NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
496664 |
2l81   |
17389 | cing | 4-filtered-FRED | Wattos | check | stereo assignment | distance |
data_2l81
save_assign_stereo
_Stereo_assign_list.Sf_category stereo_assignments
_Stereo_assign_list.Triplet_count 237
_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 0.154
_Stereo_assign_list.Total_e_high_states 511.469
_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 QG 230 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 12 ASP QB 229 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 13 LYS QB 140 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 13 LYS QD 228 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 13 LYS QE 169 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.000 0 0
1 13 LYS QG 156 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 14 ARG QB 191 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 14 ARG QD 190 no 100.0 0.0 0.000 0.001 0.001 4 0 no 0.171 0 0
1 14 ARG QG 189 no 100.0 0.0 0.000 0.001 0.001 4 0 no 0.140 0 0
1 15 LEU QB 118 no 100.0 99.5 0.234 0.236 0.001 10 6 no 0.056 0 0
1 15 LEU QD 16 no 100.0 100.0 8.225 8.226 0.001 41 14 no 0.059 0 0
1 16 PHE QB 227 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 17 LEU QB 73 no 100.0 100.0 0.710 0.710 0.000 13 4 no 0.005 0 0
1 17 LEU QD 18 no 100.0 100.0 8.210 8.210 0.000 40 11 no 0.044 0 0
1 18 ASP QB 72 no 95.0 99.9 0.207 0.207 0.000 13 4 no 0.047 0 0
1 19 PRO QB 70 no 100.0 100.0 2.273 2.273 0.001 13 2 no 0.083 0 0
1 19 PRO QD 165 no 100.0 100.0 1.523 1.523 0.000 6 2 no 0.036 0 0
1 19 PRO QG 86 no 100.0 99.9 3.447 3.449 0.002 12 4 no 0.085 0 0
1 20 ASP QB 105 no 100.0 0.0 0.000 0.000 0.000 10 2 no 0.000 0 0
1 23 ILE QG 131 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.000 0 0
1 24 GLU QB 104 no 100.0 99.9 1.894 1.895 0.002 10 2 no 0.066 0 0
1 24 GLU QG 49 no 100.0 99.9 0.412 0.413 0.000 16 2 no 0.055 0 0
1 25 ARG QB 112 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.000 0 0
1 25 ARG QD 117 no 100.0 0.0 0.000 0.000 0.000 10 6 no 0.043 0 0
1 25 ARG QG 38 no 100.0 99.9 2.496 2.498 0.002 18 3 no 0.118 0 0
1 26 LEU QB 41 no 100.0 100.0 0.824 0.824 0.000 18 6 no 0.003 0 0
1 26 LEU QD 8 no 100.0 100.0 17.927 17.927 0.000 45 8 no 0.039 0 0
1 27 GLN QB 60 no 100.0 100.0 0.962 0.962 0.000 15 6 no 0.000 0 0
1 27 GLN QE 52 no 100.0 100.0 0.517 0.517 0.000 16 9 no 0.064 0 0
1 27 GLN QG 36 no 100.0 94.8 0.113 0.120 0.006 19 8 no 0.110 0 0
1 28 ARG QB 90 no 100.0 100.0 0.146 0.146 0.000 11 1 no 0.000 0 0
1 28 ARG QD 226 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 28 ARG QG 130 no 100.0 0.0 0.000 0.006 0.006 8 0 no 0.131 0 0
1 29 LEU QB 188 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 29 LEU QD 25 no 100.0 100.0 12.707 12.707 0.000 31 6 no 0.033 0 0
1 30 GLN QB 89 no 100.0 100.0 1.959 1.959 0.001 11 0 no 0.081 0 0
1 30 GLN QE 88 no 100.0 0.0 0.000 0.000 0.000 12 8 no 0.048 0 0
1 30 GLN QG 225 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 31 GLN QB 85 no 100.0 100.0 2.261 2.261 0.000 12 4 no 0.078 0 0
1 31 GLN QE 143 no 90.0 93.3 0.051 0.054 0.004 7 4 no 0.153 0 0
1 31 GLN QG 155 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 33 LEU QB 111 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.000 0 0
1 33 LEU QD 2 no 100.0 100.0 14.374 14.375 0.001 53 16 no 0.075 0 0
1 34 GLU QB 142 no 100.0 99.9 0.319 0.319 0.000 7 0 no 0.054 0 0
1 35 MET QB 164 no 100.0 100.0 0.855 0.855 0.000 6 2 no 0.000 0 0
1 35 MET QG 63 no 100.0 99.3 0.139 0.140 0.001 14 2 no 0.079 0 0
1 36 GLY QA 39 no 100.0 99.8 0.192 0.192 0.000 18 5 no 0.051 0 0
1 37 VAL QG 5 no 100.0 100.0 22.908 22.909 0.001 46 10 no 0.061 0 0
1 38 SER QB 129 no 100.0 100.0 0.084 0.084 0.000 8 0 no 0.000 0 0
1 39 SER QB 139 no 100.0 0.0 0.000 0.001 0.001 8 2 no 0.077 0 0
1 40 LEU QB 50 no 100.0 100.0 0.518 0.518 0.000 16 6 no 0.000 0 0
1 40 LEU QD 28 no 100.0 100.0 12.012 12.012 0.000 30 8 no 0.042 0 0
1 41 MET QB 224 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 41 MET QG 187 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 43 LEU QB 207 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.000 0 0
1 43 LEU QD 11 no 100.0 99.9 10.920 10.927 0.006 44 10 no 0.112 0 0
1 44 VAL QG 110 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.030 0 0
1 51 TYR QB 186 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 52 GLY QA 199 no 55.0 100.0 0.168 0.168 0.000 4 2 no 0.000 0 0
1 54 MET QB 103 no 100.0 100.0 1.477 1.477 0.000 10 2 no 0.032 0 0
1 54 MET QG 138 no 100.0 0.0 0.000 0.000 0.000 8 2 no 0.000 0 0
1 55 GLU QB 94 no 100.0 99.9 1.941 1.942 0.001 11 4 no 0.074 0 0
1 55 GLU QG 65 no 100.0 100.0 2.695 2.695 0.000 14 4 no 0.047 0 0
1 56 ARG QB 154 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.047 0 0
1 56 ARG QD 185 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.029 0 0
1 56 ARG QG 163 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.036 0 0
1 58 ILE QG 162 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.010 0 0
1 59 ASN QB 128 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.000 0 0
1 59 ASN QD 184 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.065 0 0
1 60 GLU QB 137 no 100.0 0.0 0.000 0.000 0.000 8 2 no 0.001 0 0
1 60 GLU QG 136 no 100.0 0.0 0.000 0.000 0.000 8 2 no 0.000 0 0
1 61 ILE QG 237 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.000 0 0
1 62 ARG QB 223 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 62 ARG QD 141 no 80.0 99.0 0.127 0.129 0.001 7 0 no 0.127 0 0
1 62 ARG QG 222 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 65 VAL QG 27 no 100.0 100.0 9.623 9.624 0.001 30 4 no 0.059 0 0
1 66 ASP QB 127 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.027 0 0
1 67 LYS QB 29 no 100.0 100.0 1.119 1.119 0.000 25 9 no 0.048 0 0
1 67 LYS QD 198 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.000 0 0
1 67 LYS QE 120 no 100.0 0.0 0.000 0.000 0.000 10 8 no 0.000 0 0
1 67 LYS QG 40 no 100.0 0.0 0.000 0.002 0.002 18 6 no 0.088 0 0
1 68 VAL QG 15 no 100.0 100.0 24.407 24.407 0.001 41 11 no 0.077 0 0
1 69 GLU QB 124 no 90.0 99.6 0.318 0.319 0.001 9 3 no 0.090 0 0
1 69 GLU QG 126 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.020 0 0
1 70 LEU QB 59 no 100.0 99.9 0.140 0.140 0.000 15 6 no 0.047 0 0
1 70 LEU QD 26 no 100.0 100.0 26.744 26.752 0.007 31 12 no 0.186 0 0
1 71 PHE QB 153 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 72 LEU QB 84 no 100.0 100.0 0.353 0.353 0.000 12 4 no 0.010 0 0
1 72 LEU QD 83 no 100.0 0.0 0.000 0.000 0.000 12 4 no 0.046 0 0
1 73 LYS QB 122 no 100.0 100.0 0.587 0.587 0.000 9 2 no 0.000 0 0
1 73 LYS QD 221 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 73 LYS QE 236 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.004 0 0
1 73 LYS QG 183 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 74 GLU QB 135 no 100.0 100.0 0.481 0.481 0.000 8 2 no 0.000 0 0
1 74 GLU QG 55 no 85.0 98.2 0.350 0.356 0.006 15 2 no 0.120 0 0
1 75 TYR QB 78 no 100.0 100.0 1.331 1.331 0.000 12 3 no 0.001 0 0
1 76 LEU QB 31 no 100.0 99.8 0.234 0.234 0.000 21 9 no 0.086 0 0
1 76 LEU QD 1 no 100.0 99.9 12.368 12.385 0.017 54 28 no 0.202 0 0
1 77 HIS QB 121 no 100.0 100.0 0.390 0.390 0.000 9 1 no 0.021 0 0
1 78 PHE QB 197 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.000 0 0
1 79 VAL QG 3 no 100.0 100.0 22.477 22.478 0.001 47 14 no 0.074 0 0
1 80 LYS QB 97 no 100.0 100.0 0.837 0.837 0.000 11 6 no 0.000 0 0
1 80 LYS QD 62 no 100.0 99.9 2.955 2.957 0.002 15 8 no 0.111 0 0
1 80 LYS QE 119 no 100.0 0.0 0.000 0.000 0.000 10 8 no 0.086 0 0
1 80 LYS QG 33 no 100.0 100.0 1.365 1.365 0.000 21 10 no 0.018 0 0
1 81 GLY QA 82 no 100.0 99.9 0.269 0.269 0.000 12 4 no 0.049 0 0
1 83 VAL QG 14 no 100.0 100.0 19.040 19.042 0.002 42 11 no 0.121 0 0
1 85 ASN QB 81 no 100.0 100.0 0.875 0.875 0.000 12 4 no 0.023 0 0
1 85 ASN QD 37 no 100.0 100.0 1.023 1.023 0.000 18 3 no 0.038 0 0
1 88 CYS QB 182 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.068 0 0
1 89 LEU QB 206 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.000 0 0
1 89 LEU QD 23 no 100.0 100.0 14.117 14.118 0.000 36 13 no 0.056 0 0
1 90 PRO QB 220 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 90 PRO QD 235 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.000 0 0
1 90 PRO QG 196 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.000 0 0
1 92 LEU QB 172 no 85.0 100.0 0.059 0.059 0.000 5 4 no 0.000 0 0
1 92 LEU QD 34 no 100.0 100.0 9.129 9.129 0.000 20 8 no 0.037 0 0
1 93 ILE QG 69 no 100.0 99.9 0.371 0.371 0.000 13 0 no 0.059 0 0
1 94 LEU QB 96 no 85.0 100.0 0.089 0.089 0.000 11 5 no 0.000 0 0
1 94 LEU QD 7 no 100.0 100.0 28.761 28.765 0.003 46 19 no 0.080 0 0
1 95 HIS QB 71 no 100.0 100.0 0.467 0.467 0.000 13 3 no 0.000 0 0
1 96 ASN QB 152 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 96 ASN QD 102 no 95.0 100.0 0.449 0.449 0.000 10 2 no 0.033 0 0
1 97 LYS QB 116 no 100.0 0.0 0.000 0.000 0.000 10 6 no 0.000 0 0
1 97 LYS QD 115 no 100.0 0.0 0.000 0.000 0.000 10 6 no 0.000 0 0
1 97 LYS QE 205 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.000 0 0
1 97 LYS QG 109 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.000 0 0
1 98 MET QB 93 no 100.0 100.0 0.633 0.633 0.000 11 3 no 0.000 0 0
1 98 MET QG 151 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.016 0 0
1 99 LYS QB 47 no 100.0 99.8 0.761 0.763 0.001 17 9 no 0.115 0 0
1 99 LYS QD 58 no 95.0 100.0 2.332 2.333 0.001 15 4 no 0.121 0 0
1 99 LYS QE 204 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.000 0 0
1 99 LYS QG 54 no 100.0 99.7 0.119 0.120 0.000 15 2 no 0.064 0 0
1 100 ARG QB 219 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 100 ARG QD 181 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 100 ARG QG 150 no 100.0 0.0 0.000 0.002 0.002 6 0 no 0.200 0 0
1 101 GLU QG 180 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 102 LEU QB 61 no 100.0 100.0 0.477 0.477 0.000 15 8 no 0.000 0 0
1 102 LEU QD 17 no 100.0 100.0 8.602 8.602 0.000 41 16 no 0.036 0 0
1 103 GLN QB 80 no 100.0 100.0 0.635 0.635 0.000 12 4 no 0.000 0 0
1 103 GLN QE 68 no 100.0 99.3 0.162 0.163 0.001 14 7 no 0.079 0 0
1 103 GLN QG 74 no 100.0 100.0 0.049 0.049 0.000 13 5 no 0.000 0 0
1 104 ARG QB 179 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 104 ARG QD 178 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.035 0 0
1 104 ARG QG 76 no 95.0 99.8 1.177 1.179 0.002 12 0 no 0.104 0 0
1 105 VAL QG 13 no 100.0 100.0 19.412 19.417 0.005 42 11 no 0.247 0 0
1 106 GLU QB 87 no 100.0 99.9 1.967 1.968 0.001 12 6 no 0.061 0 0
1 106 GLU QG 32 no 100.0 99.9 0.998 0.999 0.001 21 10 no 0.115 0 0
1 107 ASP QB 149 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.042 0 0
1 108 SER QB 161 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.000 0 0
1 109 HIS QB 160 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.043 0 0
1 110 GLN QB 95 no 100.0 100.0 0.584 0.584 0.000 11 5 no 0.048 0 0
1 110 GLN QE 171 no 100.0 100.0 0.704 0.704 0.000 5 4 no 0.017 0 0
1 110 GLN QG 57 no 100.0 100.0 3.129 3.129 0.000 15 3 no 0.010 0 0
1 111 ILE QG 125 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.000 0 0
1 112 LEU QB 195 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.000 0 0
1 112 LEU QD 4 no 100.0 100.0 11.582 11.584 0.002 46 9 no 0.079 0 0
1 113 SER QB 106 no 100.0 100.0 1.189 1.189 0.000 10 3 no 0.011 0 0
1 114 GLN QB 108 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.037 0 0
1 114 GLN QE 134 no 75.0 97.9 0.177 0.181 0.004 8 2 no 0.170 0 0
1 114 GLN QG 177 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.011 0 0
1 117 HIS QB 148 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 118 ASP QB 147 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 119 LEU QB 159 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.000 0 0
1 119 LEU QD 19 no 100.0 100.0 5.859 5.860 0.001 39 10 no 0.052 0 0
1 120 ASN QB 92 no 95.0 100.0 1.078 1.078 0.000 11 3 no 0.081 0 0
1 120 ASN QD 123 no 100.0 99.9 1.568 1.569 0.001 9 3 no 0.071 0 0
1 121 GLU QB 132 no 100.0 100.0 0.056 0.056 0.000 8 1 no 0.000 0 0
1 121 GLU QG 56 no 100.0 99.7 2.911 2.919 0.008 15 3 no 0.179 0 0
1 122 CYS QB 176 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.013 0 0
1 123 SER QB 175 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 124 TRP QB 234 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.000 0 0
1 125 SER QB 174 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 126 LEU QB 64 no 65.0 98.9 0.108 0.110 0.001 14 4 no 0.098 0 0
1 126 LEU QD 22 no 100.0 99.9 8.338 8.347 0.008 38 12 no 0.186 0 0
1 127 ASN QB 203 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.000 0 0
1 128 ILE QG 79 no 100.0 0.0 0.000 0.000 0.000 12 4 no 0.000 0 0
1 129 LEU QB 75 no 95.0 100.0 0.185 0.185 0.000 13 8 no 0.033 0 0
1 129 LEU QD 6 no 100.0 100.0 15.069 15.070 0.001 46 17 no 0.052 0 0
1 131 ILE QG 99 no 100.0 0.0 0.000 0.000 0.000 10 0 no 0.016 0 0
1 133 LYS QE 218 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 133 LYS QG 168 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.000 0 0
1 134 PRO QD 202 no 100.0 0.0 0.000 0.000 0.000 4 4 no 0.000 0 0
1 135 GLN QG 217 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 137 LYS QD 216 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 139 ASP QB 215 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 140 ASP QB 214 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 141 LEU QB 194 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.000 0 0
1 141 LEU QD 20 no 100.0 100.0 8.166 8.167 0.001 39 18 no 0.081 0 0
1 142 ASP QB 213 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 143 ARG QB 158 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.000 0 0
1 143 ARG QD 212 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 143 ARG QG 101 no 100.0 0.0 0.000 0.001 0.001 10 2 no 0.055 0 0
1 144 PHE QB 146 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 145 VAL QG 12 no 100.0 100.0 15.827 15.829 0.002 44 14 no 0.090 0 0
1 146 MET QB 91 no 100.0 100.0 1.143 1.143 0.000 11 3 no 0.001 0 0
1 146 MET QG 43 no 100.0 100.0 0.616 0.616 0.000 18 7 no 0.000 0 0
1 147 VAL QG 9 no 100.0 100.0 26.280 26.280 0.000 45 13 no 0.034 0 0
1 149 LYS QB 42 no 100.0 100.0 0.386 0.386 0.000 18 7 no 0.000 0 0
1 149 LYS QD 193 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.000 0 0
1 149 LYS QE 167 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.020 0 0
1 149 LYS QG 145 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 151 VAL QG 24 no 100.0 100.0 14.565 14.568 0.002 34 12 no 0.078 0 0
1 152 PRO QB 77 no 80.0 99.9 0.170 0.170 0.000 12 2 no 0.039 0 0
1 152 PRO QD 114 no 100.0 0.0 0.000 0.000 0.000 10 6 no 0.012 0 0
1 152 PRO QG 233 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.000 0 0
1 153 ASP QB 144 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.019 0 0
1 154 ASP QB 192 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.029 0 0
1 156 LYS QB 51 no 55.0 100.0 0.888 0.888 0.000 16 7 no 0.048 0 0
1 156 LYS QD 113 no 100.0 0.0 0.000 0.000 0.000 10 6 no 0.011 0 0
1 156 LYS QE 232 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.000 0 0
1 156 LYS QG 211 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 157 GLN QB 48 no 100.0 99.8 0.113 0.113 0.000 17 10 no 0.063 0 0
1 157 GLN QE 98 no 100.0 99.8 0.144 0.145 0.000 11 9 no 0.063 0 0
1 157 GLN QG 44 no 100.0 99.8 0.081 0.082 0.000 18 9 no 0.031 0 0
1 158 LEU QB 107 no 100.0 0.0 0.000 0.000 0.000 10 4 no 0.000 0 0
1 158 LEU QD 21 no 100.0 100.0 4.498 4.499 0.001 38 12 no 0.074 0 0
1 162 ILE QG 210 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 163 ASN QB 100 no 100.0 0.0 0.000 0.002 0.002 10 2 no 0.066 0 0
1 163 ASN QD 30 no 100.0 99.9 1.421 1.422 0.001 25 10 no 0.071 0 0
1 165 ASN QB 67 no 70.0 100.0 0.157 0.157 0.000 14 6 no 0.014 0 0
1 165 ASN QD 46 no 100.0 100.0 2.079 2.079 0.000 17 4 no 0.007 0 0
1 167 GLU QB 133 no 100.0 100.0 1.184 1.184 0.000 8 2 no 0.057 0 0
1 167 GLU QG 45 no 100.0 99.9 1.397 1.399 0.002 17 2 no 0.072 0 0
1 169 LEU QB 66 no 35.0 100.0 0.015 0.015 0.000 14 6 no 0.000 0 0
1 169 LEU QD 10 no 100.0 100.0 22.842 22.844 0.002 44 10 no 0.056 0 0
1 170 PHE QB 173 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 171 ARG QB 157 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.000 0 0
1 171 ARG QD 201 no 0.0 0.0 0.000 0.002 0.002 4 4 no 0.105 0 0
1 171 ARG QG 231 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.041 0 0
1 172 PRO QB 209 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 172 PRO QD 35 no 100.0 98.9 0.198 0.200 0.002 19 8 no 0.105 0 0
1 172 PRO QG 170 no 100.0 100.0 2.535 2.535 0.000 5 2 no 0.062 0 0
1 173 GLY QA 53 no 80.0 99.2 0.193 0.194 0.002 16 12 no 0.095 0 0
1 174 PRO QD 166 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.065 0 0
1 174 PRO QG 200 no 100.0 0.0 0.000 0.001 0.001 4 4 no 0.095 0 0
1 176 SER QB 208 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
stop_
save_
Contact the webmaster for help, if required. Saturday, May 18, 2024 1:37:02 AM GMT (wattos1)