data_4NC2

_pdbx_vrpt_database.id    PDB
_pdbx_vrpt_database.code  4NC2
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   x-ray
#
_pdbx_vrpt_summary.entry_id                    4NC2
_pdbx_vrpt_summary.PDB_deposition_date         2013-10-23
_pdbx_vrpt_summary.PDB_revision_number         4
_pdbx_vrpt_summary.PDB_revision_date           2023-09-20
_pdbx_vrpt_summary.report_creation_date        2023-09-12:19:05
_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  "Toxin B"  
2  polymer  "B39 VHH"  
3  water    water  
#
loop_
_pdbx_vrpt_asym.label_asym_id
_pdbx_vrpt_asym.entity_id
A  1  
B  2  
C  3  
D  3  
#
loop_
_pdbx_vrpt_percentile_list.id
_pdbx_vrpt_percentile_list.range
_pdbx_vrpt_percentile_list.exp_method
1  all  x-ray  
2  2.5  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   46.84  141614     ?     ?  
 2  2  1   66.42    5346  2.50  2.50  
 3  1  2  100.00  138981     ?     ?  
 4  2  2  100.00    5231  2.50  2.50  
 5  1  3   40.74  138945     ?     ?  
 6  2  3   67.80    5233  2.50  2.50  
 7  1  4  100.00  127900     ?     ?  
 8  2  4  100.00    4559  2.50  2.50  
 9  1  5   68.17  130704     ?     ?  
10  2  5   91.84    4661  2.50  2.50  
#
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  100.00  
 2  4  2  A  1  1  A  100.00  
 3  5  3  A  1  1  A   56.63  
 4  6  3  A  1  1  A   80.09  
 5  7  4  A  1  1  A  100.00  
 6  8  4  A  1  1  A  100.00  
 7  3  2  B  1  2  B  100.00  
 8  4  2  B  1  2  B  100.00  
 9  5  3  B  1  2  B   30.34  
10  6  3  B  1  2  B   55.07  
11  7  4  B  1  2  B  100.00  
12  8  4  B  1  2  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  0.60  0.45  1033  1397  
2  1  2  B  B  0.58  0.42   962  1303  
#
_pdbx_vrpt_summary_geometry.ordinal                        1
_pdbx_vrpt_summary_geometry.percent_ramachandran_outliers  0.00
_pdbx_vrpt_summary_geometry.percent_rotamer_outliers       2.97
_pdbx_vrpt_summary_geometry.clashscore                     6.16
_pdbx_vrpt_summary_geometry.num_H_reduce                   1787
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ                 1995
_pdbx_vrpt_summary_geometry.bonds_RMSZ                     0.43
_pdbx_vrpt_summary_geometry.num_angles_RMSZ                2700
_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.bulk_solvent_b            37.581
_pdbx_vrpt_summary_diffraction.Wilson_B_estimate         41.122
_pdbx_vrpt_summary_diffraction.I_over_sigma              1.81(2.08A)
_pdbx_vrpt_summary_diffraction.num_miller_indices        21109
_pdbx_vrpt_summary_diffraction.bulk_solvent_k            0.338
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L_mean     0.495
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L2_mean    0.326
_pdbx_vrpt_summary_diffraction.Fo_Fc_correlation         0.959
_pdbx_vrpt_summary_diffraction.twin_fraction             -h,-k,l:0.033
_pdbx_vrpt_summary_diffraction.DCC_R                     0.19
_pdbx_vrpt_summary_diffraction.DCC_Rfree                 0.22
_pdbx_vrpt_summary_diffraction.EDS_R                     0.23
_pdbx_vrpt_summary_diffraction.EDS_res_high              2.09
_pdbx_vrpt_summary_diffraction.EDS_res_low               43.86
_pdbx_vrpt_summary_diffraction.Wilson_B_aniso            "[36.435,36.435,51.504,-0.000,0.000,0.000]"
_pdbx_vrpt_summary_diffraction.data_anisotropy           0.363
_pdbx_vrpt_summary_diffraction.trans_NCS_details         "The largest off-origin peak in the Patterson function is 4.76% 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         99.83
_pdbx_vrpt_summary_diffraction.number_reflns_R_free      1056
_pdbx_vrpt_summary_diffraction.percent_free_reflections  5.00
_pdbx_vrpt_summary_diffraction.percent_RSRZ_outliers     0.00
_pdbx_vrpt_summary_diffraction.PDB_resolution_high       2.50
_pdbx_vrpt_summary_diffraction.PDB_resolution_low        30.00
_pdbx_vrpt_summary_diffraction.PDB_R                     0.19
_pdbx_vrpt_summary_diffraction.PDB_Rfree                 0.23
#
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
_pdbx_vrpt_model_instance.count_symm_clashes
  1  1  1  A    5  HIS  A    5  .  ?        ?     ?  
  2  1  1  A    6  HIS  A    6  .  ?        ?     ?  
  3  1  1  A    7  HIS  A    7  .  ?        ?     ?  
  4  1  1  A    8  LYS  A    8  .  ?        ?     ?  
  5  1  1  A    9  GLY  A    9  .  ?        ?     ?  
  6  1  1  A   10  ILE  A   10  .  ?        ?     ?  
  7  1  1  A   11  MET  A   11  .  ?        ?     ?  
  8  1  1  A   12  ARG  A   12  .  ?        ?     ?  
  9  1  1  A   13  THR  A   13  .  ?        ?     ?  
 10  1  1  A   14  GLY  A   14  .  ?        ?     ?  
 11  1  1  A   15  LEU  A   15  .  ?        ?     ?  
 12  1  1  A   16  ILE  A   16  .  ?        ?     ?  
 13  1  1  A   17  SER  A   17  .  ?        ?     ?  
 14  1  1  A   18  PHE  A   18  .  ?        ?     ?  
 15  1  1  A   19  GLU  A   19  .  ?        ?     ?  
 16  1  1  A   20  ASN  A   20  .  ?        ?     ?  
 17  1  1  A   21  ASN  A   21  .  ?        ?     ?  
 18  1  1  A   22  ASN  A   22  .  ?        ?     ?  
 19  1  1  A   23  TYR  A   23  .  ?        ?     ?  
 20  1  1  A   24  TYR  A   24  .  ?        ?     ?  
 21  1  1  A   25  PHE  A   25  .  ?        ?     ?  
 22  1  1  A   26  ASN  A   26  .  ?        ?     ?  
 23  1  1  A   27  GLU  A   27  .  ?        ?     ?  
 24  1  1  A   28  ASN  A   28  .  ?        ?     ?  
 25  1  1  A   29  GLY  A   29  .  ?        ?     ?  
 26  1  1  A   30  GLU  A   30  .  ?        ?     ?  
 27  1  1  A   31  MET  A   31  .  ?        4     ?  
 28  1  1  A   32  GLN  A   32  .  ?        ?     ?  
 29  1  1  A   33  PHE  A   33  .  ?        4     ?  
 30  1  1  A   34  GLY  A   34  .  ?        ?     ?  
 31  1  1  A   35  TYR  A   35  .  ?        ?     ?  
 32  1  1  A   36  ILE  A   36  .  ?        ?     ?  
 33  1  1  A   37  ASN  A   37  .  ?        ?     ?  
 34  1  1  A   38  ILE  A   38  .  ?        ?     ?  
 35  1  1  A   39  GLU  A   39  .  ?        3     ?  
 36  1  1  A   40  ASP  A   40  .  ?        1     ?  
 37  1  1  A   41  LYS  A   41  .  ?        1     ?  
 38  1  1  A   42  MET  A   42  .  ?        ?     ?  
 39  1  1  A   43  PHE  A   43  .  ?        ?     ?  
 40  1  1  A   44  TYR  A   44  .  ?        ?     ?  
 41  1  1  A   45  PHE  A   45  .  ?        ?     ?  
 42  1  1  A   46  GLY  A   46  .  ?        ?     ?  
 43  1  1  A   47  GLU  A   47  .  ?        ?     ?  
 44  1  1  A   48  ASP  A   48  .  ?        ?     ?  
 45  1  1  A   49  GLY  A   49  .  ?        ?     ?  
 46  1  1  A   50  VAL  A   50  .  ?        ?     ?  
 47  1  1  A   51  MET  A   51  .  ?        1     ?  
 48  1  1  A   52  GLN  A   52  .  ?        ?     ?  
 49  1  1  A   53  ILE  A   53  .  ?        1     ?  
 50  1  1  A   54  GLY  A   54  .  ?        ?     ?  
 51  1  1  A   55  VAL  A   55  .  ?        1     ?  
 52  1  1  A   56  PHE  A   56  .  ?        ?     ?  
 53  1  1  A   57  ASN  A   57  .  ?        ?     ?  
 54  1  1  A   58  THR  A   58  .  ?        ?     ?  
 55  1  1  A   59  PRO  A   59  .  ?        ?     ?  
 56  1  1  A   60  ASP  A   60  .  ?        ?     ?  
 57  1  1  A   61  GLY  A   61  .  ?        ?     ?  
 58  1  1  A   62  PHE  A   62  .  ?        1     ?  
 59  1  1  A   63  LYS  A   63  .  ?        1     ?  
 60  1  1  A   64  TYR  A   64  .  ?        ?     ?  
 61  1  1  A   65  PHE  A   65  .  ?        ?     ?  
 62  1  1  A   66  ALA  A   66  .  ?        ?     ?  
 63  1  1  A   67  HIS  A   67  .  ?        ?     ?  
 64  1  1  A   68  GLN  A   68  .  ?        ?     ?  
 65  1  1  A   69  ASN  A   69  .  ?        ?     ?  
 66  1  1  A   70  THR  A   70  .  ?        ?     ?  
 67  1  1  A   71  LEU  A   71  .  ?        ?     ?  
 68  1  1  A   72  ASP  A   72  .  ?        ?     ?  
 69  1  1  A   73  GLU  A   73  .  ?        ?     ?  
 70  1  1  A   74  ASN  A   74  .  ?        ?     ?  
 71  1  1  A   75  PHE  A   75  .  ?        2     ?  
 72  1  1  A   76  GLU  A   76  .  ?        ?     ?  
 73  1  1  A   77  GLY  A   77  .  ?        ?     ?  
 74  1  1  A   78  GLU  A   78  .  ?        ?     ?  
 75  1  1  A   79  SER  A   79  .  ?        ?     ?  
 76  1  1  A   80  ILE  A   80  .  ?        ?     ?  
 77  1  1  A   81  ASN  A   81  .  ?        ?     ?  
 78  1  1  A   82  TYR  A   82  .  ?        ?     ?  
 79  1  1  A   83  THR  A   83  .  ?        ?     ?  
 80  1  1  A   84  GLY  A   84  .  ?        ?     ?  
 81  1  1  A   85  TRP  A   85  .  ?        ?     ?  
 82  1  1  A   86  LEU  A   86  .  ?        ?     ?  
 83  1  1  A   87  ASP  A   87  .  ?        ?     ?  
 84  1  1  A   88  LEU  A   88  .  ?        ?     ?  
 85  1  1  A   89  ASP  A   89  .  ?        1     ?  
 86  1  1  A   90  GLU  A   90  .  ?        1     ?  
 87  1  1  A   91  LYS  A   91  .  ?        ?     ?  
 88  1  1  A   92  ARG  A   92  .  ?        ?     ?  
 89  1  1  A   93  TYR  A   93  .  ?        ?     ?  
 90  1  1  A   94  TYR  A   94  .  ?        ?     ?  
 91  1  1  A   95  PHE  A   95  .  ?        ?     ?  
 92  1  1  A   96  THR  A   96  .  ?        1     ?  
 93  1  1  A   97  ASP  A   97  .  ?        ?     ?  
 94  1  1  A   98  GLU  A   98  .  ?        1     ?  
 95  1  1  A   99  TYR  A   99  .  ?        ?     ?  
 96  1  1  A  100  ILE  A  100  .  ?        ?     ?  
 97  1  1  A  101  ALA  A  101  .  ?        1     ?  
 98  1  1  A  102  ALA  A  102  .  ?        ?     ?  
 99  1  1  A  103  THR  A  103  .  ?        ?     ?  
100  1  1  A  104  GLY  A  104  .  ?        ?     ?  
101  1  1  A  105  SER  A  105  .  ?        ?     ?  
102  1  1  A  106  VAL  A  106  .  ?        ?     ?  
103  1  1  A  107  ILE  A  107  .  ?        ?     ?  
104  1  1  A  108  ILE  A  108  .  ?        ?     ?  
105  1  1  A  109  ASP  A  109  .  ?        ?     ?  
106  1  1  A  110  GLY  A  110  .  ?        ?     ?  
107  1  1  A  111  GLU  A  111  .  ?        ?     ?  
108  1  1  A  112  GLU  A  112  .  ?        ?     ?  
109  1  1  A  113  TYR  A  113  .  ?        ?     ?  
110  1  1  A  114  TYR  A  114  .  ?        ?     ?  
111  1  1  A  115  PHE  A  115  .  ?        ?     ?  
112  1  1  A  116  ASP  A  116  .  ?        ?     ?  
113  1  1  A  117  PRO  A  117  .  ?        ?     ?  
114  1  1  A  118  ASP  A  118  .  ?        ?     ?  
115  1  1  A  119  THR  A  119  .  ?        1     ?  
116  1  1  A  120  ALA  A  120  .  ?        ?     ?  
117  1  1  A  121  GLN  A  121  .  ?        1     ?  
118  1  1  A  122  LEU  A  122  .  ?        ?     ?  
119  1  1  A  123  VAL  A  123  .  ?        ?     ?  
120  1  1  A  124  ILE  A  124  .  ?        ?     ?  
121  1  1  A  125  SER  A  125  .  ?        ?     ?  
122  1  2  B    1  GLN  B    1  .  ?        ?     1  
123  1  2  B    2  VAL  B    2  .  ?        ?     ?  
124  1  2  B    3  GLN  B    3  .  ?        ?     ?  
125  1  2  B    4  LEU  B    4  .  ?        ?     ?  
126  1  2  B    5  VAL  B    5  .  ?        ?     ?  
127  1  2  B    6  GLU  B    6  .  ?        ?     ?  
128  1  2  B    7  SER  B    7  .  ?        ?     ?  
129  1  2  B    8  GLY  B    8  .  ?        ?     ?  
130  1  2  B    9  GLY  B    9  .  ?        ?     ?  
131  1  2  B   10  GLY  B   10  .  ?        ?     ?  
132  1  2  B   11  LEU  B   11  .  ?        ?     ?  
133  1  2  B   12  VAL  B   12  .  ?        ?     ?  
134  1  2  B   13  GLN  B   13  .  ?        ?     ?  
135  1  2  B   14  ALA  B   14  .  ?        ?     ?  
136  1  2  B   15  GLY  B   15  .  ?        ?     ?  
137  1  2  B   16  GLY  B   16  .  ?        ?     ?  
138  1  2  B   17  SER  B   17  .  ?        ?     ?  
139  1  2  B   18  LEU  B   18  .  ?        ?     ?  
140  1  2  B   19  ARG  B   19  .  ?        ?     ?  
141  1  2  B   20  LEU  B   20  .  ?        ?     ?  
142  1  2  B   21  SER  B   21  .  ?        ?     ?  
143  1  2  B   22  CYS  B   22  .  ?        1     ?  
144  1  2  B   23  ALA  B   23  .  ?        ?     ?  
145  1  2  B   24  ALA  B   24  .  ?        ?     ?  
146  1  2  B   25  SER  B   25  .  ?        ?     ?  
147  1  2  B   26  GLY  B   26  .  ?        ?     ?  
148  1  2  B   27  LEU  B   27  .  ?        ?     ?  
149  1  2  B   28  THR  B   28  .  ?        ?     ?  
150  1  2  B   29  PHE  B   29  .  ?        ?     ?  
151  1  2  B   30  SER  B   30  .  ?        ?     ?  
152  1  2  B   31  ARG  B   31  .  ?        ?     ?  
153  1  2  B   32  TYR  B   32  .  ?        ?     ?  
154  1  2  B   33  VAL  B   33  .  ?        2     ?  
155  1  2  B   34  MET  B   34  .  ?        ?     ?  
156  1  2  B   35  GLY  B   35  .  ?        ?     ?  
157  1  2  B   36  TRP  B   36  .  ?        ?     ?  
158  1  2  B   37  PHE  B   37  .  ?        ?     ?  
159  1  2  B   38  ARG  B   38  .  ?        ?     ?  
160  1  2  B   39  GLN  B   39  .  ?        ?     ?  
161  1  2  B   40  ALA  B   40  .  ?        ?     ?  
162  1  2  B   41  PRO  B   41  .  ?        ?     ?  
163  1  2  B   42  GLY  B   42  .  ?        ?     ?  
164  1  2  B   43  LYS  B   43  .  ?        ?     ?  
165  1  2  B   44  GLU  B   44  .  ?        ?     ?  
166  1  2  B   45  ARG  B   45  .  ?        ?     ?  
167  1  2  B   46  GLU  B   46  .  ?        ?     ?  
168  1  2  B   47  PHE  B   47  .  ?        ?     ?  
169  1  2  B   48  VAL  B   48  .  ?        ?     ?  
170  1  2  B   49  ALA  B   49  .  ?        ?     ?  
171  1  2  B   50  ALA  B   50  .  ?        ?     ?  
172  1  2  B   51  ILE  B   51  .  ?        ?     ?  
173  1  2  B   52  THR  B   52  .  ?        5     ?  
174  1  2  B   53  TRP  B   53  .  ?        2     ?  
175  1  2  B   54  GLY  B   54  .  ?        2     ?  
176  1  2  B   55  GLY  B   55  .  ?        ?     ?  
177  1  2  B   56  THR  B   56  .  ?        ?     ?  
178  1  2  B   57  PRO  B   57  .  ?        ?     ?  
179  1  2  B   58  ASN  B   58  .  ?        ?     ?  
180  1  2  B   59  TYR  B   59  .  ?        ?     ?  
181  1  2  B   60  ALA  B   60  .  ?        ?     ?  
182  1  2  B   61  ASP  B   61  .  ?        ?     ?  
183  1  2  B   62  SER  B   62  .  ?        ?     ?  
184  1  2  B   63  VAL  B   63  .  ?        ?     ?  
185  1  2  B   64  LYS  B   64  .  ?        ?     ?  
186  1  2  B   65  GLY  B   65  .  ?        ?     ?  
187  1  2  B   66  ARG  B   66  .  ?        ?     ?  
188  1  2  B   67  PHE  B   67  .  ?        ?     ?  
189  1  2  B   68  THR  B   68  .  ?        ?     ?  
190  1  2  B   69  ILE  B   69  .  ?        ?     ?  
191  1  2  B   70  SER  B   70  .  ?        ?     ?  
192  1  2  B   71  ARG  B   71  .  ?        ?     ?  
193  1  2  B   72  ASP  B   72  .  ?        ?     ?  
194  1  2  B   73  ASN  B   73  .  ?        ?     ?  
195  1  2  B   74  SER  B   74  .  ?        ?     ?  
196  1  2  B   75  LYS  B   75  .  ?        ?     ?  
197  1  2  B   76  ASN  B   76  .  ?        ?     ?  
198  1  2  B   77  THR  B   77  .  ?        ?     ?  
199  1  2  B   78  GLN  B   78  .  ?        3     ?  
200  1  2  B   79  TYR  B   79  .  ?        ?     ?  
201  1  2  B   80  LEU  B   80  .  ?        ?     ?  
202  1  2  B   81  GLN  B   81  .  ?        ?     ?  
203  1  2  B   82  MET  B   82  .  ?        ?     ?  
204  1  2  B   83  ASN  B   83  .  ?        ?     ?  
205  1  2  B   84  SER  B   84  .  ?        ?     ?  
206  1  2  B   85  LEU  B   85  .  ?        ?     ?  
207  1  2  B   86  LYS  B   86  .  ?        ?     ?  
208  1  2  B   87  PRO  B   87  .  ?        ?     ?  
209  1  2  B   88  GLU  B   88  .  ?        ?     ?  
210  1  2  B   89  ASP  B   89  .  ?        ?     ?  
211  1  2  B   90  THR  B   90  .  ?        ?     ?  
212  1  2  B   91  ALA  B   91  .  ?        ?     ?  
213  1  2  B   92  VAL  B   92  .  ?        ?     ?  
214  1  2  B   93  TYR  B   93  .  ?        ?     ?  
215  1  2  B   94  TYR  B   94  .  ?        ?     ?  
216  1  2  B   95  CYS  B   95  .  ?        2     ?  
217  1  2  B   96  ALA  B   96  .  ?        ?     ?  
218  1  2  B   97  ALA  B   97  .  ?        ?     ?  
219  1  2  B   98  GLY  B   98  .  ?        1     ?  
220  1  2  B   99  LEU  B   99  .  ?        ?     ?  
221  1  2  B  100  GLY  B  100  .  ?        ?     ?  
222  1  2  B  101  TRP  B  101  .  ?        ?     ?  
223  1  2  B  102  ASP  B  102  .  ?        ?     ?  
224  1  2  B  103  SER  B  103  .  ?        ?     ?  
225  1  2  B  104  ARG  B  104  .  ?        ?     ?  
226  1  2  B  105  TYR  B  105  .  ?        ?     ?  
227  1  2  B  106  SER  B  106  .  ?        ?     ?  
228  1  2  B  107  GLN  B  107  .  ?        ?     ?  
229  1  2  B  108  SER  B  108  .  ?        ?     ?  
230  1  2  B  109  TYR  B  109  .  ?        1     ?  
231  1  2  B  110  ASN  B  110  .  ?        ?     ?  
232  1  2  B  111  TYR  B  111  .  ?        ?     ?  
233  1  2  B  112  TRP  B  112  .  ?        ?     ?  
234  1  2  B  113  GLY  B  113  .  ?        ?     ?  
235  1  2  B  114  GLN  B  114  .  ?        ?     1  
236  1  2  B  115  GLY  B  115  .  ?        ?     ?  
237  1  2  B  116  THR  B  116  .  ?        ?     ?  
238  1  2  B  117  GLN  B  117  .  ?        ?     ?  
239  1  2  B  118  VAL  B  118  .  ?        ?     ?  
240  1  2  B  119  THR  B  119  .  ?        ?     ?  
241  1  2  B  120  VAL  B  120  .  ?        ?     ?  
242  1  2  B  121  SER  B  121  .  ?        ?     ?  
243  1  2  B  122  SER  B  122  .  ?        ?     ?  
244  1  3  C    .  HOH  A  201  .  ?        ?     ?  
245  1  3  C    .  HOH  A  202  .  ?        ?     ?  
246  1  3  C    .  HOH  A  203  .  ?        ?     ?  
247  1  3  C    .  HOH  A  204  .  ?        ?     ?  
248  1  3  C    .  HOH  A  205  .  ?        ?     ?  
249  1  3  C    .  HOH  A  206  .  ?        ?     ?  
250  1  3  C    .  HOH  A  207  .  ?        ?     ?  
251  1  3  D    .  HOH  B  201  .  ?        ?     ?  
252  1  3  D    .  HOH  B  202  .  ?        ?     ?  
253  1  3  D    .  HOH  B  203  .  ?        ?     ?  
254  1  3  D    .  HOH  B  204  .  ?        ?     ?  
#
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  m-70          ?       ?  ?           ?     6  109.310    11  0.51    15  0.33  molprobity  1.000  
  2    2  t-80     -145.1   128.5  Favored     ?     7  114.850    11  0.14    15  0.21  molprobity  1.000  
  3    3  p80      -138.0   146.9  Favored     ?     7  104.010    11  0.18    15  0.40  molprobity  1.000  
  4    4  ttpp     -140.5   136.4  Favored     ?    13   87.430     9  0.35    11  0.60  molprobity  1.000  
  5    5  ?         -90.4   128.5  Favored     ?     3   75.340     4  0.21     5  0.61  molprobity  1.000  
  6    6  pt       -117.1  -177.2  Allowed     ?    11   68.870     8  0.21    11  0.76  molprobity  1.000  
  7    7  ttm      -138.0   130.6  Favored     ?     9   69.980     8  0.41    10  0.59  molprobity  1.000  
  8    8  mmt180   -117.8   131.8  Favored     ?    13   64.080    11  0.48    14  0.78  molprobity  1.000  
  9    9  p        -130.6   150.1  Favored     ?     7   52.190     7  0.30    10  0.60  molprobity  1.000  
 10   10  ?          87.6  -159.9  Favored     ?     3   52.590     4  0.45     5  0.74  molprobity  1.000  
 11   11  mp        -83.5   112.0  Favored     ?    11   46.710     8  0.48    11  0.51  molprobity  1.000  
 12   12  mt       -128.0   141.0  Favored     ?    11   40.900     8  0.22    11  0.67  molprobity  1.000  
 13   13  m        -112.4   132.2  Favored     ?     5   43.020     6  0.45     8  0.34  molprobity  1.000  
 14   14  m-85     -117.7   113.5  Favored     ?     9   62.100    12  0.64    16  0.69  molprobity  1.000  
 15   15  OUTLIER    57.6  -121.3  Allowed     ?     6   91.630     9  0.43    12  0.63  molprobity  1.000  
 16   16  m120     -105.3    16.4  Favored     ?     6   83.140     8  0.37    11  0.38  molprobity  1.000  
 17   17  m-20     -105.9   128.9  Favored     ?     6   49.130     8  0.27    11  0.55  molprobity  1.000  
 18   18  m-20     -100.9   127.0  Favored     ?     6   34.150     8  0.36    11  0.51  molprobity  1.000  
 19   19  m-85     -118.8   158.0  Favored     ?     9   40.550    13  0.43    18  0.49  molprobity  1.000  
 20   20  t80      -121.5   123.0  Favored     ?     9   49.870    13  0.46    18  0.40  molprobity  1.000  
 21   21  m-85     -104.9   133.2  Favored     ?     9   43.840    12  0.45    16  0.39  molprobity  1.000  
 22   22  p30       -75.4   179.6  Favored     ?     6   54.170     8  0.31    11  0.41  molprobity  1.000  
 23   23  mt-10     -46.8   -43.1  Favored     ?     6   83.670     9  0.44    12  0.87  molprobity  1.000  
 24   24  m-20      -82.2     6.2  Favored     ?     6   76.170     8  0.19    11  0.39  molprobity  1.000  
 25   25  ?          86.0    15.9  Favored     ?     3   52.860     4  0.28     5  0.47  molprobity  1.000  
 26   26  mt-10    -100.0   124.6  Favored     ?     6   60.170     9  0.36    12  0.58  molprobity  1.000  
 27   27  ttp       -65.8   146.0  Favored     ?     9   46.440     8  0.36    10  0.86  molprobity  1.000  
 28   28  mm100    -112.5   147.6  Favored     ?     8   50.210     9  0.28    12  0.58  molprobity  1.000  
 29   29  m-85     -133.9   143.6  Favored     ?     9   45.300    12  0.42    16  0.41  molprobity  1.000  
 30   30  ?          80.9  -148.7  Favored     ?     3   45.300     4  0.19     5  0.59  molprobity  1.000  
 31   31  t80       -81.9   115.3  Favored     ?     9   46.290    13  0.66    18  0.70  molprobity  1.000  
 32   32  mm       -128.9   135.0  Favored     ?    11   44.570     8  0.31    11  0.76  molprobity  1.000  
 33   33  t-20      -94.1   116.6  Favored     ?     6   53.640     8  0.42    11  0.42  molprobity  1.000  
 34   34  mt       -115.0   106.8  Favored     ?    11   47.630     8  0.39    11  1.00  molprobity  1.000  
 35   35  mt-10      44.0    40.3  Favored     ?     6   56.380     9  0.56    12  0.60  molprobity  1.000  
 36   36  m-20       85.5     3.8  Allowed     ?     4   64.080     8  0.33    11  0.77  molprobity  1.000  
 37   37  mttm      -97.8   139.8  Favored     ?    13   48.600     9  0.57    11  0.81  molprobity  1.000  
 38   38  mmt      -100.4   139.0  Favored     ?     9   55.280     8  0.43    10  0.30  molprobity  1.000  
 39   39  m-85     -139.3   163.2  Favored     ?     9   39.810    12  0.80    16  0.56  molprobity  1.000  
 40   40  t80      -126.6   119.9  Favored     ?     9   41.010    13  0.58    18  0.45  molprobity  1.000  
 41   41  m-85     -111.9   129.6  Favored     ?     9   38.640    12  0.71    16  0.39  molprobity  1.000  
 42   42  ?         -60.5   172.9  Favored     ?     3   48.410     4  0.48     5  0.54  molprobity  1.000  
 43   43  tt0       -70.0    -9.7  Favored     ?     6   77.280     9  0.32    12  0.55  molprobity  1.000  
 44   44  p-10     -106.6     9.8  Favored     ?     4   40.730     8  0.57    11  0.44  molprobity  1.000  
 45   45  ?          91.9   -13.6  Favored     ?     3   41.510     4  0.33     5  0.40  molprobity  1.000  
 46   46  t         -81.2   118.7  Favored     ?     9   36.810     7  0.34    10  0.55  molprobity  1.000  
 47   47  ttp       -47.9   135.2  Favored     ?     9   39.140     8  0.39    10  0.50  molprobity  1.000  
 48   48  mm-40    -113.2   149.6  Favored     ?     8   46.300     9  0.19    12  0.63  molprobity  1.000  
 49   49  mp       -117.4   137.3  Favored     ?    11   37.190     8  0.22    11  0.61  molprobity  1.000  
 50   50  ?         133.2  -166.1  Favored     ?     3   39.000     4  0.82     5  0.67  molprobity  1.000  
 51   51  t        -103.6   122.0  Favored     ?     9   38.690     7  0.26    10  0.63  molprobity  1.000  
 52   52  m-85     -131.1   153.3  Favored     ?     9   39.990    12  0.68    16  0.43  molprobity  1.000  
 53   53  t30       -74.5   130.9  Favored     ?     6   58.820     8  0.38    11  0.38  molprobity  1.000  
 54   54  p        -130.4   165.5  Favored     ?     7   55.900     7  0.51    11  0.70  molprobity  1.000  
 55   55  Cg_exo    -53.4   -29.1  Favored     ?     7   65.960     8  0.23    11  0.34  molprobity  1.000  
 56   56  m-20      -84.6     2.5  Favored     ?     4   78.570     8  0.30    11  0.41  molprobity  1.000  
 57   57  ?         108.2   174.3  Favored     ?     3   54.260     4  0.41     5  0.48  molprobity  1.000  
 58   58  m-85      -69.4   121.8  Favored     ?     9   51.330    12  0.60    16  0.43  molprobity  1.000  
 59   59  mmmt     -115.6   156.3  Favored     ?    13   50.720     9  0.41    11  0.74  molprobity  1.000  
 60   60  t80       -98.5   113.3  Favored     ?     9   36.690    13  0.38    18  0.70  molprobity  1.000  
 61   61  m-85      -99.8   120.2  Favored     ?     9   36.770    12  0.69    16  0.54  molprobity  1.000  
 62   62  ?        -125.3   159.2  Favored     ?     5   38.130     5  0.35     7  0.47  molprobity  1.000  
 63   63  m-70      -59.7   152.7  Favored     ?     7   37.260    11  0.29    15  0.27  molprobity  1.000  
 64   64  pt20      -46.0   137.9  Favored     ?     8   43.490     9  0.23    12  0.32  molprobity  1.000  
 65   65  t-20       70.5    27.6  Favored     ?     6   51.250     8  0.35    11  0.47  molprobity  1.000  
 66   66  m         -74.6   -45.2  Favored     ?     7   45.970     7  0.42    10  0.65  molprobity  1.000  
 67   67  tp       -151.0   138.7  Favored     ?    11   49.880     8  0.29    11  0.71  molprobity  1.000  
 68   68  m-20       50.0    40.7  Favored     ?     4   67.140     8  0.57    11  0.38  molprobity  1.000  
 69   69  mt-10      49.7    38.5  Favored     ?     6   57.100     9  0.22    12  0.59  molprobity  1.000  
 70   70  p-10      -65.2   157.0  Favored     ?     6   47.450     8  0.59    11  0.84  molprobity  1.000  
 71   71  t80       -83.5   148.3  Favored     ?     9   41.220    12  0.41    16  0.52  molprobity  1.000  
 72   72  mm-40     -39.7   114.2  Allowed     ?     6   42.990     9  0.91    12  0.96  molprobity  1.000  
 73   73  ?          88.7    -2.3  Favored     ?     3   31.480     4  0.46     5  0.71  molprobity  1.000  
 74   74  tt0       -68.5   149.7  Favored     ?     6   51.530     9  0.33    12  0.43  molprobity  1.000  
 75   75  p         -65.0   136.8  Favored     ?     5   48.550     6  0.27     8  0.53  molprobity  1.000  
 76   76  pt       -119.8   158.4  Favored     ?    11   48.720     8  0.23    11  0.51  molprobity  1.000  
 77   77  m-20      -87.2    60.5  Favored     ?     6   58.780     8  0.23    11  0.69  molprobity  1.000  
 78   78  t80       -79.1   146.1  Favored     ?     9   52.930    13  0.83    18  0.56  molprobity  1.000  
 79   79  p        -140.5   150.8  Favored     ?     7   61.490     7  0.24    10  0.82  molprobity  1.000  
 80   80  ?         100.2  -163.5  Favored     ?     3   56.880     4  0.57     5  0.69  molprobity  1.000  
 81   81  m95       -78.4   143.4  Favored     ?    10   55.210    16  0.47    23  0.38  molprobity  1.000  
 82   82  tp       -134.1   130.3  Favored     ?    11   46.820     8  0.34    11  0.45  molprobity  1.000  
 83   83  m-20     -109.8   122.9  Favored     ?     4   56.340     8  0.40    11  0.47  molprobity  1.000  
 84   84  mt       -118.0    89.5  Favored     ?    11   57.300     8  0.20    11  0.92  molprobity  1.000  
 85   85  p30        50.5  -131.6  Allowed     ?     4   88.630     8  0.69    11  1.23  molprobity  1.000  
 86   86  mm-40     -68.0    -7.3  Favored     ?     6   92.780     9  0.41    12  0.53  molprobity  1.000  
 87   87  mttp      -95.7   132.3  Favored     ?    13   59.720     9  0.33    11  0.91  molprobity  1.000  
 88   88  ttm180   -121.9   145.0  Favored     ?    13   61.230    11  0.44    14  0.51  molprobity  1.000  
 89   89  m-85     -142.8   163.4  Favored     ?     9   37.860    13  0.66    18  0.76  molprobity  1.000  
 90   90  t80      -137.2   124.3  Favored     ?     9   47.290    13  0.53    18  0.43  molprobity  1.000  
 91   91  m-85     -101.6   133.2  Favored     ?     9   45.240    12  0.54    16  0.50  molprobity  1.000  
 92   92  t         -78.8  -179.7  Favored     ?     7   71.170     7  0.40    10  0.46  molprobity  1.000  
 93   93  m-20      -58.3   -29.0  Favored     ?     4   84.960     8  0.30    11  0.46  molprobity  1.000  
 94   94  mt-10     -85.2    10.8  Favored     ?     6   90.370     9  0.29    12  0.47  molprobity  1.000  
 95   95  m-85       60.6    20.7  Favored     ?     9   72.340    13  0.46    18  0.45  molprobity  1.000  
 96   96  pt       -112.1   162.6  Favored     ?    11   61.440     8  0.38    11  0.44  molprobity  1.000  
 97   97  ?         -77.8   136.2  Favored     ?     5   53.280     5  0.37     7  0.23  molprobity  1.000  
 98   98  ?         -67.7   144.0  Favored     ?     5   47.280     5  0.24     7  0.26  molprobity  1.000  
 99   99  p        -136.3   142.3  Favored     ?     7   50.800     7  0.37    10  0.56  molprobity  1.000  
100  100  ?          92.3  -160.9  Favored     ?     3   46.460     4  0.24     5  0.55  molprobity  1.000  
101  101  m         -78.0   128.5  Favored     ?     5   51.760     6  0.25     8  0.30  molprobity  1.000  
102  102  m        -142.0   148.2  Favored     ?     9   57.450     7  0.41    10  0.58  molprobity  1.000  
103  103  mp       -100.4   120.9  Favored     ?    11   64.260     8  0.27    11  0.82  molprobity  1.000  
104  104  mt       -125.9   121.2  Favored     ?    11   64.030     8  0.35    11  0.67  molprobity  1.000  
105  105  m-20       47.0    47.9  Favored     ?     4   81.020     8  0.33    11  0.44  molprobity  1.000  
106  106  ?          73.2     5.3  Favored     ?     3   71.000     4  0.38     5  0.94  molprobity  1.000  
107  107  mm-40    -116.7   146.2  Favored     ?     6   84.610     9  0.47    12  0.60  molprobity  1.000  
108  108  tt0       -92.5   141.1  Favored     ?     6   63.780     9  0.34    12  0.58  molprobity  1.000  
109  109  m-85     -136.3   161.1  Favored     ?     9   50.820    13  0.36    18  0.31  molprobity  1.000  
110  110  t80      -129.0   132.1  Favored     ?     9   46.900    13  0.54    18  0.41  molprobity  1.000  
111  111  m-85     -119.0   132.7  Favored     ?     9   42.520    12  0.43    16  0.35  molprobity  1.000  
112  112  t0        -59.6   124.5  Favored     ?     4   51.260     8  0.36    12  1.28  molprobity  1.000  
113  113  Cg_exo    -60.8   -23.3  Favored     ?     7   50.890     8  0.30    11  0.46  molprobity  1.000  
114  114  m-20      -89.3   -22.7  Favored     ?     4   57.130     8  0.38    11  0.78  molprobity  1.000  
115  115  p        -128.3   -16.6  Favored     ?     7   49.080     7  0.43    10  0.84  molprobity  1.000  
116  116  ?          67.8     3.8  Favored     ?     5   40.680     5  0.59     7  1.08  molprobity  1.000  
117  117  pt20      -77.8   132.4  Favored     1     8   52.700     9  0.41    12  0.99  molprobity  1.000  
118  118  tp        -44.9   135.5  Favored     ?    11   40.390     8  0.37    11  0.37  molprobity  1.000  
119  119  t         -97.9   108.0  Favored     ?     9   47.340     7  0.31    10  0.31  molprobity  1.000  
120  120  pt       -103.3   159.1  Favored     ?    11   75.030     8  0.38    11  1.09  molprobity  1.000  
121  121  OUTLIER       ?       ?  ?           ?     5   71.860     5  0.63     5  0.54  molprobity  1.000  
122  122  tt0           ?       ?  ?           ?    10  116.260     9  0.55    12  0.33  molprobity  1.000  
123  123  t        -101.5   124.8  Favored     ?     9   80.030     7  0.25    10  0.51  molprobity  1.000  
124  124  mt-30    -138.0   136.3  Favored     ?     8   88.530     9  0.36    12  0.59  molprobity  1.000  
125  125  mt       -121.9   116.1  Favored     ?    11   63.310     8  0.33    11  0.58  molprobity  1.000  
126  126  t        -107.7   115.8  Favored     ?     9   73.490     7  0.18    10  0.49  molprobity  1.000  
127  127  mp0       -79.5   154.5  Favored     ?     6   64.840     9  0.43    12  0.71  molprobity  1.000  
128  128  p        -169.3   169.5  Favored     ?     5   74.110     6  0.28     8  0.52  molprobity  1.000  
129  129  ?          94.4     3.3  Favored     ?     3   75.540     4  0.26     5  0.35  molprobity  1.000  
130  130  ?         -72.0  -161.3  Favored     ?     3   74.260     4  0.29     5  0.31  molprobity  1.000  
131  131  ?         110.6  -158.4  Favored     ?     3   70.070     4  0.22     5  0.98  molprobity  1.000  
132  132  OUTLIER   -96.3   134.0  Favored     ?    11   76.100     8  0.29    11  0.77  molprobity  1.000  
133  133  p        -145.8   155.8  Favored     ?     9   78.130     7  0.19    10  0.38  molprobity  1.000  
134  134  tt0       -82.7   152.2  Favored     ?     8   95.460     9  0.28    12  0.50  molprobity  1.000  
135  135  ?         -64.2   146.5  Favored     ?     5   82.300     5  0.29     7  0.28  molprobity  1.000  
136  136  ?          80.6   -16.9  Favored     ?     3   78.930     4  0.64     5  0.21  molprobity  1.000  
137  137  ?         -76.3  -169.2  Favored     ?     3   75.930     4  0.54     5  0.48  molprobity  1.000  
138  138  m        -137.0   151.0  Favored     ?     5   76.510     6  0.22     8  0.65  molprobity  1.000  
139  139  mt       -140.7   154.3  Favored     ?    11   76.990     8  0.23    11  0.89  molprobity  1.000  
140  140  ttt85    -124.3   104.7  Favored     ?    13   82.480    11  0.32    14  0.52  molprobity  1.000  
141  141  mt        -80.1   137.4  Favored     ?    11   56.400     8  0.36    11  0.96  molprobity  1.000  
142  142  t        -117.8   140.1  Favored     ?     5   63.740     6  0.51     8  0.37  molprobity  1.000  
143  143  t        -126.8   120.8  Favored     ?     4   65.190     6  0.16     8  0.50  molprobity  1.000  
144  144  ?        -102.5   123.6  Favored     ?     5   69.690     5  0.19     7  0.28  molprobity  1.000  
145  145  ?        -109.6   132.7  Favored     ?     5   68.920     5  0.26     7  0.67  molprobity  1.000  
146  146  p        -137.8   148.7  Favored     ?     5   75.660     6  0.30     8  0.21  molprobity  1.000  
147  147  ?          97.2    15.0  Favored     ?     3   73.980     4  0.49     5  0.49  molprobity  1.000  
148  148  OUTLIER  -160.1   154.2  Favored     ?    11   60.280     8  0.28    11  1.03  molprobity  1.000  
149  149  m         -68.4    98.6  Allowed     ?     7   65.690     7  0.30    10  0.68  molprobity  1.000  
150  150  t80       -59.4   -37.4  Favored     ?     9   60.600    12  0.49    16  0.23  molprobity  1.000  
151  151  p         -66.2    -8.8  Favored     ?     5   72.280     6  0.17     8  0.28  molprobity  1.000  
152  152  mtt180    -97.3   -17.0  Favored     ?    13   68.920    11  0.26    14  0.73  molprobity  1.000  
153  153  m-85      -98.2   146.4  Favored     ?     9   50.890    13  0.36    18  0.44  molprobity  1.000  
154  154  t         -76.0   131.8  Favored     ?     9   43.260     7  0.34    10  0.81  molprobity  1.000  
155  155  mmm      -110.3   140.1  Favored     ?     9   45.360     8  0.44    10  0.59  molprobity  1.000  
156  156  ?        -143.3   165.8  Favored     ?     3   38.680     4  0.52     5  1.12  molprobity  1.000  
157  157  m95      -128.3   133.6  Favored     ?    10   44.910    16  0.62    23  0.50  molprobity  1.000  
158  158  m-85     -122.6   164.3  Favored     ?     9   44.600    12  0.75    16  0.51  molprobity  1.000  
159  159  ptt180   -140.7   146.0  Favored     ?    13   44.690    11  0.40    14  0.58  molprobity  1.000  
160  160  tt0      -130.6   117.3  Favored     ?     8   51.790     9  0.41    12  0.74  molprobity  1.000  
161  161  ?         -94.7   130.7  Favored     ?     5   57.130     5  0.44     8  0.79  molprobity  1.000  
162  162  Cg_exo    -41.5   130.1  Favored     ?     7   66.800     8  0.44    11  0.29  molprobity  1.000  
163  163  ?          95.8   -15.2  Favored     ?     3   54.480     4  0.37     5  0.21  molprobity  1.000  
164  164  mttm     -125.2   162.9  Favored     ?    13   58.160     9  0.44    11  0.53  molprobity  1.000  
165  165  mt-10     -83.5   152.6  Favored     ?     6   50.110     9  0.44    12  0.50  molprobity  1.000  
166  166  ttp180    -57.9   130.6  Favored     ?    13   53.220    11  0.39    14  0.44  molprobity  1.000  
167  167  pt-20    -129.8   143.9  Favored     ?     6   51.310     9  0.44    12  0.49  molprobity  1.000  
168  168  t80       -57.0   142.5  Favored     ?     9   38.050    12  0.60    16  0.35  molprobity  1.000  
169  169  t        -117.1   -62.1  Favored     ?     9   41.890     7  0.31    10  0.30  molprobity  1.000  
170  170  ?        -159.0   154.1  Favored     ?     5   39.270     5  0.40     7  0.38  molprobity  1.000  
171  171  ?        -148.0   154.3  Favored     ?     5   40.790     5  0.58     7  0.65  molprobity  1.000  
172  172  tt       -141.6   132.0  Favored     ?    11   45.200     8  0.54    11  1.01  molprobity  1.000  
173  173  m         -69.0   161.8  Favored     ?     7   50.300     7  0.58    10  0.73  molprobity  1.000  
174  174  p90       -56.8   -26.9  Favored     ?    10   49.180    16  0.42    23  0.23  molprobity  1.000  
175  175  ?        -100.5    12.0  Favored     ?     3   63.000     4  0.39     5  0.32  molprobity  1.000  
176  176  ?          85.7    10.2  Favored     ?     3   61.210     4  0.33     5  0.91  molprobity  1.000  
177  177  m         -79.7   118.4  Favored     ?     7   55.770     7  0.18    11  0.68  molprobity  1.000  
178  178  Cg_endo   -96.4   155.9  Allowed     ?     7   53.460     8  0.36    11  0.38  molprobity  1.000  
179  179  p30      -147.9   150.6  Favored     ?     6   46.730     8  0.34    11  0.53  molprobity  1.000  
180  180  m-85     -130.7   146.8  Favored     ?     9   49.950    13  0.64    18  0.53  molprobity  1.000  
181  181  ?         -56.4   158.1  Favored     ?     5   52.040     5  0.43     7  0.27  molprobity  1.000  
182  182  m-20      -60.7   -38.1  Favored     ?     4   68.350     8  0.29    11  0.46  molprobity  1.000  
183  183  p         -84.6    -4.1  Favored     ?     5   61.460     6  0.31     8  0.57  molprobity  1.000  
184  184  m        -116.4    -9.5  Favored     ?     9   56.680     7  0.22    10  0.43  molprobity  1.000  
185  185  tptt      -53.5   124.2  Favored     ?    13   77.040     9  0.39    11  0.64  molprobity  1.000  
186  186  ?          90.8   -25.8  Favored     ?     3   78.140     4  0.33     5  0.22  molprobity  1.000  
187  187  mtm105    -96.4   -33.0  Favored     ?    13   67.150    11  0.26    14  0.51  molprobity  1.000  
188  188  m-30     -107.9   153.4  Favored     ?     9   52.740    12  0.50    16  0.72  molprobity  1.000  
189  189  m        -138.4   119.9  Favored     ?     7   60.460     7  0.29    10  0.37  molprobity  1.000  
190  190  tt        -97.0   151.0  Favored     ?    11   54.050     8  0.28    11  0.56  molprobity  1.000  
191  191  p        -158.7   164.7  Favored     ?     5   57.650     6  0.34     8  0.42  molprobity  1.000  
192  192  ptm180   -138.2   143.9  Favored     ?    13   60.810    11  0.39    14  0.78  molprobity  1.000  
193  193  t0       -113.2    98.3  Favored     ?     4   87.680     8  0.42    11  0.60  molprobity  1.000  
194  194  m-20      -68.5   -22.9  Favored     ?     6   86.620     8  0.33    11  0.40  molprobity  1.000  
195  195  p         -81.8   -16.2  Favored     ?     5  100.670     6  0.38     8  0.36  molprobity  1.000  
196  196  mttp     -115.6     2.5  Favored     ?    13   99.390     9  0.36    11  0.46  molprobity  1.000  
197  197  m-20       55.6    44.7  Favored     ?     6   78.920     8  0.40    11  0.58  molprobity  1.000  
198  198  m        -135.3   140.9  Favored     ?     7   72.700     7  0.36    10  0.50  molprobity  1.000  
199  199  pt20     -128.2   154.3  Favored     ?     8   54.940     9  0.46    12  0.65  molprobity  1.000  
200  200  m-85     -128.1   140.9  Favored     ?     9   72.980    13  0.52    18  0.45  molprobity  1.000  
201  201  tp       -119.9   103.1  Favored     ?    11   55.320     8  0.29    11  0.54  molprobity  1.000  
202  202  tp60      -80.7   119.5  Favored     ?     8   70.310     9  0.31    12  0.63  molprobity  1.000  
203  203  mtm      -112.2   111.6  Favored     ?     9   66.190     8  0.55    10  0.60  molprobity  1.000  
204  204  m-20     -110.6   167.1  Favored     ?     6   78.250     8  0.32    11  0.40  molprobity  1.000  
205  205  m          47.0    48.1  Favored     ?     5   78.040     6  0.49     8  0.37  molprobity  1.000  
206  206  mt        -67.0   142.9  Favored     ?    11   74.330     8  0.31    11  0.55  molprobity  1.000  
207  207  mtmt     -123.4   161.0  Favored     ?    13   78.250     9  0.30    12  0.36  molprobity  1.000  
208  208  Cg_exo    -57.7   -26.6  Favored     ?     7   75.390     8  0.15    11  0.39  molprobity  1.000  
209  209  mp0       -66.0   -21.4  Favored     ?     6   76.420     9  0.40    12  0.44  molprobity  1.000  
210  210  m-20      -82.7    -2.3  Favored     ?     4   55.830     8  0.22    11  0.40  molprobity  1.000  
211  211  m         -70.6   122.1  Favored     ?     7   51.310     7  0.40    10  0.53  molprobity  1.000  
212  212  ?        -175.7   163.7  Favored     ?     5   48.420     5  0.50     7  0.38  molprobity  1.000  
213  213  t         -78.1   131.2  Favored     ?     9   46.210     7  0.21    10  0.94  molprobity  1.000  
214  214  m-85     -107.8   134.5  Favored     ?     9   45.800    13  0.44    18  0.44  molprobity  1.000  
215  215  m-85     -120.4   132.3  Favored     ?     9   44.320    13  0.38    18  0.80  molprobity  1.000  
216  216  p         -89.8   154.7  Favored     ?     4   52.940     6  0.76     8  1.21  molprobity  1.000  
217  217  ?        -147.5   153.7  Favored     ?     5   43.190     5  0.58     7  0.72  molprobity  1.000  
218  218  ?        -129.6   139.1  Favored     ?     5   46.670     5  0.46     7  0.72  molprobity  1.000  
219  219  ?        -153.0   160.8  Favored     ?     3   44.490     4  0.69     5  0.80  molprobity  1.000  
220  220  mt       -119.1     2.5  Favored     ?    11   45.960     8  0.36    11  0.54  molprobity  1.000  
221  221  ?         -76.8   168.5  Favored     ?     3   47.590     4  0.88     5  0.71  molprobity  1.000  
222  222  t-105     -66.8   -72.5  Allowed     ?    10   40.320    16  0.53    23  0.49  molprobity  1.000  
223  223  t0        -84.0   114.9  Favored     ?     4   40.770     8  0.55    11  0.80  molprobity  1.000  
224  224  m         -47.2   -29.5  Favored     ?     5   44.040     6  0.55     8  1.03  molprobity  1.000  
225  225  mtm180    -79.0    -1.0  Favored     ?    13   42.570    11  0.40    14  0.67  molprobity  1.000  
226  226  m-85     -123.8   125.3  Favored     ?     9   47.580    13  0.60    18  0.68  molprobity  1.000  
227  227  OUTLIER   -44.9   -45.2  Favored     ?     5   41.320     6  0.89     8  1.17  molprobity  1.000  
228  228  pm0       -71.0    -8.7  Favored     ?     8   37.740     9  0.51    12  0.66  molprobity  1.000  
229  229  m         -77.1    -0.8  Favored     ?     5   37.570     6  0.45     8  0.40  molprobity  1.000  
230  230  m-85     -118.4   136.0  Favored     ?     9   39.610    13  0.39    18  0.35  molprobity  1.000  
231  231  OUTLIER  -108.6   -12.7  Favored     ?     6   59.430     8  0.29    11  0.62  molprobity  1.000  
232  232  m-85     -128.2   135.3  Favored     ?     9   53.910    13  0.38    18  0.45  molprobity  1.000  
233  233  m95      -131.2   140.0  Favored     ?    10   48.270    16  0.49    23  0.36  molprobity  1.000  
234  234  ?         -83.1   169.9  Favored     ?     3   56.600     4  0.42     5  0.88  molprobity  1.000  
235  235  mm-40     -73.9   -26.2  Favored     1     8   77.190     9  0.29    12  0.41  molprobity  1.000  
236  236  ?          94.1   145.9  Favored     ?     3   58.480     4  0.46     5  0.52  molprobity  1.000  
237  237  t        -132.4   138.7  Favored     ?     7   61.880     7  0.39    10  0.48  molprobity  1.000  
238  238  tp60      -72.7   127.1  Favored     ?     8   58.210     9  0.32    12  0.47  molprobity  1.000  
239  239  t        -117.0   114.8  Favored     ?     9   53.130     7  0.28    10  0.48  molprobity  1.000  
240  240  m        -111.4   132.1  Favored     ?     7   62.200     7  0.36    10  0.63  molprobity  1.000  
241  241  t        -124.2   125.6  Favored     ?     9   66.520     7  0.20    10  0.62  molprobity  1.000  
242  242  p        -106.2   147.7  Favored     ?     5   93.440     6  0.22     8  0.32  molprobity  1.000  
243  243  m             ?       ?  ?           ?     5  105.100     5  0.30     5  0.28  molprobity  1.000  
244  244  ?             ?       ?  ?           ?     ?   43.590     ?     ?     ?     ?  ?           1.000  
245  245  ?             ?       ?  ?           ?     ?   44.850     ?     ?     ?     ?  ?           1.000  
246  246  ?             ?       ?  ?           ?     ?   45.060     ?     ?     ?     ?  ?           1.000  
247  247  ?             ?       ?  ?           ?     ?   43.430     ?     ?     ?     ?  ?           1.000  
248  248  ?             ?       ?  ?           ?     ?   38.660     ?     ?     ?     ?  ?           1.000  
249  249  ?             ?       ?  ?           ?     ?   35.760     ?     ?     ?     ?  ?           1.000  
250  250  ?             ?       ?  ?           ?     ?   46.730     ?     ?     ?     ?  ?           1.000  
251  251  ?             ?       ?  ?           ?     ?   57.990     ?     ?     ?     ?  ?           1.000  
252  252  ?             ?       ?  ?           ?     ?   52.330     ?     ?     ?     ?  ?           1.000  
253  253  ?             ?       ?  ?           ?     ?   40.550     ?     ?     ?     ?  ?           1.000  
254  254  ?             ?       ?  ?           ?     ?   55.330     ?     ?     ?     ?  ?           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   27  HE3    1  0.66  2.29  
 2   27  HE3    2  0.45  2.52  
 3   27  CE     3  0.48  2.96  
 4   27  CE     4  0.43  3.02  
 5   29  CE1    1  0.66  2.29  
 6   29  CE1    3  0.48  2.96  
 7   29  CZ     2  0.45  2.52  
 8   29  CZ     4  0.43  3.02  
 9   35  OE2    5  0.85  1.77  
10   35  CD     6  0.41  2.39  
11   35  O      7  0.41  2.20  
12   36  HB2    7  0.41  2.20  
13   37  HD2    8  0.50  2.47  
14   47  CE     9  0.40  2.51  
15   49  HD11   9  0.40  2.51  
16   51  HA    10  0.43  2.19  
17   58  HB2   11  0.51  1.91  
18   59  O     10  0.43  2.19  
19   71  HE1   12  0.42  1.84  
20   71  CE1   13  0.41  2.55  
21   85  OD1   14  0.68  2.25  
22   86  N     14  0.68  2.25  
23   92  HG23  15  0.40  1.86  
24   94  H     15  0.40  1.86  
25   97  HB3   11  0.51  1.91  
26  115  OG1   16  0.65  1.96  
27  117  HG2   16  0.65  1.96  
28  143  HB3   17  0.41  2.02  
29  154  HG23  12  0.42  1.84  
30  154  HG23  13  0.41  2.55  
31  173  HG22  18  0.95  1.26  
32  173  HG22  19  0.63  2.08  
33  173  HG21   5  0.85  1.77  
34  173  HG21   6  0.41  2.39  
35  173  CG2   20  0.47  2.77  
36  174  CE2    8  0.50  2.47  
37  174  N     20  0.47  2.77  
38  175  H     18  0.95  1.26  
39  175  N     19  0.63  2.08  
40  199  NE2   21  0.49  2.28  
41  199  HE21  22  0.42  1.85  
42  199  HG3   17  0.41  2.02  
43  216  HB2   21  0.49  2.28  
44  216  HB2   22  0.42  1.85  
45  219  HA3   23  0.43  2.01  
46  230  HA    23  0.43  2.01  
#
loop_
_pdbx_vrpt_instance_symm_clashes.ordinal
_pdbx_vrpt_instance_symm_clashes.instance_id
_pdbx_vrpt_instance_symm_clashes.label_atom_id
_pdbx_vrpt_instance_symm_clashes.scid
_pdbx_vrpt_instance_symm_clashes.symop
_pdbx_vrpt_instance_symm_clashes.clashmag
_pdbx_vrpt_instance_symm_clashes.dist
1  122  N    0  1_555  0.03  2.17  
2  235  OE1  0  6_555  0.03  2.17  
#
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  10  0.792  0.208   0.780  
  2    2  10  0.892  0.175   0.284  
  3    3  10  0.912  0.143  -0.197  
  4    4   9  0.965  0.166  -0.403  
  5    5   4  0.955  0.138  -0.107  
  6    6   8  0.963  0.169   0.052  
  7    7   8  0.920  0.127  -0.435  
  8    8  11  0.910  0.129  -0.721  
  9    9   7  0.962  0.088  -1.039  
 10   10   4  0.965  0.092  -0.784  
 11   11   8  0.965  0.169   0.018  
 12   12   8  0.955  0.164  -0.032  
 13   13   6  0.957  0.130  -0.318  
 14   14  11  0.941  0.147  -0.188  
 15   15   9  0.845  0.232   0.538  
 16   16   8  0.935  0.158  -0.029  
 17   17   8  0.955  0.142  -0.264  
 18   18   8  0.973  0.104  -0.822  
 19   19  12  0.959  0.109  -0.770  
 20   20  12  0.946  0.121  -0.559  
 21   21  11  0.976  0.102  -0.941  
 22   22   8  0.935  0.088  -1.057  
 23   23   9  0.911  0.196   0.091  
 24   24   8  0.958  0.136  -0.352  
 25   25   4  0.985  0.103  -0.622  
 26   26   9  0.957  0.110  -0.978  
 27   27   8  0.969  0.107  -0.761  
 28   28   9  0.955  0.114  -0.844  
 29   29  11  0.974  0.101  -0.958  
 30   30   4  0.975  0.102  -0.637  
 31   31  12  0.974  0.117  -0.629  
 32   32   8  0.980  0.101  -1.085  
 33   33   8  0.970  0.108  -0.764  
 34   34   8  0.978  0.118  -0.801  
 35   35   9  0.936  0.127  -0.766  
 36   36   8  0.899  0.161  -0.024  
 37   37   9  0.959  0.111  -1.084  
 38   38   8  0.965  0.137  -0.271  
 39   39  11  0.934  0.104  -0.908  
 40   40  12  0.952  0.084  -1.209  
 41   41  11  0.958  0.097  -1.025  
 42   42   4  0.986  0.070  -1.107  
 43   43   9  0.942  0.187  -0.021  
 44   44   8  0.949  0.096  -0.939  
 45   45   4  0.936  0.074  -1.049  
 46   46   7  0.948  0.128  -0.534  
 47   47   8  0.969  0.105  -0.794  
 48   48   9  0.949  0.133  -0.585  
 49   49   8  0.930  0.167   0.018  
 50   50   4  0.972  0.102  -0.637  
 51   51   7  0.968  0.105  -0.920  
 52   52  11  0.966  0.100  -0.975  
 53   53   8  0.948  0.117  -0.631  
 54   54   7  0.973  0.098  -0.877  
 55   55   7  0.976  0.118  -0.469  
 56   56   8  0.938  0.135  -0.390  
 57   57   4  0.927  0.186   0.599  
 58   58  11  0.968  0.142  -0.271  
 59   59   9  0.962  0.144  -0.675  
 60   60  12  0.965  0.097  -0.981  
 61   61  11  0.955  0.130  -0.472  
 62   62   5  0.987  0.119  -0.481  
 63   63  10  0.969  0.117  -0.588  
 64   64   9  0.948  0.116  -0.816  
 65   65   8  0.955  0.116  -0.646  
 66   66   7  0.952  0.121  -0.503  
 67   67   8  0.963  0.165  -0.047  
 68   68   8  0.901  0.166   0.046  
 69   69   9  0.961  0.185  -0.046  
 70   70   8  0.952  0.136  -0.352  
 71   71  11  0.964  0.128  -0.506  
 72   72   9  0.938  0.152  -0.456  
 73   73   4  0.937  0.094  -0.754  
 74   74   9  0.957  0.117  -0.891  
 75   75   6  0.979  0.115  -0.551  
 76   76   8  0.974  0.134  -0.533  
 77   77   8  0.972  0.098  -0.910  
 78   78  12  0.956  0.096  -0.998  
 79   79   7  0.969  0.086  -1.071  
 80   80   4  0.969  0.072  -1.078  
 81   81  14  0.951  0.131  -0.326  
 82   82   8  0.969  0.106  -1.010  
 83   83   8  0.924  0.123  -0.559  
 84   84   8  0.970  0.132  -0.586  
 85   85   8  0.925  0.254   1.286  
 86   86   9  0.923  0.290   1.258  
 87   87   9  0.947  0.135  -0.787  
 88   88  11  0.933  0.141  -0.562  
 89   89  12  0.975  0.067  -1.508  
 90   90  12  0.963  0.099  -0.946  
 91   91  11  0.971  0.094  -1.075  
 92   92   7  0.903  0.159   0.114  
 93   93   8  0.894  0.150  -0.179  
 94   94   9  0.944  0.217   0.352  
 95   95  12  0.949  0.092  -1.069  
 96   96   8  0.971  0.143  -0.383  
 97   97   5  0.947  0.132  -0.271  
 98   98   5  0.979  0.088  -0.984  
 99   99   7  0.972  0.117  -0.568  
100  100   4  0.971  0.078  -0.990  
101  101   6  0.967  0.095  -0.862  
102  102   7  0.966  0.158  -0.032  
103  103   8  0.980  0.140  -0.433  
104  104   8  0.948  0.164  -0.032  
105  105   8  0.927  0.138  -0.348  
106  106   4  0.966  0.109  -0.534  
107  107   9  0.903  0.205   0.202  
108  108   9  0.955  0.088  -1.251  
109  109  12  0.954  0.122  -0.541  
110  110  12  0.981  0.099  -0.946  
111  111  11  0.971  0.113  -0.757  
112  112   8  0.979  0.128  -0.489  
113  113   7  0.974  0.127  -0.328  
114  114   8  0.932  0.129  -0.475  
115  115   7  0.969  0.112  -0.649  
116  116   5  0.983  0.076  -1.178  
117  117   9  0.955  0.114  -0.844  
118  118   8  0.983  0.094  -1.206  
119  119   7  0.978  0.103  -0.953  
120  120   8  0.961  0.180   0.236  
121  121   6  0.901  0.146  -0.070  
122  122   9  0.788  0.289   1.537  
123  123   7  0.889  0.236   1.275  
124  124   9  0.923  0.249   0.993  
125  125   8  0.923  0.158  -0.162  
126  126   7  0.962  0.154  -0.099  
127  127   9  0.939  0.115  -0.916  
128  128   6  0.976  0.129  -0.334  
129  129   4  0.970  0.082  -0.931  
130  130   4  0.963  0.112  -0.490  
131  131   4  0.968  0.134  -0.166  
132  132   8  0.955  0.230   1.013  
133  133   7  0.961  0.143  -0.283  
134  134   9  0.951  0.247   0.966  
135  135   5  0.991  0.110  -0.627  
136  136   4  0.962  0.085  -0.887  
137  137   4  0.942  0.091  -0.799  
138  138   6  0.952  0.146  -0.070  
139  139   8  0.968  0.163  -0.080  
140  140  11  0.905  0.184   0.008  
141  141   8  0.970  0.151  -0.276  
142  142   6  0.950  0.122  -0.443  
143  143   6  0.926  0.074  -1.154  
144  144   5  0.971  0.101  -0.773  
145  145   5  0.975  0.104  -0.724  
146  146   6  0.927  0.158   0.116  
147  147   4  0.898  0.117  -0.416  
148  148   8  0.969  0.105  -1.026  
149  149   7  0.972  0.140  -0.195  
150  150  11  0.967  0.131  -0.456  
151  151   6  0.961  0.159   0.132  
152  152  11  0.898  0.191   0.101  
153  153  12  0.976  0.157   0.074  
154  154   7  0.972  0.152  -0.132  
155  155   8  0.981  0.113  -0.663  
156  156   4  0.972  0.075  -1.034  
157  157  14  0.971  0.117  -0.588  
158  158  11  0.967  0.130  -0.472  
159  159  11  0.951  0.134  -0.655  
160  160   9  0.964  0.118  -0.789  
161  161   5  0.913  0.132  -0.271  
162  162   7  0.896  0.163   0.234  
163  163   4  0.975  0.086  -0.872  
164  164   9  0.949  0.173  -0.316  
165  165   9  0.940  0.122  -0.829  
166  166  11  0.958  0.155  -0.377  
167  167   9  0.961  0.151  -0.468  
168  168  11  0.968  0.110  -0.807  
169  169   7  0.972  0.163   0.052  
170  170   5  0.977  0.125  -0.384  
171  171   5  0.983  0.117  -0.514  
172  172   8  0.966  0.148  -0.299  
173  173   7  0.958  0.129  -0.373  
174  174  14  0.969  0.121  -0.513  
175  175   4  0.978  0.095  -0.740  
176  176   4  0.973  0.085  -0.887  
177  177   7  0.974  0.103  -0.795  
178  178   7  0.974  0.115  -0.516  
179  179   8  0.975  0.103  -0.837  
180  180  12  0.974  0.081  -1.262  
181  181   5  0.978  0.117  -0.514  
182  182   8  0.946  0.099  -0.897  
183  183   6  0.956  0.105  -0.707  
184  184   7  0.976  0.125  -0.585  
185  185   9  0.961  0.169  -0.366  
186  186   4  0.938  0.133  -0.181  
187  187  11  0.959  0.164  -0.257  
188  188  11  0.967  0.075  -1.394  
189  189   7  0.955  0.095  -0.925  
190  190   8  0.956  0.101  -1.085  
191  191   6  0.949  0.098  -0.815  
192  192  11  0.909  0.103  -1.066  
193  193   8  0.941  0.119  -0.615  
194  194   8  0.917  0.131  -0.426  
195  195   6  0.877  0.141  -0.148  
196  196   9  0.953  0.169  -0.366  
197  197   8  0.952  0.116  -0.646  
198  198   7  0.958  0.146  -0.097  
199  199   9  0.942  0.104  -0.980  
200  200  12  0.916  0.159   0.109  
201  201   8  0.949  0.104  -1.042  
202  202   9  0.942  0.147  -0.395  
203  203   8  0.920  0.144  -0.157  
204  204   8  0.955  0.130  -0.441  
205  205   6  0.970  0.115  -0.551  
206  206   8  0.979  0.141  -0.439  
207  207   9  0.959  0.144  -0.675  
208  208   7  0.978  0.184   0.562  
209  209   9  0.904  0.180  -0.108  
210  210   8  0.956  0.084  -1.108  
211  211   7  0.973  0.118  -0.552  
212  212   5  0.979  0.127  -0.352  
213  213   7  0.969  0.131  -0.484  
214  214  12  0.972  0.094  -1.033  
215  215  12  0.961  0.142  -0.190  
216  216   6  0.896  0.120  -0.244  
217  217   5  0.985  0.125  -0.384  
218  218   5  0.973  0.162   0.216  
219  219   4  0.979  0.171   0.378  
220  220   8  0.962  0.155  -0.210  
221  221   4  0.911  0.178   0.481  
222  222  14  0.968  0.139  -0.176  
223  223   8  0.941  0.154  -0.123  
224  224   6  0.936  0.150  -0.008  
225  225  11  0.957  0.148  -0.469  
226  226  12  0.966  0.144  -0.155  
227  227   6  0.954  0.163   0.194  
228  228   9  0.960  0.160  -0.218  
229  229   6  0.964  0.133  -0.272  
230  230  12  0.956  0.144  -0.155  
231  231   8  0.923  0.181   0.308  
232  232  12  0.969  0.143  -0.172  
233  233  14  0.968  0.152   0.067  
234  234   4  0.953  0.126  -0.284  
235  235   9  0.919  0.162  -0.190  
236  236   4  0.900  0.127  -0.269  
237  237   7  0.963  0.162   0.162  
238  238   9  0.966  0.140  -0.490  
239  239   7  0.975  0.107  -0.886  
240  240   7  0.979  0.172   0.325  
241  241   7  0.964  0.116  -0.735  
242  242   6  0.931  0.159   0.132  
243  243   6  0.934  0.277   1.964  
244  244   1  0.864  0.145       ?  
245  245   1  0.989  0.148       ?  
246  246   1  0.977  0.273       ?  
247  247   1  0.935  0.415       ?  
248  248   1  0.901  0.121       ?  
249  249   1  0.931  0.219       ?  
250  250   1  0.955  0.231       ?  
251  251   1  0.908  0.694       ?  
252  252   1  0.860  0.184       ?  
253  253   1  0.925  0.162       ?  
254  254   1  0.712  0.366       ?  
#
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          2.35.1                                                                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  
##
