NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
571130 |
2mhg   |
19632 | cing | 4-filtered-FRED | Wattos | check | stereo assignment | distance |
data_2mhg
save_assign_stereo
_Stereo_assign_list.Sf_category stereo_assignments
_Stereo_assign_list.Triplet_count 182
_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 0.552
_Stereo_assign_list.Total_e_high_states 132.225
_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 7 PRO QB 179 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 7 PRO QD 146 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.035 0 0
1 8 SER QB 178 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 9 GLY QA 109 no 100.0 0.0 0.000 0.001 0.001 6 6 no 0.068 0 0
1 10 GLU QB 83 no 100.0 0.0 0.000 0.002 0.002 8 4 no 0.104 0 0
1 11 PRO QB 32 no 100.0 99.5 4.818 4.842 0.024 13 2 no 0.301 0 0
1 11 PRO QD 82 no 90.0 98.2 0.165 0.168 0.003 8 4 no 0.116 0 0
1 11 PRO QG 24 no 100.0 99.8 3.159 3.165 0.007 14 2 no 0.125 0 0
1 12 ASP QB 153 no 100.0 0.0 0.000 0.001 0.001 4 2 no 0.068 0 0
1 13 VAL QG 3 no 100.0 99.8 6.799 6.811 0.011 37 12 no 0.145 0 0
1 15 ILE QG 41 no 100.0 100.0 0.474 0.474 0.000 12 2 no 0.044 0 0
1 16 ARG QB 145 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.042 0 0
1 16 ARG QD 177 no 0.0 0.0 0.000 0.003 0.003 2 0 no 0.137 0 0
1 16 ARG QG 144 no 0.0 0.0 0.000 0.001 0.001 4 0 no 0.080 0 0
1 17 GLN QB 87 no 100.0 99.8 3.269 3.277 0.007 7 0 no 0.131 0 0
1 17 GLN QE 176 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 17 GLN QG 98 no 100.0 0.0 0.000 0.001 0.001 6 0 no 0.083 0 0
1 18 GLU QB 21 no 100.0 99.9 1.004 1.004 0.001 15 2 no 0.094 0 0
1 20 ASP QB 28 no 100.0 95.6 0.246 0.257 0.011 14 7 no 0.191 0 0
1 21 LYS QB 36 no 100.0 100.0 1.359 1.360 0.001 12 1 no 0.054 0 0
1 21 LYS QD 175 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.034 0 0
1 21 LYS QG 182 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.000 0 0
1 23 ILE QG 74 no 100.0 0.0 0.000 0.000 0.000 8 0 no 0.077 0 0
1 24 GLN QB 8 no 100.0 99.9 1.220 1.221 0.001 20 8 no 0.091 0 0
1 24 GLN QE 85 no 100.0 0.0 0.000 0.000 0.000 8 6 no 0.000 0 0
1 24 GLN QG 23 no 100.0 0.0 0.000 0.005 0.005 14 2 no 0.110 0 0
1 25 GLU QB 45 no 100.0 100.0 0.558 0.558 0.000 11 0 no 0.000 0 0
1 25 GLU QG 44 no 75.0 90.6 0.065 0.072 0.007 11 0 no 0.116 0 0
1 26 TYR QB 97 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 27 ARG QB 73 no 100.0 99.9 1.070 1.071 0.001 8 0 no 0.063 0 0
1 27 ARG QG 143 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.006 0 0
1 28 VAL QG 4 no 100.0 0.0 0.000 0.001 0.001 30 18 no 0.063 0 0
1 29 ASN QB 81 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 29 ASN QD 42 no 100.0 99.8 1.696 1.700 0.004 12 4 no 0.085 0 0
1 31 PHE QB 80 no 100.0 0.0 0.000 0.000 0.000 8 4 no 0.000 0 0
1 32 LEU QB 142 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 32 LEU QD 72 no 100.0 0.0 0.000 0.002 0.002 8 0 no 0.129 0 0
1 33 TYR QB 105 no 95.0 100.0 0.387 0.387 0.000 6 2 no 0.000 0 0
1 35 ILE QG 141 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.027 0 0
1 36 LYS QB 96 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 36 LYS QG 26 no 55.0 98.0 0.090 0.092 0.002 14 3 no 0.177 0 0
1 37 VAL QG 40 no 100.0 0.0 0.000 0.014 0.014 12 2 no 0.155 0 0
1 38 VAL QG 6 no 100.0 100.0 4.210 4.210 0.000 27 11 no 0.044 0 0
1 39 PRO QB 33 no 100.0 100.0 1.634 1.635 0.001 12 0 no 0.061 0 0
1 39 PRO QD 9 no 100.0 99.7 3.146 3.155 0.009 19 8 no 0.155 0 0
1 40 LYS QB 19 no 100.0 98.7 2.218 2.248 0.030 16 6 no 0.256 0 0
1 40 LYS QG 77 no 100.0 0.0 0.000 0.003 0.003 8 2 no 0.125 0 0
1 41 HIS QB 152 no 100.0 0.0 0.000 0.005 0.005 4 2 no 0.138 0 0
1 42 GLY QA 71 no 100.0 0.0 0.000 0.001 0.001 8 0 no 0.067 0 0
1 43 LYS QB 151 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.015 0 0
1 44 PRO QB 30 no 100.0 0.0 0.000 0.001 0.001 14 8 no 0.094 0 0
1 44 PRO QD 47 no 100.0 99.9 1.110 1.111 0.001 11 4 no 0.099 0 0
1 45 TYR QB 111 no 100.0 99.9 1.851 1.852 0.002 5 0 no 0.080 0 0
1 46 PHE QB 174 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 47 LEU QB 107 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.000 0 0
1 47 LEU QD 13 no 100.0 0.0 0.000 0.002 0.002 18 6 no 0.078 0 0
1 48 VAL QG 53 no 100.0 0.0 0.000 0.000 0.000 10 0 no 0.000 0 0
1 49 ARG QB 140 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.025 0 0
1 49 ARG QD 95 no 0.0 0.0 0.000 0.001 0.001 6 0 no 0.068 0 0
1 49 ARG QG 173 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 51 ASP QB 139 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 53 SER QB 138 no 100.0 0.0 0.000 0.006 0.006 4 0 no 0.158 0 0
1 54 ASP QB 172 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 55 GLY QA 171 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.017 0 0
1 56 ASN QB 137 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 57 PHE QB 17 no 100.0 99.9 1.281 1.282 0.002 16 2 no 0.100 0 0
1 58 ILE QG 94 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
1 59 ARG QB 136 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 59 ARG QD 170 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 60 SER QB 169 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 61 ASP QB 135 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 62 GLN QB 55 no 100.0 99.5 1.199 1.205 0.006 10 4 no 0.287 0 0
1 62 GLN QG 168 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 63 PRO QB 167 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.019 0 0
1 63 PRO QD 104 no 100.0 0.0 0.000 0.002 0.002 6 2 no 0.088 0 0
1 64 ASP QB 166 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.021 0 0
1 65 LYS QB 70 no 100.0 0.0 0.000 0.005 0.005 8 0 no 0.161 0 0
1 65 LYS QG 76 no 100.0 0.0 0.000 0.005 0.005 8 2 no 0.146 0 0
1 66 LEU QB 134 no 100.0 0.0 0.000 0.003 0.003 4 0 no 0.133 0 0
1 67 ILE QG 133 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
1 68 PRO QD 61 no 100.0 100.0 0.759 0.760 0.000 9 2 no 0.022 0 0
1 68 PRO QG 100 no 100.0 99.0 1.650 1.666 0.016 6 1 no 0.175 0 0
1 69 GLN QB 132 no 100.0 0.0 0.000 0.003 0.003 4 0 no 0.251 0 0
1 69 GLN QG 69 no 100.0 0.0 0.000 0.014 0.014 8 0 no 0.196 0 0
1 70 TRP QB 52 no 100.0 100.0 1.090 1.090 0.000 10 0 no 0.028 0 0
1 71 GLU QB 15 no 100.0 99.7 5.658 5.672 0.014 17 6 no 0.168 0 0
1 71 GLU QG 165 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
1 72 ILE QG 58 no 100.0 99.6 1.276 1.281 0.005 9 1 no 0.168 0 0
1 73 PHE QB 131 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.045 0 0
1 74 SER QB 103 no 100.0 0.0 0.000 0.001 0.001 6 2 no 0.084 0 0
1 75 TRP QB 130 no 100.0 0.0 0.000 0.001 0.001 4 0 no 0.117 0 0
2 7 PRO QB 164 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
2 7 PRO QD 129 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.018 0 0
2 8 SER QB 163 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
2 9 GLY QA 108 no 0.0 0.0 0.000 0.000 0.000 6 6 no 0.042 0 0
2 10 GLU QB 79 no 100.0 0.0 0.000 0.002 0.002 8 4 no 0.152 0 0
2 11 PRO QB 39 no 100.0 99.6 4.636 4.656 0.020 12 2 no 0.219 0 0
2 11 PRO QD 78 no 80.0 97.8 0.150 0.154 0.003 8 4 no 0.152 0 0
2 11 PRO QG 31 no 100.0 99.7 3.072 3.080 0.008 13 2 no 0.101 0 0
2 12 ASP QB 150 no 100.0 0.0 0.000 0.001 0.001 4 2 no 0.096 0 0
2 13 VAL QG 2 no 100.0 99.8 7.352 7.363 0.012 37 12 no 0.116 0 0
2 15 ILE QG 38 no 100.0 100.0 0.500 0.500 0.000 12 2 no 0.042 0 0
2 16 ARG QB 128 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.059 0 0
2 16 ARG QD 162 no 100.0 0.0 0.000 0.006 0.006 2 0 no 0.157 0 0
2 16 ARG QG 127 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.042 0 0
2 17 GLN QB 86 no 100.0 99.5 3.372 3.388 0.016 7 0 no 0.337 0 0
2 17 GLN QE 161 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
2 17 GLN QG 93 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.006 0 0
2 18 GLU QB 20 no 100.0 99.9 1.181 1.182 0.001 15 2 no 0.074 0 0
2 20 ASP QB 27 no 100.0 94.9 0.138 0.146 0.007 14 7 no 0.156 0 0
2 21 LYS QB 35 no 100.0 99.9 1.283 1.284 0.001 12 1 no 0.075 0 0
2 21 LYS QD 160 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.016 0 0
2 21 LYS QG 181 no 100.0 0.0 0.000 0.000 0.000 2 2 no 0.000 0 0
2 23 ILE QG 68 no 100.0 0.0 0.000 0.001 0.001 8 0 no 0.078 0 0
2 24 GLN QB 7 no 100.0 99.9 1.206 1.207 0.001 20 8 no 0.070 0 0
2 24 GLN QE 84 no 100.0 0.0 0.000 0.000 0.000 8 6 no 0.000 0 0
2 24 GLN QG 22 no 100.0 0.0 0.000 0.005 0.005 14 2 no 0.137 0 0
2 25 GLU QB 43 no 100.0 100.0 0.652 0.652 0.000 11 0 no 0.000 0 0
2 25 GLU QG 126 no 100.0 0.0 0.000 0.001 0.001 4 0 no 0.054 0 0
2 26 TYR QB 92 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.014 0 0
2 27 ARG QB 67 no 100.0 100.0 1.104 1.104 0.001 8 0 no 0.072 0 0
2 27 ARG QG 125 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.005 0 0
2 28 VAL QG 1 no 100.0 100.0 21.693 21.695 0.003 50 23 no 0.093 0 0
2 29 ASN QB 102 no 100.0 0.0 0.000 0.000 0.000 6 2 no 0.082 0 0
2 29 ASN QD 48 no 100.0 99.7 1.454 1.458 0.004 11 5 no 0.104 0 0
2 31 PHE QB 56 no 100.0 0.0 0.000 0.000 0.000 10 6 no 0.044 0 0
2 32 LEU QB 124 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
2 32 LEU QD 66 no 100.0 0.0 0.000 0.003 0.003 8 0 no 0.155 0 0
2 33 TYR QB 101 no 90.0 100.0 0.428 0.428 0.000 6 2 no 0.021 0 0
2 35 ILE QG 123 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.023 0 0
2 36 LYS QB 91 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
2 36 LYS QG 25 no 60.0 100.0 0.037 0.037 0.000 14 3 no 0.000 0 0
2 37 VAL QG 37 no 95.0 0.0 0.000 0.018 0.018 12 2 no 0.160 0 0
2 38 VAL QG 5 no 100.0 100.0 4.089 4.089 0.000 27 11 no 0.005 0 0
2 39 PRO QB 34 no 100.0 99.9 2.827 2.829 0.002 12 1 no 0.088 0 0
2 39 PRO QD 10 no 100.0 99.6 3.010 3.022 0.012 19 9 no 0.160 0 0
2 40 LYS QB 18 no 100.0 98.9 1.994 2.017 0.023 16 6 no 0.230 0 0
2 40 LYS QG 75 no 100.0 0.0 0.000 0.004 0.004 8 2 no 0.156 0 0
2 41 HIS QB 149 no 100.0 0.0 0.000 0.004 0.004 4 2 no 0.108 0 0
2 42 GLY QA 46 no 100.0 99.8 0.489 0.489 0.001 11 3 no 0.067 0 0
2 43 LYS QB 62 no 100.0 99.9 0.921 0.922 0.001 9 5 no 0.115 0 0
2 44 PRO QB 29 no 100.0 0.0 0.000 0.000 0.000 14 8 no 0.054 0 0
2 44 PRO QD 49 no 100.0 99.9 1.498 1.499 0.001 11 6 no 0.115 0 0
2 45 TYR QB 110 no 100.0 99.9 1.677 1.679 0.002 5 0 no 0.113 0 0
2 46 PHE QB 54 no 100.0 100.0 0.153 0.153 0.000 10 2 no 0.017 0 0
2 47 LEU QB 106 no 100.0 0.0 0.000 0.000 0.000 6 4 no 0.001 0 0
2 47 LEU QD 12 no 100.0 0.0 0.000 0.002 0.002 18 6 no 0.083 0 0
2 48 VAL QG 51 no 100.0 0.0 0.000 0.000 0.000 10 0 no 0.049 0 0
2 49 ARG QB 122 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.076 0 0
2 49 ARG QD 90 no 100.0 0.0 0.000 0.003 0.003 6 0 no 0.210 0 0
2 49 ARG QG 159 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
2 51 ASP QB 121 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
2 53 SER QB 120 no 100.0 0.0 0.000 0.004 0.004 4 0 no 0.164 0 0
2 54 ASP QB 65 no 100.0 99.1 0.512 0.516 0.005 8 0 no 0.189 0 0
2 55 GLY QA 148 no 100.0 0.0 0.000 0.012 0.012 4 2 no 0.270 0 0
2 56 ASN QB 11 no 95.0 96.7 0.967 0.999 0.033 18 4 no 0.296 0 0
2 56 ASN QD 180 no 100.0 0.0 0.000 0.009 0.009 2 2 no 0.296 0 0
2 57 PHE QB 16 no 100.0 99.9 1.197 1.199 0.002 16 2 no 0.104 0 0
2 58 ILE QG 89 no 100.0 0.0 0.000 0.000 0.000 6 0 no 0.000 0 0
2 59 ARG QB 119 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
2 59 ARG QD 158 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
2 60 SER QB 147 no 100.0 0.0 0.000 0.000 0.000 4 2 no 0.000 0 0
2 61 ASP QB 118 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
2 62 GLN QG 157 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
2 63 PRO QB 156 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.056 0 0
2 63 PRO QD 117 no 100.0 0.0 0.000 0.002 0.002 4 0 no 0.106 0 0
2 64 ASP QB 155 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
2 65 LYS QB 64 no 0.0 0.0 0.000 0.002 0.002 8 0 no 0.112 0 0
2 65 LYS QG 88 no 100.0 0.0 0.000 0.003 0.003 6 0 no 0.178 0 0
2 66 LEU QB 116 no 100.0 0.0 0.000 0.002 0.002 4 0 no 0.120 0 0
2 67 ILE QG 115 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.000 0 0
2 68 PRO QD 60 no 100.0 100.0 0.729 0.729 0.000 9 2 no 0.000 0 0
2 68 PRO QG 99 no 100.0 98.5 1.445 1.466 0.021 6 1 no 0.192 0 0
2 69 GLN QB 114 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.092 0 0
2 69 GLN QG 63 no 100.0 0.0 0.000 0.013 0.013 8 0 no 0.147 0 0
2 70 TRP QB 50 no 100.0 100.0 1.079 1.079 0.000 10 0 no 0.004 0 0
2 71 GLU QB 14 no 100.0 99.8 5.581 5.595 0.014 17 6 no 0.166 0 0
2 71 GLU QG 154 no 100.0 0.0 0.000 0.000 0.000 2 0 no 0.000 0 0
2 72 ILE QG 57 no 100.0 99.4 1.247 1.255 0.008 9 1 no 0.166 0 0
2 73 PHE QB 113 no 100.0 0.0 0.000 0.001 0.001 4 0 no 0.049 0 0
2 74 SER QB 59 no 100.0 99.6 0.538 0.540 0.002 9 2 no 0.121 0 0
2 75 TRP QB 112 no 100.0 0.0 0.000 0.000 0.000 4 0 no 0.075 0 0
stop_
save_
Contact the webmaster for help, if required. Monday, April 29, 2024 10:29:21 AM GMT (wattos1)