data_2LVH

loop_
_pdbx_vrpt_database.id
_pdbx_vrpt_database.code
PDB   2LVH   
BMRB  18570  
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   nmr
#
_pdbx_vrpt_summary.entry_id                    2LVH
_pdbx_vrpt_summary.PDB_deposition_date         2012-07-05
_pdbx_vrpt_summary.PDB_revision_number         2
_pdbx_vrpt_summary.PDB_revision_date           2023-06-14
_pdbx_vrpt_summary.report_creation_date        2023-06-05:08:38
_pdbx_vrpt_summary.attempted_validation_steps  mogul,molprobity,validation-pack,coreclust,chemicalshiftanalysis,restraintsanalysis,percentiles,writepdf,writexml,writecif
_pdbx_vrpt_summary.ligands_for_buster_report   N
#
loop_
_pdbx_vrpt_entity.id
_pdbx_vrpt_entity.type
_pdbx_vrpt_entity.description
1  polymer      "Putative zinc finger protein ORF59a"  
2  non-polymer  "ZINC ION"  
#
loop_
_pdbx_vrpt_asym.label_asym_id
_pdbx_vrpt_asym.entity_id
A  1  
B  2  
#
loop_
_pdbx_vrpt_percentile_list.id
_pdbx_vrpt_percentile_list.range
_pdbx_vrpt_percentile_list.exp_method
1  all  pdb    
2  nmr  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      
#
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   21.23  158937  ?     ?     
2  2  1   46.42   12864  ?     ?     
3  1  2  100.00  154571  ?     ?     
4  2  2  100.00   11451  ?     ?     
5  1  3   19.04  154315  ?     ?     
6  2  3   67.50   11428  ?     ?     
#
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    9.03  
 4  6  3  A   1  1  A    9.03  
 5  3  2  A   2  1  A  100.00  
 6  4  2  A   2  1  A  100.00  
 7  5  3  A   2  1  A    9.03  
 8  6  3  A   2  1  A    9.03  
 9  3  2  A   3  1  A  100.00  
10  4  2  A   3  1  A  100.00  
11  5  3  A   3  1  A   15.53  
12  6  3  A   3  1  A   15.53  
13  3  2  A   4  1  A  100.00  
14  4  2  A   4  1  A  100.00  
15  5  3  A   4  1  A    9.03  
16  6  3  A   4  1  A    9.03  
17  3  2  A   5  1  A  100.00  
18  4  2  A   5  1  A  100.00  
19  5  3  A   5  1  A   15.53  
20  6  3  A   5  1  A   15.53  
21  3  2  A   6  1  A  100.00  
22  4  2  A   6  1  A  100.00  
23  5  3  A   6  1  A   15.53  
24  6  3  A   6  1  A   15.53  
25  3  2  A   7  1  A  100.00  
26  4  2  A   7  1  A  100.00  
27  5  3  A   7  1  A  100.00  
28  6  3  A   7  1  A  100.00  
29  3  2  A   8  1  A  100.00  
30  4  2  A   8  1  A  100.00  
31  5  3  A   8  1  A    9.03  
32  6  3  A   8  1  A    9.03  
33  3  2  A   9  1  A  100.00  
34  4  2  A   9  1  A  100.00  
35  5  3  A   9  1  A   50.02  
36  6  3  A   9  1  A   50.02  
37  3  2  A  10  1  A  100.00  
38  4  2  A  10  1  A  100.00  
39  5  3  A  10  1  A   27.36  
40  6  3  A  10  1  A   27.36  
#
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  0.41  0.34  386  519  
 2   2  1  A  A  0.42  0.32  386  519  
 3   3  1  A  A  0.43  0.33  386  519  
 4   4  1  A  A  0.42  0.33  386  519  
 5   5  1  A  A  0.43  0.32  386  519  
 6   6  1  A  A  0.42  0.34  386  519  
 7   7  1  A  A  0.40  0.33  386  519  
 8   8  1  A  A  0.42  0.34  386  519  
 9   9  1  A  A  0.41  0.33  386  519  
10  10  1  A  A  0.42  0.33  386  519  
#
_pdbx_vrpt_summary_geometry.ordinal                                    1
_pdbx_vrpt_summary_geometry.percent_ramachandran_outliers_full_length  0.00
_pdbx_vrpt_summary_geometry.percent_rotamer_outliers                   6.94
_pdbx_vrpt_summary_geometry.percent_rotamer_outliers_full_length       6.36
_pdbx_vrpt_summary_geometry.clashscore                                 13.10
_pdbx_vrpt_summary_geometry.clashscore_full_length                     12.17
_pdbx_vrpt_summary_geometry.num_H_reduce                               3840
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ                             3860
_pdbx_vrpt_summary_geometry.bonds_RMSZ                                 0.33
_pdbx_vrpt_summary_geometry.num_angles_RMSZ                            5190
_pdbx_vrpt_summary_geometry.angles_RMSZ                                0.42
#
_pdbx_vrpt_summary_nmr.exp_method                               nmr
_pdbx_vrpt_summary_nmr.ordinal                                  1
_pdbx_vrpt_summary_nmr.nmr_models_consistency_flag              True
_pdbx_vrpt_summary_nmr.nmrclust_representative_model            6
_pdbx_vrpt_summary_nmr.medoid_model                             9
_pdbx_vrpt_summary_nmr.nmrclust_number_of_outliers              2
_pdbx_vrpt_summary_nmr.nmrclust_number_of_models                10
_pdbx_vrpt_summary_nmr.nmrclust_number_of_clusters              2
_pdbx_vrpt_summary_nmr.cyrange_number_of_domains                1
_pdbx_vrpt_summary_nmr.chemical_shift_completeness              85.89
_pdbx_vrpt_summary_nmr.chemical_shift_completeness_full_length  85.16
#
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   7  MET  A    7  .  ?        ?  
  2   1  1  A   8  GLU  A    8  .  ?        ?  
  3   1  1  A   9  ARG  A    9  .  ?        1  
  4   1  1  A  10  VAL  A   10  .  ?        1  
  5   1  1  A  11  TYR  A   11  .  ?        ?  
  6   1  1  A  12  GLN  A   12  .  ?        2  
  7   1  1  A  13  CYS  A   13  .  ?        ?  
  8   1  1  A  14  LEU  A   14  .  ?        ?  
  9   1  1  A  15  ARG  A   15  .  ?        ?  
 10   1  1  A  16  CYS  A   16  .  ?        1  
 11   1  1  A  17  GLY  A   17  .  ?        ?  
 12   1  1  A  18  LEU  A   18  .  ?        2  
 13   1  1  A  19  THR  A   19  .  ?        1  
 14   1  1  A  20  PHE  A   20  .  ?        ?  
 15   1  1  A  21  ARG  A   21  .  ?        1  
 16   1  1  A  22  THR  A   22  .  ?        ?  
 17   1  1  A  23  LYS  A   23  .  ?        ?  
 18   1  1  A  24  LYS  A   24  .  ?        ?  
 19   1  1  A  25  GLN  A   25  .  ?        ?  
 20   1  1  A  26  LEU  A   26  .  ?        ?  
 21   1  1  A  27  ILE  A   27  .  ?        ?  
 22   1  1  A  28  ARG  A   28  .  ?        ?  
 23   1  1  A  29  HIS  A   29  .  ?        ?  
 24   1  1  A  30  LEU  A   30  .  ?        3  
 25   1  1  A  31  VAL  A   31  .  ?        ?  
 26   1  1  A  32  ASN  A   32  .  ?        ?  
 27   1  1  A  33  THR  A   33  .  ?        1  
 28   1  1  A  34  GLU  A   34  .  ?        3  
 29   1  1  A  35  LYS  A   35  .  ?        ?  
 30   1  1  A  36  VAL  A   36  .  ?        ?  
 31   1  1  A  37  ASN  A   37  .  ?        ?  
 32   1  1  A  38  PRO  A   38  .  ?        1  
 33   1  1  A  39  LEU  A   39  .  ?        ?  
 34   1  1  A  40  SER  A   40  .  ?        ?  
 35   1  1  A  41  ILE  A   41  .  ?        1  
 36   1  1  A  42  ASP  A   42  .  ?        ?  
 37   1  1  A  43  TYR  A   43  .  ?        ?  
 38   1  1  A  44  TYR  A   44  .  ?        ?  
 39   1  1  A  45  TYR  A   45  .  ?        1  
 40   1  1  A  46  GLN  A   46  .  ?        ?  
 41   1  1  A  47  SER  A   47  .  ?        1  
 42   1  1  A  48  PHE  A   48  .  ?        ?  
 43   1  1  A  49  SER  A   49  .  ?        ?  
 44   1  1  A  50  VAL  A   50  .  ?        ?  
 45   1  1  A  51  SER  A   51  .  ?        ?  
 46   1  2  B   .  ZN   A  101  .  ?        ?  
 47   2  1  A   7  MET  A    7  .  ?        ?  
 48   2  1  A   8  GLU  A    8  .  ?        ?  
 49   2  1  A   9  ARG  A    9  .  ?        ?  
 50   2  1  A  10  VAL  A   10  .  ?        2  
 51   2  1  A  11  TYR  A   11  .  ?        1  
 52   2  1  A  12  GLN  A   12  .  ?        2  
 53   2  1  A  13  CYS  A   13  .  ?        ?  
 54   2  1  A  14  LEU  A   14  .  ?        ?  
 55   2  1  A  15  ARG  A   15  .  ?        ?  
 56   2  1  A  16  CYS  A   16  .  ?        1  
 57   2  1  A  17  GLY  A   17  .  ?        ?  
 58   2  1  A  18  LEU  A   18  .  ?        1  
 59   2  1  A  19  THR  A   19  .  ?        5  
 60   2  1  A  20  PHE  A   20  .  ?        ?  
 61   2  1  A  21  ARG  A   21  .  ?        ?  
 62   2  1  A  22  THR  A   22  .  ?        ?  
 63   2  1  A  23  LYS  A   23  .  ?        ?  
 64   2  1  A  24  LYS  A   24  .  ?        ?  
 65   2  1  A  25  GLN  A   25  .  ?        ?  
 66   2  1  A  26  LEU  A   26  .  ?        ?  
 67   2  1  A  27  ILE  A   27  .  ?        ?  
 68   2  1  A  28  ARG  A   28  .  ?        ?  
 69   2  1  A  29  HIS  A   29  .  ?        ?  
 70   2  1  A  30  LEU  A   30  .  ?        2  
 71   2  1  A  31  VAL  A   31  .  ?        ?  
 72   2  1  A  32  ASN  A   32  .  ?        ?  
 73   2  1  A  33  THR  A   33  .  ?        ?  
 74   2  1  A  34  GLU  A   34  .  ?        2  
 75   2  1  A  35  LYS  A   35  .  ?        ?  
 76   2  1  A  36  VAL  A   36  .  ?        ?  
 77   2  1  A  37  ASN  A   37  .  ?        ?  
 78   2  1  A  38  PRO  A   38  .  ?        1  
 79   2  1  A  39  LEU  A   39  .  ?        ?  
 80   2  1  A  40  SER  A   40  .  ?        ?  
 81   2  1  A  41  ILE  A   41  .  ?        1  
 82   2  1  A  42  ASP  A   42  .  ?        ?  
 83   2  1  A  43  TYR  A   43  .  ?        ?  
 84   2  1  A  44  TYR  A   44  .  ?        ?  
 85   2  1  A  45  TYR  A   45  .  ?        ?  
 86   2  1  A  46  GLN  A   46  .  ?        ?  
 87   2  1  A  47  SER  A   47  .  ?        ?  
 88   2  1  A  48  PHE  A   48  .  ?        ?  
 89   2  1  A  49  SER  A   49  .  ?        ?  
 90   2  1  A  50  VAL  A   50  .  ?        ?  
 91   2  1  A  51  SER  A   51  .  ?        ?  
 92   2  2  B   .  ZN   A  101  .  ?        ?  
 93   3  1  A   7  MET  A    7  .  ?        ?  
 94   3  1  A   8  GLU  A    8  .  ?        ?  
 95   3  1  A   9  ARG  A    9  .  ?        ?  
 96   3  1  A  10  VAL  A   10  .  ?        2  
 97   3  1  A  11  TYR  A   11  .  ?        ?  
 98   3  1  A  12  GLN  A   12  .  ?        1  
 99   3  1  A  13  CYS  A   13  .  ?        ?  
100   3  1  A  14  LEU  A   14  .  ?        ?  
101   3  1  A  15  ARG  A   15  .  ?        2  
102   3  1  A  16  CYS  A   16  .  ?        2  
103   3  1  A  17  GLY  A   17  .  ?        ?  
104   3  1  A  18  LEU  A   18  .  ?        1  
105   3  1  A  19  THR  A   19  .  ?        1  
106   3  1  A  20  PHE  A   20  .  ?        ?  
107   3  1  A  21  ARG  A   21  .  ?        1  
108   3  1  A  22  THR  A   22  .  ?        ?  
109   3  1  A  23  LYS  A   23  .  ?        2  
110   3  1  A  24  LYS  A   24  .  ?        ?  
111   3  1  A  25  GLN  A   25  .  ?        ?  
112   3  1  A  26  LEU  A   26  .  ?        1  
113   3  1  A  27  ILE  A   27  .  ?        2  
114   3  1  A  28  ARG  A   28  .  ?        ?  
115   3  1  A  29  HIS  A   29  .  ?        ?  
116   3  1  A  30  LEU  A   30  .  ?        2  
117   3  1  A  31  VAL  A   31  .  ?        2  
118   3  1  A  32  ASN  A   32  .  ?        ?  
119   3  1  A  33  THR  A   33  .  ?        ?  
120   3  1  A  34  GLU  A   34  .  ?        3  
121   3  1  A  35  LYS  A   35  .  ?        1  
122   3  1  A  36  VAL  A   36  .  ?        ?  
123   3  1  A  37  ASN  A   37  .  ?        1  
124   3  1  A  38  PRO  A   38  .  ?        1  
125   3  1  A  39  LEU  A   39  .  ?        ?  
126   3  1  A  40  SER  A   40  .  ?        ?  
127   3  1  A  41  ILE  A   41  .  ?        ?  
128   3  1  A  42  ASP  A   42  .  ?        1  
129   3  1  A  43  TYR  A   43  .  ?        ?  
130   3  1  A  44  TYR  A   44  .  ?        ?  
131   3  1  A  45  TYR  A   45  .  ?        1  
132   3  1  A  46  GLN  A   46  .  ?        ?  
133   3  1  A  47  SER  A   47  .  ?        1  
134   3  1  A  48  PHE  A   48  .  ?        ?  
135   3  1  A  49  SER  A   49  .  ?        ?  
136   3  1  A  50  VAL  A   50  .  ?        ?  
137   3  1  A  51  SER  A   51  .  ?        ?  
138   3  2  B   .  ZN   A  101  .  ?        ?  
139   4  1  A   7  MET  A    7  .  ?        ?  
140   4  1  A   8  GLU  A    8  .  ?        ?  
141   4  1  A   9  ARG  A    9  .  ?        1  
142   4  1  A  10  VAL  A   10  .  ?        1  
143   4  1  A  11  TYR  A   11  .  ?        2  
144   4  1  A  12  GLN  A   12  .  ?        2  
145   4  1  A  13  CYS  A   13  .  ?        ?  
146   4  1  A  14  LEU  A   14  .  ?        ?  
147   4  1  A  15  ARG  A   15  .  ?        2  
148   4  1  A  16  CYS  A   16  .  ?        2  
149   4  1  A  17  GLY  A   17  .  ?        ?  
150   4  1  A  18  LEU  A   18  .  ?        2  
151   4  1  A  19  THR  A   19  .  ?        ?  
152   4  1  A  20  PHE  A   20  .  ?        ?  
153   4  1  A  21  ARG  A   21  .  ?        ?  
154   4  1  A  22  THR  A   22  .  ?        ?  
155   4  1  A  23  LYS  A   23  .  ?        ?  
156   4  1  A  24  LYS  A   24  .  ?        ?  
157   4  1  A  25  GLN  A   25  .  ?        ?  
158   4  1  A  26  LEU  A   26  .  ?        ?  
159   4  1  A  27  ILE  A   27  .  ?        ?  
160   4  1  A  28  ARG  A   28  .  ?        ?  
161   4  1  A  29  HIS  A   29  .  ?        ?  
162   4  1  A  30  LEU  A   30  .  ?        2  
163   4  1  A  31  VAL  A   31  .  ?        ?  
164   4  1  A  32  ASN  A   32  .  ?        ?  
165   4  1  A  33  THR  A   33  .  ?        ?  
166   4  1  A  34  GLU  A   34  .  ?        3  
167   4  1  A  35  LYS  A   35  .  ?        ?  
168   4  1  A  36  VAL  A   36  .  ?        ?  
169   4  1  A  37  ASN  A   37  .  ?        ?  
170   4  1  A  38  PRO  A   38  .  ?        ?  
171   4  1  A  39  LEU  A   39  .  ?        ?  
172   4  1  A  40  SER  A   40  .  ?        ?  
173   4  1  A  41  ILE  A   41  .  ?        ?  
174   4  1  A  42  ASP  A   42  .  ?        1  
175   4  1  A  43  TYR  A   43  .  ?        ?  
176   4  1  A  44  TYR  A   44  .  ?        ?  
177   4  1  A  45  TYR  A   45  .  ?        1  
178   4  1  A  46  GLN  A   46  .  ?        1  
179   4  1  A  47  SER  A   47  .  ?        3  
180   4  1  A  48  PHE  A   48  .  ?        ?  
181   4  1  A  49  SER  A   49  .  ?        1  
182   4  1  A  50  VAL  A   50  .  ?        ?  
183   4  1  A  51  SER  A   51  .  ?        ?  
184   4  2  B   .  ZN   A  101  .  ?        ?  
185   5  1  A   7  MET  A    7  .  ?        ?  
186   5  1  A   8  GLU  A    8  .  ?        ?  
187   5  1  A   9  ARG  A    9  .  ?        ?  
188   5  1  A  10  VAL  A   10  .  ?        ?  
189   5  1  A  11  TYR  A   11  .  ?        ?  
190   5  1  A  12  GLN  A   12  .  ?        2  
191   5  1  A  13  CYS  A   13  .  ?        ?  
192   5  1  A  14  LEU  A   14  .  ?        ?  
193   5  1  A  15  ARG  A   15  .  ?        2  
194   5  1  A  16  CYS  A   16  .  ?        2  
195   5  1  A  17  GLY  A   17  .  ?        ?  
196   5  1  A  18  LEU  A   18  .  ?        2  
197   5  1  A  19  THR  A   19  .  ?        1  
198   5  1  A  20  PHE  A   20  .  ?        ?  
199   5  1  A  21  ARG  A   21  .  ?        ?  
200   5  1  A  22  THR  A   22  .  ?        ?  
201   5  1  A  23  LYS  A   23  .  ?        ?  
202   5  1  A  24  LYS  A   24  .  ?        ?  
203   5  1  A  25  GLN  A   25  .  ?        ?  
204   5  1  A  26  LEU  A   26  .  ?        ?  
205   5  1  A  27  ILE  A   27  .  ?        ?  
206   5  1  A  28  ARG  A   28  .  ?        ?  
207   5  1  A  29  HIS  A   29  .  ?        ?  
208   5  1  A  30  LEU  A   30  .  ?        1  
209   5  1  A  31  VAL  A   31  .  ?        ?  
210   5  1  A  32  ASN  A   32  .  ?        ?  
211   5  1  A  33  THR  A   33  .  ?        ?  
212   5  1  A  34  GLU  A   34  .  ?        3  
213   5  1  A  35  LYS  A   35  .  ?        1  
214   5  1  A  36  VAL  A   36  .  ?        ?  
215   5  1  A  37  ASN  A   37  .  ?        ?  
216   5  1  A  38  PRO  A   38  .  ?        ?  
217   5  1  A  39  LEU  A   39  .  ?        ?  
218   5  1  A  40  SER  A   40  .  ?        ?  
219   5  1  A  41  ILE  A   41  .  ?        ?  
220   5  1  A  42  ASP  A   42  .  ?        1  
221   5  1  A  43  TYR  A   43  .  ?        ?  
222   5  1  A  44  TYR  A   44  .  ?        ?  
223   5  1  A  45  TYR  A   45  .  ?        1  
224   5  1  A  46  GLN  A   46  .  ?        ?  
225   5  1  A  47  SER  A   47  .  ?        ?  
226   5  1  A  48  PHE  A   48  .  ?        ?  
227   5  1  A  49  SER  A   49  .  ?        ?  
228   5  1  A  50  VAL  A   50  .  ?        ?  
229   5  1  A  51  SER  A   51  .  ?        ?  
230   5  2  B   .  ZN   A  101  .  ?        ?  
231   6  1  A   7  MET  A    7  .  ?        ?  
232   6  1  A   8  GLU  A    8  .  ?        ?  
233   6  1  A   9  ARG  A    9  .  ?        ?  
234   6  1  A  10  VAL  A   10  .  ?        ?  
235   6  1  A  11  TYR  A   11  .  ?        ?  
236   6  1  A  12  GLN  A   12  .  ?        2  
237   6  1  A  13  CYS  A   13  .  ?        ?  
238   6  1  A  14  LEU  A   14  .  ?        ?  
239   6  1  A  15  ARG  A   15  .  ?        1  
240   6  1  A  16  CYS  A   16  .  ?        1  
241   6  1  A  17  GLY  A   17  .  ?        ?  
242   6  1  A  18  LEU  A   18  .  ?        2  
243   6  1  A  19  THR  A   19  .  ?        1  
244   6  1  A  20  PHE  A   20  .  ?        ?  
245   6  1  A  21  ARG  A   21  .  ?        ?  
246   6  1  A  22  THR  A   22  .  ?        ?  
247   6  1  A  23  LYS  A   23  .  ?        ?  
248   6  1  A  24  LYS  A   24  .  ?        ?  
249   6  1  A  25  GLN  A   25  .  ?        ?  
250   6  1  A  26  LEU  A   26  .  ?        ?  
251   6  1  A  27  ILE  A   27  .  ?        ?  
252   6  1  A  28  ARG  A   28  .  ?        ?  
253   6  1  A  29  HIS  A   29  .  ?        ?  
254   6  1  A  30  LEU  A   30  .  ?        1  
255   6  1  A  31  VAL  A   31  .  ?        1  
256   6  1  A  32  ASN  A   32  .  ?        ?  
257   6  1  A  33  THR  A   33  .  ?        ?  
258   6  1  A  34  GLU  A   34  .  ?        3  
259   6  1  A  35  LYS  A   35  .  ?        1  
260   6  1  A  36  VAL  A   36  .  ?        2  
261   6  1  A  37  ASN  A   37  .  ?        ?  
262   6  1  A  38  PRO  A   38  .  ?        ?  
263   6  1  A  39  LEU  A   39  .  ?        ?  
264   6  1  A  40  SER  A   40  .  ?        ?  
265   6  1  A  41  ILE  A   41  .  ?        ?  
266   6  1  A  42  ASP  A   42  .  ?        ?  
267   6  1  A  43  TYR  A   43  .  ?        ?  
268   6  1  A  44  TYR  A   44  .  ?        1  
269   6  1  A  45  TYR  A   45  .  ?        ?  
270   6  1  A  46  GLN  A   46  .  ?        ?  
271   6  1  A  47  SER  A   47  .  ?        ?  
272   6  1  A  48  PHE  A   48  .  ?        ?  
273   6  1  A  49  SER  A   49  .  ?        ?  
274   6  1  A  50  VAL  A   50  .  ?        ?  
275   6  1  A  51  SER  A   51  .  ?        ?  
276   6  2  B   .  ZN   A  101  .  ?        ?  
277   7  1  A   7  MET  A    7  .  ?        ?  
278   7  1  A   8  GLU  A    8  .  ?        ?  
279   7  1  A   9  ARG  A    9  .  ?        ?  
280   7  1  A  10  VAL  A   10  .  ?        ?  
281   7  1  A  11  TYR  A   11  .  ?        ?  
282   7  1  A  12  GLN  A   12  .  ?        1  
283   7  1  A  13  CYS  A   13  .  ?        ?  
284   7  1  A  14  LEU  A   14  .  ?        ?  
285   7  1  A  15  ARG  A   15  .  ?        1  
286   7  1  A  16  CYS  A   16  .  ?        1  
287   7  1  A  17  GLY  A   17  .  ?        ?  
288   7  1  A  18  LEU  A   18  .  ?        2  
289   7  1  A  19  THR  A   19  .  ?        ?  
290   7  1  A  20  PHE  A   20  .  ?        1  
291   7  1  A  21  ARG  A   21  .  ?        ?  
292   7  1  A  22  THR  A   22  .  ?        ?  
293   7  1  A  23  LYS  A   23  .  ?        ?  
294   7  1  A  24  LYS  A   24  .  ?        ?  
295   7  1  A  25  GLN  A   25  .  ?        ?  
296   7  1  A  26  LEU  A   26  .  ?        ?  
297   7  1  A  27  ILE  A   27  .  ?        ?  
298   7  1  A  28  ARG  A   28  .  ?        ?  
299   7  1  A  29  HIS  A   29  .  ?        1  
300   7  1  A  30  LEU  A   30  .  ?        1  
301   7  1  A  31  VAL  A   31  .  ?        1  
302   7  1  A  32  ASN  A   32  .  ?        ?  
303   7  1  A  33  THR  A   33  .  ?        ?  
304   7  1  A  34  GLU  A   34  .  ?        3  
305   7  1  A  35  LYS  A   35  .  ?        1  
306   7  1  A  36  VAL  A   36  .  ?        1  
307   7  1  A  37  ASN  A   37  .  ?        ?  
308   7  1  A  38  PRO  A   38  .  ?        ?  
309   7  1  A  39  LEU  A   39  .  ?        ?  
310   7  1  A  40  SER  A   40  .  ?        ?  
311   7  1  A  41  ILE  A   41  .  ?        ?  
312   7  1  A  42  ASP  A   42  .  ?        1  
313   7  1  A  43  TYR  A   43  .  ?        ?  
314   7  1  A  44  TYR  A   44  .  ?        ?  
315   7  1  A  45  TYR  A   45  .  ?        1  
316   7  1  A  46  GLN  A   46  .  ?        ?  
317   7  1  A  47  SER  A   47  .  ?        ?  
318   7  1  A  48  PHE  A   48  .  ?        ?  
319   7  1  A  49  SER  A   49  .  ?        ?  
320   7  1  A  50  VAL  A   50  .  ?        ?  
321   7  1  A  51  SER  A   51  .  ?        ?  
322   7  2  B   .  ZN   A  101  .  ?        ?  
323   8  1  A   7  MET  A    7  .  ?        ?  
324   8  1  A   8  GLU  A    8  .  ?        1  
325   8  1  A   9  ARG  A    9  .  ?        ?  
326   8  1  A  10  VAL  A   10  .  ?        2  
327   8  1  A  11  TYR  A   11  .  ?        ?  
328   8  1  A  12  GLN  A   12  .  ?        1  
329   8  1  A  13  CYS  A   13  .  ?        ?  
330   8  1  A  14  LEU  A   14  .  ?        ?  
331   8  1  A  15  ARG  A   15  .  ?        1  
332   8  1  A  16  CYS  A   16  .  ?        1  
333   8  1  A  17  GLY  A   17  .  ?        ?  
334   8  1  A  18  LEU  A   18  .  ?        1  
335   8  1  A  19  THR  A   19  .  ?        3  
336   8  1  A  20  PHE  A   20  .  ?        ?  
337   8  1  A  21  ARG  A   21  .  ?        ?  
338   8  1  A  22  THR  A   22  .  ?        ?  
339   8  1  A  23  LYS  A   23  .  ?        ?  
340   8  1  A  24  LYS  A   24  .  ?        ?  
341   8  1  A  25  GLN  A   25  .  ?        ?  
342   8  1  A  26  LEU  A   26  .  ?        ?  
343   8  1  A  27  ILE  A   27  .  ?        ?  
344   8  1  A  28  ARG  A   28  .  ?        ?  
345   8  1  A  29  HIS  A   29  .  ?        ?  
346   8  1  A  30  LEU  A   30  .  ?        2  
347   8  1  A  31  VAL  A   31  .  ?        ?  
348   8  1  A  32  ASN  A   32  .  ?        ?  
349   8  1  A  33  THR  A   33  .  ?        ?  
350   8  1  A  34  GLU  A   34  .  ?        4  
351   8  1  A  35  LYS  A   35  .  ?        1  
352   8  1  A  36  VAL  A   36  .  ?        ?  
353   8  1  A  37  ASN  A   37  .  ?        ?  
354   8  1  A  38  PRO  A   38  .  ?        ?  
355   8  1  A  39  LEU  A   39  .  ?        ?  
356   8  1  A  40  SER  A   40  .  ?        ?  
357   8  1  A  41  ILE  A   41  .  ?        ?  
358   8  1  A  42  ASP  A   42  .  ?        ?  
359   8  1  A  43  TYR  A   43  .  ?        ?  
360   8  1  A  44  TYR  A   44  .  ?        ?  
361   8  1  A  45  TYR  A   45  .  ?        ?  
362   8  1  A  46  GLN  A   46  .  ?        ?  
363   8  1  A  47  SER  A   47  .  ?        ?  
364   8  1  A  48  PHE  A   48  .  ?        ?  
365   8  1  A  49  SER  A   49  .  ?        ?  
366   8  1  A  50  VAL  A   50  .  ?        1  
367   8  1  A  51  SER  A   51  .  ?        ?  
368   8  2  B   .  ZN   A  101  .  ?        ?  
369   9  1  A   7  MET  A    7  .  ?        ?  
370   9  1  A   8  GLU  A    8  .  ?        ?  
371   9  1  A   9  ARG  A    9  .  ?        ?  
372   9  1  A  10  VAL  A   10  .  ?        ?  
373   9  1  A  11  TYR  A   11  .  ?        ?  
374   9  1  A  12  GLN  A   12  .  ?        1  
375   9  1  A  13  CYS  A   13  .  ?        ?  
376   9  1  A  14  LEU  A   14  .  ?        1  
377   9  1  A  15  ARG  A   15  .  ?        ?  
378   9  1  A  16  CYS  A   16  .  ?        1  
379   9  1  A  17  GLY  A   17  .  ?        ?  
380   9  1  A  18  LEU  A   18  .  ?        2  
381   9  1  A  19  THR  A   19  .  ?        ?  
382   9  1  A  20  PHE  A   20  .  ?        ?  
383   9  1  A  21  ARG  A   21  .  ?        ?  
384   9  1  A  22  THR  A   22  .  ?        ?  
385   9  1  A  23  LYS  A   23  .  ?        ?  
386   9  1  A  24  LYS  A   24  .  ?        ?  
387   9  1  A  25  GLN  A   25  .  ?        ?  
388   9  1  A  26  LEU  A   26  .  ?        ?  
389   9  1  A  27  ILE  A   27  .  ?        ?  
390   9  1  A  28  ARG  A   28  .  ?        ?  
391   9  1  A  29  HIS  A   29  .  ?        ?  
392   9  1  A  30  LEU  A   30  .  ?        1  
393   9  1  A  31  VAL  A   31  .  ?        1  
394   9  1  A  32  ASN  A   32  .  ?        ?  
395   9  1  A  33  THR  A   33  .  ?        ?  
396   9  1  A  34  GLU  A   34  .  ?        1  
397   9  1  A  35  LYS  A   35  .  ?        1  
398   9  1  A  36  VAL  A   36  .  ?        ?  
399   9  1  A  37  ASN  A   37  .  ?        ?  
400   9  1  A  38  PRO  A   38  .  ?        ?  
401   9  1  A  39  LEU  A   39  .  ?        ?  
402   9  1  A  40  SER  A   40  .  ?        ?  
403   9  1  A  41  ILE  A   41  .  ?        ?  
404   9  1  A  42  ASP  A   42  .  ?        ?  
405   9  1  A  43  TYR  A   43  .  ?        ?  
406   9  1  A  44  TYR  A   44  .  ?        ?  
407   9  1  A  45  TYR  A   45  .  ?        ?  
408   9  1  A  46  GLN  A   46  .  ?        1  
409   9  1  A  47  SER  A   47  .  ?        ?  
410   9  1  A  48  PHE  A   48  .  ?        ?  
411   9  1  A  49  SER  A   49  .  ?        ?  
412   9  1  A  50  VAL  A   50  .  ?        2  
413   9  1  A  51  SER  A   51  .  ?        2  
414   9  2  B   .  ZN   A  101  .  ?        ?  
415  10  1  A   7  MET  A    7  .  ?        ?  
416  10  1  A   8  GLU  A    8  .  ?        ?  
417  10  1  A   9  ARG  A    9  .  ?        ?  
418  10  1  A  10  VAL  A   10  .  ?        1  
419  10  1  A  11  TYR  A   11  .  ?        ?  
420  10  1  A  12  GLN  A   12  .  ?        2  
421  10  1  A  13  CYS  A   13  .  ?        ?  
422  10  1  A  14  LEU  A   14  .  ?        ?  
423  10  1  A  15  ARG  A   15  .  ?        ?  
424  10  1  A  16  CYS  A   16  .  ?        1  
425  10  1  A  17  GLY  A   17  .  ?        ?  
426  10  1  A  18  LEU  A   18  .  ?        2  
427  10  1  A  19  THR  A   19  .  ?        1  
428  10  1  A  20  PHE  A   20  .  ?        3  
429  10  1  A  21  ARG  A   21  .  ?        ?  
430  10  1  A  22  THR  A   22  .  ?        ?  
431  10  1  A  23  LYS  A   23  .  ?        ?  
432  10  1  A  24  LYS  A   24  .  ?        ?  
433  10  1  A  25  GLN  A   25  .  ?        1  
434  10  1  A  26  LEU  A   26  .  ?        ?  
435  10  1  A  27  ILE  A   27  .  ?        ?  
436  10  1  A  28  ARG  A   28  .  ?        ?  
437  10  1  A  29  HIS  A   29  .  ?        1  
438  10  1  A  30  LEU  A   30  .  ?        1  
439  10  1  A  31  VAL  A   31  .  ?        ?  
440  10  1  A  32  ASN  A   32  .  ?        ?  
441  10  1  A  33  THR  A   33  .  ?        ?  
442  10  1  A  34  GLU  A   34  .  ?        2  
443  10  1  A  35  LYS  A   35  .  ?        ?  
444  10  1  A  36  VAL  A   36  .  ?        1  
445  10  1  A  37  ASN  A   37  .  ?        ?  
446  10  1  A  38  PRO  A   38  .  ?        ?  
447  10  1  A  39  LEU  A   39  .  ?        ?  
448  10  1  A  40  SER  A   40  .  ?        ?  
449  10  1  A  41  ILE  A   41  .  ?        ?  
450  10  1  A  42  ASP  A   42  .  ?        ?  
451  10  1  A  43  TYR  A   43  .  ?        ?  
452  10  1  A  44  TYR  A   44  .  ?        ?  
453  10  1  A  45  TYR  A   45  .  ?        ?  
454  10  1  A  46  GLN  A   46  .  ?        ?  
455  10  1  A  47  SER  A   47  .  ?        ?  
456  10  1  A  48  PHE  A   48  .  ?        ?  
457  10  1  A  49  SER  A   49  .  ?        ?  
458  10  1  A  50  VAL  A   50  .  ?        ?  
459  10  1  A  51  SER  A   51  .  ?        ?  
460  10  2  B   .  ZN   A  101  .  ?        ?  
#
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.num_H_reduce
_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.cyrange_domain_id
_pdbx_vrpt_model_instance_geometry.validate
  1    1  mpp?          ?       ?  ?           8     8  0.48    10  0.40  molprobity     ?  False  
  2    2  pm0      -156.0   165.1  Favored     6     9  0.43    12  0.42  molprobity     ?  False  
  3    3  ttm180    -99.3   118.2  Favored    13    11  0.45    14  0.45  molprobity     ?  False  
  4    4  m        -103.2   164.8  Favored     9     7  0.30    10  0.36  molprobity     1  True   
  5    5  m-85     -132.5   120.6  Favored     9    13  0.37    18  0.28  molprobity     1  True   
  6    6  pt20     -103.9   150.0  Favored     8     9  0.26    12  0.35  molprobity     1  True   
  7    7  p         -83.2   127.9  Favored     4     6  0.46     8  0.48  molprobity     1  True   
  8    8  OUTLIER   -71.9    13.8  Allowed    11     8  0.32    11  0.41  molprobity     1  True   
  9    9  mmm180   -108.8   -56.7  Favored    13    11  0.29    14  0.39  molprobity     1  True   
 10   10  m         -98.9   -17.6  Favored     4     6  0.09     8  0.56  molprobity     1  True   
 11   11  ?          81.3    21.8  Favored     3     4  0.32     5  0.43  molprobity     1  True   
 12   12  mt        -85.7   123.6  Favored    11     8  0.26    11  0.23  molprobity     1  True   
 13   13  OUTLIER  -106.5   134.5  Favored     7     7  0.32    10  0.54  molprobity     1  True   
 14   14  m-85     -120.7   153.4  Favored     9    12  0.50    16  0.45  molprobity     1  True   
 15   15  mtp180    -87.4    -7.1  Favored    13    11  0.21    14  0.40  molprobity     1  True   
 16   16  p        -140.3   150.0  Favored     7     7  0.26    10  0.53  molprobity     1  True   
 17   17  mttt      -67.5   -26.6  Favored    13     9  0.24    11  0.22  molprobity     1  True   
 18   18  tttp      -60.4   -49.4  Favored    13     9  0.23    11  0.25  molprobity     1  True   
 19   19  mt-30     -63.6   -35.8  Favored     8     9  0.27    12  0.36  molprobity     1  True   
 20   20  tp        -65.5   -52.9  Favored    11     8  0.24    11  0.40  molprobity     1  True   
 21   21  mt        -65.3   -44.2  Favored    11     8  0.16    11  0.37  molprobity     1  True   
 22   22  ptm180    -63.1   -29.2  Favored    13    11  0.19    14  0.50  molprobity     1  True   
 23   23  t60       -81.8   -42.2  Favored     7    11  0.20    15  0.32  molprobity     1  True   
 24   24  mt        -52.2   -47.6  Favored    11     8  0.28    11  0.32  molprobity     1  True   
 25   25  t         -66.5   -48.8  Favored     9     7  0.22    10  0.46  molprobity     1  True   
 26   26  t30       -64.4   -60.2  Favored     6     8  0.35    11  0.35  molprobity     1  True   
 27   27  m         -95.0   -43.3  Favored     7     7  0.29    10  0.43  molprobity     1  True   
 28   28  OUTLIER   -89.7     3.9  Favored     6     9  0.64    12  0.92  molprobity     1  True   
 29   29  pttp       51.2    32.7  Favored    13     9  0.47    11  0.45  molprobity     1  True   
 30   30  t         -93.9   123.4  Favored     9     7  0.33    10  0.41  molprobity     1  True   
 31   31  m120      -76.3   145.0  Favored     6     8  0.29    12  0.57  molprobity     1  True   
 32   32  Cg_endo   -56.8   -19.2  Favored     7     8  0.23    11  0.40  molprobity     1  True   
 33   33  mt        -86.9    -4.0  Favored    11     8  0.26    11  0.23  molprobity     1  True   
 34   34  m        -124.7    17.0  Favored     5     6  0.20     8  0.23  molprobity     1  True   
 35   35  pt        -70.2   -23.1  Favored    11     8  0.14    11  0.55  molprobity     1  True   
 36   36  p-10      -57.0   -24.7  Favored     4     8  0.31    11  0.36  molprobity     1  True   
 37   37  m-85      -92.2   -20.8  Favored     9    13  0.34    18  0.33  molprobity     1  True   
 38   38  m-85     -108.9     4.0  Favored     9    13  0.51    18  0.42  molprobity     1  True   
 39   39  OUTLIER  -131.3   145.7  Favored     9    13  0.41    18  0.39  molprobity     1  True   
 40   40  tt0      -130.4   136.2  Favored     8     9  0.30    12  0.28  molprobity     1  True   
 41   41  m         -93.5   125.0  Favored     5     6  0.27     8  0.21  molprobity     ?  False  
 42   42  t80      -135.1   137.3  Favored     9    12  0.40    16  0.21  molprobity     ?  False  
 43   43  m         -97.9   128.4  Favored     5     6  0.29     8  0.29  molprobity     ?  False  
 44   44  p        -127.3   149.2  Favored     9     7  0.31    10  0.25  molprobity     ?  False  
 45   45  m             ?       ?  ?           5     4  0.42     4  0.36  molprobity     ?  False  
 46   46  ?             ?       ?  ?           ?     ?     ?     ?     ?  ?              ?  True   
 47   47  ttp           ?       ?  ?           8     8  0.43    10  0.29  molprobity     ?  False  
 48   48  tp10      -70.8   141.9  Favored     6     9  0.34    12  0.33  molprobity     ?  False  
 49   49  OUTLIER  -103.8   137.7  Favored    13    11  0.36    14  0.43  molprobity     ?  False  
 50   50  OUTLIER  -125.5   143.5  Favored     9     7  0.29    10  0.48  molprobity     1  True   
 51   51  m-85     -109.0   117.4  Favored     9    13  0.36    18  0.33  molprobity     1  True   
 52   52  mt-30     -98.8   129.2  Favored     8     9  0.31    12  0.41  molprobity     1  True   
 53   53  p         -77.1   122.5  Favored     4     6  0.43     8  0.59  molprobity     1  True   
 54   54  mt        -74.6    12.1  Allowed    11     8  0.22    11  0.23  molprobity     1  True   
 55   55  mmm180   -104.2   -52.0  Favored    13    11  0.31    14  0.39  molprobity     1  True   
 56   56  m        -105.9   -12.1  Favored     4     6  0.26     8  0.43  molprobity     1  True   
 57   57  ?          78.1    24.6  Favored     3     4  0.27     5  0.34  molprobity     1  True   
 58   58  mt        -85.5   129.2  Favored    11     8  0.22    11  0.27  molprobity     1  True   
 59   59  OUTLIER  -109.9   136.4  Favored     7     7  0.28    10  0.57  molprobity     1  True   
 60   60  m-85     -127.4   147.6  Favored     9    12  0.45    16  0.44  molprobity     1  True   
 61   61  ptm180    -94.7     7.0  Favored    13    11  0.26    14  0.55  molprobity     1  True   
 62   62  t        -139.1   132.5  Favored     7     7  0.40    10  0.55  molprobity     1  True   
 63   63  ttpt      -67.7   -23.9  Favored    13     9  0.20    11  0.21  molprobity     1  True   
 64   64  mttm      -67.7   -43.2  Favored    13     9  0.26    11  0.22  molprobity     1  True   
 65   65  mm100     -68.8   -27.6  Favored     8     9  0.21    12  0.28  molprobity     1  True   
 66   66  tp        -66.1   -52.9  Favored    11     8  0.20    11  0.32  molprobity     1  True   
 67   67  mt        -61.0   -42.5  Favored    11     8  0.17    11  0.33  molprobity     1  True   
 68   68  mtt180    -55.0   -51.1  Favored    13    11  0.25    14  0.41  molprobity     1  True   
 69   69  t60       -69.4   -45.8  Favored     7    11  0.24    15  0.38  molprobity     1  True   
 70   70  mm?       -52.4   -52.3  Favored    11     8  0.29    11  0.26  molprobity     1  True   
 71   71  t         -73.1   -43.3  Favored     9     7  0.27    10  0.48  molprobity     1  True   
 72   72  t30       -80.0   -48.4  Favored     6     8  0.25    11  0.26  molprobity     1  True   
 73   73  m         -95.7   -43.2  Favored     7     7  0.26    10  0.44  molprobity     1  True   
 74   74  OUTLIER   -84.4     1.3  Favored     6     9  0.66    12  1.02  molprobity     1  True   
 75   75  ptmt       49.3    33.4  Favored    13     9  0.38    11  0.49  molprobity     1  True   
 76   76  t        -109.3   110.3  Favored     9     7  0.32    10  0.43  molprobity     1  True   
 77   77  m-20      -67.9   155.2  Favored     6     8  0.30    12  0.49  molprobity     1  True   
 78   78  Cg_exo    -49.7   -42.4  Favored     7     8  0.24    11  0.31  molprobity     1  True   
 79   79  mm?       -78.0    11.7  Favored    11     8  0.29    11  0.23  molprobity     1  True   
 80   80  m        -138.9     6.3  Favored     5     6  0.18     8  0.21  molprobity     1  True   
 81   81  pt        -68.5   -15.6  Favored    11     8  0.24    11  0.63  molprobity     1  True   
 82   82  t70       -46.3   -40.2  Favored     4     8  0.28    11  0.41  molprobity     1  True   
 83   83  m-85      -85.3   -21.1  Favored     9    13  0.33    18  0.40  molprobity     1  True   
 84   84  m-85     -105.3   -10.4  Favored     9    13  0.40    18  0.45  molprobity     1  True   
 85   85  p90      -117.7   140.6  Favored     9    13  0.32    18  0.45  molprobity     1  True   
 86   86  tt0      -122.7   128.1  Favored     8     9  0.28    12  0.27  molprobity     1  True   
 87   87  t        -111.0   127.3  Favored     5     6  0.34     8  0.28  molprobity     ?  False  
 88   88  p90      -140.8   147.6  Favored     9    12  0.41    16  0.29  molprobity     ?  False  
 89   89  m        -101.5   140.9  Favored     5     6  0.35     8  0.35  molprobity     ?  False  
 90   90  m         -96.0   179.9  Allowed     9     7  0.24    10  0.27  molprobity     ?  False  
 91   91  m             ?       ?  ?           5     4  0.23     4  0.27  molprobity     ?  False  
 92   92  ?             ?       ?  ?           ?     ?     ?     ?     ?  ?              ?  True   
 93   93  ppp?          ?       ?  ?           8     8  0.48    10  0.50  molprobity     ?  False  
 94   94  mp0       -80.4   133.4  Favored     6     9  0.41    12  0.41  molprobity     ?  False  
 95   95  mtm180    -98.7   106.5  Favored    13    11  0.31    14  0.60  molprobity     ?  False  
 96   96  m         -98.4   175.4  Allowed     9     7  0.19    10  0.36  molprobity     1  True   
 97   97  m-85     -126.9   126.1  Favored     9    13  0.29    18  0.29  molprobity     1  True   
 98   98  pt20     -109.5   140.7  Favored     8     9  0.22    12  0.24  molprobity     1  True   
 99   99  p         -81.2   131.4  Favored     4     6  0.28     8  0.35  molprobity     1  True   
100  100  mt        -76.3     9.0  Favored    11     8  0.32    11  0.24  molprobity     1  True   
101  101  tpt180    -99.8   -56.5  Favored    13    11  0.29    14  0.45  molprobity     1  True   
102  102  m        -103.5   -16.4  Favored     4     6  0.14     8  0.34  molprobity     1  True   
103  103  ?          86.0     1.6  Favored     3     4  0.28     5  0.38  molprobity     1  True   
104  104  mt        -66.6   124.7  Favored    11     8  0.24    11  0.24  molprobity     1  True   
105  105  OUTLIER  -108.9   138.1  Favored     7     7  0.28    10  0.54  molprobity     1  True   
106  106  m-85     -124.9   147.2  Favored     9    12  0.42    16  0.52  molprobity     1  True   
107  107  mpt_?     -84.4   -28.6  Favored    13    11  0.31    14  0.30  molprobity     1  True   
108  108  OUTLIER  -110.1   134.2  Favored     7     7  0.29    10  0.65  molprobity     1  True   
109  109  tttp      -65.9   -33.0  Favored    13     9  0.28    11  0.23  molprobity     1  True   
110  110  mtmm      -63.9   -39.9  Favored    13     9  0.27    11  0.22  molprobity     1  True   
111  111  mm100     -67.2   -33.5  Favored     8     9  0.26    12  0.37  molprobity     1  True   
112  112  tp        -60.9   -51.6  Favored    11     8  0.23    11  0.34  molprobity     1  True   
113  113  mm        -60.6   -46.7  Favored    11     8  0.17    11  0.53  molprobity     1  True   
114  114  mtt180    -51.3   -46.8  Favored    13    11  0.34    14  0.43  molprobity     1  True   
115  115  t60       -74.1   -45.9  Favored     7    11  0.22    15  0.39  molprobity     1  True   
116  116  mm?       -52.0   -49.1  Favored    11     8  0.32    11  0.32  molprobity     1  True   
117  117  m         -69.2   -52.1  Favored     9     7  0.34    10  0.51  molprobity     1  True   
118  118  t30       -72.0   -60.3  Favored     6     8  0.26    11  0.31  molprobity     1  True   
119  119  m         -80.3   -48.2  Favored     7     7  0.29    10  0.46  molprobity     1  True   
120  120  OUTLIER   -81.1    -4.3  Favored     6     9  0.70    12  1.02  molprobity     1  True   
121  121  ptpt       48.7    33.6  Favored    13     9  0.36    11  0.51  molprobity     1  True   
122  122  m         -95.2   144.1  Favored     9     7  0.44    10  0.45  molprobity     1  True   
123  123  t30       -68.1   138.2  Favored     6     8  0.34    12  0.63  molprobity     1  True   
124  124  Cg_exo    -51.7   -19.9  Favored     7     8  0.23    11  0.38  molprobity     1  True   
125  125  mm?       -87.8    -4.1  Favored    11     8  0.30    11  0.28  molprobity     1  True   
126  126  t        -122.1     8.8  Favored     5     6  0.35     8  0.26  molprobity     1  True   
127  127  pt        -58.6   -42.9  Favored    11     8  0.19    11  0.59  molprobity     1  True   
128  128  m-20      -57.9   -21.7  Favored     4     8  0.25    11  0.36  molprobity     1  True   
129  129  m-85      -79.5   -21.8  Favored     9    13  0.28    18  0.27  molprobity     1  True   
130  130  m-85     -117.7     2.6  Favored     9    13  0.56    18  0.48  molprobity     1  True   
131  131  p90      -124.4   145.3  Favored     9    13  0.37    18  0.48  molprobity     1  True   
132  132  mm-40    -124.0   137.7  Favored     8     9  0.30    12  0.27  molprobity     1  True   
133  133  t         -88.8   134.9  Favored     5     6  0.41     8  0.27  molprobity     ?  False  
134  134  t80      -131.9   141.4  Favored     9    12  0.36    16  0.25  molprobity     ?  False  
135  135  m         -85.0   127.7  Favored     5     6  0.28     8  0.31  molprobity     ?  False  
136  136  t         -96.4   164.4  Favored     9     7  0.30    10  0.39  molprobity     ?  False  
137  137  m             ?       ?  ?           5     4  0.25     4  0.21  molprobity     ?  False  
138  138  ?             ?       ?  ?           ?     ?     ?     ?     ?  ?              ?  True   
139  139  ptm           ?       ?  ?           8     8  0.46    10  0.50  molprobity     ?  False  
140  140  OUTLIER  -152.7   166.8  Favored     6     9  0.39    12  0.32  molprobity     ?  False  
141  141  ttp180    -98.5   114.6  Favored    13    11  0.41    14  0.47  molprobity     ?  False  
142  142  m        -105.5   152.6  Favored     9     7  0.31    10  0.58  molprobity     1  True   
143  143  OUTLIER  -131.5   125.8  Favored     9    13  0.26    18  0.52  molprobity     1  True   
144  144  pt20     -112.3   136.9  Favored     8     9  0.30    12  0.45  molprobity     1  True   
145  145  p         -66.8   136.0  Favored     4     6  0.35     8  0.44  molprobity     1  True   
146  146  mt        -72.8     6.0  Favored    11     8  0.31    11  0.24  molprobity     1  True   
147  147  tpt180    -99.4   -59.1  Allowed    13    11  0.28    14  0.32  molprobity     1  True   
148  148  m        -102.7   -10.4  Favored     4     6  0.11     8  0.38  molprobity     1  True   
149  149  ?          74.9    14.6  Favored     3     4  0.35     5  0.30  molprobity     1  True   
150  150  mt        -74.0   122.8  Favored    11     8  0.18    11  0.24  molprobity     1  True   
151  151  p         -94.8   137.7  Favored     7     7  0.37    10  0.59  molprobity     1  True   
152  152  m-85     -124.3   149.7  Favored     9    12  0.47    16  0.37  molprobity     1  True   
153  153  mtm180   -104.2   -16.0  Favored    13    11  0.26    14  0.48  molprobity     1  True   
154  154  p        -113.1   137.3  Favored     7     7  0.34    10  0.55  molprobity     1  True   
155  155  tptm      -65.5   -27.2  Favored    13     9  0.24    11  0.26  molprobity     1  True   
156  156  mtpt      -63.9   -44.7  Favored    13     9  0.19    11  0.19  molprobity     1  True   
157  157  mm100     -67.0   -33.6  Favored     8     9  0.24    12  0.29  molprobity     1  True   
158  158  tp        -63.4   -51.9  Favored    11     8  0.20    11  0.31  molprobity     1  True   
159  159  mt        -61.4   -44.9  Favored    11     8  0.13    11  0.37  molprobity     1  True   
160  160  mtt180    -55.7   -43.0  Favored    13    11  0.26    14  0.46  molprobity     1  True   
161  161  t60       -79.5   -46.6  Favored     7    11  0.24    15  0.34  molprobity     1  True   
162  162  mm?       -52.5   -43.0  Favored    11     8  0.34    11  0.22  molprobity     1  True   
163  163  t         -76.4   -40.7  Favored     9     7  0.24    10  0.41  molprobity     1  True   
164  164  t30       -75.6   -57.5  Favored     6     8  0.31    11  0.23  molprobity     1  True   
165  165  m         -96.3   -42.0  Favored     7     7  0.31    10  0.35  molprobity     1  True   
166  166  OUTLIER   -82.0    -3.1  Favored     6     9  0.70    12  1.02  molprobity     1  True   
167  167  OUTLIER    48.2    42.2  Favored    13     9  0.41    11  0.47  molprobity     1  True   
168  168  t        -109.5   134.8  Favored     9     7  0.26    10  0.42  molprobity     1  True   
169  169  m-20      -64.8   140.9  Favored     6     8  0.28    12  0.57  molprobity     1  True   
170  170  Cg_exo    -59.1   -19.7  Favored     7     8  0.21    11  0.36  molprobity     1  True   
171  171  mm?       -87.6     0.8  Favored    11     8  0.28    11  0.20  molprobity     1  True   
172  172  m        -135.3     5.4  Favored     5     6  0.15     8  0.27  molprobity     1  True   
173  173  pt        -57.3   -30.1  Favored    11     8  0.15    11  0.61  molprobity     1  True   
174  174  t70       -58.2   -22.3  Favored     4     8  0.27    11  0.33  molprobity     1  True   
175  175  m-85      -90.1   -20.9  Favored     9    13  0.28    18  0.25  molprobity     1  True   
176  176  m-85     -108.8     5.5  Favored     9    13  0.40    18  0.42  molprobity     1  True   
177  177  p90      -132.2   146.0  Favored     9    13  0.45    18  0.40  molprobity     1  True   
178  178  tt0      -151.2   132.8  Favored     8     9  0.31    12  0.47  molprobity     1  True   
179  179  m        -174.9  -174.0  Allowed     5     6  0.31     8  0.52  molprobity     ?  False  
180  180  t80      -156.0   167.6  Favored     9    12  0.41    16  0.36  molprobity     ?  False  
181  181  m         -71.7   128.6  Favored     5     6  0.30     8  0.26  molprobity     ?  False  
182  182  m        -109.8   156.4  Favored     9     7  0.27    10  0.31  molprobity     ?  False  
183  183  t             ?       ?  ?           5     4  0.30     4  0.32  molprobity     ?  False  
184  184  ?             ?       ?  ?           ?     ?     ?     ?     ?  ?              ?  True   
185  185  mmm           ?       ?  ?           8     8  0.50    10  0.29  molprobity     ?  False  
186  186  mp0      -103.8   123.4  Favored     6     9  0.43    12  0.37  molprobity     ?  False  
187  187  mtm180    -99.2   108.1  Favored    13    11  0.33    14  0.56  molprobity     ?  False  
188  188  m         -99.2   141.9  Favored     9     7  0.39    10  0.41  molprobity     1  True   
189  189  m-85     -117.0   123.7  Favored     9    13  0.35    18  0.25  molprobity     1  True   
190  190  pt20     -108.2   132.6  Favored     8     9  0.29    12  0.35  molprobity     1  True   
191  191  p         -73.4   139.0  Favored     4     6  0.26     8  0.32  molprobity     1  True   
192  192  mt        -77.0    11.8  Allowed    11     8  0.24    11  0.23  molprobity     1  True   
193  193  tpt180   -105.9   -59.0  Allowed    13    11  0.30    14  0.29  molprobity     1  True   
194  194  m         -99.6   -15.9  Favored     4     6  0.06     8  0.39  molprobity     1  True   
195  195  ?          79.5     7.5  Favored     3     4  0.30     5  0.34  molprobity     1  True   
196  196  mt        -68.8   124.8  Favored    11     8  0.21    11  0.20  molprobity     1  True   
197  197  OUTLIER  -108.9   134.5  Favored     7     7  0.32    10  0.55  molprobity     1  True   
198  198  m-85     -125.0   148.5  Favored     9    12  0.41    16  0.34  molprobity     1  True   
199  199  mtm180    -88.6    -5.6  Favored    13    11  0.26    14  0.39  molprobity     1  True   
200  200  p        -130.4   151.2  Favored     7     7  0.29    10  0.53  molprobity     1  True   
201  201  mmtp      -60.3   -44.6  Favored    13     9  0.21    11  0.32  molprobity     1  True   
202  202  mttt      -53.5   -47.0  Favored    13     9  0.23    11  0.27  molprobity     1  True   
203  203  mm100     -66.3   -34.5  Favored     8     9  0.27    12  0.31  molprobity     1  True   
204  204  tm?       -74.2   -56.4  Favored    11     8  0.35    11  0.78  molprobity     1  True   
205  205  mt        -52.7   -50.9  Favored    11     8  0.11    11  0.44  molprobity     1  True   
206  206  ptt85     -62.6   -37.7  Favored    13    11  0.22    14  0.43  molprobity     1  True   
207  207  t60       -72.4   -46.1  Favored     7    11  0.29    15  0.39  molprobity     1  True   
208  208  mm?       -53.7   -47.4  Favored    11     8  0.26    11  0.24  molprobity     1  True   
209  209  t         -71.9   -44.2  Favored     9     7  0.21    10  0.41  molprobity     1  True   
210  210  t-20      -80.2   -53.9  Favored     6     8  0.24    11  0.32  molprobity     1  True   
211  211  m         -92.7   -39.0  Favored     7     7  0.24    10  0.40  molprobity     1  True   
212  212  OUTLIER   -85.9    -0.0  Favored     6     9  0.63    12  1.02  molprobity     1  True   
213  213  OUTLIER    44.2    41.6  Favored    13     9  0.36    11  0.57  molprobity     1  True   
214  214  t         -99.2   125.4  Favored     9     7  0.23    10  0.43  molprobity     1  True   
215  215  t-20      -55.6   129.5  Favored     6     8  0.45    12  0.57  molprobity     1  True   
216  216  Cg_endo   -54.0   -18.7  Favored     7     8  0.27    11  0.38  molprobity     1  True   
217  217  mp        -82.0   -18.7  Favored    11     8  0.29    11  0.41  molprobity     1  True   
218  218  m        -110.4    -5.1  Favored     5     6  0.16     8  0.32  molprobity     1  True   
219  219  pt        -53.9   -28.5  Favored    11     8  0.28    11  0.66  molprobity     1  True   
220  220  t70       -56.5   -23.8  Favored     4     8  0.28    11  0.37  molprobity     1  True   
221  221  t80       -92.0   -20.8  Favored     9    13  0.27    18  0.31  molprobity     1  True   
222  222  m-85     -107.5     5.8  Favored     9    13  0.47    18  0.39  molprobity     1  True   
223  223  p90      -124.1   144.2  Favored     9    13  0.37    18  0.42  molprobity     1  True   
224  224  tt0      -113.6   134.6  Favored     8     9  0.25    12  0.24  molprobity     1  True   
225  225  p         -96.6   133.0  Favored     5     6  0.25     8  0.44  molprobity     ?  False  
226  226  t80      -121.9   137.7  Favored     9    12  0.37    16  0.29  molprobity     ?  False  
227  227  m        -105.4   127.5  Favored     5     6  0.26     8  0.51  molprobity     ?  False  
228  228  t        -114.2   121.8  Favored     9     7  0.32    10  0.47  molprobity     ?  False  
229  229  m             ?       ?  ?           5     4  0.22     4  0.31  molprobity     ?  False  
230  230  ?             ?       ?  ?           ?     ?     ?     ?     ?  ?              ?  True   
231  231  pmm?          ?       ?  ?           8     8  0.57    10  0.46  molprobity     ?  False  
232  232  mm-40     -86.5   111.7  Favored     6     9  0.30    12  0.31  molprobity     ?  False  
233  233  mtp180    -84.9   104.2  Favored    13    11  0.34    14  0.45  molprobity     ?  False  
234  234  m         -99.5   157.8  Favored     9     7  0.38    10  0.50  molprobity     1  True   
235  235  m-85     -111.2   117.9  Favored     9    13  0.44    18  0.35  molprobity     1  True   
236  236  pt20     -109.0   144.0  Favored     8     9  0.34    12  0.31  molprobity     1  True   
237  237  OUTLIER   -81.7   128.3  Favored     4     6  0.42     8  0.53  molprobity     1  True   
238  238  mt        -75.8    11.4  Allowed    11     8  0.24    11  0.25  molprobity     1  True   
239  239  mmt180   -106.2   -55.7  Favored    13    11  0.47    14  0.51  molprobity     1  True   
240  240  m         -99.5    -7.0  Favored     4     6  0.26     8  0.44  molprobity     1  True   
241  241  ?          72.0    26.0  Favored     3     4  0.39     5  0.43  molprobity     1  True   
242  242  mt        -86.1   125.6  Favored    11     8  0.23    11  0.33  molprobity     1  True   
243  243  p        -101.0   145.3  Favored     7     7  0.29    10  0.48  molprobity     1  True   
244  244  m-85     -134.1   144.6  Favored     9    12  0.44    16  0.37  molprobity     1  True   
245  245  mtp180    -85.9    -8.4  Favored    13    11  0.23    14  0.42  molprobity     1  True   
246  246  p        -138.8   151.1  Favored     7     7  0.25    10  0.54  molprobity     1  True   
247  247  ttpp      -70.5   -20.1  Favored    13     9  0.21    11  0.26  molprobity     1  True   
248  248  mttm      -57.9   -52.0  Favored    13     9  0.27    11  0.53  molprobity     1  True   
249  249  mt-30     -65.7   -34.2  Favored     8     9  0.25    12  0.44  molprobity     1  True   
250  250  tp        -63.9   -52.8  Favored    11     8  0.22    11  0.31  molprobity     1  True   
251  251  mt        -62.2   -41.7  Favored    11     8  0.17    11  0.40  molprobity     1  True   
252  252  mtt180    -60.4   -38.7  Favored    13    11  0.24    14  0.24  molprobity     1  True   
253  253  t60       -82.4   -45.9  Favored     7    11  0.24    15  0.29  molprobity     1  True   
254  254  mm?       -52.2   -49.3  Favored    11     8  0.29    11  0.22  molprobity     1  True   
255  255  t         -72.7   -47.0  Favored     9     7  0.25    10  0.38  molprobity     1  True   
256  256  t30       -70.8   -56.3  Favored     6     8  0.30    11  0.24  molprobity     1  True   
257  257  m         -91.4   -38.7  Favored     7     7  0.32    10  0.42  molprobity     1  True   
258  258  OUTLIER   -85.3    -2.5  Favored     6     9  0.58    12  1.03  molprobity     1  True   
259  259  pttt       65.3    10.4  Favored    13     9  0.52    11  0.46  molprobity     1  True   
260  260  t         -72.5   130.1  Favored     9     7  0.26    10  0.64  molprobity     1  True   
261  261  t-20      -65.6   132.3  Favored     6     8  0.46    12  0.73  molprobity     1  True   
262  262  Cg_exo    -53.6   -25.6  Favored     7     8  0.21    11  0.36  molprobity     1  True   
263  263  mm?       -89.5    11.5  Favored    11     8  0.30    11  0.20  molprobity     1  True   
264  264  t        -129.2     4.0  Favored     5     6  0.29     8  0.27  molprobity     1  True   
265  265  pt        -60.0   -31.5  Favored    11     8  0.15    11  0.51  molprobity     1  True   
266  266  m-20      -56.9   -22.4  Favored     4     8  0.30    11  0.36  molprobity     1  True   
267  267  m-85      -92.0   -20.3  Favored     9    13  0.29    18  0.30  molprobity     1  True   
268  268  m-85     -111.7   -13.0  Favored     9    13  0.47    18  0.33  molprobity     1  True   
269  269  OUTLIER  -110.9   155.2  Favored     9    13  0.36    18  0.39  molprobity     1  True   
270  270  tp60     -139.5   141.7  Favored     8     9  0.31    12  0.31  molprobity     1  True   
271  271  m         -87.6   126.7  Favored     5     6  0.34     8  0.32  molprobity     ?  False  
272  272  t80      -132.9   138.8  Favored     9    12  0.41    16  0.32  molprobity     ?  False  
273  273  m        -107.5   128.6  Favored     5     6  0.25     8  0.34  molprobity     ?  False  
274  274  m        -117.0   153.3  Favored     9     7  0.39    10  0.40  molprobity     ?  False  
275  275  m             ?       ?  ?           5     4  0.31     4  0.29  molprobity     ?  False  
276  276  ?             ?       ?  ?           ?     ?     ?     ?     ?  ?              ?  True   
277  277  mpp?          ?       ?  ?           8     8  0.53    10  0.41  molprobity     ?  False  
278  278  mt-10     -78.7   169.4  Favored     6     9  0.28    12  0.27  molprobity     ?  False  
279  279  mtm-85   -130.0   133.2  Favored    13    11  0.32    14  0.50  molprobity     ?  False  
280  280  m        -108.2   131.9  Favored     9     7  0.40    10  0.55  molprobity     1  True   
281  281  m-85     -110.8   114.4  Favored     9    13  0.40    18  0.29  molprobity     1  True   
282  282  pt20     -107.5   133.9  Favored     8     9  0.30    12  0.32  molprobity     1  True   
283  283  p         -74.3   134.6  Favored     4     6  0.28     8  0.41  molprobity     1  True   
284  284  mt        -75.2    10.6  Allowed    11     8  0.33    11  0.27  molprobity     1  True   
285  285  tpm_?    -100.9   -60.9  Allowed    13    11  0.30    14  0.39  molprobity     1  True   
286  286  m         -99.5   -17.6  Favored     4     6  0.17     8  0.42  molprobity     1  True   
287  287  ?          80.9    13.8  Favored     3     4  0.26     5  0.35  molprobity     1  True   
288  288  mt        -74.9   127.8  Favored    11     8  0.16    11  0.27  molprobity     1  True   
289  289  p         -94.6   144.0  Favored     7     7  0.27    10  0.52  molprobity     1  True   
290  290  m-85     -125.5   163.3  Favored     9    12  0.42    16  0.35  molprobity     1  True   
291  291  mtt180    -96.2   -39.4  Favored    13    11  0.26    14  0.44  molprobity     1  True   
292  292  p        -111.7   163.6  Favored     7     7  0.27    10  0.50  molprobity     1  True   
293  293  ttmt      -70.9   -27.1  Favored    13     9  0.22    11  0.24  molprobity     1  True   
294  294  mmtt      -67.5   -43.8  Favored    13     9  0.20    11  0.17  molprobity     1  True   
295  295  mt-30     -60.8   -33.7  Favored     8     9  0.23    12  0.34  molprobity     1  True   
296  296  tp        -68.4   -52.6  Favored    11     8  0.21    11  0.34  molprobity     1  True   
297  297  mt        -61.4   -43.2  Favored    11     8  0.15    11  0.32  molprobity     1  True   
298  298  mtp180    -53.9   -49.2  Favored    13    11  0.29    14  0.39  molprobity     1  True   
299  299  t60       -78.1   -46.5  Favored     7    11  0.19    15  0.44  molprobity     1  True   
300  300  mm?       -53.1   -52.5  Favored    11     8  0.30    11  0.22  molprobity     1  True   
301  301  t         -70.5   -48.5  Favored     9     7  0.25    10  0.40  molprobity     1  True   
302  302  t30       -78.1   -55.9  Favored     6     8  0.33    11  0.31  molprobity     1  True   
303  303  m         -84.3   -48.1  Favored     7     7  0.26    10  0.48  molprobity     1  True   
304  304  mm-40     -77.1   -11.7  Favored     6     9  0.62    12  0.88  molprobity     1  True   
305  305  ptpp?      71.4    10.8  Favored    13     9  0.44    11  0.39  molprobity     1  True   
306  306  t         -78.1   131.5  Favored     9     7  0.26    10  0.45  molprobity     1  True   
307  307  t-20      -68.2   140.6  Favored     6     8  0.38    12  0.59  molprobity     1  True   
308  308  Cg_exo    -54.3   -23.2  Favored     7     8  0.29    11  0.38  molprobity     1  True   
309  309  mm?       -87.0   -12.9  Favored    11     8  0.30    11  0.25  molprobity     1  True   
310  310  m        -110.7    -2.3  Favored     5     6  0.17     8  0.23  molprobity     1  True   
311  311  pt        -53.8   -33.5  Favored    11     8  0.22    11  0.61  molprobity     1  True   
312  312  t70       -55.0   -30.5  Favored     4     8  0.21    11  0.33  molprobity     1  True   
313  313  m-85      -82.3   -21.1  Favored     9    13  0.29    18  0.31  molprobity     1  True   
314  314  m-85     -117.1    10.0  Favored     9    13  0.58    18  0.46  molprobity     1  True   
315  315  p90      -127.0   148.6  Favored     9    13  0.38    18  0.42  molprobity     1  True   
316  316  tp60     -123.6   130.4  Favored     8     9  0.38    12  0.33  molprobity     1  True   
317  317  p        -101.1   141.3  Favored     5     6  0.33     8  0.33  molprobity     ?  False  
318  318  t80      -134.6   136.9  Favored     9    12  0.41    16  0.23  molprobity     ?  False  
319  319  p         -98.8   130.8  Favored     5     6  0.34     8  0.23  molprobity     ?  False  
320  320  m         -90.2   151.9  Favored     9     7  0.42    10  0.39  molprobity     ?  False  
321  321  m             ?       ?  ?           5     4  0.28     4  0.36  molprobity     ?  False  
322  322  ?             ?       ?  ?           ?     ?     ?     ?     ?  ?              ?  True   
323  323  mtp           ?       ?  ?           8     8  0.43    10  0.29  molprobity     ?  False  
324  324  mm-40    -112.5   116.3  Favored     6     9  0.28    12  0.32  molprobity     ?  False  
325  325  mtm180    -95.9   100.7  Favored    13    11  0.31    14  0.60  molprobity     ?  False  
326  326  OUTLIER  -101.4   148.2  Favored     9     7  0.30    10  0.46  molprobity     1  True   
327  327  m-85     -113.5   120.7  Favored     9    13  0.32    18  0.34  molprobity     1  True   
328  328  pt20     -113.8   134.8  Favored     8     9  0.30    12  0.33  molprobity     1  True   
329  329  p         -79.3   135.1  Favored     4     6  0.28     8  0.36  molprobity     1  True   
330  330  mt        -78.2     9.2  Favored    11     8  0.31    11  0.27  molprobity     1  True   
331  331  tpm_?     -99.8   -60.9  Allowed    13    11  0.33    14  0.37  molprobity     1  True   
332  332  m         -99.0   -13.4  Favored     4     6  0.07     8  0.36  molprobity     1  True   
333  333  ?          76.9    10.3  Favored     3     4  0.35     5  0.38  molprobity     1  True   
334  334  mt        -70.2   129.7  Favored    11     8  0.21    11  0.24  molprobity     1  True   
335  335  OUTLIER  -109.6   135.1  Favored     7     7  0.33    10  0.67  molprobity     1  True   
336  336  m-85     -121.5   151.7  Favored     9    12  0.48    16  0.34  molprobity     1  True   
337  337  ttm180   -102.4     3.5  Favored    13    11  0.27    14  0.77  molprobity     1  True   
338  338  p        -135.8   137.0  Favored     7     7  0.31    10  0.49  molprobity     1  True   
339  339  ttmp?     -68.6   -31.1  Favored    13     9  0.28    11  0.26  molprobity     1  True   
340  340  mttt      -61.3   -45.4  Favored    13     9  0.21    11  0.26  molprobity     1  True   
341  341  mp0       -66.4   -25.9  Favored     8     9  0.28    12  0.37  molprobity     1  True   
342  342  tp        -68.9   -51.9  Favored    11     8  0.28    11  0.38  molprobity     1  True   
343  343  mt        -65.4   -44.0  Favored    11     8  0.16    11  0.33  molprobity     1  True   
344  344  ptm180    -60.4   -33.0  Favored    13    11  0.24    14  0.48  molprobity     1  True   
345  345  t60       -81.4   -46.8  Favored     7    11  0.21    15  0.29  molprobity     1  True   
346  346  mm?       -51.2   -46.1  Favored    11     8  0.26    11  0.16  molprobity     1  True   
347  347  t         -70.9   -48.5  Favored     9     7  0.23    10  0.40  molprobity     1  True   
348  348  t-20      -71.3   -57.0  Favored     6     8  0.24    11  0.31  molprobity     1  True   
349  349  m         -90.0   -46.7  Favored     7     7  0.25    10  0.49  molprobity     1  True   
350  350  OUTLIER   -81.6   -11.6  Favored     6     9  0.69    12  0.98  molprobity     1  True   
351  351  ptpp?      73.0    10.9  Favored    13     9  0.52    11  0.37  molprobity     1  True   
352  352  t         -87.3   141.9  Favored     9     7  0.30    10  0.57  molprobity     1  True   
353  353  m120      -74.3   140.5  Favored     6     8  0.24    12  0.55  molprobity     1  True   
354  354  Cg_endo   -60.0   -17.2  Favored     7     8  0.21    11  0.33  molprobity     1  True   
355  355  mm?       -87.1   -17.0  Favored    11     8  0.29    11  0.25  molprobity     1  True   
356  356  m        -115.8    19.4  Favored     5     6  0.23     8  0.27  molprobity     1  True   
357  357  pt        -68.8   -16.1  Favored    11     8  0.17    11  0.43  molprobity     1  True   
358  358  m-20      -49.9   -36.6  Favored     4     8  0.31    11  0.47  molprobity     1  True   
359  359  t80       -93.0   -21.5  Favored     9    13  0.29    18  0.27  molprobity     1  True   
360  360  m-85     -108.6    -7.7  Favored     9    13  0.48    18  0.34  molprobity     1  True   
361  361  OUTLIER  -122.9   144.9  Favored     9    13  0.42    18  0.35  molprobity     1  True   
362  362  tp60     -123.1   128.6  Favored     8     9  0.41    12  0.38  molprobity     1  True   
363  363  p         -87.0   126.4  Favored     5     6  0.46     8  0.37  molprobity     ?  False  
364  364  t80      -116.7   135.6  Favored     9    12  0.49    16  0.26  molprobity     ?  False  
365  365  p        -111.8   127.6  Favored     5     6  0.49     8  0.34  molprobity     ?  False  
366  366  p        -124.3   143.2  Favored     9     7  0.40    10  0.31  molprobity     ?  False  
367  367  t             ?       ?  ?           5     4  0.42     4  0.38  molprobity     ?  False  
368  368  ?             ?       ?  ?           ?     ?     ?     ?     ?  ?              ?  True   
369  369  ttp           ?       ?  ?           8     8  0.37    10  0.27  molprobity     ?  False  
370  370  mt-10     -92.3   162.3  Favored     6     9  0.35    12  0.35  molprobity     ?  False  
371  371  mtp180   -121.9   128.4  Favored    13    11  0.33    14  0.27  molprobity     ?  False  
372  372  m        -109.2   155.7  Favored     9     7  0.34    10  0.48  molprobity     1  True   
373  373  m-85     -113.4   133.4  Favored     9    13  0.35    18  0.34  molprobity     1  True   
374  374  pt20     -117.1   138.4  Favored     8     9  0.25    12  0.30  molprobity     1  True   
375  375  p         -77.4   130.0  Favored     4     6  0.33     8  0.48  molprobity     1  True   
376  376  OUTLIER   -70.1     1.2  Favored    11     8  0.24    11  0.40  molprobity     1  True   
377  377  mtm180    -99.4   -55.9  Favored    13    11  0.35    14  0.55  molprobity     1  True   
378  378  m         -99.4    -9.2  Favored     4     6  0.17     8  0.41  molprobity     1  True   
379  379  ?          72.0    28.4  Favored     3     4  0.45     5  0.36  molprobity     1  True   
380  380  mt        -85.2   125.6  Favored    11     8  0.22    11  0.34  molprobity     1  True   
381  381  p         -94.3   145.9  Favored     7     7  0.32    10  0.58  molprobity     1  True   
382  382  m-85     -134.9   147.2  Favored     9    12  0.39    16  0.34  molprobity     1  True   
383  383  mtt180    -92.0   -12.6  Favored    13    11  0.22    14  0.30  molprobity     1  True   
384  384  t        -139.6   153.2  Favored     7     7  0.35    10  0.46  molprobity     1  True   
385  385  mttm      -65.8   -28.4  Favored    13     9  0.26    11  0.33  molprobity     1  True   
386  386  tttt      -61.6   -43.9  Favored    13     9  0.23    11  0.25  molprobity     1  True   
387  387  mt-30     -64.3   -36.4  Favored     8     9  0.23    12  0.45  molprobity     1  True   
388  388  tp        -65.0   -52.7  Favored    11     8  0.25    11  0.35  molprobity     1  True   
389  389  mt        -63.3   -43.0  Favored    11     8  0.18    11  0.28  molprobity     1  True   
390  390  mtp180    -54.2   -46.4  Favored    13    11  0.24    14  0.42  molprobity     1  True   
391  391  t60       -77.2   -46.5  Favored     7    11  0.26    15  0.33  molprobity     1  True   
392  392  mm?       -54.2   -48.3  Favored    11     8  0.27    11  0.22  molprobity     1  True   
393  393  t         -73.7   -45.4  Favored     9     7  0.21    10  0.44  molprobity     1  True   
394  394  m-20      -80.3   -60.6  Favored     6     8  0.28    11  0.25  molprobity     1  True   
395  395  m         -78.9   -41.7  Favored     7     7  0.26    10  0.56  molprobity     1  True   
396  396  mm-40     -87.1    -7.3  Favored     6     9  0.66    12  0.85  molprobity     1  True   
397  397  pttt       49.7    33.2  Favored    13     9  0.36    11  0.49  molprobity     1  True   
398  398  t        -102.7   123.8  Favored     9     7  0.30    10  0.49  molprobity     1  True   
399  399  m-20      -61.6   144.7  Favored     6     8  0.25    12  0.56  molprobity     1  True   
400  400  Cg_exo    -61.3   -19.8  Favored     7     8  0.23    11  0.37  molprobity     1  True   
401  401  mt        -86.6    -5.4  Favored    11     8  0.24    11  0.32  molprobity     1  True   
402  402  m        -120.2    -7.8  Favored     5     6  0.22     8  0.35  molprobity     1  True   
403  403  pt        -62.2   -19.0  Favored    11     8  0.29    11  0.64  molprobity     1  True   
404  404  t70       -47.2   -39.7  Favored     4     8  0.28    11  0.41  molprobity     1  True   
405  405  t80       -88.3   -22.0  Favored     9    13  0.30    18  0.23  molprobity     1  True   
406  406  m-85     -100.0    -4.4  Favored     9    13  0.53    18  0.40  molprobity     1  True   
407  407  p90      -124.4   143.3  Favored     9    13  0.34    18  0.51  molprobity     1  True   
408  408  tt0      -120.9   145.6  Favored     8     9  0.31    12  0.31  molprobity     1  True   
409  409  m        -116.8   134.7  Favored     5     6  0.31     8  0.25  molprobity     ?  False  
410  410  p90      -144.9   148.8  Favored     9    12  0.40    16  0.35  molprobity     ?  False  
411  411  p         -92.3   128.3  Favored     5     6  0.49     8  0.40  molprobity     ?  False  
412  412  p        -108.3  -179.9  Allowed     9     7  0.40    10  0.48  molprobity     ?  False  
413  413  m             ?       ?  ?           5     4  0.35     4  0.35  molprobity     ?  False  
414  414  ?             ?       ?  ?           ?     ?     ?     ?     ?  ?              ?  True   
415  415  ptp           ?       ?  ?           8     8  0.47    10  0.40  molprobity     ?  False  
416  416  tt0      -119.2   141.8  Favored     6     9  0.34    12  0.42  molprobity     ?  False  
417  417  OUTLIER  -100.5   120.8  Favored    13    11  0.29    14  0.42  molprobity     ?  False  
418  418  m        -102.8   131.3  Favored     9     7  0.44    10  0.54  molprobity     1  True   
419  419  m-85     -105.0   117.9  Favored     9    13  0.42    18  0.36  molprobity     1  True   
420  420  mt-30     -99.7   130.2  Favored     8     9  0.37    12  0.42  molprobity     1  True   
421  421  p         -84.4   122.7  Favored     4     6  0.41     8  0.54  molprobity     1  True   
422  422  mt        -74.7    12.1  Allowed    11     8  0.29    11  0.24  molprobity     1  True   
423  423  mmm180   -105.8   -49.2  Favored    13    11  0.34    14  0.44  molprobity     1  True   
424  424  m        -104.0   -15.8  Favored     4     6  0.17     8  0.49  molprobity     1  True   
425  425  ?          80.6    23.8  Favored     3     4  0.31     5  0.35  molprobity     1  True   
426  426  mt        -85.7   136.8  Favored    11     8  0.21    11  0.28  molprobity     1  True   
427  427  p        -103.4   136.3  Favored     7     7  0.34    10  0.54  molprobity     1  True   
428  428  m-85     -122.5   144.3  Favored     9    12  0.46    16  0.33  molprobity     1  True   
429  429  mtp180    -88.6   -22.9  Favored    13    11  0.22    14  0.35  molprobity     1  True   
430  430  p        -125.9   141.8  Favored     7     7  0.36    10  0.61  molprobity     1  True   
431  431  ttpm?     -69.2   -16.8  Favored    13     9  0.28    11  0.41  molprobity     1  True   
432  432  tttp      -66.4   -35.8  Favored    13     9  0.21    11  0.25  molprobity     1  True   
433  433  mt-30     -67.5   -27.2  Favored     8     9  0.27    12  0.53  molprobity     1  True   
434  434  tp        -77.3   -52.7  Favored    11     8  0.30    11  0.34  molprobity     1  True   
435  435  mt        -63.6   -44.3  Favored    11     8  0.12    11  0.33  molprobity     1  True   
436  436  ptt180    -59.0   -35.8  Favored    13    11  0.17    14  0.51  molprobity     1  True   
437  437  t60       -84.2   -45.6  Favored     7    11  0.20    15  0.47  molprobity     1  True   
438  438  mm?       -51.5   -48.3  Favored    11     8  0.29    11  0.17  molprobity     1  True   
439  439  t         -73.2   -44.0  Favored     9     7  0.23    10  0.37  molprobity     1  True   
440  440  t30       -77.1   -50.2  Favored     6     8  0.33    11  0.21  molprobity     1  True   
441  441  m         -90.3   -51.7  Favored     7     7  0.26    10  0.46  molprobity     1  True   
442  442  OUTLIER   -85.2     3.1  Favored     6     9  0.64    12  1.03  molprobity     1  True   
443  443  pttm       51.1    27.7  Favored    13     9  0.39    11  0.40  molprobity     1  True   
444  444  t         -82.1   133.9  Favored     9     7  0.30    10  0.43  molprobity     1  True   
445  445  t-20      -78.5   137.1  Favored     6     8  0.25    12  0.62  molprobity     1  True   
446  446  Cg_exo    -52.7   -21.0  Favored     7     8  0.26    11  0.37  molprobity     1  True   
447  447  mm?       -86.9    -7.8  Favored    11     8  0.30    11  0.25  molprobity     1  True   
448  448  m        -125.1    10.7  Favored     5     6  0.27     8  0.27  molprobity     1  True   
449  449  pt        -56.6   -42.3  Favored    11     8  0.14    11  0.51  molprobity     1  True   
450  450  p-10      -61.5   -21.1  Favored     4     8  0.23    11  0.31  molprobity     1  True   
451  451  t80       -77.9   -21.6  Favored     9    13  0.29    18  0.37  molprobity     1  True   
452  452  m-85     -118.3     1.3  Favored     9    13  0.45    18  0.38  molprobity     1  True   
453  453  p90      -133.7   150.4  Favored     9    13  0.40    18  0.38  molprobity     1  True   
454  454  mt-30    -128.3   130.3  Favored     8     9  0.31    12  0.27  molprobity     1  True   
455  455  m         -88.9   126.3  Favored     5     6  0.32     8  0.22  molprobity     ?  False  
456  456  t80      -122.4   136.5  Favored     9    12  0.38    16  0.23  molprobity     ?  False  
457  457  t         -96.4   128.0  Favored     5     6  0.32     8  0.33  molprobity     ?  False  
458  458  m        -115.9   161.7  Favored     9     7  0.32    10  0.40  molprobity     ?  False  
459  459  m             ?       ?  ?           5     4  0.23     4  0.32  molprobity     ?  False  
460  460  ?             ?       ?  ?           ?     ?     ?     ?     ?  ?              ?  True   
#
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    3  HD3    1  0.43  1.88  
  2    4  HG12   2  0.40  1.93  
  3    6  HB3    3  0.53  1.80  
  4    6  HA     4  0.42  2.14  
  5   10  HB2    5  0.65  1.67  
  6   12  HG     5  0.65  1.67  
  7   12  O      4  0.42  2.14  
  8   13  HG23   3  0.53  1.80  
  9   15  HA     2  0.40  1.93  
 10   24  HA     6  0.49  2.37  
 11   24  HD23   7  0.47  1.85  
 12   24  HD11   8  0.41  1.92  
 13   27  HB     9  0.46  2.10  
 14   28  CG     6  0.49  2.37  
 15   28  HG3    7  0.47  1.85  
 16   28  OE1    9  0.46  2.10  
 17   32  HA    10  0.47  1.85  
 18   35  HG23  10  0.47  1.85  
 19   39  HB3    8  0.41  1.92  
 20   41  HB3    1  0.43  1.88  
 21   50  HB    11  0.70  1.62  
 22   50  HB    12  0.56  2.29  
 23   51  O     13  0.43  2.13  
 24   52  HG3   14  0.58  1.74  
 25   52  CG    15  0.50  2.36  
 26   56  HB2   16  0.41  1.92  
 27   58  HG    16  0.41  1.92  
 28   59  HG22  11  0.70  1.62  
 29   59  HG23  14  0.58  1.74  
 30   59  HG23  15  0.50  2.36  
 31   59  CG2   12  0.56  2.29  
 32   59  HA    13  0.43  2.13  
 33   70  HA    17  0.55  2.32  
 34   70  HA    18  0.42  1.92  
 35   74  CG    17  0.55  2.32  
 36   74  HG2   18  0.42  1.92  
 37   78  O     19  0.43  2.13  
 38   81  HG12  19  0.43  2.13  
 39   96  HG12  20  0.48  1.85  
 40   96  O     21  0.44  2.12  
 41   98  HB3   22  0.47  1.85  
 42  101  HB3   23  0.56  2.00  
 43  101  HG3   24  0.42  2.55  
 44  102  HB2   25  0.49  1.84  
 45  102  SG    24  0.42  2.55  
 46  104  HG    25  0.49  1.84  
 47  105  HG23  22  0.47  1.85  
 48  107  HA    20  0.48  1.85  
 49  109  O     26  0.43  2.13  
 50  109  O     27  0.40  2.16  
 51  112  HB3   27  0.40  2.16  
 52  113  O     28  0.54  2.01  
 53  113  HG12  26  0.43  2.13  
 54  116  HA    29  0.56  2.30  
 55  116  HA    30  0.44  1.89  
 56  117  HG22  28  0.54  2.01  
 57  117  O     31  0.47  2.10  
 58  120  CG    29  0.56  2.30  
 59  120  OE2   23  0.56  2.00  
 60  120  HG2   30  0.44  1.89  
 61  121  HA    31  0.47  2.10  
 62  123  OD1   32  0.48  2.08  
 63  124  HD2   32  0.48  2.08  
 64  128  HA    33  0.45  2.46  
 65  131  CE2   33  0.45  2.46  
 66  133  HA    21  0.44  2.12  
 67  141  HA    34  0.50  1.83  
 68  142  O     35  0.50  2.07  
 69  143  HA    36  0.94  1.39  
 70  143  CA    37  0.48  2.28  
 71  144  HA    38  0.52  2.04  
 72  144  HG2   39  0.49  2.07  
 73  147  HB3   40  0.56  2.00  
 74  147  HG3   41  0.41  2.55  
 75  148  HB2   42  0.54  1.79  
 76  148  SG    41  0.41  2.55  
 77  150  HG    42  0.54  1.79  
 78  150  O     38  0.52  2.04  
 79  162  HA    43  0.57  2.30  
 80  162  HA    44  0.42  1.91  
 81  166  CG    43  0.57  2.30  
 82  166  OE1   40  0.56  2.00  
 83  166  HG2   44  0.42  1.91  
 84  174  HA    45  0.65  2.26  
 85  177  CE2   45  0.65  2.26  
 86  178  O     39  0.49  2.07  
 87  179  HB2   36  0.94  1.39  
 88  179  HB2   37  0.48  2.28  
 89  179  HB3   35  0.50  2.07  
 90  181  HA    34  0.50  1.83  
 91  190  HB3   46  0.54  1.80  
 92  190  HA    47  0.42  2.14  
 93  193  HB3   48  0.52  2.05  
 94  193  HG3   49  0.43  2.52  
 95  194  HB2   50  0.51  1.82  
 96  194  SG    49  0.43  2.52  
 97  196  HG    50  0.51  1.82  
 98  196  O     47  0.42  2.14  
 99  197  HG23  46  0.54  1.80  
100  208  HA    51  0.54  2.33  
101  212  CG    51  0.54  2.33  
102  212  OE1   48  0.52  2.05  
103  212  O     52  0.45  2.12  
104  213  HG2   52  0.45  2.12  
105  220  HA    53  0.49  2.42  
106  223  CE2   53  0.49  2.42  
107  236  HB3   54  0.47  1.85  
108  236  HA    55  0.41  2.15  
109  239  HH21  56  0.42  1.74  
110  240  HB2   57  0.55  1.79  
111  242  HG    57  0.55  1.79  
112  242  O     55  0.41  2.15  
113  243  HG22  54  0.47  1.85  
114  254  HA    58  0.47  2.40  
115  255  HA    59  0.44  2.13  
116  258  CG    58  0.47  2.40  
117  258  HB2   60  0.44  1.88  
118  258  O     61  0.43  2.13  
119  259  HG2   61  0.43  2.13  
120  260  HG23  60  0.44  1.88  
121  260  O     59  0.44  2.13  
122  268  HA    56  0.42  1.74  
123  282  HA    62  0.53  2.04  
124  285  HB3   63  0.49  2.08  
125  286  HB2   64  0.59  1.74  
126  288  HG    64  0.59  1.74  
127  288  O     62  0.53  2.04  
128  290  HZ    65  0.41  2.33  
129  299  CD2   65  0.41  2.33  
130  300  HA    66  0.51  2.36  
131  301  HA    67  0.53  2.03  
132  304  CG    66  0.51  2.36  
133  304  OE2   63  0.49  2.08  
134  304  O     68  0.47  2.09  
135  305  HG2   68  0.47  2.09  
136  306  O     67  0.53  2.03  
137  312  HA    69  0.49  2.43  
138  315  CE2   69  0.49  2.43  
139  324  HB2   70  0.42  2.45  
140  326  HB    71  0.67  1.65  
141  326  HB    72  0.46  2.38  
142  328  HB3   73  0.44  1.89  
143  331  HB3   74  0.53  2.04  
144  332  HB2   75  0.49  1.84  
145  334  HG    75  0.49  1.84  
146  335  HG22  71  0.67  1.65  
147  335  CG2   72  0.46  2.38  
148  335  HG23  73  0.44  1.89  
149  346  HA    76  0.55  2.31  
150  346  HA    77  0.43  1.89  
151  350  CG    76  0.55  2.31  
152  350  OE1   74  0.53  2.04  
153  350  O     78  0.45  2.12  
154  350  HG2   77  0.43  1.89  
155  351  HG2   78  0.45  2.12  
156  366  CG1   70  0.42  2.45  
157  374  HA    79  0.49  2.08  
158  376  HD21  80  0.47  1.86  
159  378  HB2   81  0.61  1.72  
160  380  HG    81  0.61  1.72  
161  380  O     79  0.49  2.08  
162  392  HA    82  0.51  2.35  
163  393  O     83  0.42  2.14  
164  396  CG    82  0.51  2.35  
165  397  HA    83  0.42  2.14  
166  408  HB2   80  0.47  1.86  
167  412  HG22  84  0.50  1.67  
168  412  HG22  85  0.42  2.30  
169  413  H     84  0.50  1.67  
170  413  N     85  0.42  2.30  
171  418  HA    86  0.45  2.11  
172  420  HG2   87  0.67  1.65  
173  420  HA    88  0.47  2.10  
174  424  HB2   89  0.60  1.73  
175  426  HG    89  0.60  1.73  
176  426  O     88  0.47  2.10  
177  427  HG22  87  0.67  1.65  
178  428  O     86  0.45  2.11  
179  428  HZ    90  0.42  2.33  
180  428  HB3   91  0.40  1.91  
181  433  HB2   91  0.40  1.91  
182  437  CD2   90  0.42  2.33  
183  438  HA    92  0.50  2.37  
184  442  CG    92  0.50  2.37  
185  442  HB2   93  0.48  1.84  
186  444  HG23  93  0.48  1.84  
#
loop_
_pdbx_vrpt_model_list.PDB_model_num
_pdbx_vrpt_model_list.nmrclust_cluster_id
_pdbx_vrpt_model_list.nmrclust_representative
 1  2        ?     
 2  2        True  
 3  1        ?     
 4  outlier  ?     
 5  1        ?     
 6  1        True  
 7  1        ?     
 8  outlier  ?     
 9  2        ?     
10  1        ?     
#
_pdbx_vrpt_cyrange_domain.ordinal             1
_pdbx_vrpt_cyrange_domain.domain              1
_pdbx_vrpt_cyrange_domain.number_of_gaps      0
_pdbx_vrpt_cyrange_domain.number_of_residues  37
_pdbx_vrpt_cyrange_domain.percentage_of_core  100.00
_pdbx_vrpt_cyrange_domain.rmsd                0.290
_pdbx_vrpt_cyrange_domain.medoid_model        9
_pdbx_vrpt_cyrange_domain.medoid_rmsd         0.381
_pdbx_vrpt_cyrange_domain.residue_string      A:10-A:46
#
_pdbx_vrpt_chemical_shift_list.ordinal                           1
_pdbx_vrpt_chemical_shift_list.file_id                           5
_pdbx_vrpt_chemical_shift_list.file_name                         working_cs.cif
_pdbx_vrpt_chemical_shift_list.block_name                        assigned_chem_shift_list_1
_pdbx_vrpt_chemical_shift_list.list_id                           1
_pdbx_vrpt_chemical_shift_list.type                              full
_pdbx_vrpt_chemical_shift_list.number_of_errors_while_mapping    170
_pdbx_vrpt_chemical_shift_list.number_of_warnings_while_mapping  0
_pdbx_vrpt_chemical_shift_list.number_of_mapped_shifts           568
_pdbx_vrpt_chemical_shift_list.number_of_parsed_shifts           738
_pdbx_vrpt_chemical_shift_list.total_number_of_shifts            738
_pdbx_vrpt_chemical_shift_list.number_of_unparsed_shifts         0
#
loop_
_pdbx_vrpt_unmapped_chemical_shift.ordinal
_pdbx_vrpt_unmapped_chemical_shift.auth_asym_id
_pdbx_vrpt_unmapped_chemical_shift.rescode
_pdbx_vrpt_unmapped_chemical_shift.auth_seq_id
_pdbx_vrpt_unmapped_chemical_shift.label_atom_id
_pdbx_vrpt_unmapped_chemical_shift.value
_pdbx_vrpt_unmapped_chemical_shift.error
_pdbx_vrpt_unmapped_chemical_shift.ambiguity
_pdbx_vrpt_unmapped_chemical_shift.diagnostic
  1  A  MET   1  HA      4.524  0.02  1  "No matching atoms found in structure"  
  2  A  MET   1  HG2     2.525  0.02  2  "No matching atoms found in structure"  
  3  A  MET   1  HG3     2.525  0.02  2  "No matching atoms found in structure"  
  4  A  MET   1  HE1     1.997  0.02  1  "No matching atoms found in structure"  
  5  A  MET   1  HE2     1.997  0.02  1  "No matching atoms found in structure"  
  6  A  MET   1  HE3     1.997  0.02  1  "No matching atoms found in structure"  
  7  A  MET   1  C     175.700  0.35  1  "No matching atoms found in structure"  
  8  A  MET   1  CA     54.220  0.35  1  "No matching atoms found in structure"  
  9  A  MET   1  CB     33.240  0.35  1  "No matching atoms found in structure"  
 10  A  MET   1  CG     31.833  0.35  1  "No matching atoms found in structure"  
 11  A  MET   1  CE     17.118  0.35  1  "No matching atoms found in structure"  
 12  A  ILE   2  H       8.256  0.02  1  "No matching atoms found in structure"  
 13  A  ILE   2  HA      4.120  0.02  1  "No matching atoms found in structure"  
 14  A  ILE   2  HB      1.807  0.02  1  "No matching atoms found in structure"  
 15  A  ILE   2  HG12    1.159  0.02  2  "No matching atoms found in structure"  
 16  A  ILE   2  HG13    1.450  0.02  2  "No matching atoms found in structure"  
 17  A  ILE   2  HG21    0.905  0.02  1  "No matching atoms found in structure"  
 18  A  ILE   2  HG22    0.905  0.02  1  "No matching atoms found in structure"  
 19  A  ILE   2  HG23    0.905  0.02  1  "No matching atoms found in structure"  
 20  A  ILE   2  HD11    0.837  0.02  1  "No matching atoms found in structure"  
 21  A  ILE   2  HD12    0.837  0.02  1  "No matching atoms found in structure"  
 22  A  ILE   2  HD13    0.837  0.02  1  "No matching atoms found in structure"  
 23  A  ILE   2  C     175.800  0.35  1  "No matching atoms found in structure"  
 24  A  ILE   2  CA     61.140  0.35  1  "No matching atoms found in structure"  
 25  A  ILE   2  CB     38.920  0.35  1  "No matching atoms found in structure"  
 26  A  ILE   2  CG1    27.268  0.35  1  "No matching atoms found in structure"  
 27  A  ILE   2  CG2    17.485  0.35  1  "No matching atoms found in structure"  
 28  A  ILE   2  CD1    12.864  0.35  1  "No matching atoms found in structure"  
 29  A  ILE   2  N     122.759  0.15  1  "No matching atoms found in structure"  
 30  A  GLU   3  H       8.539  0.02  1  "No matching atoms found in structure"  
 31  A  GLU   3  HA      4.340  0.02  1  "No matching atoms found in structure"  
 32  A  GLU   3  HB2     1.921  0.02  2  "No matching atoms found in structure"  
 33  A  GLU   3  HB3     2.015  0.02  2  "No matching atoms found in structure"  
 34  A  GLU   3  HG2     2.214  0.02  2  "No matching atoms found in structure"  
 35  A  GLU   3  HG3     2.214  0.02  2  "No matching atoms found in structure"  
 36  A  GLU   3  C     176.300  0.35  1  "No matching atoms found in structure"  
 37  A  GLU   3  CA     56.340  0.35  1  "No matching atoms found in structure"  
 38  A  GLU   3  CB     30.490  0.35  1  "No matching atoms found in structure"  
 39  A  GLU   3  CG     36.301  0.35  1  "No matching atoms found in structure"  
 40  A  GLU   3  N     125.788  0.15  1  "No matching atoms found in structure"  
 41  A  VAL   4  H       8.278  0.02  1  "No matching atoms found in structure"  
 42  A  VAL   4  HA      4.123  0.02  1  "No matching atoms found in structure"  
 43  A  VAL   4  HB      2.160  0.02  1  "No matching atoms found in structure"  
 44  A  VAL   4  HG11    0.920  0.02  2  "No matching atoms found in structure"  
 45  A  VAL   4  HG12    0.920  0.02  2  "No matching atoms found in structure"  
 46  A  VAL   4  HG13    0.920  0.02  2  "No matching atoms found in structure"  
 47  A  VAL   4  HG21    0.920  0.02  2  "No matching atoms found in structure"  
 48  A  VAL   4  HG22    0.920  0.02  2  "No matching atoms found in structure"  
 49  A  VAL   4  HG23    0.920  0.02  2  "No matching atoms found in structure"  
 50  A  VAL   4  C     175.700  0.35  1  "No matching atoms found in structure"  
 51  A  VAL   4  CA     62.414  0.35  1  "No matching atoms found in structure"  
 52  A  VAL   4  CB     32.370  0.35  1  "No matching atoms found in structure"  
 53  A  VAL   4  CG1    21.010  0.35  2  "No matching atoms found in structure"  
 54  A  VAL   4  CG2    21.010  0.35  2  "No matching atoms found in structure"  
 55  A  VAL   4  N     122.096  0.15  1  "No matching atoms found in structure"  
 56  A  SER   5  H       7.514  0.02  1  "No matching atoms found in structure"  
 57  A  SER   5  N     110.841  0.15  1  "No matching atoms found in structure"  
 58  A  LEU  52  H       8.423  0.02  1  "No matching atoms found in structure"  
 59  A  LEU  52  HA      4.226  0.02  1  "No matching atoms found in structure"  
 60  A  LEU  52  HB2     1.572  0.02  2  "No matching atoms found in structure"  
 61  A  LEU  52  HB3     1.572  0.02  2  "No matching atoms found in structure"  
 62  A  LEU  52  HG      1.723  0.02  1  "No matching atoms found in structure"  
 63  A  LEU  52  HD11    0.802  0.02  2  "No matching atoms found in structure"  
 64  A  LEU  52  HD12    0.802  0.02  2  "No matching atoms found in structure"  
 65  A  LEU  52  HD13    0.802  0.02  2  "No matching atoms found in structure"  
 66  A  LEU  52  HD21    0.802  0.02  2  "No matching atoms found in structure"  
 67  A  LEU  52  HD22    0.802  0.02  2  "No matching atoms found in structure"  
 68  A  LEU  52  HD23    0.802  0.02  2  "No matching atoms found in structure"  
 69  A  LEU  52  C     177.600  0.35  1  "No matching atoms found in structure"  
 70  A  LEU  52  CA     56.070  0.35  1  "No matching atoms found in structure"  
 71  A  LEU  52  CB     42.170  0.35  1  "No matching atoms found in structure"  
 72  A  LEU  52  CG     27.003  0.35  1  "No matching atoms found in structure"  
 73  A  LEU  52  CD1    23.600  0.35  2  "No matching atoms found in structure"  
 74  A  LEU  52  CD2    23.600  0.35  2  "No matching atoms found in structure"  
 75  A  LEU  52  N     125.326  0.15  1  "No matching atoms found in structure"  
 76  A  LYS  53  H       8.126  0.02  1  "No matching atoms found in structure"  
 77  A  LYS  53  HA      4.194  0.02  1  "No matching atoms found in structure"  
 78  A  LYS  53  HB2     1.728  0.02  2  "No matching atoms found in structure"  
 79  A  LYS  53  HB3     1.728  0.02  2  "No matching atoms found in structure"  
 80  A  LYS  53  HG2     1.344  0.02  2  "No matching atoms found in structure"  
 81  A  LYS  53  HG3     1.344  0.02  2  "No matching atoms found in structure"  
 82  A  LYS  53  HD2     1.625  0.02  2  "No matching atoms found in structure"  
 83  A  LYS  53  HD3     1.625  0.02  2  "No matching atoms found in structure"  
 84  A  LYS  53  C     176.400  0.35  1  "No matching atoms found in structure"  
 85  A  LYS  53  CA     56.940  0.35  1  "No matching atoms found in structure"  
 86  A  LYS  53  CB     32.910  0.35  1  "No matching atoms found in structure"  
 87  A  LYS  53  CG     24.473  0.35  1  "No matching atoms found in structure"  
 88  A  LYS  53  N     119.682  0.15  1  "No matching atoms found in structure"  
 89  A  ASP  54  H       8.057  0.02  1  "No matching atoms found in structure"  
 90  A  ASP  54  HA      4.616  0.02  1  "No matching atoms found in structure"  
 91  A  ASP  54  HB2     2.578  0.02  2  "No matching atoms found in structure"  
 92  A  ASP  54  HB3     2.711  0.02  2  "No matching atoms found in structure"  
 93  A  ASP  54  C     176.700  0.35  1  "No matching atoms found in structure"  
 94  A  ASP  54  CA     54.620  0.35  1  "No matching atoms found in structure"  
 95  A  ASP  54  CB     41.400  0.35  1  "No matching atoms found in structure"  
 96  A  ASP  54  N     120.232  0.15  1  "No matching atoms found in structure"  
 97  A  VAL  55  H       7.869  0.02  1  "No matching atoms found in structure"  
 98  A  VAL  55  HA      3.950  0.02  1  "No matching atoms found in structure"  
 99  A  VAL  55  HB      2.102  0.02  1  "No matching atoms found in structure"  
100  A  VAL  55  HG11    0.890  0.02  2  "No matching atoms found in structure"  
101  A  VAL  55  HG12    0.890  0.02  2  "No matching atoms found in structure"  
102  A  VAL  55  HG13    0.890  0.02  2  "No matching atoms found in structure"  
103  A  VAL  55  HG21    0.870  0.02  2  "No matching atoms found in structure"  
104  A  VAL  55  HG22    0.870  0.02  2  "No matching atoms found in structure"  
105  A  VAL  55  HG23    0.870  0.02  2  "No matching atoms found in structure"  
106  A  VAL  55  C     176.400  0.35  1  "No matching atoms found in structure"  
107  A  VAL  55  CA     63.240  0.35  1  "No matching atoms found in structure"  
108  A  VAL  55  CB     32.290  0.35  1  "No matching atoms found in structure"  
109  A  VAL  55  CG1    20.840  0.35  2  "No matching atoms found in structure"  
110  A  VAL  55  CG2    20.840  0.35  2  "No matching atoms found in structure"  
111  A  VAL  55  N     119.586  0.15  1  "No matching atoms found in structure"  
112  A  ASN  56  H       8.308  0.02  1  "No matching atoms found in structure"  
113  A  ASN  56  HA      4.652  0.02  1  "No matching atoms found in structure"  
114  A  ASN  56  HB2     2.700  0.02  2  "No matching atoms found in structure"  
115  A  ASN  56  HB3     2.781  0.02  2  "No matching atoms found in structure"  
116  A  ASN  56  HD21    6.876  0.02  2  "No matching atoms found in structure"  
117  A  ASN  56  HD22    7.600  0.02  2  "No matching atoms found in structure"  
118  A  ASN  56  C     174.900  0.35  1  "No matching atoms found in structure"  
119  A  ASN  56  CA     53.660  0.35  1  "No matching atoms found in structure"  
120  A  ASN  56  CB     38.820  0.35  1  "No matching atoms found in structure"  
121  A  ASN  56  N     119.722  0.15  1  "No matching atoms found in structure"  
122  A  ASN  56  ND2   112.966  0.15  1  "No matching atoms found in structure"  
123  A  LYS  57  H       7.912  0.02  1  "No matching atoms found in structure"  
124  A  LYS  57  HA      4.280  0.02  1  "No matching atoms found in structure"  
125  A  LYS  57  HB2     1.720  0.02  2  "No matching atoms found in structure"  
126  A  LYS  57  HB3     1.807  0.02  2  "No matching atoms found in structure"  
127  A  LYS  57  HG2     1.349  0.02  2  "No matching atoms found in structure"  
128  A  LYS  57  HG3     1.349  0.02  2  "No matching atoms found in structure"  
129  A  LYS  57  C     175.900  0.35  1  "No matching atoms found in structure"  
130  A  LYS  57  CA     56.310  0.35  1  "No matching atoms found in structure"  
131  A  LYS  57  CB     33.170  0.35  1  "No matching atoms found in structure"  
132  A  LYS  57  CG     24.725  0.35  1  "No matching atoms found in structure"  
133  A  LYS  57  CD     29.085  0.35  1  "No matching atoms found in structure"  
134  A  LYS  57  CE     42.161  0.35  1  "No matching atoms found in structure"  
135  A  LYS  57  N     120.734  0.15  1  "No matching atoms found in structure"  
136  A  ILE  58  H       8.031  0.02  1  "No matching atoms found in structure"  
137  A  ILE  58  HA      4.120  0.02  1  "No matching atoms found in structure"  
138  A  ILE  58  HB      1.831  0.02  1  "No matching atoms found in structure"  
139  A  ILE  58  HG12    1.119  0.02  2  "No matching atoms found in structure"  
140  A  ILE  58  HG13    1.434  0.02  2  "No matching atoms found in structure"  
141  A  ILE  58  HG21    0.842  0.02  1  "No matching atoms found in structure"  
142  A  ILE  58  HG22    0.842  0.02  1  "No matching atoms found in structure"  
143  A  ILE  58  HG23    0.842  0.02  1  "No matching atoms found in structure"  
144  A  ILE  58  HD11    0.789  0.02  1  "No matching atoms found in structure"  
145  A  ILE  58  HD12    0.789  0.02  1  "No matching atoms found in structure"  
146  A  ILE  58  HD13    0.789  0.02  1  "No matching atoms found in structure"  
147  A  ILE  58  C     175.100  0.35  1  "No matching atoms found in structure"  
148  A  ILE  58  CA     61.350  0.35  1  "No matching atoms found in structure"  
149  A  ILE  58  CB     38.510  0.35  1  "No matching atoms found in structure"  
150  A  ILE  58  CG1    27.183  0.35  1  "No matching atoms found in structure"  
151  A  ILE  58  CG2    17.530  0.35  1  "No matching atoms found in structure"  
152  A  ILE  58  CD1    12.843  0.35  1  "No matching atoms found in structure"  
153  A  ILE  58  N     122.483  0.15  1  "No matching atoms found in structure"  
154  A  ILE  59  H       7.686  0.02  1  "No matching atoms found in structure"  
155  A  ILE  59  HA      4.020  0.02  1  "No matching atoms found in structure"  
156  A  ILE  59  HB      1.759  0.02  1  "No matching atoms found in structure"  
157  A  ILE  59  HG12    1.087  0.02  2  "No matching atoms found in structure"  
158  A  ILE  59  HG13    1.371  0.02  2  "No matching atoms found in structure"  
159  A  ILE  59  HG21    0.829  0.02  1  "No matching atoms found in structure"  
160  A  ILE  59  HG22    0.829  0.02  1  "No matching atoms found in structure"  
161  A  ILE  59  HG23    0.829  0.02  1  "No matching atoms found in structure"  
162  A  ILE  59  HD11    0.790  0.02  1  "No matching atoms found in structure"  
163  A  ILE  59  HD12    0.790  0.02  1  "No matching atoms found in structure"  
164  A  ILE  59  HD13    0.790  0.02  1  "No matching atoms found in structure"  
165  A  ILE  59  CA     62.860  0.35  1  "No matching atoms found in structure"  
166  A  ILE  59  CB     39.620  0.35  1  "No matching atoms found in structure"  
167  A  ILE  59  CG1    27.140  0.35  1  "No matching atoms found in structure"  
168  A  ILE  59  CG2    17.700  0.35  1  "No matching atoms found in structure"  
169  A  ILE  59  CD1    13.195  0.35  1  "No matching atoms found in structure"  
170  A  ILE  59  N     129.371  0.15  1  "No matching atoms found in structure"  
#
loop_
_pdbx_vrpt_random_coil_index.ordinal
_pdbx_vrpt_random_coil_index.auth_asym_id
_pdbx_vrpt_random_coil_index.rescode
_pdbx_vrpt_random_coil_index.auth_seq_id
_pdbx_vrpt_random_coil_index.value
 1  A  MET   1  0.366  
 2  A  VAL  10  0.034  
 3  A  TYR  11  0.024  
 4  A  GLN  12  0.021  
 5  A  CYS  13  0.025  
 6  A  LEU  14  0.033  
 7  A  ARG  15  0.038  
 8  A  CYS  16  0.037  
 9  A  GLY  17  0.032  
10  A  LEU  18  0.026  
11  A  THR  19  0.022  
12  A  ILE   2  0.329  
13  A  PHE  20  0.020  
14  A  ARG  21  0.018  
15  A  THR  22  0.015  
16  A  LYS  23  0.013  
17  A  LYS  24  0.013  
18  A  GLN  25  0.013  
19  A  LEU  26  0.013  
20  A  ILE  27  0.013  
21  A  ARG  28  0.013  
22  A  HIS  29  0.014  
23  A  GLU   3  0.237  
24  A  LEU  30  0.018  
25  A  VAL  31  0.023  
26  A  ASN  32  0.030  
27  A  THR  33  0.032  
28  A  GLU  34  0.035  
29  A  LYS  35  0.037  
30  A  VAL  36  0.047  
31  A  ASN  37  0.057  
32  A  PRO  38  0.059  
33  A  LEU  39  0.051  
34  A  VAL   4  0.144  
35  A  SER  40  0.037  
36  A  ILE  41  0.027  
37  A  ASP  42  0.024  
38  A  TYR  43  0.022  
39  A  TYR  44  0.019  
40  A  TYR  45  0.015  
41  A  GLN  46  0.015  
42  A  SER  47  0.020  
43  A  PHE  48  0.027  
44  A  SER  49  0.039  
45  A  SER   5  0.074  
46  A  VAL  50  0.058  
47  A  SER  51  0.110  
48  A  LEU  52  0.122  
49  A  LYS  53  0.123  
50  A  ASP  54  0.084  
51  A  VAL  55  0.103  
52  A  ASN  56  0.130  
53  A  LYS  57  0.177  
54  A  ILE  58  0.206  
55  A  ILE  59  0.226  
56  A  MET   7  0.063  
57  A  GLU   8  0.065  
58  A  ARG   9  0.049  
#
loop_
_pdbx_vrpt_referencing_offset.ordinal
_pdbx_vrpt_referencing_offset.label_atom_id
_pdbx_vrpt_referencing_offset.uncertainty
_pdbx_vrpt_referencing_offset.precision
_pdbx_vrpt_referencing_offset.value
_pdbx_vrpt_referencing_offset.number_of_measurements
1  C   0.50  0.18  -0.04  54  
2  CA  0.50  0.20  -0.45  57  
3  CB  0.50  0.30   0.00  56  
4  N   0.50  0.73   2.12  54  
#
loop_
_pdbx_vrpt_assign_completeness_well_defined.ordinal
_pdbx_vrpt_assign_completeness_well_defined.number_of_assigned_shifts
_pdbx_vrpt_assign_completeness_well_defined.number_of_unassigned_shifts
_pdbx_vrpt_assign_completeness_well_defined.number_of_shifts
_pdbx_vrpt_assign_completeness_well_defined.type
_pdbx_vrpt_assign_completeness_well_defined.element
 1    0   8    8  stereomethyl  stereomethyl  
 2  481  79  560  overall       Total         
 3  180   4  184  backbone      Total         
 4  257  66  323  sidechain     Total         
 5   44   9   53  aromatic      Total         
 6  264  44  308  overall       H             
 7   73   1   74  backbone      H             
 8  169  40  209  sidechain     H             
 9   22   3   25  aromatic      H             
10  178  20  198  overall       C             
11   72   2   74  backbone      C             
12   84  13   97  sidechain     C             
13   22   5   27  aromatic      C             
14   39  15   54  overall       N             
15   35   1   36  backbone      N             
16    4  13   17  sidechain     N             
17    0   1    1  aromatic      N             
#
loop_
_pdbx_vrpt_assign_completeness_full_length.ordinal
_pdbx_vrpt_assign_completeness_full_length.number_of_assigned_shifts
_pdbx_vrpt_assign_completeness_full_length.number_of_unassigned_shifts
_pdbx_vrpt_assign_completeness_full_length.number_of_shifts
_pdbx_vrpt_assign_completeness_full_length.type
_pdbx_vrpt_assign_completeness_full_length.element
 1    0   9    9  stereomethyl  stereomethyl  
 2  568  99  667  overall       Total         
 3  218   6  224  backbone      Total         
 4  298  82  380  sidechain     Total         
 5   52  11   63  aromatic      Total         
 6  309  57  366  overall       H             
 7   88   2   90  backbone      H             
 8  195  51  246  sidechain     H             
 9   26   4   30  aromatic      H             
10  213  23  236  overall       C             
11   88   2   90  backbone      C             
12   99  15  114  sidechain     C             
13   26   6   32  aromatic      C             
14   46  19   65  overall       N             
15   42   2   44  backbone      N             
16    4  16   20  sidechain     N             
17    0   1    1  aromatic      N             
#
loop_
_pdbx_vrpt_restraint_summary.ordinal
_pdbx_vrpt_restraint_summary.description
_pdbx_vrpt_restraint_summary.value
 1  "Total distance restraints"                     978  
 2  "Intra-residue (|i-j|=0)"                       387  
 3  "Sequential (|i-j|=1)"                          193  
 4  "Medium range (|i-j|>1 and |i-j|<5)"            171  
 5  "Long range (|i-j|>=5)"                         208  
 6  Inter-chain                                       0  
 7  "Total hydrogen bond restraints"                 19  
 8  "Total disulfide bond restraints"                 0  
 9  "Total dihedral-angle restraints"                77  
10  "Number of unmapped restraints"                   0  
11  "Number of restraints per residue"             17.9  
12  "Number of long range restraints per residue"   3.7  
#
loop_
_pdbx_vrpt_distance_violation_summary.ordinal
_pdbx_vrpt_distance_violation_summary.restraint_type
_pdbx_vrpt_distance_violation_summary.restraint_sub_type
_pdbx_vrpt_distance_violation_summary.restraints_count
_pdbx_vrpt_distance_violation_summary.percent_total
_pdbx_vrpt_distance_violation_summary.consistently_violated_count
_pdbx_vrpt_distance_violation_summary.consistently_violated_percent_total
_pdbx_vrpt_distance_violation_summary.consistently_violated_percent_type
_pdbx_vrpt_distance_violation_summary.violated_count
_pdbx_vrpt_distance_violation_summary.violated_percent_total
_pdbx_vrpt_distance_violation_summary.violated_percent_type
 1  Intra-residue  all                 387   39.6   5  0.5  1.3   31   3.2   8.0  
 2  Intra-residue  BackboneBackbone     39    4.0   0  0.0  0.0    0   0.0   0.0  
 3  Intra-residue  BackboneSidechain   213   21.8   5  0.5  2.3   25   2.6  11.7  
 4  Intra-residue  SidechainSidechain  135   13.8   0  0.0  0.0    6   0.6   4.4  
 5  Sequential     all                 193   19.7   3  0.3  1.6   15   1.5   7.8  
 6  Sequential     BackboneBackbone     66    6.7   0  0.0  0.0    0   0.0   0.0  
 7  Sequential     BackboneSidechain   113   11.6   3  0.3  2.7   12   1.2  10.6  
 8  Sequential     SidechainSidechain   14    1.4   0  0.0  0.0    3   0.3  21.4  
 9  MediumRange    all                 171   17.5   1  0.1  0.6   18   1.8  10.5  
10  MediumRange    BackboneBackbone     48    4.9   0  0.0  0.0    0   0.0   0.0  
11  MediumRange    BackboneSidechain    90    9.2   1  0.1  1.1   10   1.0  11.1  
12  MediumRange    SidechainSidechain   33    3.4   0  0.0  0.0    8   0.8  24.2  
13  LongRange      all                 208   21.3   3  0.3  1.4   40   4.1  19.2  
14  LongRange      BackboneBackbone     29    3.0   0  0.0  0.0    1   0.1   3.4  
15  LongRange      BackboneSidechain    87    8.9   0  0.0  0.0   14   1.4  16.1  
16  LongRange      SidechainSidechain   92    9.4   3  0.3  3.3   25   2.6  27.2  
17  InterChain     all                   0    0.0   0  0.0  0.0    0   0.0   0.0  
18  InterChain     BackboneBackbone      0    0.0   0  0.0  0.0    0   0.0   0.0  
19  InterChain     BackboneSidechain     0    0.0   0  0.0  0.0    0   0.0   0.0  
20  InterChain     SidechainSidechain    0    0.0   0  0.0  0.0    0   0.0   0.0  
21  HydrogenBond   all                  19    1.9   0  0.0  0.0    2   0.2  10.5  
22  DisulfideBond  all                   0    0.0   0  0.0  0.0    0   0.0   0.0  
23  Total          all                 978  100.0  12  1.2  1.2  104  10.6  10.6  
24  Total          BackboneBackbone    182   18.6   0  0.0  0.0    1   0.1   0.5  
25  Total          BackboneSidechain   503   51.4   9  0.9  1.8   61   6.2  12.1  
26  Total          SidechainSidechain  274   28.0   3  0.3  1.1   42   4.3  15.3  
#
loop_
_pdbx_vrpt_distance_violation_model_summary.ordinal
_pdbx_vrpt_distance_violation_model_summary.PDB_model_num
_pdbx_vrpt_distance_violation_model_summary.max_violation
_pdbx_vrpt_distance_violation_model_summary.mean_violation
_pdbx_vrpt_distance_violation_model_summary.median_violation
_pdbx_vrpt_distance_violation_model_summary.standard_deviation
 1   1  1.72  0.52  0.39  0.41  
 2   2  1.65  0.52  0.31  0.41  
 3   3  2.16  0.60  0.37  0.52  
 4   4  1.40  0.50  0.33  0.38  
 5   5  1.89  0.71  0.58  0.45  
 6   6  1.42  0.52  0.40  0.35  
 7   7  1.73  0.54  0.42  0.38  
 8   8  1.45  0.47  0.33  0.35  
 9   9  1.12  0.46  0.34  0.31  
10  10  2.11  0.55  0.46  0.41  
#
loop_
_pdbx_vrpt_distance_violation_model_restraints.ordinal
_pdbx_vrpt_distance_violation_model_restraints.PDB_model_num
_pdbx_vrpt_distance_violation_model_restraints.dist_rest_type
_pdbx_vrpt_distance_violation_model_restraints.violations_count
 1   1  intraresidue  15  
 2   1  sequential     6  
 3   1  medium         8  
 4   1  long          10  
 5   1  interchain     0  
 6   1  total         39  
 7   2  intraresidue  16  
 8   2  sequential     6  
 9   2  medium         6  
10   2  long          18  
11   2  interchain     0  
12   2  total         46  
13   3  intraresidue  14  
14   3  sequential     8  
15   3  medium         9  
16   3  long          17  
17   3  interchain     0  
18   3  total         48  
19   4  intraresidue  14  
20   4  sequential     8  
21   4  medium         9  
22   4  long          10  
23   4  interchain     0  
24   4  total         41  
25   5  intraresidue  10  
26   5  sequential     9  
27   5  medium        12  
28   5  long          18  
29   5  interchain     0  
30   5  total         49  
31   6  intraresidue  15  
32   6  sequential     6  
33   6  medium         7  
34   6  long          12  
35   6  interchain     0  
36   6  total         40  
37   7  intraresidue  14  
38   7  sequential     8  
39   7  medium         8  
40   7  long          16  
41   7  interchain     0  
42   7  total         46  
43   8  intraresidue  14  
44   8  sequential     7  
45   8  medium         6  
46   8  long          15  
47   8  interchain     0  
48   8  total         42  
49   9  intraresidue  12  
50   9  sequential     7  
51   9  medium         8  
52   9  long           9  
53   9  interchain     0  
54   9  total         36  
55  10  intraresidue  17  
56  10  sequential     5  
57  10  medium        10  
58  10  long          15  
59  10  interchain     0  
60  10  total         47  
#
loop_
_pdbx_vrpt_distance_violations_ensemble_summary.id
_pdbx_vrpt_distance_violations_ensemble_summary.fraction_of_ensemble_count
_pdbx_vrpt_distance_violations_ensemble_summary.fraction_of_ensemble_percent
 1   1   10.0  
 2   2   20.0  
 3   3   30.0  
 4   4   40.0  
 5   5   50.0  
 6   6   60.0  
 7   7   70.0  
 8   8   80.0  
 9   9   90.0  
10  10  100.0  
#
loop_
_pdbx_vrpt_distance_violation_ensemble.ordinal
_pdbx_vrpt_distance_violation_ensemble.ensemble_distance_count
_pdbx_vrpt_distance_violation_ensemble.dist_rest_type
_pdbx_vrpt_distance_violation_ensemble.violations_count
 1   1  intraresidue   8  
 2   1  sequential     5  
 3   1  medium         5  
 4   1  long          14  
 5   1  interchain     0  
 6   1  total         32  
 7   2  intraresidue   4  
 8   2  sequential     1  
 9   2  medium         3  
10   2  long           7  
11   2  interchain     0  
12   2  total         15  
13   3  intraresidue   4  
14   3  sequential     1  
15   3  medium         1  
16   3  long           5  
17   3  interchain     0  
18   3  total         11  
19   4  intraresidue   3  
20   4  sequential     1  
21   4  medium         0  
22   4  long           4  
23   4  interchain     0  
24   4  total          8  
25   5  intraresidue   1  
26   5  sequential     2  
27   5  medium         2  
28   5  long           2  
29   5  interchain     0  
30   5  total          7  
31   6  intraresidue   1  
32   6  sequential     0  
33   6  medium         1  
34   6  long           1  
35   6  interchain     0  
36   6  total          3  
37   7  intraresidue   2  
38   7  sequential     1  
39   7  medium         0  
40   7  long           0  
41   7  interchain     0  
42   7  total          3  
43   8  intraresidue   1  
44   8  sequential     0  
45   8  medium         2  
46   8  long           3  
47   8  interchain     0  
48   8  total          6  
49   9  intraresidue   2  
50   9  sequential     1  
51   9  medium         3  
52   9  long           1  
53   9  interchain     0  
54   9  total          7  
55  10  intraresidue   5  
56  10  sequential     3  
57  10  medium         1  
58  10  long           3  
59  10  interchain     0  
60  10  total         12  
#
loop_
_pdbx_vrpt_residual_distance_violations.ordinal
_pdbx_vrpt_residual_distance_violations.bins
_pdbx_vrpt_residual_distance_violations.max_violation
_pdbx_vrpt_residual_distance_violations.violations_per_model
1  0.1-0.2  0.2  10.1  
2  0.2-0.5  0.5  15.3  
3  >0.5     2.2  18.0  
#
loop_
_pdbx_vrpt_most_violated_distance_restraints.ordinal
_pdbx_vrpt_most_violated_distance_restraints.rest_id
_pdbx_vrpt_most_violated_distance_restraints.rlist_id
_pdbx_vrpt_most_violated_distance_restraints.altcode_1
_pdbx_vrpt_most_violated_distance_restraints.chain_1
_pdbx_vrpt_most_violated_distance_restraints.resnum_1
_pdbx_vrpt_most_violated_distance_restraints.resname_1
_pdbx_vrpt_most_violated_distance_restraints.icode_1
_pdbx_vrpt_most_violated_distance_restraints.ent_1
_pdbx_vrpt_most_violated_distance_restraints.said_1
_pdbx_vrpt_most_violated_distance_restraints.seq_1
_pdbx_vrpt_most_violated_distance_restraints.atom_1
_pdbx_vrpt_most_violated_distance_restraints.chain_2
_pdbx_vrpt_most_violated_distance_restraints.altcode_2
_pdbx_vrpt_most_violated_distance_restraints.resnum_2
_pdbx_vrpt_most_violated_distance_restraints.resname_2
_pdbx_vrpt_most_violated_distance_restraints.seq_2
_pdbx_vrpt_most_violated_distance_restraints.said_2
_pdbx_vrpt_most_violated_distance_restraints.ent_2
_pdbx_vrpt_most_violated_distance_restraints.icode_2
_pdbx_vrpt_most_violated_distance_restraints.atom_2
_pdbx_vrpt_most_violated_distance_restraints.violated_models
_pdbx_vrpt_most_violated_distance_restraints.mean_distance_violation
_pdbx_vrpt_most_violated_distance_restraints.median_violation
_pdbx_vrpt_most_violated_distance_restraints.standard_deviation
  1  110  1  .  A  20  PHE  ?     1  A  20  HB3   A  .  26  LEU  26  A  1  ?     HB3   10  1.30  1.32  0.18  
  2   89  1  .  A  18  LEU  ?     1  A  18  HA    A  .  18  LEU  18  A  1  ?     HD12  10  1.09  1.09  0.03  
  3   89  1  .  A  18  LEU  ?     1  A  18  HA    A  .  18  LEU  18  A  1  ?     HD11  10  1.09  1.09  0.03  
  4   89  1  .  A  18  LEU  ?     1  A  18  HA    A  .  18  LEU  18  A  1  ?     HD13  10  1.09  1.09  0.03  
  5  297  1  .  A  30  LEU  ?     1  A  30  HG    A  .  44  TYR  44  A  1  ?     HB3   10  1.06  1.06  0.17  
  6  778  1  .  A  19  THR  ?     1  A  19  H     A  .  18  LEU  18  A  1  ?     HD12  10  0.96  0.97  0.09  
  7  778  1  .  A  19  THR  ?     1  A  19  H     A  .  18  LEU  18  A  1  ?     HD11  10  0.96  0.97  0.09  
  8  778  1  .  A  19  THR  ?     1  A  19  H     A  .  18  LEU  18  A  1  ?     HD13  10  0.96  0.97  0.09  
  9  475  1  .  A  30  LEU  ?     1  A  30  H     A  .  29  HIS  29  A  1  ?     HB2   10  0.66  0.65  0.05  
 10  302  1  .  A  11  TYR  ?     1  A  11  HB3   A  .  26  LEU  26  A  1  ?     HB3   10  0.57  0.48  0.37  
 11  739  1  .  A  44  TYR  ?     1  A  44  H     A  .  44  TYR  44  A  1  ?     HB3   10  0.45  0.44  0.03  
 12  514  1  .  A  11  TYR  ?     1  A  11  H     A  .  11  TYR  11  A  1  ?     HB3   10  0.45  0.42  0.05  
 13  683  1  .  A  34  GLU  ?     1  A  34  H     A  .  34  GLU  34  A  1  ?     HG3   10  0.32  0.33  0.07  
 14  412  1  .  A  18  LEU  ?     1  A  18  H     A  .  15  ARG  15  A  1  ?     HG2   10  0.28  0.28  0.06  
 15  412  1  .  A  18  LEU  ?     1  A  18  H     A  .  15  ARG  15  A  1  ?     HG3   10  0.28  0.28  0.06  
 16  712  1  .  A  45  TYR  ?     1  A  45  H     A  .  44  TYR  44  A  1  ?     HE1   10  0.23  0.23  0.04  
 17  712  1  .  A  45  TYR  ?     1  A  45  H     A  .  44  TYR  44  A  1  ?     HE2   10  0.23  0.23  0.04  
 18  546  1  .  A  20  PHE  ?     1  A  20  H     A  .  20  PHE  20  A  1  ?     HB3   10  0.18  0.17  0.03  
 19   38  1  .  A  24  LYS  ?     1  A  24  HA    A  .  27  ILE  27  A  1  ?     HG12   9  1.07  1.03  0.18  
 20  253  1  .  A  41  ILE  ?     1  A  41  HG22  A  .  45  TYR  45  A  1  ?     HB2    9  1.03  1.17  0.29  
 21  253  1  .  A  41  ILE  ?     1  A  41  HG21  A  .  45  TYR  45  A  1  ?     HB2    9  1.03  1.17  0.29  
 22  253  1  .  A  41  ILE  ?     1  A  41  HG23  A  .  45  TYR  45  A  1  ?     HB2    9  1.03  1.17  0.29  
 23  271  1  .  A  37  ASN  ?     1  A  37  HB2   A  .  40  SER  40  A  1  ?     HB3    9  0.99  0.83  0.70  
 24  499  1  .  A  27  ILE  ?     1  A  27  H     A  .  27  ILE  27  A  1  ?     HG12   9  0.68  0.70  0.07  
 25  680  1  .  A  39  LEU  ?     1  A  39  H     A  .  38  PRO  38  A  1  ?     HB3    9  0.32  0.31  0.06  
 26  308  1  .  A  27  ILE  ?     1  A  27  HG13  A  .  27  ILE  27  A  1  ?     HG22   9  0.24  0.24  0.00  
 27  308  1  .  A  27  ILE  ?     1  A  27  HG13  A  .  27  ILE  27  A  1  ?     HG21   9  0.24  0.24  0.00  
 28  308  1  .  A  27  ILE  ?     1  A  27  HG13  A  .  27  ILE  27  A  1  ?     HG23   9  0.24  0.24  0.00  
 29  170  1  .  A  13  CYS  ?     1  A  13  HB2   A  .  30  LEU  30  A  1  ?     H      9  0.22  0.22  0.03  
 30  250  1  .  A  10  VAL  ?     1  A  10  HG12  A  .  50  VAL  50  A  1  ?     HG12   8  1.09  1.04  0.44  
 31  250  1  .  A  10  VAL  ?     1  A  10  HG12  A  .  50  VAL  50  A  1  ?     HG11   8  1.09  1.04  0.44  
 32  250  1  .  A  10  VAL  ?     1  A  10  HG12  A  .  50  VAL  50  A  1  ?     HG13   8  1.09  1.04  0.44  
 33  250  1  .  A  10  VAL  ?     1  A  10  HG11  A  .  50  VAL  50  A  1  ?     HG12   8  1.09  1.04  0.44  
 34  250  1  .  A  10  VAL  ?     1  A  10  HG11  A  .  50  VAL  50  A  1  ?     HG11   8  1.09  1.04  0.44  
 35  250  1  .  A  10  VAL  ?     1  A  10  HG11  A  .  50  VAL  50  A  1  ?     HG13   8  1.09  1.04  0.44  
 36  250  1  .  A  10  VAL  ?     1  A  10  HG13  A  .  50  VAL  50  A  1  ?     HG12   8  1.09  1.04  0.44  
 37  250  1  .  A  10  VAL  ?     1  A  10  HG13  A  .  50  VAL  50  A  1  ?     HG11   8  1.09  1.04  0.44  
 38  250  1  .  A  10  VAL  ?     1  A  10  HG13  A  .  50  VAL  50  A  1  ?     HG13   8  1.09  1.04  0.44  
 39   88  1  .  A  14  LEU  ?     1  A  14  HA    A  .  14  LEU  14  A  1  ?     HD12   8  1.01  1.00  0.02  
 40   88  1  .  A  14  LEU  ?     1  A  14  HA    A  .  14  LEU  14  A  1  ?     HD11   8  1.01  1.00  0.02  
 41   88  1  .  A  14  LEU  ?     1  A  14  HA    A  .  14  LEU  14  A  1  ?     HD13   8  1.01  1.00  0.02  
 42  163  1  .  A  38  PRO  ?     1  A  38  HB2   A  .  41  ILE  41  A  1  ?     HD12   8  0.68  0.81  0.26  
 43  163  1  .  A  38  PRO  ?     1  A  38  HB2   A  .  41  ILE  41  A  1  ?     HD11   8  0.68  0.81  0.26  
 44  163  1  .  A  38  PRO  ?     1  A  38  HB2   A  .  41  ILE  41  A  1  ?     HD13   8  0.68  0.81  0.26  
 45  725  1  .  A  45  TYR  ?     1  A  45  H     A  .  14  LEU  14  A  1  ?     HD22   8  0.59  0.57  0.29  
 46  725  1  .  A  45  TYR  ?     1  A  45  H     A  .  14  LEU  14  A  1  ?     HD21   8  0.59  0.57  0.29  
 47  725  1  .  A  45  TYR  ?     1  A  45  H     A  .  14  LEU  14  A  1  ?     HD23   8  0.59  0.57  0.29  
 48  272  1  .  A  40  SER  ?     1  A  40  HB3   A  .  36  VAL  36  A  1  ?     HG22   8  0.52  0.54  0.20  
 49  272  1  .  A  40  SER  ?     1  A  40  HB3   A  .  36  VAL  36  A  1  ?     HG21   8  0.52  0.54  0.20  
 50  272  1  .  A  40  SER  ?     1  A  40  HB3   A  .  36  VAL  36  A  1  ?     HG23   8  0.52  0.54  0.20  
 51  263  1  .  A  41  ILE  ?     1  A  41  HD12  A  .  27  ILE  27  A  1  ?     HG13   8  0.38  0.37  0.16  
 52  263  1  .  A  41  ILE  ?     1  A  41  HD11  A  .  27  ILE  27  A  1  ?     HG13   8  0.38  0.37  0.16  
 53  263  1  .  A  41  ILE  ?     1  A  41  HD13  A  .  27  ILE  27  A  1  ?     HG13   8  0.38  0.37  0.16  
 54  103  1  .  A  38  PRO  ?     1  A  38  HD3   A  .  38  PRO  38  A  1  ?     HB3    7  0.21  0.21  0.01  
 55  676  1  .  A  34  GLU  ?     1  A  34  H     A  .  34  GLU  34  A  1  ?     HG2    7  0.21  0.17  0.07  
 56  401  1  .  A  13  CYS  ?     1  A  13  H     A  .  12  GLN  12  A  1  ?     HB3    7  0.20  0.20  0.05  
 57  704  1  .  A  43  TYR  ?     1  A  43  H     A  .  43  TYR  43  A  1  ?     HB3    6  0.43  0.43  0.03  
 58  158  1  .  A  34  GLU  ?     1  A  34  HG3   A  .  30  LEU  30  A  1  ?     HD22   6  0.15  0.15  0.03  
 59  158  1  .  A  34  GLU  ?     1  A  34  HG3   A  .  30  LEU  30  A  1  ?     HD21   6  0.15  0.15  0.03  
 60  158  1  .  A  34  GLU  ?     1  A  34  HG3   A  .  30  LEU  30  A  1  ?     HD23   6  0.15  0.15  0.03  
 61  158  1  .  A  34  GLU  ?     1  A  34  HG3   A  .  30  LEU  30  A  1  ?     HD12   6  0.15  0.15  0.03  
 62  158  1  .  A  34  GLU  ?     1  A  34  HG3   A  .  30  LEU  30  A  1  ?     HD11   6  0.15  0.15  0.03  
 63  158  1  .  A  34  GLU  ?     1  A  34  HG3   A  .  30  LEU  30  A  1  ?     HD13   6  0.15  0.15  0.03  
 64  508  1  .  A  11  TYR  ?     1  A  11  H     A  .  20  PHE  20  A  1  ?     HE1    6  0.14  0.14  0.02  
 65  508  1  .  A  11  TYR  ?     1  A  11  H     A  .  20  PHE  20  A  1  ?     HE2    6  0.14  0.14  0.02  
 66  495  1  .  A  15  ARG  ?     1  A  15  H     A  .  15  ARG  15  A  1  ?     HB3    5  0.89  0.89  0.01  
 67  812  1  .  A  12  GLN  ?     1  A  12  HE21  A  .  17  GLY  17  A  1  ?     HA3    5  0.86  0.71  0.53  
 68  707  1  .  A  16  CYS  ?     1  A  16  H     A  .  15  ARG  15  A  1  ?     HB3    5  0.66  0.68  0.08  
 69  729  1  .  A  40  SER  ?     1  A  40  H     A  .  37  ASN  37  A  1  ?     HB2    5  0.63  0.57  0.15  
 70    4  1  .  A  19  THR  ?     1  A  19  HB    A  .  10  VAL  10  A  1  ?     HG22   5  0.52  0.53  0.35  
 71    4  1  .  A  19  THR  ?     1  A  19  HB    A  .  10  VAL  10  A  1  ?     HG21   5  0.52  0.53  0.35  
 72    4  1  .  A  19  THR  ?     1  A  19  HB    A  .  10  VAL  10  A  1  ?     HG23   5  0.52  0.53  0.35  
 73  601  1  .  A  25  GLN  ?     1  A  25  H     A  .  24  LYS  24  A  1  ?     HB3    5  0.28  0.29  0.06  
 74  305  1  .  A  34  GLU  ?     1  A  34  HG2   A  .  30  LEU  30  A  1  ?     HA     5  0.13  0.13  0.01  
 75  259  1  .  A   7  MET  ?     1  A   7  HE2   A  .   7  MET   7  A  1  ?     HB3    4  1.03  1.12  0.21  
 76  259  1  .  A   7  MET  ?     1  A   7  HE1   A  .   7  MET   7  A  1  ?     HB3    4  1.03  1.12  0.21  
 77  259  1  .  A   7  MET  ?     1  A   7  HE3   A  .   7  MET   7  A  1  ?     HB3    4  1.03  1.12  0.21  
 78  565  1  .  A  28  ARG  ?     1  A  28  H     A  .  28  ARG  28  A  1  ?     HB2    4  1.01  1.01  0.01  
 79  242  1  .  A  36  VAL  ?     1  A  36  HG22  A  .  35  LYS  35  A  1  ?     HG3    4  0.91  0.95  0.51  
 80  242  1  .  A  36  VAL  ?     1  A  36  HG21  A  .  35  LYS  35  A  1  ?     HG3    4  0.91  0.95  0.51  
 81  242  1  .  A  36  VAL  ?     1  A  36  HG23  A  .  35  LYS  35  A  1  ?     HG3    4  0.91  0.95  0.51  
 82  235  1  .  A  10  VAL  ?     1  A  10  HG22  A  .  21  ARG  21  A  1  ?     HG2    4  0.86  0.73  0.51  
 83  235  1  .  A  10  VAL  ?     1  A  10  HG21  A  .  21  ARG  21  A  1  ?     HG2    4  0.86  0.73  0.51  
 84  235  1  .  A  10  VAL  ?     1  A  10  HG23  A  .  21  ARG  21  A  1  ?     HG2    4  0.86  0.73  0.51  
 85  332  1  .  A  38  PRO  ?     1  A  38  HB2   A  .  31  VAL  31  A  1  ?     HG22   4  0.71  0.30  0.83  
 86  332  1  .  A  38  PRO  ?     1  A  38  HB2   A  .  31  VAL  31  A  1  ?     HG21   4  0.71  0.30  0.83  
 87  332  1  .  A  38  PRO  ?     1  A  38  HB2   A  .  31  VAL  31  A  1  ?     HG23   4  0.71  0.30  0.83  
 88  335  1  .  A  14  LEU  ?     1  A  14  HD12  A  .  46  GLN  46  A  1  ?     HG2    4  0.57  0.60  0.18  
 89  335  1  .  A  14  LEU  ?     1  A  14  HD12  A  .  46  GLN  46  A  1  ?     HG3    4  0.57  0.60  0.18  
 90  335  1  .  A  14  LEU  ?     1  A  14  HD11  A  .  46  GLN  46  A  1  ?     HG2    4  0.57  0.60  0.18  
 91  335  1  .  A  14  LEU  ?     1  A  14  HD11  A  .  46  GLN  46  A  1  ?     HG3    4  0.57  0.60  0.18  
 92  335  1  .  A  14  LEU  ?     1  A  14  HD13  A  .  46  GLN  46  A  1  ?     HG2    4  0.57  0.60  0.18  
 93  335  1  .  A  14  LEU  ?     1  A  14  HD13  A  .  46  GLN  46  A  1  ?     HG3    4  0.57  0.60  0.18  
 94  333  1  .  A  14  LEU  ?     1  A  14  HD12  A  .  46  GLN  46  A  1  ?     HB3    4  0.57  0.64  0.21  
 95  333  1  .  A  14  LEU  ?     1  A  14  HD11  A  .  46  GLN  46  A  1  ?     HB3    4  0.57  0.64  0.21  
 96  333  1  .  A  14  LEU  ?     1  A  14  HD13  A  .  46  GLN  46  A  1  ?     HB3    4  0.57  0.64  0.21  
 97  728  1  .  A  40  SER  ?     1  A  40  H     A  .  40  SER  40  A  1  ?     HB3    4  0.15  0.15  0.03  
 98  156  1  .  A   8  GLU  ?     1  A   8  HG2   A  .  50  VAL  50  A  1  ?     HG12   3  0.49  0.55  0.27  
 99  156  1  .  A   8  GLU  ?     1  A   8  HG2   A  .  50  VAL  50  A  1  ?     HG11   3  0.49  0.55  0.27  
100  156  1  .  A   8  GLU  ?     1  A   8  HG2   A  .  50  VAL  50  A  1  ?     HG13   3  0.49  0.55  0.27  
101  156  1  .  A   8  GLU  ?     1  A   8  HG3   A  .  50  VAL  50  A  1  ?     HG12   3  0.49  0.55  0.27  
102  156  1  .  A   8  GLU  ?     1  A   8  HG3   A  .  50  VAL  50  A  1  ?     HG11   3  0.49  0.55  0.27  
103  156  1  .  A   8  GLU  ?     1  A   8  HG3   A  .  50  VAL  50  A  1  ?     HG13   3  0.49  0.55  0.27  
104   92  1  .  A  39  LEU  ?     1  A  39  HA    A  .  39  LEU  39  A  1  ?     HD22   3  0.40  0.13  0.40  
105   92  1  .  A  39  LEU  ?     1  A  39  HA    A  .  39  LEU  39  A  1  ?     HD21   3  0.40  0.13  0.40  
106   92  1  .  A  39  LEU  ?     1  A  39  HA    A  .  39  LEU  39  A  1  ?     HD23   3  0.40  0.13  0.40  
107  574  1  .  A  42  ASP  ?     1  A  42  H     A  .  42  ASP  42  A  1  ?     HB3    3  0.39  0.39  0.01  
108  557  1  .  A  20  PHE  ?     1  A  20  H     A  .  10  VAL  10  A  1  ?     HG22   3  0.29  0.30  0.04  
109  557  1  .  A  20  PHE  ?     1  A  20  H     A  .  10  VAL  10  A  1  ?     HG21   3  0.29  0.30  0.04  
110  557  1  .  A  20  PHE  ?     1  A  20  H     A  .  10  VAL  10  A  1  ?     HG23   3  0.29  0.30  0.04  
111  108  1  .  A  20  PHE  ?     1  A  20  HB3   A  .  25  GLN  25  A  1  ?     HB2    3  0.24  0.23  0.02  
112  123  1  .  A  45  TYR  ?     1  A  45  HB2   A  .  14  LEU  14  A  1  ?     HD22   3  0.24  0.18  0.09  
113  123  1  .  A  45  TYR  ?     1  A  45  HB2   A  .  14  LEU  14  A  1  ?     HD21   3  0.24  0.18  0.09  
114  123  1  .  A  45  TYR  ?     1  A  45  HB2   A  .  14  LEU  14  A  1  ?     HD23   3  0.24  0.18  0.09  
115  772  1  .  A  12  GLN  ?     1  A  12  HE21  A  .  12  GLN  12  A  1  ?     HB3    3  0.23  0.21  0.05  
116  205  1  .  A  14  LEU  ?     1  A  14  HD22  A  .  46  GLN  46  A  1  ?     HB2    3  0.18  0.15  0.05  
117  205  1  .  A  14  LEU  ?     1  A  14  HD21  A  .  46  GLN  46  A  1  ?     HB2    3  0.18  0.15  0.05  
118  205  1  .  A  14  LEU  ?     1  A  14  HD23  A  .  46  GLN  46  A  1  ?     HB2    3  0.18  0.15  0.05  
119  550  1  .  A  10  VAL  ?     1  A  10  H     A  .   9  ARG   9  A  1  ?     HB3    3  0.18  0.15  0.06  
120  227  1  .  A  39  LEU  ?     1  A  39  HD12  A  .  39  LEU  39  A  1  ?     H      3  0.18  0.15  0.04  
121  227  1  .  A  39  LEU  ?     1  A  39  HD11  A  .  39  LEU  39  A  1  ?     H      3  0.18  0.15  0.04  
122  227  1  .  A  39  LEU  ?     1  A  39  HD13  A  .  39  LEU  39  A  1  ?     H      3  0.18  0.15  0.04  
123  900  1  .  A  26  LEU  ?     1  A  26  H     A  .  30  LEU  30  A  1  ?     HG     3  0.14  0.14  0.00  
124  900  1  .  A  26  LEU  ?     1  A  26  H     A  .  41  ILE  41  A  1  ?     HG22   3  0.14  0.14  0.00  
125  900  1  .  A  26  LEU  ?     1  A  26  H     A  .  41  ILE  41  A  1  ?     HG21   3  0.14  0.14  0.00  
126  900  1  .  A  26  LEU  ?     1  A  26  H     A  .  41  ILE  41  A  1  ?     HG23   3  0.14  0.14  0.00  
127  556  1  .  A  10  VAL  ?     1  A  10  H     A  .  50  VAL  50  A  1  ?     HG12   2  1.10  1.10  0.15  
128  556  1  .  A  10  VAL  ?     1  A  10  H     A  .  50  VAL  50  A  1  ?     HG11   2  1.10  1.10  0.15  
129  556  1  .  A  10  VAL  ?     1  A  10  H     A  .  50  VAL  50  A  1  ?     HG13   2  1.10  1.10  0.15  
130  112  1  .  A  28  ARG  ?     1  A  28  HD2   A  .  28  ARG  28  A  1  ?     HB2    2  0.58  0.58  0.02  
131  233  1  .  A  19  THR  ?     1  A  19  HG21  A  .  12  GLN  12  A  1  ?     HB2    2  0.52  0.52  0.36  
132  233  1  .  A  19  THR  ?     1  A  19  HG22  A  .  12  GLN  12  A  1  ?     HB2    2  0.52  0.52  0.36  
133  233  1  .  A  19  THR  ?     1  A  19  HG23  A  .  12  GLN  12  A  1  ?     HB2    2  0.52  0.52  0.36  
134  334  1  .  A  14  LEU  ?     1  A  14  HD12  A  .  46  GLN  46  A  1  ?     HB2    2  0.45  0.45  0.02  
135  334  1  .  A  14  LEU  ?     1  A  14  HD11  A  .  46  GLN  46  A  1  ?     HB2    2  0.45  0.45  0.02  
136  334  1  .  A  14  LEU  ?     1  A  14  HD13  A  .  46  GLN  46  A  1  ?     HB2    2  0.45  0.45  0.02  
137  767  1  .  A  46  GLN  ?     1  A  46  HE21  A  .  14  LEU  14  A  1  ?     HD12   2  0.42  0.42  0.15  
138  767  1  .  A  46  GLN  ?     1  A  46  HE21  A  .  14  LEU  14  A  1  ?     HD11   2  0.42  0.42  0.15  
139  767  1  .  A  46  GLN  ?     1  A  46  HE21  A  .  14  LEU  14  A  1  ?     HD13   2  0.42  0.42  0.15  
140   57  1  .  A  23  LYS  ?     1  A  23  HA    A  .  26  LEU  26  A  1  ?     HB2    2  0.30  0.30  0.16  
141  554  1  .  A  20  PHE  ?     1  A  20  H     A  .  26  LEU  26  A  1  ?     HB3    2  0.26  0.26  0.07  
142  754  1  .  A  17  GLY  ?     1  A  17  H     A  .  12  GLN  12  A  1  ?     HB3    2  0.23  0.23  0.12  
143   48  1  .  A  19  THR  ?     1  A  19  HA    A  .  10  VAL  10  A  1  ?     HG22   2  0.22  0.22  0.02  
144   48  1  .  A  19  THR  ?     1  A  19  HA    A  .  10  VAL  10  A  1  ?     HG21   2  0.22  0.22  0.02  
145   48  1  .  A  19  THR  ?     1  A  19  HA    A  .  10  VAL  10  A  1  ?     HG23   2  0.22  0.22  0.02  
146  134  1  .  A  23  LYS  ?     1  A  23  HE2   A  .  23  LYS  23  A  1  ?     HG3    2  0.22  0.22  0.03  
147  134  1  .  A  23  LYS  ?     1  A  23  HE3   A  .  23  LYS  23  A  1  ?     HG3    2  0.22  0.22  0.03  
148   52  1  .  A  25  GLN  ?     1  A  25  HA    A  .  28  ARG  28  A  1  ?     HD2    2  0.20  0.20  0.04  
149  391  1  .  A  14  LEU  ?     1  A  14  H     A  .  14  LEU  14  A  1  ?     HG     2  0.17  0.17  0.03  
150  813  1  .  A  28  ARG  ?     1  A  28  H     A  .  28  ARG  28  A  1  ?     HG3    2  0.17  0.17  0.04  
151  234  1  .  A  22  THR  ?     1  A  22  HG21  A  .  21  ARG  21  A  1  ?     HB3    2  0.15  0.15  0.04  
152  234  1  .  A  22  THR  ?     1  A  22  HG22  A  .  21  ARG  21  A  1  ?     HB3    2  0.15  0.15  0.04  
153  234  1  .  A  22  THR  ?     1  A  22  HG23  A  .  21  ARG  21  A  1  ?     HB3    2  0.15  0.15  0.04  
154   30  1  .  A  40  SER  ?     1  A  40  HB2   A  .  36  VAL  36  A  1  ?     HG22   2  0.14  0.14  0.01  
155   30  1  .  A  40  SER  ?     1  A  40  HB2   A  .  36  VAL  36  A  1  ?     HG21   2  0.14  0.14  0.01  
156   30  1  .  A  40  SER  ?     1  A  40  HB2   A  .  36  VAL  36  A  1  ?     HG23   2  0.14  0.14  0.01  
#
loop_
_pdbx_vrpt_violated_distance_restraints.ordinal
_pdbx_vrpt_violated_distance_restraints.rest_id
_pdbx_vrpt_violated_distance_restraints.rlist_id
_pdbx_vrpt_violated_distance_restraints.instance_id_1
_pdbx_vrpt_violated_distance_restraints.instance_id_2
_pdbx_vrpt_violated_distance_restraints.atom_1
_pdbx_vrpt_violated_distance_restraints.atom_2
_pdbx_vrpt_violated_distance_restraints.violation
  1  105  1  124  117  HD2   HG22  2.16  
  2  105  1  124  117  HD2   HG21  2.16  
  3  105  1  124  117  HD2   HG23  2.16  
  4  332  1  124  117  HB2   HG22  2.14  
  5  332  1  124  117  HB2   HG21  2.14  
  6  332  1  124  117  HB2   HG23  2.14  
  7  271  1  445  448  HB2   HB3   2.11  
  8  250  1  188  228  HG12  HG12  1.89  
  9  250  1  188  228  HG12  HG11  1.89  
 10  250  1  188  228  HG12  HG13  1.89  
 11  250  1  188  228  HG11  HG12  1.89  
 12  250  1  188  228  HG11  HG11  1.89  
 13  250  1  188  228  HG11  HG13  1.89  
 14  250  1  188  228  HG13  HG12  1.89  
 15  250  1  188  228  HG13  HG11  1.89  
 16  250  1  188  228  HG13  HG13  1.89  
 17  271  1  215  218  HB2   HB3   1.80  
 18  271  1  307  310  HB2   HB3   1.73  
 19  812  1    6   11  HE21  HA3   1.72  
 20  235  1   50   61  HG22  HG2   1.65  
 21  235  1   50   61  HG21  HG2   1.65  
 22  235  1   50   61  HG23  HG2   1.65  
 23  250  1   96  136  HG12  HG12  1.59  
 24  250  1   96  136  HG12  HG11  1.59  
 25  250  1   96  136  HG12  HG13  1.59  
 26  250  1   96  136  HG11  HG12  1.59  
 27  250  1   96  136  HG11  HG11  1.59  
 28  250  1   96  136  HG11  HG13  1.59  
 29  250  1   96  136  HG13  HG12  1.59  
 30  250  1   96  136  HG13  HG11  1.59  
 31  250  1   96  136  HG13  HG13  1.59  
 32  110  1  198  204  HB3   HB3   1.56  
 33  110  1   60   66  HB3   HB3   1.52  
 34  857  1  204  205  HD22  HG12  1.47  
 35  857  1  204  205  HD21  HG12  1.47  
 36  857  1  204  205  HD23  HG12  1.47  
 37  857  1  204  219  HD22  HD12  1.47  
 38  857  1  204  219  HD22  HD11  1.47  
 39  857  1  204  219  HD22  HD13  1.47  
 40  857  1  204  219  HD21  HD12  1.47  
 41  857  1  204  219  HD21  HD11  1.47  
 42  857  1  204  219  HD21  HD13  1.47  
 43  857  1  204  219  HD23  HD12  1.47  
 44  857  1  204  219  HD23  HD11  1.47  
 45  857  1  204  219  HD23  HD13  1.47  
 46  242  1  122  121  HG22  HG3   1.47  
 47  242  1  122  121  HG21  HG3   1.47  
 48  242  1  122  121  HG23  HG3   1.47  
 49  110  1  336  342  HB3   HB3   1.45  
 50   38  1  248  251  HA    HG12  1.42  
 51  253  1  219  223  HG22  HB2   1.42  
 52  253  1  219  223  HG21  HB2   1.42  
 53  253  1  219  223  HG23  HB2   1.42  
 54  302  1  143  158  HB3   HB3   1.40  
 55  110  1  290  296  HB3   HB3   1.39  
 56  242  1  214  213  HG22  HG3   1.35  
 57  242  1  214  213  HG21  HG3   1.35  
 58  242  1  214  213  HG23  HG3   1.35  
 59  110  1  244  250  HB3   HB3   1.33  
 60  253  1  173  177  HG22  HB2   1.32  
 61  253  1  173  177  HG21  HB2   1.32  
 62  253  1  173  177  HG23  HB2   1.32  
 63  110  1  106  112  HB3   HB3   1.31  
 64  253  1  127  131  HG22  HB2   1.30  
 65  253  1  127  131  HG21  HB2   1.30  
 66  253  1  127  131  HG23  HB2   1.30  
 67  110  1   14   20  HB3   HB3   1.30  
 68   38  1   18   21  HA    HG12  1.26  
 69  297  1  116  130  HG    HB3   1.26  
 70  297  1  438  452  HG    HB3   1.26  
 71  556  1  188  228  H     HG12  1.25  
 72  556  1  188  228  H     HG11  1.25  
 73  556  1  188  228  H     HG13  1.25  
 74  297  1  162  176  HG    HB3   1.24  
 75  259  1    1    1  HE2   HB3   1.22  
 76  259  1    1    1  HE1   HB3   1.22  
 77  259  1    1    1  HE3   HB3   1.22  
 78  253  1  449  453  HG22  HB2   1.19  
 79  253  1  449  453  HG21  HB2   1.19  
 80  253  1  449  453  HG23  HB2   1.19  
 81  297  1  300  314  HG    HB3   1.18  
 82   38  1  202  205  HA    HG12  1.17  
 83  253  1  311  315  HG22  HB2   1.17  
 84  253  1  311  315  HG21  HB2   1.17  
 85  253  1  311  315  HG23  HB2   1.17  
 86  259  1   93   93  HE2   HB3   1.14  
 87  259  1   93   93  HE1   HB3   1.14  
 88  259  1   93   93  HE3   HB3   1.14  
 89   89  1  196  196  HA    HD12  1.13  
 90   89  1  196  196  HA    HD11  1.13  
 91   89  1  196  196  HA    HD13  1.13  
 92  271  1   77   80  HB2   HB3   1.13  
 93   89  1  288  288  HA    HD12  1.12  
 94   89  1  288  288  HA    HD11  1.12  
 95   89  1  288  288  HA    HD13  1.12  
 96  812  1   52   57  HE21  HA3   1.12  
 97   38  1  386  389  HA    HG12  1.12  
 98   89  1  104  104  HA    HD12  1.11  
 99   89  1  104  104  HA    HD11  1.11  
100   89  1  104  104  HA    HD13  1.11  
101   89  1  334  334  HA    HD12  1.11  
102   89  1  334  334  HA    HD11  1.11  
103   89  1  334  334  HA    HD13  1.11  
104  297  1  208  222  HG    HB3   1.11  
105  259  1  277  277  HE2   HB3   1.11  
106  259  1  277  277  HE1   HB3   1.11  
107  259  1  277  277  HE3   HB3   1.11  
108  250  1   50   90  HG12  HG12  1.11  
109  250  1   50   90  HG12  HG11  1.11  
110  250  1   50   90  HG12  HG13  1.11  
111  250  1   50   90  HG11  HG12  1.11  
112  250  1   50   90  HG11  HG11  1.11  
113  250  1   50   90  HG11  HG13  1.11  
114  250  1   50   90  HG13  HG12  1.11  
115  250  1   50   90  HG13  HG11  1.11  
116  250  1   50   90  HG13  HG13  1.11  
117  725  1  269  238  H     HD22  1.10  
118  725  1  269  238  H     HD21  1.10  
119  725  1  269  238  H     HD23  1.10  
120   89  1   58   58  HA    HD12  1.09  
121   89  1   58   58  HA    HD11  1.09  
122   89  1   58   58  HA    HD13  1.09  
123   89  1  150  150  HA    HD12  1.09  
124   89  1  150  150  HA    HD11  1.09  
125   89  1  150  150  HA    HD13  1.09  
126   89  1  426  426  HA    HD12  1.09  
127   89  1  426  426  HA    HD11  1.09  
128   89  1  426  426  HA    HD13  1.09  
129   89  1   12   12  HA    HD12  1.08  
130   89  1   12   12  HA    HD11  1.08  
131   89  1   12   12  HA    HD13  1.08  
132  250  1  142  182  HG12  HG12  1.08  
133  250  1  142  182  HG12  HG11  1.08  
134  250  1  142  182  HG12  HG13  1.08  
135  250  1  142  182  HG11  HG12  1.08  
136  250  1  142  182  HG11  HG11  1.08  
137  250  1  142  182  HG11  HG13  1.08  
138  250  1  142  182  HG13  HG12  1.08  
139  250  1  142  182  HG13  HG11  1.08  
140  250  1  142  182  HG13  HG13  1.08  
141  778  1  197  196  H     HD12  1.07  
142  778  1  197  196  H     HD11  1.07  
143  778  1  197  196  H     HD13  1.07  
144  110  1  428  434  HB3   HB3   1.07  
145  110  1  382  388  HB3   HB3   1.06  
146   89  1  380  380  HA    HD12  1.05  
147   89  1  380  380  HA    HD11  1.05  
148   89  1  380  380  HA    HD13  1.05  
149  778  1  105  104  H     HD12  1.05  
150  778  1  105  104  H     HD11  1.05  
151  778  1  105  104  H     HD13  1.05  
152  778  1  289  288  H     HD12  1.05  
153  778  1  289  288  H     HD11  1.05  
154  778  1  289  288  H     HD13  1.05  
155   89  1  242  242  HA    HD12  1.04  
156   89  1  242  242  HA    HD11  1.04  
157   89  1  242  242  HA    HD13  1.04  
158   88  1  238  238  HA    HD12  1.04  
159   88  1  238  238  HA    HD11  1.04  
160   88  1  238  238  HA    HD13  1.04  
161  778  1  151  150  H     HD12  1.04  
162  778  1  151  150  H     HD11  1.04  
163  778  1  151  150  H     HD13  1.04  
164  266  1  204  219  HD22  HD12  1.04  
165  266  1  204  219  HD22  HD11  1.04  
166  266  1  204  219  HD22  HD13  1.04  
167  266  1  204  219  HD21  HD12  1.04  
168  266  1  204  219  HD21  HD11  1.04  
169  266  1  204  219  HD21  HD13  1.04  
170  266  1  204  219  HD23  HD12  1.04  
171  266  1  204  219  HD23  HD11  1.04  
172  266  1  204  219  HD23  HD13  1.04  
173  565  1  206  206  H     HB2   1.03  
174   38  1  432  435  HA    HG12  1.03  
175  110  1  152  158  HB3   HB3   1.03  
176   88  1   54   54  HA    HD12  1.02  
177   88  1   54   54  HA    HD11  1.02  
178   88  1   54   54  HA    HD13  1.02  
179   88  1  422  422  HA    HD12  1.02  
180   88  1  422  422  HA    HD11  1.02  
181   88  1  422  422  HA    HD13  1.02  
182   88  1  330  330  HA    HD12  1.01  
183   88  1  330  330  HA    HD11  1.01  
184   88  1  330  330  HA    HD13  1.01  
185  565  1   22   22  H     HB2   1.01  
186  565  1  344  344  H     HB2   1.01  
187   38  1  340  343  HA    HG12  1.01  
188  297  1  392  406  HG    HB3   1.01  
189  220  1  204  201  HD22  HD2   1.01  
190  220  1  204  201  HD22  HD3   1.01  
191  220  1  204  201  HD21  HD2   1.01  
192  220  1  204  201  HD21  HD3   1.01  
193  220  1  204  201  HD23  HD2   1.01  
194  220  1  204  201  HD23  HD3   1.01  
195   88  1  100  100  HA    HD12  1.00  
196   88  1  100  100  HA    HD11  1.00  
197   88  1  100  100  HA    HD13  1.00  
198   88  1  284  284  HA    HD12  1.00  
199   88  1  284  284  HA    HD11  1.00  
200   88  1  284  284  HA    HD13  1.00  
201  778  1   13   12  H     HD12  1.00  
202  778  1   13   12  H     HD11  1.00  
203  778  1   13   12  H     HD13  1.00  
204  250  1  234  274  HG12  HG12  1.00  
205  250  1  234  274  HG12  HG11  1.00  
206  250  1  234  274  HG12  HG13  1.00  
207  250  1  234  274  HG11  HG12  1.00  
208  250  1  234  274  HG11  HG11  1.00  
209  250  1  234  274  HG11  HG13  1.00  
210  250  1  234  274  HG13  HG12  1.00  
211  250  1  234  274  HG13  HG11  1.00  
212  250  1  234  274  HG13  HG13  1.00  
213   88  1  192  192  HA    HD12  0.99  
214   88  1  192  192  HA    HD11  0.99  
215   88  1  192  192  HA    HD13  0.99  
216  565  1  436  436  H     HB2   0.99  
217  297  1  346  360  HG    HB3   0.99  
218  250  1  326  366  HG12  HG12  0.99  
219  250  1  326  366  HG12  HG11  0.99  
220  250  1  326  366  HG12  HG13  0.99  
221  250  1  326  366  HG11  HG12  0.99  
222  250  1  326  366  HG11  HG11  0.99  
223  250  1  326  366  HG11  HG13  0.99  
224  250  1  326  366  HG13  HG12  0.99  
225  250  1  326  366  HG13  HG11  0.99  
226  250  1  326  366  HG13  HG13  0.99  
227   88  1  146  146  HA    HD12  0.98  
228   88  1  146  146  HA    HD11  0.98  
229   88  1  146  146  HA    HD13  0.98  
230  297  1   70   84  HG    HB3   0.98  
231   92  1  217  217  HA    HD22  0.97  
232   92  1  217  217  HA    HD21  0.97  
233   92  1  217  217  HA    HD23  0.97  
234  254  1  219  204  HG22  HD22  0.96  
235  254  1  219  204  HG22  HD21  0.96  
236  254  1  219  204  HG22  HD23  0.96  
237  254  1  219  204  HG21  HD22  0.96  
238  254  1  219  204  HG21  HD21  0.96  
239  254  1  219  204  HG21  HD23  0.96  
240  254  1  219  204  HG23  HD22  0.96  
241  254  1  219  204  HG23  HD21  0.96  
242  254  1  219  204  HG23  HD23  0.96  
243  778  1  335  334  H     HD12  0.95  
244  778  1  335  334  H     HD11  0.95  
245  778  1  335  334  H     HD13  0.95  
246  556  1   96  136  H     HG12  0.95  
247  556  1   96  136  H     HG11  0.95  
248  556  1   96  136  H     HG13  0.95  
249  235  1  280  291  HG22  HG2   0.95  
250  235  1  280  291  HG21  HG2   0.95  
251  235  1  280  291  HG23  HG2   0.95  
252    4  1   59   50  HB    HG22  0.93  
253    4  1   59   50  HB    HG21  0.93  
254    4  1   59   50  HB    HG23  0.93  
255  495  1    9    9  H     HB3   0.91  
256   38  1  156  159  HA    HG12  0.91  
257  778  1   59   58  H     HD12  0.90  
258  778  1   59   58  H     HD11  0.90  
259  778  1   59   58  H     HD13  0.90  
260  778  1  381  380  H     HD12  0.90  
261  778  1  381  380  H     HD11  0.90  
262  778  1  381  380  H     HD13  0.90  
263  495  1   55   55  H     HB3   0.89  
264  495  1  239  239  H     HB3   0.89  
265  495  1  423  423  H     HB3   0.89  
266    4  1  335  326  HB    HG22  0.89  
267    4  1  335  326  HB    HG21  0.89  
268    4  1  335  326  HB    HG23  0.89  
269  302  1  373  388  HB3   HB3   0.89  
270  778  1  243  242  H     HD12  0.88  
271  778  1  243  242  H     HD11  0.88  
272  778  1  243  242  H     HD13  0.88  
273  233  1  427  420  HG21  HB2   0.88  
274  233  1  427  420  HG22  HB2   0.88  
275  233  1  427  420  HG23  HB2   0.88  
276  729  1  264  261  H     HB2   0.87  
277  495  1  377  377  H     HB3   0.87  
278   38  1  294  297  HA    HG12  0.87  
279  163  1  262  265  HB2   HD12  0.87  
280  163  1  262  265  HB2   HD11  0.87  
281  163  1  262  265  HB2   HD13  0.87  
282   38  1   64   67  HA    HG12  0.86  
283  302  1   97  112  HB3   HB3   0.85  
284  163  1   78   81  HB2   HD12  0.85  
285  163  1   78   81  HB2   HD11  0.85  
286  163  1   78   81  HB2   HD13  0.85  
287  163  1  446  449  HB2   HD12  0.85  
288  163  1  446  449  HB2   HD11  0.85  
289  163  1  446  449  HB2   HD13  0.85  
290  163  1  308  311  HB2   HD12  0.84  
291  163  1  308  311  HB2   HD11  0.84  
292  163  1  308  311  HB2   HD13  0.84  
293  725  1   85   54  H     HD22  0.83  
294  725  1   85   54  H     HD21  0.83  
295  725  1   85   54  H     HD23  0.83  
296  297  1  254  268  HG    HB3   0.83  
297  271  1   31   34  HB2   HB3   0.83  
298  778  1  427  426  H     HD12  0.79  
299  778  1  427  426  H     HD11  0.79  
300  778  1  427  426  H     HD13  0.79  
301  475  1   24   23  H     HB2   0.79  
302  335  1  284  316  HD12  HG2   0.79  
303  335  1  284  316  HD12  HG3   0.79  
304  335  1  284  316  HD11  HG2   0.79  
305  335  1  284  316  HD11  HG3   0.79  
306  335  1  284  316  HD13  HG2   0.79  
307  335  1  284  316  HD13  HG3   0.79  
308  253  1  403  407  HG22  HB2   0.79  
309  253  1  403  407  HG21  HB2   0.79  
310  253  1  403  407  HG23  HB2   0.79  
311  163  1  124  127  HB2   HD12  0.79  
312  163  1  124  127  HB2   HD11  0.79  
313  163  1  124  127  HB2   HD13  0.79  
314  156  1  416  458  HG2   HG12  0.79  
315  156  1  416  458  HG2   HG11  0.79  
316  156  1  416  458  HG2   HG13  0.79  
317  156  1  416  458  HG3   HG12  0.79  
318  156  1  416  458  HG3   HG11  0.79  
319  156  1  416  458  HG3   HG13  0.79  
320  499  1   21   21  H     HG12  0.78  
321  333  1  192  224  HD12  HB3   0.78  
322  333  1  192  224  HD11  HB3   0.78  
323  333  1  192  224  HD13  HB3   0.78  
324  281  1  201  204  HA    HD22  0.77  
325  281  1  201  204  HA    HD21  0.77  
326  281  1  201  204  HA    HD23  0.77  
327  272  1  218  214  HB3   HG22  0.77  
328  272  1  218  214  HB3   HG21  0.77  
329  272  1  218  214  HB3   HG23  0.77  
330  263  1  449  435  HD12  HG13  0.77  
331  263  1  449  435  HD11  HG13  0.77  
332  263  1  449  435  HD13  HG13  0.77  
333  725  1  361  330  H     HD22  0.76  
334  725  1  361  330  H     HD21  0.76  
335  725  1  361  330  H     HD23  0.76  
336  297  1   24   38  HG    HB3   0.76  
337  707  1  424  423  H     HB3   0.75  
338  499  1  343  343  H     HG12  0.74  
339  729  1  448  445  H     HB2   0.73  
340  707  1   56   55  H     HB3   0.72  
341  272  1  448  444  HB3   HG22  0.72  
342  272  1  448  444  HB3   HG21  0.72  
343  272  1  448  444  HB3   HG23  0.72  
344  253  1   81   85  HG22  HB2   0.72  
345  253  1   81   85  HG21  HB2   0.72  
346  253  1   81   85  HG23  HB2   0.72  
347  163  1  170  173  HB2   HD12  0.72  
348  163  1  170  173  HB2   HD11  0.72  
349  163  1  170  173  HB2   HD13  0.72  
350  812  1  190  195  HE21  HA3   0.71  
351  624  1  122  122  H     HB    0.70  
352  499  1   67   67  H     HG12  0.70  
353  499  1  251  251  H     HG12  0.70  
354  499  1  297  297  H     HG12  0.70  
355  499  1  389  389  H     HG12  0.70  
356  272  1  356  352  HB3   HG22  0.70  
357  272  1  356  352  HB3   HG21  0.70  
358  272  1  356  352  HB3   HG23  0.70  
359  475  1  254  253  H     HB2   0.69  
360  475  1  438  437  H     HB2   0.69  
361  333  1  100  132  HD12  HB3   0.69  
362  333  1  100  132  HD11  HB3   0.69  
363  333  1  100  132  HD13  HB3   0.69  
364  253  1   35   39  HG22  HB2   0.69  
365  253  1   35   39  HG21  HB2   0.69  
366  253  1   35   39  HG23  HB2   0.69  
367  253  1  265  269  HG22  HB2   0.69  
368  253  1  265  269  HG21  HB2   0.69  
369  253  1  265  269  HG23  HB2   0.69  
370  707  1  378  377  H     HB3   0.68  
371  725  1  131  100  H     HD22  0.67  
372  725  1  131  100  H     HD21  0.67  
373  725  1  131  100  H     HD23  0.67  
374  335  1  192  224  HD12  HG2   0.67  
375  335  1  192  224  HD12  HG3   0.67  
376  335  1  192  224  HD11  HG2   0.67  
377  335  1  192  224  HD11  HG3   0.67  
378  335  1  192  224  HD13  HG2   0.67  
379  335  1  192  224  HD13  HG3   0.67  
380  271  1  169  172  HB2   HB3   0.67  
381  259  1  139  139  HE2   HB3   0.67  
382  259  1  139  139  HE1   HB3   0.67  
383  259  1  139  139  HE3   HB3   0.67  
384   70  1  291  280  HA    HG22  0.66  
385   70  1  291  280  HA    HG21  0.66  
386   70  1  291  280  HA    HG23  0.66  
387  499  1  159  159  H     HG12  0.66  
388  475  1  300  299  H     HB2   0.66  
389  475  1   70   69  H     HB2   0.65  
390  410  1  191  204  H     HD12  0.65  
391  410  1  191  204  H     HD11  0.65  
392  410  1  191  204  H     HD13  0.65  
393  499  1  435  435  H     HG12  0.64  
394  475  1  116  115  H     HB2   0.64  
395  475  1  162  161  H     HB2   0.64  
396  475  1  392  391  H     HB2   0.64  
397  475  1  346  345  H     HB2   0.63  
398  302  1  281  296  HB3   HB3   0.62  
399  250  1  418  458  HG12  HG12  0.62  
400  250  1  418  458  HG12  HG11  0.62  
401  250  1  418  458  HG12  HG13  0.62  
402  250  1  418  458  HG11  HG12  0.62  
403  250  1  418  458  HG11  HG11  0.62  
404  250  1  418  458  HG11  HG13  0.62  
405  250  1  418  458  HG13  HG12  0.62  
406  250  1  418  458  HG13  HG11  0.62  
407  250  1  418  458  HG13  HG13  0.62  
408  475  1  208  207  H     HB2   0.61  
409  707  1   10    9  H     HB3   0.60  
410  112  1  390  390  HD2   HB2   0.60  
411  812  1  328  333  HE21  HA3   0.58  
412  767  1  224  192  HE21  HD12  0.58  
413  767  1  224  192  HE21  HD11  0.58  
414  767  1  224  192  HE21  HD13  0.58  
415  333  1  422  454  HD12  HB3   0.58  
416  333  1  422  454  HD11  HB3   0.58  
417  333  1  422  454  HD13  HB3   0.58  
418  272  1  172  168  HB3   HG22  0.58  
419  272  1  172  168  HB3   HG21  0.58  
420  272  1  172  168  HB3   HG23  0.58  
421  729  1  126  123  H     HB2   0.57  
422  112  1  298  298  HD2   HB2   0.56  
423  156  1  232  274  HG2   HG12  0.55  
424  156  1  232  274  HG2   HG11  0.55  
425  156  1  232  274  HG2   HG13  0.55  
426  156  1  232  274  HG3   HG12  0.55  
427  156  1  232  274  HG3   HG11  0.55  
428  156  1  232  274  HG3   HG13  0.55  
429  242  1  306  305  HG22  HG3   0.54  
430  242  1  306  305  HG21  HG3   0.54  
431  242  1  306  305  HG23  HG3   0.54  
432  707  1  240  239  H     HB3   0.53  
433  514  1    5    5  H     HB3   0.53  
434  514  1  143  143  H     HB3   0.53  
435    4  1  289  280  HB    HG22  0.53  
436    4  1  289  280  HB    HG21  0.53  
437    4  1  289  280  HB    HG23  0.53  
438  335  1  146  178  HD12  HG2   0.53  
439  335  1  146  178  HD12  HG3   0.53  
440  335  1  146  178  HD11  HG2   0.53  
441  335  1  146  178  HD11  HG3   0.53  
442  335  1  146  178  HD13  HG2   0.53  
443  335  1  146  178  HD13  HG3   0.53  
444  729  1  310  307  H     HB2   0.51  
445  514  1   97   97  H     HB3   0.51  
446  272  1  402  398  HB3   HG22  0.51  
447  272  1  402  398  HB3   HG21  0.51  
448  272  1  402  398  HB3   HG23  0.51  
449  235  1  326  337  HG22  HG2   0.51  
450  235  1  326  337  HG21  HG2   0.51  
451  235  1  326  337  HG23  HG2   0.51  
452  499  1  205  205  H     HG12  0.50  
453  302  1  189  204  HB3   HB3   0.50  
454  217  1  204  219  HD22  HB    0.50  
455  217  1  204  219  HD21  HB    0.50  
456  217  1  204  219  HD23  HB    0.50  
457  739  1  130  130  H     HB3   0.49  
458  739  1  314  314  H     HB3   0.49  
459  739  1  452  452  H     HB3   0.48  
460  725  1  453  422  H     HD22  0.48  
461  725  1  453  422  H     HD21  0.48  
462  725  1  453  422  H     HD23  0.48  
463  173  1  191  204  HB3   HD12  0.48  
464  173  1  191  204  HB3   HD11  0.48  
465  173  1  191  204  HB3   HD13  0.48  
466  729  1  218  215  H     HB2   0.46  
467  704  1  175  175  H     HB3   0.46  
468   57  1  201  204  HA    HB2   0.46  
469  334  1  422  454  HD12  HB2   0.46  
470  334  1  422  454  HD11  HB2   0.46  
471  334  1  422  454  HD13  HB2   0.46  
472  302  1    5   20  HB3   HB3   0.46  
473  739  1   38   38  H     HB3   0.45  
474  725  1  223  192  H     HD22  0.45  
475  725  1  223  192  H     HD21  0.45  
476  725  1  223  192  H     HD23  0.45  
477  704  1  267  267  H     HB3   0.45  
478  739  1  176  176  H     HB3   0.44  
479  739  1  268  268  H     HB3   0.44  
480  514  1  189  189  H     HB3   0.44  
481  739  1   84   84  H     HB3   0.43  
482  739  1  222  222  H     HB3   0.43  
483  739  1  360  360  H     HB3   0.43  
484  704  1  129  129  H     HB3   0.43  
485  704  1  313  313  H     HB3   0.43  
486  683  1  396  396  H     HG3   0.43  
487  514  1  373  373  H     HB3   0.43  
488  334  1  100  132  HD12  HB2   0.43  
489  334  1  100  132  HD11  HB2   0.43  
490  334  1  100  132  HD13  HB2   0.43  
491  263  1  265  251  HD12  HG13  0.43  
492  263  1  265  251  HD11  HG13  0.43  
493  263  1  265  251  HD13  HG13  0.43  
494  250  1  280  320  HG12  HG12  0.43  
495  250  1  280  320  HG12  HG11  0.43  
496  250  1  280  320  HG12  HG13  0.43  
497  250  1  280  320  HG11  HG12  0.43  
498  250  1  280  320  HG11  HG11  0.43  
499  250  1  280  320  HG11  HG13  0.43  
500  250  1  280  320  HG13  HG12  0.43  
501  250  1  280  320  HG13  HG11  0.43  
502  250  1  280  320  HG13  HG13  0.43  
503  680  1   33   32  H     HB3   0.42  
504  514  1  281  281  H     HB3   0.42  
505  514  1  327  327  H     HB3   0.42  
506  514  1  235  235  H     HB3   0.41  
507  739  1  406  406  H     HB3   0.40  
508  680  1  217  216  H     HB3   0.40  
509  680  1  355  354  H     HB3   0.40  
510  574  1  358  358  H     HB3   0.40  
511  704  1   37   37  H     HB3   0.39  
512  704  1   83   83  H     HB3   0.39  
513  683  1  212  212  H     HG3   0.39  
514  574  1  128  128  H     HB3   0.39  
515  514  1  419  419  H     HB3   0.39  
516  412  1  242  239  H     HG2   0.39  
517  412  1  242  239  H     HG3   0.39  
518  332  1   32   25  HB2   HG22  0.39  
519  332  1   32   25  HB2   HG21  0.39  
520  332  1   32   25  HB2   HG23  0.39  
521  574  1  266  266  H     HB3   0.38  
522  514  1   51   51  H     HB3   0.38  
523  263  1   35   21  HD12  HG13  0.38  
524  263  1   35   21  HD11  HG13  0.38  
525  263  1   35   21  HD13  HG13  0.38  
526  412  1  380  377  H     HG2   0.37  
527  412  1  380  377  H     HG3   0.37  
528  271  1  261  264  HB2   HB3   0.37  
529  263  1   81   67  HD12  HG13  0.37  
530  263  1   81   67  HD11  HG13  0.37  
531  263  1   81   67  HD13  HG13  0.37  
532  263  1  357  343  HD12  HG13  0.37  
533  263  1  357  343  HD11  HG13  0.37  
534  263  1  357  343  HD13  HG13  0.37  
535  163  1  400  403  HB2   HD12  0.37  
536  163  1  400  403  HB2   HD11  0.37  
537  163  1  400  403  HB2   HD13  0.37  
538  123  1  361  330  HB2   HD22  0.37  
539  123  1  361  330  HB2   HD21  0.37  
540  123  1  361  330  HB2   HD23  0.37  
541  601  1  157  156  H     HB3   0.36  
542  754  1  241  236  H     HB3   0.35  
543  683  1  304  304  H     HG3   0.35  
544  289  1  122  127  HG12  HA    0.35  
545  289  1  122  127  HG11  HA    0.35  
546  289  1  122  127  HG13  HA    0.35  
547  272  1  310  306  HB3   HG22  0.35  
548  272  1  310  306  HB3   HG21  0.35  
549  272  1  310  306  HB3   HG23  0.35  
550  683  1  258  258  H     HG3   0.34  
551  503  1  205  204  H     HG    0.34  
552  302  1  235  250  HB3   HB3   0.34  
553  725  1  315  284  H     HD22  0.33  
554  725  1  315  284  H     HD21  0.33  
555  725  1  315  284  H     HD23  0.33  
556  683  1  166  166  H     HG3   0.33  
557  557  1  290  280  H     HG22  0.33  
558  557  1  290  280  H     HG21  0.33  
559  557  1  290  280  H     HG23  0.33  
560  272  1   34   30  HB3   HG22  0.33  
561  272  1   34   30  HB3   HG21  0.33  
562  272  1   34   30  HB3   HG23  0.33  
563  235  1   96  107  HG22  HG2   0.33  
564  235  1   96  107  HG21  HG2   0.33  
565  235  1   96  107  HG23  HG2   0.33  
566  683  1   74   74  H     HG3   0.32  
567  680  1  171  170  H     HB3   0.32  
568  676  1  442  442  H     HG2   0.32  
569  601  1  111  110  H     HB3   0.32  
570  554  1  290  296  H     HB3   0.32  
571   12  1  113  117  HA    HG22  0.32  
572   12  1  113  117  HA    HG21  0.32  
573   12  1  113  117  HA    HG23  0.32  
574    2  3  142  180  O     H     0.31  
575  712  1  315  314  H     HE1   0.31  
576  712  1  315  314  H     HE2   0.31  
577  683  1  120  120  H     HG3   0.31  
578  680  1  401  400  H     HB3   0.31  
579  676  1   28   28  H     HG2   0.31  
580  772  1  420  420  HE21  HB3   0.30  
581  680  1  447  446  H     HB3   0.30  
582  557  1   60   50  H     HG22  0.30  
583  557  1   60   50  H     HG21  0.30  
584  557  1   60   50  H     HG23  0.30  
585  412  1  426  423  H     HG2   0.30  
586  412  1  426  423  H     HG3   0.30  
587  335  1   54   86  HD12  HG2   0.30  
588  335  1   54   86  HD12  HG3   0.30  
589  335  1   54   86  HD11  HG2   0.30  
590  335  1   54   86  HD11  HG3   0.30  
591  335  1   54   86  HD13  HG2   0.30  
592  335  1   54   86  HD13  HG3   0.30  
593  712  1  223  222  H     HE1   0.29  
594  712  1  223  222  H     HE2   0.29  
595  680  1  125  124  H     HB3   0.29  
596  601  1  295  294  H     HB3   0.29  
597  453  1   49   49  H     HB2   0.29  
598  412  1  334  331  H     HG2   0.29  
599  412  1  334  331  H     HG3   0.29  
600  263  1  219  205  HD12  HG13  0.29  
601  263  1  219  205  HD11  HG13  0.29  
602  263  1  219  205  HD13  HG13  0.29  
603  797  1  203  206  H     HD2   0.28  
604  712  1  131  130  H     HE1   0.28  
605  712  1  131  130  H     HE2   0.28  
606  683  1  350  350  H     HG3   0.28  
607  412  1   58   55  H     HG2   0.28  
608  412  1   58   55  H     HG3   0.28  
609  767  1  454  422  HE21  HD12  0.27  
610  767  1  454  422  HE21  HD11  0.27  
611  767  1  454  422  HE21  HD13  0.27  
612  412  1   12    9  H     HG2   0.27  
613  412  1   12    9  H     HG3   0.27  
614  412  1  150  147  H     HG2   0.27  
615  412  1  150  147  H     HG3   0.27  
616  401  1  191  190  H     HB3   0.27  
617   34  1  122  122  HA    HG22  0.27  
618   34  1  122  122  HA    HG21  0.27  
619   34  1  122  122  HA    HG23  0.27  
620  242  1  352  351  HG22  HG3   0.27  
621  242  1  352  351  HG21  HG3   0.27  
622  242  1  352  351  HG23  HG3   0.27  
623  680  1  309  308  H     HB3   0.26  
624  629  1  117  122  H     HG12  0.26  
625  629  1  117  122  H     HG11  0.26  
626  629  1  117  122  H     HG13  0.26  
627  550  1    4    3  H     HB3   0.26  
628  412  1  288  285  H     HG2   0.26  
629  412  1  288  285  H     HG3   0.26  
630  205  1  376  408  HD22  HB2   0.26  
631  205  1  376  408  HD21  HB2   0.26  
632  205  1  376  408  HD23  HB2   0.26  
633  108  1  428  433  HB3   HB2   0.26  
634  860  1   24   39  HD22  HB3   0.25  
635  860  1   24   39  HD21  HB3   0.25  
636  860  1   24   39  HD23  HB3   0.25  
637  860  1   24   39  HD12  HB3   0.25  
638  860  1   24   39  HD11  HB3   0.25  
639  860  1   24   39  HD13  HB3   0.25  
640  860  1   29   29  HG3   HE2   0.25  
641  860  1   29   29  HG3   HE3   0.25  
642  601  1  203  202  H     HB3   0.25  
643  302  1   51   66  HB3   HB3   0.25  
644  170  1   99  116  HB2   H     0.25  
645  170  1  329  346  HB2   H     0.25  
646  134  1  247  247  HE2   HG3   0.25  
647  134  1  247  247  HE3   HG3   0.25  
648  712  1  453  452  H     HE1   0.24  
649  712  1  453  452  H     HE2   0.24  
650   52  1  387  390  HA    HD2   0.24  
651   48  1   59   50  HA    HG22  0.24  
652   48  1   59   50  HA    HG21  0.24  
653   48  1   59   50  HA    HG23  0.24  
654  308  1   21   21  HG13  HG22  0.24  
655  308  1   21   21  HG13  HG21  0.24  
656  308  1   21   21  HG13  HG23  0.24  
657  308  1   67   67  HG13  HG22  0.24  
658  308  1   67   67  HG13  HG21  0.24  
659  308  1   67   67  HG13  HG23  0.24  
660  308  1  159  159  HG13  HG22  0.24  
661  308  1  159  159  HG13  HG21  0.24  
662  308  1  159  159  HG13  HG23  0.24  
663  308  1  251  251  HG13  HG22  0.24  
664  308  1  251  251  HG13  HG21  0.24  
665  308  1  251  251  HG13  HG23  0.24  
666  308  1  297  297  HG13  HG22  0.24  
667  308  1  297  297  HG13  HG21  0.24  
668  308  1  297  297  HG13  HG23  0.24  
669  308  1  343  343  HG13  HG22  0.24  
670  308  1  343  343  HG13  HG21  0.24  
671  308  1  343  343  HG13  HG23  0.24  
672  308  1  389  389  HG13  HG22  0.24  
673  308  1  389  389  HG13  HG21  0.24  
674  308  1  389  389  HG13  HG23  0.24  
675  308  1  435  435  HG13  HG22  0.24  
676  308  1  435  435  HG13  HG21  0.24  
677  308  1  435  435  HG13  HG23  0.24  
678  270  1  377  377  HA    HD3   0.24  
679  263  1  403  389  HD12  HG13  0.24  
680  263  1  403  389  HD11  HG13  0.24  
681  263  1  403  389  HD13  HG13  0.24  
682  170  1  145  162  HB2   H     0.24  
683  170  1  283  300  HB2   H     0.24  
684  712  1  269  268  H     HE1   0.23  
685  712  1  269  268  H     HE2   0.23  
686  557  1  336  326  H     HG22  0.23  
687  557  1  336  326  H     HG21  0.23  
688  557  1  336  326  H     HG23  0.23  
689  401  1  145  144  H     HB3   0.23  
690  401  1  375  374  H     HB3   0.23  
691  333  1  284  316  HD12  HB3   0.23  
692  333  1  284  316  HD11  HB3   0.23  
693  333  1  284  316  HD13  HB3   0.23  
694  308  1  205  205  HG13  HG22  0.23  
695  308  1  205  205  HG13  HG21  0.23  
696  308  1  205  205  HG13  HG23  0.23  
697  227  1  309  309  HD12  H     0.23  
698  227  1  309  309  HD11  H     0.23  
699  227  1  309  309  HD13  H     0.23  
700  108  1  244  249  HB3   HB2   0.23  
701   18  3  178  144  O     H     0.22  
702  712  1  177  176  H     HE1   0.22  
703  712  1  177  176  H     HE2   0.22  
704  712  1  407  406  H     HE1   0.22  
705  712  1  407  406  H     HE2   0.22  
706  680  1  263  262  H     HB3   0.22  
707  546  1  244  244  H     HB3   0.22  
708  546  1  382  382  H     HB3   0.22  
709  263  1  311  297  HD12  HG13  0.22  
710  263  1  311  297  HD11  HG13  0.22  
711  263  1  311  297  HD13  HG13  0.22  
712  170  1  375  392  HB2   H     0.22  
713  161  1  117  117  H     HB    0.22  
714  108  1  382  387  HB3   HB2   0.22  
715  103  1   78   78  HD3   HB3   0.22  
716  103  1  446  446  HD3   HB3   0.22  
717  813  1  436  436  H     HG3   0.21  
718  772  1  282  282  HE21  HB3   0.21  
719  683  1   28   28  H     HG3   0.21  
720  332  1  446  439  HB2   HG22  0.21  
721  332  1  446  439  HB2   HG21  0.21  
722  332  1  446  439  HB2   HG23  0.21  
723  170  1  191  208  HB2   H     0.21  
724  103  1  170  170  HD3   HB3   0.21  
725  103  1  308  308  HD3   HB3   0.21  
726  103  1  400  400  HD3   HB3   0.21  
727  712  1   39   38  H     HE1   0.20  
728  712  1   39   38  H     HE2   0.20  
729  676  1  350  350  H     HG2   0.20  
730  654  1  118  117  H     HB    0.20  
731   48  1  335  326  HA    HG22  0.20  
732   48  1  335  326  HA    HG21  0.20  
733   48  1  335  326  HA    HG23  0.20  
734  456  1   95  136  H     HG12  0.20  
735  456  1   95  136  H     HG11  0.20  
736  456  1   95  136  H     HG13  0.20  
737  401  1  237  236  H     HB3   0.20  
738  391  1  376  376  H     HG    0.20  
739  302  1  327  342  HB3   HB3   0.20  
740  170  1  421  438  HB2   H     0.20  
741  158  1   28   24  HG3   HD22  0.20  
742  158  1   28   24  HG3   HD21  0.20  
743  158  1   28   24  HG3   HD23  0.20  
744  158  1   28   24  HG3   HD12  0.20  
745  158  1   28   24  HG3   HD11  0.20  
746  158  1   28   24  HG3   HD13  0.20  
747  103  1  124  124  HD3   HB3   0.20  
748  728  1   80   80  H     HB3   0.19  
749  683  1  442  442  H     HG3   0.19  
750  554  1  382  388  H     HB3   0.19  
751  546  1   60   60  H     HB3   0.19  
752  412  1  196  193  H     HG2   0.19  
753  412  1  196  193  H     HG3   0.19  
754  234  1   62   61  HG21  HB3   0.19  
755  234  1   62   61  HG22  HB3   0.19  
756  234  1   62   61  HG23  HB3   0.19  
757  134  1  431  431  HE2   HG3   0.19  
758  134  1  431  431  HE3   HG3   0.19  
759  103  1  262  262  HD3   HB3   0.19  
760  772  1  328  328  HE21  HB3   0.18  
761  728  1  172  172  H     HB3   0.18  
762  712  1  361  360  H     HE1   0.18  
763  712  1  361  360  H     HE2   0.18  
764  546  1  106  106  H     HB3   0.18  
765  546  1  198  198  H     HB3   0.18  
766  508  1    5   14  H     HE1   0.18  
767  508  1    5   14  H     HE2   0.18  
768  401  1  283  282  H     HB3   0.18  
769  272  1   80   76  HB3   HG22  0.18  
770  272  1   80   76  HB3   HG21  0.18  
771  272  1   80   76  HB3   HG23  0.18  
772  170  1   53   70  HB2   H     0.18  
773  123  1  269  238  HB2   HD22  0.18  
774  123  1  269  238  HB2   HD21  0.18  
775  123  1  269  238  HB2   HD23  0.18  
776  812  1  282  287  HE21  HA3   0.17  
777  712  1   85   84  H     HE1   0.17  
778  712  1   85   84  H     HE2   0.17  
779  676  1  120  120  H     HG2   0.17  
780  601  1  341  340  H     HB3   0.17  
781  546  1  152  152  H     HB3   0.17  
782  412  1  104  101  H     HG2   0.17  
783  412  1  104  101  H     HG3   0.17  
784  401  1   99   98  H     HB3   0.17  
785  170  1  237  254  HB2   H     0.17  
786  158  1  442  438  HG3   HD22  0.17  
787  158  1  442  438  HG3   HD21  0.17  
788  158  1  442  438  HG3   HD23  0.17  
789  158  1  442  438  HG3   HD12  0.17  
790  158  1  442  438  HG3   HD11  0.17  
791  158  1  442  438  HG3   HD13  0.17  
792  546  1  290  290  H     HB3   0.16  
793  546  1  336  336  H     HB3   0.16  
794  527  1  180  179  H     HB3   0.16  
795   52  1  203  206  HA    HD2   0.16  
796  271  1  353  356  HB2   HB3   0.16  
797  123  1   85   54  HB2   HD22  0.16  
798  123  1   85   54  HB2   HD21  0.16  
799  123  1   85   54  HB2   HD23  0.16  
800  900  1  204  208  H     HG    0.15  
801  900  1  204  219  H     HG22  0.15  
802  900  1  204  219  H     HG21  0.15  
803  900  1  204  219  H     HG23  0.15  
804  676  1   74   74  H     HG2   0.15  
805  676  1  166  166  H     HG2   0.15  
806   57  1  155  158  HA    HB2   0.15  
807  550  1  142  141  H     HB3   0.15  
808  546  1   14   14  H     HB3   0.15  
809  508  1  235  244  H     HE1   0.15  
810  508  1  235  244  H     HE2   0.15  
811  449  1   49   49  H     HD2   0.15  
812  449  1   49   49  H     HD3   0.15  
813    4  1  197  188  HB    HG22  0.15  
814    4  1  197  188  HB    HG21  0.15  
815    4  1  197  188  HB    HG23  0.15  
816  302  1  419  434  HB3   HB3   0.15  
817  233  1   59   52  HG21  HB2   0.15  
818  233  1   59   52  HG22  HB2   0.15  
819  233  1   59   52  HG23  HB2   0.15  
820  227  1  355  355  HD12  H     0.15  
821  227  1  355  355  HD11  H     0.15  
822  227  1  355  355  HD13  H     0.15  
823  227  1  447  447  HD12  H     0.15  
824  227  1  447  447  HD11  H     0.15  
825  227  1  447  447  HD13  H     0.15  
826  205  1    8   40  HD22  HB2   0.15  
827  205  1    8   40  HD21  HB2   0.15  
828  205  1    8   40  HD23  HB2   0.15  
829  158  1  166  162  HG3   HD22  0.15  
830  158  1  166  162  HG3   HD21  0.15  
831  158  1  166  162  HG3   HD23  0.15  
832  158  1  166  162  HG3   HD12  0.15  
833  158  1  166  162  HG3   HD11  0.15  
834  158  1  166  162  HG3   HD13  0.15  
835  158  1  350  346  HG3   HD22  0.15  
836  158  1  350  346  HG3   HD21  0.15  
837  158  1  350  346  HG3   HD23  0.15  
838  158  1  350  346  HG3   HD12  0.15  
839  158  1  350  346  HG3   HD11  0.15  
840  158  1  350  346  HG3   HD13  0.15  
841  900  1  388  392  H     HG    0.14  
842  900  1  388  403  H     HG22  0.14  
843  900  1  388  403  H     HG21  0.14  
844  900  1  388  403  H     HG23  0.14  
845  900  1  434  438  H     HG    0.14  
846  900  1  434  449  H     HG22  0.14  
847  900  1  434  449  H     HG21  0.14  
848  900  1  434  449  H     HG23  0.14  
849  676  1  258  258  H     HG2   0.14  
850  598  1  341  341  H     HG2   0.14  
851  598  1  341  341  H     HG3   0.14  
852  546  1  428  428  H     HB3   0.14  
853  508  1   97  106  H     HE1   0.14  
854  508  1   97  106  H     HE2   0.14  
855  508  1  143  152  H     HE1   0.14  
856  508  1  143  152  H     HE2   0.14  
857  391  1    8    8  H     HG    0.14  
858  305  1  120  116  HG2   HA    0.14  
859  305  1  350  346  HG2   HA    0.14  
860   30  1  126  122  HB2   HG22  0.14  
861   30  1  126  122  HB2   HG21  0.14  
862   30  1  126  122  HB2   HG23  0.14  
863  271  1  399  402  HB2   HB3   0.14  
864  205  1  330  362  HD22  HB2   0.14  
865  205  1  330  362  HD21  HB2   0.14  
866  205  1  330  362  HD23  HB2   0.14  
867  163  1   32   35  HB2   HD12  0.14  
868  163  1   32   35  HB2   HD11  0.14  
869  163  1   32   35  HB2   HD13  0.14  
870  158  1  120  116  HG3   HD22  0.14  
871  158  1  120  116  HG3   HD21  0.14  
872  158  1  120  116  HG3   HD23  0.14  
873  158  1  120  116  HG3   HD12  0.14  
874  158  1  120  116  HG3   HD11  0.14  
875  158  1  120  116  HG3   HD13  0.14  
876   92  1  171  171  HA    HD22  0.13  
877   92  1  171  171  HA    HD21  0.13  
878   92  1  171  171  HA    HD23  0.13  
879  813  1   22   22  H     HG3   0.13  
880  728  1  448  448  H     HB3   0.13  
881  550  1   50   49  H     HB3   0.13  
882  518  1  281  280  H     HG22  0.13  
883  518  1  281  280  H     HG21  0.13  
884  518  1  281  280  H     HG23  0.13  
885  508  1   51   60  H     HE1   0.13  
886  508  1   51   60  H     HE2   0.13  
887  305  1  166  162  HG2   HA    0.13  
888   30  1  264  260  HB2   HG22  0.13  
889   30  1  264  260  HB2   HG21  0.13  
890   30  1  264  260  HB2   HG23  0.13  
891  239  1  122  120  HG22  HB3   0.13  
892  239  1  122  120  HG21  HB3   0.13  
893  239  1  122  120  HG23  HB3   0.13  
894  156  1  278  320  HG2   HG12  0.13  
895  156  1  278  320  HG2   HG11  0.13  
896  156  1  278  320  HG2   HG13  0.13  
897  156  1  278  320  HG3   HG12  0.13  
898  156  1  278  320  HG3   HG11  0.13  
899  156  1  278  320  HG3   HG13  0.13  
900  560  1   50   50  H     HG12  0.12  
901  560  1   50   50  H     HG11  0.12  
902  560  1   50   50  H     HG13  0.12  
903  508  1  327  336  H     HE1   0.12  
904  508  1  327  336  H     HE2   0.12  
905  493  1  377  392  H     HA    0.12  
906    4  1   13    4  HB    HG22  0.12  
907    4  1   13    4  HB    HG21  0.12  
908    4  1   13    4  HB    HG23  0.12  
909  237  1  427  418  HG21  HG12  0.12  
910  237  1  427  418  HG21  HG11  0.12  
911  237  1  427  418  HG21  HG13  0.12  
912  237  1  427  418  HG22  HG12  0.12  
913  237  1  427  418  HG22  HG11  0.12  
914  237  1  427  418  HG22  HG13  0.12  
915  237  1  427  418  HG23  HG12  0.12  
916  237  1  427  418  HG23  HG11  0.12  
917  237  1  427  418  HG23  HG13  0.12  
918   92  1  263  263  HA    HD22  0.11  
919   92  1  263  263  HA    HD21  0.11  
920   92  1  263  263  HA    HD23  0.11  
921  754  1  103   98  H     HB3   0.11  
922  728  1   34   34  H     HB3   0.11  
923  725  1  177  146  H     HD22  0.11  
924  725  1  177  146  H     HD21  0.11  
925  725  1  177  146  H     HD23  0.11  
926  401  1  329  328  H     HB3   0.11  
927  332  1   78   71  HB2   HG22  0.11  
928  332  1   78   71  HB2   HG21  0.11  
929  332  1   78   71  HB2   HG23  0.11  
930  324  1   51   66  HB3   HD12  0.11  
931  324  1   51   66  HB3   HD11  0.11  
932  324  1   51   66  HB3   HD13  0.11  
933  305  1   28   24  HG2   HA    0.11  
934  305  1  442  438  HG2   HA    0.11  
935  234  1  384  383  HG21  HB3   0.11  
936  234  1  384  383  HG22  HB3   0.11  
937  234  1  384  383  HG23  HB3   0.11  
938  158  1  304  300  HG3   HD22  0.11  
939  158  1  304  300  HG3   HD21  0.11  
940  158  1  304  300  HG3   HD23  0.11  
941  158  1  304  300  HG3   HD12  0.11  
942  158  1  304  300  HG3   HD11  0.11  
943  158  1  304  300  HG3   HD13  0.11  
#
loop_
_pdbx_vrpt_dihedralangle_violations_summary.ordinal
_pdbx_vrpt_dihedralangle_violations_summary.restraint_type
_pdbx_vrpt_dihedralangle_violations_summary.restraints_count
_pdbx_vrpt_dihedralangle_violations_summary.percent_total
_pdbx_vrpt_dihedralangle_violations_summary.consistently_violated_count
_pdbx_vrpt_dihedralangle_violations_summary.consistently_violated_percent_total
_pdbx_vrpt_dihedralangle_violations_summary.consistently_violated_percent_type
_pdbx_vrpt_dihedralangle_violations_summary.violated_count
_pdbx_vrpt_dihedralangle_violations_summary.violated_percent_total
_pdbx_vrpt_dihedralangle_violations_summary.violated_percent_type
1  PSI    37   48.1  0  0.0  0.0   9  11.7  24.3  
2  PHI    40   51.9  0  0.0  0.0   7   9.1  17.5  
3  Total  77  100.0  0  0.0  0.0  16  20.8  20.8  
#
loop_
_pdbx_vrpt_dihedralangle_violation_model_summary.ordinal
_pdbx_vrpt_dihedralangle_violation_model_summary.PDB_model_num
_pdbx_vrpt_dihedralangle_violation_model_summary.max_violation
_pdbx_vrpt_dihedralangle_violation_model_summary.mean_violation
_pdbx_vrpt_dihedralangle_violation_model_summary.median_violation
_pdbx_vrpt_dihedralangle_violation_model_summary.standard_deviation
 1   1  2.80  1.75  1.70  0.57  
 2   2  1.90  1.42  1.35  0.31  
 3   3  2.20  1.60  1.45  0.37  
 4   4  5.00  2.90  2.75  1.61  
 5   5  5.40  2.08  1.20  1.67  
 6   6  2.40  1.54  1.40  0.43  
 7   7  1.80  1.48  1.50  0.26  
 8   8  3.30  2.18  2.00  0.65  
 9   9  2.20  1.83  1.70  0.26  
10  10  1.90  1.55  1.60  0.30  
#
loop_
_pdbx_vrpt_dihedralangle_violation_model.ordinal
_pdbx_vrpt_dihedralangle_violation_model.PDB_model_num
_pdbx_vrpt_dihedralangle_violation_model.ang_rest_type
_pdbx_vrpt_dihedralangle_violation_model.violations_count
 1   1  PSI    4  
 2   1  PHI    2  
 3   1  Total  6  
 4   2  PSI    2  
 5   2  PHI    2  
 6   2  Total  4  
 7   3  PSI    2  
 8   3  PHI    2  
 9   3  Total  4  
10   4  PSI    3  
11   4  PHI    1  
12   4  Total  4  
13   5  PSI    4  
14   5  PHI    1  
15   5  Total  5  
16   6  PSI    3  
17   6  PHI    4  
18   6  Total  7  
19   7  PSI    3  
20   7  PHI    1  
21   7  Total  4  
22   8  PSI    3  
23   8  PHI    2  
24   8  Total  5  
25   9  PSI    2  
26   9  PHI    1  
27   9  Total  3  
28  10  PSI    4  
29  10  PHI    0  
30  10  Total  4  
#
loop_
_pdbx_vrpt_dihedralangle_violation_ensemble_summary.id
_pdbx_vrpt_dihedralangle_violation_ensemble_summary.fraction_of_ensemble_count
_pdbx_vrpt_dihedralangle_violation_ensemble_summary.fraction_of_ensemble_percent
 1   1   10.0  
 2   2   20.0  
 3   3   30.0  
 4   4   40.0  
 5   5   50.0  
 6   6   60.0  
 7   7   70.0  
 8   8   80.0  
 9   9   90.0  
10  10  100.0  
#
loop_
_pdbx_vrpt_dihedralangle_ensemble_violation.ordinal
_pdbx_vrpt_dihedralangle_ensemble_violation.ensemble_dihedral_count
_pdbx_vrpt_dihedralangle_ensemble_violation.ang_rest_type
_pdbx_vrpt_dihedralangle_ensemble_violation.violations_count
 1   1  PSI    1  
 2   1  PHI    5  
 3   1  Total  6  
 4   2  PSI    2  
 5   2  PHI    0  
 6   2  Total  2  
 7   3  PSI    3  
 8   3  PHI    1  
 9   3  Total  4  
10   4  PSI    1  
11   4  PHI    0  
12   4  Total  1  
13   5  PSI    1  
14   5  PHI    0  
15   5  Total  1  
16   6  PSI    0  
17   6  PHI    0  
18   6  Total  0  
19   7  PSI    1  
20   7  PHI    0  
21   7  Total  1  
22   8  PSI    0  
23   8  PHI    1  
24   8  Total  1  
25   9  PSI    0  
26   9  PHI    0  
27   9  Total  0  
28  10  PSI    0  
29  10  PHI    0  
30  10  Total  0  
#
loop_
_pdbx_vrpt_residual_angle_violations.ordinal
_pdbx_vrpt_residual_angle_violations.bins
_pdbx_vrpt_residual_angle_violations.max_violation
_pdbx_vrpt_residual_angle_violations.violations_per_model
1  1.0-10.0   5.4   4.6   
2  10.0-20.0  None  None  
3  >20.0      None  None  
#
loop_
_pdbx_vrpt_most_violated_dihedralangle_restraints.ordinal
_pdbx_vrpt_most_violated_dihedralangle_restraints.rest_id
_pdbx_vrpt_most_violated_dihedralangle_restraints.rlist_id
_pdbx_vrpt_most_violated_dihedralangle_restraints.altcode_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.chain_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.resnum_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.resname_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.icode_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.ent_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.said_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.seq_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.atom_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.chain_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.altcode_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.resnum_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.resname_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.seq_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.said_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.ent_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.icode_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.atom_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.altcode_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.chain_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.resnum_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.resname_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.icode_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.ent_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.said_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.seq_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.atom_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.chain_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.altcode_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.resnum_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.resname_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.seq_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.said_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.ent_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.icode_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.atom_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.violated_models
_pdbx_vrpt_most_violated_dihedralangle_restraints.mean_angle_violation
_pdbx_vrpt_most_violated_dihedralangle_restraints.median_violation
_pdbx_vrpt_most_violated_dihedralangle_restraints.standard_deviation
 1  40  1  .  A  50  VAL  ?     1  A  50  C  A  .  51  SER  51  A  1  ?     N   .  A  51  SER  ?     1  A  51  CA  A  .  51  SER  51  A  1  ?     C  8  1.88  1.65  0.64  
 2  56  1  .  A  26  LEU  ?     1  A  26  N  A  .  26  LEU  26  A  1  ?     CA  .  A  26  LEU  ?     1  A  26  C   A  .  27  ILE  27  A  1  ?     N  7  2.29  1.80  1.28  
 3  59  1  .  A  29  HIS  ?     1  A  29  N  A  .  29  HIS  29  A  1  ?     CA  .  A  29  HIS  ?     1  A  29  C   A  .  30  LEU  30  A  1  ?     N  5  1.50  1.60  0.24  
 4  70  1  .  A  43  TYR  ?     1  A  43  N  A  .  43  TYR  43  A  1  ?     CA  .  A  43  TYR  ?     1  A  43  C   A  .  44  TYR  44  A  1  ?     N  4  1.30  1.20  0.23  
 5  36  1  .  A  46  GLN  ?     1  A  46  C  A  .  47  SER  47  A  1  ?     N   .  A  47  SER  ?     1  A  47  CA  A  .  47  SER  47  A  1  ?     C  3  2.43  2.00  1.07  
 6  47  1  .  A  14  LEU  ?     1  A  14  N  A  .  14  LEU  14  A  1  ?     CA  .  A  14  LEU  ?     1  A  14  C   A  .  15  ARG  15  A  1  ?     N  3  1.67  1.10  0.80  
 7  75  1  .  A  48  PHE  ?     1  A  48  N  A  .  48  PHE  48  A  1  ?     CA  .  A  48  PHE  ?     1  A  48  C   A  .  49  SER  49  A  1  ?     N  3  1.67  1.50  0.54  
 8  76  1  .  A  49  SER  ?     1  A  49  N  A  .  49  SER  49  A  1  ?     CA  .  A  49  SER  ?     1  A  49  C   A  .  50  VAL  50  A  1  ?     N  3  1.40  1.40  0.08  
 9  74  1  .  A  47  SER  ?     1  A  47  N  A  .  47  SER  47  A  1  ?     CA  .  A  47  SER  ?     1  A  47  C   A  .  48  PHE  48  A  1  ?     N  2  3.50  3.50  1.50  
10  69  1  .  A  42  ASP  ?     1  A  42  N  A  .  42  ASP  42  A  1  ?     CA  .  A  42  ASP  ?     1  A  42  C   A  .  43  TYR  43  A  1  ?     N  2  1.60  1.60  0.30  
#
loop_
_pdbx_vrpt_violated_dihedralangle_restraints.ordinal
_pdbx_vrpt_violated_dihedralangle_restraints.rest_id
_pdbx_vrpt_violated_dihedralangle_restraints.rlist_id
_pdbx_vrpt_violated_dihedralangle_restraints.instance_id_1
_pdbx_vrpt_violated_dihedralangle_restraints.instance_id_2
_pdbx_vrpt_violated_dihedralangle_restraints.instance_id_3
_pdbx_vrpt_violated_dihedralangle_restraints.instance_id_4
_pdbx_vrpt_violated_dihedralangle_restraints.atom_1
_pdbx_vrpt_violated_dihedralangle_restraints.atom_2
_pdbx_vrpt_violated_dihedralangle_restraints.atom_3
_pdbx_vrpt_violated_dihedralangle_restraints.atom_4
_pdbx_vrpt_violated_dihedralangle_restraints.violation
 1  56  1  204  204  204  205  N  CA  C   N  5.40  
 2  74  1  179  179  179  180  N  CA  C   N  5.00  
 3  36  1  178  179  179  179  C  N   CA  C  3.90  
 4  40  1  366  367  367  367  C  N   CA  C  3.30  
 5  47  1    8    8    8    9  N  CA  C   N  2.80  
 6  75  1  364  364  364  365  N  CA  C   N  2.40  
 7  29  1  262  263  263  263  C  N   CA  C  2.40  
 8  40  1  136  137  137  137  C  N   CA  C  2.20  
 9  40  1  412  413  413  413  C  N   CA  C  2.20  
10  74  1   41   41   41   42  N  CA  C   N  2.00  
11  36  1  362  363  363  363  C  N   CA  C  2.00  
12  69  1  450  450  450  451  N  CA  C   N  1.90  
13  56  1   20   20   20   21  N  CA  C   N  1.90  
14  56  1   66   66   66   67  N  CA  C   N  1.90  
15  59  1  345  345  345  346  N  CA  C   N  1.80  
16  56  1  250  250  250  251  N  CA  C   N  1.80  
17  40  1  320  321  321  321  C  N   CA  C  1.80  
18  70  1  267  267  267  268  N  CA  C   N  1.70  
19  56  1  388  388  388  389  N  CA  C   N  1.70  
20  56  1  434  434  434  435  N  CA  C   N  1.70  
21  59  1  161  161  161  162  N  CA  C   N  1.60  
22  59  1  391  391  391  392  N  CA  C   N  1.60  
23  56  1  296  296  296  297  N  CA  C   N  1.60  
24   3  1   95   96   96   96  C  N   CA  C  1.60  
25  76  1  227  227  227  228  N  CA  C   N  1.50  
26  75  1  456  456  456  457  N  CA  C   N  1.50  
27  40  1   44   45   45   45  C  N   CA  C  1.50  
28  40  1   90   91   91   91  C  N   CA  C  1.50  
29  76  1  365  365  365  366  N  CA  C   N  1.40  
30  59  1  299  299  299  300  N  CA  C   N  1.40  
31  36  1  270  271  271  271  C  N   CA  C  1.40  
32  76  1  135  135  135  136  N  CA  C   N  1.30  
33  69  1  128  128  128  129  N  CA  C   N  1.30  
34  40  1  274  275  275  275  C  N   CA  C  1.30  
35  70  1   37   37   37   38  N  CA  C   N  1.20  
36  70  1  221  221  221  222  N  CA  C   N  1.20  
37   5  1   51   52   52   52  C  N   CA  C  1.20  
38  40  1  228  229  229  229  C  N   CA  C  1.20  
39   9  1    9   10   10   10  C  N   CA  C  1.10  
40  75  1  318  318  318  319  N  CA  C   N  1.10  
41  70  1  175  175  175  176  N  CA  C   N  1.10  
42  59  1  207  207  207  208  N  CA  C   N  1.10  
43  54  1  248  248  248  249  N  CA  C   N  1.10  
44  47  1   54   54   54   55  N  CA  C   N  1.10  
45  47  1  422  422  422  423  N  CA  C   N  1.10  
46  10  1  241  242  242  242  C  N   CA  C  1.10  
#
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  coreclust              2.33                                                                  Y  
4  chemicalshiftanalysis  2.33                                                                  Y  
5  panav                  "Wang et al. (2010)"                                                  Y  
6  rci                    "v_1n_11_5_13_A (Berjanski et al., 2005)"                             Y  
7  restraintsanalysis     v1.2                                                                  Y  
8  percentiles            "20191225.v01 (using entries in the PDB archive December 25th 2019)"  Y  
##
