data_7RPQ

_pdbx_vrpt_database.id    PDB
_pdbx_vrpt_database.code  7RPQ
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   x-ray
#
_pdbx_vrpt_summary.entry_id                    7RPQ
_pdbx_vrpt_summary.PDB_deposition_date         2021-08-04
_pdbx_vrpt_summary.PDB_revision_number         1
_pdbx_vrpt_summary.PDB_revision_date           2022-04-27
_pdbx_vrpt_summary.report_creation_date        2022-04-19:14:02
_pdbx_vrpt_summary.attempted_validation_steps  molprobity,validation-pack,xtriage,eds,percentiles,writexml,writecif,writepdf
_pdbx_vrpt_summary.ligands_for_buster_report   N
#
_pdbx_vrpt_entity.id           1
_pdbx_vrpt_entity.type         polymer
_pdbx_vrpt_entity.description  "Probable carboxyl-terminal protease"
#
loop_
_pdbx_vrpt_asym.label_asym_id
_pdbx_vrpt_asym.entity_id
A  1  
B  1  
#
loop_
_pdbx_vrpt_percentile_list.id
_pdbx_vrpt_percentile_list.range
_pdbx_vrpt_percentile_list.exp_method
1  all  x-ray  
2  3.3  x-ray  
#
loop_
_pdbx_vrpt_percentile_type.id
_pdbx_vrpt_percentile_type.type
1  all_atom_clashscore           
2  Ramachandran_outlier_percent  
3  rotamer_outliers_percent      
4  RSRZ_outliers_percent         
5  R_value_R_free                
#
loop_
_pdbx_vrpt_percentile_conditions.id
_pdbx_vrpt_percentile_conditions.percentile_list_id
_pdbx_vrpt_percentile_conditions.type_id
_pdbx_vrpt_percentile_conditions.rank
_pdbx_vrpt_percentile_conditions.number_entries_total
_pdbx_vrpt_percentile_conditions.res_high
_pdbx_vrpt_percentile_conditions.res_low
 1  1  1   26.06  141614     ?     ?  
 2  2  1   57.68    1205  3.26  3.34  
 3  1  2  100.00  138981     ?     ?  
 4  2  2  100.00    1183  3.26  3.34  
 5  1  3   66.62  138945     ?     ?  
 6  2  3   81.73    1182  3.26  3.34  
 7  1  4    5.00  127900     ?     ?  
 8  2  4    4.84    1115  3.26  3.34  
 9  1  5   27.11  130704     ?     ?  
10  2  5   69.15    1149  3.26  3.34  
#
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   66.62  
 4  6  3  A  1  1  A   81.73  
 5  7  4  A  1  1  A    7.21  
 6  8  4  A  1  1  A    7.00  
 7  3  2  B  1  1  B  100.00  
 8  4  2  B  1  1  B  100.00  
 9  5  3  B  1  1  B   66.62  
10  6  3  B  1  1  B   81.73  
11  7  4  B  1  1  B    3.45  
12  8  4  B  1  1  B    3.18  
#
loop_
_pdbx_vrpt_summary_entity_geometry.ordinal
_pdbx_vrpt_summary_entity_geometry.PDB_model_num
_pdbx_vrpt_summary_entity_geometry.entity_id
_pdbx_vrpt_summary_entity_geometry.label_asym_id
_pdbx_vrpt_summary_entity_geometry.auth_asym_id
_pdbx_vrpt_summary_entity_geometry.angles_RMSZ
_pdbx_vrpt_summary_entity_geometry.bonds_RMSZ
_pdbx_vrpt_summary_entity_geometry.num_bonds_RMSZ
_pdbx_vrpt_summary_entity_geometry.num_angles_RMSZ
1  1  1  A  A  0.57  0.28  1984  2682  
2  1  1  B  B  0.55  0.27  1991  2691  
#
_pdbx_vrpt_summary_geometry.ordinal                        1
_pdbx_vrpt_summary_geometry.percent_ramachandran_outliers  0.00
_pdbx_vrpt_summary_geometry.percent_rotamer_outliers       1.40
_pdbx_vrpt_summary_geometry.clashscore                     10.39
_pdbx_vrpt_summary_geometry.num_H_reduce                   4052
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ                 3975
_pdbx_vrpt_summary_geometry.bonds_RMSZ                     0.27
_pdbx_vrpt_summary_geometry.num_angles_RMSZ                5373
_pdbx_vrpt_summary_geometry.angles_RMSZ                    0.56
#
_pdbx_vrpt_summary_diffraction.exp_method                x-ray
_pdbx_vrpt_summary_diffraction.ordinal                   1
_pdbx_vrpt_summary_diffraction.bulk_solvent_b            65.008
_pdbx_vrpt_summary_diffraction.Wilson_B_estimate         90.562
_pdbx_vrpt_summary_diffraction.I_over_sigma              2.33(3.32A)
_pdbx_vrpt_summary_diffraction.num_miller_indices        26026
_pdbx_vrpt_summary_diffraction.bulk_solvent_k            0.347
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L_mean     0.391
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L2_mean    0.215
_pdbx_vrpt_summary_diffraction.Fo_Fc_correlation         0.919
_pdbx_vrpt_summary_diffraction.twin_fraction             h,-h-k,-l:0.160
_pdbx_vrpt_summary_diffraction.DCC_R                     0.24
_pdbx_vrpt_summary_diffraction.DCC_Rfree                 0.26
_pdbx_vrpt_summary_diffraction.EDS_R                     0.21
_pdbx_vrpt_summary_diffraction.EDS_res_high              3.30
_pdbx_vrpt_summary_diffraction.EDS_res_low               39.83
_pdbx_vrpt_summary_diffraction.Wilson_B_aniso            "[88.301,88.301,95.436,-0.000,0.000,0.000]"
_pdbx_vrpt_summary_diffraction.data_anisotropy           0.079
_pdbx_vrpt_summary_diffraction.trans_NCS_details         "The largest off-origin peak in the Patterson function is 3.18% of the height of the origin peak. No significant pseudotranslation is detected."
_pdbx_vrpt_summary_diffraction.B_factor_type             FULL
_pdbx_vrpt_summary_diffraction.acentric_outliers         0
_pdbx_vrpt_summary_diffraction.centric_outliers          0
_pdbx_vrpt_summary_diffraction.data_completeness         99.93
_pdbx_vrpt_summary_diffraction.number_reflns_R_free      1219
_pdbx_vrpt_summary_diffraction.percent_free_reflections  4.68
_pdbx_vrpt_summary_diffraction.percent_RSRZ_outliers     11.13
_pdbx_vrpt_summary_diffraction.PDB_resolution_high       3.30
_pdbx_vrpt_summary_diffraction.PDB_resolution_low        39.83
_pdbx_vrpt_summary_diffraction.PDB_R                     0.24
_pdbx_vrpt_summary_diffraction.PDB_Rfree                 0.26
#
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    8  LEU  A   41  .  ?        ?  
  2  1  1  A    9  PRO  A   42  .  ?        ?  
  3  1  1  A   10  LEU  A   43  .  ?        ?  
  4  1  1  A   11  ASP  A   44  .  ?        1  
  5  1  1  A   12  GLU  A   45  .  ?        1  
  6  1  1  A   13  LEU  A   46  .  ?        ?  
  7  1  1  A   14  ARG  A   47  .  ?        ?  
  8  1  1  A   15  THR  A   48  .  ?        ?  
  9  1  1  A   16  PHE  A   49  .  ?        ?  
 10  1  1  A   17  ALA  A   50  .  ?        ?  
 11  1  1  A   18  GLU  A   51  .  ?        ?  
 12  1  1  A   19  VAL  A   52  .  ?        ?  
 13  1  1  A   20  LEU  A   53  .  ?        ?  
 14  1  1  A   21  ASP  A   54  .  ?        ?  
 15  1  1  A   22  ARG  A   55  .  ?        ?  
 16  1  1  A   23  VAL  A   56  .  ?        ?  
 17  1  1  A   24  LYS  A   57  .  ?        ?  
 18  1  1  A   25  ALA  A   58  .  ?        ?  
 19  1  1  A   26  ALA  A   59  .  ?        ?  
 20  1  1  A   27  TYR  A   60  .  ?        ?  
 21  1  1  A   28  VAL  A   61  .  ?        ?  
 22  1  1  A   29  GLU  A   62  .  ?        ?  
 23  1  1  A   30  PRO  A   63  .  ?        ?  
 24  1  1  A   31  VAL  A   64  .  ?        ?  
 25  1  1  A   32  ASP  A   65  .  ?        ?  
 26  1  1  A   33  ASP  A   66  .  ?        ?  
 27  1  1  A   34  LYS  A   67  .  ?        ?  
 28  1  1  A   35  THR  A   68  .  ?        ?  
 29  1  1  A   36  LEU  A   69  .  ?        ?  
 30  1  1  A   37  LEU  A   70  .  ?        ?  
 31  1  1  A   38  GLU  A   71  .  ?        1  
 32  1  1  A   39  ASN  A   72  .  ?        ?  
 33  1  1  A   40  ALA  A   73  .  ?        ?  
 34  1  1  A   41  ILE  A   74  .  ?        ?  
 35  1  1  A   42  LYS  A   75  .  ?        1  
 36  1  1  A   43  GLY  A   76  .  ?        ?  
 37  1  1  A   44  MSE  A   77  .  ?        ?  
 38  1  1  A   45  LEU  A   78  .  ?        ?  
 39  1  1  A   46  SER  A   79  .  ?        ?  
 40  1  1  A   47  ASN  A   80  .  ?        ?  
 41  1  1  A   48  LEU  A   81  .  ?        ?  
 42  1  1  A   49  ASP  A   82  .  ?        1  
 43  1  1  A   50  PRO  A   83  .  ?        ?  
 44  1  1  A   51  HIS  A   84  .  ?        ?  
 45  1  1  A   52  SER  A   85  .  ?        1  
 46  1  1  A   53  ALA  A   86  .  ?        ?  
 47  1  1  A   54  TYR  A   87  .  ?        ?  
 48  1  1  A  158  VAL  A  191  .  ?        ?  
 49  1  1  A  159  LYS  A  192  .  ?        ?  
 50  1  1  A  160  SER  A  193  .  ?        ?  
 51  1  1  A  161  VAL  A  194  .  ?        2  
 52  1  1  A  162  LYS  A  195  .  ?        ?  
 53  1  1  A  163  SER  A  196  .  ?        ?  
 54  1  1  A  164  GLN  A  197  .  ?        ?  
 55  1  1  A  165  VAL  A  198  .  ?        ?  
 56  1  1  A  166  LEU  A  199  .  ?        1  
 57  1  1  A  167  GLU  A  200  .  ?        ?  
 58  1  1  A  168  PRO  A  201  .  ?        ?  
 59  1  1  A  169  GLY  A  202  .  ?        2  
 60  1  1  A  170  TYR  A  203  .  ?        ?  
 61  1  1  A  171  ALA  A  204  .  ?        1  
 62  1  1  A  172  TYR  A  205  .  ?        2  
 63  1  1  A  173  LEU  A  206  .  ?        ?  
 64  1  1  A  174  ARG  A  207  .  ?        ?  
 65  1  1  A  175  ILE  A  208  .  ?        1  
 66  1  1  A  176  THR  A  209  .  ?        ?  
 67  1  1  A  177  GLN  A  210  .  ?        ?  
 68  1  1  A  178  PHE  A  211  .  ?        1  
 69  1  1  A  179  GLN  A  212  .  ?        ?  
 70  1  1  A  180  VAL  A  213  .  ?        ?  
 71  1  1  A  181  ASN  A  214  .  ?        ?  
 72  1  1  A  182  THR  A  215  .  ?        ?  
 73  1  1  A  183  GLY  A  216  .  ?        ?  
 74  1  1  A  184  GLU  A  217  .  ?        ?  
 75  1  1  A  185  GLU  A  218  .  ?        1  
 76  1  1  A  186  VAL  A  219  .  ?        ?  
 77  1  1  A  187  VAL  A  220  .  ?        ?  
 78  1  1  A  188  LYS  A  221  .  ?        ?  
 79  1  1  A  189  ALA  A  222  .  ?        ?  
 80  1  1  A  190  LEU  A  223  .  ?        ?  
 81  1  1  A  191  ASN  A  224  .  ?        ?  
 82  1  1  A  192  GLN  A  225  .  ?        ?  
 83  1  1  A  193  LEU  A  226  .  ?        1  
 84  1  1  A  194  ARG  A  227  .  ?        ?  
 85  1  1  A  195  LYS  A  228  .  ?        ?  
 86  1  1  A  196  ASP  A  229  .  ?        ?  
 87  1  1  A  197  ASN  A  230  .  ?        1  
 88  1  1  A  198  LYS  A  231  .  ?        ?  
 89  1  1  A  199  GLY  A  232  .  ?        ?  
 90  1  1  A  200  ARG  A  233  .  ?        ?  
 91  1  1  A  201  LEU  A  234  .  ?        ?  
 92  1  1  A  202  LYS  A  235  .  ?        1  
 93  1  1  A  203  GLY  A  236  .  ?        ?  
 94  1  1  A  204  LEU  A  237  .  ?        ?  
 95  1  1  A  205  VAL  A  238  .  ?        ?  
 96  1  1  A  206  LEU  A  239  .  ?        ?  
 97  1  1  A  207  ASP  A  240  .  ?        1  
 98  1  1  A  208  LEU  A  241  .  ?        ?  
 99  1  1  A  209  ARG  A  242  .  ?        ?  
100  1  1  A  210  ASN  A  243  .  ?        1  
101  1  1  A  211  ASN  A  244  .  ?        ?  
102  1  1  A  212  PRO  A  245  .  ?        ?  
103  1  1  A  213  GLY  A  246  .  ?        ?  
104  1  1  A  214  GLY  A  247  .  ?        ?  
105  1  1  A  215  VAL  A  248  .  ?        ?  
106  1  1  A  216  LEU  A  249  .  ?        ?  
107  1  1  A  217  GLN  A  250  .  ?        1  
108  1  1  A  218  SER  A  251  .  ?        ?  
109  1  1  A  219  ALA  A  252  .  ?        1  
110  1  1  A  220  VAL  A  253  .  ?        1  
111  1  1  A  221  GLU  A  254  .  ?        ?  
112  1  1  A  222  VAL  A  255  .  ?        ?  
113  1  1  A  223  ALA  A  256  .  ?        ?  
114  1  1  A  224  ASP  A  257  .  ?        1  
115  1  1  A  225  ALA  A  258  .  ?        1  
116  1  1  A  226  PHE  A  259  .  ?        ?  
117  1  1  A  227  LEU  A  260  .  ?        1  
118  1  1  A  228  THR  A  261  .  ?        ?  
119  1  1  A  229  LYS  A  262  .  ?        ?  
120  1  1  A  230  GLY  A  263  .  ?        ?  
121  1  1  A  231  LEU  A  264  .  ?        ?  
122  1  1  A  232  ILE  A  265  .  ?        ?  
123  1  1  A  233  VAL  A  266  .  ?        1  
124  1  1  A  234  TYR  A  267  .  ?        1  
125  1  1  A  235  THR  A  268  .  ?        2  
126  1  1  A  236  LYS  A  269  .  ?        2  
127  1  1  A  237  GLY  A  270  .  ?        ?  
128  1  1  A  238  ARG  A  271  .  ?        ?  
129  1  1  A  239  ILE  A  272  .  ?        3  
130  1  1  A  240  ALA  A  273  .  ?        1  
131  1  1  A  241  ASN  A  274  .  ?        ?  
132  1  1  A  242  SER  A  275  .  ?        2  
133  1  1  A  243  GLU  A  276  .  ?        ?  
134  1  1  A  244  LEU  A  277  .  ?        1  
135  1  1  A  245  ARG  A  278  .  ?        ?  
136  1  1  A  246  PHE  A  279  .  ?        1  
137  1  1  A  247  SER  A  280  .  ?        ?  
138  1  1  A  248  ALA  A  281  .  ?        ?  
139  1  1  A  249  ASP  A  282  .  ?        ?  
140  1  1  A  250  PRO  A  283  .  ?        ?  
141  1  1  A  251  ALA  A  284  .  ?        ?  
142  1  1  A  252  ASP  A  285  .  ?        1  
143  1  1  A  253  PRO  A  286  .  ?        1  
144  1  1  A  254  SER  A  287  .  ?        1  
145  1  1  A  255  ASP  A  288  .  ?        ?  
146  1  1  A  256  LYS  A  289  .  ?        ?  
147  1  1  A  257  VAL  A  290  .  ?        ?  
148  1  1  A  258  PRO  A  291  .  ?        ?  
149  1  1  A  259  LEU  A  292  .  ?        ?  
150  1  1  A  260  VAL  A  293  .  ?        ?  
151  1  1  A  261  VAL  A  294  .  ?        1  
152  1  1  A  262  LEU  A  295  .  ?        ?  
153  1  1  A  263  ILE  A  296  .  ?        ?  
154  1  1  A  264  ASN  A  297  .  ?        1  
155  1  1  A  265  GLY  A  298  .  ?        ?  
156  1  1  A  266  GLY  A  299  .  ?        ?  
157  1  1  A  267  SER  A  300  .  ?        ?  
158  1  1  A  268  ALA  A  301  .  ?        2  
159  1  1  A  269  SER  A  302  .  ?        1  
160  1  1  A  270  ALA  A  303  .  ?        1  
161  1  1  A  271  ALA  A  304  .  ?        ?  
162  1  1  A  272  GLU  A  305  .  ?        2  
163  1  1  A  273  ILE  A  306  .  ?        1  
164  1  1  A  274  VAL  A  307  .  ?        ?  
165  1  1  A  275  ALA  A  308  .  ?        ?  
166  1  1  A  276  GLY  A  309  .  ?        ?  
167  1  1  A  277  ALA  A  310  .  ?        ?  
168  1  1  A  278  LEU  A  311  .  ?        ?  
169  1  1  A  279  GLN  A  312  .  ?        ?  
170  1  1  A  280  ASP  A  313  .  ?        1  
171  1  1  A  281  GLN  A  314  .  ?        1  
172  1  1  A  282  LYS  A  315  .  ?        ?  
173  1  1  A  283  ARG  A  316  .  ?        ?  
174  1  1  A  284  ALA  A  317  .  ?        ?  
175  1  1  A  285  ILE  A  318  .  ?        ?  
176  1  1  A  286  LEU  A  319  .  ?        1  
177  1  1  A  287  MSE  A  320  .  ?        ?  
178  1  1  A  288  GLY  A  321  .  ?        ?  
179  1  1  A  289  THR  A  322  .  ?        ?  
180  1  1  A  290  ASP  A  323  .  ?        ?  
181  1  1  A  291  SER  A  324  .  ?        ?  
182  1  1  A  292  PHE  A  325  .  ?        1  
183  1  1  A  293  GLY  A  326  .  ?        2  
184  1  1  A  294  LYS  A  327  .  ?        ?  
185  1  1  A  295  GLY  A  328  .  ?        1  
186  1  1  A  296  SER  A  329  .  ?        1  
187  1  1  A  297  VAL  A  330  .  ?        ?  
188  1  1  A  298  GLN  A  331  .  ?        ?  
189  1  1  A  299  THR  A  332  .  ?        ?  
190  1  1  A  300  VAL  A  333  .  ?        1  
191  1  1  A  301  LEU  A  334  .  ?        ?  
192  1  1  A  302  PRO  A  335  .  ?        ?  
193  1  1  A  303  LEU  A  336  .  ?        ?  
194  1  1  A  304  ASN  A  337  .  ?        ?  
195  1  1  A  305  ASN  A  338  .  ?        ?  
196  1  1  A  306  ASP  A  339  .  ?        ?  
197  1  1  A  307  ARG  A  340  .  ?        ?  
198  1  1  A  308  ALA  A  341  .  ?        ?  
199  1  1  A  309  LEU  A  342  .  ?        ?  
200  1  1  A  310  LYS  A  343  .  ?        1  
201  1  1  A  311  LEU  A  344  .  ?        ?  
202  1  1  A  312  THR  A  345  .  ?        ?  
203  1  1  A  313  THR  A  346  .  ?        ?  
204  1  1  A  314  ALA  A  347  .  ?        ?  
205  1  1  A  315  LEU  A  348  .  ?        ?  
206  1  1  A  316  TYR  A  349  .  ?        2  
207  1  1  A  317  TYR  A  350  .  ?        1  
208  1  1  A  318  THR  A  351  .  ?        ?  
209  1  1  A  319  PRO  A  352  .  ?        ?  
210  1  1  A  320  ASN  A  353  .  ?        1  
211  1  1  A  321  GLY  A  354  .  ?        ?  
212  1  1  A  322  ARG  A  355  .  ?        1  
213  1  1  A  323  SER  A  356  .  ?        ?  
214  1  1  A  324  ILE  A  357  .  ?        ?  
215  1  1  A  325  GLN  A  358  .  ?        3  
216  1  1  A  326  ALA  A  359  .  ?        ?  
217  1  1  A  327  GLN  A  360  .  ?        1  
218  1  1  A  328  GLY  A  361  .  ?        ?  
219  1  1  A  329  ILE  A  362  .  ?        ?  
220  1  1  A  330  VAL  A  363  .  ?        ?  
221  1  1  A  331  PRO  A  364  .  ?        ?  
222  1  1  A  332  ASP  A  365  .  ?        ?  
223  1  1  A  333  ILE  A  366  .  ?        1  
224  1  1  A  334  GLU  A  367  .  ?        ?  
225  1  1  A  335  VAL  A  368  .  ?        2  
226  1  1  A  336  GLY  A  369  .  ?        ?  
227  1  1  A  337  ARG  A  370  .  ?        ?  
228  1  1  A  338  ALA  A  371  .  ?        ?  
229  1  1  A  339  LYS  A  372  .  ?        ?  
230  1  1  A  340  VAL  A  373  .  ?        ?  
231  1  1  A  341  THR  A  374  .  ?        ?  
232  1  1  A  342  GLN  A  375  .  ?        ?  
233  1  1  A  343  GLU  A  376  .  ?        ?  
234  1  1  A  378  GLU  A  411  .  ?        1  
235  1  1  A  379  ARG  A  412  .  ?        1  
236  1  1  A  380  PRO  A  413  .  ?        ?  
237  1  1  A  381  GLN  A  414  .  ?        ?  
238  1  1  A  382  ASP  A  415  .  ?        ?  
239  1  1  A  383  SER  A  416  .  ?        ?  
240  1  1  A  384  ASP  A  417  .  ?        ?  
241  1  1  A  385  TYR  A  418  .  ?        ?  
242  1  1  A  386  GLN  A  419  .  ?        1  
243  1  1  A  387  LEU  A  420  .  ?        ?  
244  1  1  A  388  SER  A  421  .  ?        ?  
245  1  1  A  389  GLN  A  422  .  ?        ?  
246  1  1  A  390  ALA  A  423  .  ?        ?  
247  1  1  A  391  LEU  A  424  .  ?        ?  
248  1  1  A  392  SER  A  425  .  ?        ?  
249  1  1  A  393  LEU  A  426  .  ?        ?  
250  1  1  A  394  LEU  A  427  .  ?        ?  
251  1  1  A  395  LYS  A  428  .  ?        ?  
252  1  1  A  396  GLY  A  429  .  ?        ?  
253  1  1  A  397  LEU  A  430  .  ?        ?  
254  1  1  A  398  SER  A  431  .  ?        ?  
255  1  1  A  399  VAL  A  432  .  ?        ?  
256  1  1  A  400  THR  A  433  .  ?        ?  
257  1  1  A  401  ARG  A  434  .  ?        ?  
258  1  1  A  402  GLY  A  435  .  ?        ?  
259  1  1  B    8  LEU  B   41  .  ?        ?  
260  1  1  B    9  PRO  B   42  .  ?        1  
261  1  1  B   10  LEU  B   43  .  ?        ?  
262  1  1  B   11  ASP  B   44  .  ?        ?  
263  1  1  B   12  GLU  B   45  .  ?        ?  
264  1  1  B   13  LEU  B   46  .  ?        1  
265  1  1  B   14  ARG  B   47  .  ?        ?  
266  1  1  B   15  THR  B   48  .  ?        ?  
267  1  1  B   16  PHE  B   49  .  ?        ?  
268  1  1  B   17  ALA  B   50  .  ?        ?  
269  1  1  B   18  GLU  B   51  .  ?        ?  
270  1  1  B   19  VAL  B   52  .  ?        ?  
271  1  1  B   20  LEU  B   53  .  ?        ?  
272  1  1  B   21  ASP  B   54  .  ?        ?  
273  1  1  B   22  ARG  B   55  .  ?        2  
274  1  1  B   23  VAL  B   56  .  ?        ?  
275  1  1  B   24  LYS  B   57  .  ?        ?  
276  1  1  B   25  ALA  B   58  .  ?        ?  
277  1  1  B   26  ALA  B   59  .  ?        ?  
278  1  1  B   27  TYR  B   60  .  ?        ?  
279  1  1  B   28  VAL  B   61  .  ?        ?  
280  1  1  B   29  GLU  B   62  .  ?        ?  
281  1  1  B   30  PRO  B   63  .  ?        ?  
282  1  1  B   31  VAL  B   64  .  ?        ?  
283  1  1  B   32  ASP  B   65  .  ?        ?  
284  1  1  B   33  ASP  B   66  .  ?        ?  
285  1  1  B   34  LYS  B   67  .  ?        ?  
286  1  1  B   35  THR  B   68  .  ?        ?  
287  1  1  B   36  LEU  B   69  .  ?        ?  
288  1  1  B   37  LEU  B   70  .  ?        ?  
289  1  1  B   38  GLU  B   71  .  ?        ?  
290  1  1  B   39  ASN  B   72  .  ?        ?  
291  1  1  B   40  ALA  B   73  .  ?        ?  
292  1  1  B   41  ILE  B   74  .  ?        ?  
293  1  1  B   42  LYS  B   75  .  ?        ?  
294  1  1  B   43  GLY  B   76  .  ?        ?  
295  1  1  B   44  MSE  B   77  .  ?        ?  
296  1  1  B   45  LEU  B   78  .  ?        1  
297  1  1  B   46  SER  B   79  .  ?        ?  
298  1  1  B   47  ASN  B   80  .  ?        ?  
299  1  1  B   48  LEU  B   81  .  ?        ?  
300  1  1  B   49  ASP  B   82  .  ?        ?  
301  1  1  B   50  PRO  B   83  .  ?        ?  
302  1  1  B   51  HIS  B   84  .  ?        ?  
303  1  1  B   52  SER  B   85  .  ?        ?  
304  1  1  B   53  ALA  B   86  .  ?        ?  
305  1  1  B   54  TYR  B   87  .  ?        1  
306  1  1  B  158  VAL  B  191  .  ?        ?  
307  1  1  B  159  LYS  B  192  .  ?        ?  
308  1  1  B  160  SER  B  193  .  ?        1  
309  1  1  B  161  VAL  B  194  .  ?        ?  
310  1  1  B  162  LYS  B  195  .  ?        ?  
311  1  1  B  163  SER  B  196  .  ?        ?  
312  1  1  B  164  GLN  B  197  .  ?        ?  
313  1  1  B  165  VAL  B  198  .  ?        ?  
314  1  1  B  166  LEU  B  199  .  ?        3  
315  1  1  B  167  GLU  B  200  .  ?        1  
316  1  1  B  168  PRO  B  201  .  ?        ?  
317  1  1  B  169  GLY  B  202  .  ?        ?  
318  1  1  B  170  TYR  B  203  .  ?        ?  
319  1  1  B  171  ALA  B  204  .  ?        1  
320  1  1  B  172  TYR  B  205  .  ?        2  
321  1  1  B  173  LEU  B  206  .  ?        ?  
322  1  1  B  174  ARG  B  207  .  ?        ?  
323  1  1  B  175  ILE  B  208  .  ?        1  
324  1  1  B  176  THR  B  209  .  ?        ?  
325  1  1  B  177  GLN  B  210  .  ?        ?  
326  1  1  B  178  PHE  B  211  .  ?        1  
327  1  1  B  179  GLN  B  212  .  ?        1  
328  1  1  B  180  VAL  B  213  .  ?        ?  
329  1  1  B  181  ASN  B  214  .  ?        1  
330  1  1  B  182  THR  B  215  .  ?        ?  
331  1  1  B  183  GLY  B  216  .  ?        2  
332  1  1  B  184  GLU  B  217  .  ?        1  
333  1  1  B  185  GLU  B  218  .  ?        ?  
334  1  1  B  186  VAL  B  219  .  ?        2  
335  1  1  B  187  VAL  B  220  .  ?        ?  
336  1  1  B  188  LYS  B  221  .  ?        ?  
337  1  1  B  189  ALA  B  222  .  ?        1  
338  1  1  B  190  LEU  B  223  .  ?        1  
339  1  1  B  191  ASN  B  224  .  ?        ?  
340  1  1  B  192  GLN  B  225  .  ?        ?  
341  1  1  B  193  LEU  B  226  .  ?        2  
342  1  1  B  194  ARG  B  227  .  ?        ?  
343  1  1  B  195  LYS  B  228  .  ?        ?  
344  1  1  B  196  ASP  B  229  .  ?        ?  
345  1  1  B  197  ASN  B  230  .  ?        ?  
346  1  1  B  198  LYS  B  231  .  ?        ?  
347  1  1  B  199  GLY  B  232  .  ?        ?  
348  1  1  B  200  ARG  B  233  .  ?        ?  
349  1  1  B  201  LEU  B  234  .  ?        ?  
350  1  1  B  202  LYS  B  235  .  ?        ?  
351  1  1  B  203  GLY  B  236  .  ?        ?  
352  1  1  B  204  LEU  B  237  .  ?        ?  
353  1  1  B  205  VAL  B  238  .  ?        1  
354  1  1  B  206  LEU  B  239  .  ?        ?  
355  1  1  B  207  ASP  B  240  .  ?        1  
356  1  1  B  208  LEU  B  241  .  ?        ?  
357  1  1  B  209  ARG  B  242  .  ?        3  
358  1  1  B  210  ASN  B  243  .  ?        ?  
359  1  1  B  211  ASN  B  244  .  ?        1  
360  1  1  B  212  PRO  B  245  .  ?        ?  
361  1  1  B  213  GLY  B  246  .  ?        1  
362  1  1  B  214  GLY  B  247  .  ?        ?  
363  1  1  B  215  VAL  B  248  .  ?        ?  
364  1  1  B  216  LEU  B  249  .  ?        ?  
365  1  1  B  217  GLN  B  250  .  ?        1  
366  1  1  B  218  SER  B  251  .  ?        1  
367  1  1  B  219  ALA  B  252  .  ?        2  
368  1  1  B  220  VAL  B  253  .  ?        ?  
369  1  1  B  221  GLU  B  254  .  ?        2  
370  1  1  B  222  VAL  B  255  .  ?        ?  
371  1  1  B  223  ALA  B  256  .  ?        ?  
372  1  1  B  224  ASP  B  257  .  ?        1  
373  1  1  B  225  ALA  B  258  .  ?        1  
374  1  1  B  226  PHE  B  259  .  ?        1  
375  1  1  B  227  LEU  B  260  .  ?        ?  
376  1  1  B  228  THR  B  261  .  ?        ?  
377  1  1  B  229  LYS  B  262  .  ?        ?  
378  1  1  B  230  GLY  B  263  .  ?        ?  
379  1  1  B  231  LEU  B  264  .  ?        ?  
380  1  1  B  232  ILE  B  265  .  ?        ?  
381  1  1  B  233  VAL  B  266  .  ?        ?  
382  1  1  B  234  TYR  B  267  .  ?        ?  
383  1  1  B  235  THR  B  268  .  ?        1  
384  1  1  B  236  LYS  B  269  .  ?        ?  
385  1  1  B  237  GLY  B  270  .  ?        ?  
386  1  1  B  238  ARG  B  271  .  ?        ?  
387  1  1  B  239  ILE  B  272  .  ?        3  
388  1  1  B  240  ALA  B  273  .  ?        1  
389  1  1  B  241  ASN  B  274  .  ?        ?  
390  1  1  B  242  SER  B  275  .  ?        2  
391  1  1  B  243  GLU  B  276  .  ?        1  
392  1  1  B  244  LEU  B  277  .  ?        ?  
393  1  1  B  245  ARG  B  278  .  ?        ?  
394  1  1  B  246  PHE  B  279  .  ?        ?  
395  1  1  B  247  SER  B  280  .  ?        ?  
396  1  1  B  248  ALA  B  281  .  ?        1  
397  1  1  B  249  ASP  B  282  .  ?        ?  
398  1  1  B  250  PRO  B  283  .  ?        ?  
399  1  1  B  251  ALA  B  284  .  ?        ?  
400  1  1  B  252  ASP  B  285  .  ?        ?  
401  1  1  B  253  PRO  B  286  .  ?        1  
402  1  1  B  254  SER  B  287  .  ?        ?  
403  1  1  B  255  ASP  B  288  .  ?        ?  
404  1  1  B  256  LYS  B  289  .  ?        ?  
405  1  1  B  257  VAL  B  290  .  ?        ?  
406  1  1  B  258  PRO  B  291  .  ?        ?  
407  1  1  B  259  LEU  B  292  .  ?        ?  
408  1  1  B  260  VAL  B  293  .  ?        2  
409  1  1  B  261  VAL  B  294  .  ?        1  
410  1  1  B  262  LEU  B  295  .  ?        ?  
411  1  1  B  263  ILE  B  296  .  ?        ?  
412  1  1  B  264  ASN  B  297  .  ?        2  
413  1  1  B  265  GLY  B  298  .  ?        ?  
414  1  1  B  266  GLY  B  299  .  ?        ?  
415  1  1  B  267  SER  B  300  .  ?        ?  
416  1  1  B  268  ALA  B  301  .  ?        ?  
417  1  1  B  269  SER  B  302  .  ?        2  
418  1  1  B  270  ALA  B  303  .  ?        1  
419  1  1  B  271  ALA  B  304  .  ?        ?  
420  1  1  B  272  GLU  B  305  .  ?        2  
421  1  1  B  273  ILE  B  306  .  ?        1  
422  1  1  B  274  VAL  B  307  .  ?        ?  
423  1  1  B  275  ALA  B  308  .  ?        ?  
424  1  1  B  276  GLY  B  309  .  ?        ?  
425  1  1  B  277  ALA  B  310  .  ?        ?  
426  1  1  B  278  LEU  B  311  .  ?        ?  
427  1  1  B  279  GLN  B  312  .  ?        ?  
428  1  1  B  280  ASP  B  313  .  ?        ?  
429  1  1  B  281  GLN  B  314  .  ?        ?  
430  1  1  B  282  LYS  B  315  .  ?        2  
431  1  1  B  283  ARG  B  316  .  ?        1  
432  1  1  B  284  ALA  B  317  .  ?        ?  
433  1  1  B  285  ILE  B  318  .  ?        ?  
434  1  1  B  286  LEU  B  319  .  ?        1  
435  1  1  B  287  MSE  B  320  .  ?        ?  
436  1  1  B  288  GLY  B  321  .  ?        ?  
437  1  1  B  289  THR  B  322  .  ?        ?  
438  1  1  B  290  ASP  B  323  .  ?        ?  
439  1  1  B  291  SER  B  324  .  ?        ?  
440  1  1  B  292  PHE  B  325  .  ?        ?  
441  1  1  B  293  GLY  B  326  .  ?        ?  
442  1  1  B  294  LYS  B  327  .  ?        1  
443  1  1  B  295  GLY  B  328  .  ?        ?  
444  1  1  B  296  SER  B  329  .  ?        ?  
445  1  1  B  297  VAL  B  330  .  ?        ?  
446  1  1  B  298  GLN  B  331  .  ?        1  
447  1  1  B  299  THR  B  332  .  ?        ?  
448  1  1  B  300  VAL  B  333  .  ?        ?  
449  1  1  B  301  LEU  B  334  .  ?        ?  
450  1  1  B  302  PRO  B  335  .  ?        ?  
451  1  1  B  303  LEU  B  336  .  ?        ?  
452  1  1  B  304  ASN  B  337  .  ?        ?  
453  1  1  B  305  ASN  B  338  .  ?        ?  
454  1  1  B  306  ASP  B  339  .  ?        ?  
455  1  1  B  307  ARG  B  340  .  ?        ?  
456  1  1  B  308  ALA  B  341  .  ?        ?  
457  1  1  B  309  LEU  B  342  .  ?        2  
458  1  1  B  310  LYS  B  343  .  ?        ?  
459  1  1  B  311  LEU  B  344  .  ?        ?  
460  1  1  B  312  THR  B  345  .  ?        1  
461  1  1  B  313  THR  B  346  .  ?        ?  
462  1  1  B  314  ALA  B  347  .  ?        ?  
463  1  1  B  315  LEU  B  348  .  ?        ?  
464  1  1  B  316  TYR  B  349  .  ?        1  
465  1  1  B  317  TYR  B  350  .  ?        ?  
466  1  1  B  318  THR  B  351  .  ?        1  
467  1  1  B  319  PRO  B  352  .  ?        ?  
468  1  1  B  320  ASN  B  353  .  ?        ?  
469  1  1  B  321  GLY  B  354  .  ?        ?  
470  1  1  B  322  ARG  B  355  .  ?        1  
471  1  1  B  323  SER  B  356  .  ?        ?  
472  1  1  B  324  ILE  B  357  .  ?        1  
473  1  1  B  325  GLN  B  358  .  ?        ?  
474  1  1  B  326  ALA  B  359  .  ?        ?  
475  1  1  B  327  GLN  B  360  .  ?        ?  
476  1  1  B  328  GLY  B  361  .  ?        ?  
477  1  1  B  329  ILE  B  362  .  ?        1  
478  1  1  B  330  VAL  B  363  .  ?        ?  
479  1  1  B  331  PRO  B  364  .  ?        ?  
480  1  1  B  332  ASP  B  365  .  ?        ?  
481  1  1  B  333  ILE  B  366  .  ?        1  
482  1  1  B  334  GLU  B  367  .  ?        ?  
483  1  1  B  335  VAL  B  368  .  ?        2  
484  1  1  B  336  GLY  B  369  .  ?        ?  
485  1  1  B  337  ARG  B  370  .  ?        ?  
486  1  1  B  338  ALA  B  371  .  ?        ?  
487  1  1  B  339  LYS  B  372  .  ?        ?  
488  1  1  B  340  VAL  B  373  .  ?        ?  
489  1  1  B  341  THR  B  374  .  ?        ?  
490  1  1  B  342  GLN  B  375  .  ?        ?  
491  1  1  B  343  GLU  B  376  .  ?        ?  
492  1  1  B  344  ARG  B  377  .  ?        ?  
493  1  1  B  378  GLU  B  411  .  ?        ?  
494  1  1  B  379  ARG  B  412  .  ?        ?  
495  1  1  B  380  PRO  B  413  .  ?        ?  
496  1  1  B  381  GLN  B  414  .  ?        ?  
497  1  1  B  382  ASP  B  415  .  ?        ?  
498  1  1  B  383  SER  B  416  .  ?        ?  
499  1  1  B  384  ASP  B  417  .  ?        1  
500  1  1  B  385  TYR  B  418  .  ?        ?  
501  1  1  B  386  GLN  B  419  .  ?        1  
502  1  1  B  387  LEU  B  420  .  ?        ?  
503  1  1  B  388  SER  B  421  .  ?        ?  
504  1  1  B  389  GLN  B  422  .  ?        ?  
505  1  1  B  390  ALA  B  423  .  ?        1  
506  1  1  B  391  LEU  B  424  .  ?        1  
507  1  1  B  392  SER  B  425  .  ?        ?  
508  1  1  B  393  LEU  B  426  .  ?        ?  
509  1  1  B  394  LEU  B  427  .  ?        ?  
510  1  1  B  395  LYS  B  428  .  ?        ?  
511  1  1  B  396  GLY  B  429  .  ?        ?  
512  1  1  B  397  LEU  B  430  .  ?        ?  
513  1  1  B  398  SER  B  431  .  ?        ?  
514  1  1  B  399  VAL  B  432  .  ?        ?  
515  1  1  B  400  THR  B  433  .  ?        ?  
516  1  1  B  401  ARG  B  434  .  ?        2  
#
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.OWAB
_pdbx_vrpt_model_instance_geometry.num_bonds_RMSZ
_pdbx_vrpt_model_instance_geometry.bonds_RMSZ
_pdbx_vrpt_model_instance_geometry.num_angles_RMSZ
_pdbx_vrpt_model_instance_geometry.angles_RMSZ
_pdbx_vrpt_model_instance_geometry.program_for_bond_angle_geometry
_pdbx_vrpt_model_instance_geometry.average_occupancy
  1    1  pp            ?       ?  ?        10  117.390   8  0.24  12  0.85  molprobity  1.000  
  2    2  Cg_endo   -66.5   106.5  Allowed   7  126.480   8  0.20  11  0.54  molprobity  1.000  
  3    3  mp        -62.9   -28.8  Favored  11  137.170   8  0.28  11  0.50  molprobity  1.000  
  4    4  p30       -61.7   -46.4  Favored   4  147.380   8  0.52  11  1.45  molprobity  1.000  
  5    5  pt-20     -78.0   -24.1  Favored   6  143.870   9  0.34  12  0.79  molprobity  1.000  
  6    6  tm?       -57.5   -30.9  Favored  11  116.570   8  0.29  11  1.05  molprobity  1.000  
  7    7  mtt-85    -58.8   -49.5  Favored  13  132.130  11  0.25  14  1.18  molprobity  1.000  
  8    8  m         -58.0   -49.9  Favored   7  110.530   7  0.55  10  0.62  molprobity  1.000  
  9    9  t80       -63.0   -42.6  Favored   9  101.470  12  0.46  16  0.41  molprobity  1.000  
 10   10  ?         -63.7   -41.9  Favored   5  115.690   5  0.59   7  0.74  molprobity  1.000  
 11   11  tm-20     -59.8   -45.9  Favored   6  126.490   9  0.58  12  0.72  molprobity  1.000  
 12   12  t         -64.6   -42.9  Favored   9  102.550   7  0.26  10  0.35  molprobity  1.000  
 13   13  tt        -64.2   -37.6  Favored  11  100.510   8  0.20  11  0.39  molprobity  1.000  
 14   14  m-20      -69.2   -41.8  Favored   4  113.310   8  0.19  11  0.27  molprobity  1.000  
 15   15  ttm180    -60.1   -40.3  Favored  13  111.570  11  0.25  14  0.93  molprobity  1.000  
 16   16  t         -65.2   -43.3  Favored   9   84.890   7  0.27  10  0.40  molprobity  1.000  
 17   17  ttpp      -61.2   -26.3  Favored  13  115.360   9  0.33  11  0.26  molprobity  1.000  
 18   18  ?         -85.0   -33.9  Favored   5   93.190   5  0.35   7  0.44  molprobity  1.000  
 19   19  ?         -95.8   -30.1  Favored   5   90.360   5  0.25   7  0.84  molprobity  1.000  
 20   20  t80       -56.8   152.9  Favored   9   88.060  13  0.24  18  0.30  molprobity  1.000  
 21   21  t         -68.3   -59.8  Favored   9   86.930   7  0.47  10  0.96  molprobity  1.000  
 22   22  pt-20     -90.5   132.1  Favored   6  126.580   9  0.34  13  0.43  molprobity  1.000  
 23   23  Cg_endo   -65.4   142.9  Favored   7  114.680   8  0.17  11  0.45  molprobity  1.000  
 24   24  m        -133.7   136.3  Favored   9  121.080   7  0.20  10  0.46  molprobity  1.000  
 25   25  p-10      -79.2   173.5  Favored   4  137.660   8  0.22  11  0.45  molprobity  1.000  
 26   26  m-20      -64.0   -33.5  Favored   4  128.290   8  0.23  11  0.25  molprobity  1.000  
 27   27  tmtt?     -65.1   -45.5  Favored  13  131.970   9  0.26  11  0.36  molprobity  1.000  
 28   28  m         -66.7   -38.1  Favored   7  122.100   7  0.19  10  0.45  molprobity  1.000  
 29   29  mt        -64.5   -43.9  Favored  11  111.720   8  0.20  11  0.29  molprobity  1.000  
 30   30  mm?       -63.0   -44.6  Favored  11  111.380   8  0.29  11  0.30  molprobity  1.000  
 31   31  tt0       -62.4   -42.0  Favored   6  122.760   9  0.21  12  0.45  molprobity  1.000  
 32   32  m-20      -66.0   -37.2  Favored   6  100.660   8  0.19  11  0.30  molprobity  1.000  
 33   33  ?         -59.7   -42.8  Favored   5   92.660   5  0.23   7  0.24  molprobity  1.000  
 34   34  mm        -62.0   -54.2  Favored  11   99.680   8  0.32  11  0.33  molprobity  1.000  
 35   35  mttm      -58.1   -39.5  Favored  13  105.560   9  0.27  11  0.40  molprobity  1.000  
 36   36  ?         -77.2   -28.7  Favored   3   84.610   3  0.33   2  0.41  molprobity  1.000  
 37   37  ttp       -63.3   -42.3  Favored   9   98.880   8  0.25  10  0.64  molprobity  1.000  
 38   38  mm?       -69.9   -44.1  Favored  11   91.790   8  0.22  11  0.57  molprobity  1.000  
 39   39  t         -63.3   -42.6  Favored   5   79.110   6  0.24   8  0.41  molprobity  1.000  
 40   40  m120      -74.1   -30.0  Favored   6   81.310   8  0.25  11  0.25  molprobity  1.000  
 41   41  tp        -70.8   -52.5  Favored  11   88.600   8  0.26  11  0.29  molprobity  1.000  
 42   42  t0       -146.4   124.5  Favored   4  101.840   8  0.30  12  0.50  molprobity  1.000  
 43   43  Cg_endo   -62.6   -29.6  Favored   7   90.180   8  0.26  11  0.28  molprobity  1.000  
 44   44  m80       -82.8     2.9  Favored   7  106.450  11  0.16  15  0.35  molprobity  1.000  
 45   45  m         -92.2   142.4  Favored   5   95.710   6  0.17   8  0.37  molprobity  1.000  
 46   46  ?        -144.2   179.5  Favored   5  108.550   5  0.36   7  0.60  molprobity  1.000  
 47   47  t80           ?       ?  ?         9  127.220  12  0.24  15  0.33  molprobity  1.000  
 48   48  m             ?       ?  ?         8  132.880   7  0.18  10  0.35  molprobity  1.000  
 49   49  mttt      -83.1   131.5  Favored  13  117.580   9  0.31  11  0.51  molprobity  1.000  
 50   50  t         -72.0   -42.7  Favored   5   86.240   6  0.25   8  0.32  molprobity  1.000  
 51   51  p        -122.7   138.4  Favored   9   86.070   7  0.25  10  0.41  molprobity  1.000  
 52   52  ptmm?    -136.2   127.3  Favored  13   99.430   9  0.26  11  0.56  molprobity  1.000  
 53   53  p        -119.5   159.5  Favored   5   81.370   6  0.29   8  0.50  molprobity  1.000  
 54   54  tt0      -165.4   143.4  Favored   8   86.140   9  0.20  12  0.42  molprobity  1.000  
 55   55  p         -90.0   108.3  Favored   9   79.000   7  0.22  10  0.45  molprobity  1.000  
 56   56  mt        -71.2   -47.0  Favored  11   72.510   8  0.27  11  0.64  molprobity  1.000  
 57   57  mt-10    -138.4   162.7  Favored   6   89.030   9  0.25  13  0.50  molprobity  1.000  
 58   58  Cg_exo    -59.5   112.5  Allowed   7   76.070   8  0.23  11  0.29  molprobity  1.000  
 59   59  ?         101.8   -14.8  Favored   3   75.920   4  0.45   5  0.66  molprobity  1.000  
 60   60  m-85     -129.8   129.4  Favored   9   79.840  13  0.20  18  0.27  molprobity  1.000  
 61   61  ?        -130.9   165.0  Favored   5   68.830   5  0.33   7  0.71  molprobity  1.000  
 62   62  t80      -136.0   127.0  Favored   9   71.610  13  0.34  18  0.41  molprobity  1.000  
 63   63  tp       -126.8   119.9  Favored  11   69.400   8  0.19  11  0.52  molprobity  1.000  
 64   64  ttt180   -111.3   132.4  Favored  13   86.320  11  0.19  14  0.84  molprobity  1.000  
 65   65  mm       -107.9    96.2  Favored  11   71.300   8  0.27  11  0.53  molprobity  1.000  
 66   66  m         -62.0   -43.2  Favored   7   77.420   7  0.19  10  0.47  molprobity  1.000  
 67   67  tt0      -159.4   163.5  Favored   8   95.590   9  0.27  12  0.50  molprobity  1.000  
 68   68  m-85     -105.4    94.9  Favored   9   72.490  12  0.34  16  0.42  molprobity  1.000  
 69   69  mt-30    -104.0  -179.7  Favored   8   92.880   9  0.24  12  0.46  molprobity  1.000  
 70   70  m         -68.0   -41.8  Favored   9   85.790   7  0.24  10  0.39  molprobity  1.000  
 71   71  m-20      -64.9   -20.5  Favored   6   99.510   8  0.32  11  0.38  molprobity  1.000  
 72   72  m         -49.6   -53.2  Favored   7   77.210   7  0.25  10  0.55  molprobity  1.000  
 73   73  ?         -51.6   -59.0  Favored   3   65.820   4  0.40   5  0.52  molprobity  1.000  
 74   74  mt-10     -54.5   -45.8  Favored   6   87.270   9  0.45  12  0.65  molprobity  1.000  
 75   75  mt-10     -63.0   -39.8  Favored   6   83.090   9  0.29  12  0.38  molprobity  1.000  
 76   76  t         -60.1   -45.3  Favored   9   54.470   7  0.36  10  0.49  molprobity  1.000  
 77   77  t         -66.1   -43.9  Favored   9   52.830   7  0.33  10  0.43  molprobity  1.000  
 78   78  mttt      -54.9   -37.6  Favored  13   65.670   9  0.21  11  0.38  molprobity  1.000  
 79   79  ?         -70.7   -42.2  Favored   5   67.890   5  0.30   7  0.29  molprobity  1.000  
 80   80  mt        -55.6   -59.0  Favored  11   57.730   8  0.25  11  0.35  molprobity  1.000  
 81   81  m-80      -55.1   -40.3  Favored   6   86.540   8  0.25  11  0.35  molprobity  1.000  
 82   82  mm-40     -61.0   -42.8  Favored   8   84.700   9  0.28  12  0.36  molprobity  1.000  
 83   83  mt        -63.2   -38.3  Favored  11   68.400   8  0.24  11  0.39  molprobity  1.000  
 84   84  mtp-105   -59.3   -37.9  Favored  13  106.190  11  0.23  14  0.95  molprobity  1.000  
 85   85  mtpt      -71.7   -31.8  Favored  13   91.870   9  0.27  11  0.29  molprobity  1.000  
 86   86  m-20      -68.4   -47.8  Favored   4   92.260   8  0.21  11  0.25  molprobity  1.000  
 87   87  t30       -72.3    -7.5  Favored   6   84.210   8  0.19  11  0.48  molprobity  1.000  
 88   88  mttp       57.8    15.3  Favored  13   99.310   9  0.19  11  0.40  molprobity  1.000  
 89   89  ?        -173.0   177.5  Favored   3   92.270   4  0.26   5  0.88  molprobity  1.000  
 90   90  mtp85     -58.6   149.9  Favored  13  110.380  11  0.25  14  0.92  molprobity  1.000  
 91   91  mp        -88.4   143.9  Favored  11   72.180   8  0.20  11  0.49  molprobity  1.000  
 92   92  mtmt      -83.8   -27.3  Favored  13   83.510   9  0.27  11  0.31  molprobity  1.000  
 93   93  ?        -165.2   153.8  Favored   3   76.700   4  0.35   5  0.30  molprobity  1.000  
 94   94  tp       -137.9   146.6  Favored  11   58.500   8  0.19  11  0.58  molprobity  1.000  
 95   95  t        -119.6   122.3  Favored   9   66.000   7  0.29  10  0.43  molprobity  1.000  
 96   96  OUTLIER   -94.2   109.2  Favored  11   58.450   8  0.22  11  0.54  molprobity  1.000  
 97   97  t0        -88.8    97.5  Favored   4   73.440   8  0.27  11  0.51  molprobity  1.000  
 98   98  mt       -104.0    10.0  Favored  11   69.710   8  0.26  11  0.42  molprobity  1.000  
 99   99  mtm180    -75.9   152.5  Favored  13   84.760  11  0.20  14  0.93  molprobity  1.000  
100  100  m-20       57.0    44.7  Favored   6   87.010   8  0.26  11  0.36  molprobity  1.000  
101  101  t-20     -121.0   102.4  Favored   6   80.000   8  0.31  12  0.29  molprobity  1.000  
102  102  Cg_endo   -63.5   -35.4  Favored   7   72.250   8  0.29  11  0.34  molprobity  1.000  
103  103  ?         142.5  -150.9  Favored   3   76.280   4  0.38   5  0.46  molprobity  1.000  
104  104  ?         152.9  -148.9  Favored   3   65.290   4  0.34   5  0.87  molprobity  1.000  
105  105  t         -63.3   124.7  Favored   9   58.300   7  0.29  10  0.38  molprobity  1.000  
106  106  tt        -64.5   -40.1  Favored  11   62.510   8  0.28  11  1.36  molprobity  1.000  
107  107  tt0       -61.7   -39.8  Favored   8   69.300   9  0.25  12  0.38  molprobity  1.000  
108  108  m         -63.5   -34.2  Favored   5   62.150   6  0.14   8  0.29  molprobity  1.000  
109  109  ?         -63.5   -46.5  Favored   5   61.950   5  0.26   7  0.48  molprobity  1.000  
110  110  m         -68.0   -27.6  Favored   9   58.460   7  0.27  10  0.41  molprobity  1.000  
111  111  mt-10     -68.4   -44.4  Favored   6   56.240   9  0.27  12  0.68  molprobity  1.000  
112  112  t         -62.5   -42.9  Favored   9   60.130   7  0.30  10  0.51  molprobity  1.000  
113  113  ?         -63.9   -39.2  Favored   5   56.160   5  0.22   7  0.21  molprobity  1.000  
114  114  t0        -69.1   -21.6  Favored   4   62.420   8  0.22  11  0.34  molprobity  1.000  
115  115  ?         -68.4    -7.9  Favored   5   55.620   5  0.25   7  0.39  molprobity  1.000  
116  116  m-85     -120.7   -10.4  Favored   9   56.120  12  0.33  16  0.45  molprobity  1.000  
117  117  mp       -117.5   140.9  Favored  11   63.170   8  0.33  11  1.00  molprobity  1.000  
118  118  p        -107.3   -13.7  Favored   7   67.470   7  0.26  10  0.68  molprobity  1.000  
119  119  pttt     -164.0   166.4  Favored  13   78.880   9  0.25  11  0.44  molprobity  1.000  
120  120  ?          94.1   175.6  Favored   3   79.850   4  0.37   5  0.95  molprobity  1.000  
121  121  tp        -79.9   155.0  Favored  11   79.850   8  0.20  11  0.83  molprobity  1.000  
122  122  mt       -114.3   -53.1  Favored  11   67.470   8  0.15  11  0.34  molprobity  1.000  
123  123  p        -162.9   148.8  Favored   9   71.520   7  0.27  10  0.51  molprobity  1.000  
124  124  p90      -146.2   139.4  Favored   9   88.980  13  0.27  18  0.37  molprobity  1.000  
125  125  p         -98.2   140.1  Favored   7   78.780   7  0.25  10  0.58  molprobity  1.000  
126  126  mtmt     -123.2   132.9  Favored  13   96.940   9  0.27  11  0.45  molprobity  1.000  
127  127  ?        -163.0  -178.3  Favored   3  123.220   4  0.20   5  0.76  molprobity  1.000  
128  128  mtm105   -111.0    -6.9  Favored  13  127.270  11  0.27  14  1.07  molprobity  1.000  
129  129  tt        -77.4   164.7  Favored  11  125.970   8  0.32  11  0.44  molprobity  1.000  
130  130  ?         -61.3   -50.9  Favored   5  137.190   5  0.31   7  0.34  molprobity  1.000  
131  131  m-20     -116.4    41.9  Favored   6  140.920   8  0.24  11  0.34  molprobity  1.000  
132  132  OUTLIER  -100.5   -37.0  Favored   5  122.900   6  0.18   8  0.42  molprobity  1.000  
133  133  mt-10     -63.7   103.0  Allowed   6  119.420   9  0.22  12  0.32  molprobity  1.000  
134  134  pp       -130.8   161.1  Favored  11   88.590   8  0.28  11  0.97  molprobity  1.000  
135  135  mtp85    -138.5   155.6  Favored  13   99.210  11  0.20  14  0.96  molprobity  1.000  
136  136  m-85     -136.2   118.5  Favored   9   77.350  12  0.48  16  0.36  molprobity  1.000  
137  137  m        -111.2   144.6  Favored   5   79.570   6  0.25   8  0.36  molprobity  1.000  
138  138  ?         -73.5   143.1  Favored   5   76.830   5  0.25   7  0.41  molprobity  1.000  
139  139  p-10      -86.3   155.6  Favored   4   76.800   8  0.31  12  0.84  molprobity  1.000  
140  140  Cg_endo   -75.6    28.1  Allowed   7   77.800   8  0.19  11  0.47  molprobity  1.000  
141  141  ?        -122.0   122.0  Favored   5   57.250   5  0.31   7  0.47  molprobity  1.000  
142  142  p-10     -122.4   108.8  Favored   4   62.790   8  0.37  12  0.55  molprobity  1.000  
143  143  Cg_exo    -64.6    -7.3  Favored   7   64.550   8  0.27  11  0.31  molprobity  1.000  
144  144  p         -68.3   -18.6  Favored   5   65.850   6  0.21   8  0.27  molprobity  1.000  
145  145  m-20       53.5    42.7  Favored   4   80.060   8  0.15  11  0.50  molprobity  1.000  
146  146  mtpp       61.1    21.3  Favored  13   70.980   9  0.27  11  0.28  molprobity  1.000  
147  147  p         -63.3   136.2  Favored   9   63.010   7  0.47  11  0.40  molprobity  1.000  
148  148  Cg_endo   -70.4   129.1  Favored   7   66.640   8  0.19  11  0.36  molprobity  1.000  
149  149  pt?      -133.5   150.2  Favored  11   61.500   8  0.21  11  0.86  molprobity  1.000  
150  150  t        -113.6   131.0  Favored   9   70.640   7  0.26  10  0.46  molprobity  1.000  
151  151  t        -105.0   134.2  Favored   9   69.330   7  0.28  10  0.39  molprobity  1.000  
152  152  mt       -106.1   125.0  Favored  11   73.560   8  0.21  11  0.35  molprobity  1.000  
153  153  pt       -130.9   134.2  Favored  11   74.370   8  0.23  11  0.48  molprobity  1.000  
154  154  p30      -115.8  -169.4  Allowed   6   90.000   8  0.32  11  0.58  molprobity  1.000  
155  155  ?         -66.6   -34.6  Favored   3   93.070   4  0.23   5  0.53  molprobity  1.000  
156  156  ?         -86.3    38.6  Favored   3   90.770   4  0.20   5  0.53  molprobity  1.000  
157  157  p        -129.8   118.1  Favored   5   85.590   6  0.27   8  0.51  molprobity  1.000  
158  158  ?        -139.6   167.8  Favored   5   83.090   5  0.31   7  0.83  molprobity  1.000  
159  159  p          53.5  -113.2  Allowed   5   86.270   6  0.27   8  0.28  molprobity  1.000  
160  160  ?         -52.8   -47.8  Favored   5   80.800   5  0.30   7  0.34  molprobity  1.000  
161  161  ?         -59.3   -43.0  Favored   5   69.080   5  0.31   7  0.31  molprobity  1.000  
162  162  mt-10     -63.8   -35.7  Favored   6   72.320   9  0.39  12  0.29  molprobity  1.000  
163  163  mt        -60.5   -48.1  Favored  11   68.640   8  0.24  11  0.30  molprobity  1.000  
164  164  t         -59.6   -51.3  Favored   9   55.490   7  0.24  10  0.31  molprobity  1.000  
165  165  ?         -60.5   -46.7  Favored   5   57.460   5  0.28   7  0.42  molprobity  1.000  
166  166  ?         -61.0   -44.5  Favored   3   59.580   4  0.12   5  0.31  molprobity  1.000  
167  167  ?         -57.6   -48.3  Favored   5   70.330   5  0.25   7  0.28  molprobity  1.000  
168  168  mt        -61.7   -34.0  Favored  11   57.120   8  0.21  11  0.48  molprobity  1.000  
169  169  tt0       -78.9   -45.4  Favored   8   74.700   9  0.27  12  0.37  molprobity  1.000  
170  170  m-20      -70.8   -26.8  Favored   4   86.930   8  0.26  11  0.21  molprobity  1.000  
171  171  mm-40     -80.9     4.1  Favored   8   86.520   9  0.25  12  0.38  molprobity  1.000  
172  172  mttm       52.2    40.0  Favored  13   88.690   9  0.27  11  0.45  molprobity  1.000  
173  173  tpt85     -98.1   -31.7  Favored  13   62.010  11  0.22  14  0.97  molprobity  1.000  
174  174  ?        -135.5   159.2  Favored   5   64.430   5  0.41   7  0.67  molprobity  1.000  
175  175  mm       -103.6   120.7  Favored  11   70.380   8  0.30  11  0.49  molprobity  1.000  
176  176  mt        -90.3   136.0  Favored  11   70.840   7  0.20   8  0.74  molprobity  1.000  
177  177  ttm      -138.5   137.2  Favored   9   83.240   8  0.32  10  0.56  molprobity  1.000  
178  178  ?         134.2  -153.4  Favored   3   83.560   4  0.28   5  0.22  molprobity  1.000  
179  179  p         -97.7   178.4  Favored   7   89.890   7  0.19  10  0.58  molprobity  1.000  
180  180  m-20      -68.6   165.4  Favored   4   95.850   8  0.20  11  0.47  molprobity  1.000  
181  181  p        -104.0   175.0  Favored   5   95.830   6  0.14   8  0.53  molprobity  1.000  
182  182  OUTLIER   -60.9   -51.4  Favored   9  107.980  12  0.32  16  0.48  molprobity  1.000  
183  183  ?          90.4    25.2  Favored   3   91.000   4  0.36   5  0.53  molprobity  1.000  
184  184  ttmt      -91.3    97.1  Favored  13   97.070   9  0.25  11  0.50  molprobity  1.000  
185  185  ?        -134.0    56.1  Allowed   3   87.550   4  0.32   5  0.27  molprobity  1.000  
186  186  p        -135.2   147.2  Favored   5   98.320   6  0.23   8  0.38  molprobity  1.000  
187  187  m        -111.3   130.6  Favored   9   98.710   7  0.37  10  0.56  molprobity  1.000  
188  188  mp0      -107.1   125.4  Favored   8  121.420   9  0.26  12  0.39  molprobity  1.000  
189  189  m        -104.3   140.7  Favored   7  120.880   7  0.28  10  0.56  molprobity  1.000  
190  190  t         -85.7   118.4  Favored   9  107.450   7  0.27  10  0.51  molprobity  1.000  
191  191  mp       -103.2   139.6  Favored  11  115.050   8  0.39  12  1.46  molprobity  1.000  
192  192  Cg_endo   -88.4   151.7  Favored   7  126.650   8  0.29  11  0.50  molprobity  1.000  
193  193  mt       -121.9   163.0  Favored  11  131.090   8  0.23  11  0.53  molprobity  1.000  
194  194  m-20      -56.7   -46.6  Favored   6  148.370   8  0.30  11  0.28  molprobity  1.000  
195  195  t-20      -74.0   157.8  Favored   6  159.890   8  0.25  11  0.38  molprobity  1.000  
196  196  p-10      -73.2    59.0  Allowed   4  149.680   8  0.17  11  0.37  molprobity  1.000  
197  197  mmt-85   -156.4   153.8  Favored  13  127.810  11  0.22  14  1.00  molprobity  1.000  
198  198  ?        -131.1   164.2  Favored   5  132.490   5  0.40   7  0.54  molprobity  1.000  
199  199  pt?      -127.3   137.7  Favored  11  110.210   8  0.27  11  0.97  molprobity  1.000  
200  200  ttpt      -90.8   121.5  Favored  13  103.860   9  0.28  11  0.42  molprobity  1.000  
201  201  tp       -133.5   134.6  Favored  11   93.710   8  0.21  11  0.44  molprobity  1.000  
202  202  m         -67.2   118.5  Favored   7   97.680   7  0.22  10  0.58  molprobity  1.000  
203  203  p         -99.4   -22.4  Favored   7  108.920   7  0.23  10  0.66  molprobity  1.000  
204  204  ?        -157.8   171.8  Favored   5   93.550   5  0.31   7  0.78  molprobity  1.000  
205  205  pp       -143.3   156.8  Favored  11   89.390   8  0.24  11  1.26  molprobity  1.000  
206  206  m-85      -79.4   151.2  Favored   9   77.340  13  0.19  18  0.49  molprobity  1.000  
207  207  m-85     -138.0   137.9  Favored   9   91.600  13  0.29  18  0.59  molprobity  1.000  
208  208  p         -76.4   167.7  Favored   7   79.040   7  0.16  11  0.50  molprobity  1.000  
209  209  Cg_exo    -57.0   -33.9  Favored   7   82.740   8  0.24  11  0.62  molprobity  1.000  
210  210  m-20      -61.2   -38.8  Favored   6  117.300   8  0.23  11  0.29  molprobity  1.000  
211  211  ?         122.7     4.6  Favored   3   92.650   4  0.31   5  0.38  molprobity  1.000  
212  212  mtm105    -81.2   126.5  Favored  13  105.880  11  0.41  14  1.23  molprobity  1.000  
213  213  t         -66.7   126.2  Favored   5   84.350   6  0.17   8  0.35  molprobity  1.000  
214  214  mt        -64.9   -33.9  Favored  11   74.840   8  0.22  11  0.48  molprobity  1.000  
215  215  mm-40     -66.9   -43.5  Favored   8   95.450   9  0.30  12  0.34  molprobity  1.000  
216  216  ?         -82.3   -58.8  Favored   5  109.860   5  0.29   7  0.27  molprobity  1.000  
217  217  tp-100    -68.1   -45.2  Favored   8  136.840   9  0.20  12  0.45  molprobity  1.000  
218  218  ?          76.9  -172.3  Favored   3   94.240   4  0.50   5  0.92  molprobity  1.000  
219  219  tp       -115.1   114.0  Favored  11   91.500   8  0.27  11  0.71  molprobity  1.000  
220  220  t         -94.7   123.9  Favored   9   91.730   7  0.34  11  0.53  molprobity  1.000  
221  221  Cg_endo   -70.2   148.9  Favored   7   74.120   8  0.23  11  0.61  molprobity  1.000  
222  222  m-20      -65.0   -34.1  Favored   4   77.340   8  0.20  11  0.28  molprobity  1.000  
223  223  mp       -122.7   126.7  Favored  11   76.010   8  0.24  11  0.41  molprobity  1.000  
224  224  tp10      -89.3   121.3  Favored   6   91.600   9  0.22  12  0.41  molprobity  1.000  
225  225  t        -140.5   107.3  Favored   9   75.310   7  0.28  10  0.76  molprobity  1.000  
226  226  ?         -75.2   162.3  Favored   3   87.540   4  0.36   5  0.71  molprobity  1.000  
227  227  ttm-85    -68.6   140.4  Favored  13  117.410  11  0.17  14  0.98  molprobity  1.000  
228  228  ?        -161.4   164.7  Favored   5  103.290   5  0.31   7  0.71  molprobity  1.000  
229  229  tttt     -120.1   130.8  Favored  13  111.730   9  0.26  11  0.38  molprobity  1.000  
230  230  m        -103.8   140.0  Favored   9  121.450   7  0.35  10  0.51  molprobity  1.000  
231  231  p        -127.1   114.3  Favored   7  126.500   7  0.19  10  0.59  molprobity  1.000  
232  232  mm-40     -71.3   151.2  Favored   8  122.630   9  0.36  12  0.45  molprobity  1.000  
233  233  mm-40         ?       ?  ?         6  130.650   8  0.23   9  0.39  molprobity  1.000  
234  234  tt0           ?       ?  ?         5  120.890   9  0.27  12  0.41  molprobity  1.000  
235  235  mtp85    -127.5   103.0  Favored  13  101.370  11  0.35  15  0.97  molprobity  1.000  
236  236  Cg_endo   -76.0   -25.8  Favored   7   84.170   8  0.17  11  0.30  molprobity  1.000  
237  237  pm0       -64.4   -26.9  Favored   8   88.640   9  0.28  12  0.37  molprobity  1.000  
238  238  m-20      -64.8   -19.7  Favored   4  104.210   8  0.15  11  0.34  molprobity  1.000  
239  239  m        -115.0   -20.3  Favored   5  103.100   6  0.34   8  0.64  molprobity  1.000  
240  240  t0       -106.1   123.5  Favored   4   90.520   8  0.24  11  0.59  molprobity  1.000  
241  241  t80       -71.6   -48.3  Favored   9   87.890  13  0.23  18  0.24  molprobity  1.000  
242  242  mt-30     -64.4   -43.1  Favored   8   79.230   9  0.29  12  0.35  molprobity  1.000  
243  243  tp        -63.6   -40.1  Favored  11   74.020   8  0.22  11  0.24  molprobity  1.000  
244  244  t         -62.9   -42.1  Favored   5   73.940   6  0.20   8  0.21  molprobity  1.000  
245  245  tp60      -61.0   -45.0  Favored   8   77.100   9  0.22  12  0.35  molprobity  1.000  
246  246  ?         -64.0   -40.4  Favored   5   72.800   5  0.28   7  0.23  molprobity  1.000  
247  247  tp        -63.6   -46.6  Favored  11   62.450   8  0.22  11  0.40  molprobity  1.000  
248  248  p         -65.5   -36.0  Favored   5   69.330   6  0.22   8  0.31  molprobity  1.000  
249  249  tp        -62.8   -43.0  Favored  11   69.750   8  0.21  11  0.22  molprobity  1.000  
250  250  mt        -64.2   -41.4  Favored  11   71.760   8  0.21  11  0.38  molprobity  1.000  
251  251  mtmt      -62.5   -48.6  Favored  13   79.480   9  0.37  11  0.49  molprobity  1.000  
252  252  ?         -62.5   -40.4  Favored   3   83.780   4  0.15   5  0.21  molprobity  1.000  
253  253  tp        -59.5   -42.1  Favored  11   83.660   8  0.17  11  0.71  molprobity  1.000  
254  254  t         -65.1   -40.0  Favored   5   95.580   6  0.18   8  0.29  molprobity  1.000  
255  255  t         -66.4   -47.2  Favored   9   88.010   7  0.24  10  0.36  molprobity  1.000  
256  256  p         -61.5   -37.7  Favored   7   94.930   7  0.23  10  0.44  molprobity  1.000  
257  257  mtp180    -70.7    -2.1  Favored  13  108.680  11  0.24  14  1.12  molprobity  1.000  
258  258  ?             ?       ?  ?         3  110.660   3  0.28   2  0.20  molprobity  1.000  
259  259  mt            ?       ?  ?        10  133.360   8  0.13  12  0.50  molprobity  1.000  
260  260  Cg_exo    -66.9   -29.4  Favored   7  136.470   8  0.25  11  0.62  molprobity  1.000  
261  261  mt         64.2   -46.4  Allowed  11  139.120   8  0.20  11  0.66  molprobity  1.000  
262  262  p-10      -70.9   -44.1  Favored   4  147.240   8  0.27  11  0.40  molprobity  1.000  
263  263  mm-40     -71.5   -31.4  Favored   6  143.230   9  0.28  12  0.43  molprobity  1.000  
264  264  mm?       -64.5   -35.9  Favored  11  122.390   8  0.19  11  0.58  molprobity  1.000  
265  265  mtp180    -62.8   -45.3  Favored  13  145.520  11  0.22  14  0.93  molprobity  1.000  
266  266  m         -59.7   -44.1  Favored   7  105.450   7  0.31  10  0.55  molprobity  1.000  
267  267  t80       -60.1   -47.8  Favored   9  110.730  12  0.31  16  0.27  molprobity  1.000  
268  268  ?         -66.6   -32.7  Favored   5  113.140   5  0.23   7  0.25  molprobity  1.000  
269  269  tt0       -65.9   -44.1  Favored   6  127.930   9  0.36  12  0.53  molprobity  1.000  
270  270  t         -61.5   -42.6  Favored   9   99.530   7  0.28  10  0.33  molprobity  1.000  
271  271  tt        -64.0   -37.2  Favored  11  102.530   8  0.15  11  0.29  molprobity  1.000  
272  272  m-20      -69.2   -40.5  Favored   4  114.490   8  0.22  11  0.30  molprobity  1.000  
273  273  OUTLIER   -59.0   -43.0  Favored  13  105.570  11  0.24  14  0.90  molprobity  1.000  
274  274  t         -66.3   -42.8  Favored   9  103.710   7  0.28  10  0.35  molprobity  1.000  
275  275  tttm      -60.0   -27.8  Favored  13  116.520   9  0.24  11  0.55  molprobity  1.000  
276  276  ?         -88.5   -36.9  Favored   5  110.420   5  0.30   7  0.55  molprobity  1.000  
277  277  ?         -97.7   -28.0  Favored   5  104.280   5  0.21   7  0.85  molprobity  1.000  
278  278  t80       -54.8   156.4  Favored   9   95.530  13  0.24  18  0.24  molprobity  1.000  
279  279  t         -65.0   -59.1  Favored   9  104.220   7  0.52  10  0.34  molprobity  1.000  
280  280  mt-10     -91.6   134.1  Favored   6  114.350   9  0.30  13  0.31  molprobity  1.000  
281  281  Cg_endo   -65.2   142.0  Favored   7  128.490   8  0.15  11  0.36  molprobity  1.000  
282  282  m        -134.4   134.4  Favored   9  129.080   7  0.22  10  0.39  molprobity  1.000  
283  283  p-10      -81.5   175.6  Favored   4  127.630   8  0.18  11  0.45  molprobity  1.000  
284  284  m-20      -64.5   -34.9  Favored   4  127.250   8  0.28  11  0.37  molprobity  1.000  
285  285  tttt      -66.5   -45.9  Favored  13  126.570   9  0.24  11  0.33  molprobity  1.000  
286  286  p         -66.7   -36.7  Favored   7  115.530   7  0.20  10  0.52  molprobity  1.000  
287  287  mt        -63.3   -42.7  Favored  11  102.660   8  0.22  11  0.30  molprobity  1.000  
288  288  mp        -61.7   -44.9  Favored  11  108.740   8  0.20  11  0.48  molprobity  1.000  
289  289  tt0       -62.9   -41.2  Favored   6  104.600   9  0.24  12  0.30  molprobity  1.000  
290  290  m-20      -65.6   -38.7  Favored   6   98.040   8  0.20  11  0.29  molprobity  1.000  
291  291  ?         -60.1   -42.6  Favored   5   89.050   5  0.24   7  0.20  molprobity  1.000  
292  292  mt        -62.8   -53.2  Favored  11   86.740   8  0.28  11  0.30  molprobity  1.000  
293  293  mttp      -58.6   -39.5  Favored  13   88.240   9  0.29  11  0.54  molprobity  1.000  
294  294  ?         -76.2   -28.1  Favored   3   79.700   3  0.27   2  0.29  molprobity  1.000  
295  295  ttp       -63.8   -40.1  Favored   9   99.030   8  0.24  10  0.47  molprobity  1.000  
296  296  mt        -71.2   -44.2  Favored  11   89.910   8  0.22  11  0.43  molprobity  1.000  
297  297  m         -61.4   -39.6  Favored   5   85.290   6  0.20   8  0.24  molprobity  1.000  
298  298  m120      -73.3   -30.6  Favored   6   92.350   8  0.21  11  0.27  molprobity  1.000  
299  299  tp        -73.4   -57.1  Favored  11   83.490   8  0.20  11  0.27  molprobity  1.000  
300  300  t70      -149.0   127.4  Favored   4   98.090   8  0.33  12  0.43  molprobity  1.000  
301  301  Cg_exo    -61.9   -30.5  Favored   7   88.690   8  0.26  11  0.41  molprobity  1.000  
302  302  m80       -82.5     2.7  Favored   7   92.040  11  0.15  15  0.38  molprobity  1.000  
303  303  m         -92.6   143.3  Favored   5   89.540   6  0.18   8  0.29  molprobity  1.000  
304  304  ?        -143.6   177.2  Favored   5   88.280   5  0.32   7  0.60  molprobity  1.000  
305  305  t80           ?       ?  ?         9  116.460  12  0.22  15  0.61  molprobity  1.000  
306  306  m             ?       ?  ?         8  130.840   7  0.17  10  0.36  molprobity  1.000  
307  307  mmmt      -88.8   125.9  Favored  13  136.150   9  0.21  11  0.24  molprobity  1.000  
308  308  m         -80.0   -45.3  Favored   5   99.270   6  0.23   8  0.30  molprobity  1.000  
309  309  t        -124.1   137.8  Favored   9   77.890   7  0.32  10  0.56  molprobity  1.000  
310  310  mtpt     -134.2   126.2  Favored  13   97.960   9  0.23  11  0.41  molprobity  1.000  
311  311  p        -120.5   158.3  Favored   5   82.950   6  0.36   8  0.53  molprobity  1.000  
312  312  tt0      -166.9   142.6  Favored   8   95.220   9  0.23  12  0.39  molprobity  1.000  
313  313  t         -90.1   103.0  Favored   9   94.530   7  0.34  10  0.73  molprobity  1.000  
314  314  pp        -73.1   -43.4  Favored  11   96.350   8  0.29  11  1.07  molprobity  1.000  
315  315  mt-10    -137.9   160.9  Favored   6  103.320   9  0.28  13  0.48  molprobity  1.000  
316  316  Cg_endo   -59.6   113.4  Allowed   7   85.690   8  0.19  11  0.28  molprobity  1.000  
317  317  ?          99.8   -15.8  Favored   3   84.770   4  0.48   5  0.49  molprobity  1.000  
318  318  m-85     -129.4   128.7  Favored   9   94.460  13  0.25  18  0.33  molprobity  1.000  
319  319  ?        -130.4   164.3  Favored   5   70.750   5  0.36   7  0.72  molprobity  1.000  
320  320  t80      -135.3   127.0  Favored   9   65.550  13  0.33  18  0.51  molprobity  1.000  
321  321  tp       -127.1   117.4  Favored  11   66.440   8  0.20  11  0.44  molprobity  1.000  
322  322  ttt85    -112.8   133.4  Favored  13   80.560  11  0.20  14  0.99  molprobity  1.000  
323  323  mt       -108.4    97.6  Favored  11   62.100   8  0.29  11  0.57  molprobity  1.000  
324  324  m         -59.9   -41.6  Favored   7   65.880   7  0.21  10  0.36  molprobity  1.000  
325  325  tt0      -159.4   163.5  Favored   8   76.870   9  0.27  12  0.48  molprobity  1.000  
326  326  m-85     -105.3    95.7  Favored   9   65.940  12  0.38  16  0.40  molprobity  1.000  
327  327  mt-30    -103.6  -180.0  Favored   8   86.610   9  0.23  12  0.44  molprobity  1.000  
328  328  m         -68.8   -44.5  Favored   9   73.560   7  0.33  10  0.41  molprobity  1.000  
329  329  p-10      -66.5   -15.1  Favored   6   81.600   8  0.18  11  0.37  molprobity  1.000  
330  330  m         -50.0   -48.5  Favored   7   66.040   7  0.17  10  0.65  molprobity  1.000  
331  331  ?         -53.9   -58.1  Favored   3   59.240   4  0.38   5  0.63  molprobity  1.000  
332  332  pt-20     -55.1   -38.7  Favored   6   83.880   9  0.16  12  0.52  molprobity  1.000  
333  333  mt-10     -66.5   -40.8  Favored   6   76.090   9  0.24  12  0.50  molprobity  1.000  
334  334  m         -65.0   -41.4  Favored   9   65.540   7  0.32  10  0.74  molprobity  1.000  
335  335  t         -66.3   -42.8  Favored   9   57.780   7  0.40  10  0.38  molprobity  1.000  
336  336  tttt      -54.2   -41.4  Favored  13   76.570   9  0.23  11  0.95  molprobity  1.000  
337  337  ?         -69.7   -39.9  Favored   5   66.660   5  0.21   7  0.32  molprobity  1.000  
338  338  mp        -55.5   -56.0  Favored  11   59.700   8  0.26  11  0.82  molprobity  1.000  
339  339  m120      -57.6   -40.0  Favored   6   93.540   8  0.21  11  0.30  molprobity  1.000  
340  340  tp60      -63.0   -43.4  Favored   8   95.310   9  0.26  12  0.24  molprobity  1.000  
341  341  mt        -65.1   -39.0  Favored  11   76.650   8  0.20  11  0.33  molprobity  1.000  
342  342  ttm105    -61.1   -39.3  Favored  13   89.200  11  0.20  14  0.91  molprobity  1.000  
343  343  mtmm      -72.0   -32.2  Favored  13   96.400   9  0.29  11  0.25  molprobity  1.000  
344  344  m-20      -67.5   -45.1  Favored   4   93.320   8  0.20  11  0.23  molprobity  1.000  
345  345  t30       -70.2    -8.0  Favored   6   90.120   8  0.21  11  0.49  molprobity  1.000  
346  346  mtpt       56.9    17.0  Favored  13  103.200   9  0.20  11  0.31  molprobity  1.000  
347  347  ?        -172.2   176.9  Favored   3   90.330   4  0.29   5  0.89  molprobity  1.000  
348  348  mmm180    -59.2   150.1  Favored  13  112.610  11  0.22  14  0.97  molprobity  1.000  
349  349  mt        -87.3   142.0  Favored  11   81.390   8  0.17  11  0.37  molprobity  1.000  
350  350  mttp      -86.0   -28.8  Favored  13   91.850   9  0.26  11  0.47  molprobity  1.000  
351  351  ?        -165.3   153.6  Favored   3   84.160   4  0.32   5  0.35  molprobity  1.000  
352  352  tp       -138.1   146.4  Favored  11   69.080   8  0.16  11  0.41  molprobity  1.000  
353  353  t        -120.3   122.4  Favored   9   74.810   7  0.33  10  0.39  molprobity  1.000  
354  354  mt        -94.2   109.8  Favored  11   71.350   8  0.21  11  0.56  molprobity  1.000  
355  355  t0        -88.0    95.6  Favored   4   78.020   8  0.30  11  0.61  molprobity  1.000  
356  356  mt       -104.9     7.3  Favored  11   66.600   8  0.27  11  0.39  molprobity  1.000  
357  357  ptt180    -78.3   155.5  Favored  13   81.650  11  0.47  14  0.98  molprobity  1.000  
358  358  m-20       59.2    44.3  Favored   6   88.900   8  0.15  11  0.50  molprobity  1.000  
359  359  t-20     -121.8   104.1  Favored   6   76.960   8  0.35  12  0.33  molprobity  1.000  
360  360  Cg_endo   -63.4   -34.3  Favored   7   77.440   8  0.27  11  0.40  molprobity  1.000  
361  361  ?         141.9  -150.9  Favored   3   75.110   4  0.42   5  0.80  molprobity  1.000  
362  362  ?         152.1  -149.6  Favored   3   73.570   4  0.37   5  0.88  molprobity  1.000  
363  363  t         -64.0   124.2  Favored   9   59.900   7  0.33  10  0.39  molprobity  1.000  
364  364  tp        -63.9   -42.2  Favored  11   52.480   8  0.20  11  0.29  molprobity  1.000  
365  365  tt0       -62.2   -39.5  Favored   8   67.940   9  0.25  12  0.30  molprobity  1.000  
366  366  t         -64.2   -37.3  Favored   5   58.520   6  0.22   8  0.40  molprobity  1.000  
367  367  ?         -62.9   -43.9  Favored   5   56.150   5  0.28   7  0.30  molprobity  1.000  
368  368  t         -67.8   -34.0  Favored   9   55.250   7  0.35  10  0.57  molprobity  1.000  
369  369  pt-20     -72.0   -36.7  Favored   6   58.620   9  0.33  12  0.86  molprobity  1.000  
370  370  t         -59.7   -41.2  Favored   9   49.080   7  0.36  10  0.45  molprobity  1.000  
371  371  ?         -62.7   -36.9  Favored   5   58.830   5  0.24   7  0.20  molprobity  1.000  
372  372  m-20      -66.7   -22.5  Favored   4   62.430   8  0.25  11  0.53  molprobity  1.000  
373  373  ?         -69.2    -9.9  Favored   5   57.830   5  0.29   7  0.41  molprobity  1.000  
374  374  m-85     -121.0   -10.2  Favored   9   56.750  12  0.34  16  0.42  molprobity  1.000  
375  375  mt       -119.3   140.4  Favored  11   57.670   8  0.26  11  0.45  molprobity  1.000  
376  376  p        -107.0   -15.3  Favored   7   63.180   7  0.27  10  0.71  molprobity  1.000  
377  377  pttp     -165.4   167.9  Favored  13   85.640   9  0.20  11  0.52  molprobity  1.000  
378  378  ?          94.8   176.1  Favored   3   83.100   4  0.39   5  0.89  molprobity  1.000  
379  379  tp        -79.4   153.2  Favored  11   75.860   8  0.18  11  0.87  molprobity  1.000  
380  380  mt       -114.8   -52.4  Favored  11   70.700   8  0.19  11  0.34  molprobity  1.000  
381  381  p        -162.8   150.4  Favored   9   65.040   7  0.27  10  0.56  molprobity  1.000  
382  382  p90      -144.6   138.6  Favored   9   73.810  13  0.29  18  0.59  molprobity  1.000  
383  383  m         -97.5   134.1  Favored   7   75.730   7  0.35  10  0.46  molprobity  1.000  
384  384  ttpt     -126.2   133.1  Favored  13   85.200   9  0.29  11  0.36  molprobity  1.000  
385  385  ?        -163.6   178.2  Favored   3   98.890   4  0.33   5  1.01  molprobity  1.000  
386  386  ptt85    -113.3    85.8  Favored  13  105.650  11  0.21  14  1.08  molprobity  1.000  
387  387  tt       -169.4   166.0  Allowed  11  110.660   8  0.36  11  0.90  molprobity  1.000  
388  388  ?         -59.2   -48.6  Favored   5  127.400   5  0.28   7  0.31  molprobity  1.000  
389  389  m120     -115.9    41.5  Favored   6  141.270   8  0.24  11  0.36  molprobity  1.000  
390  390  p        -100.8   -41.4  Favored   5  119.340   6  0.24   8  0.49  molprobity  1.000  
391  391  mt-10     -66.0   106.8  Allowed   6  104.550   9  0.25  12  0.34  molprobity  1.000  
392  392  mt       -126.1   158.8  Favored  11   87.410   8  0.18  11  0.84  molprobity  1.000  
393  393  mtp85    -140.7   152.8  Favored  13   90.280  11  0.18  14  0.94  molprobity  1.000  
394  394  m-85     -137.4   119.1  Favored   9   80.170  12  0.34  16  0.30  molprobity  1.000  
395  395  m        -110.2   146.0  Favored   5   89.630   6  0.29   8  0.39  molprobity  1.000  
396  396  ?         -73.7   141.8  Favored   5   74.830   5  0.29   7  0.32  molprobity  1.000  
397  397  p-10      -87.8   155.9  Favored   4   75.970   8  0.24  12  0.43  molprobity  1.000  
398  398  Cg_exo    -74.8    26.2  Allowed   7   74.260   8  0.28  11  0.47  molprobity  1.000  
399  399  ?        -123.1   120.9  Favored   5   66.000   5  0.30   7  0.44  molprobity  1.000  
400  400  p-10     -123.5   108.8  Favored   4   72.830   8  0.34  12  0.45  molprobity  1.000  
401  401  Cg_exo    -65.3    -8.1  Favored   7   66.730   8  0.25  11  0.38  molprobity  1.000  
402  402  p         -70.1   -18.4  Favored   5   68.390   6  0.18   8  0.43  molprobity  1.000  
403  403  m-20       53.2    41.8  Favored   4   82.760   8  0.15  11  0.45  molprobity  1.000  
404  404  mtmt       59.5    22.1  Favored  13   79.850   9  0.23  11  0.32  molprobity  1.000  
405  405  p         -61.6   136.7  Favored   9   73.540   7  0.47  11  0.42  molprobity  1.000  
406  406  Cg_endo   -68.4   130.0  Favored   7   76.660   8  0.17  11  0.35  molprobity  1.000  
407  407  pt?      -132.3   147.1  Favored  11   66.390   8  0.26  11  0.80  molprobity  1.000  
408  408  p        -114.7   131.4  Favored   9   76.290   7  0.35  10  0.53  molprobity  1.000  
409  409  t        -105.2   135.0  Favored   9   70.760   7  0.24  10  0.41  molprobity  1.000  
410  410  mt       -105.5   127.6  Favored  11   73.820   8  0.20  11  0.31  molprobity  1.000  
411  411  pt       -128.1   135.7  Favored  11   76.260   8  0.23  11  0.43  molprobity  1.000  
412  412  t-20     -113.6  -172.5  Favored   6  105.050   8  0.31  11  0.56  molprobity  1.000  
413  413  ?         -67.5   -33.5  Favored   3   88.710   4  0.26   5  0.38  molprobity  1.000  
414  414  ?         -86.6    41.3  Favored   3   92.270   4  0.33   5  0.20  molprobity  1.000  
415  415  t        -124.2   113.6  Favored   5   86.380   6  0.19   8  0.63  molprobity  1.000  
416  416  ?        -144.1   169.2  Favored   5   71.230   5  0.34   7  0.84  molprobity  1.000  
417  417  t          53.2  -116.5  Allowed   5   68.060   6  0.25   8  0.37  molprobity  1.000  
418  418  ?         -55.8   -48.7  Favored   5   66.210   5  0.28   7  0.34  molprobity  1.000  
419  419  ?         -60.2   -41.5  Favored   5   59.340   5  0.30   7  0.31  molprobity  1.000  
420  420  tt0       -62.5   -38.1  Favored   6   69.110   9  0.52  12  0.34  molprobity  1.000  
421  421  mt        -61.8   -47.5  Favored  11   62.400   8  0.25  11  0.32  molprobity  1.000  
422  422  t         -58.7   -50.0  Favored   9   51.380   7  0.24  10  0.33  molprobity  1.000  
423  423  ?         -60.0   -45.1  Favored   5   55.840   5  0.33   7  0.48  molprobity  1.000  
424  424  ?         -61.4   -45.4  Favored   3   64.470   4  0.08   5  0.24  molprobity  1.000  
425  425  ?         -58.3   -48.1  Favored   5   62.400   5  0.28   7  0.29  molprobity  1.000  
426  426  mt        -61.8   -32.8  Favored  11   59.910   8  0.24  11  0.41  molprobity  1.000  
427  427  tt0       -77.6   -42.5  Favored   8   80.840   9  0.32  12  0.36  molprobity  1.000  
428  428  m-20      -69.8   -27.4  Favored   4   84.240   8  0.26  11  0.25  molprobity  1.000  
429  429  mm100     -81.5     2.7  Favored   8   78.280   9  0.21  12  0.38  molprobity  1.000  
430  430  mtpt       51.5    40.8  Favored  13   90.810   9  0.25  11  0.54  molprobity  1.000  
431  431  tpt180    -98.3   -29.1  Favored  13   68.450  11  0.24  14  0.98  molprobity  1.000  
432  432  ?        -132.4   161.5  Favored   5   65.070   5  0.41   7  0.65  molprobity  1.000  
433  433  mm       -102.1   118.7  Favored  11   78.250   8  0.29  11  0.51  molprobity  1.000  
434  434  mt        -92.8   118.6  Favored  11   72.280   7  0.20   8  0.83  molprobity  1.000  
435  435  ptp      -130.9   148.1  Favored   9   86.890   8  0.12  10  0.49  molprobity  1.000  
436  436  ?         138.8  -153.6  Favored   3   71.720   4  0.38   5  0.55  molprobity  1.000  
437  437  t         -97.5   179.2  Favored   7   88.800   7  0.24  10  0.56  molprobity  1.000  
438  438  OUTLIER   -66.2   167.9  Favored   4   86.370   8  0.24  11  0.44  molprobity  1.000  
439  439  m        -100.8   172.8  Favored   5   90.900   6  0.23   8  0.53  molprobity  1.000  
440  440  OUTLIER   -62.0   -51.2  Favored   9   91.330  12  0.34  16  0.41  molprobity  1.000  
441  441  ?          90.9    24.5  Favored   3   77.000   4  0.35   5  0.63  molprobity  1.000  
442  442  ttpt      -93.3    99.4  Favored  13   74.450   9  0.26  11  0.49  molprobity  1.000  
443  443  ?        -133.5    57.3  Allowed   3   69.820   4  0.23   5  0.42  molprobity  1.000  
444  444  p        -134.2   148.4  Favored   5   80.120   6  0.33   8  0.46  molprobity  1.000  
445  445  m        -110.6   133.1  Favored   9   84.040   7  0.46  10  0.45  molprobity  1.000  
446  446  mp0      -107.0   122.2  Favored   8   78.060   9  0.29  12  0.39  molprobity  1.000  
447  447  p        -108.7   142.2  Favored   7   91.660   7  0.23  10  0.63  molprobity  1.000  
448  448  m         -86.1   122.4  Favored   9   88.870   7  0.29  10  0.68  molprobity  1.000  
449  449  mt       -102.5   141.5  Favored  11  102.600   8  0.41  12  0.83  molprobity  1.000  
450  450  Cg_endo   -88.1   150.4  Favored   7  142.450   8  0.25  11  0.52  molprobity  1.000  
451  451  mt       -123.8   159.9  Favored  11  142.150   8  0.25  11  0.45  molprobity  1.000  
452  452  m-20      -59.8   -44.0  Favored   6  144.810   8  0.23  11  0.31  molprobity  1.000  
453  453  t-20      -70.7   155.7  Favored   6  149.850   8  0.26  11  0.38  molprobity  1.000  
454  454  m-20      -75.7    55.3  Allowed   4  159.840   8  0.28  11  0.60  molprobity  1.000  
455  455  ptt180   -163.1   154.4  Favored  13  157.710  11  0.22  14  1.11  molprobity  1.000  
456  456  ?        -129.9   165.6  Favored   5  125.850   5  0.31   7  0.45  molprobity  1.000  
457  457  pp       -125.9   137.1  Favored  11  105.110   8  0.33  11  1.38  molprobity  1.000  
458  458  tttt      -94.7   123.6  Favored  13   85.030   9  0.25  11  0.47  molprobity  1.000  
459  459  mt       -133.4   139.2  Favored  11   83.330   8  0.23  11  1.12  molprobity  1.000  
460  460  p         -65.9   116.7  Favored   7   77.550   7  0.23  10  0.60  molprobity  1.000  
461  461  m        -100.4   -21.4  Favored   7   88.030   7  0.20  10  0.71  molprobity  1.000  
462  462  ?        -158.8   176.2  Favored   5   76.810   5  0.21   7  0.72  molprobity  1.000  
463  463  mp       -136.7   156.2  Favored  11   75.690   8  0.25  11  1.35  molprobity  1.000  
464  464  m-85      -79.8   149.8  Favored   9   70.520  13  0.33  18  0.39  molprobity  1.000  
465  465  m-85     -138.1   138.1  Favored   9   77.650  13  0.28  18  0.41  molprobity  1.000  
466  466  p         -75.5   168.5  Favored   7   77.220   7  0.19  11  0.54  molprobity  1.000  
467  467  Cg_exo    -56.8   -35.2  Favored   7   80.520   8  0.25  11  0.49  molprobity  1.000  
468  468  m-20      -62.5   -40.6  Favored   6  101.260   8  0.22  11  0.30  molprobity  1.000  
469  469  ?         122.7     4.0  Favored   3   86.760   4  0.32   5  0.65  molprobity  1.000  
470  470  ptt180    -81.3   129.2  Favored  13   97.230  11  0.20  14  1.08  molprobity  1.000  
471  471  t         -66.0   125.4  Favored   5   83.400   6  0.14   8  0.28  molprobity  1.000  
472  472  mt        -64.3   -33.0  Favored  11   69.970   8  0.24  11  0.33  molprobity  1.000  
473  473  tp60      -66.7   -42.9  Favored   8   85.960   9  0.27  12  0.31  molprobity  1.000  
474  474  ?         -82.2   -59.2  Favored   5  100.060   5  0.28   7  0.30  molprobity  1.000  
475  475  tt0       -68.9   -43.8  Favored   8  111.070   9  0.25  12  0.50  molprobity  1.000  
476  476  ?          79.4  -169.5  Favored   3   80.970   4  0.46   5  0.81  molprobity  1.000  
477  477  mm       -114.4   114.2  Favored  11   82.960   8  0.29  11  0.42  molprobity  1.000  
478  478  m         -94.0   124.1  Favored   9   81.750   7  0.45  11  0.55  molprobity  1.000  
479  479  Cg_endo   -69.5   148.8  Favored   7   79.430   8  0.22  11  0.63  molprobity  1.000  
480  480  m-20      -63.9   -33.3  Favored   4   84.000   8  0.25  11  0.32  molprobity  1.000  
481  481  mp       -122.7   126.2  Favored  11   78.190   8  0.25  11  0.43  molprobity  1.000  
482  482  mm-40     -88.3   123.9  Favored   6   85.080   9  0.23  12  0.33  molprobity  1.000  
483  483  t        -137.4   101.0  Favored   9   72.150   7  0.26  10  0.30  molprobity  1.000  
484  484  ?         -81.3   167.9  Favored   3  101.300   4  0.35   5  0.61  molprobity  1.000  
485  485  mtm180    -65.7   138.4  Favored  13  131.510  11  0.20  14  0.90  molprobity  1.000  
486  486  ?        -162.1   165.4  Favored   5  111.550   5  0.32   7  0.70  molprobity  1.000  
487  487  tptm     -119.5   133.8  Favored  13  117.560   9  0.26  11  0.35  molprobity  1.000  
488  488  m        -101.3   139.9  Favored   9  114.920   7  0.27  10  0.44  molprobity  1.000  
489  489  m        -125.9   114.8  Favored   7  119.370   7  0.21  10  0.64  molprobity  1.000  
490  490  mm-40     -70.2   145.8  Favored   8  130.970   9  0.20  12  0.44  molprobity  1.000  
491  491  mt-10    -126.5    25.5  Favored   6  129.770   9  0.29  12  0.23  molprobity  1.000  
492  492  mmm-85        ?       ?  ?        13  137.590  10  0.15  11  1.04  molprobity  1.000  
493  493  mp0           ?       ?  ?         5  137.920   9  0.22  12  0.25  molprobity  1.000  
494  494  ttt180   -133.1    99.0  Favored  13  121.170  11  0.33  15  0.94  molprobity  1.000  
495  495  Cg_endo   -81.9   -25.9  Favored   7  119.330   8  0.16  11  0.59  molprobity  1.000  
496  496  pm0       -62.4   -23.8  Favored   8  110.990   9  0.24  12  0.56  molprobity  1.000  
497  497  m-20      -61.8   -20.4  Favored   4  122.410   8  0.18  11  0.35  molprobity  1.000  
498  498  t        -112.7   -17.9  Favored   5  108.720   6  0.37   8  0.49  molprobity  1.000  
499  499  t0       -106.0   122.3  Favored   4  106.990   8  0.22  11  0.58  molprobity  1.000  
500  500  t80       -72.3   -49.2  Favored   9  101.730  13  0.25  18  0.22  molprobity  1.000  
501  501  mt-30     -64.2   -41.3  Favored   8   88.640   9  0.25  12  0.33  molprobity  1.000  
502  502  tp        -63.3   -41.7  Favored  11   88.250   8  0.23  11  0.24  molprobity  1.000  
503  503  t         -63.7   -41.6  Favored   5   95.520   6  0.22   8  0.25  molprobity  1.000  
504  504  mm-40     -61.4   -44.6  Favored   8   89.810   9  0.21  12  0.26  molprobity  1.000  
505  505  ?         -63.3   -40.0  Favored   5   79.860   5  0.30   7  0.26  molprobity  1.000  
506  506  tp        -61.9   -47.1  Favored  11   87.520   8  0.30  11  0.50  molprobity  1.000  
507  507  p         -65.7   -36.6  Favored   5   90.630   6  0.23   8  0.37  molprobity  1.000  
508  508  tp        -63.6   -43.0  Favored  11   70.680   8  0.25  11  0.27  molprobity  1.000  
509  509  mt        -63.5   -39.6  Favored  11   83.010   8  0.20  11  0.32  molprobity  1.000  
510  510  mttt      -60.8   -48.8  Favored  13   82.250   9  0.29  11  0.46  molprobity  1.000  
511  511  ?         -62.9   -40.7  Favored   3   75.690   4  0.13   5  0.26  molprobity  1.000  
512  512  mt        -60.6   -43.1  Favored  11   81.610   8  0.19  11  0.41  molprobity  1.000  
513  513  t         -64.3   -39.8  Favored   5   93.850   6  0.21   8  0.24  molprobity  1.000  
514  514  t         -65.2   -45.8  Favored   9   82.520   7  0.24  10  0.39  molprobity  1.000  
515  515  m         -61.4   -44.6  Favored   7   84.240   7  0.23  10  0.48  molprobity  1.000  
516  516  mmt180        ?       ?  ?        13  106.480  10  0.21  11  1.03  molprobity  1.000  
#
loop_
_pdbx_vrpt_instance_clashes.ordinal
_pdbx_vrpt_instance_clashes.instance_id
_pdbx_vrpt_instance_clashes.label_atom_id
_pdbx_vrpt_instance_clashes.cid
_pdbx_vrpt_instance_clashes.clashmag
_pdbx_vrpt_instance_clashes.dist
  1    4  OD1    1  0.73  2.21  
  2    5  N      1  0.73  2.21  
  3   31  O      2  0.42  2.20  
  4   35  HG3    2  0.42  2.20  
  5   42  HB3    3  0.47  2.14  
  6   45  OG     3  0.47  2.14  
  7   51  HG23   4  0.48  1.95  
  8   51  HG12   5  0.41  2.02  
  9   56  HD11   6  0.49  1.93  
 10   59  N      7  0.43  2.46  
 11   59  O      8  0.40  2.47  
 12   61  HB1    9  0.58  1.85  
 13   62  HB2    6  0.49  1.93  
 14   62  CE1   10  0.43  2.53  
 15   65  HD13   4  0.48  1.95  
 16   68  CE2   11  0.42  2.54  
 17   75  HB3    5  0.41  2.02  
 18   83  HD13   9  0.58  1.85  
 19   87  OD1    7  0.43  2.46  
 20   92  N      8  0.40  2.47  
 21   97  HB2   10  0.43  2.53  
 22  100  OD1   12  0.44  2.39  
 23  107  HG2   13  0.40  2.02  
 24  109  HA    11  0.42  2.54  
 25  110  O     14  0.47  2.15  
 26  114  HB2   14  0.47  2.15  
 27  115  HA    15  0.53  1.90  
 28  117  HD21  16  0.65  1.78  
 29  123  HG21  17  0.45  1.99  
 30  124  HE2   18  0.55  1.72  
 31  125  HG22  19  0.47  1.78  
 32  125  HG22  20  0.46  2.50  
 33  126  HE2   18  0.55  1.72  
 34  126  HB2   21  0.40  2.56  
 35  129  CG2   22  0.50  2.42  
 36  129  HG12  23  0.45  1.82  
 37  129  HG22  24  0.44  2.00  
 38  130  H     23  0.45  1.82  
 39  132  HB2   22  0.50  2.42  
 40  132  HB2   24  0.44  2.00  
 41  134  HD13  25  0.43  2.54  
 42  136  CE2   25  0.43  2.54  
 43  142  OD2   26  0.45  2.32  
 44  143  HD2   15  0.53  1.90  
 45  144  OG    26  0.45  2.32  
 46  151  HB    27  0.52  1.91  
 47  154  ND2   12  0.44  2.39  
 48  158  HA    28  0.45  2.37  
 49  158  HB2   29  0.43  2.01  
 50  159  OG    30  0.63  2.31  
 51  160  N     30  0.63  2.31  
 52  162  OE2   31  0.46  2.32  
 53  162  CD    28  0.45  2.37  
 54  163  HG12  17  0.45  1.99  
 55  170  OD2   32  0.41  2.21  
 56  171  HG3   16  0.65  1.78  
 57  176  HD22  27  0.52  1.91  
 58  182  HB3   29  0.43  2.01  
 59  183  N     31  0.46  2.32  
 60  183  O     33  0.41  2.21  
 61  185  H     34  0.61  1.66  
 62  186  HB3   35  0.45  1.98  
 63  190  HG22  36  0.53  1.90  
 64  200  HG3   36  0.53  1.90  
 65  206  HD1   19  0.47  1.78  
 66  206  CD1   20  0.46  2.50  
 67  207  CE1   21  0.40  2.56  
 68  210  HB2   32  0.41  2.21  
 69  212  HH11  37  0.54  1.72  
 70  215  HG2   34  0.61  1.66  
 71  215  HG3   35  0.45  1.98  
 72  215  HA    33  0.41  2.21  
 73  217  HG2   37  0.54  1.72  
 74  223  HG22  38  0.51  1.92  
 75  225  HG23  38  0.51  1.92  
 76  225  HG12  39  0.45  1.98  
 77  234  HG2   40  0.50  1.75  
 78  235  H     40  0.50  1.75  
 79  242  HG3   39  0.45  1.98  
 80  260  HD2   41  0.48  1.95  
 81  264  HD23  41  0.48  1.95  
 82  273  HD3   42  0.44  1.73  
 83  273  HA    42  0.44  1.73  
 84  296  HD12  43  0.43  2.00  
 85  305  HB2   43  0.43  2.00  
 86  308  OG    44  0.44  2.35  
 87  314  HD23  45  0.62  1.82  
 88  314  HD12  46  0.45  2.30  
 89  314  HD11  47  0.44  2.00  
 90  315  N     46  0.45  2.30  
 91  319  HB1   48  0.53  1.89  
 92  320  HB2   45  0.62  1.82  
 93  320  CE1   49  0.44  2.51  
 94  323  O     50  0.52  2.42  
 95  326  CE1   51  0.41  2.56  
 96  327  OE1   44  0.44  2.35  
 97  329  O     52  0.57  2.05  
 98  331  O     53  0.47  2.14  
 99  331  HA3   54  0.41  2.03  
100  332  HG2   52  0.57  2.05  
101  334  O     55  0.49  2.12  
102  334  HG22  53  0.47  2.14  
103  337  O     56  0.42  2.20  
104  338  HD13  55  0.49  2.12  
105  341  HD13  48  0.53  1.89  
106  341  HG    56  0.42  2.20  
107  353  HG13  57  0.45  1.98  
108  355  HB2   49  0.44  2.51  
109  357  NH2   58  0.61  2.32  
110  357  HB2   59  0.55  1.89  
111  357  CB    60  0.48  2.44  
112  359  ND2   50  0.52  2.42  
113  361  HA3   61  0.48  1.96  
114  365  HG2   13  0.40  2.02  
115  366  HA    62  0.40  2.03  
116  367  HB2   63  0.55  1.88  
117  367  HA    51  0.41  2.56  
118  369  HG3   54  0.41  2.03  
119  369  HG2   62  0.40  2.03  
120  372  OD1   64  0.41  2.20  
121  373  HA    65  0.64  1.79  
122  374  O     66  0.57  2.37  
123  383  O     67  0.47  2.14  
124  387  HG22  68  0.47  1.96  
125  387  HG12  69  0.43  1.83  
126  387  CG2   70  0.40  2.51  
127  388  H     69  0.43  1.83  
128  390  HB3   68  0.47  1.96  
129  390  HB3   70  0.40  2.51  
130  391  HA    67  0.47  2.14  
131  396  HA    64  0.41  2.20  
132  401  HD2   65  0.64  1.79  
133  408  HG11  71  0.57  1.86  
134  408  HG13  57  0.45  1.98  
135  409  HB    72  0.61  1.83  
136  412  HB2   59  0.55  1.89  
137  412  HB2   60  0.48  2.44  
138  417  HB3   61  0.48  1.96  
139  417  HB2   73  0.45  1.98  
140  418  HB1   63  0.55  1.88  
141  420  HG2   74  0.44  1.99  
142  420  OE2   75  0.43  2.17  
143  421  HD11  76  0.51  2.46  
144  430  HE2   77  0.41  1.76  
145  430  HB2   77  0.41  1.76  
146  431  NH1   66  0.57  2.37  
147  434  HD22  72  0.61  1.83  
148  442  HE3   73  0.45  1.98  
149  446  HG3   78  0.57  1.86  
150  457  HD12  79  0.44  2.17  
151  457  O     79  0.44  2.17  
152  460  HG22  78  0.57  1.86  
153  464  CD2   76  0.51  2.46  
154  466  OG1   80  0.52  2.10  
155  470  HG2   80  0.52  2.10  
156  472  HG23  75  0.43  2.17  
157  477  HG12  74  0.44  1.99  
158  481  HG22  81  0.49  1.93  
159  483  HG23  81  0.49  1.93  
160  483  O     82  0.41  2.46  
161  499  OD2   58  0.61  2.32  
162  501  NE2   82  0.41  2.46  
163  505  HB1   71  0.57  1.86  
164  506  HD13  47  0.44  2.00  
165  516  HD3   83  0.47  1.58  
166  516  HA    83  0.47  1.58  
#
loop_
_pdbx_vrpt_model_instance_density.ordinal
_pdbx_vrpt_model_instance_density.instance_id
_pdbx_vrpt_model_instance_density.natoms_eds
_pdbx_vrpt_model_instance_density.RSRCC
_pdbx_vrpt_model_instance_density.RSR
_pdbx_vrpt_model_instance_density.RSRZ
  1    1   8  0.822  0.320   0.457  
  2    2   7  0.811  0.226   0.085  
  3    3   8  0.878  0.497   2.009  
  4    4   8  0.865  0.172  -0.460  
  5    5   9  0.878  0.337   0.706  
  6    6   8  0.940  0.251  -0.147  
  7    7  11  0.876  0.428   1.227  
  8    8   7  0.916  0.195  -0.199  
  9    9  11  0.960  0.738   4.153  
 10   10   5  0.970  0.207  -0.094  
 11   11   9  0.890  0.401   1.267  
 12   12   7  0.978  0.509   2.304  
 13   13   8  0.980  0.404   1.194  
 14   14   8  0.929  0.215  -0.017  
 15   15  11  0.861  0.337   0.508  
 16   16   7  0.982  0.588   3.010  
 17   17   9  0.946  0.355   0.536  
 18   18   5  0.972  0.208  -0.085  
 19   19   5  0.982  0.352   1.255  
 20   20  12  0.943  0.341   0.849  
 21   21   7  0.944  0.428   1.581  
 22   22   9  0.875  0.335   0.689  
 23   23   7  0.953  0.263   0.453  
 24   24   7  0.895  0.530   2.492  
 25   25   8  0.792  0.224   0.075  
 26   26   8  0.892  0.269   0.538  
 27   27   9  0.881  0.328   0.325  
 28   28   7  0.938  0.295   0.855  
 29   29   8  0.954  0.416   1.299  
 30   30   8  0.979  0.585   2.780  
 31   31   9  0.899  0.259   0.023  
 32   32   8  0.941  0.289   0.789  
 33   33   5  0.959  0.343   1.171  
 34   34   8  0.973  0.544   2.551  
 35   35   9  0.953  0.520   1.823  
 36   36   4  0.981  0.291   0.795  
 37   37   8  0.958  0.262       ?  
 38   38   8  0.979  0.481   1.869  
 39   39   6  0.963  0.191  -0.131  
 40   40   8  0.927  0.234   0.208  
 41   41   8  0.939  0.506   2.088  
 42   42   8  0.954  0.302   0.878  
 43   43   7  0.955  0.272   0.542  
 44   44  10  0.888  0.323   0.979  
 45   45   6  0.938  0.249   0.477  
 46   46   5  0.945  0.303   0.799  
 47   47  12  0.692  0.495   2.279  
 48   48   7  0.711  0.765   4.590  
 49   49   9  0.888  0.564   2.166  
 50   50   6  0.889  0.212   0.089  
 51   51   7  0.929  0.419   1.501  
 52   52   9  0.943  0.461   1.363  
 53   53   6  0.900  0.253   0.519  
 54   54   9  0.933  0.255   0.123  
 55   55   7  0.915  0.339   0.787  
 56   56   8  0.960  0.475   1.816  
 57   57   9  0.857  0.274   0.154  
 58   58   7  0.964  0.253   0.353  
 59   59   4  0.976  0.219   0.149  
 60   60  12  0.961  0.368   1.099  
 61   61   5  0.983  0.314   0.901  
 62   62  12  0.970  0.421   1.591  
 63   63   8  0.990  0.491   1.956  
 64   64  11  0.829  0.379   0.840  
 65   65   8  0.980  0.475   1.927  
 66   66   7  0.957  0.335   1.276  
 67   67   9  0.884  0.418   1.686  
 68   68  11  0.945  0.427   1.428  
 69   69   9  0.880  0.250   0.075  
 70   70   7  0.965  0.316   0.581  
 71   71   8  0.811  0.401   1.971  
 72   72   7  0.976  0.284   0.739  
 73   73   4  0.945  0.225   0.203  
 74   74   9  0.911  0.473   1.898  
 75   75   9  0.944  0.219  -0.328  
 76   76   7  0.990  0.364   1.010  
 77   77   7  0.983  0.355   0.929  
 78   78   9  0.902  0.263  -0.182  
 79   79   5  0.977  0.271   0.501  
 80   80   8  0.991  0.419   1.325  
 81   81   8  0.950  0.372   1.665  
 82   82   9  0.940  0.207  -0.337  
 83   83   8  0.988  0.485   1.904  
 84   84  11  0.892  0.442   1.337  
 85   85   9  0.934  0.306   0.154  
 86   86   8  0.950  0.259   0.435  
 87   87   8  0.962  0.207  -0.077  
 88   88   9  0.952  0.367   0.629  
 89   89   4  0.977  0.208   0.050  
 90   90  11  0.942  0.378   0.832  
 91   91   8  0.918  0.487   1.921  
 92   92   9  0.917  0.291   0.037  
 93   93   4  0.963  0.338   1.217  
 94   94   8  0.989  0.524   2.245  
 95   95   7  0.972  0.458   1.849  
 96   96   8  0.980  0.567   2.622  
 97   97   8  0.946  0.272   0.569  
 98   98   8  0.973  0.582   2.754  
 99   99  11  0.912  0.311   0.303  
100  100   8  0.966  0.210  -0.045  
101  101   8  0.936  0.312   1.032  
102  102   7  0.974  0.362   1.438  
103  103   4  0.984  0.190  -0.111  
104  104   4  0.938  0.170  -0.291  
105  105   7  0.975  0.450   1.778  
106  106   8  0.959  0.526   2.263  
107  107   9  0.968  0.360   1.129  
108  108   6  0.991  0.247   0.456  
109  109   5  0.992  0.395   1.655  
110  110   7  0.981  0.397   1.304  
111  111   9  0.970  0.197  -0.521  
112  112   7  0.990  0.471   1.965  
113  113   5  0.998  0.390   1.608  
114  114   8  0.958  0.243   0.271  
115  115   5  0.983  0.393   1.636  
116  116  11  0.966  0.432   1.472  
117  117   8  0.966  0.377   0.957  
118  118   7  0.949  0.345   1.381  
119  119   9  0.938  0.336   0.388  
120  120   4  0.960  0.279   0.688  
121  121   8  0.939  0.464   1.720  
122  122   8  0.980  0.496   2.117  
123  123   7  0.986  0.382   1.171  
124  124  12  0.918  0.449   1.851  
125  125   7  0.945  0.270   0.591  
126  126   9  0.813  0.412   0.980  
127  127   4  0.840  0.350   1.325  
128  128  11  0.858  0.311   0.303  
129  129   8  0.939  0.441   1.619  
130  130   5  0.909  0.151  -0.615  
131  131   8  0.810  0.208  -0.067  
132  132   6  0.923  0.370   1.747  
133  133   9  0.901  0.205  -0.450  
134  134   8  0.961  0.367   0.869  
135  135  11  0.933  0.294   0.168  
136  136  11  0.982  0.434   1.489  
137  137   6  0.924  0.251   0.498  
138  138   5  0.977  0.350   1.236  
139  139   8  0.959  0.246   0.301  
140  140   7  0.979  0.407   1.886  
141  141   5  0.965  0.304   0.808  
142  142   8  0.933  0.259   0.435  
143  143   7  0.970  0.410   1.915  
144  144   6  0.971  0.278   0.782  
145  145   8  0.949  0.218   0.013  
146  146   9  0.940  0.264  -0.174  
147  147   7  0.982  0.338   0.778  
148  148   7  0.975  0.291   0.731  
149  149   8  0.978  0.469   1.763  
150  150   7  0.986  0.456   1.831  
151  151   7  0.985  0.442   1.706  
152  152   8  0.978  0.524   2.245  
153  153   8  0.988  0.564   2.731  
154  154   8  0.931  0.280   0.694  
155  155   4  0.962  0.192  -0.093  
156  156   4  0.965  0.167  -0.318  
157  157   6  0.956  0.281   0.813  
158  158   5  0.970  0.323   0.985  
159  159   6  0.940  0.221   0.184  
160  160   5  0.976  0.380   1.515  
161  161   5  0.970  0.387   1.580  
162  162   9  0.954  0.246  -0.091  
163  163   8  0.975  0.459   1.782  
164  164   7  0.987  0.416   1.474  
165  165   5  0.995  0.382   1.534  
166  166   4  0.993  0.262   0.535  
167  167   5  0.993  0.288   0.660  
168  168   8  0.991  0.485   1.904  
169  169   9  0.973  0.319   0.736  
170  170   8  0.957  0.225   0.085  
171  171   9  0.926  0.320   0.746  
172  172   9  0.929  0.302   0.122  
173  173  11  0.953  0.274   0.010  
174  174   5  0.966  0.396   1.664  
175  175   8  0.944  0.474   1.918  
176  176   8  0.989  0.389   1.062  
177  177   8  0.980  0.337       ?  
178  178   4  0.974  0.286   0.750  
179  179   7  0.893  0.288   0.781  
180  180   8  0.941  0.240   0.240  
181  181   6  0.931  0.197  -0.068  
182  182  11  0.961  0.350   0.753  
183  183   4  0.896  0.206   0.032  
184  184   9  0.914  0.385   0.770  
185  185   4  0.980  0.305   0.921  
186  186   6  0.934  0.249   0.477  
187  187   7  0.937  0.329   0.697  
188  188   9  0.801  0.328   0.823  
189  189   7  0.880  0.305   0.960  
190  190   7  0.953  0.425   1.554  
191  191   8  0.952  0.399   1.150  
192  192   7  0.935  0.265   0.473  
193  193   8  0.932  0.508   2.105  
194  194   8  0.783  0.251   0.388  
195  195   8  0.898  0.315   1.063  
196  196   8  0.876  0.297   0.826  
197  197  11  0.678  0.168  -0.827  
198  198   5  0.894  0.607   3.627  
199  199   8  0.952  0.574   2.684  
200  200   9  0.884  0.526   1.870  
201  201   8  0.954  0.447   1.571  
202  202   7  0.954  0.340   1.329  
203  203   7  0.978  0.334   1.266  
204  204   5  0.959  0.318   0.939  
205  205   8  0.960  0.432   1.439  
206  206  12  0.928  0.401   1.406  
207  207  12  0.903  0.502   2.344  
208  208   7  0.971  0.438   2.361  
209  209   7  0.947  0.357   1.388  
210  210   8  0.893  0.259   0.472  
211  211   4  0.943  0.269   0.598  
212  212  11  0.937  0.349   0.603  
213  213   6  0.973  0.237   0.352  
214  214   8  0.981  0.395   1.203  
215  215   9  0.936  0.253   0.104  
216  216   5  0.958  0.279   0.576  
217  217   9  0.899  0.285   0.410  
218  218   4  0.909  0.224   0.194  
219  219   8  0.962  0.424   1.466  
220  220   7  0.936  0.337   0.769  
221  221   7  0.969  0.340   1.219  
222  222   8  0.924  0.240   0.240  
223  223   8  0.989  0.384   1.104  
224  224   9  0.926  0.307   0.443  
225  225   7  0.975  0.375   1.108  
226  226   4  0.965  0.274   0.643  
227  227  11  0.845  0.234  -0.306  
228  228   5  0.941  0.237   0.185  
229  229   9  0.916  0.427   1.098  
230  230   7  0.917  0.384   1.188  
231  231   7  0.940  0.296   0.865  
232  232   9  0.899  0.310   0.650  
233  233   9  0.781  0.311   0.479  
234  234   9  0.878  0.166  -0.792  
235  235  11  0.906  0.280   0.058  
236  236   7  0.977  0.279   0.612  
237  237   9  0.977  0.360   1.129  
238  238   8  0.895  0.202  -0.151  
239  239   6  0.899  0.156  -0.498  
240  240   8  0.922  0.212  -0.048  
241  241  12  0.946  0.339   0.830  
242  242   9  0.924  0.269   0.257  
243  243   8  0.988  0.474   1.807  
244  244   6  0.961  0.260   0.593  
245  245   9  0.948  0.310   0.650  
246  246   5  0.985  0.325   1.004  
247  247   8  0.983  0.513   2.149  
248  248   6  0.959  0.260   0.593  
249  249   8  0.989  0.405   1.202  
250  250   8  0.982  0.437   1.483  
251  251   9  0.961  0.400   0.887  
252  252   4  0.991  0.431   2.052  
253  253   8  0.976  0.405   1.202  
254  254   6  0.964  0.211   0.079  
255  255   7  0.954  0.311   0.537  
256  256   7  0.917  0.246   0.338  
257  257  11  0.892  0.214  -0.464  
258  258   4  0.885  0.165  -0.336  
259  259   8  0.865  0.504   2.070  
260  260   7  0.864  0.293   0.751  
261  261   8  0.861  0.426   1.387  
262  262   8  0.616  0.200  -0.172  
263  263   9  0.823  0.457   1.758  
264  264   8  0.934  0.501   2.044  
265  265  11  0.883  0.364   0.721  
266  266   7  0.937  0.171  -0.452  
267  267  11  0.952  0.628   3.189  
268  268   5  0.967  0.166  -0.475  
269  269   9  0.915  0.250  -0.056  
270  270   7  0.987  0.413   1.447  
271  271   8  0.973  0.477   1.833  
272  272   8  0.922  0.198  -0.192  
273  273  11  0.957  0.246  -0.211  
274  274   7  0.984  0.599   3.108  
275  275   9  0.916  0.331   0.349  
276  276   5  0.977  0.213  -0.038  
277  277   5  0.961  0.260   0.399  
278  278  12  0.955  0.424   1.619  
279  279   7  0.943  0.303   0.465  
280  280   9  0.873  0.291   0.303  
281  281   7  0.949  0.316   0.980  
282  282   7  0.947  0.547   2.644  
283  283   8  0.864  0.319   1.052  
284  284   8  0.905  0.363   1.505  
285  285   9  0.884  0.307   0.161  
286  286   7  0.941  0.373   1.677  
287  287   8  0.988  0.397   1.132  
288  288   8  0.974  0.584   2.771  
289  289   9  0.943  0.228  -0.249  
290  290   8  0.974  0.320   1.116  
291  291   5  0.987  0.290   0.678  
292  292   8  0.987  0.520   2.334  
293  293   9  0.962  0.341   0.427  
294  294   4  0.980  0.309   0.957  
295  295   8  0.965  0.332       ?  
296  296   8  0.977  0.388   1.053  
297  297   6  0.973  0.187  -0.173  
298  298   8  0.962  0.207  -0.077  
299  299   8  0.953  0.397   1.132  
300  300   8  0.921  0.188  -0.295  
301  301   7  0.961  0.213  -0.045  
302  302  10  0.869  0.312   0.869  
303  303   6  0.973  0.248   0.467  
304  304   5  0.974  0.358   1.311  
305  305  12  0.768  0.574   3.012  
306  306   7  0.896  0.183  -0.606  
307  307   9  0.892  0.413   0.988  
308  308   6  0.916  0.323   1.254  
309  309   7  0.942  0.357   0.947  
310  310   9  0.936  0.569   2.205  
311  311   6  0.908  0.286   0.866  
312  312   9  0.918  0.273   0.295  
313  313   7  0.935  0.380   1.153  
314  314   8  0.920  0.489   1.939  
315  315   9  0.875  0.308   0.452  
316  316   7  0.969  0.286   0.682  
317  317   4  0.942  0.250   0.427  
318  318  12  0.974  0.503   2.353  
319  319   5  0.975  0.465   2.306  
320  320  12  0.959  0.417   1.554  
321  321   8  0.973  0.401   1.167  
322  322  11  0.935  0.362   0.705  
323  323   8  0.990  0.487   2.035  
324  324   7  0.975  0.352   1.455  
325  325   9  0.921  0.445   1.944  
326  326  11  0.966  0.454   1.664  
327  327   9  0.906  0.282   0.382  
328  328   7  0.971  0.314   0.563  
329  329   8  0.920  0.251   0.388  
330  330   7  0.983  0.287   0.770  
331  331   4  0.964  0.240   0.338  
332  332   9  0.919  0.402   1.276  
333  333   9  0.954  0.284   0.242  
334  334   7  0.982  0.390   1.242  
335  335   7  0.991  0.443   1.715  
336  336   9  0.962  0.343   0.442  
337  337   5  0.985  0.321   0.967  
338  338   8  0.994  0.388   1.053  
339  339   8  0.931  0.302   0.926  
340  340   9  0.948  0.278   0.343  
341  341   8  0.981  0.417   1.308  
342  342  11  0.955  0.293   0.160  
343  343   9  0.941  0.305   0.146  
344  344   8  0.932  0.184  -0.336  
345  345   8  0.961  0.220   0.060  
346  346   9  0.941  0.272  -0.112  
347  347   4  0.961  0.205   0.023  
348  348  11  0.917  0.304   0.247  
349  349   8  0.972  0.490   1.947  
350  350   9  0.872  0.316   0.232  
351  351   4  0.986  0.424   1.989  
352  352   8  0.988  0.533   2.324  
353  353   7  0.987  0.374   1.099  
354  354   8  0.977  0.535   2.342  
355  355   8  0.912  0.309   0.950  
356  356   8  0.982  0.562   2.578  
357  357  11  0.923  0.290   0.137  
358  358   8  0.953  0.233   0.197  
359  359   8  0.966  0.283   0.725  
360  360   7  0.980  0.315   0.970  
361  361   4  0.977  0.247   0.400  
362  362   4  0.913  0.159  -0.390  
363  363   7  0.973  0.330   0.706  
364  364   8  0.979  0.466   1.737  
365  365   9  0.978  0.328   0.823  
366  366   6  0.975  0.354   1.579  
367  367   5  0.988  0.308   0.846  
368  368   7  0.980  0.391   1.251  
369  369   9  0.945  0.343   0.759  
370  370   7  0.992  0.448   1.760  
371  371   5  0.994  0.403   1.729  
372  372   8  0.943  0.341   1.279  
373  373   5  0.985  0.411   1.804  
374  374  11  0.956  0.514   2.190  
375  375   8  0.971  0.396   1.124  
376  376   7  0.944  0.281   0.707  
377  377   9  0.955  0.351   0.505  
378  378   4  0.956  0.242   0.355  
379  379   8  0.963  0.535   2.342  
380  380   8  0.979  0.471   1.891  
381  381   7  0.991  0.479   2.037  
382  382  12  0.939  0.441   1.777  
383  383   7  0.953  0.398   1.940  
384  384   9  0.931  0.321   0.271  
385  385   4  0.925  0.170  -0.291  
386  386  11  0.822  0.341   0.539  
387  387   8  0.967  0.275   0.118  
388  388   5  0.956  0.218   0.008  
389  389   8  0.819  0.230   0.166  
390  390   6  0.936  0.300   1.013  
391  391   9  0.860  0.158  -0.862  
392  392   8  0.927  0.455   1.641  
393  393  11  0.898  0.456   1.448  
394  394  11  0.980  0.565   2.637  
395  395   6  0.936  0.304   1.055  
396  396   5  0.953  0.275   0.539  
397  397   8  0.961  0.233   0.168  
398  398   7  0.951  0.420   2.015  
399  399   5  0.963  0.264   0.436  
400  400   8  0.951  0.332   1.186  
401  401   7  0.982  0.367   1.488  
402  402   6  0.973  0.264   0.635  
403  403   8  0.934  0.206  -0.110  
404  404   9  0.948  0.395   0.848  
405  405   7  0.971  0.352   0.903  
406  406   7  0.982  0.383   1.647  
407  407   8  0.962  0.521   2.219  
408  408   7  0.978  0.469   1.947  
409  409   7  0.986  0.448   1.760  
410  410   8  0.978  0.498   2.018  
411  411   8  0.975  0.580   2.876  
412  412   8  0.874  0.273   0.620  
413  413   4  0.961  0.251   0.436  
414  414   4  0.966  0.271   0.616  
415  415   6  0.961  0.330   1.327  
416  416   5  0.990  0.314   0.901  
417  417   6  0.961  0.304   1.055  
418  418   5  0.984  0.479   2.436  
419  419   5  0.986  0.349   1.227  
420  420   9  0.982  0.346   0.785  
421  421   8  0.971  0.427   1.493  
422  422   7  0.995  0.470   1.956  
423  423   5  0.985  0.467   2.325  
424  424   4  0.989  0.270   0.607  
425  425   5  0.989  0.453   2.194  
426  426   8  0.987  0.512   2.140  
427  427   9  0.935  0.361   1.139  
428  428   8  0.979  0.280   0.651  
429  429   9  0.964  0.280   0.362  
430  430   9  0.914  0.295   0.068  
431  431  11  0.925  0.279   0.050  
432  432   5  0.978  0.302   0.790  
433  433   8  0.988  0.424   1.466  
434  434   8  0.984  0.396   1.124  
435  435   8  0.977  0.321       ?  
436  436   4  0.986  0.298   0.858  
437  437   7  0.893  0.305   0.960  
438  438   8  0.931  0.230   0.137  
439  439   6  0.910  0.354   1.579  
440  440  11  0.938  0.374   0.963  
441  441   4  0.953  0.178  -0.219  
442  442   9  0.939  0.420   1.043  
443  443   4  0.986  0.366   1.469  
444  444   6  0.926  0.226   0.236  
445  445   7  0.975  0.343   0.822  
446  446   9  0.930  0.305   0.602  
447  447   7  0.949  0.353   1.466  
448  448   7  0.967  0.366   1.028  
449  449   8  0.952  0.453   1.623  
450  450   7  0.873  0.401   1.826  
451  451   8  0.868  0.603   2.938  
452  452   8  0.812  0.161  -0.563  
453  453   8  0.899  0.358   1.517  
454  454   8  0.852  0.169  -0.491  
455  455  11  0.809  0.533   2.056  
456  456   5  0.728  0.303   0.799  
457  457   8  0.974  0.586   2.789  
458  458   9  0.814  0.477   1.488  
459  459   8  0.939  0.494   1.982  
460  460   7  0.970  0.300   0.907  
461  461   7  0.976  0.302   0.928  
462  462   5  0.983  0.290   0.678  
463  463   8  0.964  0.344   0.668  
464  464  12  0.952  0.352   0.951  
465  465  12  0.941  0.359   1.016  
466  466   7  0.984  0.367   1.613  
467  467   7  0.961  0.362   1.438  
468  468   8  0.937  0.181  -0.352  
469  469   4  0.955  0.235   0.293  
470  470  11  0.937  0.423   1.187  
471  471   6  0.980  0.315   1.170  
472  472   8  0.990  0.467   1.854  
473  473   9  0.951  0.266   0.228  
474  474   5  0.972  0.240   0.213  
475  475   9  0.830  0.336   0.899  
476  476   4  0.974  0.263   0.544  
477  477   8  0.974  0.451   1.710  
478  478   7  0.945  0.332   0.724  
479  479   7  0.955  0.322   1.040  
480  480   8  0.927  0.280   0.651  
481  481   8  0.973  0.420   1.429  
482  482   9  0.915  0.355   0.864  
483  483   7  0.979  0.463   1.894  
484  484   4  0.962  0.297   0.849  
485  485  11  0.876  0.323   0.397  
486  486   5  0.886  0.223   0.055  
487  487   9  0.840  0.402   0.902  
488  488   7  0.869  0.323   0.644  
489  489   7  0.940  0.273   0.623  
490  490   9  0.890  0.255   0.123  
491  491   9  0.758  0.292   0.312  
492  492  11  0.628  0.578   2.412  
493  493   9  0.779  0.400   1.259  
494  494  11  0.780  0.190  -0.653  
495  495   7  0.930  0.227   0.095  
496  496   9  0.929  0.396   1.475  
497  497   8  0.926  0.253   0.373  
498  498   6  0.926  0.194  -0.100  
499  499   8  0.914  0.156  -0.624  
500  500  12  0.936  0.312   0.579  
501  501   9  0.929  0.338   0.919  
502  502   8  0.985  0.498   2.018  
503  503   6  0.906  0.197  -0.068  
504  504   9  0.973  0.255   0.123  
505  505   5  0.990  0.264   0.436  
506  506   8  0.984  0.481   1.869  
507  507   6  0.960  0.284   0.845  
508  508   8  0.983  0.367   0.869  
509  509   8  0.982  0.407   1.220  
510  510   9  0.896  0.239  -0.369  
511  511   4  0.987  0.197  -0.048  
512  512   8  0.990  0.427   1.395  
513  513   6  0.964  0.248   0.467  
514  514   7  0.957  0.367   1.037  
515  515   7  0.928  0.336   1.287  
516  516  11  0.849  0.333   0.476  
#
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        "1.8.5 (274361), CSD as541be (2020)"                                  Y  
3  eds          2.27                                                                  Y  
4  dcc          "2.26  (2020-01-20)"                                                  Y  
5  xtriage      1.13                                                                  Y  
6  percentiles  "20191225.v01 (using entries in the PDB archive December 25th 2019)"  Y  
##
