data_3PX1

_pdbx_vrpt_database.id    PDB
_pdbx_vrpt_database.code  3PX1
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   x-ray
#
_pdbx_vrpt_summary.entry_id                    3PX1
_pdbx_vrpt_summary.PDB_deposition_date         2010-12-09
_pdbx_vrpt_summary.PDB_revision_number         3
_pdbx_vrpt_summary.PDB_revision_date           2023-11-01
_pdbx_vrpt_summary.report_creation_date        2023-11-02:10:03
_pdbx_vrpt_summary.attempted_validation_steps  molprobity,validation-pack,xtriage,eds,mogul,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      "Calcium-binding protein"  
2  non-polymer  "STRONTIUM ION"  
3  water        water  
#
loop_
_pdbx_vrpt_asym.label_asym_id
_pdbx_vrpt_asym.entity_id
A  1  
B  1  
C  2  
D  2  
E  2  
F  2  
G  3  
H  3  
#
loop_
_pdbx_vrpt_percentile_list.id
_pdbx_vrpt_percentile_list.range
_pdbx_vrpt_percentile_list.exp_method
1  all  x-ray  
2  3.0  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   8.35  141614     ?     ?  
 2  2  1  36.13    2416  3.00  3.00  
 3  1  2  19.33  138981     ?     ?  
 4  2  2  57.48    2333  3.00  3.00  
 5  1  3  19.79  138945     ?     ?  
 6  2  3  54.84    2336  3.00  3.00  
 7  1  4  85.69  127900     ?     ?  
 8  2  4  65.28    1990  3.00  3.00  
 9  1  5  12.99  130704     ?     ?  
10  2  5  38.95    2092  3.00  3.00  
#
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    9.39  
 2  4  2  A  1  1  A   40.03  
 3  5  3  A  1  1  A   19.31  
 4  6  3  A  1  1  A   53.94  
 5  7  4  A  1  1  A   71.70  
 6  8  4  A  1  1  A   43.82  
 7  3  2  B  1  1  B  100.00  
 8  4  2  B  1  1  B  100.00  
 9  5  3  B  1  1  B   19.79  
10  6  3  B  1  1  B   54.84  
11  7  4  B  1  1  B  100.00  
12  8  4  B  1  1  B  100.00  
#
loop_
_pdbx_vrpt_summary_entity_geometry.ordinal
_pdbx_vrpt_summary_entity_geometry.PDB_model_num
_pdbx_vrpt_summary_entity_geometry.entity_id
_pdbx_vrpt_summary_entity_geometry.label_asym_id
_pdbx_vrpt_summary_entity_geometry.auth_asym_id
_pdbx_vrpt_summary_entity_geometry.angles_RMSZ
_pdbx_vrpt_summary_entity_geometry.bonds_RMSZ
_pdbx_vrpt_summary_entity_geometry.num_bonds_RMSZ
_pdbx_vrpt_summary_entity_geometry.num_angles_RMSZ
1  1  1  A  A  0.57  0.45  500  668  
2  1  1  B  B  0.61  0.47  508  679  
#
_pdbx_vrpt_summary_geometry.ordinal                        1
_pdbx_vrpt_summary_geometry.percent_ramachandran_outliers  0.81
_pdbx_vrpt_summary_geometry.percent_rotamer_outliers       5.83
_pdbx_vrpt_summary_geometry.clashscore                     20.78
_pdbx_vrpt_summary_geometry.num_H_reduce                   973
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ                 1008
_pdbx_vrpt_summary_geometry.bonds_RMSZ                     0.46
_pdbx_vrpt_summary_geometry.num_angles_RMSZ                1347
_pdbx_vrpt_summary_geometry.angles_RMSZ                    0.59
#
_pdbx_vrpt_summary_diffraction.exp_method                x-ray
_pdbx_vrpt_summary_diffraction.ordinal                   1
_pdbx_vrpt_summary_diffraction.Babinet_b                 145.277
_pdbx_vrpt_summary_diffraction.bulk_solvent_b            69.360
_pdbx_vrpt_summary_diffraction.Wilson_B_estimate         91.114
_pdbx_vrpt_summary_diffraction.I_over_sigma              2.62(2.99A)
_pdbx_vrpt_summary_diffraction.num_miller_indices        6427
_pdbx_vrpt_summary_diffraction.Babinet_k                 0.599
_pdbx_vrpt_summary_diffraction.bulk_solvent_k            0.323
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L_mean     0.508
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L2_mean    0.342
_pdbx_vrpt_summary_diffraction.Fo_Fc_correlation         0.909
_pdbx_vrpt_summary_diffraction.twin_fraction             h,-h-k,-l:0.480
_pdbx_vrpt_summary_diffraction.DCC_R                     0.27
_pdbx_vrpt_summary_diffraction.DCC_Rfree                 0.28
_pdbx_vrpt_summary_diffraction.EDS_R                     0.27
_pdbx_vrpt_summary_diffraction.EDS_res_high              3.00
_pdbx_vrpt_summary_diffraction.EDS_res_low               22.92
_pdbx_vrpt_summary_diffraction.Wilson_B_aniso            "[81.422,81.422,118.903,0.000,0.000,0.000]"
_pdbx_vrpt_summary_diffraction.data_anisotropy           0.399
_pdbx_vrpt_summary_diffraction.trans_NCS_details         "The largest off-origin peak in the Patterson function is 5.15% 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         94.77
_pdbx_vrpt_summary_diffraction.number_reflns_R_free      312
_pdbx_vrpt_summary_diffraction.percent_free_reflections  4.85
_pdbx_vrpt_summary_diffraction.percent_RSRZ_outliers     0.79
_pdbx_vrpt_summary_diffraction.PDB_resolution_high       3.00
_pdbx_vrpt_summary_diffraction.PDB_resolution_low        50.00
_pdbx_vrpt_summary_diffraction.PDB_R                     0.24
_pdbx_vrpt_summary_diffraction.PDB_Rfree                 0.28
#
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_clashes
  1  1  1  A   2  ALA  A    2  .  ?        1  
  2  1  1  A   3  GLU  A    3  .  ?        ?  
  3  1  1  A   4  ALA  A    4  .  ?        ?  
  4  1  1  A   5  LEU  A    5  .  ?        1  
  5  1  1  A   6  PHE  A    6  .  ?        ?  
  6  1  1  A   7  LYS  A    7  .  ?        ?  
  7  1  1  A   8  GLU  A    8  .  ?        ?  
  8  1  1  A   9  ILE  A    9  .  ?        ?  
  9  1  1  A  10  ASP  A   10  .  ?        ?  
 10  1  1  A  11  VAL  A   11  .  ?        ?  
 11  1  1  A  12  ASN  A   12  .  ?        ?  
 12  1  1  A  13  GLY  A   13  .  ?        ?  
 13  1  1  A  14  ASP  A   14  .  ?        2  
 14  1  1  A  15  GLY  A   15  .  ?        ?  
 15  1  1  A  16  ALA  A   16  .  ?        ?  
 16  1  1  A  17  VAL  A   17  .  ?        1  
 17  1  1  A  18  SER  A   18  .  ?        1  
 18  1  1  A  19  TYR  A   19  .  ?        ?  
 19  1  1  A  20  GLU  A   20  .  ?        2  
 20  1  1  A  21  GLU  A   21  .  ?        2  
 21  1  1  A  22  VAL  A   22  .  ?        ?  
 22  1  1  A  23  LYS  A   23  .  ?        ?  
 23  1  1  A  24  ALA  A   24  .  ?        ?  
 24  1  1  A  25  PHE  A   25  .  ?        ?  
 25  1  1  A  26  VAL  A   26  .  ?        ?  
 26  1  1  A  27  SER  A   27  .  ?        ?  
 27  1  1  A  28  LYS  A   28  .  ?        ?  
 28  1  1  A  29  LYS  A   29  .  ?        ?  
 29  1  1  A  30  ARG  A   30  .  ?        ?  
 30  1  1  A  31  ALA  A   31  .  ?        ?  
 31  1  1  A  32  ILE  A   32  .  ?        1  
 32  1  1  A  33  LYS  A   33  .  ?        ?  
 33  1  1  A  34  ASN  A   34  .  ?        ?  
 34  1  1  A  35  GLU  A   35  .  ?        1  
 35  1  1  A  36  GLN  A   36  .  ?        1  
 36  1  1  A  37  LEU  A   37  .  ?        ?  
 37  1  1  A  38  LEU  A   38  .  ?        ?  
 38  1  1  A  39  GLN  A   39  .  ?        1  
 39  1  1  A  40  LEU  A   40  .  ?        2  
 40  1  1  A  41  ILE  A   41  .  ?        1  
 41  1  1  A  42  PHE  A   42  .  ?        ?  
 42  1  1  A  43  LYS  A   43  .  ?        ?  
 43  1  1  A  44  SER  A   44  .  ?        1  
 44  1  1  A  45  ILE  A   45  .  ?        ?  
 45  1  1  A  46  ASP  A   46  .  ?        1  
 46  1  1  A  47  ALA  A   47  .  ?        ?  
 47  1  1  A  48  ASP  A   48  .  ?        1  
 48  1  1  A  49  GLY  A   49  .  ?        2  
 49  1  1  A  50  ASN  A   50  .  ?        ?  
 50  1  1  A  51  GLY  A   51  .  ?        ?  
 51  1  1  A  52  GLU  A   52  .  ?        ?  
 52  1  1  A  53  ILE  A   53  .  ?        1  
 53  1  1  A  54  ASP  A   54  .  ?        ?  
 54  1  1  A  55  GLN  A   55  .  ?        ?  
 55  1  1  A  56  ASN  A   56  .  ?        1  
 56  1  1  A  57  GLU  A   57  .  ?        1  
 57  1  1  A  58  PHE  A   58  .  ?        1  
 58  1  1  A  59  ALA  A   59  .  ?        1  
 59  1  1  A  60  LYS  A   60  .  ?        2  
 60  1  1  A  61  PHE  A   61  .  ?        2  
 61  1  1  A  62  TYR  A   62  .  ?        2  
 62  1  1  A  63  GLY  A   63  .  ?        1  
 63  1  1  A  64  SER  A   64  .  ?        1  
 64  1  1  B   2  ALA  B    2  .  ?        ?  
 65  1  1  B   3  GLU  B    3  .  ?        ?  
 66  1  1  B   4  ALA  B    4  .  ?        ?  
 67  1  1  B   5  LEU  B    5  .  ?        ?  
 68  1  1  B   6  PHE  B    6  .  ?        ?  
 69  1  1  B   7  LYS  B    7  .  ?        2  
 70  1  1  B   8  GLU  B    8  .  ?        ?  
 71  1  1  B   9  ILE  B    9  .  ?        ?  
 72  1  1  B  10  ASP  B   10  .  ?        ?  
 73  1  1  B  11  VAL  B   11  .  ?        ?  
 74  1  1  B  12  ASN  B   12  .  ?        ?  
 75  1  1  B  13  GLY  B   13  .  ?        ?  
 76  1  1  B  14  ASP  B   14  .  ?        ?  
 77  1  1  B  15  GLY  B   15  .  ?        ?  
 78  1  1  B  16  ALA  B   16  .  ?        ?  
 79  1  1  B  17  VAL  B   17  .  ?        ?  
 80  1  1  B  18  SER  B   18  .  ?        2  
 81  1  1  B  19  TYR  B   19  .  ?        ?  
 82  1  1  B  20  GLU  B   20  .  ?        ?  
 83  1  1  B  21  GLU  B   21  .  ?        1  
 84  1  1  B  22  VAL  B   22  .  ?        2  
 85  1  1  B  23  LYS  B   23  .  ?        ?  
 86  1  1  B  24  ALA  B   24  .  ?        ?  
 87  1  1  B  25  PHE  B   25  .  ?        ?  
 88  1  1  B  26  VAL  B   26  .  ?        1  
 89  1  1  B  27  SER  B   27  .  ?        ?  
 90  1  1  B  28  LYS  B   28  .  ?        1  
 91  1  1  B  29  LYS  B   29  .  ?        ?  
 92  1  1  B  30  ARG  B   30  .  ?        ?  
 93  1  1  B  31  ALA  B   31  .  ?        ?  
 94  1  1  B  32  ILE  B   32  .  ?        2  
 95  1  1  B  33  LYS  B   33  .  ?        1  
 96  1  1  B  34  ASN  B   34  .  ?        ?  
 97  1  1  B  35  GLU  B   35  .  ?        1  
 98  1  1  B  36  GLN  B   36  .  ?        1  
 99  1  1  B  37  LEU  B   37  .  ?        1  
100  1  1  B  38  LEU  B   38  .  ?        2  
101  1  1  B  39  GLN  B   39  .  ?        1  
102  1  1  B  40  LEU  B   40  .  ?        ?  
103  1  1  B  41  ILE  B   41  .  ?        3  
104  1  1  B  42  PHE  B   42  .  ?        ?  
105  1  1  B  43  LYS  B   43  .  ?        ?  
106  1  1  B  44  SER  B   44  .  ?        2  
107  1  1  B  45  ILE  B   45  .  ?        2  
108  1  1  B  46  ASP  B   46  .  ?        2  
109  1  1  B  47  ALA  B   47  .  ?        ?  
110  1  1  B  48  ASP  B   48  .  ?        3  
111  1  1  B  49  GLY  B   49  .  ?        2  
112  1  1  B  50  ASN  B   50  .  ?        ?  
113  1  1  B  51  GLY  B   51  .  ?        ?  
114  1  1  B  52  GLU  B   52  .  ?        ?  
115  1  1  B  53  ILE  B   53  .  ?        1  
116  1  1  B  54  ASP  B   54  .  ?        ?  
117  1  1  B  55  GLN  B   55  .  ?        ?  
118  1  1  B  56  ASN  B   56  .  ?        1  
119  1  1  B  57  GLU  B   57  .  ?        ?  
120  1  1  B  58  PHE  B   58  .  ?        ?  
121  1  1  B  59  ALA  B   59  .  ?        1  
122  1  1  B  60  LYS  B   60  .  ?        ?  
123  1  1  B  61  PHE  B   61  .  ?        3  
124  1  1  B  62  TYR  B   62  .  ?        1  
125  1  1  B  63  GLY  B   63  .  ?        3  
126  1  1  B  64  SER  B   64  .  ?        ?  
127  1  1  B  65  ILE  B   65  .  ?        3  
128  1  2  C   .  SR   A  149  .  ?        ?  
129  1  2  D   .  SR   A  150  .  ?        ?  
130  1  2  E   .  SR   B  149  .  ?        ?  
131  1  2  F   .  SR   B  150  .  ?        ?  
132  1  3  G   .  HOH  A  135  .  ?        ?  
133  1  3  G   .  HOH  A  136  .  ?        ?  
134  1  3  G   .  HOH  A  137  .  ?        ?  
135  1  3  G   .  HOH  A  138  .  ?        ?  
136  1  3  G   .  HOH  A  139  .  ?        ?  
137  1  3  G   .  HOH  A  140  .  ?        ?  
138  1  3  G   .  HOH  A  141  .  ?        ?  
139  1  3  G   .  HOH  A  142  .  ?        ?  
140  1  3  G   .  HOH  A  143  .  ?        1  
141  1  3  G   .  HOH  A  144  .  ?        ?  
142  1  3  G   .  HOH  A  145  .  ?        ?  
143  1  3  H   .  HOH  B  135  .  ?        ?  
144  1  3  H   .  HOH  B  136  .  ?        ?  
145  1  3  H   .  HOH  B  137  .  ?        ?  
146  1  3  H   .  HOH  B  138  .  ?        ?  
147  1  3  H   .  HOH  B  139  .  ?        ?  
148  1  3  H   .  HOH  B  140  .  ?        ?  
149  1  3  H   .  HOH  B  141  .  ?        ?  
150  1  3  H   .  HOH  B  142  .  ?        ?  
151  1  3  H   .  HOH  B  143  .  ?        ?  
152  1  3  H   .  HOH  B  144  .  ?        ?  
153  1  3  H   .  HOH  B  145  .  ?        ?  
154  1  3  H   .  HOH  B  146  .  ?        ?  
155  1  3  H   .  HOH  B  147  .  ?        ?  
156  1  3  H   .  HOH  B  148  .  ?        ?  
157  1  3  H   .  HOH  B  151  .  ?        ?  
158  1  3  H   .  HOH  B  152  .  ?        1  
#
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  ?             ?       ?  ?           ?     4  116.650     5  0.14     7  0.26  molprobity  1.000  
  2    2  mt-10     -54.0   -72.8  Allowed     ?     6  116.550     9  0.19    12  0.28  molprobity  1.000  
  3    3  ?         -50.3   -47.6  Favored     ?     5  103.170     5  0.22     7  0.43  molprobity  1.000  
  4    4  tp        -55.0   -46.6  Favored     ?    11   94.110     8  0.23    11  0.75  molprobity  1.000  
  5    5  t80       -59.8   -38.6  Favored     ?     9   83.790    12  0.58    16  0.33  molprobity  1.000  
  6    6  mtpm?     -67.1   -26.4  Favored     ?    13   91.390     9  0.51    11  0.50  molprobity  1.000  
  7    7  tt0       -76.3   -50.6  Favored     ?     6   94.880     9  0.50    12  0.34  molprobity  1.000  
  8    8  mt        -64.3   -37.0  Favored     ?    11   80.810     8  0.29    11  0.40  molprobity  1.000  
  9    9  t0        -84.8    87.4  Favored     ?     4   81.330     8  0.46    11  0.97  molprobity  1.000  
 10   10  t         -67.6   -43.5  Favored     ?     9   78.860     7  0.69    10  1.27  molprobity  1.000  
 11   11  p-10      -75.9   -10.1  Favored     ?     6   79.910     8  0.25    11  0.41  molprobity  1.000  
 12   12  ?          68.4    30.1  Favored     ?     3   79.210     4  0.40     5  0.84  molprobity  1.000  
 13   13  p-10      -89.8    16.1  Favored     ?     4   79.380     8  0.36    11  0.63  molprobity  1.000  
 14   14  ?          78.1    -7.7  Favored     ?     3   77.300     4  0.32     5  0.56  molprobity  1.000  
 15   15  ?        -117.0   155.8  Favored     ?     5   78.420     5  0.25     7  0.42  molprobity  1.000  
 16   16  t        -116.3   106.3  Favored     ?     9   77.130     7  0.22    10  0.57  molprobity  1.000  
 17   17  p         -78.5  -179.7  Favored     ?     5   77.860     6  0.21     8  0.44  molprobity  1.000  
 18   18  t80       -71.0   -53.4  Favored     ?     9   78.190    13  0.69    18  0.59  molprobity  1.000  
 19   19  mp0       -50.0   -34.5  Favored     ?     6   88.580     9  0.43    12  0.51  molprobity  1.000  
 20   20  mt-10     -68.9   -44.7  Favored     ?     6   81.690     9  0.38    12  0.26  molprobity  1.000  
 21   21  t         -63.5   -51.5  Favored     ?     9   75.690     7  0.43    10  0.83  molprobity  1.000  
 22   22  tttt      -53.6   -33.8  Favored     ?    13   73.200     9  0.39    11  0.81  molprobity  1.000  
 23   23  ?         -75.5   -48.5  Favored     ?     5   70.230     5  0.23     7  0.48  molprobity  1.000  
 24   24  t80       -56.5   -48.6  Favored     ?     9   70.980    12  0.57    16  0.45  molprobity  1.000  
 25   25  t         -55.2   -51.8  Favored     ?     9   77.050     7  0.43    10  0.61  molprobity  1.000  
 26   26  m         -55.4   -54.2  Favored     ?     5   78.490     6  0.29     8  0.38  molprobity  1.000  
 27   27  ttpt      -51.8   -47.9  Favored     ?    13   80.070     9  0.51    11  0.43  molprobity  1.000  
 28   28  ttpp      -60.4   -45.9  Favored     ?    13   85.300     9  0.56    11  0.53  molprobity  1.000  
 29   29  mtm-85    -55.1   -44.2  Favored     ?    13   89.560    11  0.50    14  0.61  molprobity  1.000  
 30   30  ?         -56.5   -61.7  Favored     ?     5   74.470     5  0.38     7  0.44  molprobity  1.000  
 31   31  mt        -52.5   -48.8  Favored     ?    11   74.570     8  0.51    11  0.67  molprobity  1.000  
 32   32  OUTLIER   -48.9   -51.1  Favored     ?    13   86.860     9  0.44    11  0.26  molprobity  1.000  
 33   33  m120      -65.2   -46.1  Favored     1     6   84.030     8  0.23    11  0.40  molprobity  1.000  
 34   34  mm-40     -52.7   -57.5  Favored     ?     6   85.280     9  0.54    12  0.75  molprobity  1.000  
 35   35  mt-30     -49.4   -48.1  Favored     1     8   77.350     9  0.28    12  0.50  molprobity  1.000  
 36   36  tp        -61.8   -47.1  Favored     ?    11   75.080     8  0.31    11  0.50  molprobity  1.000  
 37   37  OUTLIER   -55.9   -52.7  Favored     ?    11   80.490     8  0.45    11  0.96  molprobity  1.000  
 38   38  mt-30     -56.8   -43.4  Favored     1     8   81.540     9  0.41    12  0.48  molprobity  1.000  
 39   39  tt        -56.8   -41.3  Favored     ?    11   81.250     8  0.39    11  0.63  molprobity  1.000  
 40   40  mt        -66.5   -41.3  Favored     ?    11   78.720     8  0.26    11  0.49  molprobity  1.000  
 41   41  t80       -62.0   -69.9  Allowed     ?     9   79.090    12  0.53    16  0.41  molprobity  1.000  
 42   42  mtmt      -45.0   -25.1  Allowed     ?    13   85.820     9  0.30    11  0.43  molprobity  1.000  
 43   43  t         -69.2   -60.7  Favored     ?     5   86.220     6  0.19     8  0.25  molprobity  1.000  
 44   44  mt        -55.1   -41.2  Favored     ?    11   80.050     8  0.28    11  0.76  molprobity  1.000  
 45   45  t0        -72.5    86.9  Allowed     ?     4   87.610     8  0.35    11  0.47  molprobity  1.000  
 46   46  ?         -58.2   -52.2  Favored     ?     5   90.570     5  0.23     7  0.55  molprobity  1.000  
 47   47  p30       -79.5    24.3  Allowed     ?     4   97.680     8  0.42    11  0.66  molprobity  1.000  
 48   48  ?          20.5    57.0  OUTLIER     ?     3   95.560     4  0.37     5  0.58  molprobity  1.000  
 49   49  p-10     -107.3     4.6  Favored     ?     6   95.090     8  0.43    11  0.65  molprobity  1.000  
 50   50  ?          95.3    -9.2  Favored     ?     3   94.160     4  0.38     5  0.72  molprobity  1.000  
 51   51  mt-10    -129.5   158.6  Favored     ?     6   95.450     9  0.45    12  0.54  molprobity  1.000  
 52   52  mt       -114.5   113.1  Favored     ?    11   86.560     8  0.32    11  0.82  molprobity  1.000  
 53   53  p30       -86.6   169.3  Favored     ?     4   92.080     8  0.28    11  0.26  molprobity  1.000  
 54   54  mt-30     -53.8   -28.6  Favored     ?     8   87.300     9  0.27    12  0.47  molprobity  1.000  
 55   55  t-20      -72.2   -50.3  Favored     ?     6   94.260     8  0.25    11  0.44  molprobity  1.000  
 56   56  mt-10     -60.0   -51.1  Favored     ?     6   88.070     9  0.85    12  0.68  molprobity  1.000  
 57   57  t80       -55.5   -31.4  Favored     ?     9   87.200    12  0.73    16  0.44  molprobity  1.000  
 58   58  ?         -73.0   -43.3  Favored     ?     5   98.080     5  0.10     7  0.19  molprobity  1.000  
 59   59  mtmm      -73.3     1.1  Favored     ?    13  112.550     9  0.58    11  0.64  molprobity  1.000  
 60   60  t80      -102.1    50.2  Allowed     ?     9  109.280    12  0.67    16  0.43  molprobity  1.000  
 61   61  m-85     -148.6   105.1  Favored     ?     9  125.830    13  0.40    18  0.42  molprobity  1.000  
 62   62  ?         -88.7   -11.6  Favored     ?     3  133.670     4  0.40     5  0.39  molprobity  1.000  
 63   63  OUTLIER       ?       ?  ?           ?     5  139.460     5  0.93     5  0.84  molprobity  1.000  
 64   64  ?             ?       ?  ?           ?     4  111.520     5  0.78     7  0.33  molprobity  1.000  
 65   65  pt-20     -46.1   -57.5  Favored     ?     6  112.310     9  0.35    12  0.43  molprobity  1.000  
 66   66  ?         -56.5   -57.6  Favored     ?     5  101.160     5  0.39     7  0.43  molprobity  1.000  
 67   67  tp        -52.6   -48.8  Favored     ?    11   93.650     8  0.25    11  0.47  molprobity  1.000  
 68   68  t80       -55.7   -41.9  Favored     ?     9   79.180    12  0.53    16  0.20  molprobity  1.000  
 69   69  mtpm?     -67.3   -20.1  Favored     ?    13   88.000     9  0.29    11  0.35  molprobity  1.000  
 70   70  tt0       -81.4   -48.9  Favored     ?     6   92.950     9  0.40    12  0.25  molprobity  1.000  
 71   71  mt        -64.6   -42.9  Favored     ?    11   79.520     8  0.28    11  0.46  molprobity  1.000  
 72   72  t0        -79.4    86.9  Favored     ?     4   83.660     8  0.34    11  0.64  molprobity  1.000  
 73   73  t         -63.9   -57.5  Favored     ?     9   81.430     7  0.54    10  1.01  molprobity  1.000  
 74   74  p-10      -62.2   -17.3  Favored     ?     6   79.610     8  0.16    11  0.53  molprobity  1.000  
 75   75  ?          75.5    30.3  Favored     ?     3   78.210     4  0.64     5  1.56  molprobity  1.000  
 76   76  p30       -91.4    12.5  Favored     ?     4   82.510     8  0.75    11  1.02  molprobity  1.000  
 77   77  ?          84.9   -14.0  Favored     ?     3   80.320     4  0.76     5  0.67  molprobity  1.000  
 78   78  ?        -112.5   148.8  Favored     ?     5   78.990     5  0.58     7  0.65  molprobity  1.000  
 79   79  t        -107.7   122.1  Favored     ?     9   76.270     7  0.54    10  0.69  molprobity  1.000  
 80   80  p         -94.9   168.8  Favored     ?     5   78.930     6  0.22     8  0.33  molprobity  1.000  
 81   81  t80       -63.2   -54.1  Favored     ?     9   79.720    13  0.54    18  0.46  molprobity  1.000  
 82   82  mp0       -51.3   -33.4  Favored     ?     6   91.470     9  0.29    12  0.46  molprobity  1.000  
 83   83  mt-10     -69.7   -44.5  Favored     ?     6   85.610     9  0.32    12  0.43  molprobity  1.000  
 84   84  t         -65.7   -43.0  Favored     ?     9   79.430     7  0.44    10  0.81  molprobity  1.000  
 85   85  tttt      -54.7   -48.4  Favored     ?    13   77.040     9  0.45    11  0.57  molprobity  1.000  
 86   86  ?         -61.4   -45.9  Favored     ?     5   69.930     5  0.32     7  0.30  molprobity  1.000  
 87   87  t80       -61.5   -48.0  Favored     ?     9   71.910    12  0.49    16  0.30  molprobity  1.000  
 88   88  t         -55.4   -55.1  Favored     ?     9   72.510     7  0.37    10  0.86  molprobity  1.000  
 89   89  t         -49.1   -57.5  Favored     ?     5   74.990     6  0.51     8  0.46  molprobity  1.000  
 90   90  ttpt      -57.0   -38.6  Favored     ?    13   80.140     9  0.50    11  0.47  molprobity  1.000  
 91   91  tttp      -61.9   -47.0  Favored     ?    13   82.180     9  0.59    11  0.93  molprobity  1.000  
 92   92  ttm-85    -58.6   -44.6  Favored     ?    13   88.430    11  0.45    14  0.59  molprobity  1.000  
 93   93  ?         -57.3   -54.5  Favored     ?     5   75.410     5  0.37     7  0.41  molprobity  1.000  
 94   94  mm        -56.8   -47.7  Favored     ?    11   76.640     8  0.32    11  0.78  molprobity  1.000  
 95   95  tptp      -53.1   -46.1  Favored     ?    13   87.530     9  0.67    11  0.41  molprobity  1.000  
 96   96  m120      -68.6   -40.5  Favored     1     6   85.100     8  0.29    11  0.35  molprobity  1.000  
 97   97  mm-40     -55.0   -51.0  Favored     ?     6   87.340     9  0.32    12  0.51  molprobity  1.000  
 98   98  mt-30     -55.3   -46.3  Favored     ?     8   80.550     9  0.30    12  0.46  molprobity  1.000  
 99   99  tp        -66.5   -37.5  Favored     ?    11   76.560     8  0.26    11  0.33  molprobity  1.000  
100  100  OUTLIER   -65.5   -48.8  Favored     ?    11   79.120     8  0.36    11  0.75  molprobity  1.000  
101  101  mt-30     -58.4   -46.4  Favored     1     8   80.960     9  0.43    12  0.42  molprobity  1.000  
102  102  tt        -54.9   -53.9  Favored     ?    11   82.350     8  0.31    11  0.51  molprobity  1.000  
103  103  mt        -55.9   -34.6  Favored     ?    11   82.350     8  0.42    11  0.74  molprobity  1.000  
104  104  t80       -65.8   -65.9  Allowed     ?     9   79.830    12  0.49    16  0.37  molprobity  1.000  
105  105  mttm      -49.2   -32.3  Favored     ?    13   89.710     9  0.54    11  0.45  molprobity  1.000  
106  106  t         -59.6   -47.8  Favored     ?     5   89.180     6  0.26     8  0.49  molprobity  1.000  
107  107  mt        -73.4   -29.5  Favored     ?    11   83.750     8  0.28    11  0.46  molprobity  1.000  
108  108  t0        -86.0    95.3  Favored     ?     4   91.570     8  0.36    11  0.48  molprobity  1.000  
109  109  ?         -58.1   -63.4  Allowed     ?     5   96.550     5  0.58     7  0.82  molprobity  1.000  
110  110  p-10      -72.2    11.5  Allowed     ?     4  104.940     8  0.75    11  1.45  molprobity  1.000  
111  111  ?          33.1    44.0  Allowed     ?     3   98.570     4  0.98     5  0.96  molprobity  1.000  
112  112  p-10      -94.2     2.6  Favored     ?     6   97.210     8  0.31    11  0.52  molprobity  1.000  
113  113  ?         102.5   -32.9  Favored     ?     3   96.850     4  0.38     5  0.46  molprobity  1.000  
114  114  OUTLIER  -114.4   166.0  Favored     ?     6   98.980     9  0.61    12  0.38  molprobity  1.000  
115  115  mm       -115.8   115.6  Favored     ?    11   94.290     8  0.32    11  1.21  molprobity  1.000  
116  116  p30       -84.9   169.7  Favored     ?     4   99.070     8  0.25    11  0.37  molprobity  1.000  
117  117  mt-30     -61.0   -28.2  Favored     ?     8   89.360     9  0.56    12  0.62  molprobity  1.000  
118  118  OUTLIER   -65.7   -55.3  Favored     ?     6   94.820     8  0.35    11  0.44  molprobity  1.000  
119  119  mt-10     -54.1   -52.0  Favored     ?     6   87.800     9  0.81    12  0.63  molprobity  1.000  
120  120  t80       -55.5   -38.0  Favored     ?     9   83.410    12  0.59    16  0.36  molprobity  1.000  
121  121  ?         -64.2   -46.5  Favored     ?     5   92.460     5  0.29     7  0.48  molprobity  1.000  
122  122  ttmm      -59.5   -56.5  Favored     ?    13  103.310     9  0.45    11  0.71  molprobity  1.000  
123  123  t80       -37.7   -41.9  Allowed     ?     9  103.520    12  0.56    16  0.45  molprobity  1.000  
124  124  m-85      -82.5  -166.9  Allowed     ?     9  113.400    13  0.64    18  0.41  molprobity  1.000  
125  125  ?         115.3    51.0  Allowed     ?     3  118.600     4  0.22     5  0.96  molprobity  1.000  
126  126  p          62.6    -5.0  Allowed     ?     5  121.130     6  0.48     8  0.63  molprobity  1.000  
127  127  pt            ?       ?  ?           ?    11  119.120     7  0.43     8  0.70  molprobity  1.000  
128  128  ?             ?       ?  ?           ?     ?   49.130     ?     ?     ?     ?  ?           1.000  
129  129  ?             ?       ?  ?           ?     ?   61.520     ?     ?     ?     ?  ?           1.000  
130  130  ?             ?       ?  ?           ?     ?   53.520     ?     ?     ?     ?  ?           1.000  
131  131  ?             ?       ?  ?           ?     ?   62.170     ?     ?     ?     ?  ?           1.000  
132  132  ?             ?       ?  ?           ?     ?   69.980     ?     ?     ?     ?  ?           1.000  
133  133  ?             ?       ?  ?           ?     ?   72.650     ?     ?     ?     ?  ?           1.000  
134  134  ?             ?       ?  ?           ?     ?  106.750     ?     ?     ?     ?  ?           1.000  
135  135  ?             ?       ?  ?           ?     ?   71.310     ?     ?     ?     ?  ?           1.000  
136  136  ?             ?       ?  ?           ?     ?   86.830     ?     ?     ?     ?  ?           1.000  
137  137  ?             ?       ?  ?           ?     ?   80.800     ?     ?     ?     ?  ?           1.000  
138  138  ?             ?       ?  ?           ?     ?   86.330     ?     ?     ?     ?  ?           1.000  
139  139  ?             ?       ?  ?           ?     ?   93.550     ?     ?     ?     ?  ?           1.000  
140  140  ?             ?       ?  ?           ?     ?  138.750     ?     ?     ?     ?  ?           1.000  
141  141  ?             ?       ?  ?           ?     ?   95.130     ?     ?     ?     ?  ?           1.000  
142  142  ?             ?       ?  ?           ?     ?   69.920     ?     ?     ?     ?  ?           1.000  
143  143  ?             ?       ?  ?           ?     ?   68.750     ?     ?     ?     ?  ?           1.000  
144  144  ?             ?       ?  ?           ?     ?   64.170     ?     ?     ?     ?  ?           1.000  
145  145  ?             ?       ?  ?           ?     ?   70.180     ?     ?     ?     ?  ?           1.000  
146  146  ?             ?       ?  ?           ?     ?   80.640     ?     ?     ?     ?  ?           1.000  
147  147  ?             ?       ?  ?           ?     ?   68.740     ?     ?     ?     ?  ?           1.000  
148  148  ?             ?       ?  ?           ?     ?   75.920     ?     ?     ?     ?  ?           1.000  
149  149  ?             ?       ?  ?           ?     ?   82.650     ?     ?     ?     ?  ?           1.000  
150  150  ?             ?       ?  ?           ?     ?   79.670     ?     ?     ?     ?  ?           1.000  
151  151  ?             ?       ?  ?           ?     ?   74.640     ?     ?     ?     ?  ?           1.000  
152  152  ?             ?       ?  ?           ?     ?   87.530     ?     ?     ?     ?  ?           1.000  
153  153  ?             ?       ?  ?           ?     ?  100.200     ?     ?     ?     ?  ?           1.000  
154  154  ?             ?       ?  ?           ?     ?   63.250     ?     ?     ?     ?  ?           1.000  
155  155  ?             ?       ?  ?           ?     ?   92.780     ?     ?     ?     ?  ?           1.000  
156  156  ?             ?       ?  ?           ?     ?   84.720     ?     ?     ?     ?  ?           1.000  
157  157  ?             ?       ?  ?           ?     ?   99.440     ?     ?     ?     ?  ?           1.000  
158  158  ?             ?       ?  ?           ?     ?  111.750     ?     ?     ?     ?  ?           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    1  HB3    1  0.47  1.97  
 2    4  HB3    1  0.47  1.97  
 3   13  OD1    2  0.43  2.56  
 4   13  C      2  0.43  2.56  
 5   16  HA     3  0.66  1.96  
 6   17  OG     4  0.69  1.91  
 7   19  CD     5  0.48  2.16  
 8   19  H      5  0.48  2.16  
 9   20  HG3    4  0.69  1.91  
10   20  OE1    3  0.66  1.96  
11   31  O      6  0.54  2.05  
12   34  O      7  0.46  2.15  
13   35  HG3    6  0.54  2.05  
14   38  HG3    7  0.46  2.15  
15   39  HD11   8  0.48  1.79  
16   39  HD21   9  0.40  2.51  
17   40  O     10  0.56  2.06  
18   43  HB3   10  0.56  2.06  
19   45  OD2   11  0.44  2.17  
20   47  O     12  0.50  2.49  
21   48  C     12  0.50  2.49  
22   48  HA2   11  0.44  2.17  
23   52  HA    13  0.41  2.20  
24   55  O     14  0.41  2.21  
25   56  OE1   13  0.41  2.20  
26   57  CZ    15  0.45  2.61  
27   58  HB3   14  0.41  2.21  
28   59  HE2   16  0.43  1.88  
29   59  HB3   16  0.43  1.88  
30   60  CD2   17  0.49  2.66  
31   60  O     17  0.49  2.66  
32   61  HA    18  0.74  1.88  
33   61  OH    15  0.45  2.61  
34   62  O     19  0.62  1.99  
35   63  HB3   19  0.62  1.99  
36   69  NZ    20  0.45  2.31  
37   69  HB3   20  0.45  2.31  
38   80  OG    21  0.82  1.80  
39   80  O     22  0.54  2.08  
40   83  HG3   21  0.82  1.80  
41   84  HG23  22  0.54  2.08  
42   84  O     23  0.42  2.19  
43   88  HG23  23  0.42  2.19  
44   90  O     24  0.67  1.94  
45   94  HG12  24  0.67  1.94  
46   94  O     25  0.47  2.15  
47   95  HD3   26  0.69  1.92  
48   97  O     27  0.63  1.98  
49   98  HG3   25  0.47  2.15  
50   99  O     28  0.52  2.09  
51  100  HD23  29  0.41  1.91  
52  100  HA    29  0.41  1.91  
53  101  HG3   27  0.63  1.98  
54  103  HG13  28  0.52  2.09  
55  103  O     30  0.43  2.18  
56  103  O     31  0.41  2.21  
57  106  HB3   30  0.43  2.18  
58  106  CB     9  0.40  2.51  
59  107  HG12  32  0.60  2.36  
60  107  HG13  31  0.41  2.21  
61  108  HB2   33  0.48  2.43  
62  108  OD2   34  0.41  2.21  
63  110  O     35  0.49  2.51  
64  110  OD1   36  0.45  2.49  
65  110  N     36  0.45  2.49  
66  111  C     35  0.49  2.51  
67  111  HA2   34  0.41  2.21  
68  115  CD1   33  0.48  2.43  
69  118  O     37  0.42  2.19  
70  121  HB3   37  0.42  2.19  
71  123  CD1   32  0.60  2.36  
72  123  HE1    8  0.48  1.79  
73  123  HD2   38  0.43  2.36  
74  124  CE1   38  0.43  2.36  
75  125  C     39  0.58  2.05  
76  125  C     40  0.47  2.68  
77  125  O     41  0.50  2.10  
78  127  H     39  0.58  2.05  
79  127  HG23  41  0.50  2.10  
80  127  N     40  0.47  2.68  
81  140  O     18  0.74  1.88  
82  158  O     26  0.69  1.92  
#
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   5   0.847  0.251   0.315  
  2    2   9   0.886  0.212  -0.389  
  3    3   5   0.936  0.191  -0.243  
  4    4   8   0.963  0.270   0.019  
  5    5  11   0.975  0.227  -0.325  
  6    6   9   0.953  0.250  -0.283  
  7    7   9   0.873  0.318   0.540  
  8    8   8   0.941  0.291   0.263  
  9    9   8   0.918  0.226   0.096  
 10   10   7   0.979  0.259   0.072  
 11   11   8   0.948  0.152  -0.658  
 12   12   4   0.962  0.260   0.517  
 13   13   8   0.935  0.141  -0.779  
 14   14   4   0.948  0.157  -0.408  
 15   15   5   0.928  0.156  -0.568  
 16   16   7   0.985  0.276   0.224  
 17   17   6   0.946  0.202  -0.016  
 18   18  12   0.976  0.289   0.366  
 19   19   9   0.925  0.237  -0.170  
 20   20   9   0.922  0.208  -0.424  
 21   21   7   0.990  0.270   0.171  
 22   22   9   0.955  0.186  -0.782  
 23   23   5   0.966  0.166  -0.475  
 24   24  11   0.954  0.256  -0.071  
 25   25   7   0.984  0.325   0.662  
 26   26   6   0.941  0.179  -0.257  
 27   27   9   0.957  0.306   0.154  
 28   28   9   0.943  0.278  -0.065  
 29   29  11   0.913  0.250  -0.179  
 30   30   5   0.982  0.199  -0.168  
 31   31   8   0.981  0.340   0.706  
 32   32   9   0.929  0.220  -0.517  
 33   33   8   0.959  0.178  -0.383  
 34   34   9   0.947  0.168  -0.775  
 35   35   9   0.929  0.261   0.180  
 36   36   8   0.981  0.230  -0.331  
 37   37   8   0.976  0.231  -0.323  
 38   38   9   0.939  0.220  -0.213  
 39   39   8   0.984  0.241  -0.235  
 40   40   8   0.966  0.263   0.010  
 41   41  11   0.975  0.243  -0.185  
 42   42   9   0.893  0.308   0.169  
 43   43   6   0.954  0.159  -0.467  
 44   44   8   0.963  0.260  -0.017  
 45   45   8   0.943  0.168  -0.501  
 46   46   5   0.961  0.132  -0.792  
 47   47   8   0.934  0.141  -0.779  
 48   48   4   0.979  0.135  -0.605  
 49   49   8   0.964  0.139  -0.795  
 50   50   4   0.942  0.163  -0.354  
 51   51   9   0.890  0.162  -0.827  
 52   52   8   0.969  0.260  -0.017  
 53   53   8   0.928  0.201  -0.162  
 54   54   9   0.928  0.207  -0.337  
 55   55   8   0.901  0.244   0.314  
 56   56   9   0.927  0.160  -0.845  
 57   57  11   0.967  0.203  -0.535  
 58   58   5   0.985  0.191  -0.243  
 59   59   9   0.918  0.295   0.068  
 60   60  11   0.947  0.264  -0.001  
 61   61  12   0.833  0.243  -0.061  
 62   62   4   0.599  0.255   0.472  
 63   63   6   0.674  0.567   3.814  
 64   64   5   0.822  0.270   0.492  
 65   65   9   0.937  0.206  -0.442  
 66   66   5   0.956  0.204  -0.122  
 67   67   8   0.966  0.265  -0.025  
 68   68  11   0.977  0.238  -0.229  
 69   69   9   0.962  0.236  -0.392  
 70   70   9   0.880  0.302   0.400  
 71   71   8   0.934  0.253  -0.080  
 72   72   8   0.941  0.212  -0.048  
 73   73   7   0.968  0.272   0.188  
 74   74   8   0.948  0.122  -0.975  
 75   75   4   0.970  0.211   0.077  
 76   76   8   0.929  0.171  -0.470  
 77   77   4   0.956  0.157  -0.408  
 78   78   5   0.910  0.152  -0.606  
 79   79   7   0.986  0.241  -0.088  
 80   80   6   0.942  0.234   0.320  
 81   81  12   0.964  0.305   0.514  
 82   82   9   0.883  0.227  -0.258  
 83   83   9   0.945  0.232  -0.214  
 84   84   7   0.986  0.229  -0.196  
 85   85   9   0.966  0.229  -0.447  
 86   86   5   0.981  0.204  -0.122  
 87   87  11   0.981  0.267   0.025  
 88   88   7   0.982  0.290   0.349  
 89   89   6   0.963  0.191  -0.131  
 90   90   9   0.951  0.266  -0.158  
 91   91   9   0.931  0.201  -0.665  
 92   92  11   0.911  0.218  -0.432  
 93   93   5   0.971  0.210  -0.066  
 94   94   8   0.987  0.305   0.390  
 95   95   9   0.939  0.217  -0.541  
 96   96   8   0.950  0.194  -0.214  
 97   97   9   0.922  0.194  -0.547  
 98   98   9   0.936  0.309   0.640  
 99   99   8   0.989  0.253  -0.130  
100  100   8   0.984  0.241  -0.235  
101  101   9   0.953  0.243   0.008  
102  102   8   0.975  0.206  -0.542  
103  103   8   0.962  0.264   0.019  
104  104  11   0.968  0.207  -0.500  
105  105   9   0.920  0.285  -0.010  
106  106   6   0.965  0.157  -0.488  
107  107   8   0.972  0.233  -0.261  
108  108   8   0.909  0.152  -0.666  
109  109   5   0.956  0.183  -0.317  
110  110   8   0.937  0.157  -0.614  
111  111   4   0.924  0.128  -0.668  
112  112   8   0.921  0.121  -0.985  
113  113   4   0.920  0.187  -0.138  
114  114   9   0.888  0.244  -0.109  
115  115   8   0.944  0.294   0.290  
116  116   8   0.919  0.275   0.600  
117  117   9   0.929  0.230  -0.117  
118  118   8   0.884  0.255   0.430  
119  119   9   0.928  0.181  -0.661  
120  120  11   0.976  0.237  -0.238  
121  121   5   0.980  0.162  -0.513  
122  122   9   0.941  0.277  -0.073  
123  123  11   0.942  0.266   0.017  
124  124  12   0.858  0.302   0.487  
125  125   4   0.871  0.262   0.535  
126  126   6   0.873  0.203  -0.005  
127  127   8   0.843  0.218  -0.397  
128  128   1   0.962  0.040       ?  
129  129   1   0.922  0.047       ?  
130  130   1   0.941  0.038       ?  
131  131   1   0.962  0.038       ?  
132  132   1   0.776  0.278       ?  
133  133   1   0.860  0.296       ?  
134  134   1   0.726  0.421       ?  
135  135   1   0.670  0.798       ?  
136  136   1   0.571  0.350       ?  
137  137   1   0.897  0.124       ?  
138  138   1   0.949  0.332       ?  
139  139   1   0.404  0.371       ?  
140  140   1   0.452  0.612       ?  
141  141   1   0.309  0.365       ?  
142  142   1   0.749  0.478       ?  
143  143   1   0.773  0.430       ?  
144  144   1   0.861  0.406       ?  
145  145   1   0.921  0.432       ?  
146  146   1   0.885  0.548       ?  
147  147   1   0.725  0.283       ?  
148  148   1   0.770  0.424       ?  
149  149   1   0.919  0.138       ?  
150  150   1   0.567  0.361       ?  
151  151   1   0.706  0.429       ?  
152  152   1   0.870  0.114       ?  
153  153   1   0.625  0.549       ?  
154  154   1   0.870  0.169       ?  
155  155   1   0.870  0.279       ?  
156  156   1   0.827  0.286       ?  
157  157   1  -0.197  0.528       ?  
158  158   1   0.569  0.976       ?  
#
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  mogul        unknown                                                               Y  
3  eds          2.36                                                                  Y  
4  dcc          '"2.27  (2023-04-10)"'                                                Y  
5  xtriage      1.13                                                                  Y  
6  percentiles  "20191225.v01 (using entries in the PDB archive December 25th 2019)"  Y  
##
