NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
652012 |
6um9   |
30679 | cing | 4-filtered-FRED | Wattos | check | stereo assignment | distance |
data_6um9
save_assign_stereo
_Stereo_assign_list.Sf_category stereo_assignments
_Stereo_assign_list.Triplet_count 211
_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 20
_Stereo_assign_list.Total_e_low_states 0.006
_Stereo_assign_list.Total_e_high_states 747.610
_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 1 SER QB 205 no 0.0 0.0 0.000 0.003 0.003 2 0 no 0.140 0 0
1 2 LYS QB 204 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 2 LYS QD 165 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.003 0 0
1 2 LYS QG 203 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.002 0 0
1 3 GLU QB 202 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.005 0 0
1 3 GLU QG 164 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.006 0 0
1 4 VAL QG 65 no 100.0 100.0 4.412 4.412 0.000 13 0 no 0.000 0 0
1 5 MET QB 201 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 5 MET QG 200 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 6 LYS QB 199 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 6 LYS QD 163 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.005 0 0
1 6 LYS QG 198 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 14 LYS QB 210 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.000 0 0
1 15 PRO QB 31 no 100.0 100.0 1.021 1.021 0.000 21 15 no 0.002 0 0
1 15 PRO QD 63 no 100.0 100.0 2.580 2.580 0.000 14 7 no 0.007 0 0
1 15 PRO QG 37 no 100.0 100.0 5.721 5.721 0.000 19 15 no 0.007 0 0
1 16 MET QB 197 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.006 0 0
1 16 MET QG 136 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.000 0 0
1 17 GLU QB 100 no 100.0 100.0 2.453 2.453 0.000 9 2 no 0.002 0 0
1 17 GLU QG 72 no 100.0 100.0 3.879 3.879 0.000 12 3 no 0.002 0 0
1 19 CYS QB 138 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.000 0 0
1 20 LYS QB 67 no 100.0 100.0 5.027 5.027 0.000 13 4 no 0.002 0 0
1 20 LYS QD 39 no 100.0 100.0 9.614 9.614 0.000 18 3 no 0.004 0 0
1 20 LYS QE 209 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.000 0 0
1 20 LYS QG 51 no 100.0 100.0 2.403 2.403 0.000 16 3 no 0.000 0 0
1 21 GLN QB 162 no 100.0 100.0 0.990 0.991 0.000 4 0 no 0.012 0 0
1 21 GLN QE 93 no 100.0 100.0 5.135 5.135 0.000 10 4 no 0.012 0 0
1 21 GLN QG 129 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 22 GLU QB 44 no 100.0 100.0 2.163 2.163 0.000 17 5 no 0.008 0 0
1 22 GLU QG 96 no 100.0 0.0 0.000 0.000 0.000 10 6 no 0.010 0 0
1 23 LEU QB 58 no 100.0 100.0 5.144 5.144 0.000 15 7 no 0.003 0 0
1 23 LEU QD 6 no 100.0 100.0 9.624 9.624 0.000 45 13 no 0.000 0 0
1 24 ASN QB 161 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.004 0 0
1 24 ASN QD 172 no 100.0 100.0 2.236 2.236 0.000 3 0 no 0.001 0 0
1 25 VAL QG 15 no 100.0 100.0 22.379 22.379 0.000 37 11 no 0.000 0 0
1 26 PRO QB 73 no 100.0 100.0 4.222 4.222 0.000 12 4 no 0.009 0 0
1 26 PRO QD 45 no 100.0 100.0 4.394 4.394 0.000 17 8 no 0.001 0 0
1 26 PRO QG 36 no 100.0 100.0 1.194 1.194 0.000 19 7 no 0.003 0 0
1 27 ASP QB 169 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.009 0 0
1 29 VAL QG 2 no 100.0 100.0 6.001 6.001 0.000 57 24 no 0.000 0 0
1 30 MET QB 88 no 100.0 100.0 0.954 0.954 0.000 10 3 no 0.001 0 0
1 30 MET QG 196 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.001 0 0
1 31 GLN QB 86 no 100.0 100.0 1.991 1.991 0.000 10 2 no 0.013 0 0
1 31 GLN QE 78 no 100.0 100.0 0.939 0.939 0.000 11 3 no 0.006 0 0
1 31 GLN QG 75 no 100.0 100.0 3.469 3.469 0.000 11 1 no 0.006 0 0
1 32 ASP QB 160 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.014 0 0
1 33 PHE QB 56 no 100.0 100.0 3.166 3.166 0.000 15 6 no 0.008 0 0
1 33 PHE QD 66 no 100.0 100.0 5.648 5.648 0.000 13 4 no 0.001 0 0
1 33 PHE QE 92 no 100.0 100.0 8.356 8.356 0.000 10 4 no 0.002 0 0
1 34 PHE QB 159 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.003 0 0
1 34 PHE QD 103 no 100.0 100.0 46.853 46.853 0.000 8 0 no 0.014 0 0
1 34 PHE QE 211 no 100.0 100.0 1.584 1.584 0.000 1 0 no 0.000 0 0
1 35 ASN QB 128 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.009 0 0
1 35 ASN QD 112 no 0.0 0.0 0.000 0.000 0.000 8 4 no 0.004 0 0
1 36 PHE QB 158 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 36 PHE QD 60 no 100.0 100.0 26.426 26.426 0.000 14 2 no 0.000 0 0
1 36 PHE QE 137 no 100.0 100.0 6.440 6.440 0.000 6 4 no 0.000 0 0
1 37 TRP QB 142 no 100.0 100.0 1.926 1.926 0.000 5 2 no 0.000 0 0
1 38 LYS QB 53 no 100.0 100.0 4.212 4.212 0.000 16 4 no 0.007 0 0
1 38 LYS QG 195 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 39 GLU QB 194 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.005 0 0
1 41 TYR QB 135 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.005 0 0
1 41 TYR QD 87 no 100.0 100.0 12.122 12.122 0.000 10 3 no 0.005 0 0
1 41 TYR QE 171 no 100.0 100.0 3.142 3.142 0.000 3 0 no 0.000 0 0
1 42 GLN QB 127 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.005 0 0
1 42 GLN QE 173 no 100.0 100.0 1.819 1.819 0.000 3 1 no 0.003 0 0
1 43 ILE QG 82 no 100.0 0.0 0.000 0.000 0.000 10 0 no 0.009 0 0
1 45 ASN QB 71 no 100.0 100.0 1.758 1.758 0.000 12 3 no 0.004 0 0
1 45 ASN QD 43 no 100.0 100.0 1.308 1.308 0.000 18 12 no 0.005 0 0
1 46 ARG QB 101 no 100.0 100.0 0.824 0.824 0.000 9 4 no 0.000 0 0
1 46 ARG QD 134 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.001 0 0
1 46 ARG QG 74 no 100.0 100.0 1.885 1.885 0.000 11 1 no 0.004 0 0
1 47 GLU QB 64 no 100.0 100.0 2.467 2.467 0.000 14 8 no 0.011 0 0
1 47 GLU QG 111 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.010 0 0
1 49 GLY QA 21 no 100.0 100.0 1.061 1.061 0.000 27 11 no 0.007 0 0
1 50 CYS QB 115 no 100.0 100.0 2.028 2.028 0.000 7 2 no 0.001 0 0
1 51 VAL QG 7 no 100.0 100.0 19.025 19.025 0.000 45 15 no 0.000 0 0
1 52 ILE QG 95 no 95.0 100.0 0.004 0.004 0.000 10 6 no 0.000 0 0
1 53 LEU QB 110 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 53 LEU QD 18 yes 100.0 100.0 23.623 23.623 0.000 34 9 no 0.000 0 0
1 54 CYS QB 109 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.002 0 0
1 55 LEU QB 80 no 100.0 100.0 1.279 1.279 0.000 11 4 no 0.006 0 0
1 55 LEU QD 8 no 100.0 100.0 9.270 9.270 0.000 45 18 no 0.000 0 0
1 57 LYS QD 126 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.007 0 0
1 57 LYS QG 193 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 58 LYS QB 57 no 100.0 100.0 1.820 1.820 0.000 15 7 no 0.009 0 0
1 58 LYS QD 133 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.000 0 0
1 58 LYS QE 97 no 100.0 0.0 0.000 0.000 0.000 10 10 no 0.002 0 0
1 58 LYS QG 168 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.000 0 0
1 59 LEU QB 107 no 100.0 0.0 0.000 0.000 0.000 8 2 no 0.002 0 0
1 59 LEU QD 12 no 100.0 100.0 17.362 17.362 0.000 41 7 no 0.000 0 0
1 60 GLU QB 157 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.004 0 0
1 60 GLU QG 125 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.010 0 0
1 61 LEU QB 54 no 100.0 100.0 1.058 1.058 0.000 16 9 no 0.005 0 0
1 61 LEU QD 10 no 100.0 100.0 21.004 21.004 0.000 42 22 no 0.000 0 0
1 62 LEU QB 192 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 62 LEU QD 19 no 100.0 100.0 17.984 17.984 0.000 32 7 no 0.000 0 0
1 63 ASP QB 124 no 0.0 0.0 0.000 0.000 0.000 6 0 no 0.003 0 0
1 64 GLN QB 123 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.001 0 0
1 64 GLN QE 77 no 100.0 100.0 2.553 2.553 0.000 11 2 no 0.003 0 0
1 64 GLN QG 114 no 100.0 100.0 5.091 5.091 0.000 7 2 no 0.006 0 0
1 65 ASP QB 132 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.003 0 0
1 66 MET QB 106 no 100.0 100.0 3.795 3.795 0.000 8 2 no 0.004 0 0
1 66 MET QG 191 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 67 ASN QB 108 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 67 ASN QD 156 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 68 LEU QB 155 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.004 0 0
1 68 LEU QD 16 no 100.0 100.0 4.727 4.727 0.000 36 15 no 0.000 0 0
1 69 HIS QB 190 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 70 HIS QB 122 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 72 LYS QB 154 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.003 0 0
1 72 LYS QD 189 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.016 0 0
1 72 LYS QE 153 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.006 0 0
1 74 MET QB 99 no 100.0 100.0 0.688 0.688 0.000 9 0 no 0.005 0 0
1 74 MET QG 131 no 0.0 0.0 0.000 0.000 0.000 6 2 no 0.005 0 0
1 75 GLU QB 152 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.020 0 0
1 75 GLU QG 188 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 76 PHE QB 76 no 100.0 100.0 0.635 0.635 0.000 11 2 no 0.002 0 0
1 76 PHE QD 52 no 100.0 100.0 27.761 27.761 0.000 16 4 no 0.002 0 0
1 78 MET QB 140 no 100.0 100.0 0.909 0.909 0.000 5 0 no 0.003 0 0
1 78 MET QG 35 no 100.0 100.0 1.427 1.427 0.000 19 0 no 0.004 0 0
1 79 LYS QB 91 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.002 0 0
1 79 LYS QD 187 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 79 LYS QG 186 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 80 HIS QB 130 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.008 0 0
1 83 ASP QB 121 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.021 0 0
1 84 GLU QB 139 no 100.0 100.0 2.099 2.099 0.000 5 0 no 0.000 0 0
1 84 GLU QG 120 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 86 MET QB 81 no 100.0 0.0 0.000 0.000 0.000 10 0 no 0.002 0 0
1 86 MET QG 151 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.002 0 0
1 88 LYS QB 170 no 100.0 100.0 0.681 0.681 0.000 3 0 no 0.001 0 0
1 88 LYS QD 185 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.004 0 0
1 88 LYS QE 184 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.002 0 0
1 88 LYS QG 183 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 89 GLN QB 150 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 89 GLN QE 113 no 100.0 0.0 0.000 0.000 0.000 8 6 no 0.001 0 0
1 89 GLN QG 33 no 100.0 100.0 2.063 2.063 0.000 20 5 no 0.008 0 0
1 90 LEU QB 182 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.017 0 0
1 90 LEU QD 3 no 100.0 100.0 15.282 15.282 0.000 52 12 no 0.000 0 0
1 91 LEU QB 79 no 100.0 100.0 1.827 1.827 0.000 11 4 no 0.000 0 0
1 91 LEU QD 14 no 100.0 100.0 9.843 9.843 0.000 41 14 no 0.000 0 0
1 92 ASP QB 119 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.014 0 0
1 93 ILE QG 104 no 100.0 100.0 0.364 0.364 0.000 8 1 no 0.001 0 0
1 94 LYS QB 149 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.004 0 0
1 94 LYS QE 167 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.008 0 0
1 94 LYS QG 181 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 95 HIS QB 180 no 0.0 0.0 0.000 0.000 0.000 2 0 no 0.006 0 0
1 96 SER QB 61 no 100.0 100.0 0.526 0.526 0.000 14 3 no 0.006 0 0
1 97 CYS QB 23 no 100.0 100.0 4.528 4.528 0.000 26 12 no 0.005 0 0
1 98 GLU QB 90 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.029 0 0
1 98 GLU QG 105 no 100.0 0.0 0.000 0.000 0.000 8 2 no 0.015 0 0
1 99 LYS QB 148 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.002 0 0
1 99 LYS QD 208 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.004 0 0
1 99 LYS QE 179 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 99 LYS QG 147 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.002 0 0
1 100 VAL QG 26 no 100.0 100.0 13.503 13.503 0.000 23 7 no 0.000 0 0
1 101 ILE QG 22 no 100.0 100.0 6.931 6.931 0.000 26 5 no 0.001 0 0
1 103 ILE QG 59 no 100.0 100.0 1.568 1.568 0.000 14 1 no 0.005 0 0
1 104 VAL QG 4 no 100.0 100.0 20.843 20.843 0.000 52 21 no 0.000 0 0
1 106 ASP QB 146 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 107 ASP QB 42 no 100.0 100.0 5.601 5.601 0.000 18 11 no 0.005 0 0
1 108 PRO QB 166 no 100.0 100.0 0.382 0.382 0.000 4 2 no 0.002 0 0
1 108 PRO QD 118 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 108 PRO QG 141 no 100.0 100.0 0.715 0.715 0.000 5 2 no 0.000 0 0
1 109 CYS QB 145 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 110 GLN QB 41 no 100.0 100.0 5.321 5.321 0.000 18 10 no 0.008 0 0
1 110 GLN QE 46 no 100.0 100.0 5.760 5.760 0.000 17 9 no 0.009 0 0
1 110 GLN QG 94 no 100.0 100.0 2.125 2.125 0.000 10 5 no 0.001 0 0
1 112 MET QB 68 no 100.0 100.0 0.742 0.742 0.000 13 5 no 0.007 0 0
1 112 MET QG 178 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 113 LEU QB 27 no 100.0 100.0 3.474 3.474 0.000 23 10 no 0.009 0 0
1 113 LEU QD 5 no 100.0 100.0 34.521 34.521 0.000 47 18 no 0.000 0 0
1 114 ASN QB 29 no 100.0 100.0 1.356 1.356 0.000 22 2 no 0.004 0 0
1 114 ASN QD 25 no 100.0 100.0 1.440 1.440 0.000 25 9 no 0.002 0 0
1 115 LEU QB 30 no 100.0 100.0 1.097 1.097 0.000 21 6 no 0.004 0 0
1 115 LEU QD 1 no 100.0 100.0 29.485 29.485 0.000 59 25 no 0.000 0 0
1 117 MET QB 62 no 100.0 100.0 4.211 4.211 0.000 14 4 no 0.014 0 0
1 117 MET QG 70 no 100.0 100.0 1.777 1.777 0.000 12 0 no 0.002 0 0
1 118 CYS QB 28 no 100.0 100.0 0.687 0.687 0.000 23 11 no 0.000 0 0
1 119 PHE QB 32 no 100.0 100.0 0.987 0.987 0.000 20 5 no 0.010 0 0
1 119 PHE QD 55 no 100.0 100.0 37.112 37.112 0.000 15 3 no 0.000 0 0
1 119 PHE QE 38 no 100.0 100.0 62.993 62.993 0.000 18 1 no 0.000 0 0
1 120 LYS QB 177 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 120 LYS QG 176 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 122 GLU QB 49 no 100.0 100.0 3.752 3.752 0.000 16 0 no 0.006 0 0
1 122 GLU QG 117 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 123 ILE QG 69 no 100.0 100.0 2.765 2.765 0.000 12 0 no 0.000 0 0
1 124 HIS QB 102 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.000 0 0
1 125 LYS QB 85 no 100.0 100.0 5.809 5.809 0.000 10 2 no 0.004 0 0
1 125 LYS QE 207 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.000 0 0
1 125 LYS QG 98 no 100.0 100.0 1.508 1.508 0.000 9 0 no 0.002 0 0
1 126 LEU QB 84 no 100.0 0.0 0.000 0.000 0.000 10 2 no 0.002 0 0
1 126 LEU QD 13 no 100.0 100.0 9.001 9.001 0.000 41 11 no 0.000 0 0
1 127 ASP QB 144 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.005 0 0
1 128 TRP QB 175 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 130 PRO QB 89 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.000 0 0
1 130 PRO QD 40 no 100.0 100.0 0.549 0.549 0.000 18 6 no 0.000 0 0
1 130 PRO QG 174 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 132 LEU QB 143 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 132 LEU QD 24 no 100.0 100.0 8.666 8.666 0.000 25 5 no 0.000 0 0
1 133 ASP QB 206 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.000 0 0
1 134 VAL QG 11 no 100.0 100.0 11.227 11.227 0.000 41 4 no 0.000 0 0
1 136 VAL QG 17 no 100.0 100.0 0.152 0.152 0.000 35 3 no 0.000 0 0
1 137 GLY QA 48 no 100.0 100.0 2.593 2.593 0.000 17 11 no 0.000 0 0
1 138 GLU QB 34 no 100.0 100.0 3.444 3.444 0.000 20 7 no 0.000 0 0
1 138 GLU QG 83 no 100.0 0.0 0.000 0.000 0.000 10 2 no 0.009 0 0
1 139 LEU QB 116 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.008 0 0
1 139 LEU QD 9 no 100.0 100.0 9.004 9.004 0.000 43 12 no 0.000 0 0
1 140 LEU QB 47 no 100.0 100.0 1.453 1.453 0.000 17 11 no 0.001 0 0
1 140 LEU QD 20 no 100.0 100.0 4.163 4.163 0.000 29 12 no 0.000 0 0
1 142 ASP QB 50 no 100.0 100.0 2.690 2.690 0.000 16 3 no 0.001 0 0
stop_
save_
Contact the webmaster for help, if required. Saturday, May 11, 2024 8:21:05 PM GMT (wattos1)