD 63 no 100.0 100.0 0.057 0.057 0.000 7 1 no 0.463 0 0 1 15 PRO QG 42 no 100.0 99.8 2.596 2.600 0.004 9 2 no 0.115 0 0 1 17 ARG QB 69 yes 100.0 94.3 4.221 4.477 0.256 7 4 no 0.200 0 0 1 17 ARG QD 181 no 100.0 0.0 0.000 0.000 0.000 1 1 no 0.000 0 0 1 17 ARG QG 80 yes 100.0 98.1 0.707 0.721 0.014 6 2 no 0.200 0 0 1 17 ARG QH1 37 yes 100.0 96.4 3.548 3.682 0.134 10 6 yes 1.027 1 3 1 18 LEU QB 68 yes 100.0 99.2 1.301 1.311 0.010 7 3 no 0.094 0 0 1 18 LEU QD 44 no 70.0 84.1 1.661 1.975 0.314 9 3 yes 1.326 3 4 1 19 PHE QB 18 no 100.0 74.9 3.838 5.126 1.288 12 4 no 0.094 0 0 1 20 LYS QB 36 no 60.0 47.1 0.182 0.386 0.204 10 4 yes 0.760 0 12 1 20 LYS QD 111 no 90.0 86.3 0.001 0.001 0.000 4 3 no 0.000 0 0 1 20 LYS QE 19 no 65.0 40.7 0.247 0.606 0.360 12 9 yes 1.507 3 7 1 20 LYS QG 83 no 25.0 94.9 0.060 0.063 0.003 6 4 no 0.159 0 0 1 22 PHE QB 47 yes 95.0 71.1 5.432 7.643 2.211 9 5 no 0.252 0 0 1 23 VAL QG 53 yes 100.0 100.0 2.017 2.017 0.000 8 1 no 0.000 0 0 1 25 ASP QB 141 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0 1 27 ASP QB 65 no 90.0 83.9 0.856 1.020 0.164 7 2 yes 1.069 1 2 1 28 ASN QB 122 yes 90.0 99.8 0.245 0.246 0.000 3 0 no 0.077 0 0 1 29 LEU QB 10 yes 100.0 100.0 0.187 0.187 0.000 14 4 no 0.007 0 0 1 29 LEU QD 22 no 75.0 82.8 3.670 4.433 0.763 11 3 yes 2.388 4 11 1 30 ILE QG 86 no 40.0 74.9 0.582 0.777 0.195 5 0 yes 1.691 7 8 1 31 PRO QB 121 no 100.0 100.0 0.470 0.470 0.000 3 0 no 0.000 0 0 1 31 PRO QD 23 no 100.0 98.9 2.048 2.071 0.023 11 4 no 0.177 0 0 1 31 PRO QG 24 no 100.0 90.9 2.375 2.612 0.238 11 5 yes 1.374 2 5 1 32 LYS QD 140 no 35.0 100.0 0.130 0.130 0.000 2 0 no 0.001 0 0 1 32 LYS QG 168 no 100.0 0.0 0.000 0.000 0.000 1 0 no 0.000 0 0 1 33 VAL QG 8 no 100.0 100.0 3.099 3.100 0.001 14 3 no 0.056 0 0 1 35 PRO QB 52 no 100.0 0.0 0.000 0.000 0.000 8 1 no 0.000 0 0 1 35 PRO QD 180 no 100.0 0.0 0.000 0.000 0.000 1 1 no 0.000 0 0 1 35 PRO QG 128 no 100.0 0.0 0.000 0.000 0.000 3 2 no 0.000 0 0 1 36 GLN QB 167 no 80.0 53.2 0.006 0.012 0.006 1 0 no 0.215 0 0 1 38 ILE QG 28 no 70.0 44.6 0.516 1.156 0.640 10 1 yes 1.317 6 27 1 39 LYS QD 166 no 100.0 0.0 0.000 0.000 0.000 1 0 no 0.000 0 0 1 39 LYS QG 139 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0 1 41 SER QB 21 no 70.0 72.4 0.120 0.165 0.046 11 1 no 0.999 0 5 1 42 GLU QB 152 no 100.0 100.0 0.000 0.000 0.000 2 1 no 0.061 0 0 1 42 GLU QG 120 no 10.0 94.1 0.000 0.000 0.000 3 0 no 0.024 0 0 1 44 ILE QG 67 no 90.0 33.2 0.066 0.197 0.132 7 3 yes 1.485 1 3 1 45 GLU QG 46 no 100.0 95.3 0.649 0.681 0.032 9 5 no 0.793 0 1 1 46 GLY QA 55 no 100.0 100.0 1.242 1.242 0.000 8 2 no 0.000 0 0 1 47 SER QB 179 no 100.0 0.0 0.000 0.000 0.000 1 1 no 0.000 0 0 1 48 GLY QA 78 yes 100.0 99.9 0.997 0.998 0.001 6 1 no 0.082 0 0 1 50 PRO QB 99 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0 1 50 PRO QG 165 no 100.0 0.0 0.000 0.000 0.000 1 0 no 0.000 0 0 1 51 GLY QA 48 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.000 0 0 1 53 ILE QG 57 no 50.0 21.4 0.151 0.703 0.553 8 4 yes 1.227 4 19 1 54 LYS QD 178 no 95.0 4.7 0.000 0.000 0.000 1 1 no 0.062 0 0 1 54 LYS QE 91 no 50.0 61.9 0.486 0.786 0.300 5 4 yes 1.740 5 10 1 54 LYS QG 151 no 100.0 0.0 0.000 0.000 0.000 2 1 no 0.000 0 0 1 55 LYS QB 127 no 100.0 0.0 0.000 0.000 0.000 3 2 no 0.000 0 0 1 55 LYS QD 177 no 85.0 80.3 0.001 0.001 0.000 1 1 no 0.000 0 0 1 55 LYS QE 71 no 45.0 65.3 0.453 0.694 0.241 7 6 no 0.838 0 2 1 55 LYS QG 125 no 65.0 42.2 0.094 0.222 0.128 3 1 no 0.906 0 6 1 58 PHE QB 39 no 20.0 9.3 0.001 0.006 0.006 9 0 no 0.291 0 0 1 59 GLY QA 77 no 20.0 99.8 0.035 0.035 0.000 6 1 no 0.039 0 0 1 60 GLU QB 176 no 100.0 0.0 0.000 0.000 0.000 1 1 no 0.000 0 0 1 60 GLU QG 164 no 100.0 0.0 0.000 0.000 0.000 1 0 no 0.000 0 0 1 61 GLY QA 138 no 100.0 100.0 0.000 0.000 0.000 2 0 no 0.020 0 0 1 63 GLN QE 119 no 60.0 99.5 0.843 0.848 0.004 3 0 no 0.187 0 0 1 65 ASN QB 118 no 30.0 99.4 0.005 0.005 0.000 3 0 no 0.021 0 0 1 66 TYR QB 13 yes 100.0 97.1 0.247 0.255 0.007 12 2 no 0.381 0 0 1 67 VAL QG 7 no 90.0 87.9 4.570 5.198 0.628 14 3 yes 2.107 5 6 1 68 LYS QB 117 no 80.0 100.0 0.095 0.095 0.000 3 0 no 0.000 0 0 1 68 LYS QD 163 no 70.0 94.4 1.262 1.337 0.075 1 0 no 0.746 0 3 1 68 LYS QE 110 no 40.0 32.1 0.014 0.043 0.029 4 3 no 0.485 0 0 1 68 LYS QG 108 no 90.0 89.3 0.042 0.047 0.005 4 2 no 0.416 0 0 1 69 HIS QB 62 no 100.0 100.0 0.729 0.729 0.000 7 1 no 0.000 0 0 1 70 ARG QB 155 no 65.0 28.7 0.040 0.139 0.099 2 2 no 0.871 0 3 1 70 ARG QH2 154 no 100.0 99.4 0.099 0.099 0.001 2 2 no 0.871 0 3 1 71 ILE QG 41 no 100.0 86.2 3.526 4.089 0.564 9 2 no 0.061 0 0 1 72 ASP QB 27 yes 100.0 99.9 1.308 1.309 0.001 10 0 no 0.090 0 0 1 73 GLU QB 98 yes 100.0 100.0 1.171 1.171 0.000 4 0 no 0.047 0 0 1 73 GLU QG 97 no 90.0 85.5 0.812 0.951 0.138 4 0 yes 1.374 1 2 1 74 ILE QG 61 no 20.0 71.2 0.000 0.001 0.000 7 1 no 0.062 0 0 1 75 ASP QB 26 yes 100.0 99.3 0.273 0.275 0.002 10 0 no 0.095 0 0 1 78 ASN QB 45 no 100.0 94.6 0.037 0.039 0.002 9 4 no 0.381 0 0 1 78 ASN QD 82 no 5.0 100.0 0.061 0.061 0.000 6 3 no 0.018 0 0 1 79 PHE QB 9 yes 75.0 96.5 0.179 0.185 0.006 14 4 no 0.124 0 0 1 81 TYR QB 25 no 100.0 100.0 0.004 0.004 0.000 10 0 no 0.237 0 0 1 83 CYS QB 76 no 50.0 79.7 0.167 0.210 0.042 6 1 no 0.516 0 1 1 85 LEU QB 54 no 80.0 60.7 0.277 0.456 0.179 8 2 yes 1.343 1 4 1 85 LEU QD 12 no 85.0 94.1 13.122 13.943 0.821 12 2 yes 2.084 4 9 1 86 ILE QG 150 no 100.0 100.0 0.000 0.000 0.000 2 1 no 0.037 0 0 1 87 GLU QB 137 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0 1 87 GLU QG 162 no 100.0 0.0 0.000 0.000 0.000 1 0 no 0.000 0 0 1 88 GLY QA 32 yes 100.0 100.0 0.429 0.429 0.000 10 2 no 0.044 0 0 1 91 ILE QG 149 no 95.0 72.6 0.882 1.216 0.333 2 1 no 0.148 0 0 1 92 SER QB 136 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0 1 93 GLU QG 135 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0 1 95 LEU QB 89 no 75.0 99.9 0.293 0.293 0.000 5 1 no 0.092 0 0 1 95 LEU QD 124 no 100.0 100.0 0.001 0.001 0.000 3 1 no 0.125 0 0 1 96 GLU QB 96 yes 100.0 100.0 3.278 3.278 0.000 4 0 no 0.035 0 0 1 96 GLU QG 106 no 60.0 52.2 0.530 1.015 0.485 4 1 yes 1.365 6 6 1 97 LYS QE 175 no 5.0 37.6 0.010 0.026 0.016 1 1 no 0.000 0 0 1 97 LYS QG 148 no 100.0 53.6 0.000 0.001 0.000 2 1 no 0.033 0 0 1 100 TYR QB 174 no 5.0 100.0 0.000 0.000 0.000 1 1 no 0.000 0 0 1 101 GLU QB 75 no 65.0 69.4 0.541 0.779 0.239 6 1 yes 1.603 5 18 1 101 GLU QG 161 no 100.0 100.0 0.001 0.001 0.000 1 0 no 0.154 0 0 1 102 ILE QG 147 no 15.0 41.8 0.025 0.060 0.035 2 1 no 0.837 0 1 1 103 LYS QB 20 yes 100.0 100.0 1.606 1.606 0.000 11 0 no 0.040 0 0 1 103 LYS QE 92 no 40.0 62.7 0.466 0.744 0.278 5 5 no 0.976 0 5 1 103 LYS QG 85 no 60.0 38.5 0.792 2.060 1.268 5 0 yes 1.676 11 16 1 104 LEU QB 35 yes 95.0 99.7 0.602 0.604 0.002 10 4 no 0.124 0 0 1 104 LEU QD 6 no 95.0 91.4 3.642 3.986 0.343 15 4 yes 1.236 1 2 1 105 VAL QG 17 no 95.0 87.7 8.978 10.239 1.260 12 4 yes 2.266 5 9 1 107 SER QB 4 yes 95.0 86.6 1.017 1.175 0.158 16 1 yes 1.424 1 3 1 108 PRO QB 79 no 65.0 98.6 0.583 0.591 0.008 6 2 no 0.346 0 0 1 108 PRO QD 173 no 100.0 0.0 0.000 0.000 0.000 1 1 no 0.000 0 0 1 108 PRO QG 172 no 100.0 0.0 0.000 0.000 0.000 1 1 no 0.000 0 0 1 109 ASP QB 146 no 100.0 100.0 0.008 0.008 0.000 2 1 no 0.346 0 0 1 110 GLY QA 84 no 55.0 0.3 0.001 0.454 0.453 5 0 yes 1.070 4 11 1 111 GLY QA 74 no 100.0 98.7 1.443 1.461 0.018 6 1 no 0.232 0 0 1 112 SER QB 88 no 45.0 7.6 0.108 1.433 1.325 5 1 yes 1.406 10 24 1 113 ILE QG 160 no 100.0 0.0 0.000 0.000 0.000 1 0 no 0.000 0 0 1 114 LEU QB 31 yes 100.0 100.0 1.141 1.141 0.000 10 2 no 0.000 0 0 1 114 LEU QD 40 yes 100.0 100.0 0.198 0.199 0.000 9 2 no 0.033 0 0 1 115 LYS QB 51 no 100.0 100.0 0.107 0.107 0.000 8 1 no 0.000 0 0 1 115 LYS QD 105 no 100.0 0.0 0.000 0.000 0.000 4 1 no 0.000 0 0 1 115 LYS QE 129 no 100.0 0.0 0.000 0.000 0.000 3 3 no 0.000 0 0 1 115 LYS QG 116 no 80.0 73.9 0.048 0.065 0.017 3 0 no 0.783 0 2 1 116 SER QB 104 no 45.0 15.3 0.043 0.280 0.237 4 1 no 0.966 0 6 1 118 SER QB 16 no 60.0 42.0 1.065 2.540 1.474 12 4 yes 1.146 6 24 1 119 LYS QB 60 yes 95.0 74.7 1.513 2.026 0.513 7 1 no 0.054 0 0 1 119 LYS QD 109 no 60.0 92.5 0.513 0.554 0.041 4 3 no 0.754 0 1 1 119 LYS QE 153 no 20.0 34.2 0.001 0.003 0.002 2 2 no 0.000 0 0 1 119 LYS QG 103 no 85.0 71.0 0.068 0.096 0.028 4 1 no 0.015 0 0 1 120 TYR QB 38 yes 100.0 100.0 0.302 0.302 0.000 9 0 no 0.028 0 0 1 121 HIS QB 95 no 100.0 99.9 1.145 1.146 0.001 4 0 no 0.082 0 0 1 123 LYS QB 145 no 100.0 0.0 0.000 0.000 0.000 2 1 no 0.000 0 0 1 123 LYS QD 144 no 45.0 38.9 0.275 0.707 0.432 2 1 yes 1.277 5 7 1 123 LYS QG 159 no 100.0 0.0 0.000 0.000 0.000 1 0 no 0.000 0 0 1 125 ASP QB 134 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0 1 126 HIS QB 59 no 15.0 80.8 0.041 0.051 0.010 7 0 no 0.311 0 0 1 127 GLU QB 102 yes 85.0 80.1 2.997 3.741 0.744 4 1 yes 1.028 1 5 1 127 GLU QG 94 no 20.0 49.1 0.001 0.003 0.002 4 0 no 0.124 0 0 1 128 ILE QG 15 no 65.0 38.0 1.326 3.495 2.168 12 4 yes 1.829 5 21 1 129 LYS QB 115 yes 100.0 100.0 0.254 0.254 0.000 3 0 no 0.000 0 0 1 129 LYS QE 143 no 100.0 0.0 0.000 0.000 0.000 2 1 no 0.000 0 0 1 129 LYS QG 114 no 10.0 100.0 0.000 0.000 0.000 3 0 no 0.000 0 0 1 130 GLU QB 158 no 100.0 0.0 0.000 0.000 0.000 1 0 no 0.000 0 0 1 130 GLU QG 101 no 5.0 100.0 0.000 0.000 0.000 4 1 no 0.000 0 0 1 131 ASP QB 133 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0 1 132 GLN QB 30 yes 100.0 78.1 2.111 2.703 0.592 10 2 no 0.033 0 0 1 132 GLN QG 100 yes 90.0 85.5 0.238 0.278 0.040 4 1 no 0.498 0 0 1 133 ILE QG 5 no 65.0 40.0 1.586 3.960 2.374 15 4 yes 1.637 17 27 1 134 LYS QB 132 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0 1 134 LYS QD 157 no 55.0 16.6 0.031 0.185 0.154 1 0 yes 1.015 2 3 1 134 LYS QG 171 no 100.0 0.0 0.000 0.000 0.000 1 1 no 0.000 0 0 1 136 GLY QA 107 no 40.0 100.0 0.472 0.472 0.000 4 2 no 0.000 0 0 1 138 GLU QB 93 no 45.0 53.9 0.876 1.627 0.751 4 0 yes 1.052 5 19 1 138 GLU QG 170 no 100.0 0.0 0.000 0.000 0.000 1 1 no 0.000 0 0 1 139 GLU QB 56 no 35.0 26.0 0.567 2.182 1.615 8 3 yes 1.694 15 18 1 139 GLU QG 131 yes 100.0 99.4 0.163 0.164 0.001 2 0 no 0.099 0 0 1 141 SER QB 130 no 45.0 42.9 0.104 0.243 0.139 2 0 no 0.815 0 9 1 142 GLY QA 73 no 100.0 86.4 5.000 5.785 0.786 6 1 yes 1.580 7 7 1 143 ILE QG 113 no 70.0 10.2 0.062 0.603 0.542 3 0 yes 1.137 2 21 1 144 PHE QB 50 yes 85.0 76.7 1.643 2.141 0.498 8 1 yes 1.629 3 4 1 145 LYS QB 87 no 65.0 2.7 0.023 0.837 0.814 5 1 yes 1.435 7 7 1 145 LYS QG 156 no 100.0 0.0 0.000 0.000 0.000 1 0 no 0.000 0 0 1 147 VAL QG 1 no 85.0 84.6 8.881 10.496 1.615 17 2 yes 2.074 8 13 1 148 GLU QB 123 no 65.0 37.7 0.801 2.126 1.324 3 1 yes 1.694 13 14 1 150 TYR QB 43 no 100.0 99.9 1.847 1.849 0.002 9 3 no 0.090 0 0 1 151 LEU QB 72 no 100.0 99.1 3.890 3.927 0.037 6 1 no 0.257 0 0 1 151 LEU QD 3 no 90.0 63.8 6.096 9.560 3.464 17 9 yes 2.551 4 6 1 152 LEU QD 49 no 60.0 56.8 1.295 2.280 0.985 8 1 yes 1.859 4 9 1 154 ASN QB 66 no 95.0 96.5 1.308 1.355 0.047 7 3 no 0.548 0 1 1 154 ASN QD 34 yes 100.0 99.7 1.184 1.188 0.004 10 3 no 0.185 0 0 1 155 PRO QB 142 no 100.0 0.0 0.000 0.000 0.000 2 1 no 0.000 0 0 1 155 PRO QD 11 yes 100.0 61.6 0.683 1.110 0.427 13 9 no 0.135 0 0 1 155 PRO QG 90 no 20.0 37.7 0.052 0.137 0.085 5 4 no 0.799 0 2 1 159 HIS QB 112 no 100.0 0.0 0.000 0.000 0.000 3 0 no 0.000 0 0 stop_ save_
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