data_3STN

_pdbx_vrpt_database.id    PDB
_pdbx_vrpt_database.code  3STN
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   x-ray
#
_pdbx_vrpt_summary.entry_id                    3STN
_pdbx_vrpt_summary.PDB_deposition_date         2011-07-11
_pdbx_vrpt_summary.PDB_revision_number         3
_pdbx_vrpt_summary.PDB_revision_date           2024-03-20
_pdbx_vrpt_summary.report_creation_date        2024-03-10:00:57
_pdbx_vrpt_summary.attempted_validation_steps  molprobity,validation-pack,xtriage,eds,percentiles,writexml,writecif,writepdf
_pdbx_vrpt_summary.ligands_for_buster_report   N
#
loop_
_pdbx_vrpt_entity.id
_pdbx_vrpt_entity.type
_pdbx_vrpt_entity.description
1  polymer  "Fatty acid-binding protein, liver"  
2  water    water  
#
loop_
_pdbx_vrpt_asym.label_asym_id
_pdbx_vrpt_asym.entity_id
A  1  
B  2  
#
loop_
_pdbx_vrpt_percentile_list.id
_pdbx_vrpt_percentile_list.range
_pdbx_vrpt_percentile_list.exp_method
1  all    x-ray  
2  2.595  x-ray  
#
loop_
_pdbx_vrpt_percentile_type.id
_pdbx_vrpt_percentile_type.type
1  all_atom_clashscore           
2  Ramachandran_outlier_percent  
3  rotamer_outliers_percent      
4  RSRZ_outliers_percent         
5  R_value_R_free                
#
loop_
_pdbx_vrpt_percentile_conditions.id
_pdbx_vrpt_percentile_conditions.percentile_list_id
_pdbx_vrpt_percentile_conditions.type_id
_pdbx_vrpt_percentile_conditions.rank
_pdbx_vrpt_percentile_conditions.number_entries_total
_pdbx_vrpt_percentile_conditions.res_high
_pdbx_vrpt_percentile_conditions.res_low
 1  1  1  14.39  141614     ?     ?  
 2  2  1  28.34    3518  2.60  2.60  
 3  1  2  19.33  138981     ?     ?  
 4  2  2  38.76    3455  2.60  2.60  
 5  1  3   0.81  138945     ?     ?  
 6  2  3   1.42    3455  2.60  2.60  
 7  1  4  85.69  127900     ?     ?  
 8  2  4  83.96    3104  2.60  2.60  
 9  1  5  19.18  130704     ?     ?  
10  2  5  36.68    3163  2.60  2.60  
#
loop_
_pdbx_vrpt_percentile_entity_view.ordinal
_pdbx_vrpt_percentile_entity_view.conditions_id
_pdbx_vrpt_percentile_entity_view.type_id
_pdbx_vrpt_percentile_entity_view.label_asym_id
_pdbx_vrpt_percentile_entity_view.PDB_model_num
_pdbx_vrpt_percentile_entity_view.entity_id
_pdbx_vrpt_percentile_entity_view.auth_asym_id
_pdbx_vrpt_percentile_entity_view.rank
1  3  2  A  1  1  A  19.33  
2  4  2  A  1  1  A  38.76  
3  5  3  A  1  1  A   0.84  
4  6  3  A  1  1  A   1.48  
5  7  4  A  1  1  A  85.69  
6  8  4  A  1  1  A  83.96  
#
_pdbx_vrpt_summary_entity_geometry.ordinal          1
_pdbx_vrpt_summary_entity_geometry.PDB_model_num    1
_pdbx_vrpt_summary_entity_geometry.entity_id        1
_pdbx_vrpt_summary_entity_geometry.label_asym_id    A
_pdbx_vrpt_summary_entity_geometry.auth_asym_id     A
_pdbx_vrpt_summary_entity_geometry.angles_RMSZ      0.58
_pdbx_vrpt_summary_entity_geometry.bonds_RMSZ       0.63
_pdbx_vrpt_summary_entity_geometry.num_bonds_RMSZ   1010
_pdbx_vrpt_summary_entity_geometry.num_angles_RMSZ  1353
#
_pdbx_vrpt_summary_geometry.ordinal                        1
_pdbx_vrpt_summary_geometry.percent_ramachandran_outliers  0.80
_pdbx_vrpt_summary_geometry.percent_rotamer_outliers       21.43
_pdbx_vrpt_summary_geometry.clashscore                     15.35
_pdbx_vrpt_summary_geometry.num_H_reduce                   1019
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ                 1010
_pdbx_vrpt_summary_geometry.bonds_RMSZ                     0.63
_pdbx_vrpt_summary_geometry.num_angles_RMSZ                1353
_pdbx_vrpt_summary_geometry.angles_RMSZ                    0.58
#
_pdbx_vrpt_summary_diffraction.exp_method                x-ray
_pdbx_vrpt_summary_diffraction.ordinal                   1
_pdbx_vrpt_summary_diffraction.bulk_solvent_b            33.177
_pdbx_vrpt_summary_diffraction.Wilson_B_estimate         61.440
_pdbx_vrpt_summary_diffraction.I_over_sigma              0.90(2.58A)
_pdbx_vrpt_summary_diffraction.num_miller_indices        4252
_pdbx_vrpt_summary_diffraction.bulk_solvent_k            0.279
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L_mean     0.478
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L2_mean    0.313
_pdbx_vrpt_summary_diffraction.Fo_Fc_correlation         0.925
_pdbx_vrpt_summary_diffraction.DCC_R                     0.25
_pdbx_vrpt_summary_diffraction.DCC_Rfree                 0.27
_pdbx_vrpt_summary_diffraction.EDS_R                     0.25
_pdbx_vrpt_summary_diffraction.EDS_res_high              2.59
_pdbx_vrpt_summary_diffraction.EDS_res_low               45.25
_pdbx_vrpt_summary_diffraction.Wilson_B_aniso            "[58.814,63.117,63.257,0.000,0.000,0.000]"
_pdbx_vrpt_summary_diffraction.data_anisotropy           0.072
_pdbx_vrpt_summary_diffraction.trans_NCS_details         "The largest off-origin peak in the Patterson function is 9.38% of the height of the origin peak. No significant pseudotranslation is detected."
_pdbx_vrpt_summary_diffraction.B_factor_type             FULL
_pdbx_vrpt_summary_diffraction.acentric_outliers         0
_pdbx_vrpt_summary_diffraction.centric_outliers          0
_pdbx_vrpt_summary_diffraction.data_completeness         99.23
_pdbx_vrpt_summary_diffraction.number_reflns_R_free      192
_pdbx_vrpt_summary_diffraction.percent_free_reflections  4.52
_pdbx_vrpt_summary_diffraction.percent_RSRZ_outliers     0.79
_pdbx_vrpt_summary_diffraction.PDB_resolution_high       2.60
_pdbx_vrpt_summary_diffraction.PDB_resolution_low        9.98
_pdbx_vrpt_summary_diffraction.PDB_R                     0.25
_pdbx_vrpt_summary_diffraction.PDB_Rfree                 0.27
#
loop_
_pdbx_vrpt_model_instance.id
_pdbx_vrpt_model_instance.PDB_model_num
_pdbx_vrpt_model_instance.entity_id
_pdbx_vrpt_model_instance.label_asym_id
_pdbx_vrpt_model_instance.label_seq_id
_pdbx_vrpt_model_instance.label_comp_id
_pdbx_vrpt_model_instance.auth_asym_id
_pdbx_vrpt_model_instance.auth_seq_id
_pdbx_vrpt_model_instance.label_alt_id
_pdbx_vrpt_model_instance.PDB_ins_code
_pdbx_vrpt_model_instance.count_bond_outliers
_pdbx_vrpt_model_instance.count_angle_outliers
_pdbx_vrpt_model_instance.count_clashes
_pdbx_vrpt_model_instance.count_plane_outliers
  1  1  1  A    4  SER  A    1  .  ?        ?     ?     ?     1  
  2  1  1  A    5  SER  A    2  .  ?        ?     ?     ?     ?  
  3  1  1  A    6  PHE  A    3  .  ?        ?     ?     ?     ?  
  4  1  1  A    7  SER  A    4  .  ?        ?     ?     ?     1  
  5  1  1  A    8  GLY  A    5  .  ?        ?     ?     ?     1  
  6  1  1  A    9  LYS  A    6  .  ?        ?     ?     1     ?  
  7  1  1  A   10  TYR  A    7  .  ?        ?     ?     ?     ?  
  8  1  1  A   11  GLN  A    8  .  ?        ?     ?     ?     ?  
  9  1  1  A   12  LEU  A    9  .  ?        ?     ?     ?     ?  
 10  1  1  A   13  GLN  A   10  .  ?        ?     ?     ?     ?  
 11  1  1  A   14  SER  A   11  .  ?        ?     ?     ?     ?  
 12  1  1  A   15  GLN  A   12  .  ?        ?     ?     ?     ?  
 13  1  1  A   16  GLU  A   13  .  ?        ?     ?     ?     ?  
 14  1  1  A   17  ASN  A   14  .  ?        ?     ?     ?     ?  
 15  1  1  A   18  PHE  A   15  .  ?        ?     ?     ?     1  
 16  1  1  A   19  GLU  A   16  .  ?        ?     ?     ?     ?  
 17  1  1  A   20  ALA  A   17  .  ?        ?     ?     ?     ?  
 18  1  1  A   21  PHE  A   18  .  ?        ?     ?     2     ?  
 19  1  1  A   22  MET  A   19  .  ?        ?     ?    11     ?  
 20  1  1  A   23  LYS  A   20  .  ?        ?     ?     ?     ?  
 21  1  1  A   24  ALA  A   21  .  ?        ?     ?     ?     ?  
 22  1  1  A   25  ILE  A   22  .  ?        ?     ?     7     ?  
 23  1  1  A   26  GLY  A   23  .  ?        ?     ?     ?     ?  
 24  1  1  A   27  LEU  A   24  .  ?        ?     ?    12     ?  
 25  1  1  A   28  PRO  A   25  .  ?        ?     ?     6     ?  
 26  1  1  A   29  GLU  A   26  .  ?        ?     ?     1     ?  
 27  1  1  A   30  GLU  A   27  .  ?        ?     ?     ?     ?  
 28  1  1  A   31  LEU  A   28  .  ?        ?     ?     2     ?  
 29  1  1  A   32  ILE  A   29  .  ?        ?     ?     1     ?  
 30  1  1  A   33  GLN  A   30  .  ?        ?     ?     2     1  
 31  1  1  A   34  LYS  A   31  .  ?        ?     ?     ?     ?  
 32  1  1  A   35  GLY  A   32  .  ?        ?     ?     1     ?  
 33  1  1  A   36  LYS  A   33  .  ?        ?     ?     ?     ?  
 34  1  1  A   37  ASP  A   34  .  ?        ?     ?     ?     ?  
 35  1  1  A   38  ILE  A   35  .  ?        ?     ?     1     ?  
 36  1  1  A   39  LYS  A   36  .  ?        ?     ?     ?     ?  
 37  1  1  A   40  GLY  A   37  .  ?        ?     ?     ?     ?  
 38  1  1  A   41  VAL  A   38  .  ?        ?     ?     ?     ?  
 39  1  1  A   42  SER  A   39  .  ?        ?     ?     ?     ?  
 40  1  1  A   43  GLU  A   40  .  ?        ?     ?     ?     ?  
 41  1  1  A   44  ILE  A   41  .  ?        ?     ?     ?     ?  
 42  1  1  A   45  VAL  A   42  .  ?        ?     ?     ?     ?  
 43  1  1  A   46  GLN  A   43  .  ?        ?     ?     ?     ?  
 44  1  1  A   47  ASN  A   44  .  ?        ?     ?     ?     ?  
 45  1  1  A   48  GLY  A   45  .  ?        ?     ?     ?     ?  
 46  1  1  A   49  LYS  A   46  .  ?        ?     ?     2     ?  
 47  1  1  A   50  HIS  A   47  A  ?        ?     ?     ?     ?  
 48  1  1  A   50  HIS  A   47  B  ?        ?     ?     ?     ?  
 49  1  1  A   51  PHE  A   48  .  ?        ?     ?     ?     ?  
 50  1  1  A   52  LYS  A   49  .  ?        ?     ?     ?     ?  
 51  1  1  A   53  PHE  A   50  .  ?        ?     ?     ?     ?  
 52  1  1  A   54  THR  A   51  .  ?        ?     ?     ?     ?  
 53  1  1  A   55  ILE  A   52  .  ?        ?     ?     ?     ?  
 54  1  1  A   56  THR  A   53  .  ?        ?     ?     ?     ?  
 55  1  1  A   57  ALA  A   54  .  ?        ?     ?     ?     ?  
 56  1  1  A   58  GLY  A   55  .  ?        ?     ?     ?     ?  
 57  1  1  A   59  SER  A   56  .  ?        ?     ?     ?     1  
 58  1  1  A   60  LYS  A   57  .  ?        ?     ?     ?     1  
 59  1  1  A   61  VAL  A   58  .  ?        ?     ?     ?     1  
 60  1  1  A   62  ILE  A   59  .  ?        ?     ?     ?     ?  
 61  1  1  A   63  GLN  A   60  .  ?        ?     ?     ?     ?  
 62  1  1  A   64  ASN  A   61  .  ?        ?     ?     ?     ?  
 63  1  1  A   65  GLU  A   62  .  ?        ?     ?     ?     ?  
 64  1  1  A   66  PHE  A   63  .  ?        ?     ?     ?     ?  
 65  1  1  A   67  THR  A   64  .  ?        ?     ?     ?     ?  
 66  1  1  A   68  VAL  A   65  .  ?        ?     ?     ?     ?  
 67  1  1  A   69  GLY  A   66  .  ?        ?     ?     ?     ?  
 68  1  1  A   70  GLU  A   67  .  ?        ?     ?     ?     ?  
 69  1  1  A   71  GLU  A   68  .  ?        ?     ?     ?     ?  
 70  1  1  A   72  CYS  A   69  .  ?        ?     ?     ?     ?  
 71  1  1  A   73  GLU  A   70  .  ?        ?     ?     ?     ?  
 72  1  1  A   74  LEU  A   71  .  ?        ?     ?     ?     ?  
 73  1  1  A   75  GLU  A   72  .  ?        ?     ?     ?     ?  
 74  1  1  A   76  THR  A   73  .  ?        ?     ?     1     ?  
 75  1  1  A   77  MET  A   74  .  ?        ?     ?     ?     ?  
 76  1  1  A   78  THR  A   75  .  ?        ?     ?     1     ?  
 77  1  1  A   79  GLY  A   76  .  ?        ?     ?     ?     ?  
 78  1  1  A   80  GLU  A   77  .  ?        ?     ?     2     ?  
 79  1  1  A   81  LYS  A   78  .  ?        ?     ?     ?     ?  
 80  1  1  A   82  VAL  A   79  .  ?        ?     ?     ?     ?  
 81  1  1  A   83  LYS  A   80  .  ?        ?     ?     2     ?  
 82  1  1  A   84  THR  A   81  .  ?        ?     ?     ?     ?  
 83  1  1  A   85  VAL  A   82  .  ?        ?     ?     ?     ?  
 84  1  1  A   86  VAL  A   83  .  ?        ?     ?     ?     ?  
 85  1  1  A   87  GLN  A   84  .  ?        ?     ?     ?     ?  
 86  1  1  A   88  LEU  A   85  .  ?        ?     ?     ?     ?  
 87  1  1  A   89  GLU  A   86  .  ?        ?     ?     ?     ?  
 88  1  1  A   90  GLY  A   87  .  ?        ?     1     ?     ?  
 89  1  1  A   91  ASP  A   88  .  ?        ?     ?     2     ?  
 90  1  1  A   92  ASN  A   89  .  ?        2     ?     ?     ?  
 91  1  1  A   93  LYS  A   90  .  ?        ?     ?     1     ?  
 92  1  1  A   94  LEU  A   91  .  ?        ?     ?     ?     ?  
 93  1  1  A   95  VAL  A   92  .  ?        ?     ?     ?     ?  
 94  1  1  A   96  THR  A   93  .  ?        ?     ?     ?     ?  
 95  1  1  A   97  THR  A   94  .  ?        ?     ?     ?     ?  
 96  1  1  A   98  PHE  A   95  .  ?        ?     ?     ?     ?  
 97  1  1  A   99  LYS  A   96  .  ?        ?     ?     ?     ?  
 98  1  1  A  100  ASN  A   97  .  ?        ?     ?     ?     ?  
 99  1  1  A  101  ILE  A   98  .  ?        ?     ?     ?     ?  
100  1  1  A  102  LYS  A   99  .  ?        ?     ?     ?     ?  
101  1  1  A  103  SER  A  100  .  ?        ?     ?     ?     ?  
102  1  1  A  104  VAL  A  101  .  ?        ?     ?     ?     ?  
103  1  1  A  105  THR  A  102  .  ?        ?     ?     ?     ?  
104  1  1  A  106  GLU  A  103  .  ?        ?     ?     1     ?  
105  1  1  A  107  LEU  A  104  .  ?        ?     ?     ?     ?  
106  1  1  A  108  ASN  A  105  .  ?        ?     ?     ?     ?  
107  1  1  A  109  GLY  A  106  .  ?        ?     ?     ?     ?  
108  1  1  A  110  ASP  A  107  .  ?        ?     ?     ?     ?  
109  1  1  A  111  ILE  A  108  .  ?        ?     ?     ?     ?  
110  1  1  A  112  ILE  A  109  .  ?        ?     ?     ?     ?  
111  1  1  A  113  THR  A  110  .  ?        ?     ?     ?     ?  
112  1  1  A  114  ASN  A  111  .  ?        ?     ?     ?     ?  
113  1  1  A  115  THR  A  112  .  ?        ?     ?     ?     ?  
114  1  1  A  116  MET  A  113  .  ?        ?     ?     ?     ?  
115  1  1  A  117  THR  A  114  .  ?        ?     ?     ?     ?  
116  1  1  A  118  LEU  A  115  .  ?        ?     ?     ?     ?  
117  1  1  A  119  GLY  A  116  .  ?        ?     ?     ?     ?  
118  1  1  A  120  ASP  A  117  .  ?        ?     ?     ?     ?  
119  1  1  A  121  ILE  A  118  .  ?        ?     ?     ?     ?  
120  1  1  A  122  VAL  A  119  .  ?        ?     ?     2     ?  
121  1  1  A  123  PHE  A  120  .  ?        ?     ?     ?     ?  
122  1  1  A  124  LYS  A  121  .  ?        ?     ?     ?     ?  
123  1  1  A  125  ARG  A  122  .  ?        ?     ?     ?     ?  
124  1  1  A  126  ILE  A  123  .  ?        ?     ?     ?     ?  
125  1  1  A  127  SER  A  124  .  ?        ?     ?     ?     ?  
126  1  1  A  128  LYS  A  125  .  ?        ?     ?     ?     ?  
127  1  1  A  129  ARG  A  126  .  ?        ?     ?     ?     ?  
128  1  1  A  130  ILE  A  127  .  ?        ?     ?     1     ?  
129  1  2  B    .  HOH  A  130  .  ?        ?     ?     ?     ?  
130  1  2  B    .  HOH  A  131  .  ?        ?     ?     ?     ?  
131  1  2  B    .  HOH  A  132  .  ?        ?     ?     ?     ?  
132  1  2  B    .  HOH  A  133  .  ?        ?     ?     ?     ?  
133  1  2  B    .  HOH  A  134  .  ?        ?     ?     ?     ?  
134  1  2  B    .  HOH  A  135  .  ?        ?     ?     ?     ?  
135  1  2  B    .  HOH  A  136  .  ?        ?     ?     ?     ?  
136  1  2  B    .  HOH  A  137  .  ?        ?     ?     ?     ?  
137  1  2  B    .  HOH  A  138  .  ?        ?     ?     ?     ?  
138  1  2  B    .  HOH  A  139  .  ?        ?     ?     ?     ?  
139  1  2  B    .  HOH  A  140  .  ?        ?     ?     ?     ?  
140  1  2  B    .  HOH  A  141  .  ?        ?     ?     ?     ?  
141  1  2  B    .  HOH  A  142  .  ?        ?     ?     ?     ?  
142  1  2  B    .  HOH  A  143  .  ?        ?     ?     ?     ?  
#
loop_
_pdbx_vrpt_model_instance_geometry.ordinal
_pdbx_vrpt_model_instance_geometry.instance_id
_pdbx_vrpt_model_instance_geometry.rotamer_class
_pdbx_vrpt_model_instance_geometry.phi
_pdbx_vrpt_model_instance_geometry.psi
_pdbx_vrpt_model_instance_geometry.ramachandran_class
_pdbx_vrpt_model_instance_geometry.flippable_sidechain
_pdbx_vrpt_model_instance_geometry.num_H_reduce
_pdbx_vrpt_model_instance_geometry.OWAB
_pdbx_vrpt_model_instance_geometry.num_bonds_RMSZ
_pdbx_vrpt_model_instance_geometry.bonds_RMSZ
_pdbx_vrpt_model_instance_geometry.num_angles_RMSZ
_pdbx_vrpt_model_instance_geometry.angles_RMSZ
_pdbx_vrpt_model_instance_geometry.program_for_bond_angle_geometry
_pdbx_vrpt_model_instance_geometry.average_occupancy
  1    1  OUTLIER       ?       ?  ?           ?     7   87.190     6  0.19     8  0.21  molprobity  1.000  
  2    2  t         -99.4   -30.2  Favored     ?     5  104.000     6  0.20     8  0.24  molprobity  1.000  
  3    3  m-85     -102.2    -3.5  Favored     ?     9   45.910    12  0.35    16  0.19  molprobity  1.000  
  4    4  OUTLIER   -87.2   136.3  Favored     ?     5   49.900     6  0.17     8  0.20  molprobity  1.000  
  5    5  ?         167.6   144.0  Favored     ?     3   48.210     4  0.32     5  0.29  molprobity  1.000  
  6    6  mttp      -84.2   133.2  Favored     ?    13   61.890     9  0.22    11  0.27  molprobity  1.000  
  7    7  m-85     -127.4   156.1  Favored     ?     9   48.360    13  0.45    18  0.24  molprobity  1.000  
  8    8  tt0      -136.2   147.6  Favored     ?     8   52.700     9  0.21    12  0.31  molprobity  1.000  
  9    9  tp        -63.7   142.4  Favored     ?    11   44.960     8  0.18    11  0.34  molprobity  1.000  
 10   10  mt-30    -110.2   -71.7  Allowed     ?     8   64.410     9  0.23    12  0.31  molprobity  1.000  
 11   11  OUTLIER  -118.2   162.7  Favored     ?     5   60.210     6  0.22     8  0.21  molprobity  1.000  
 12   12  pt20     -154.3   151.1  Favored     ?     8   60.960     9  0.20    12  0.34  molprobity  1.000  
 13   13  mt-10    -109.4   143.4  Favored     ?     6   69.030     9  0.24    12  0.28  molprobity  1.000  
 14   14  m120       62.5    36.1  Favored     1     6   65.980     8  0.20    11  0.32  molprobity  1.000  
 15   15  t80       -53.7   -45.2  Favored     ?     9   69.360    12  0.41    16  0.99  molprobity  1.000  
 16   16  OUTLIER   -69.3   -49.8  Favored     ?     6  118.030     9  1.28    12  1.67  molprobity  1.000  
 17   17  ?         -61.9   -49.3  Favored     ?     5   88.420     5  1.82     7  1.36  molprobity  1.000  
 18   18  t80       -62.7   -42.6  Favored     ?     9   67.300    12  2.00    16  0.72  molprobity  1.000  
 19   19  tpp       -78.9   -22.9  Favored     ?     9   96.530     8  0.24    10  0.29  molprobity  1.000  
 20   20  ?         -50.7   -59.6  Favored     ?     2   84.540     5  0.24     7  0.28  molprobity  1.000  
 21   21  ?         -78.3   -12.1  Favored     ?     5   77.340     5  0.59     7  1.32  molprobity  1.000  
 22   22  OUTLIER   -90.2   -14.7  Favored     ?    11  101.080     8  1.02    11  0.78  molprobity  1.000  
 23   23  ?         105.7    46.2  Allowed     ?     3  114.960     4  1.00     5  0.40  molprobity  1.000  
 24   24  OUTLIER  -105.5   143.5  Favored     ?    11  117.520     8  0.33    12  0.87  molprobity  1.000  
 25   25  Cg_exo    -71.0   112.0  Favored     ?     7  150.100     8  0.82    11  1.71  molprobity  1.000  
 26   26  tm-20     -62.9   -13.8  Favored     ?     6  147.340     9  0.21    12  0.28  molprobity  1.000  
 27   27  tt0       -47.1   -72.4  Allowed     ?     6  139.120     9  0.20    12  0.28  molprobity  1.000  
 28   28  OUTLIER   -75.2     4.3  Favored     ?    11  122.010     8  0.18    11  0.32  molprobity  1.000  
 29   29  OUTLIER   -67.7   -49.9  Favored     ?    11   91.460     8  0.20    11  0.42  molprobity  1.000  
 30   30  OUTLIER   -94.0   -18.0  Favored     ?     8  140.400     9  0.23    12  0.25  molprobity  1.000  
 31   31  tttt      -45.6   -53.9  Favored     ?    13  106.630     9  0.24    11  0.19  molprobity  1.000  
 32   32  ?         -69.6   -29.1  Favored     ?     3   85.080     4  0.28     5  0.33  molprobity  1.000  
 33   33  OUTLIER   -64.8   -21.3  Favored     ?    13   84.520     9  0.21    11  0.24  molprobity  1.000  
 34   34  OUTLIER  -124.6     8.9  Favored     ?     4   82.920     8  0.19    11  0.26  molprobity  1.000  
 35   35  mt        -71.2   133.1  Favored     ?    11   70.940     8  0.23    11  0.46  molprobity  1.000  
 36   36  mttp     -105.8    94.9  Favored     ?    13   67.910     9  0.20    11  0.19  molprobity  1.000  
 37   37  ?         -78.8   169.1  Favored     ?     3   74.880     4  0.33     5  0.33  molprobity  1.000  
 38   38  t        -121.2   134.3  Favored     ?     9   39.710     7  0.30    10  0.40  molprobity  1.000  
 39   39  m        -112.8   118.2  Favored     ?     5   46.430     6  0.20     8  0.21  molprobity  1.000  
 40   40  mt-10     -95.5   124.3  Favored     ?     6   62.280     9  0.21    12  0.27  molprobity  1.000  
 41   41  mt       -115.3   130.9  Favored     ?    11   39.020     8  0.23    11  0.43  molprobity  1.000  
 42   42  t        -114.4   120.0  Favored     ?     9   45.400     7  0.28    10  0.49  molprobity  1.000  
 43   43  tt0      -110.6   122.0  Favored     ?     8   55.400     9  0.21    12  0.28  molprobity  1.000  
 44   44  OUTLIER  -115.4    85.7  Favored     ?     6   87.650     8  0.15    11  0.27  molprobity  1.000  
 45   45  ?          63.7  -102.3  Allowed     ?     3   63.360     4  0.30     5  0.29  molprobity  1.000  
 46   46  OUTLIER  -102.7     0.3  Favored     ?    13   68.230     9  0.24    11  0.22  molprobity  1.000  
 47   47  m-70     -108.6   130.2  Favored     ?     7   48.740    11  0.17    15  0.21  molprobity  1.000  
 48   48  m-70     -108.6   130.2  Favored     ?     7   48.740    11  0.17    15  0.21  molprobity  1.000  
 49   49  m-85     -120.2   135.2  Favored     ?     8   47.820    12  0.37    16  0.19  molprobity  1.000  
 50   50  mttt     -105.1   124.6  Favored     ?    13   66.970     9  0.21    11  0.27  molprobity  1.000  
 51   51  m-85     -112.5   118.9  Favored     ?     9   61.500    12  0.35    16  0.19  molprobity  1.000  
 52   52  OUTLIER  -115.8   105.2  Favored     ?     7   48.950     7  0.21    10  0.60  molprobity  1.000  
 53   53  OUTLIER   -96.5   141.3  Favored     ?    11   60.010     8  0.21    11  0.46  molprobity  1.000  
 54   54  m        -131.6   121.9  Favored     ?     7   60.030     7  0.18    10  0.61  molprobity  1.000  
 55   55  ?        -138.7    92.9  Favored     ?     5   75.860     5  0.14     7  0.21  molprobity  1.000  
 56   56  ?          94.2  -110.7  Favored     ?     3   75.580     4  0.27     5  0.28  molprobity  1.000  
 57   57  OUTLIER  -130.2    18.4  Favored     ?     5  106.750     6  0.19     8  0.20  molprobity  1.000  
 58   58  tttt      -63.0    83.3  OUTLIER     ?    13   85.180     9  0.23    11  0.21  molprobity  1.000  
 59   59  t         -75.6   119.7  Favored     ?     9   61.220     7  0.26    10  0.45  molprobity  1.000  
 60   60  OUTLIER  -107.1   137.5  Favored     ?    11   66.980     8  0.21    11  0.45  molprobity  1.000  
 61   61  tt0      -123.8   128.2  Favored     1     8   57.530     9  0.23    12  0.29  molprobity  1.000  
 62   62  m-20     -122.8   150.3  Favored     ?     6   51.070     8  0.22    11  0.25  molprobity  1.000  
 63   63  pt-20    -135.9   151.6  Favored     ?     6   76.860     9  0.23    12  0.31  molprobity  1.000  
 64   64  p90      -150.1   157.1  Favored     ?     9   39.720    12  0.36    16  0.18  molprobity  1.000  
 65   65  m        -104.6   127.8  Favored     ?     7   41.080     7  0.22    10  0.64  molprobity  1.000  
 66   66  t         -62.5   124.8  Favored     ?     9   61.910     7  0.19    10  0.38  molprobity  1.000  
 67   67  ?         106.7   -19.8  Favored     ?     3   62.890     4  0.31     5  0.24  molprobity  1.000  
 68   68  mm-40    -115.5   164.9  Favored     ?     6   57.950     9  0.31    12  0.28  molprobity  1.000  
 69   69  OUTLIER   -58.6   156.9  Favored     ?     6   63.360     9  0.26    12  0.28  molprobity  1.000  
 70   70  p        -157.7   172.4  Favored     ?     5   80.010     6  0.30     8  0.27  molprobity  1.000  
 71   71  tt0      -126.4   108.1  Favored     ?     6   68.700     9  0.25    12  0.30  molprobity  1.000  
 72   72  mt       -102.2   123.5  Favored     ?    11   46.780     8  0.20    11  0.32  molprobity  1.000  
 73   73  tt0       -66.5   124.0  Favored     ?     6   58.170     9  0.25    12  0.26  molprobity  1.000  
 74   74  p         -98.0  -177.3  Favored     ?     7   56.700     7  0.20    10  0.62  molprobity  1.000  
 75   75  mtp       -69.9    -4.7  Favored     ?     9   89.030     8  0.23    10  0.30  molprobity  1.000  
 76   76  p         -98.3   -15.0  Favored     ?     7   62.660     7  0.14    10  0.60  molprobity  1.000  
 77   77  ?          99.2   -18.4  Favored     ?     3   49.490     4  0.29     5  0.26  molprobity  1.000  
 78   78  tt0       -77.2   135.6  Favored     ?     6   59.470     9  0.29    12  0.28  molprobity  1.000  
 79   79  mttt     -110.4   125.5  Favored     ?    13   57.340     9  0.21    11  0.24  molprobity  1.000  
 80   80  t        -129.3   136.4  Favored     ?     9   53.420     7  0.26    10  0.43  molprobity  1.000  
 81   81  OUTLIER   -87.1   121.8  Favored     ?    13   61.100     9  0.22    11  0.23  molprobity  1.000  
 82   82  t        -155.8  -178.8  Favored     ?     7   42.230     7  0.27    10  0.52  molprobity  1.000  
 83   83  t        -126.7   130.2  Favored     ?     9   42.380     7  0.27    10  0.45  molprobity  1.000  
 84   84  t         -95.5   134.5  Favored     ?     9   37.260     7  0.27    10  0.44  molprobity  1.000  
 85   85  mm100    -121.5   152.6  Favored     1     8   61.960     9  0.23    12  0.33  molprobity  1.000  
 86   86  mt       -101.2    90.4  Favored     ?    11   66.070     8  0.39    11  0.38  molprobity  1.000  
 87   87  mt-10     -90.2    74.9  Favored     ?     6   78.370     9  1.91    12  1.01  molprobity  1.000  
 88   88  ?         135.3  -156.1  Favored     ?     3   87.460     4  1.38     5  2.80  molprobity  1.000  
 89   89  p-10     -126.6    10.2  Favored     ?     4  116.780     8  1.30    11  1.98  molprobity  1.000  
 90   90  p-10     -153.9    10.0  Allowed     ?     6   73.530     8  3.10    11  1.55  molprobity  1.000  
 91   91  OUTLIER  -133.7   122.3  Favored     ?    13   49.110     9  1.94    11  1.00  molprobity  1.000  
 92   92  mt        -95.9   128.4  Favored     ?    11   42.550     8  0.19    11  0.26  molprobity  1.000  
 93   93  t        -127.3   126.5  Favored     ?     9   37.750     7  0.21    10  0.42  molprobity  1.000  
 94   94  t        -140.5   162.3  Favored     ?     7   35.810     7  0.25    10  0.58  molprobity  1.000  
 95   95  m        -125.3   125.1  Favored     ?     7   51.230     7  0.23    10  0.60  molprobity  1.000  
 96   96  p90      -135.6   136.2  Favored     ?     9   50.770    12  0.35    16  0.25  molprobity  1.000  
 97   97  mmmt       51.0    42.9  Favored     ?    13   62.190     9  0.22    11  0.29  molprobity  0.908  
 98   98  m-20       62.9    27.3  Favored     ?     6   57.860     8  0.20    11  0.33  molprobity  1.000  
 99   99  mt       -109.3   122.7  Favored     ?    11   56.800     8  0.18    11  0.46  molprobity  1.000  
100  100  OUTLIER   -84.2   111.9  Favored     ?    13   64.440     9  0.23    11  0.23  molprobity  1.000  
101  101  t        -106.9   107.4  Favored     ?     5   48.310     6  0.19     8  0.24  molprobity  1.000  
102  102  t        -103.0   129.3  Favored     ?     9   37.500     7  0.30    10  0.46  molprobity  1.000  
103  103  m        -123.1   115.0  Favored     ?     7   44.540     7  0.22    10  0.58  molprobity  1.000  
104  104  tt0      -119.8   127.9  Favored     ?     6   63.760     9  0.24    12  0.32  molprobity  1.000  
105  105  OUTLIER   -98.4   122.1  Favored     ?    11   54.120     8  0.20    11  0.30  molprobity  1.000  
106  106  OUTLIER  -124.4    86.1  Favored     ?     6   80.140     8  0.20    11  0.25  molprobity  1.000  
107  107  ?          90.7   -96.4  Favored     ?     3   58.370     4  0.33     5  0.26  molprobity  1.000  
108  108  m-20     -125.1    10.0  Favored     ?     4   62.020     8  0.23    11  0.28  molprobity  1.000  
109  109  mm       -120.0   114.5  Favored     ?    11   45.120     8  0.22    11  0.47  molprobity  1.000  
110  110  mt        -87.5   128.7  Favored     ?    11   48.970     8  0.22    11  0.45  molprobity  1.000  
111  111  m        -110.7   127.5  Favored     ?     7   58.550     7  0.25    10  0.59  molprobity  1.000  
112  112  t-20     -114.3   121.6  Favored     ?     6   56.770     8  0.22    11  0.27  molprobity  1.000  
113  113  OUTLIER  -113.2   105.8  Favored     ?     7   51.170     7  0.20    10  0.61  molprobity  1.000  
114  114  mtp       -92.2   147.8  Favored     ?     9   52.440     8  0.27    10  0.25  molprobity  1.000  
115  115  m        -147.4   111.1  Favored     ?     7   45.750     7  0.49    10  0.64  molprobity  1.000  
116  116  tp       -122.8    98.0  Favored     ?    11   62.720     8  1.17    11  1.19  molprobity  1.000  
117  117  ?          70.8  -119.0  Favored     ?     3   65.430     4  2.30     5  1.48  molprobity  1.000  
118  118  m-20      -93.1    -1.1  Favored     ?     4   77.810     8  0.97    11  1.22  molprobity  1.000  
119  119  mt        -99.9   129.1  Favored     ?    11   65.270     8  1.43    11  0.90  molprobity  1.000  
120  120  t        -110.4   110.6  Favored     ?     9   61.540     7  1.69    10  0.73  molprobity  1.000  
121  121  t80       -99.9   111.3  Favored     ?     9   43.220    12  0.35    16  0.19  molprobity  1.000  
122  122  tttt     -120.5   127.4  Favored     ?    13   64.510     9  0.21    11  0.23  molprobity  1.000  
123  123  mtm180   -116.8   121.1  Favored     ?    13   55.770    11  0.16    14  0.30  molprobity  1.000  
124  124  mt       -100.9   123.4  Favored     ?    11   54.510     8  0.22    11  0.45  molprobity  1.000  
125  125  m        -126.5   158.9  Favored     ?     5   41.520     6  0.21     8  0.24  molprobity  1.000  
126  126  ttpt     -131.9   152.7  Favored     ?    13   58.470     9  0.20    11  0.21  molprobity  1.000  
127  127  ttm-85    -83.1   136.6  Favored     ?    13   44.500    11  0.18    14  0.30  molprobity  1.000  
128  128  pt            ?       ?  ?           ?    11   49.040     7  0.21     8  0.54  molprobity  1.000  
129  129  ?             ?       ?  ?           ?     ?   35.950     ?     ?     ?     ?  ?           1.000  
130  130  ?             ?       ?  ?           ?     ?   35.950     ?     ?     ?     ?  ?           1.000  
131  131  ?             ?       ?  ?           ?     ?   35.950     ?     ?     ?     ?  ?           1.000  
132  132  ?             ?       ?  ?           ?     ?   35.950     ?     ?     ?     ?  ?           1.000  
133  133  ?             ?       ?  ?           ?     ?   35.950     ?     ?     ?     ?  ?           1.000  
134  134  ?             ?       ?  ?           ?     ?   35.950     ?     ?     ?     ?  ?           1.000  
135  135  ?             ?       ?  ?           ?     ?   35.950     ?     ?     ?     ?  ?           1.000  
136  136  ?             ?       ?  ?           ?     ?   35.950     ?     ?     ?     ?  ?           1.000  
137  137  ?             ?       ?  ?           ?     ?   35.950     ?     ?     ?     ?  ?           1.000  
138  138  ?             ?       ?  ?           ?     ?   35.950     ?     ?     ?     ?  ?           1.000  
139  139  ?             ?       ?  ?           ?     ?   35.950     ?     ?     ?     ?  ?           1.000  
140  140  ?             ?       ?  ?           ?     ?   35.950     ?     ?     ?     ?  ?           1.000  
141  141  ?             ?       ?  ?           ?     ?   53.730     ?     ?     ?     ?  ?           1.000  
142  142  ?             ?       ?  ?           ?     ?   68.020     ?     ?     ?     ?  ?           1.000  
#
loop_
_pdbx_vrpt_instance_clashes.ordinal
_pdbx_vrpt_instance_clashes.instance_id
_pdbx_vrpt_instance_clashes.label_atom_id
_pdbx_vrpt_instance_clashes.cid
_pdbx_vrpt_instance_clashes.clashmag
_pdbx_vrpt_instance_clashes.dist
 1    6  HB3    1  0.65  1.78  
 2   18  O      2  1.05  1.57  
 3   18  O      3  0.84  2.26  
 4   19  CG     4  1.24  1.66  
 5   19  CG     5  0.74  2.44  
 6   19  HG3    6  1.22  1.68  
 7   19  HG3    7  0.92  0.93  
 8   19  HG3    8  0.50  1.83  
 9   19  HG2    9  0.55  1.78  
10   19  O     10  0.52  2.10  
11   19  O     11  0.44  2.17  
12   19  HA    12  0.48  2.43  
13   19  HA    13  0.45  1.99  
14   19  SD    14  0.41  3.08  
15   22  HG22   2  1.05  1.57  
16   22  CG2    3  0.84  2.26  
17   22  CG2   12  0.48  2.43  
18   22  HG12  15  0.51  2.02  
19   22  O     15  0.51  2.02  
20   22  HG21  13  0.45  1.99  
21   22  HG23  11  0.44  2.17  
22   24  HD23   4  1.24  1.66  
23   24  HD23   7  0.92  0.93  
24   24  HD23   9  0.55  1.78  
25   24  CD2    6  1.22  1.68  
26   24  CD2    5  0.74  2.44  
27   24  CD2   14  0.41  3.08  
28   24  HD12  16  0.67  2.24  
29   24  HD12  17  0.67  1.77  
30   24  HD12  18  0.50  1.92  
31   24  HB2   10  0.52  2.10  
32   24  HD22   8  0.50  1.83  
33   24  HA    19  0.48  1.69  
34   25  HD2   20  0.72  1.71  
35   25  HD2   21  0.63  2.27  
36   25  HD2   18  0.50  1.92  
37   25  CD    16  0.67  2.24  
38   25  HD3   17  0.67  1.77  
39   25  HD3   19  0.48  1.69  
40   26  O     22  0.41  2.20  
41   28  HD21  20  0.72  1.71  
42   28  CD2   21  0.63  2.27  
43   29  HB    22  0.41  2.20  
44   30  H     23  0.43  1.56  
45   30  HG3   23  0.43  1.56  
46   32  HA2   24  0.79  1.63  
47   35  HD12  24  0.79  1.63  
48   46  HB2   25  0.48  1.75  
49   46  HE3   25  0.48  1.75  
50   74  HG23  26  0.45  2.16  
51   76  OG1   27  0.46  2.16  
52   78  HB3   27  0.46  2.16  
53   78  O     26  0.45  2.16  
54   81  HE2   28  0.42  1.51  
55   81  HB3   28  0.42  1.51  
56   89  OD1   29  0.64  2.30  
57   89  N     29  0.64  2.30  
58   91  HB2   30  0.41  2.03  
59  104  HG3   30  0.41  2.03  
60  120  O     31  0.61  2.00  
61  120  HG12  31  0.61  2.00  
62  128  HG13   1  0.65  1.78  
#
loop_
_pdbx_vrpt_instance_intra_plane_outliers.ordinal
_pdbx_vrpt_instance_intra_plane_outliers.instance_id
_pdbx_vrpt_instance_intra_plane_outliers.type
_pdbx_vrpt_instance_intra_plane_outliers.improper
_pdbx_vrpt_instance_intra_plane_outliers.omega
1   1  peptide        ?  -129.37  
2   4  peptide        ?  -140.55  
3   5  peptide        ?   138.76  
4  15  mainchain  11.36        ?  
5  30  peptide        ?   143.30  
6  57  peptide        ?   144.01  
7  58  peptide        ?   145.31  
8  59  peptide        ?   147.01  
#
loop_
_pdbx_vrpt_instance_intra_bond_outliers.ordinal
_pdbx_vrpt_instance_intra_bond_outliers.instance_id
_pdbx_vrpt_instance_intra_bond_outliers.atom_1
_pdbx_vrpt_instance_intra_bond_outliers.atom_2
_pdbx_vrpt_instance_intra_bond_outliers.obs
_pdbx_vrpt_instance_intra_bond_outliers.mean
_pdbx_vrpt_instance_intra_bond_outliers.stdev
_pdbx_vrpt_instance_intra_bond_outliers.Z
1  90  C  O   1.123  1.229  0.019  -5.60  
2  90  N  CA  1.353  1.459  0.020  -5.31  
#
_pdbx_vrpt_instance_intra_angle_outliers.ordinal      1
_pdbx_vrpt_instance_intra_angle_outliers.instance_id  88
_pdbx_vrpt_instance_intra_angle_outliers.atom_1       N
_pdbx_vrpt_instance_intra_angle_outliers.atom_2       CA
_pdbx_vrpt_instance_intra_angle_outliers.atom_3       C
_pdbx_vrpt_instance_intra_angle_outliers.obs          99.149
_pdbx_vrpt_instance_intra_angle_outliers.mean         113.100
_pdbx_vrpt_instance_intra_angle_outliers.stdev        2.500
_pdbx_vrpt_instance_intra_angle_outliers.Z            -5.58
#
loop_
_pdbx_vrpt_model_instance_density.ordinal
_pdbx_vrpt_model_instance_density.instance_id
_pdbx_vrpt_model_instance_density.natoms_eds
_pdbx_vrpt_model_instance_density.RSRCC
_pdbx_vrpt_model_instance_density.RSR
_pdbx_vrpt_model_instance_density.RSRZ
  1    1   6  0.843  0.219   1.064  
  2    2   6  0.854  0.182   0.489  
  3    3  11  0.962  0.164   0.097  
  4    4   6  0.943  0.139  -0.179  
  5    5   4  0.976  0.111  -0.504  
  6    6   9  0.917  0.162  -0.452  
  7    7  12  0.941  0.164   0.197  
  8    8   9  0.950  0.140  -0.490  
  9    9   8  0.967  0.125  -0.700  
 10   10   9  0.898  0.136  -0.544  
 11   11   6  0.945  0.133  -0.272  
 12   12   9  0.896  0.169  -0.095  
 13   13   9  0.949  0.124  -0.804  
 14   14   8  0.903  0.151  -0.132  
 15   15  11  0.924  0.170   0.198  
 16   16   9  0.790  0.242   0.662  
 17   17   5  0.862  0.125  -0.384  
 18   18  11  0.961  0.111  -0.791  
 19   19   8  0.786  0.160   0.105  
 20   20   5  0.857  0.129  -0.861  
 21   21   5  0.963  0.117  -0.514  
 22   22   8  0.737  0.189   0.386  
 23   23   4  0.853  0.128  -0.254  
 24   24   8  0.750  0.209   0.670  
 25   25   7  0.685  0.266   1.844  
 26   26   9  0.786  0.153  -0.443  
 27   27   9  0.641  0.213   0.302  
 28   28   8  0.744  0.218   0.817  
 29   29   8  0.859  0.151  -0.249  
 30   30   9  0.694  0.300   1.687  
 31   31   9  0.785  0.236   0.465  
 32   32   4  0.918  0.107  -0.563  
 33   33   9  0.922  0.201   0.031  
 34   34   8  0.866  0.173   0.145  
 35   35   8  0.928  0.172   0.102  
 36   36   9  0.931  0.154  -0.551  
 37   37   4  0.955  0.106  -0.578  
 38   38   7  0.971  0.114  -0.769  
 39   39   6  0.950  0.133  -0.272  
 40   40   9  0.896  0.162  -0.332  
 41   41   8  0.973  0.127  -0.651  
 42   42   7  0.942  0.190   0.504  
 43   43   9  0.896  0.148  -0.381  
 44   44   8  0.887  0.160   0.000  
 45   45   4  0.806  0.178   0.481  
 46   46   9  0.904  0.325   1.568  
 47   47  20  0.941  0.190   0.510  
 48   48  20  0.941  0.190   0.510  
 49   49  11  0.936  0.180   0.365  
 50   50   9  0.915  0.206   0.093  
 51   51  11  0.931  0.317   2.660  
 52   52   7  0.924  0.139  -0.211  
 53   53   8  0.965  0.194   0.470  
 54   54   7  0.926  0.112  -0.649  
 55   55   5  0.916  0.158   0.151  
 56   56   4  0.917  0.099  -0.681  
 57   57   6  0.689  0.238   1.359  
 58   58   9  0.832  0.333   1.667  
 59   59   7  0.919  0.131  -0.484  
 60   60   8  0.959  0.188   0.370  
 61   61   9  0.936  0.177   0.014  
 62   62   8  0.948  0.132  -0.411  
 63   63   9  0.908  0.190   0.016  
 64   64  11  0.970  0.106  -0.874  
 65   65   7  0.964  0.138  -0.227  
 66   66   7  0.942  0.169   0.152  
 67   67   4  0.946  0.090  -0.813  
 68   68   9  0.918  0.152  -0.456  
 69   69   9  0.897  0.159  -0.369  
 70   70   6  0.911  0.137   0.093  
 71   71   9  0.937  0.151  -0.468  
 72   72   8  0.968  0.212   0.719  
 73   73   9  0.924  0.127  -0.766  
 74   74   7  0.938  0.154   0.032  
 75   75   8  0.872  0.160   0.105  
 76   76   7  0.906  0.109  -0.698  
 77   77   4  0.946  0.137  -0.122  
 78   78   9  0.952  0.133  -0.692  
 79   79   9  0.964  0.119  -0.985  
 80   80   7  0.944  0.242   1.375  
 81   81   9  0.914  0.164  -0.428  
 82   82   7  0.925  0.095  -0.925  
 83   83   7  0.966  0.146  -0.233  
 84   84   7  0.967  0.125  -0.585  
 85   85   9  0.914  0.143  -0.449  
 86   86   8  0.955  0.163  -0.080  
 87   87   9  0.874  0.229   0.501  
 88   88   4  0.870  0.158   0.187  
 89   89   8  0.855  0.227   0.906  
 90   90   8  0.895  0.172   0.176  
 91   91   9  0.889  0.167  -0.390  
 92   92   8  0.972  0.139  -0.471  
 93   93   7  0.967  0.143  -0.283  
 94   94   7  0.964  0.177   0.406  
 95   95   7  0.941  0.137  -0.244  
 96   96  11  0.962  0.209   0.851  
 97   97   9  0.902  0.161  -0.465  
 98   98   8  0.964  0.111  -0.720  
 99   99   8  0.965  0.115  -0.851  
100  100   9  0.937  0.154  -0.551  
101  101   6  0.964  0.113  -0.582  
102  102   7  0.974  0.115  -0.752  
103  103   7  0.951  0.132  -0.325  
104  104   9  0.909  0.200   0.140  
105  105   8  0.933  0.200   0.524  
106  106   8  0.883  0.255   1.395  
107  107   4  0.972  0.118  -0.401  
108  108   8  0.933  0.123  -0.559  
109  109   8  0.978  0.137  -0.483  
110  110   8  0.957  0.226   1.005  
111  111   7  0.973  0.181   0.471  
112  112   8  0.871  0.182   0.323  
113  113   7  0.965  0.158   0.097  
114  114   8  0.939  0.165   0.186  
115  115   7  0.940  0.115  -0.601  
116  116   8  0.966  0.101  -1.091  
117  117   4  0.926  0.177   0.466  
118  118   8  0.892  0.143  -0.277  
119  119   8  0.948  0.138  -0.467  
120  120   7  0.960  0.122  -0.635  
121  121  11  0.945  0.129  -0.489  
122  122   9  0.949  0.202   0.043  
123  123  11  0.914  0.161  -0.297  
124  124   8  0.972  0.124  -0.701  
125  125   6  0.971  0.094  -0.877  
126  126   9  0.945  0.209   0.130  
127  127  11  0.947  0.123  -0.801  
128  128   8  0.902  0.146  -0.333  
129  129   1  0.856  0.162       ?  
130  130   1  0.808  0.176       ?  
131  131   1  0.837  0.186       ?  
132  132   1  0.688  0.181       ?  
133  133   1  0.939  0.374       ?  
134  134   1  0.791  0.098       ?  
135  135   1  0.920  0.125       ?  
136  136   1  0.905  0.145       ?  
137  137   1  0.769  0.218       ?  
138  138   1  0.697  0.276       ?  
139  139   1  0.701  0.275       ?  
140  140   1  0.702  0.244       ?  
141  141   1  0.688  0.435       ?  
142  142   1  0.849  0.286       ?  
#
loop_
_pdbx_vrpt_software.ordinal
_pdbx_vrpt_software.name
_pdbx_vrpt_software.version
_pdbx_vrpt_software.success_y_or_n
1  molprobity   4.02b-467                                                             Y  
2  eds          2.36                                                                  Y  
3  dcc          '"2.27  (2023-04-10)"'                                                Y  
4  xtriage      1.13                                                                  Y  
5  percentiles  "20191225.v01 (using entries in the PDB archive December 25th 2019)"  Y  
##
