data_2KCL

loop_
_pdbx_vrpt_database.id
_pdbx_vrpt_database.code
PDB   2KCL   
BMRB  16084  
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   nmr
#
_pdbx_vrpt_summary.entry_id                    2KCL
_pdbx_vrpt_summary.PDB_deposition_date         2008-12-22
_pdbx_vrpt_summary.PDB_revision_number         4
_pdbx_vrpt_summary.PDB_revision_date           2023-06-14
_pdbx_vrpt_summary.report_creation_date        2023-06-03:22:07
_pdbx_vrpt_summary.attempted_validation_steps  molprobity,validation-pack,coreclust,chemicalshiftanalysis,restraintsanalysis,percentiles,writepdf,writexml,writecif
_pdbx_vrpt_summary.ligands_for_buster_report   N
#
_pdbx_vrpt_entity.id           1
_pdbx_vrpt_entity.type         polymer
_pdbx_vrpt_entity.description  "Tetratricopeptide repeat domain protein"
#
_pdbx_vrpt_asym.label_asym_id  A
_pdbx_vrpt_asym.entity_id      1
#
loop_
_pdbx_vrpt_percentile_list.id
_pdbx_vrpt_percentile_list.range
_pdbx_vrpt_percentile_list.exp_method
1  all  pdb    
2  nmr  x-ray  
#
loop_
_pdbx_vrpt_percentile_type.id
_pdbx_vrpt_percentile_type.type
1  all_atom_clashscore           
2  Ramachandran_outlier_percent  
3  rotamer_outliers_percent      
#
loop_
_pdbx_vrpt_percentile_conditions.id
_pdbx_vrpt_percentile_conditions.percentile_list_id
_pdbx_vrpt_percentile_conditions.type_id
_pdbx_vrpt_percentile_conditions.rank
_pdbx_vrpt_percentile_conditions.number_entries_total
_pdbx_vrpt_percentile_conditions.res_high
_pdbx_vrpt_percentile_conditions.res_low
1  1  1  83.87  158937  ?     ?     
2  2  1  76.50   12864  ?     ?     
3  1  2  54.40  154571  ?     ?     
4  2  2  85.17   11451  ?     ?     
5  1  3  58.86  154315  ?     ?     
6  2  3  93.42   11428  ?     ?     
#
loop_
_pdbx_vrpt_percentile_entity_view.ordinal
_pdbx_vrpt_percentile_entity_view.conditions_id
_pdbx_vrpt_percentile_entity_view.type_id
_pdbx_vrpt_percentile_entity_view.label_asym_id
_pdbx_vrpt_percentile_entity_view.PDB_model_num
_pdbx_vrpt_percentile_entity_view.entity_id
_pdbx_vrpt_percentile_entity_view.auth_asym_id
_pdbx_vrpt_percentile_entity_view.rank
 1  3  2  A   1  1  A  100.00  
 2  4  2  A   1  1  A  100.00  
 3  5  3  A   1  1  A   48.54  
 4  6  3  A   1  1  A   48.54  
 5  3  2  A   2  1  A  100.00  
 6  4  2  A   2  1  A  100.00  
 7  5  3  A   2  1  A   34.70  
 8  6  3  A   2  1  A   34.70  
 9  3  2  A   3  1  A  100.00  
10  4  2  A   3  1  A  100.00  
11  5  3  A   3  1  A   71.01  
12  6  3  A   3  1  A   71.01  
13  3  2  A   4  1  A  100.00  
14  4  2  A   4  1  A  100.00  
15  5  3  A   4  1  A   25.39  
16  6  3  A   4  1  A   25.39  
17  3  2  A   5  1  A  100.00  
18  4  2  A   5  1  A  100.00  
19  5  3  A   5  1  A   48.54  
20  6  3  A   5  1  A   48.54  
21  3  2  A   6  1  A  100.00  
22  4  2  A   6  1  A  100.00  
23  5  3  A   6  1  A   48.54  
24  6  3  A   6  1  A   48.54  
25  3  2  A   7  1  A    6.72  
26  4  2  A   7  1  A    6.72  
27  5  3  A   7  1  A   48.54  
28  6  3  A   7  1  A   48.54  
29  3  2  A   8  1  A  100.00  
30  4  2  A   8  1  A  100.00  
31  5  3  A   8  1  A   71.01  
32  6  3  A   8  1  A   71.01  
33  3  2  A   9  1  A    6.72  
34  4  2  A   9  1  A    6.72  
35  5  3  A   9  1  A   48.54  
36  6  3  A   9  1  A   48.54  
37  3  2  A  10  1  A  100.00  
38  4  2  A  10  1  A  100.00  
39  5  3  A  10  1  A   34.70  
40  6  3  A  10  1  A   34.70  
41  3  2  A  11  1  A  100.00  
42  4  2  A  11  1  A  100.00  
43  5  3  A  11  1  A   48.54  
44  6  3  A  11  1  A   48.54  
45  3  2  A  12  1  A  100.00  
46  4  2  A  12  1  A  100.00  
47  5  3  A  12  1  A   48.54  
48  6  3  A  12  1  A   48.54  
49  3  2  A  13  1  A  100.00  
50  4  2  A  13  1  A  100.00  
51  5  3  A  13  1  A   71.01  
52  6  3  A  13  1  A   71.01  
53  3  2  A  14  1  A  100.00  
54  4  2  A  14  1  A  100.00  
55  5  3  A  14  1  A   48.54  
56  6  3  A  14  1  A   48.54  
57  3  2  A  15  1  A  100.00  
58  4  2  A  15  1  A  100.00  
59  5  3  A  15  1  A   48.54  
60  6  3  A  15  1  A   48.54  
61  3  2  A  16  1  A  100.00  
62  4  2  A  16  1  A  100.00  
63  5  3  A  16  1  A   48.54  
64  6  3  A  16  1  A   48.54  
65  3  2  A  17  1  A  100.00  
66  4  2  A  17  1  A  100.00  
67  5  3  A  17  1  A   48.54  
68  6  3  A  17  1  A   48.54  
69  3  2  A  18  1  A  100.00  
70  4  2  A  18  1  A  100.00  
71  5  3  A  18  1  A   48.54  
72  6  3  A  18  1  A   48.54  
73  3  2  A  19  1  A    6.72  
74  4  2  A  19  1  A    6.72  
75  5  3  A  19  1  A   71.01  
76  6  3  A  19  1  A   71.01  
77  3  2  A  20  1  A  100.00  
78  4  2  A  20  1  A  100.00  
79  5  3  A  20  1  A   48.54  
80  6  3  A  20  1  A   48.54  
#
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  0.36  0.48  831  1124  
 2   2  1  A  A  0.37  0.49  831  1124  
 3   3  1  A  A  0.36  0.49  831  1124  
 4   4  1  A  A  0.37  0.49  831  1124  
 5   5  1  A  A  0.36  0.49  831  1124  
 6   6  1  A  A  0.38  0.50  831  1124  
 7   7  1  A  A  0.37  0.49  831  1124  
 8   8  1  A  A  0.37  0.49  831  1124  
 9   9  1  A  A  0.37  0.49  831  1124  
10  10  1  A  A  0.37  0.49  831  1124  
11  11  1  A  A  0.37  0.50  831  1124  
12  12  1  A  A  0.36  0.49  831  1124  
13  13  1  A  A  0.37  0.49  831  1124  
14  14  1  A  A  0.36  0.49  831  1124  
15  15  1  A  A  0.36  0.49  831  1124  
16  16  1  A  A  0.35  0.49  831  1124  
17  17  1  A  A  0.36  0.49  831  1124  
18  18  1  A  A  0.36  0.49  831  1124  
19  19  1  A  A  0.39  0.49  831  1124  
20  20  1  A  A  0.37  0.49  831  1124  
#
_pdbx_vrpt_summary_geometry.ordinal                                    1
_pdbx_vrpt_summary_geometry.percent_ramachandran_outliers              0.11
_pdbx_vrpt_summary_geometry.percent_ramachandran_outliers_full_length  0.31
_pdbx_vrpt_summary_geometry.percent_rotamer_outliers                   1.91
_pdbx_vrpt_summary_geometry.percent_rotamer_outliers_full_length       2.38
_pdbx_vrpt_summary_geometry.clashscore                                 2.32
_pdbx_vrpt_summary_geometry.clashscore_full_length                     2.25
_pdbx_vrpt_summary_geometry.num_H_reduce                               14920
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ                             16620
_pdbx_vrpt_summary_geometry.bonds_RMSZ                                 0.49
_pdbx_vrpt_summary_geometry.num_angles_RMSZ                            22480
_pdbx_vrpt_summary_geometry.angles_RMSZ                                0.37
#
_pdbx_vrpt_summary_nmr.exp_method                               nmr
_pdbx_vrpt_summary_nmr.ordinal                                  1
_pdbx_vrpt_summary_nmr.nmr_models_consistency_flag              True
_pdbx_vrpt_summary_nmr.nmrclust_representative_model            5
_pdbx_vrpt_summary_nmr.medoid_model                             12
_pdbx_vrpt_summary_nmr.nmrclust_number_of_outliers              3
_pdbx_vrpt_summary_nmr.nmrclust_number_of_models                20
_pdbx_vrpt_summary_nmr.nmrclust_number_of_clusters              3
_pdbx_vrpt_summary_nmr.cyrange_number_of_domains                1
_pdbx_vrpt_summary_nmr.chemical_shift_completeness              83.89
_pdbx_vrpt_summary_nmr.chemical_shift_completeness_full_length  78.80
#
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   1  GLU  A   1  .  ?        ?  
   2   1  1  A   2  ASP  A   2  .  ?        ?  
   3   1  1  A   3  PRO  A   3  .  ?        ?  
   4   1  1  A   4  GLU  A   4  .  ?        ?  
   5   1  1  A   5  ASP  A   5  .  ?        ?  
   6   1  1  A   6  PRO  A   6  .  ?        ?  
   7   1  1  A   7  PHE  A   7  .  ?        ?  
   8   1  1  A   8  THR  A   8  .  ?        ?  
   9   1  1  A   9  ARG  A   9  .  ?        1  
  10   1  1  A  10  TYR  A  10  .  ?        ?  
  11   1  1  A  11  ALA  A  11  .  ?        ?  
  12   1  1  A  12  LEU  A  12  .  ?        ?  
  13   1  1  A  13  ALA  A  13  .  ?        ?  
  14   1  1  A  14  GLN  A  14  .  ?        ?  
  15   1  1  A  15  GLU  A  15  .  ?        ?  
  16   1  1  A  16  HIS  A  16  .  ?        ?  
  17   1  1  A  17  LEU  A  17  .  ?        ?  
  18   1  1  A  18  LYS  A  18  .  ?        ?  
  19   1  1  A  19  HIS  A  19  .  ?        ?  
  20   1  1  A  20  ASP  A  20  .  ?        ?  
  21   1  1  A  21  ASN  A  21  .  ?        ?  
  22   1  1  A  22  ALA  A  22  .  ?        ?  
  23   1  1  A  23  SER  A  23  .  ?        ?  
  24   1  1  A  24  ARG  A  24  .  ?        ?  
  25   1  1  A  25  ALA  A  25  .  ?        ?  
  26   1  1  A  26  LEU  A  26  .  ?        ?  
  27   1  1  A  27  ALA  A  27  .  ?        ?  
  28   1  1  A  28  LEU  A  28  .  ?        ?  
  29   1  1  A  29  PHE  A  29  .  ?        ?  
  30   1  1  A  30  GLU  A  30  .  ?        ?  
  31   1  1  A  31  GLU  A  31  .  ?        ?  
  32   1  1  A  32  LEU  A  32  .  ?        1  
  33   1  1  A  33  VAL  A  33  .  ?        ?  
  34   1  1  A  34  GLU  A  34  .  ?        ?  
  35   1  1  A  35  THR  A  35  .  ?        ?  
  36   1  1  A  36  ASP  A  36  .  ?        ?  
  37   1  1  A  37  PRO  A  37  .  ?        ?  
  38   1  1  A  38  ASP  A  38  .  ?        ?  
  39   1  1  A  39  TYR  A  39  .  ?        ?  
  40   1  1  A  40  VAL  A  40  .  ?        ?  
  41   1  1  A  41  GLY  A  41  .  ?        ?  
  42   1  1  A  42  THR  A  42  .  ?        ?  
  43   1  1  A  43  TYR  A  43  .  ?        ?  
  44   1  1  A  44  TYR  A  44  .  ?        1  
  45   1  1  A  45  HIS  A  45  .  ?        ?  
  46   1  1  A  46  LEU  A  46  .  ?        ?  
  47   1  1  A  47  GLY  A  47  .  ?        ?  
  48   1  1  A  48  LYS  A  48  .  ?        2  
  49   1  1  A  49  LEU  A  49  .  ?        ?  
  50   1  1  A  50  TYR  A  50  .  ?        ?  
  51   1  1  A  51  GLU  A  51  .  ?        ?  
  52   1  1  A  52  ARG  A  52  .  ?        ?  
  53   1  1  A  53  LEU  A  53  .  ?        ?  
  54   1  1  A  54  ASP  A  54  .  ?        ?  
  55   1  1  A  55  ARG  A  55  .  ?        ?  
  56   1  1  A  56  THR  A  56  .  ?        ?  
  57   1  1  A  57  ASP  A  57  .  ?        ?  
  58   1  1  A  58  ASP  A  58  .  ?        ?  
  59   1  1  A  59  ALA  A  59  .  ?        ?  
  60   1  1  A  60  ILE  A  60  .  ?        ?  
  61   1  1  A  61  ASP  A  61  .  ?        ?  
  62   1  1  A  62  THR  A  62  .  ?        ?  
  63   1  1  A  63  TYR  A  63  .  ?        1  
  64   1  1  A  64  ALA  A  64  .  ?        ?  
  65   1  1  A  65  GLN  A  65  .  ?        ?  
  66   1  1  A  66  GLY  A  66  .  ?        ?  
  67   1  1  A  67  ILE  A  67  .  ?        ?  
  68   1  1  A  68  GLU  A  68  .  ?        ?  
  69   1  1  A  69  VAL  A  69  .  ?        ?  
  70   1  1  A  70  ALA  A  70  .  ?        ?  
  71   1  1  A  71  ARG  A  71  .  ?        ?  
  72   1  1  A  72  GLU  A  72  .  ?        ?  
  73   1  1  A  73  GLU  A  73  .  ?        ?  
  74   1  1  A  74  GLY  A  74  .  ?        ?  
  75   1  1  A  75  THR  A  75  .  ?        ?  
  76   1  1  A  76  GLN  A  76  .  ?        ?  
  77   1  1  A  77  LYS  A  77  .  ?        ?  
  78   1  1  A  78  ASP  A  78  .  ?        ?  
  79   1  1  A  79  LEU  A  79  .  ?        ?  
  80   1  1  A  80  SER  A  80  .  ?        ?  
  81   1  1  A  81  GLU  A  81  .  ?        ?  
  82   1  1  A  82  LEU  A  82  .  ?        ?  
  83   1  1  A  83  GLN  A  83  .  ?        ?  
  84   1  1  A  84  ASP  A  84  .  ?        ?  
  85   1  1  A  85  ALA  A  85  .  ?        ?  
  86   1  1  A  86  LYS  A  86  .  ?        ?  
  87   1  1  A  87  LEU  A  87  .  ?        ?  
  88   1  1  A  88  LYS  A  88  .  ?        ?  
  89   1  1  A  89  ALA  A  89  .  ?        ?  
  90   1  1  A  90  GLU  A  90  .  ?        ?  
  91   1  1  A  91  GLY  A  91  .  ?        ?  
  92   1  1  A  92  LEU  A  92  .  ?        ?  
  93   1  1  A  93  GLU  A  93  .  ?        ?  
  94   1  1  A  94  HIS  A  94  .  ?        ?  
  95   1  1  A  95  HIS  A  95  .  ?        ?  
  96   1  1  A  96  HIS  A  96  .  ?        ?  
  97   1  1  A  97  HIS  A  97  .  ?        ?  
  98   1  1  A  98  HIS  A  98  .  ?        ?  
  99   1  1  A  99  HIS  A  99  .  ?        ?  
 100   2  1  A   1  GLU  A   1  .  ?        ?  
 101   2  1  A   2  ASP  A   2  .  ?        ?  
 102   2  1  A   3  PRO  A   3  .  ?        ?  
 103   2  1  A   4  GLU  A   4  .  ?        ?  
 104   2  1  A   5  ASP  A   5  .  ?        1  
 105   2  1  A   6  PRO  A   6  .  ?        ?  
 106   2  1  A   7  PHE  A   7  .  ?        ?  
 107   2  1  A   8  THR  A   8  .  ?        ?  
 108   2  1  A   9  ARG  A   9  .  ?        1  
 109   2  1  A  10  TYR  A  10  .  ?        ?  
 110   2  1  A  11  ALA  A  11  .  ?        ?  
 111   2  1  A  12  LEU  A  12  .  ?        ?  
 112   2  1  A  13  ALA  A  13  .  ?        ?  
 113   2  1  A  14  GLN  A  14  .  ?        ?  
 114   2  1  A  15  GLU  A  15  .  ?        ?  
 115   2  1  A  16  HIS  A  16  .  ?        ?  
 116   2  1  A  17  LEU  A  17  .  ?        ?  
 117   2  1  A  18  LYS  A  18  .  ?        ?  
 118   2  1  A  19  HIS  A  19  .  ?        ?  
 119   2  1  A  20  ASP  A  20  .  ?        ?  
 120   2  1  A  21  ASN  A  21  .  ?        ?  
 121   2  1  A  22  ALA  A  22  .  ?        ?  
 122   2  1  A  23  SER  A  23  .  ?        ?  
 123   2  1  A  24  ARG  A  24  .  ?        ?  
 124   2  1  A  25  ALA  A  25  .  ?        ?  
 125   2  1  A  26  LEU  A  26  .  ?        ?  
 126   2  1  A  27  ALA  A  27  .  ?        ?  
 127   2  1  A  28  LEU  A  28  .  ?        ?  
 128   2  1  A  29  PHE  A  29  .  ?        ?  
 129   2  1  A  30  GLU  A  30  .  ?        ?  
 130   2  1  A  31  GLU  A  31  .  ?        ?  
 131   2  1  A  32  LEU  A  32  .  ?        ?  
 132   2  1  A  33  VAL  A  33  .  ?        ?  
 133   2  1  A  34  GLU  A  34  .  ?        ?  
 134   2  1  A  35  THR  A  35  .  ?        ?  
 135   2  1  A  36  ASP  A  36  .  ?        ?  
 136   2  1  A  37  PRO  A  37  .  ?        ?  
 137   2  1  A  38  ASP  A  38  .  ?        ?  
 138   2  1  A  39  TYR  A  39  .  ?        ?  
 139   2  1  A  40  VAL  A  40  .  ?        1  
 140   2  1  A  41  GLY  A  41  .  ?        ?  
 141   2  1  A  42  THR  A  42  .  ?        ?  
 142   2  1  A  43  TYR  A  43  .  ?        ?  
 143   2  1  A  44  TYR  A  44  .  ?        1  
 144   2  1  A  45  HIS  A  45  .  ?        ?  
 145   2  1  A  46  LEU  A  46  .  ?        ?  
 146   2  1  A  47  GLY  A  47  .  ?        ?  
 147   2  1  A  48  LYS  A  48  .  ?        1  
 148   2  1  A  49  LEU  A  49  .  ?        ?  
 149   2  1  A  50  TYR  A  50  .  ?        ?  
 150   2  1  A  51  GLU  A  51  .  ?        ?  
 151   2  1  A  52  ARG  A  52  .  ?        ?  
 152   2  1  A  53  LEU  A  53  .  ?        ?  
 153   2  1  A  54  ASP  A  54  .  ?        ?  
 154   2  1  A  55  ARG  A  55  .  ?        ?  
 155   2  1  A  56  THR  A  56  .  ?        ?  
 156   2  1  A  57  ASP  A  57  .  ?        ?  
 157   2  1  A  58  ASP  A  58  .  ?        ?  
 158   2  1  A  59  ALA  A  59  .  ?        ?  
 159   2  1  A  60  ILE  A  60  .  ?        ?  
 160   2  1  A  61  ASP  A  61  .  ?        ?  
 161   2  1  A  62  THR  A  62  .  ?        ?  
 162   2  1  A  63  TYR  A  63  .  ?        ?  
 163   2  1  A  64  ALA  A  64  .  ?        ?  
 164   2  1  A  65  GLN  A  65  .  ?        ?  
 165   2  1  A  66  GLY  A  66  .  ?        ?  
 166   2  1  A  67  ILE  A  67  .  ?        1  
 167   2  1  A  68  GLU  A  68  .  ?        ?  
 168   2  1  A  69  VAL  A  69  .  ?        ?  
 169   2  1  A  70  ALA  A  70  .  ?        ?  
 170   2  1  A  71  ARG  A  71  .  ?        ?  
 171   2  1  A  72  GLU  A  72  .  ?        ?  
 172   2  1  A  73  GLU  A  73  .  ?        ?  
 173   2  1  A  74  GLY  A  74  .  ?        ?  
 174   2  1  A  75  THR  A  75  .  ?        ?  
 175   2  1  A  76  GLN  A  76  .  ?        1  
 176   2  1  A  77  LYS  A  77  .  ?        ?  
 177   2  1  A  78  ASP  A  78  .  ?        1  
 178   2  1  A  79  LEU  A  79  .  ?        2  
 179   2  1  A  80  SER  A  80  .  ?        ?  
 180   2  1  A  81  GLU  A  81  .  ?        ?  
 181   2  1  A  82  LEU  A  82  .  ?        ?  
 182   2  1  A  83  GLN  A  83  .  ?        ?  
 183   2  1  A  84  ASP  A  84  .  ?        ?  
 184   2  1  A  85  ALA  A  85  .  ?        ?  
 185   2  1  A  86  LYS  A  86  .  ?        ?  
 186   2  1  A  87  LEU  A  87  .  ?        ?  
 187   2  1  A  88  LYS  A  88  .  ?        ?  
 188   2  1  A  89  ALA  A  89  .  ?        ?  
 189   2  1  A  90  GLU  A  90  .  ?        ?  
 190   2  1  A  91  GLY  A  91  .  ?        ?  
 191   2  1  A  92  LEU  A  92  .  ?        ?  
 192   2  1  A  93  GLU  A  93  .  ?        ?  
 193   2  1  A  94  HIS  A  94  .  ?        ?  
 194   2  1  A  95  HIS  A  95  .  ?        ?  
 195   2  1  A  96  HIS  A  96  .  ?        ?  
 196   2  1  A  97  HIS  A  97  .  ?        ?  
 197   2  1  A  98  HIS  A  98  .  ?        ?  
 198   2  1  A  99  HIS  A  99  .  ?        ?  
 199   3  1  A   1  GLU  A   1  .  ?        ?  
 200   3  1  A   2  ASP  A   2  .  ?        ?  
 201   3  1  A   3  PRO  A   3  .  ?        ?  
 202   3  1  A   4  GLU  A   4  .  ?        ?  
 203   3  1  A   5  ASP  A   5  .  ?        ?  
 204   3  1  A   6  PRO  A   6  .  ?        ?  
 205   3  1  A   7  PHE  A   7  .  ?        ?  
 206   3  1  A   8  THR  A   8  .  ?        ?  
 207   3  1  A   9  ARG  A   9  .  ?        ?  
 208   3  1  A  10  TYR  A  10  .  ?        ?  
 209   3  1  A  11  ALA  A  11  .  ?        ?  
 210   3  1  A  12  LEU  A  12  .  ?        ?  
 211   3  1  A  13  ALA  A  13  .  ?        ?  
 212   3  1  A  14  GLN  A  14  .  ?        ?  
 213   3  1  A  15  GLU  A  15  .  ?        ?  
 214   3  1  A  16  HIS  A  16  .  ?        ?  
 215   3  1  A  17  LEU  A  17  .  ?        ?  
 216   3  1  A  18  LYS  A  18  .  ?        ?  
 217   3  1  A  19  HIS  A  19  .  ?        ?  
 218   3  1  A  20  ASP  A  20  .  ?        ?  
 219   3  1  A  21  ASN  A  21  .  ?        ?  
 220   3  1  A  22  ALA  A  22  .  ?        ?  
 221   3  1  A  23  SER  A  23  .  ?        ?  
 222   3  1  A  24  ARG  A  24  .  ?        ?  
 223   3  1  A  25  ALA  A  25  .  ?        ?  
 224   3  1  A  26  LEU  A  26  .  ?        ?  
 225   3  1  A  27  ALA  A  27  .  ?        ?  
 226   3  1  A  28  LEU  A  28  .  ?        ?  
 227   3  1  A  29  PHE  A  29  .  ?        ?  
 228   3  1  A  30  GLU  A  30  .  ?        ?  
 229   3  1  A  31  GLU  A  31  .  ?        ?  
 230   3  1  A  32  LEU  A  32  .  ?        ?  
 231   3  1  A  33  VAL  A  33  .  ?        ?  
 232   3  1  A  34  GLU  A  34  .  ?        ?  
 233   3  1  A  35  THR  A  35  .  ?        ?  
 234   3  1  A  36  ASP  A  36  .  ?        ?  
 235   3  1  A  37  PRO  A  37  .  ?        ?  
 236   3  1  A  38  ASP  A  38  .  ?        ?  
 237   3  1  A  39  TYR  A  39  .  ?        ?  
 238   3  1  A  40  VAL  A  40  .  ?        ?  
 239   3  1  A  41  GLY  A  41  .  ?        ?  
 240   3  1  A  42  THR  A  42  .  ?        ?  
 241   3  1  A  43  TYR  A  43  .  ?        ?  
 242   3  1  A  44  TYR  A  44  .  ?        ?  
 243   3  1  A  45  HIS  A  45  .  ?        ?  
 244   3  1  A  46  LEU  A  46  .  ?        ?  
 245   3  1  A  47  GLY  A  47  .  ?        ?  
 246   3  1  A  48  LYS  A  48  .  ?        ?  
 247   3  1  A  49  LEU  A  49  .  ?        ?  
 248   3  1  A  50  TYR  A  50  .  ?        ?  
 249   3  1  A  51  GLU  A  51  .  ?        ?  
 250   3  1  A  52  ARG  A  52  .  ?        ?  
 251   3  1  A  53  LEU  A  53  .  ?        ?  
 252   3  1  A  54  ASP  A  54  .  ?        ?  
 253   3  1  A  55  ARG  A  55  .  ?        ?  
 254   3  1  A  56  THR  A  56  .  ?        ?  
 255   3  1  A  57  ASP  A  57  .  ?        ?  
 256   3  1  A  58  ASP  A  58  .  ?        ?  
 257   3  1  A  59  ALA  A  59  .  ?        ?  
 258   3  1  A  60  ILE  A  60  .  ?        ?  
 259   3  1  A  61  ASP  A  61  .  ?        ?  
 260   3  1  A  62  THR  A  62  .  ?        ?  
 261   3  1  A  63  TYR  A  63  .  ?        ?  
 262   3  1  A  64  ALA  A  64  .  ?        ?  
 263   3  1  A  65  GLN  A  65  .  ?        ?  
 264   3  1  A  66  GLY  A  66  .  ?        ?  
 265   3  1  A  67  ILE  A  67  .  ?        1  
 266   3  1  A  68  GLU  A  68  .  ?        ?  
 267   3  1  A  69  VAL  A  69  .  ?        ?  
 268   3  1  A  70  ALA  A  70  .  ?        ?  
 269   3  1  A  71  ARG  A  71  .  ?        2  
 270   3  1  A  72  GLU  A  72  .  ?        ?  
 271   3  1  A  73  GLU  A  73  .  ?        ?  
 272   3  1  A  74  GLY  A  74  .  ?        ?  
 273   3  1  A  75  THR  A  75  .  ?        ?  
 274   3  1  A  76  GLN  A  76  .  ?        ?  
 275   3  1  A  77  LYS  A  77  .  ?        ?  
 276   3  1  A  78  ASP  A  78  .  ?        ?  
 277   3  1  A  79  LEU  A  79  .  ?        1  
 278   3  1  A  80  SER  A  80  .  ?        ?  
 279   3  1  A  81  GLU  A  81  .  ?        ?  
 280   3  1  A  82  LEU  A  82  .  ?        ?  
 281   3  1  A  83  GLN  A  83  .  ?        ?  
 282   3  1  A  84  ASP  A  84  .  ?        ?  
 283   3  1  A  85  ALA  A  85  .  ?        ?  
 284   3  1  A  86  LYS  A  86  .  ?        ?  
 285   3  1  A  87  LEU  A  87  .  ?        ?  
 286   3  1  A  88  LYS  A  88  .  ?        1  
 287   3  1  A  89  ALA  A  89  .  ?        ?  
 288   3  1  A  90  GLU  A  90  .  ?        ?  
 289   3  1  A  91  GLY  A  91  .  ?        ?  
 290   3  1  A  92  LEU  A  92  .  ?        1  
 291   3  1  A  93  GLU  A  93  .  ?        ?  
 292   3  1  A  94  HIS  A  94  .  ?        ?  
 293   3  1  A  95  HIS  A  95  .  ?        ?  
 294   3  1  A  96  HIS  A  96  .  ?        ?  
 295   3  1  A  97  HIS  A  97  .  ?        ?  
 296   3  1  A  98  HIS  A  98  .  ?        ?  
 297   3  1  A  99  HIS  A  99  .  ?        ?  
 298   4  1  A   1  GLU  A   1  .  ?        ?  
 299   4  1  A   2  ASP  A   2  .  ?        ?  
 300   4  1  A   3  PRO  A   3  .  ?        ?  
 301   4  1  A   4  GLU  A   4  .  ?        ?  
 302   4  1  A   5  ASP  A   5  .  ?        ?  
 303   4  1  A   6  PRO  A   6  .  ?        ?  
 304   4  1  A   7  PHE  A   7  .  ?        ?  
 305   4  1  A   8  THR  A   8  .  ?        ?  
 306   4  1  A   9  ARG  A   9  .  ?        ?  
 307   4  1  A  10  TYR  A  10  .  ?        ?  
 308   4  1  A  11  ALA  A  11  .  ?        ?  
 309   4  1  A  12  LEU  A  12  .  ?        ?  
 310   4  1  A  13  ALA  A  13  .  ?        ?  
 311   4  1  A  14  GLN  A  14  .  ?        ?  
 312   4  1  A  15  GLU  A  15  .  ?        ?  
 313   4  1  A  16  HIS  A  16  .  ?        ?  
 314   4  1  A  17  LEU  A  17  .  ?        ?  
 315   4  1  A  18  LYS  A  18  .  ?        ?  
 316   4  1  A  19  HIS  A  19  .  ?        ?  
 317   4  1  A  20  ASP  A  20  .  ?        ?  
 318   4  1  A  21  ASN  A  21  .  ?        ?  
 319   4  1  A  22  ALA  A  22  .  ?        ?  
 320   4  1  A  23  SER  A  23  .  ?        ?  
 321   4  1  A  24  ARG  A  24  .  ?        ?  
 322   4  1  A  25  ALA  A  25  .  ?        ?  
 323   4  1  A  26  LEU  A  26  .  ?        ?  
 324   4  1  A  27  ALA  A  27  .  ?        ?  
 325   4  1  A  28  LEU  A  28  .  ?        1  
 326   4  1  A  29  PHE  A  29  .  ?        ?  
 327   4  1  A  30  GLU  A  30  .  ?        ?  
 328   4  1  A  31  GLU  A  31  .  ?        ?  
 329   4  1  A  32  LEU  A  32  .  ?        1  
 330   4  1  A  33  VAL  A  33  .  ?        ?  
 331   4  1  A  34  GLU  A  34  .  ?        ?  
 332   4  1  A  35  THR  A  35  .  ?        ?  
 333   4  1  A  36  ASP  A  36  .  ?        ?  
 334   4  1  A  37  PRO  A  37  .  ?        ?  
 335   4  1  A  38  ASP  A  38  .  ?        ?  
 336   4  1  A  39  TYR  A  39  .  ?        ?  
 337   4  1  A  40  VAL  A  40  .  ?        1  
 338   4  1  A  41  GLY  A  41  .  ?        ?  
 339   4  1  A  42  THR  A  42  .  ?        ?  
 340   4  1  A  43  TYR  A  43  .  ?        ?  
 341   4  1  A  44  TYR  A  44  .  ?        1  
 342   4  1  A  45  HIS  A  45  .  ?        ?  
 343   4  1  A  46  LEU  A  46  .  ?        ?  
 344   4  1  A  47  GLY  A  47  .  ?        ?  
 345   4  1  A  48  LYS  A  48  .  ?        2  
 346   4  1  A  49  LEU  A  49  .  ?        ?  
 347   4  1  A  50  TYR  A  50  .  ?        ?  
 348   4  1  A  51  GLU  A  51  .  ?        ?  
 349   4  1  A  52  ARG  A  52  .  ?        ?  
 350   4  1  A  53  LEU  A  53  .  ?        ?  
 351   4  1  A  54  ASP  A  54  .  ?        ?  
 352   4  1  A  55  ARG  A  55  .  ?        ?  
 353   4  1  A  56  THR  A  56  .  ?        ?  
 354   4  1  A  57  ASP  A  57  .  ?        ?  
 355   4  1  A  58  ASP  A  58  .  ?        ?  
 356   4  1  A  59  ALA  A  59  .  ?        ?  
 357   4  1  A  60  ILE  A  60  .  ?        ?  
 358   4  1  A  61  ASP  A  61  .  ?        ?  
 359   4  1  A  62  THR  A  62  .  ?        ?  
 360   4  1  A  63  TYR  A  63  .  ?        1  
 361   4  1  A  64  ALA  A  64  .  ?        ?  
 362   4  1  A  65  GLN  A  65  .  ?        ?  
 363   4  1  A  66  GLY  A  66  .  ?        ?  
 364   4  1  A  67  ILE  A  67  .  ?        ?  
 365   4  1  A  68  GLU  A  68  .  ?        ?  
 366   4  1  A  69  VAL  A  69  .  ?        ?  
 367   4  1  A  70  ALA  A  70  .  ?        ?  
 368   4  1  A  71  ARG  A  71  .  ?        1  
 369   4  1  A  72  GLU  A  72  .  ?        ?  
 370   4  1  A  73  GLU  A  73  .  ?        ?  
 371   4  1  A  74  GLY  A  74  .  ?        ?  
 372   4  1  A  75  THR  A  75  .  ?        ?  
 373   4  1  A  76  GLN  A  76  .  ?        ?  
 374   4  1  A  77  LYS  A  77  .  ?        1  
 375   4  1  A  78  ASP  A  78  .  ?        1  
 376   4  1  A  79  LEU  A  79  .  ?        1  
 377   4  1  A  80  SER  A  80  .  ?        ?  
 378   4  1  A  81  GLU  A  81  .  ?        1  
 379   4  1  A  82  LEU  A  82  .  ?        ?  
 380   4  1  A  83  GLN  A  83  .  ?        ?  
 381   4  1  A  84  ASP  A  84  .  ?        ?  
 382   4  1  A  85  ALA  A  85  .  ?        ?  
 383   4  1  A  86  LYS  A  86  .  ?        ?  
 384   4  1  A  87  LEU  A  87  .  ?        ?  
 385   4  1  A  88  LYS  A  88  .  ?        ?  
 386   4  1  A  89  ALA  A  89  .  ?        ?  
 387   4  1  A  90  GLU  A  90  .  ?        ?  
 388   4  1  A  91  GLY  A  91  .  ?        ?  
 389   4  1  A  92  LEU  A  92  .  ?        ?  
 390   4  1  A  93  GLU  A  93  .  ?        ?  
 391   4  1  A  94  HIS  A  94  .  ?        ?  
 392   4  1  A  95  HIS  A  95  .  ?        ?  
 393   4  1  A  96  HIS  A  96  .  ?        ?  
 394   4  1  A  97  HIS  A  97  .  ?        ?  
 395   4  1  A  98  HIS  A  98  .  ?        ?  
 396   4  1  A  99  HIS  A  99  .  ?        ?  
 397   5  1  A   1  GLU  A   1  .  ?        ?  
 398   5  1  A   2  ASP  A   2  .  ?        ?  
 399   5  1  A   3  PRO  A   3  .  ?        ?  
 400   5  1  A   4  GLU  A   4  .  ?        ?  
 401   5  1  A   5  ASP  A   5  .  ?        1  
 402   5  1  A   6  PRO  A   6  .  ?        ?  
 403   5  1  A   7  PHE  A   7  .  ?        ?  
 404   5  1  A   8  THR  A   8  .  ?        ?  
 405   5  1  A   9  ARG  A   9  .  ?        2  
 406   5  1  A  10  TYR  A  10  .  ?        ?  
 407   5  1  A  11  ALA  A  11  .  ?        ?  
 408   5  1  A  12  LEU  A  12  .  ?        ?  
 409   5  1  A  13  ALA  A  13  .  ?        ?  
 410   5  1  A  14  GLN  A  14  .  ?        ?  
 411   5  1  A  15  GLU  A  15  .  ?        ?  
 412   5  1  A  16  HIS  A  16  .  ?        1  
 413   5  1  A  17  LEU  A  17  .  ?        ?  
 414   5  1  A  18  LYS  A  18  .  ?        ?  
 415   5  1  A  19  HIS  A  19  .  ?        ?  
 416   5  1  A  20  ASP  A  20  .  ?        ?  
 417   5  1  A  21  ASN  A  21  .  ?        2  
 418   5  1  A  22  ALA  A  22  .  ?        ?  
 419   5  1  A  23  SER  A  23  .  ?        ?  
 420   5  1  A  24  ARG  A  24  .  ?        1  
 421   5  1  A  25  ALA  A  25  .  ?        ?  
 422   5  1  A  26  LEU  A  26  .  ?        ?  
 423   5  1  A  27  ALA  A  27  .  ?        ?  
 424   5  1  A  28  LEU  A  28  .  ?        1  
 425   5  1  A  29  PHE  A  29  .  ?        ?  
 426   5  1  A  30  GLU  A  30  .  ?        ?  
 427   5  1  A  31  GLU  A  31  .  ?        1  
 428   5  1  A  32  LEU  A  32  .  ?        1  
 429   5  1  A  33  VAL  A  33  .  ?        ?  
 430   5  1  A  34  GLU  A  34  .  ?        ?  
 431   5  1  A  35  THR  A  35  .  ?        ?  
 432   5  1  A  36  ASP  A  36  .  ?        ?  
 433   5  1  A  37  PRO  A  37  .  ?        ?  
 434   5  1  A  38  ASP  A  38  .  ?        ?  
 435   5  1  A  39  TYR  A  39  .  ?        ?  
 436   5  1  A  40  VAL  A  40  .  ?        ?  
 437   5  1  A  41  GLY  A  41  .  ?        ?  
 438   5  1  A  42  THR  A  42  .  ?        ?  
 439   5  1  A  43  TYR  A  43  .  ?        ?  
 440   5  1  A  44  TYR  A  44  .  ?        ?  
 441   5  1  A  45  HIS  A  45  .  ?        ?  
 442   5  1  A  46  LEU  A  46  .  ?        ?  
 443   5  1  A  47  GLY  A  47  .  ?        ?  
 444   5  1  A  48  LYS  A  48  .  ?        ?  
 445   5  1  A  49  LEU  A  49  .  ?        ?  
 446   5  1  A  50  TYR  A  50  .  ?        ?  
 447   5  1  A  51  GLU  A  51  .  ?        ?  
 448   5  1  A  52  ARG  A  52  .  ?        ?  
 449   5  1  A  53  LEU  A  53  .  ?        ?  
 450   5  1  A  54  ASP  A  54  .  ?        ?  
 451   5  1  A  55  ARG  A  55  .  ?        ?  
 452   5  1  A  56  THR  A  56  .  ?        ?  
 453   5  1  A  57  ASP  A  57  .  ?        ?  
 454   5  1  A  58  ASP  A  58  .  ?        ?  
 455   5  1  A  59  ALA  A  59  .  ?        ?  
 456   5  1  A  60  ILE  A  60  .  ?        ?  
 457   5  1  A  61  ASP  A  61  .  ?        ?  
 458   5  1  A  62  THR  A  62  .  ?        ?  
 459   5  1  A  63  TYR  A  63  .  ?        1  
 460   5  1  A  64  ALA  A  64  .  ?        ?  
 461   5  1  A  65  GLN  A  65  .  ?        ?  
 462   5  1  A  66  GLY  A  66  .  ?        ?  
 463   5  1  A  67  ILE  A  67  .  ?        1  
 464   5  1  A  68  GLU  A  68  .  ?        ?  
 465   5  1  A  69  VAL  A  69  .  ?        ?  
 466   5  1  A  70  ALA  A  70  .  ?        ?  
 467   5  1  A  71  ARG  A  71  .  ?        ?  
 468   5  1  A  72  GLU  A  72  .  ?        ?  
 469   5  1  A  73  GLU  A  73  .  ?        ?  
 470   5  1  A  74  GLY  A  74  .  ?        ?  
 471   5  1  A  75  THR  A  75  .  ?        ?  
 472   5  1  A  76  GLN  A  76  .  ?        ?  
 473   5  1  A  77  LYS  A  77  .  ?        ?  
 474   5  1  A  78  ASP  A  78  .  ?        ?  
 475   5  1  A  79  LEU  A  79  .  ?        ?  
 476   5  1  A  80  SER  A  80  .  ?        ?  
 477   5  1  A  81  GLU  A  81  .  ?        ?  
 478   5  1  A  82  LEU  A  82  .  ?        ?  
 479   5  1  A  83  GLN  A  83  .  ?        ?  
 480   5  1  A  84  ASP  A  84  .  ?        ?  
 481   5  1  A  85  ALA  A  85  .  ?        ?  
 482   5  1  A  86  LYS  A  86  .  ?        ?  
 483   5  1  A  87  LEU  A  87  .  ?        ?  
 484   5  1  A  88  LYS  A  88  .  ?        ?  
 485   5  1  A  89  ALA  A  89  .  ?        ?  
 486   5  1  A  90  GLU  A  90  .  ?        ?  
 487   5  1  A  91  GLY  A  91  .  ?        ?  
 488   5  1  A  92  LEU  A  92  .  ?        ?  
 489   5  1  A  93  GLU  A  93  .  ?        ?  
 490   5  1  A  94  HIS  A  94  .  ?        ?  
 491   5  1  A  95  HIS  A  95  .  ?        ?  
 492   5  1  A  96  HIS  A  96  .  ?        ?  
 493   5  1  A  97  HIS  A  97  .  ?        ?  
 494   5  1  A  98  HIS  A  98  .  ?        ?  
 495   5  1  A  99  HIS  A  99  .  ?        ?  
 496   6  1  A   1  GLU  A   1  .  ?        ?  
 497   6  1  A   2  ASP  A   2  .  ?        ?  
 498   6  1  A   3  PRO  A   3  .  ?        ?  
 499   6  1  A   4  GLU  A   4  .  ?        ?  
 500   6  1  A   5  ASP  A   5  .  ?        ?  
 501   6  1  A   6  PRO  A   6  .  ?        ?  
 502   6  1  A   7  PHE  A   7  .  ?        ?  
 503   6  1  A   8  THR  A   8  .  ?        ?  
 504   6  1  A   9  ARG  A   9  .  ?        ?  
 505   6  1  A  10  TYR  A  10  .  ?        ?  
 506   6  1  A  11  ALA  A  11  .  ?        ?  
 507   6  1  A  12  LEU  A  12  .  ?        ?  
 508   6  1  A  13  ALA  A  13  .  ?        ?  
 509   6  1  A  14  GLN  A  14  .  ?        ?  
 510   6  1  A  15  GLU  A  15  .  ?        ?  
 511   6  1  A  16  HIS  A  16  .  ?        ?  
 512   6  1  A  17  LEU  A  17  .  ?        ?  
 513   6  1  A  18  LYS  A  18  .  ?        ?  
 514   6  1  A  19  HIS  A  19  .  ?        ?  
 515   6  1  A  20  ASP  A  20  .  ?        ?  
 516   6  1  A  21  ASN  A  21  .  ?        ?  
 517   6  1  A  22  ALA  A  22  .  ?        ?  
 518   6  1  A  23  SER  A  23  .  ?        ?  
 519   6  1  A  24  ARG  A  24  .  ?        ?  
 520   6  1  A  25  ALA  A  25  .  ?        ?  
 521   6  1  A  26  LEU  A  26  .  ?        ?  
 522   6  1  A  27  ALA  A  27  .  ?        ?  
 523   6  1  A  28  LEU  A  28  .  ?        ?  
 524   6  1  A  29  PHE  A  29  .  ?        ?  
 525   6  1  A  30  GLU  A  30  .  ?        ?  
 526   6  1  A  31  GLU  A  31  .  ?        ?  
 527   6  1  A  32  LEU  A  32  .  ?        ?  
 528   6  1  A  33  VAL  A  33  .  ?        ?  
 529   6  1  A  34  GLU  A  34  .  ?        ?  
 530   6  1  A  35  THR  A  35  .  ?        ?  
 531   6  1  A  36  ASP  A  36  .  ?        ?  
 532   6  1  A  37  PRO  A  37  .  ?        ?  
 533   6  1  A  38  ASP  A  38  .  ?        ?  
 534   6  1  A  39  TYR  A  39  .  ?        ?  
 535   6  1  A  40  VAL  A  40  .  ?        ?  
 536   6  1  A  41  GLY  A  41  .  ?        ?  
 537   6  1  A  42  THR  A  42  .  ?        ?  
 538   6  1  A  43  TYR  A  43  .  ?        ?  
 539   6  1  A  44  TYR  A  44  .  ?        1  
 540   6  1  A  45  HIS  A  45  .  ?        ?  
 541   6  1  A  46  LEU  A  46  .  ?        ?  
 542   6  1  A  47  GLY  A  47  .  ?        ?  
 543   6  1  A  48  LYS  A  48  .  ?        1  
 544   6  1  A  49  LEU  A  49  .  ?        ?  
 545   6  1  A  50  TYR  A  50  .  ?        ?  
 546   6  1  A  51  GLU  A  51  .  ?        ?  
 547   6  1  A  52  ARG  A  52  .  ?        ?  
 548   6  1  A  53  LEU  A  53  .  ?        ?  
 549   6  1  A  54  ASP  A  54  .  ?        ?  
 550   6  1  A  55  ARG  A  55  .  ?        ?  
 551   6  1  A  56  THR  A  56  .  ?        ?  
 552   6  1  A  57  ASP  A  57  .  ?        ?  
 553   6  1  A  58  ASP  A  58  .  ?        ?  
 554   6  1  A  59  ALA  A  59  .  ?        ?  
 555   6  1  A  60  ILE  A  60  .  ?        ?  
 556   6  1  A  61  ASP  A  61  .  ?        ?  
 557   6  1  A  62  THR  A  62  .  ?        ?  
 558   6  1  A  63  TYR  A  63  .  ?        ?  
 559   6  1  A  64  ALA  A  64  .  ?        ?  
 560   6  1  A  65  GLN  A  65  .  ?        ?  
 561   6  1  A  66  GLY  A  66  .  ?        ?  
 562   6  1  A  67  ILE  A  67  .  ?        ?  
 563   6  1  A  68  GLU  A  68  .  ?        1  
 564   6  1  A  69  VAL  A  69  .  ?        ?  
 565   6  1  A  70  ALA  A  70  .  ?        ?  
 566   6  1  A  71  ARG  A  71  .  ?        ?  
 567   6  1  A  72  GLU  A  72  .  ?        1  
 568   6  1  A  73  GLU  A  73  .  ?        ?  
 569   6  1  A  74  GLY  A  74  .  ?        ?  
 570   6  1  A  75  THR  A  75  .  ?        ?  
 571   6  1  A  76  GLN  A  76  .  ?        ?  
 572   6  1  A  77  LYS  A  77  .  ?        ?  
 573   6  1  A  78  ASP  A  78  .  ?        ?  
 574   6  1  A  79  LEU  A  79  .  ?        ?  
 575   6  1  A  80  SER  A  80  .  ?        ?  
 576   6  1  A  81  GLU  A  81  .  ?        ?  
 577   6  1  A  82  LEU  A  82  .  ?        ?  
 578   6  1  A  83  GLN  A  83  .  ?        ?  
 579   6  1  A  84  ASP  A  84  .  ?        ?  
 580   6  1  A  85  ALA  A  85  .  ?        ?  
 581   6  1  A  86  LYS  A  86  .  ?        ?  
 582   6  1  A  87  LEU  A  87  .  ?        ?  
 583   6  1  A  88  LYS  A  88  .  ?        ?  
 584   6  1  A  89  ALA  A  89  .  ?        ?  
 585   6  1  A  90  GLU  A  90  .  ?        ?  
 586   6  1  A  91  GLY  A  91  .  ?        ?  
 587   6  1  A  92  LEU  A  92  .  ?        ?  
 588   6  1  A  93  GLU  A  93  .  ?        ?  
 589   6  1  A  94  HIS  A  94  .  ?        ?  
 590   6  1  A  95  HIS  A  95  .  ?        ?  
 591   6  1  A  96  HIS  A  96  .  ?        ?  
 592   6  1  A  97  HIS  A  97  .  ?        ?  
 593   6  1  A  98  HIS  A  98  .  ?        ?  
 594   6  1  A  99  HIS  A  99  .  ?        ?  
 595   7  1  A   1  GLU  A   1  .  ?        ?  
 596   7  1  A   2  ASP  A   2  .  ?        ?  
 597   7  1  A   3  PRO  A   3  .  ?        ?  
 598   7  1  A   4  GLU  A   4  .  ?        ?  
 599   7  1  A   5  ASP  A   5  .  ?        ?  
 600   7  1  A   6  PRO  A   6  .  ?        ?  
 601   7  1  A   7  PHE  A   7  .  ?        ?  
 602   7  1  A   8  THR  A   8  .  ?        ?  
 603   7  1  A   9  ARG  A   9  .  ?        1  
 604   7  1  A  10  TYR  A  10  .  ?        ?  
 605   7  1  A  11  ALA  A  11  .  ?        ?  
 606   7  1  A  12  LEU  A  12  .  ?        ?  
 607   7  1  A  13  ALA  A  13  .  ?        ?  
 608   7  1  A  14  GLN  A  14  .  ?        ?  
 609   7  1  A  15  GLU  A  15  .  ?        ?  
 610   7  1  A  16  HIS  A  16  .  ?        ?  
 611   7  1  A  17  LEU  A  17  .  ?        ?  
 612   7  1  A  18  LYS  A  18  .  ?        ?  
 613   7  1  A  19  HIS  A  19  .  ?        ?  
 614   7  1  A  20  ASP  A  20  .  ?        ?  
 615   7  1  A  21  ASN  A  21  .  ?        ?  
 616   7  1  A  22  ALA  A  22  .  ?        ?  
 617   7  1  A  23  SER  A  23  .  ?        ?  
 618   7  1  A  24  ARG  A  24  .  ?        ?  
 619   7  1  A  25  ALA  A  25  .  ?        ?  
 620   7  1  A  26  LEU  A  26  .  ?        ?  
 621   7  1  A  27  ALA  A  27  .  ?        ?  
 622   7  1  A  28  LEU  A  28  .  ?        ?  
 623   7  1  A  29  PHE  A  29  .  ?        ?  
 624   7  1  A  30  GLU  A  30  .  ?        ?  
 625   7  1  A  31  GLU  A  31  .  ?        1  
 626   7  1  A  32  LEU  A  32  .  ?        ?  
 627   7  1  A  33  VAL  A  33  .  ?        ?  
 628   7  1  A  34  GLU  A  34  .  ?        ?  
 629   7  1  A  35  THR  A  35  .  ?        ?  
 630   7  1  A  36  ASP  A  36  .  ?        ?  
 631   7  1  A  37  PRO  A  37  .  ?        ?  
 632   7  1  A  38  ASP  A  38  .  ?        ?  
 633   7  1  A  39  TYR  A  39  .  ?        ?  
 634   7  1  A  40  VAL  A  40  .  ?        ?  
 635   7  1  A  41  GLY  A  41  .  ?        ?  
 636   7  1  A  42  THR  A  42  .  ?        ?  
 637   7  1  A  43  TYR  A  43  .  ?        ?  
 638   7  1  A  44  TYR  A  44  .  ?        ?  
 639   7  1  A  45  HIS  A  45  .  ?        ?  
 640   7  1  A  46  LEU  A  46  .  ?        ?  
 641   7  1  A  47  GLY  A  47  .  ?        ?  
 642   7  1  A  48  LYS  A  48  .  ?        ?  
 643   7  1  A  49  LEU  A  49  .  ?        ?  
 644   7  1  A  50  TYR  A  50  .  ?        ?  
 645   7  1  A  51  GLU  A  51  .  ?        ?  
 646   7  1  A  52  ARG  A  52  .  ?        ?  
 647   7  1  A  53  LEU  A  53  .  ?        ?  
 648   7  1  A  54  ASP  A  54  .  ?        ?  
 649   7  1  A  55  ARG  A  55  .  ?        ?  
 650   7  1  A  56  THR  A  56  .  ?        ?  
 651   7  1  A  57  ASP  A  57  .  ?        ?  
 652   7  1  A  58  ASP  A  58  .  ?        ?  
 653   7  1  A  59  ALA  A  59  .  ?        ?  
 654   7  1  A  60  ILE  A  60  .  ?        ?  
 655   7  1  A  61  ASP  A  61  .  ?        ?  
 656   7  1  A  62  THR  A  62  .  ?        ?  
 657   7  1  A  63  TYR  A  63  .  ?        ?  
 658   7  1  A  64  ALA  A  64  .  ?        ?  
 659   7  1  A  65  GLN  A  65  .  ?        ?  
 660   7  1  A  66  GLY  A  66  .  ?        ?  
 661   7  1  A  67  ILE  A  67  .  ?        ?  
 662   7  1  A  68  GLU  A  68  .  ?        ?  
 663   7  1  A  69  VAL  A  69  .  ?        ?  
 664   7  1  A  70  ALA  A  70  .  ?        ?  
 665   7  1  A  71  ARG  A  71  .  ?        ?  
 666   7  1  A  72  GLU  A  72  .  ?        ?  
 667   7  1  A  73  GLU  A  73  .  ?        ?  
 668   7  1  A  74  GLY  A  74  .  ?        ?  
 669   7  1  A  75  THR  A  75  .  ?        ?  
 670   7  1  A  76  GLN  A  76  .  ?        ?  
 671   7  1  A  77  LYS  A  77  .  ?        ?  
 672   7  1  A  78  ASP  A  78  .  ?        ?  
 673   7  1  A  79  LEU  A  79  .  ?        ?  
 674   7  1  A  80  SER  A  80  .  ?        ?  
 675   7  1  A  81  GLU  A  81  .  ?        ?  
 676   7  1  A  82  LEU  A  82  .  ?        ?  
 677   7  1  A  83  GLN  A  83  .  ?        ?  
 678   7  1  A  84  ASP  A  84  .  ?        ?  
 679   7  1  A  85  ALA  A  85  .  ?        ?  
 680   7  1  A  86  LYS  A  86  .  ?        ?  
 681   7  1  A  87  LEU  A  87  .  ?        ?  
 682   7  1  A  88  LYS  A  88  .  ?        ?  
 683   7  1  A  89  ALA  A  89  .  ?        ?  
 684   7  1  A  90  GLU  A  90  .  ?        ?  
 685   7  1  A  91  GLY  A  91  .  ?        ?  
 686   7  1  A  92  LEU  A  92  .  ?        ?  
 687   7  1  A  93  GLU  A  93  .  ?        ?  
 688   7  1  A  94  HIS  A  94  .  ?        ?  
 689   7  1  A  95  HIS  A  95  .  ?        ?  
 690   7  1  A  96  HIS  A  96  .  ?        ?  
 691   7  1  A  97  HIS  A  97  .  ?        ?  
 692   7  1  A  98  HIS  A  98  .  ?        ?  
 693   7  1  A  99  HIS  A  99  .  ?        ?  
 694   8  1  A   1  GLU  A   1  .  ?        ?  
 695   8  1  A   2  ASP  A   2  .  ?        ?  
 696   8  1  A   3  PRO  A   3  .  ?        ?  
 697   8  1  A   4  GLU  A   4  .  ?        ?  
 698   8  1  A   5  ASP  A   5  .  ?        ?  
 699   8  1  A   6  PRO  A   6  .  ?        ?  
 700   8  1  A   7  PHE  A   7  .  ?        ?  
 701   8  1  A   8  THR  A   8  .  ?        ?  
 702   8  1  A   9  ARG  A   9  .  ?        ?  
 703   8  1  A  10  TYR  A  10  .  ?        ?  
 704   8  1  A  11  ALA  A  11  .  ?        ?  
 705   8  1  A  12  LEU  A  12  .  ?        ?  
 706   8  1  A  13  ALA  A  13  .  ?        ?  
 707   8  1  A  14  GLN  A  14  .  ?        ?  
 708   8  1  A  15  GLU  A  15  .  ?        ?  
 709   8  1  A  16  HIS  A  16  .  ?        ?  
 710   8  1  A  17  LEU  A  17  .  ?        ?  
 711   8  1  A  18  LYS  A  18  .  ?        ?  
 712   8  1  A  19  HIS  A  19  .  ?        ?  
 713   8  1  A  20  ASP  A  20  .  ?        ?  
 714   8  1  A  21  ASN  A  21  .  ?        ?  
 715   8  1  A  22  ALA  A  22  .  ?        ?  
 716   8  1  A  23  SER  A  23  .  ?        ?  
 717   8  1  A  24  ARG  A  24  .  ?        ?  
 718   8  1  A  25  ALA  A  25  .  ?        ?  
 719   8  1  A  26  LEU  A  26  .  ?        ?  
 720   8  1  A  27  ALA  A  27  .  ?        ?  
 721   8  1  A  28  LEU  A  28  .  ?        1  
 722   8  1  A  29  PHE  A  29  .  ?        ?  
 723   8  1  A  30  GLU  A  30  .  ?        ?  
 724   8  1  A  31  GLU  A  31  .  ?        ?  
 725   8  1  A  32  LEU  A  32  .  ?        1  
 726   8  1  A  33  VAL  A  33  .  ?        ?  
 727   8  1  A  34  GLU  A  34  .  ?        ?  
 728   8  1  A  35  THR  A  35  .  ?        ?  
 729   8  1  A  36  ASP  A  36  .  ?        ?  
 730   8  1  A  37  PRO  A  37  .  ?        ?  
 731   8  1  A  38  ASP  A  38  .  ?        ?  
 732   8  1  A  39  TYR  A  39  .  ?        ?  
 733   8  1  A  40  VAL  A  40  .  ?        ?  
 734   8  1  A  41  GLY  A  41  .  ?        ?  
 735   8  1  A  42  THR  A  42  .  ?        ?  
 736   8  1  A  43  TYR  A  43  .  ?        ?  
 737   8  1  A  44  TYR  A  44  .  ?        1  
 738   8  1  A  45  HIS  A  45  .  ?        ?  
 739   8  1  A  46  LEU  A  46  .  ?        ?  
 740   8  1  A  47  GLY  A  47  .  ?        ?  
 741   8  1  A  48  LYS  A  48  .  ?        1  
 742   8  1  A  49  LEU  A  49  .  ?        ?  
 743   8  1  A  50  TYR  A  50  .  ?        ?  
 744   8  1  A  51  GLU  A  51  .  ?        ?  
 745   8  1  A  52  ARG  A  52  .  ?        ?  
 746   8  1  A  53  LEU  A  53  .  ?        ?  
 747   8  1  A  54  ASP  A  54  .  ?        ?  
 748   8  1  A  55  ARG  A  55  .  ?        ?  
 749   8  1  A  56  THR  A  56  .  ?        ?  
 750   8  1  A  57  ASP  A  57  .  ?        ?  
 751   8  1  A  58  ASP  A  58  .  ?        ?  
 752   8  1  A  59  ALA  A  59  .  ?        ?  
 753   8  1  A  60  ILE  A  60  .  ?        ?  
 754   8  1  A  61  ASP  A  61  .  ?        ?  
 755   8  1  A  62  THR  A  62  .  ?        ?  
 756   8  1  A  63  TYR  A  63  .  ?        ?  
 757   8  1  A  64  ALA  A  64  .  ?        ?  
 758   8  1  A  65  GLN  A  65  .  ?        ?  
 759   8  1  A  66  GLY  A  66  .  ?        ?  
 760   8  1  A  67  ILE  A  67  .  ?        1  
 761   8  1  A  68  GLU  A  68  .  ?        ?  
 762   8  1  A  69  VAL  A  69  .  ?        ?  
 763   8  1  A  70  ALA  A  70  .  ?        ?  
 764   8  1  A  71  ARG  A  71  .  ?        1  
 765   8  1  A  72  GLU  A  72  .  ?        ?  
 766   8  1  A  73  GLU  A  73  .  ?        ?  
 767   8  1  A  74  GLY  A  74  .  ?        ?  
 768   8  1  A  75  THR  A  75  .  ?        ?  
 769   8  1  A  76  GLN  A  76  .  ?        ?  
 770   8  1  A  77  LYS  A  77  .  ?        ?  
 771   8  1  A  78  ASP  A  78  .  ?        ?  
 772   8  1  A  79  LEU  A  79  .  ?        ?  
 773   8  1  A  80  SER  A  80  .  ?        ?  
 774   8  1  A  81  GLU  A  81  .  ?        ?  
 775   8  1  A  82  LEU  A  82  .  ?        ?  
 776   8  1  A  83  GLN  A  83  .  ?        ?  
 777   8  1  A  84  ASP  A  84  .  ?        ?  
 778   8  1  A  85  ALA  A  85  .  ?        ?  
 779   8  1  A  86  LYS  A  86  .  ?        ?  
 780   8  1  A  87  LEU  A  87  .  ?        ?  
 781   8  1  A  88  LYS  A  88  .  ?        ?  
 782   8  1  A  89  ALA  A  89  .  ?        ?  
 783   8  1  A  90  GLU  A  90  .  ?        ?  
 784   8  1  A  91  GLY  A  91  .  ?        ?  
 785   8  1  A  92  LEU  A  92  .  ?        ?  
 786   8  1  A  93  GLU  A  93  .  ?        ?  
 787   8  1  A  94  HIS  A  94  .  ?        ?  
 788   8  1  A  95  HIS  A  95  .  ?        ?  
 789   8  1  A  96  HIS  A  96  .  ?        ?  
 790   8  1  A  97  HIS  A  97  .  ?        ?  
 791   8  1  A  98  HIS  A  98  .  ?        ?  
 792   8  1  A  99  HIS  A  99  .  ?        ?  
 793   9  1  A   1  GLU  A   1  .  ?        ?  
 794   9  1  A   2  ASP  A   2  .  ?        1  
 795   9  1  A   3  PRO  A   3  .  ?        1  
 796   9  1  A   4  GLU  A   4  .  ?        ?  
 797   9  1  A   5  ASP  A   5  .  ?        ?  
 798   9  1  A   6  PRO  A   6  .  ?        ?  
 799   9  1  A   7  PHE  A   7  .  ?        ?  
 800   9  1  A   8  THR  A   8  .  ?        ?  
 801   9  1  A   9  ARG  A   9  .  ?        ?  
 802   9  1  A  10  TYR  A  10  .  ?        ?  
 803   9  1  A  11  ALA  A  11  .  ?        ?  
 804   9  1  A  12  LEU  A  12  .  ?        ?  
 805   9  1  A  13  ALA  A  13  .  ?        ?  
 806   9  1  A  14  GLN  A  14  .  ?        ?  
 807   9  1  A  15  GLU  A  15  .  ?        ?  
 808   9  1  A  16  HIS  A  16  .  ?        ?  
 809   9  1  A  17  LEU  A  17  .  ?        ?  
 810   9  1  A  18  LYS  A  18  .  ?        ?  
 811   9  1  A  19  HIS  A  19  .  ?        ?  
 812   9  1  A  20  ASP  A  20  .  ?        ?  
 813   9  1  A  21  ASN  A  21  .  ?        ?  
 814   9  1  A  22  ALA  A  22  .  ?        ?  
 815   9  1  A  23  SER  A  23  .  ?        ?  
 816   9  1  A  24  ARG  A  24  .  ?        ?  
 817   9  1  A  25  ALA  A  25  .  ?        ?  
 818   9  1  A  26  LEU  A  26  .  ?        ?  
 819   9  1  A  27  ALA  A  27  .  ?        ?  
 820   9  1  A  28  LEU  A  28  .  ?        ?  
 821   9  1  A  29  PHE  A  29  .  ?        ?  
 822   9  1  A  30  GLU  A  30  .  ?        ?  
 823   9  1  A  31  GLU  A  31  .  ?        ?  
 824   9  1  A  32  LEU  A  32  .  ?        ?  
 825   9  1  A  33  VAL  A  33  .  ?        ?  
 826   9  1  A  34  GLU  A  34  .  ?        ?  
 827   9  1  A  35  THR  A  35  .  ?        ?  
 828   9  1  A  36  ASP  A  36  .  ?        ?  
 829   9  1  A  37  PRO  A  37  .  ?        ?  
 830   9  1  A  38  ASP  A  38  .  ?        ?  
 831   9  1  A  39  TYR  A  39  .  ?        ?  
 832   9  1  A  40  VAL  A  40  .  ?        ?  
 833   9  1  A  41  GLY  A  41  .  ?        ?  
 834   9  1  A  42  THR  A  42  .  ?        ?  
 835   9  1  A  43  TYR  A  43  .  ?        ?  
 836   9  1  A  44  TYR  A  44  .  ?        1  
 837   9  1  A  45  HIS  A  45  .  ?        ?  
 838   9  1  A  46  LEU  A  46  .  ?        ?  
 839   9  1  A  47  GLY  A  47  .  ?        ?  
 840   9  1  A  48  LYS  A  48  .  ?        1  
 841   9  1  A  49  LEU  A  49  .  ?        ?  
 842   9  1  A  50  TYR  A  50  .  ?        ?  
 843   9  1  A  51  GLU  A  51  .  ?        ?  
 844   9  1  A  52  ARG  A  52  .  ?        ?  
 845   9  1  A  53  LEU  A  53  .  ?        ?  
 846   9  1  A  54  ASP  A  54  .  ?        ?  
 847   9  1  A  55  ARG  A  55  .  ?        ?  
 848   9  1  A  56  THR  A  56  .  ?        ?  
 849   9  1  A  57  ASP  A  57  .  ?        ?  
 850   9  1  A  58  ASP  A  58  .  ?        ?  
 851   9  1  A  59  ALA  A  59  .  ?        ?  
 852   9  1  A  60  ILE  A  60  .  ?        ?  
 853   9  1  A  61  ASP  A  61  .  ?        ?  
 854   9  1  A  62  THR  A  62  .  ?        ?  
 855   9  1  A  63  TYR  A  63  .  ?        1  
 856   9  1  A  64  ALA  A  64  .  ?        ?  
 857   9  1  A  65  GLN  A  65  .  ?        ?  
 858   9  1  A  66  GLY  A  66  .  ?        ?  
 859   9  1  A  67  ILE  A  67  .  ?        1  
 860   9  1  A  68  GLU  A  68  .  ?        ?  
 861   9  1  A  69  VAL  A  69  .  ?        ?  
 862   9  1  A  70  ALA  A  70  .  ?        ?  
 863   9  1  A  71  ARG  A  71  .  ?        1  
 864   9  1  A  72  GLU  A  72  .  ?        ?  
 865   9  1  A  73  GLU  A  73  .  ?        ?  
 866   9  1  A  74  GLY  A  74  .  ?        ?  
 867   9  1  A  75  THR  A  75  .  ?        ?  
 868   9  1  A  76  GLN  A  76  .  ?        ?  
 869   9  1  A  77  LYS  A  77  .  ?        1  
 870   9  1  A  78  ASP  A  78  .  ?        ?  
 871   9  1  A  79  LEU  A  79  .  ?        1  
 872   9  1  A  80  SER  A  80  .  ?        ?  
 873   9  1  A  81  GLU  A  81  .  ?        1  
 874   9  1  A  82  LEU  A  82  .  ?        ?  
 875   9  1  A  83  GLN  A  83  .  ?        ?  
 876   9  1  A  84  ASP  A  84  .  ?        ?  
 877   9  1  A  85  ALA  A  85  .  ?        ?  
 878   9  1  A  86  LYS  A  86  .  ?        ?  
 879   9  1  A  87  LEU  A  87  .  ?        ?  
 880   9  1  A  88  LYS  A  88  .  ?        ?  
 881   9  1  A  89  ALA  A  89  .  ?        ?  
 882   9  1  A  90  GLU  A  90  .  ?        ?  
 883   9  1  A  91  GLY  A  91  .  ?        ?  
 884   9  1  A  92  LEU  A  92  .  ?        ?  
 885   9  1  A  93  GLU  A  93  .  ?        ?  
 886   9  1  A  94  HIS  A  94  .  ?        ?  
 887   9  1  A  95  HIS  A  95  .  ?        ?  
 888   9  1  A  96  HIS  A  96  .  ?        ?  
 889   9  1  A  97  HIS  A  97  .  ?        ?  
 890   9  1  A  98  HIS  A  98  .  ?        ?  
 891   9  1  A  99  HIS  A  99  .  ?        ?  
 892  10  1  A   1  GLU  A   1  .  ?        ?  
 893  10  1  A   2  ASP  A   2  .  ?        ?  
 894  10  1  A   3  PRO  A   3  .  ?        1  
 895  10  1  A   4  GLU  A   4  .  ?        ?  
 896  10  1  A   5  ASP  A   5  .  ?        ?  
 897  10  1  A   6  PRO  A   6  .  ?        ?  
 898  10  1  A   7  PHE  A   7  .  ?        ?  
 899  10  1  A   8  THR  A   8  .  ?        ?  
 900  10  1  A   9  ARG  A   9  .  ?        1  
 901  10  1  A  10  TYR  A  10  .  ?        ?  
 902  10  1  A  11  ALA  A  11  .  ?        ?  
 903  10  1  A  12  LEU  A  12  .  ?        ?  
 904  10  1  A  13  ALA  A  13  .  ?        ?  
 905  10  1  A  14  GLN  A  14  .  ?        ?  
 906  10  1  A  15  GLU  A  15  .  ?        ?  
 907  10  1  A  16  HIS  A  16  .  ?        ?  
 908  10  1  A  17  LEU  A  17  .  ?        ?  
 909  10  1  A  18  LYS  A  18  .  ?        ?  
 910  10  1  A  19  HIS  A  19  .  ?        ?  
 911  10  1  A  20  ASP  A  20  .  ?        ?  
 912  10  1  A  21  ASN  A  21  .  ?        ?  
 913  10  1  A  22  ALA  A  22  .  ?        ?  
 914  10  1  A  23  SER  A  23  .  ?        ?  
 915  10  1  A  24  ARG  A  24  .  ?        ?  
 916  10  1  A  25  ALA  A  25  .  ?        ?  
 917  10  1  A  26  LEU  A  26  .  ?        ?  
 918  10  1  A  27  ALA  A  27  .  ?        ?  
 919  10  1  A  28  LEU  A  28  .  ?        ?  
 920  10  1  A  29  PHE  A  29  .  ?        ?  
 921  10  1  A  30  GLU  A  30  .  ?        ?  
 922  10  1  A  31  GLU  A  31  .  ?        ?  
 923  10  1  A  32  LEU  A  32  .  ?        ?  
 924  10  1  A  33  VAL  A  33  .  ?        ?  
 925  10  1  A  34  GLU  A  34  .  ?        ?  
 926  10  1  A  35  THR  A  35  .  ?        ?  
 927  10  1  A  36  ASP  A  36  .  ?        ?  
 928  10  1  A  37  PRO  A  37  .  ?        ?  
 929  10  1  A  38  ASP  A  38  .  ?        ?  
 930  10  1  A  39  TYR  A  39  .  ?        ?  
 931  10  1  A  40  VAL  A  40  .  ?        ?  
 932  10  1  A  41  GLY  A  41  .  ?        ?  
 933  10  1  A  42  THR  A  42  .  ?        ?  
 934  10  1  A  43  TYR  A  43  .  ?        ?  
 935  10  1  A  44  TYR  A  44  .  ?        ?  
 936  10  1  A  45  HIS  A  45  .  ?        ?  
 937  10  1  A  46  LEU  A  46  .  ?        ?  
 938  10  1  A  47  GLY  A  47  .  ?        ?  
 939  10  1  A  48  LYS  A  48  .  ?        ?  
 940  10  1  A  49  LEU  A  49  .  ?        ?  
 941  10  1  A  50  TYR  A  50  .  ?        ?  
 942  10  1  A  51  GLU  A  51  .  ?        ?  
 943  10  1  A  52  ARG  A  52  .  ?        ?  
 944  10  1  A  53  LEU  A  53  .  ?        ?  
 945  10  1  A  54  ASP  A  54  .  ?        ?  
 946  10  1  A  55  ARG  A  55  .  ?        ?  
 947  10  1  A  56  THR  A  56  .  ?        ?  
 948  10  1  A  57  ASP  A  57  .  ?        ?  
 949  10  1  A  58  ASP  A  58  .  ?        ?  
 950  10  1  A  59  ALA  A  59  .  ?        ?  
 951  10  1  A  60  ILE  A  60  .  ?        ?  
 952  10  1  A  61  ASP  A  61  .  ?        ?  
 953  10  1  A  62  THR  A  62  .  ?        ?  
 954  10  1  A  63  TYR  A  63  .  ?        ?  
 955  10  1  A  64  ALA  A  64  .  ?        ?  
 956  10  1  A  65  GLN  A  65  .  ?        ?  
 957  10  1  A  66  GLY  A  66  .  ?        ?  
 958  10  1  A  67  ILE  A  67  .  ?        ?  
 959  10  1  A  68  GLU  A  68  .  ?        ?  
 960  10  1  A  69  VAL  A  69  .  ?        ?  
 961  10  1  A  70  ALA  A  70  .  ?        ?  
 962  10  1  A  71  ARG  A  71  .  ?        ?  
 963  10  1  A  72  GLU  A  72  .  ?        ?  
 964  10  1  A  73  GLU  A  73  .  ?        ?  
 965  10  1  A  74  GLY  A  74  .  ?        ?  
 966  10  1  A  75  THR  A  75  .  ?        ?  
 967  10  1  A  76  GLN  A  76  .  ?        ?  
 968  10  1  A  77  LYS  A  77  .  ?        ?  
 969  10  1  A  78  ASP  A  78  .  ?        ?  
 970  10  1  A  79  LEU  A  79  .  ?        ?  
 971  10  1  A  80  SER  A  80  .  ?        ?  
 972  10  1  A  81  GLU  A  81  .  ?        ?  
 973  10  1  A  82  LEU  A  82  .  ?        ?  
 974  10  1  A  83  GLN  A  83  .  ?        ?  
 975  10  1  A  84  ASP  A  84  .  ?        ?  
 976  10  1  A  85  ALA  A  85  .  ?        ?  
 977  10  1  A  86  LYS  A  86  .  ?        ?  
 978  10  1  A  87  LEU  A  87  .  ?        ?  
 979  10  1  A  88  LYS  A  88  .  ?        2  
 980  10  1  A  89  ALA  A  89  .  ?        1  
 981  10  1  A  90  GLU  A  90  .  ?        ?  
 982  10  1  A  91  GLY  A  91  .  ?        ?  
 983  10  1  A  92  LEU  A  92  .  ?        1  
 984  10  1  A  93  GLU  A  93  .  ?        ?  
 985  10  1  A  94  HIS  A  94  .  ?        ?  
 986  10  1  A  95  HIS  A  95  .  ?        ?  
 987  10  1  A  96  HIS  A  96  .  ?        ?  
 988  10  1  A  97  HIS  A  97  .  ?        ?  
 989  10  1  A  98  HIS  A  98  .  ?        ?  
 990  10  1  A  99  HIS  A  99  .  ?        ?  
 991  11  1  A   1  GLU  A   1  .  ?        ?  
 992  11  1  A   2  ASP  A   2  .  ?        ?  
 993  11  1  A   3  PRO  A   3  .  ?        ?  
 994  11  1  A   4  GLU  A   4  .  ?        ?  
 995  11  1  A   5  ASP  A   5  .  ?        1  
 996  11  1  A   6  PRO  A   6  .  ?        ?  
 997  11  1  A   7  PHE  A   7  .  ?        ?  
 998  11  1  A   8  THR  A   8  .  ?        ?  
 999  11  1  A   9  ARG  A   9  .  ?        1  
1000  11  1  A  10  TYR  A  10  .  ?        ?  
1001  11  1  A  11  ALA  A  11  .  ?        ?  
1002  11  1  A  12  LEU  A  12  .  ?        ?  
1003  11  1  A  13  ALA  A  13  .  ?        ?  
1004  11  1  A  14  GLN  A  14  .  ?        ?  
1005  11  1  A  15  GLU  A  15  .  ?        ?  
1006  11  1  A  16  HIS  A  16  .  ?        ?  
1007  11  1  A  17  LEU  A  17  .  ?        ?  
1008  11  1  A  18  LYS  A  18  .  ?        ?  
1009  11  1  A  19  HIS  A  19  .  ?        ?  
1010  11  1  A  20  ASP  A  20  .  ?        ?  
1011  11  1  A  21  ASN  A  21  .  ?        ?  
1012  11  1  A  22  ALA  A  22  .  ?        ?  
1013  11  1  A  23  SER  A  23  .  ?        ?  
1014  11  1  A  24  ARG  A  24  .  ?        ?  
1015  11  1  A  25  ALA  A  25  .  ?        ?  
1016  11  1  A  26  LEU  A  26  .  ?        ?  
1017  11  1  A  27  ALA  A  27  .  ?        ?  
1018  11  1  A  28  LEU  A  28  .  ?        ?  
1019  11  1  A  29  PHE  A  29  .  ?        ?  
1020  11  1  A  30  GLU  A  30  .  ?        ?  
1021  11  1  A  31  GLU  A  31  .  ?        ?  
1022  11  1  A  32  LEU  A  32  .  ?        ?  
1023  11  1  A  33  VAL  A  33  .  ?        ?  
1024  11  1  A  34  GLU  A  34  .  ?        ?  
1025  11  1  A  35  THR  A  35  .  ?        ?  
1026  11  1  A  36  ASP  A  36  .  ?        ?  
1027  11  1  A  37  PRO  A  37  .  ?        ?  
1028  11  1  A  38  ASP  A  38  .  ?        ?  
1029  11  1  A  39  TYR  A  39  .  ?        ?  
1030  11  1  A  40  VAL  A  40  .  ?        ?  
1031  11  1  A  41  GLY  A  41  .  ?        ?  
1032  11  1  A  42  THR  A  42  .  ?        ?  
1033  11  1  A  43  TYR  A  43  .  ?        ?  
1034  11  1  A  44  TYR  A  44  .  ?        1  
1035  11  1  A  45  HIS  A  45  .  ?        ?  
1036  11  1  A  46  LEU  A  46  .  ?        ?  
1037  11  1  A  47  GLY  A  47  .  ?        ?  
1038  11  1  A  48  LYS  A  48  .  ?        1  
1039  11  1  A  49  LEU  A  49  .  ?        ?  
1040  11  1  A  50  TYR  A  50  .  ?        ?  
1041  11  1  A  51  GLU  A  51  .  ?        ?  
1042  11  1  A  52  ARG  A  52  .  ?        ?  
1043  11  1  A  53  LEU  A  53  .  ?        ?  
1044  11  1  A  54  ASP  A  54  .  ?        ?  
1045  11  1  A  55  ARG  A  55  .  ?        ?  
1046  11  1  A  56  THR  A  56  .  ?        ?  
1047  11  1  A  57  ASP  A  57  .  ?        ?  
1048  11  1  A  58  ASP  A  58  .  ?        ?  
1049  11  1  A  59  ALA  A  59  .  ?        ?  
1050  11  1  A  60  ILE  A  60  .  ?        ?  
1051  11  1  A  61  ASP  A  61  .  ?        ?  
1052  11  1  A  62  THR  A  62  .  ?        ?  
1053  11  1  A  63  TYR  A  63  .  ?        ?  
1054  11  1  A  64  ALA  A  64  .  ?        ?  
1055  11  1  A  65  GLN  A  65  .  ?        ?  
1056  11  1  A  66  GLY  A  66  .  ?        ?  
1057  11  1  A  67  ILE  A  67  .  ?        ?  
1058  11  1  A  68  GLU  A  68  .  ?        ?  
1059  11  1  A  69  VAL  A  69  .  ?        ?  
1060  11  1  A  70  ALA  A  70  .  ?        ?  
1061  11  1  A  71  ARG  A  71  .  ?        ?  
1062  11  1  A  72  GLU  A  72  .  ?        ?  
1063  11  1  A  73  GLU  A  73  .  ?        ?  
1064  11  1  A  74  GLY  A  74  .  ?        ?  
1065  11  1  A  75  THR  A  75  .  ?        ?  
1066  11  1  A  76  GLN  A  76  .  ?        ?  
1067  11  1  A  77  LYS  A  77  .  ?        ?  
1068  11  1  A  78  ASP  A  78  .  ?        ?  
1069  11  1  A  79  LEU  A  79  .  ?        ?  
1070  11  1  A  80  SER  A  80  .  ?        ?  
1071  11  1  A  81  GLU  A  81  .  ?        ?  
1072  11  1  A  82  LEU  A  82  .  ?        ?  
1073  11  1  A  83  GLN  A  83  .  ?        ?  
1074  11  1  A  84  ASP  A  84  .  ?        ?  
1075  11  1  A  85  ALA  A  85  .  ?        ?  
1076  11  1  A  86  LYS  A  86  .  ?        ?  
1077  11  1  A  87  LEU  A  87  .  ?        ?  
1078  11  1  A  88  LYS  A  88  .  ?        1  
1079  11  1  A  89  ALA  A  89  .  ?        1  
1080  11  1  A  90  GLU  A  90  .  ?        ?  
1081  11  1  A  91  GLY  A  91  .  ?        ?  
1082  11  1  A  92  LEU  A  92  .  ?        ?  
1083  11  1  A  93  GLU  A  93  .  ?        ?  
1084  11  1  A  94  HIS  A  94  .  ?        ?  
1085  11  1  A  95  HIS  A  95  .  ?        ?  
1086  11  1  A  96  HIS  A  96  .  ?        ?  
1087  11  1  A  97  HIS  A  97  .  ?        ?  
1088  11  1  A  98  HIS  A  98  .  ?        ?  
1089  11  1  A  99  HIS  A  99  .  ?        ?  
1090  12  1  A   1  GLU  A   1  .  ?        ?  
1091  12  1  A   2  ASP  A   2  .  ?        ?  
1092  12  1  A   3  PRO  A   3  .  ?        ?  
1093  12  1  A   4  GLU  A   4  .  ?        ?  
1094  12  1  A   5  ASP  A   5  .  ?        ?  
1095  12  1  A   6  PRO  A   6  .  ?        ?  
1096  12  1  A   7  PHE  A   7  .  ?        ?  
1097  12  1  A   8  THR  A   8  .  ?        ?  
1098  12  1  A   9  ARG  A   9  .  ?        ?  
1099  12  1  A  10  TYR  A  10  .  ?        ?  
1100  12  1  A  11  ALA  A  11  .  ?        ?  
1101  12  1  A  12  LEU  A  12  .  ?        ?  
1102  12  1  A  13  ALA  A  13  .  ?        ?  
1103  12  1  A  14  GLN  A  14  .  ?        ?  
1104  12  1  A  15  GLU  A  15  .  ?        ?  
1105  12  1  A  16  HIS  A  16  .  ?        ?  
1106  12  1  A  17  LEU  A  17  .  ?        ?  
1107  12  1  A  18  LYS  A  18  .  ?        ?  
1108  12  1  A  19  HIS  A  19  .  ?        ?  
1109  12  1  A  20  ASP  A  20  .  ?        ?  
1110  12  1  A  21  ASN  A  21  .  ?        ?  
1111  12  1  A  22  ALA  A  22  .  ?        ?  
1112  12  1  A  23  SER  A  23  .  ?        ?  
1113  12  1  A  24  ARG  A  24  .  ?        ?  
1114  12  1  A  25  ALA  A  25  .  ?        ?  
1115  12  1  A  26  LEU  A  26  .  ?        ?  
1116  12  1  A  27  ALA  A  27  .  ?        ?  
1117  12  1  A  28  LEU  A  28  .  ?        ?  
1118  12  1  A  29  PHE  A  29  .  ?        ?  
1119  12  1  A  30  GLU  A  30  .  ?        ?  
1120  12  1  A  31  GLU  A  31  .  ?        ?  
1121  12  1  A  32  LEU  A  32  .  ?        ?  
1122  12  1  A  33  VAL  A  33  .  ?        ?  
1123  12  1  A  34  GLU  A  34  .  ?        ?  
1124  12  1  A  35  THR  A  35  .  ?        ?  
1125  12  1  A  36  ASP  A  36  .  ?        ?  
1126  12  1  A  37  PRO  A  37  .  ?        ?  
1127  12  1  A  38  ASP  A  38  .  ?        ?  
1128  12  1  A  39  TYR  A  39  .  ?        ?  
1129  12  1  A  40  VAL  A  40  .  ?        ?  
1130  12  1  A  41  GLY  A  41  .  ?        ?  
1131  12  1  A  42  THR  A  42  .  ?        ?  
1132  12  1  A  43  TYR  A  43  .  ?        ?  
1133  12  1  A  44  TYR  A  44  .  ?        ?  
1134  12  1  A  45  HIS  A  45  .  ?        ?  
1135  12  1  A  46  LEU  A  46  .  ?        ?  
1136  12  1  A  47  GLY  A  47  .  ?        ?  
1137  12  1  A  48  LYS  A  48  .  ?        ?  
1138  12  1  A  49  LEU  A  49  .  ?        ?  
1139  12  1  A  50  TYR  A  50  .  ?        ?  
1140  12  1  A  51  GLU  A  51  .  ?        ?  
1141  12  1  A  52  ARG  A  52  .  ?        ?  
1142  12  1  A  53  LEU  A  53  .  ?        ?  
1143  12  1  A  54  ASP  A  54  .  ?        ?  
1144  12  1  A  55  ARG  A  55  .  ?        ?  
1145  12  1  A  56  THR  A  56  .  ?        ?  
1146  12  1  A  57  ASP  A  57  .  ?        1  
1147  12  1  A  58  ASP  A  58  .  ?        ?  
1148  12  1  A  59  ALA  A  59  .  ?        ?  
1149  12  1  A  60  ILE  A  60  .  ?        ?  
1150  12  1  A  61  ASP  A  61  .  ?        ?  
1151  12  1  A  62  THR  A  62  .  ?        ?  
1152  12  1  A  63  TYR  A  63  .  ?        ?  
1153  12  1  A  64  ALA  A  64  .  ?        ?  
1154  12  1  A  65  GLN  A  65  .  ?        ?  
1155  12  1  A  66  GLY  A  66  .  ?        ?  
1156  12  1  A  67  ILE  A  67  .  ?        ?  
1157  12  1  A  68  GLU  A  68  .  ?        ?  
1158  12  1  A  69  VAL  A  69  .  ?        ?  
1159  12  1  A  70  ALA  A  70  .  ?        ?  
1160  12  1  A  71  ARG  A  71  .  ?        ?  
1161  12  1  A  72  GLU  A  72  .  ?        ?  
1162  12  1  A  73  GLU  A  73  .  ?        ?  
1163  12  1  A  74  GLY  A  74  .  ?        ?  
1164  12  1  A  75  THR  A  75  .  ?        ?  
1165  12  1  A  76  GLN  A  76  .  ?        ?  
1166  12  1  A  77  LYS  A  77  .  ?        ?  
1167  12  1  A  78  ASP  A  78  .  ?        ?  
1168  12  1  A  79  LEU  A  79  .  ?        ?  
1169  12  1  A  80  SER  A  80  .  ?        ?  
1170  12  1  A  81  GLU  A  81  .  ?        ?  
1171  12  1  A  82  LEU  A  82  .  ?        ?  
1172  12  1  A  83  GLN  A  83  .  ?        ?  
1173  12  1  A  84  ASP  A  84  .  ?        ?  
1174  12  1  A  85  ALA  A  85  .  ?        ?  
1175  12  1  A  86  LYS  A  86  .  ?        ?  
1176  12  1  A  87  LEU  A  87  .  ?        ?  
1177  12  1  A  88  LYS  A  88  .  ?        ?  
1178  12  1  A  89  ALA  A  89  .  ?        ?  
1179  12  1  A  90  GLU  A  90  .  ?        ?  
1180  12  1  A  91  GLY  A  91  .  ?        ?  
1181  12  1  A  92  LEU  A  92  .  ?        ?  
1182  12  1  A  93  GLU  A  93  .  ?        ?  
1183  12  1  A  94  HIS  A  94  .  ?        ?  
1184  12  1  A  95  HIS  A  95  .  ?        ?  
1185  12  1  A  96  HIS  A  96  .  ?        ?  
1186  12  1  A  97  HIS  A  97  .  ?        ?  
1187  12  1  A  98  HIS  A  98  .  ?        1  
1188  12  1  A  99  HIS  A  99  .  ?        ?  
1189  13  1  A   1  GLU  A   1  .  ?        ?  
1190  13  1  A   2  ASP  A   2  .  ?        ?  
1191  13  1  A   3  PRO  A   3  .  ?        ?  
1192  13  1  A   4  GLU  A   4  .  ?        ?  
1193  13  1  A   5  ASP  A   5  .  ?        ?  
1194  13  1  A   6  PRO  A   6  .  ?        ?  
1195  13  1  A   7  PHE  A   7  .  ?        ?  
1196  13  1  A   8  THR  A   8  .  ?        ?  
1197  13  1  A   9  ARG  A   9  .  ?        ?  
1198  13  1  A  10  TYR  A  10  .  ?        ?  
1199  13  1  A  11  ALA  A  11  .  ?        ?  
1200  13  1  A  12  LEU  A  12  .  ?        ?  
1201  13  1  A  13  ALA  A  13  .  ?        ?  
1202  13  1  A  14  GLN  A  14  .  ?        ?  
1203  13  1  A  15  GLU  A  15  .  ?        ?  
1204  13  1  A  16  HIS  A  16  .  ?        ?  
1205  13  1  A  17  LEU  A  17  .  ?        ?  
1206  13  1  A  18  LYS  A  18  .  ?        ?  
1207  13  1  A  19  HIS  A  19  .  ?        ?  
1208  13  1  A  20  ASP  A  20  .  ?        ?  
1209  13  1  A  21  ASN  A  21  .  ?        ?  
1210  13  1  A  22  ALA  A  22  .  ?        ?  
1211  13  1  A  23  SER  A  23  .  ?        ?  
1212  13  1  A  24  ARG  A  24  .  ?        ?  
1213  13  1  A  25  ALA  A  25  .  ?        ?  
1214  13  1  A  26  LEU  A  26  .  ?        ?  
1215  13  1  A  27  ALA  A  27  .  ?        ?  
1216  13  1  A  28  LEU  A  28  .  ?        ?  
1217  13  1  A  29  PHE  A  29  .  ?        ?  
1218  13  1  A  30  GLU  A  30  .  ?        ?  
1219  13  1  A  31  GLU  A  31  .  ?        ?  
1220  13  1  A  32  LEU  A  32  .  ?        ?  
1221  13  1  A  33  VAL  A  33  .  ?        ?  
1222  13  1  A  34  GLU  A  34  .  ?        ?  
1223  13  1  A  35  THR  A  35  .  ?        ?  
1224  13  1  A  36  ASP  A  36  .  ?        ?  
1225  13  1  A  37  PRO  A  37  .  ?        ?  
1226  13  1  A  38  ASP  A  38  .  ?        ?  
1227  13  1  A  39  TYR  A  39  .  ?        ?  
1228  13  1  A  40  VAL  A  40  .  ?        ?  
1229  13  1  A  41  GLY  A  41  .  ?        ?  
1230  13  1  A  42  THR  A  42  .  ?        ?  
1231  13  1  A  43  TYR  A  43  .  ?        ?  
1232  13  1  A  44  TYR  A  44  .  ?        1  
1233  13  1  A  45  HIS  A  45  .  ?        ?  
1234  13  1  A  46  LEU  A  46  .  ?        ?  
1235  13  1  A  47  GLY  A  47  .  ?        ?  
1236  13  1  A  48  LYS  A  48  .  ?        1  
1237  13  1  A  49  LEU  A  49  .  ?        ?  
1238  13  1  A  50  TYR  A  50  .  ?        ?  
1239  13  1  A  51  GLU  A  51  .  ?        ?  
1240  13  1  A  52  ARG  A  52  .  ?        ?  
1241  13  1  A  53  LEU  A  53  .  ?        ?  
1242  13  1  A  54  ASP  A  54  .  ?        ?  
1243  13  1  A  55  ARG  A  55  .  ?        ?  
1244  13  1  A  56  THR  A  56  .  ?        ?  
1245  13  1  A  57  ASP  A  57  .  ?        ?  
1246  13  1  A  58  ASP  A  58  .  ?        ?  
1247  13  1  A  59  ALA  A  59  .  ?        ?  
1248  13  1  A  60  ILE  A  60  .  ?        ?  
1249  13  1  A  61  ASP  A  61  .  ?        ?  
1250  13  1  A  62  THR  A  62  .  ?        ?  
1251  13  1  A  63  TYR  A  63  .  ?        ?  
1252  13  1  A  64  ALA  A  64  .  ?        ?  
1253  13  1  A  65  GLN  A  65  .  ?        ?  
1254  13  1  A  66  GLY  A  66  .  ?        ?  
1255  13  1  A  67  ILE  A  67  .  ?        ?  
1256  13  1  A  68  GLU  A  68  .  ?        ?  
1257  13  1  A  69  VAL  A  69  .  ?        ?  
1258  13  1  A  70  ALA  A  70  .  ?        ?  
1259  13  1  A  71  ARG  A  71  .  ?        ?  
1260  13  1  A  72  GLU  A  72  .  ?        ?  
1261  13  1  A  73  GLU  A  73  .  ?        ?  
1262  13  1  A  74  GLY  A  74  .  ?        ?  
1263  13  1  A  75  THR  A  75  .  ?        ?  
1264  13  1  A  76  GLN  A  76  .  ?        ?  
1265  13  1  A  77  LYS  A  77  .  ?        1  
1266  13  1  A  78  ASP  A  78  .  ?        ?  
1267  13  1  A  79  LEU  A  79  .  ?        ?  
1268  13  1  A  80  SER  A  80  .  ?        ?  
1269  13  1  A  81  GLU  A  81  .  ?        1  
1270  13  1  A  82  LEU  A  82  .  ?        ?  
1271  13  1  A  83  GLN  A  83  .  ?        ?  
1272  13  1  A  84  ASP  A  84  .  ?        ?  
1273  13  1  A  85  ALA  A  85  .  ?        ?  
1274  13  1  A  86  LYS  A  86  .  ?        ?  
1275  13  1  A  87  LEU  A  87  .  ?        ?  
1276  13  1  A  88  LYS  A  88  .  ?        1  
1277  13  1  A  89  ALA  A  89  .  ?        ?  
1278  13  1  A  90  GLU  A  90  .  ?        ?  
1279  13  1  A  91  GLY  A  91  .  ?        ?  
1280  13  1  A  92  LEU  A  92  .  ?        1  
1281  13  1  A  93  GLU  A  93  .  ?        ?  
1282  13  1  A  94  HIS  A  94  .  ?        ?  
1283  13  1  A  95  HIS  A  95  .  ?        ?  
1284  13  1  A  96  HIS  A  96  .  ?        ?  
1285  13  1  A  97  HIS  A  97  .  ?        1  
1286  13  1  A  98  HIS  A  98  .  ?        1  
1287  13  1  A  99  HIS  A  99  .  ?        ?  
1288  14  1  A   1  GLU  A   1  .  ?        ?  
1289  14  1  A   2  ASP  A   2  .  ?        1  
1290  14  1  A   3  PRO  A   3  .  ?        1  
1291  14  1  A   4  GLU  A   4  .  ?        ?  
1292  14  1  A   5  ASP  A   5  .  ?        ?  
1293  14  1  A   6  PRO  A   6  .  ?        ?  
1294  14  1  A   7  PHE  A   7  .  ?        ?  
1295  14  1  A   8  THR  A   8  .  ?        ?  
1296  14  1  A   9  ARG  A   9  .  ?        1  
1297  14  1  A  10  TYR  A  10  .  ?        ?  
1298  14  1  A  11  ALA  A  11  .  ?        ?  
1299  14  1  A  12  LEU  A  12  .  ?        ?  
1300  14  1  A  13  ALA  A  13  .  ?        ?  
1301  14  1  A  14  GLN  A  14  .  ?        ?  
1302  14  1  A  15  GLU  A  15  .  ?        ?  
1303  14  1  A  16  HIS  A  16  .  ?        ?  
1304  14  1  A  17  LEU  A  17  .  ?        ?  
1305  14  1  A  18  LYS  A  18  .  ?        ?  
1306  14  1  A  19  HIS  A  19  .  ?        ?  
1307  14  1  A  20  ASP  A  20  .  ?        ?  
1308  14  1  A  21  ASN  A  21  .  ?        1  
1309  14  1  A  22  ALA  A  22  .  ?        ?  
1310  14  1  A  23  SER  A  23  .  ?        ?  
1311  14  1  A  24  ARG  A  24  .  ?        1  
1312  14  1  A  25  ALA  A  25  .  ?        ?  
1313  14  1  A  26  LEU  A  26  .  ?        ?  
1314  14  1  A  27  ALA  A  27  .  ?        ?  
1315  14  1  A  28  LEU  A  28  .  ?        ?  
1316  14  1  A  29  PHE  A  29  .  ?        ?  
1317  14  1  A  30  GLU  A  30  .  ?        ?  
1318  14  1  A  31  GLU  A  31  .  ?        ?  
1319  14  1  A  32  LEU  A  32  .  ?        1  
1320  14  1  A  33  VAL  A  33  .  ?        ?  
1321  14  1  A  34  GLU  A  34  .  ?        ?  
1322  14  1  A  35  THR  A  35  .  ?        ?  
1323  14  1  A  36  ASP  A  36  .  ?        ?  
1324  14  1  A  37  PRO  A  37  .  ?        ?  
1325  14  1  A  38  ASP  A  38  .  ?        ?  
1326  14  1  A  39  TYR  A  39  .  ?        ?  
1327  14  1  A  40  VAL  A  40  .  ?        ?  
1328  14  1  A  41  GLY  A  41  .  ?        ?  
1329  14  1  A  42  THR  A  42  .  ?        ?  
1330  14  1  A  43  TYR  A  43  .  ?        ?  
1331  14  1  A  44  TYR  A  44  .  ?        1  
1332  14  1  A  45  HIS  A  45  .  ?        ?  
1333  14  1  A  46  LEU  A  46  .  ?        ?  
1334  14  1  A  47  GLY  A  47  .  ?        ?  
1335  14  1  A  48  LYS  A  48  .  ?        1  
1336  14  1  A  49  LEU  A  49  .  ?        ?  
1337  14  1  A  50  TYR  A  50  .  ?        ?  
1338  14  1  A  51  GLU  A  51  .  ?        ?  
1339  14  1  A  52  ARG  A  52  .  ?        ?  
1340  14  1  A  53  LEU  A  53  .  ?        ?  
1341  14  1  A  54  ASP  A  54  .  ?        ?  
1342  14  1  A  55  ARG  A  55  .  ?        ?  
1343  14  1  A  56  THR  A  56  .  ?        ?  
1344  14  1  A  57  ASP  A  57  .  ?        ?  
1345  14  1  A  58  ASP  A  58  .  ?        ?  
1346  14  1  A  59  ALA  A  59  .  ?        ?  
1347  14  1  A  60  ILE  A  60  .  ?        ?  
1348  14  1  A  61  ASP  A  61  .  ?        ?  
1349  14  1  A  62  THR  A  62  .  ?        ?  
1350  14  1  A  63  TYR  A  63  .  ?        1  
1351  14  1  A  64  ALA  A  64  .  ?        ?  
1352  14  1  A  65  GLN  A  65  .  ?        ?  
1353  14  1  A  66  GLY  A  66  .  ?        ?  
1354  14  1  A  67  ILE  A  67  .  ?        1  
1355  14  1  A  68  GLU  A  68  .  ?        ?  
1356  14  1  A  69  VAL  A  69  .  ?        ?  
1357  14  1  A  70  ALA  A  70  .  ?        ?  
1358  14  1  A  71  ARG  A  71  .  ?        ?  
1359  14  1  A  72  GLU  A  72  .  ?        ?  
1360  14  1  A  73  GLU  A  73  .  ?        ?  
1361  14  1  A  74  GLY  A  74  .  ?        ?  
1362  14  1  A  75  THR  A  75  .  ?        ?  
1363  14  1  A  76  GLN  A  76  .  ?        ?  
1364  14  1  A  77  LYS  A  77  .  ?        ?  
1365  14  1  A  78  ASP  A  78  .  ?        ?  
1366  14  1  A  79  LEU  A  79  .  ?        ?  
1367  14  1  A  80  SER  A  80  .  ?        ?  
1368  14  1  A  81  GLU  A  81  .  ?        ?  
1369  14  1  A  82  LEU  A  82  .  ?        ?  
1370  14  1  A  83  GLN  A  83  .  ?        ?  
1371  14  1  A  84  ASP  A  84  .  ?        ?  
1372  14  1  A  85  ALA  A  85  .  ?        ?  
1373  14  1  A  86  LYS  A  86  .  ?        ?  
1374  14  1  A  87  LEU  A  87  .  ?        ?  
1375  14  1  A  88  LYS  A  88  .  ?        ?  
1376  14  1  A  89  ALA  A  89  .  ?        ?  
1377  14  1  A  90  GLU  A  90  .  ?        ?  
1378  14  1  A  91  GLY  A  91  .  ?        ?  
1379  14  1  A  92  LEU  A  92  .  ?        ?  
1380  14  1  A  93  GLU  A  93  .  ?        ?  
1381  14  1  A  94  HIS  A  94  .  ?        ?  
1382  14  1  A  95  HIS  A  95  .  ?        1  
1383  14  1  A  96  HIS  A  96  .  ?        ?  
1384  14  1  A  97  HIS  A  97  .  ?        1  
1385  14  1  A  98  HIS  A  98  .  ?        ?  
1386  14  1  A  99  HIS  A  99  .  ?        ?  
1387  15  1  A   1  GLU  A   1  .  ?        ?  
1388  15  1  A   2  ASP  A   2  .  ?        ?  
1389  15  1  A   3  PRO  A   3  .  ?        ?  
1390  15  1  A   4  GLU  A   4  .  ?        ?  
1391  15  1  A   5  ASP  A   5  .  ?        ?  
1392  15  1  A   6  PRO  A   6  .  ?        ?  
1393  15  1  A   7  PHE  A   7  .  ?        ?  
1394  15  1  A   8  THR  A   8  .  ?        ?  
1395  15  1  A   9  ARG  A   9  .  ?        1  
1396  15  1  A  10  TYR  A  10  .  ?        ?  
1397  15  1  A  11  ALA  A  11  .  ?        ?  
1398  15  1  A  12  LEU  A  12  .  ?        ?  
1399  15  1  A  13  ALA  A  13  .  ?        ?  
1400  15  1  A  14  GLN  A  14  .  ?        ?  
1401  15  1  A  15  GLU  A  15  .  ?        ?  
1402  15  1  A  16  HIS  A  16  .  ?        ?  
1403  15  1  A  17  LEU  A  17  .  ?        ?  
1404  15  1  A  18  LYS  A  18  .  ?        ?  
1405  15  1  A  19  HIS  A  19  .  ?        ?  
1406  15  1  A  20  ASP  A  20  .  ?        ?  
1407  15  1  A  21  ASN  A  21  .  ?        1  
1408  15  1  A  22  ALA  A  22  .  ?        ?  
1409  15  1  A  23  SER  A  23  .  ?        ?  
1410  15  1  A  24  ARG  A  24  .  ?        1  
1411  15  1  A  25  ALA  A  25  .  ?        ?  
1412  15  1  A  26  LEU  A  26  .  ?        ?  
1413  15  1  A  27  ALA  A  27  .  ?        ?  
1414  15  1  A  28  LEU  A  28  .  ?        ?  
1415  15  1  A  29  PHE  A  29  .  ?        ?  
1416  15  1  A  30  GLU  A  30  .  ?        ?  
1417  15  1  A  31  GLU  A  31  .  ?        1  
1418  15  1  A  32  LEU  A  32  .  ?        ?  
1419  15  1  A  33  VAL  A  33  .  ?        ?  
1420  15  1  A  34  GLU  A  34  .  ?        ?  
1421  15  1  A  35  THR  A  35  .  ?        ?  
1422  15  1  A  36  ASP  A  36  .  ?        ?  
1423  15  1  A  37  PRO  A  37  .  ?        ?  
1424  15  1  A  38  ASP  A  38  .  ?        ?  
1425  15  1  A  39  TYR  A  39  .  ?        ?  
1426  15  1  A  40  VAL  A  40  .  ?        ?  
1427  15  1  A  41  GLY  A  41  .  ?        ?  
1428  15  1  A  42  THR  A  42  .  ?        ?  
1429  15  1  A  43  TYR  A  43  .  ?        ?  
1430  15  1  A  44  TYR  A  44  .  ?        1  
1431  15  1  A  45  HIS  A  45  .  ?        ?  
1432  15  1  A  46  LEU  A  46  .  ?        ?  
1433  15  1  A  47  GLY  A  47  .  ?        ?  
1434  15  1  A  48  LYS  A  48  .  ?        1  
1435  15  1  A  49  LEU  A  49  .  ?        ?  
1436  15  1  A  50  TYR  A  50  .  ?        ?  
1437  15  1  A  51  GLU  A  51  .  ?        ?  
1438  15  1  A  52  ARG  A  52  .  ?        ?  
1439  15  1  A  53  LEU  A  53  .  ?        ?  
1440  15  1  A  54  ASP  A  54  .  ?        ?  
1441  15  1  A  55  ARG  A  55  .  ?        ?  
1442  15  1  A  56  THR  A  56  .  ?        ?  
1443  15  1  A  57  ASP  A  57  .  ?        ?  
1444  15  1  A  58  ASP  A  58  .  ?        ?  
1445  15  1  A  59  ALA  A  59  .  ?        ?  
1446  15  1  A  60  ILE  A  60  .  ?        ?  
1447  15  1  A  61  ASP  A  61  .  ?        ?  
1448  15  1  A  62  THR  A  62  .  ?        ?  
1449  15  1  A  63  TYR  A  63  .  ?        ?  
1450  15  1  A  64  ALA  A  64  .  ?        ?  
1451  15  1  A  65  GLN  A  65  .  ?        ?  
1452  15  1  A  66  GLY  A  66  .  ?        ?  
1453  15  1  A  67  ILE  A  67  .  ?        ?  
1454  15  1  A  68  GLU  A  68  .  ?        ?  
1455  15  1  A  69  VAL  A  69  .  ?        ?  
1456  15  1  A  70  ALA  A  70  .  ?        ?  
1457  15  1  A  71  ARG  A  71  .  ?        ?  
1458  15  1  A  72  GLU  A  72  .  ?        ?  
1459  15  1  A  73  GLU  A  73  .  ?        ?  
1460  15  1  A  74  GLY  A  74  .  ?        ?  
1461  15  1  A  75  THR  A  75  .  ?        ?  
1462  15  1  A  76  GLN  A  76  .  ?        ?  
1463  15  1  A  77  LYS  A  77  .  ?        ?  
1464  15  1  A  78  ASP  A  78  .  ?        ?  
1465  15  1  A  79  LEU  A  79  .  ?        ?  
1466  15  1  A  80  SER  A  80  .  ?        ?  
1467  15  1  A  81  GLU  A  81  .  ?        ?  
1468  15  1  A  82  LEU  A  82  .  ?        ?  
1469  15  1  A  83  GLN  A  83  .  ?        ?  
1470  15  1  A  84  ASP  A  84  .  ?        ?  
1471  15  1  A  85  ALA  A  85  .  ?        ?  
1472  15  1  A  86  LYS  A  86  .  ?        ?  
1473  15  1  A  87  LEU  A  87  .  ?        ?  
1474  15  1  A  88  LYS  A  88  .  ?        ?  
1475  15  1  A  89  ALA  A  89  .  ?        ?  
1476  15  1  A  90  GLU  A  90  .  ?        ?  
1477  15  1  A  91  GLY  A  91  .  ?        ?  
1478  15  1  A  92  LEU  A  92  .  ?        ?  
1479  15  1  A  93  GLU  A  93  .  ?        ?  
1480  15  1  A  94  HIS  A  94  .  ?        ?  
1481  15  1  A  95  HIS  A  95  .  ?        ?  
1482  15  1  A  96  HIS  A  96  .  ?        ?  
1483  15  1  A  97  HIS  A  97  .  ?        ?  
1484  15  1  A  98  HIS  A  98  .  ?        ?  
1485  15  1  A  99  HIS  A  99  .  ?        ?  
1486  16  1  A   1  GLU  A   1  .  ?        ?  
1487  16  1  A   2  ASP  A   2  .  ?        ?  
1488  16  1  A   3  PRO  A   3  .  ?        ?  
1489  16  1  A   4  GLU  A   4  .  ?        ?  
1490  16  1  A   5  ASP  A   5  .  ?        ?  
1491  16  1  A   6  PRO  A   6  .  ?        ?  
1492  16  1  A   7  PHE  A   7  .  ?        ?  
1493  16  1  A   8  THR  A   8  .  ?        ?  
1494  16  1  A   9  ARG  A   9  .  ?        ?  
1495  16  1  A  10  TYR  A  10  .  ?        ?  
1496  16  1  A  11  ALA  A  11  .  ?        ?  
1497  16  1  A  12  LEU  A  12  .  ?        ?  
1498  16  1  A  13  ALA  A  13  .  ?        ?  
1499  16  1  A  14  GLN  A  14  .  ?        ?  
1500  16  1  A  15  GLU  A  15  .  ?        ?  
1501  16  1  A  16  HIS  A  16  .  ?        ?  
1502  16  1  A  17  LEU  A  17  .  ?        ?  
1503  16  1  A  18  LYS  A  18  .  ?        ?  
1504  16  1  A  19  HIS  A  19  .  ?        ?  
1505  16  1  A  20  ASP  A  20  .  ?        ?  
1506  16  1  A  21  ASN  A  21  .  ?        1  
1507  16  1  A  22  ALA  A  22  .  ?        ?  
1508  16  1  A  23  SER  A  23  .  ?        ?  
1509  16  1  A  24  ARG  A  24  .  ?        1  
1510  16  1  A  25  ALA  A  25  .  ?        ?  
1511  16  1  A  26  LEU  A  26  .  ?        ?  
1512  16  1  A  27  ALA  A  27  .  ?        ?  
1513  16  1  A  28  LEU  A  28  .  ?        1  
1514  16  1  A  29  PHE  A  29  .  ?        ?  
1515  16  1  A  30  GLU  A  30  .  ?        ?  
1516  16  1  A  31  GLU  A  31  .  ?        ?  
1517  16  1  A  32  LEU  A  32  .  ?        1  
1518  16  1  A  33  VAL  A  33  .  ?        ?  
1519  16  1  A  34  GLU  A  34  .  ?        ?  
1520  16  1  A  35  THR  A  35  .  ?        ?  
1521  16  1  A  36  ASP  A  36  .  ?        ?  
1522  16  1  A  37  PRO  A  37  .  ?        ?  
1523  16  1  A  38  ASP  A  38  .  ?        ?  
1524  16  1  A  39  TYR  A  39  .  ?        ?  
1525  16  1  A  40  VAL  A  40  .  ?        ?  
1526  16  1  A  41  GLY  A  41  .  ?        ?  
1527  16  1  A  42  THR  A  42  .  ?        ?  
1528  16  1  A  43  TYR  A  43  .  ?        ?  
1529  16  1  A  44  TYR  A  44  .  ?        1  
1530  16  1  A  45  HIS  A  45  .  ?        ?  
1531  16  1  A  46  LEU  A  46  .  ?        ?  
1532  16  1  A  47  GLY  A  47  .  ?        ?  
1533  16  1  A  48  LYS  A  48  .  ?        1  
1534  16  1  A  49  LEU  A  49  .  ?        ?  
1535  16  1  A  50  TYR  A  50  .  ?        ?  
1536  16  1  A  51  GLU  A  51  .  ?        ?  
1537  16  1  A  52  ARG  A  52  .  ?        ?  
1538  16  1  A  53  LEU  A  53  .  ?        ?  
1539  16  1  A  54  ASP  A  54  .  ?        ?  
1540  16  1  A  55  ARG  A  55  .  ?        ?  
1541  16  1  A  56  THR  A  56  .  ?        ?  
1542  16  1  A  57  ASP  A  57  .  ?        ?  
1543  16  1  A  58  ASP  A  58  .  ?        ?  
1544  16  1  A  59  ALA  A  59  .  ?        ?  
1545  16  1  A  60  ILE  A  60  .  ?        ?  
1546  16  1  A  61  ASP  A  61  .  ?        ?  
1547  16  1  A  62  THR  A  62  .  ?        ?  
1548  16  1  A  63  TYR  A  63  .  ?        ?  
1549  16  1  A  64  ALA  A  64  .  ?        ?  
1550  16  1  A  65  GLN  A  65  .  ?        ?  
1551  16  1  A  66  GLY  A  66  .  ?        ?  
1552  16  1  A  67  ILE  A  67  .  ?        ?  
1553  16  1  A  68  GLU  A  68  .  ?        ?  
1554  16  1  A  69  VAL  A  69  .  ?        ?  
1555  16  1  A  70  ALA  A  70  .  ?        ?  
1556  16  1  A  71  ARG  A  71  .  ?        ?  
1557  16  1  A  72  GLU  A  72  .  ?        ?  
1558  16  1  A  73  GLU  A  73  .  ?        ?  
1559  16  1  A  74  GLY  A  74  .  ?        ?  
1560  16  1  A  75  THR  A  75  .  ?        ?  
1561  16  1  A  76  GLN  A  76  .  ?        ?  
1562  16  1  A  77  LYS  A  77  .  ?        ?  
1563  16  1  A  78  ASP  A  78  .  ?        ?  
1564  16  1  A  79  LEU  A  79  .  ?        ?  
1565  16  1  A  80  SER  A  80  .  ?        ?  
1566  16  1  A  81  GLU  A  81  .  ?        ?  
1567  16  1  A  82  LEU  A  82  .  ?        ?  
1568  16  1  A  83  GLN  A  83  .  ?        ?  
1569  16  1  A  84  ASP  A  84  .  ?        ?  
1570  16  1  A  85  ALA  A  85  .  ?        ?  
1571  16  1  A  86  LYS  A  86  .  ?        ?  
1572  16  1  A  87  LEU  A  87  .  ?        ?  
1573  16  1  A  88  LYS  A  88  .  ?        ?  
1574  16  1  A  89  ALA  A  89  .  ?        ?  
1575  16  1  A  90  GLU  A  90  .  ?        ?  
1576  16  1  A  91  GLY  A  91  .  ?        ?  
1577  16  1  A  92  LEU  A  92  .  ?        ?  
1578  16  1  A  93  GLU  A  93  .  ?        ?  
1579  16  1  A  94  HIS  A  94  .  ?        ?  
1580  16  1  A  95  HIS  A  95  .  ?        ?  
1581  16  1  A  96  HIS  A  96  .  ?        ?  
1582  16  1  A  97  HIS  A  97  .  ?        ?  
1583  16  1  A  98  HIS  A  98  .  ?        ?  
1584  16  1  A  99  HIS  A  99  .  ?        ?  
1585  17  1  A   1  GLU  A   1  .  ?        ?  
1586  17  1  A   2  ASP  A   2  .  ?        ?  
1587  17  1  A   3  PRO  A   3  .  ?        ?  
1588  17  1  A   4  GLU  A   4  .  ?        ?  
1589  17  1  A   5  ASP  A   5  .  ?        ?  
1590  17  1  A   6  PRO  A   6  .  ?        ?  
1591  17  1  A   7  PHE  A   7  .  ?        ?  
1592  17  1  A   8  THR  A   8  .  ?        ?  
1593  17  1  A   9  ARG  A   9  .  ?        1  
1594  17  1  A  10  TYR  A  10  .  ?        ?  
1595  17  1  A  11  ALA  A  11  .  ?        ?  
1596  17  1  A  12  LEU  A  12  .  ?        ?  
1597  17  1  A  13  ALA  A  13  .  ?        ?  
1598  17  1  A  14  GLN  A  14  .  ?        ?  
1599  17  1  A  15  GLU  A  15  .  ?        ?  
1600  17  1  A  16  HIS  A  16  .  ?        ?  
1601  17  1  A  17  LEU  A  17  .  ?        ?  
1602  17  1  A  18  LYS  A  18  .  ?        ?  
1603  17  1  A  19  HIS  A  19  .  ?        ?  
1604  17  1  A  20  ASP  A  20  .  ?        ?  
1605  17  1  A  21  ASN  A  21  .  ?        ?  
1606  17  1  A  22  ALA  A  22  .  ?        ?  
1607  17  1  A  23  SER  A  23  .  ?        ?  
1608  17  1  A  24  ARG  A  24  .  ?        ?  
1609  17  1  A  25  ALA  A  25  .  ?        ?  
1610  17  1  A  26  LEU  A  26  .  ?        ?  
1611  17  1  A  27  ALA  A  27  .  ?        ?  
1612  17  1  A  28  LEU  A  28  .  ?        ?  
1613  17  1  A  29  PHE  A  29  .  ?        ?  
1614  17  1  A  30  GLU  A  30  .  ?        ?  
1615  17  1  A  31  GLU  A  31  .  ?        1  
1616  17  1  A  32  LEU  A  32  .  ?        ?  
1617  17  1  A  33  VAL  A  33  .  ?        ?  
1618  17  1  A  34  GLU  A  34  .  ?        ?  
1619  17  1  A  35  THR  A  35  .  ?        ?  
1620  17  1  A  36  ASP  A  36  .  ?        ?  
1621  17  1  A  37  PRO  A  37  .  ?        ?  
1622  17  1  A  38  ASP  A  38  .  ?        ?  
1623  17  1  A  39  TYR  A  39  .  ?        ?  
1624  17  1  A  40  VAL  A  40  .  ?        ?  
1625  17  1  A  41  GLY  A  41  .  ?        ?  
1626  17  1  A  42  THR  A  42  .  ?        ?  
1627  17  1  A  43  TYR  A  43  .  ?        ?  
1628  17  1  A  44  TYR  A  44  .  ?        ?  
1629  17  1  A  45  HIS  A  45  .  ?        ?  
1630  17  1  A  46  LEU  A  46  .  ?        ?  
1631  17  1  A  47  GLY  A  47  .  ?        ?  
1632  17  1  A  48  LYS  A  48  .  ?        ?  
1633  17  1  A  49  LEU  A  49  .  ?        ?  
1634  17  1  A  50  TYR  A  50  .  ?        ?  
1635  17  1  A  51  GLU  A  51  .  ?        ?  
1636  17  1  A  52  ARG  A  52  .  ?        ?  
1637  17  1  A  53  LEU  A  53  .  ?        ?  
1638  17  1  A  54  ASP  A  54  .  ?        ?  
1639  17  1  A  55  ARG  A  55  .  ?        ?  
1640  17  1  A  56  THR  A  56  .  ?        ?  
1641  17  1  A  57  ASP  A  57  .  ?        ?  
1642  17  1  A  58  ASP  A  58  .  ?        ?  
1643  17  1  A  59  ALA  A  59  .  ?        ?  
1644  17  1  A  60  ILE  A  60  .  ?        ?  
1645  17  1  A  61  ASP  A  61  .  ?        ?  
1646  17  1  A  62  THR  A  62  .  ?        ?  
1647  17  1  A  63  TYR  A  63  .  ?        ?  
1648  17  1  A  64  ALA  A  64  .  ?        ?  
1649  17  1  A  65  GLN  A  65  .  ?        ?  
1650  17  1  A  66  GLY  A  66  .  ?        ?  
1651  17  1  A  67  ILE  A  67  .  ?        1  
1652  17  1  A  68  GLU  A  68  .  ?        ?  
1653  17  1  A  69  VAL  A  69  .  ?        ?  
1654  17  1  A  70  ALA  A  70  .  ?        ?  
1655  17  1  A  71  ARG  A  71  .  ?        ?  
1656  17  1  A  72  GLU  A  72  .  ?        ?  
1657  17  1  A  73  GLU  A  73  .  ?        ?  
1658  17  1  A  74  GLY  A  74  .  ?        ?  
1659  17  1  A  75  THR  A  75  .  ?        ?  
1660  17  1  A  76  GLN  A  76  .  ?        ?  
1661  17  1  A  77  LYS  A  77  .  ?        ?  
1662  17  1  A  78  ASP  A  78  .  ?        ?  
1663  17  1  A  79  LEU  A  79  .  ?        ?  
1664  17  1  A  80  SER  A  80  .  ?        ?  
1665  17  1  A  81  GLU  A  81  .  ?        ?  
1666  17  1  A  82  LEU  A  82  .  ?        ?  
1667  17  1  A  83  GLN  A  83  .  ?        1  
1668  17  1  A  84  ASP  A  84  .  ?        ?  
1669  17  1  A  85  ALA  A  85  .  ?        ?  
1670  17  1  A  86  LYS  A  86  .  ?        ?  
1671  17  1  A  87  LEU  A  87  .  ?        ?  
1672  17  1  A  88  LYS  A  88  .  ?        ?  
1673  17  1  A  89  ALA  A  89  .  ?        ?  
1674  17  1  A  90  GLU  A  90  .  ?        ?  
1675  17  1  A  91  GLY  A  91  .  ?        ?  
1676  17  1  A  92  LEU  A  92  .  ?        ?  
1677  17  1  A  93  GLU  A  93  .  ?        ?  
1678  17  1  A  94  HIS  A  94  .  ?        ?  
1679  17  1  A  95  HIS  A  95  .  ?        ?  
1680  17  1  A  96  HIS  A  96  .  ?        ?  
1681  17  1  A  97  HIS  A  97  .  ?        ?  
1682  17  1  A  98  HIS  A  98  .  ?        ?  
1683  17  1  A  99  HIS  A  99  .  ?        ?  
1684  18  1  A   1  GLU  A   1  .  ?        ?  
1685  18  1  A   2  ASP  A   2  .  ?        ?  
1686  18  1  A   3  PRO  A   3  .  ?        ?  
1687  18  1  A   4  GLU  A   4  .  ?        ?  
1688  18  1  A   5  ASP  A   5  .  ?        ?  
1689  18  1  A   6  PRO  A   6  .  ?        ?  
1690  18  1  A   7  PHE  A   7  .  ?        ?  
1691  18  1  A   8  THR  A   8  .  ?        ?  
1692  18  1  A   9  ARG  A   9  .  ?        ?  
1693  18  1  A  10  TYR  A  10  .  ?        ?  
1694  18  1  A  11  ALA  A  11  .  ?        ?  
1695  18  1  A  12  LEU  A  12  .  ?        ?  
1696  18  1  A  13  ALA  A  13  .  ?        ?  
1697  18  1  A  14  GLN  A  14  .  ?        ?  
1698  18  1  A  15  GLU  A  15  .  ?        ?  
1699  18  1  A  16  HIS  A  16  .  ?        ?  
1700  18  1  A  17  LEU  A  17  .  ?        ?  
1701  18  1  A  18  LYS  A  18  .  ?        ?  
1702  18  1  A  19  HIS  A  19  .  ?        ?  
1703  18  1  A  20  ASP  A  20  .  ?        ?  
1704  18  1  A  21  ASN  A  21  .  ?        1  
1705  18  1  A  22  ALA  A  22  .  ?        ?  
1706  18  1  A  23  SER  A  23  .  ?        ?  
1707  18  1  A  24  ARG  A  24  .  ?        1  
1708  18  1  A  25  ALA  A  25  .  ?        ?  
1709  18  1  A  26  LEU  A  26  .  ?        ?  
1710  18  1  A  27  ALA  A  27  .  ?        ?  
1711  18  1  A  28  LEU  A  28  .  ?        ?  
1712  18  1  A  29  PHE  A  29  .  ?        ?  
1713  18  1  A  30  GLU  A  30  .  ?        ?  
1714  18  1  A  31  GLU  A  31  .  ?        1  
1715  18  1  A  32  LEU  A  32  .  ?        ?  
1716  18  1  A  33  VAL  A  33  .  ?        ?  
1717  18  1  A  34  GLU  A  34  .  ?        1  
1718  18  1  A  35  THR  A  35  .  ?        ?  
1719  18  1  A  36  ASP  A  36  .  ?        ?  
1720  18  1  A  37  PRO  A  37  .  ?        ?  
1721  18  1  A  38  ASP  A  38  .  ?        ?  
1722  18  1  A  39  TYR  A  39  .  ?        ?  
1723  18  1  A  40  VAL  A  40  .  ?        ?  
1724  18  1  A  41  GLY  A  41  .  ?        ?  
1725  18  1  A  42  THR  A  42  .  ?        ?  
1726  18  1  A  43  TYR  A  43  .  ?        ?  
1727  18  1  A  44  TYR  A  44  .  ?        1  
1728  18  1  A  45  HIS  A  45  .  ?        ?  
1729  18  1  A  46  LEU  A  46  .  ?        ?  
1730  18  1  A  47  GLY  A  47  .  ?        ?  
1731  18  1  A  48  LYS  A  48  .  ?        1  
1732  18  1  A  49  LEU  A  49  .  ?        ?  
1733  18  1  A  50  TYR  A  50  .  ?        ?  
1734  18  1  A  51  GLU  A  51  .  ?        ?  
1735  18  1  A  52  ARG  A  52  .  ?        ?  
1736  18  1  A  53  LEU  A  53  .  ?        ?  
1737  18  1  A  54  ASP  A  54  .  ?        ?  
1738  18  1  A  55  ARG  A  55  .  ?        ?  
1739  18  1  A  56  THR  A  56  .  ?        ?  
1740  18  1  A  57  ASP  A  57  .  ?        ?  
1741  18  1  A  58  ASP  A  58  .  ?        ?  
1742  18  1  A  59  ALA  A  59  .  ?        ?  
1743  18  1  A  60  ILE  A  60  .  ?        ?  
1744  18  1  A  61  ASP  A  61  .  ?        ?  
1745  18  1  A  62  THR  A  62  .  ?        ?  
1746  18  1  A  63  TYR  A  63  .  ?        ?  
1747  18  1  A  64  ALA  A  64  .  ?        ?  
1748  18  1  A  65  GLN  A  65  .  ?        ?  
1749  18  1  A  66  GLY  A  66  .  ?        ?  
1750  18  1  A  67  ILE  A  67  .  ?        ?  
1751  18  1  A  68  GLU  A  68  .  ?        ?  
1752  18  1  A  69  VAL  A  69  .  ?        ?  
1753  18  1  A  70  ALA  A  70  .  ?        ?  
1754  18  1  A  71  ARG  A  71  .  ?        ?  
1755  18  1  A  72  GLU  A  72  .  ?        ?  
1756  18  1  A  73  GLU  A  73  .  ?        ?  
1757  18  1  A  74  GLY  A  74  .  ?        ?  
1758  18  1  A  75  THR  A  75  .  ?        ?  
1759  18  1  A  76  GLN  A  76  .  ?        ?  
1760  18  1  A  77  LYS  A  77  .  ?        ?  
1761  18  1  A  78  ASP  A  78  .  ?        ?  
1762  18  1  A  79  LEU  A  79  .  ?        ?  
1763  18  1  A  80  SER  A  80  .  ?        ?  
1764  18  1  A  81  GLU  A  81  .  ?        ?  
1765  18  1  A  82  LEU  A  82  .  ?        ?  
1766  18  1  A  83  GLN  A  83  .  ?        ?  
1767  18  1  A  84  ASP  A  84  .  ?        ?  
1768  18  1  A  85  ALA  A  85  .  ?        ?  
1769  18  1  A  86  LYS  A  86  .  ?        ?  
1770  18  1  A  87  LEU  A  87  .  ?        ?  
1771  18  1  A  88  LYS  A  88  .  ?        ?  
1772  18  1  A  89  ALA  A  89  .  ?        ?  
1773  18  1  A  90  GLU  A  90  .  ?        ?  
1774  18  1  A  91  GLY  A  91  .  ?        ?  
1775  18  1  A  92  LEU  A  92  .  ?        ?  
1776  18  1  A  93  GLU  A  93  .  ?        ?  
1777  18  1  A  94  HIS  A  94  .  ?        ?  
1778  18  1  A  95  HIS  A  95  .  ?        ?  
1779  18  1  A  96  HIS  A  96  .  ?        ?  
1780  18  1  A  97  HIS  A  97  .  ?        ?  
1781  18  1  A  98  HIS  A  98  .  ?        ?  
1782  18  1  A  99  HIS  A  99  .  ?        ?  
1783  19  1  A   1  GLU  A   1  .  ?        ?  
1784  19  1  A   2  ASP  A   2  .  ?        ?  
1785  19  1  A   3  PRO  A   3  .  ?        1  
1786  19  1  A   4  GLU  A   4  .  ?        ?  
1787  19  1  A   5  ASP  A   5  .  ?        ?  
1788  19  1  A   6  PRO  A   6  .  ?        ?  
1789  19  1  A   7  PHE  A   7  .  ?        ?  
1790  19  1  A   8  THR  A   8  .  ?        ?  
1791  19  1  A   9  ARG  A   9  .  ?        1  
1792  19  1  A  10  TYR  A  10  .  ?        ?  
1793  19  1  A  11  ALA  A  11  .  ?        ?  
1794  19  1  A  12  LEU  A  12  .  ?        ?  
1795  19  1  A  13  ALA  A  13  .  ?        ?  
1796  19  1  A  14  GLN  A  14  .  ?        ?  
1797  19  1  A  15  GLU  A  15  .  ?        ?  
1798  19  1  A  16  HIS  A  16  .  ?        ?  
1799  19  1  A  17  LEU  A  17  .  ?        ?  
1800  19  1  A  18  LYS  A  18  .  ?        ?  
1801  19  1  A  19  HIS  A  19  .  ?        ?  
1802  19  1  A  20  ASP  A  20  .  ?        ?  
1803  19  1  A  21  ASN  A  21  .  ?        ?  
1804  19  1  A  22  ALA  A  22  .  ?        ?  
1805  19  1  A  23  SER  A  23  .  ?        ?  
1806  19  1  A  24  ARG  A  24  .  ?        ?  
1807  19  1  A  25  ALA  A  25  .  ?        ?  
1808  19  1  A  26  LEU  A  26  .  ?        ?  
1809  19  1  A  27  ALA  A  27  .  ?        ?  
1810  19  1  A  28  LEU  A  28  .  ?        ?  
1811  19  1  A  29  PHE  A  29  .  ?        ?  
1812  19  1  A  30  GLU  A  30  .  ?        ?  
1813  19  1  A  31  GLU  A  31  .  ?        ?  
1814  19  1  A  32  LEU  A  32  .  ?        ?  
1815  19  1  A  33  VAL  A  33  .  ?        ?  
1816  19  1  A  34  GLU  A  34  .  ?        ?  
1817  19  1  A  35  THR  A  35  .  ?        ?  
1818  19  1  A  36  ASP  A  36  .  ?        ?  
1819  19  1  A  37  PRO  A  37  .  ?        ?  
1820  19  1  A  38  ASP  A  38  .  ?        ?  
1821  19  1  A  39  TYR  A  39  .  ?        ?  
1822  19  1  A  40  VAL  A  40  .  ?        ?  
1823  19  1  A  41  GLY  A  41  .  ?        ?  
1824  19  1  A  42  THR  A  42  .  ?        ?  
1825  19  1  A  43  TYR  A  43  .  ?        ?  
1826  19  1  A  44  TYR  A  44  .  ?        1  
1827  19  1  A  45  HIS  A  45  .  ?        ?  
1828  19  1  A  46  LEU  A  46  .  ?        ?  
1829  19  1  A  47  GLY  A  47  .  ?        ?  
1830  19  1  A  48  LYS  A  48  .  ?        1  
1831  19  1  A  49  LEU  A  49  .  ?        ?  
1832  19  1  A  50  TYR  A  50  .  ?        ?  
1833  19  1  A  51  GLU  A  51  .  ?        ?  
1834  19  1  A  52  ARG  A  52  .  ?        ?  
1835  19  1  A  53  LEU  A  53  .  ?        ?  
1836  19  1  A  54  ASP  A  54  .  ?        ?  
1837  19  1  A  55  ARG  A  55  .  ?        ?  
1838  19  1  A  56  THR  A  56  .  ?        ?  
1839  19  1  A  57  ASP  A  57  .  ?        ?  
1840  19  1  A  58  ASP  A  58  .  ?        ?  
1841  19  1  A  59  ALA  A  59  .  ?        ?  
1842  19  1  A  60  ILE  A  60  .  ?        ?  
1843  19  1  A  61  ASP  A  61  .  ?        ?  
1844  19  1  A  62  THR  A  62  .  ?        ?  
1845  19  1  A  63  TYR  A  63  .  ?        ?  
1846  19  1  A  64  ALA  A  64  .  ?        ?  
1847  19  1  A  65  GLN  A  65  .  ?        ?  
1848  19  1  A  66  GLY  A  66  .  ?        ?  
1849  19  1  A  67  ILE  A  67  .  ?        ?  
1850  19  1  A  68  GLU  A  68  .  ?        ?  
1851  19  1  A  69  VAL  A  69  .  ?        ?  
1852  19  1  A  70  ALA  A  70  .  ?        ?  
1853  19  1  A  71  ARG  A  71  .  ?        ?  
1854  19  1  A  72  GLU  A  72  .  ?        ?  
1855  19  1  A  73  GLU  A  73  .  ?        ?  
1856  19  1  A  74  GLY  A  74  .  ?        ?  
1857  19  1  A  75  THR  A  75  .  ?        ?  
1858  19  1  A  76  GLN  A  76  .  ?        ?  
1859  19  1  A  77  LYS  A  77  .  ?        ?  
1860  19  1  A  78  ASP  A  78  .  ?        ?  
1861  19  1  A  79  LEU  A  79  .  ?        ?  
1862  19  1  A  80  SER  A  80  .  ?        ?  
1863  19  1  A  81  GLU  A  81  .  ?        ?  
1864  19  1  A  82  LEU  A  82  .  ?        ?  
1865  19  1  A  83  GLN  A  83  .  ?        ?  
1866  19  1  A  84  ASP  A  84  .  ?        ?  
1867  19  1  A  85  ALA  A  85  .  ?        ?  
1868  19  1  A  86  LYS  A  86  .  ?        ?  
1869  19  1  A  87  LEU  A  87  .  ?        ?  
1870  19  1  A  88  LYS  A  88  .  ?        ?  
1871  19  1  A  89  ALA  A  89  .  ?        ?  
1872  19  1  A  90  GLU  A  90  .  ?        ?  
1873  19  1  A  91  GLY  A  91  .  ?        ?  
1874  19  1  A  92  LEU  A  92  .  ?        ?  
1875  19  1  A  93  GLU  A  93  .  ?        ?  
1876  19  1  A  94  HIS  A  94  .  ?        ?  
1877  19  1  A  95  HIS  A  95  .  ?        1  
1878  19  1  A  96  HIS  A  96  .  ?        ?  
1879  19  1  A  97  HIS  A  97  .  ?        1  
1880  19  1  A  98  HIS  A  98  .  ?        ?  
1881  19  1  A  99  HIS  A  99  .  ?        ?  
1882  20  1  A   1  GLU  A   1  .  ?        ?  
1883  20  1  A   2  ASP  A   2  .  ?        ?  
1884  20  1  A   3  PRO  A   3  .  ?        ?  
1885  20  1  A   4  GLU  A   4  .  ?        ?  
1886  20  1  A   5  ASP  A   5  .  ?        ?  
1887  20  1  A   6  PRO  A   6  .  ?        ?  
1888  20  1  A   7  PHE  A   7  .  ?        ?  
1889  20  1  A   8  THR  A   8  .  ?        ?  
1890  20  1  A   9  ARG  A   9  .  ?        ?  
1891  20  1  A  10  TYR  A  10  .  ?        ?  
1892  20  1  A  11  ALA  A  11  .  ?        ?  
1893  20  1  A  12  LEU  A  12  .  ?        ?  
1894  20  1  A  13  ALA  A  13  .  ?        ?  
1895  20  1  A  14  GLN  A  14  .  ?        ?  
1896  20  1  A  15  GLU  A  15  .  ?        ?  
1897  20  1  A  16  HIS  A  16  .  ?        1  
1898  20  1  A  17  LEU  A  17  .  ?        ?  
1899  20  1  A  18  LYS  A  18  .  ?        ?  
1900  20  1  A  19  HIS  A  19  .  ?        ?  
1901  20  1  A  20  ASP  A  20  .  ?        ?  
1902  20  1  A  21  ASN  A  21  .  ?        1  
1903  20  1  A  22  ALA  A  22  .  ?        ?  
1904  20  1  A  23  SER  A  23  .  ?        ?  
1905  20  1  A  24  ARG  A  24  .  ?        ?  
1906  20  1  A  25  ALA  A  25  .  ?        ?  
1907  20  1  A  26  LEU  A  26  .  ?        ?  
1908  20  1  A  27  ALA  A  27  .  ?        ?  
1909  20  1  A  28  LEU  A  28  .  ?        1  
1910  20  1  A  29  PHE  A  29  .  ?        ?  
1911  20  1  A  30  GLU  A  30  .  ?        ?  
1912  20  1  A  31  GLU  A  31  .  ?        ?  
1913  20  1  A  32  LEU  A  32  .  ?        1  
1914  20  1  A  33  VAL  A  33  .  ?        ?  
1915  20  1  A  34  GLU  A  34  .  ?        ?  
1916  20  1  A  35  THR  A  35  .  ?        ?  
1917  20  1  A  36  ASP  A  36  .  ?        ?  
1918  20  1  A  37  PRO  A  37  .  ?        ?  
1919  20  1  A  38  ASP  A  38  .  ?        ?  
1920  20  1  A  39  TYR  A  39  .  ?        ?  
1921  20  1  A  40  VAL  A  40  .  ?        ?  
1922  20  1  A  41  GLY  A  41  .  ?        ?  
1923  20  1  A  42  THR  A  42  .  ?        ?  
1924  20  1  A  43  TYR  A  43  .  ?        ?  
1925  20  1  A  44  TYR  A  44  .  ?        1  
1926  20  1  A  45  HIS  A  45  .  ?        ?  
1927  20  1  A  46  LEU  A  46  .  ?        ?  
1928  20  1  A  47  GLY  A  47  .  ?        ?  
1929  20  1  A  48  LYS  A  48  .  ?        1  
1930  20  1  A  49  LEU  A  49  .  ?        ?  
1931  20  1  A  50  TYR  A  50  .  ?        ?  
1932  20  1  A  51  GLU  A  51  .  ?        ?  
1933  20  1  A  52  ARG  A  52  .  ?        ?  
1934  20  1  A  53  LEU  A  53  .  ?        ?  
1935  20  1  A  54  ASP  A  54  .  ?        ?  
1936  20  1  A  55  ARG  A  55  .  ?        ?  
1937  20  1  A  56  THR  A  56  .  ?        ?  
1938  20  1  A  57  ASP  A  57  .  ?        ?  
1939  20  1  A  58  ASP  A  58  .  ?        ?  
1940  20  1  A  59  ALA  A  59  .  ?        ?  
1941  20  1  A  60  ILE  A  60  .  ?        ?  
1942  20  1  A  61  ASP  A  61  .  ?        ?  
1943  20  1  A  62  THR  A  62  .  ?        ?  
1944  20  1  A  63  TYR  A  63  .  ?        ?  
1945  20  1  A  64  ALA  A  64  .  ?        ?  
1946  20  1  A  65  GLN  A  65  .  ?        ?  
1947  20  1  A  66  GLY  A  66  .  ?        ?  
1948  20  1  A  67  ILE  A  67  .  ?        ?  
1949  20  1  A  68  GLU  A  68  .  ?        ?  
1950  20  1  A  69  VAL  A  69  .  ?        ?  
1951  20  1  A  70  ALA  A  70  .  ?        ?  
1952  20  1  A  71  ARG  A  71  .  ?        ?  
1953  20  1  A  72  GLU  A  72  .  ?        ?  
1954  20  1  A  73  GLU  A  73  .  ?        ?  
1955  20  1  A  74  GLY  A  74  .  ?        ?  
1956  20  1  A  75  THR  A  75  .  ?        ?  
1957  20  1  A  76  GLN  A  76  .  ?        ?  
1958  20  1  A  77  LYS  A  77  .  ?        ?  
1959  20  1  A  78  ASP  A  78  .  ?        ?  
1960  20  1  A  79  LEU  A  79  .  ?        1  
1961  20  1  A  80  SER  A  80  .  ?        ?  
1962  20  1  A  81  GLU  A  81  .  ?        ?  
1963  20  1  A  82  LEU  A  82  .  ?        ?  
1964  20  1  A  83  GLN  A  83  .  ?        1  
1965  20  1  A  84  ASP  A  84  .  ?        ?  
1966  20  1  A  85  ALA  A  85  .  ?        1  
1967  20  1  A  86  LYS  A  86  .  ?        ?  
1968  20  1  A  87  LEU  A  87  .  ?        ?  
1969  20  1  A  88  LYS  A  88  .  ?        1  
1970  20  1  A  89  ALA  A  89  .  ?        ?  
1971  20  1  A  90  GLU  A  90  .  ?        ?  
1972  20  1  A  91  GLY  A  91  .  ?        ?  
1973  20  1  A  92  LEU  A  92  .  ?        ?  
1974  20  1  A  93  GLU  A  93  .  ?        ?  
1975  20  1  A  94  HIS  A  94  .  ?        ?  
1976  20  1  A  95  HIS  A  95  .  ?        ?  
1977  20  1  A  96  HIS  A  96  .  ?        ?  
1978  20  1  A  97  HIS  A  97  .  ?        ?  
1979  20  1  A  98  HIS  A  98  .  ?        ?  
1980  20  1  A  99  HIS  A  99  .  ?        ?  
#
loop_
_pdbx_vrpt_model_instance_geometry.ordinal
_pdbx_vrpt_model_instance_geometry.instance_id
_pdbx_vrpt_model_instance_geometry.rotamer_class
_pdbx_vrpt_model_instance_geometry.phi
_pdbx_vrpt_model_instance_geometry.psi
_pdbx_vrpt_model_instance_geometry.ramachandran_class
_pdbx_vrpt_model_instance_geometry.num_H_reduce
_pdbx_vrpt_model_instance_geometry.num_bonds_RMSZ
_pdbx_vrpt_model_instance_geometry.bonds_RMSZ
_pdbx_vrpt_model_instance_geometry.num_angles_RMSZ
_pdbx_vrpt_model_instance_geometry.angles_RMSZ
_pdbx_vrpt_model_instance_geometry.program_for_bond_angle_geometry
_pdbx_vrpt_model_instance_geometry.cyrange_domain_id
_pdbx_vrpt_model_instance_geometry.validate
   1     1  mm-40         ?       ?  ?         8   9  0.61  12  0.37  molprobity     ?  False  
   2     2  m-20     -103.2   152.8  Favored   4   8  0.31  12  0.50  molprobity     1  True   
   3     3  Cg_endo   -56.3   -16.9  Favored   7   8  0.39  11  0.34  molprobity     1  True   
   4     4  mm-40     -65.7   -40.3  Favored   6   9  0.38  12  0.36  molprobity     1  True   
   5     5  m-20      -63.5   134.3  Favored   4   8  0.38  12  0.59  molprobity     1  True   
   6     6  Cg_exo    -50.7   -56.5  Favored   7   8  0.31  11  0.28  molprobity     1  True   
   7     7  t80       -62.9   -33.4  Favored   9  12  0.37  16  0.17  molprobity     1  True   
   8     8  m         -67.7   -56.2  Favored   7   7  0.47  10  0.65  molprobity     1  True   
   9     9  ptm180    -61.2   -32.2  Favored  13  11  1.23  14  0.53  molprobity     1  True   
  10    10  t80       -61.7   -45.5  Favored   9  13  0.40  18  0.45  molprobity     1  True   
  11    11  ?         -61.2   -45.5  Favored   5   5  0.25   7  0.24  molprobity     1  True   
  12    12  mm?       -57.9   -36.6  Favored  11   8  0.44  11  0.22  molprobity     1  True   
  13    13  ?         -58.2   -45.5  Favored   5   5  0.30   7  0.31  molprobity     1  True   
  14    14  mt-30     -61.9   -43.0  Favored   8   9  0.35  12  0.25  molprobity     1  True   
  15    15  mm-40     -56.3   -43.6  Favored   6   9  0.37  12  0.35  molprobity     1  True   
  16    16  m-70      -57.5   -45.6  Favored   7  11  0.26  15  0.20  molprobity     1  True   
  17    17  mt        -59.5   -37.5  Favored  11   8  0.39  11  0.16  molprobity     1  True   
  18    18  mttt      -59.9   -34.9  Favored  13   9  0.34  11  0.23  molprobity     1  True   
  19    19  m-70      -91.3     5.5  Favored   7  11  0.33  15  0.35  molprobity     1  True   
  20    20  t70        73.8     7.3  Favored   4   8  0.44  11  0.45  molprobity     1  True   
  21    21  m120      -73.5    72.3  Allowed   6   8  0.42  11  0.36  molprobity     1  True   
  22    22  ?         -60.4   -50.7  Favored   5   5  0.31   7  0.25  molprobity     1  True   
  23    23  m         -62.0   -42.0  Favored   5   6  0.49   8  0.21  molprobity     1  True   
  24    24  mmt180    -65.8   -39.2  Favored  13  11  1.17  14  0.30  molprobity     1  True   
  25    25  ?         -66.7   -43.3  Favored   5   5  0.27   7  0.37  molprobity     1  True   
  26    26  tp        -55.2   -48.9  Favored  11   8  0.32  11  0.25  molprobity     1  True   
  27    27  ?         -53.9   -43.5  Favored   5   5  0.29   7  0.20  molprobity     1  True   
  28    28  mt        -64.8   -43.2  Favored  11   8  0.36  11  0.19  molprobity     1  True   
  29    29  m-85      -62.7   -45.8  Favored   9  12  0.38  16  0.22  molprobity     1  True   
  30    30  mt-10     -64.0   -33.5  Favored   6   9  0.41  12  0.38  molprobity     1  True   
  31    31  tt0       -62.8   -47.4  Favored   6   9  0.32  12  0.41  molprobity     1  True   
  32    32  mt        -54.6   -34.8  Favored  11   8  0.37  11  0.23  molprobity     1  True   
  33    33  t         -64.3   -40.5  Favored   9   7  0.38  10  0.39  molprobity     1  True   
  34    34  pt-20     -81.8   -25.6  Favored   6   9  0.40  12  0.36  molprobity     1  True   
  35    35  p         -86.3   -60.4  Favored   7   7  0.53  10  0.65  molprobity     1  True   
  36    36  m-20     -121.0    83.9  Favored   4   8  0.41  12  0.50  molprobity     1  True   
  37    37  Cg_endo   -68.8   -12.7  Favored   7   8  0.39  11  0.21  molprobity     1  True   
  38    38  p-10      -92.6    -2.0  Favored   4   8  0.31  11  0.33  molprobity     1  True   
  39    39  t80       -81.8    90.9  Favored   9  13  0.41  18  0.39  molprobity     1  True   
  40    40  t         -59.9   -38.3  Favored   9   7  0.47  10  0.44  molprobity     1  True   
  41    41  ?         -50.1   -33.1  Favored   3   4  0.61   5  0.27  molprobity     1  True   
  42    42  m         -61.0   -57.1  Favored   7   7  0.36  10  0.60  molprobity     1  True   
  43    43  m-85      -55.3   -42.9  Favored   9  13  0.36  18  0.23  molprobity     1  True   
  44    44  t80       -58.6   -60.5  Favored   9  13  0.40  18  0.19  molprobity     1  True   
  45    45  m-70      -72.6   -29.6  Favored   7  11  0.29  15  0.27  molprobity     1  True   
  46    46  tp        -62.2   -44.1  Favored  11   8  0.41  11  0.28  molprobity     1  True   
  47    47  ?         -61.3   -45.3  Favored   3   4  0.38   5  0.21  molprobity     1  True   
  48    48  mmmp?     -57.5   -40.6  Favored  13   9  0.42  11  0.48  molprobity     1  True   
  49    49  tp        -66.4   -42.0  Favored  11   8  0.36  11  0.21  molprobity     1  True   
  50    50  m-85      -58.2   -41.2  Favored   9  13  0.35  18  0.24  molprobity     1  True   
  51    51  mt-10     -57.0   -47.9  Favored   6   9  0.35  12  0.49  molprobity     1  True   
  52    52  ttt180    -58.9   -36.1  Favored  13  11  1.19  14  0.38  molprobity     1  True   
  53    53  mt        -88.3    14.3  Favored  11   8  0.38  11  0.23  molprobity     1  True   
  54    54  t70        67.0     7.0  Favored   4   8  0.48  11  0.44  molprobity     1  True   
  55    55  mmm180    -82.7    56.1  Favored  13  11  1.16  14  0.60  molprobity     1  True   
  56    56  m         -52.5   -51.8  Favored   7   7  0.55  10  0.52  molprobity     1  True   
  57    57  m-20      -61.3   -40.9  Favored   4   8  0.35  11  0.40  molprobity     1  True   
  58    58  m-20      -62.5   -41.7  Favored   4   8  0.27  11  0.42  molprobity     1  True   
  59    59  ?         -58.4   -53.9  Favored   5   5  0.29   7  0.27  molprobity     1  True   
  60    60  mt        -54.1   -44.0  Favored  11   8  0.34  11  0.39  molprobity     1  True   
  61    61  t70       -61.7   -42.9  Favored   4   8  0.34  11  0.35  molprobity     1  True   
  62    62  m         -62.0   -41.5  Favored   7   7  0.46  10  0.48  molprobity     1  True   
  63    63  m-85      -65.8   -38.7  Favored   9  13  0.35  18  0.25  molprobity     1  True   
  64    64  ?         -58.5   -51.6  Favored   5   5  0.35   7  0.30  molprobity     1  True   
  65    65  mm100     -56.6   -42.1  Favored   8   9  0.40  12  0.31  molprobity     1  True   
  66    66  ?         -57.1   -46.1  Favored   3   4  0.40   5  0.21  molprobity     1  True   
  67    67  mt        -55.3   -47.8  Favored  11   8  0.32  11  0.43  molprobity     1  True   
  68    68  mt-10     -64.6   -50.7  Favored   6   9  0.31  12  0.32  molprobity     1  True   
  69    69  m         -69.4   -26.2  Favored   9   7  0.37  10  0.37  molprobity     1  True   
  70    70  ?         -66.5   -52.3  Favored   5   5  0.30   7  0.25  molprobity     1  True   
  71    71  ptp180    -66.9   -41.9  Favored  13  11  1.16  14  0.29  molprobity     1  True   
  72    72  mm-40     -77.6   -51.5  Favored   6   9  0.42  12  0.37  molprobity     1  True   
  73    73  mm-40     -98.6   -39.1  Favored   6   9  0.46  12  0.53  molprobity     1  True   
  74    74  ?         -91.2  -120.8  Favored   3   4  0.51   5  0.27  molprobity     1  True   
  75    75  t        -145.9   166.7  Favored   7   7  0.51  10  0.63  molprobity     1  True   
  76    76  tm0?      -61.5   -31.4  Favored   8   9  0.43  12  0.44  molprobity     1  True   
  77    77  tttm      -55.6   -52.7  Favored  13   9  0.37  11  0.29  molprobity     1  True   
  78    78  m-20      -71.2   -33.9  Favored   4   8  0.21  11  0.40  molprobity     1  True   
  79    79  tp        -52.5   -52.0  Favored  11   8  0.36  11  0.28  molprobity     1  True   
  80    80  t         -60.6   -47.8  Favored   5   6  0.46   8  0.24  molprobity     1  True   
  81    81  mt-10     -59.9   -42.4  Favored   6   9  0.38  12  0.40  molprobity     1  True   
  82    82  mt        -70.6   -41.0  Favored  11   8  0.39  11  0.26  molprobity     1  True   
  83    83  mt-30     -60.2   -47.1  Favored   8   9  0.38  12  0.33  molprobity     1  True   
  84    84  t70       -62.7   -39.5  Favored   4   8  0.30  11  0.37  molprobity     1  True   
  85    85  ?         -58.9   -50.2  Favored   5   5  0.29   7  0.29  molprobity     1  True   
  86    86  pttp      -71.0   -33.7  Favored  13   9  0.30  11  0.25  molprobity     1  True   
  87    87  tp        -60.0   -54.5  Favored  11   8  0.41  11  0.20  molprobity     1  True   
  88    88  OUTLIER   -61.5   -31.1  Favored  13   9  0.39  11  0.34  molprobity     1  True   
  89    89  ?         -67.2   -48.4  Favored   5   5  0.37   7  0.25  molprobity     1  True   
  90    90  mt-10     -63.1   -21.6  Favored   6   9  0.39  12  0.38  molprobity     1  True   
  91    91  ?         -85.3   -18.5  Favored   3   4  0.49   5  0.09  molprobity     1  True   
  92    92  mt        -61.7   -69.4  Allowed  11   8  0.43  11  0.22  molprobity     1  True   
  93    93  OUTLIER  -102.1   147.4  Favored   6   9  0.46  12  0.44  molprobity     ?  False  
  94    94  t-160     -89.2    74.4  Favored   7  11  0.31  15  0.32  molprobity     ?  False  
  95    95  p-80      -54.4   128.6  Favored   7  11  0.31  15  0.30  molprobity     ?  False  
  96    96  m-70      -76.4    98.8  Favored   7  11  0.27  15  0.31  molprobity     ?  False  
  97    97  t-80     -120.4   102.1  Favored   7  11  0.28  15  0.24  molprobity     ?  False  
  98    98  t60       -66.4   126.5  Favored   7  11  0.26  15  0.27  molprobity     ?  False  
  99    99  t60           ?       ?  ?         7  11  0.65  12  0.31  molprobity     ?  False  
 100   100  mt-10         ?       ?  ?         8   9  0.69  12  0.45  molprobity     ?  False  
 101   101  m-20     -102.5   155.2  Favored   4   8  0.33  12  0.54  molprobity     1  True   
 102   102  Cg_endo   -56.5   -12.0  Favored   7   8  0.54  11  0.29  molprobity     1  True   
 103   103  mt-10     -73.5   -29.9  Favored   6   9  0.40  12  0.33  molprobity     1  True   
 104   104  m-20      -64.4   129.6  Favored   4   8  0.39  12  0.53  molprobity     1  True   
 105   105  Cg_endo   -49.3   -39.3  Favored   7   8  0.40  11  0.32  molprobity     1  True   
 106   106  t80       -71.3   -42.4  Favored   9  12  0.37  16  0.16  molprobity     1  True   
 107   107  m         -61.6   -55.4  Favored   7   7  0.42  10  0.64  molprobity     1  True   
 108   108  ptm85     -56.7   -35.0  Favored  13  11  1.19  14  0.54  molprobity     1  True   
 109   109  t80       -65.0   -44.9  Favored   9  13  0.41  18  0.30  molprobity     1  True   
 110   110  ?         -61.5   -44.9  Favored   5   5  0.30   7  0.17  molprobity     1  True   
 111   111  mm?       -59.5   -40.7  Favored  11   8  0.41  11  0.17  molprobity     1  True   
 112   112  ?         -53.4   -49.0  Favored   5   5  0.33   7  0.28  molprobity     1  True   
 113   113  mt-30     -65.9   -34.9  Favored   8   9  0.36  12  0.18  molprobity     1  True   
 114   114  mm-40     -56.7   -44.9  Favored   6   9  0.39  12  0.39  molprobity     1  True   
 115   115  m-70      -59.1   -41.5  Favored   7  11  0.28  15  0.19  molprobity     1  True   
 116   116  mt        -60.2   -46.2  Favored  11   8  0.44  11  0.31  molprobity     1  True   
 117   117  mtpp      -64.4   -22.9  Favored  13   9  0.35  11  0.26  molprobity     1  True   
 118   118  m-70     -105.2    29.4  Favored   7  11  0.33  15  0.26  molprobity     1  True   
 119   119  t70        73.7   -21.0  Allowed   4   8  0.56  11  0.49  molprobity     1  True   
 120   120  m120      -72.2    76.5  Allowed   6   8  0.45  11  0.35  molprobity     1  True   
 121   121  ?         -66.8   -47.4  Favored   5   5  0.33   7  0.20  molprobity     1  True   
 122   122  m         -63.3   -40.4  Favored   5   6  0.46   8  0.23  molprobity     1  True   
 123   123  mmt180    -66.8   -35.8  Favored  13  11  1.20  14  0.37  molprobity     1  True   
 124   124  ?         -66.8   -46.1  Favored   5   5  0.20   7  0.37  molprobity     1  True   
 125   125  tp        -51.0   -47.9  Favored  11   8  0.35  11  0.23  molprobity     1  True   
 126   126  ?         -54.9   -43.4  Favored   5   5  0.40   7  0.23  molprobity     1  True   
 127   127  mt        -67.0   -44.1  Favored  11   8  0.37  11  0.18  molprobity     1  True   
 128   128  m-85      -60.1   -46.4  Favored   9  12  0.40  16  0.22  molprobity     1  True   
 129   129  mt-10     -58.6   -39.0  Favored   6   9  0.36  12  0.37  molprobity     1  True   
 130   130  tt0       -63.8   -46.3  Favored   6   9  0.35  12  0.37  molprobity     1  True   
 131   131  mt        -53.4   -39.4  Favored  11   8  0.37  11  0.27  molprobity     1  True   
 132   132  t         -55.3   -48.2  Favored   9   7  0.38  10  0.49  molprobity     1  True   
 133   133  pt-20     -82.4   -36.3  Favored   6   9  0.35  12  0.39  molprobity     1  True   
 134   134  p         -79.4   -47.3  Favored   7   7  0.52  10  0.60  molprobity     1  True   
 135   135  m-20     -122.5    79.5  Favored   4   8  0.45  12  0.51  molprobity     1  True   
 136   136  Cg_endo   -74.2   -15.4  Favored   7   8  0.39  11  0.30  molprobity     1  True   
 137   137  p-10      -83.2    -6.9  Favored   4   8  0.30  11  0.31  molprobity     1  True   
 138   138  t80       -98.4    90.7  Favored   9  13  0.37  18  0.32  molprobity     1  True   
 139   139  t         -66.1   -31.7  Favored   9   7  0.42  10  0.41  molprobity     1  True   
 140   140  ?         -47.4   -34.8  Favored   3   4  0.54   5  0.22  molprobity     1  True   
 141   141  m         -59.9   -54.5  Favored   7   7  0.37  10  0.65  molprobity     1  True   
 142   142  m-85      -57.3   -44.6  Favored   9  13  0.35  18  0.26  molprobity     1  True   
 143   143  t80       -63.1   -52.1  Favored   9  13  0.39  18  0.29  molprobity     1  True   
 144   144  m-70      -72.5   -32.1  Favored   7  11  0.27  15  0.21  molprobity     1  True   
 145   145  tp        -61.0   -45.4  Favored  11   8  0.36  11  0.26  molprobity     1  True   
 146   146  ?         -56.0   -46.1  Favored   3   4  0.37   5  0.18  molprobity     1  True   
 147   147  mmmp?     -58.0   -39.5  Favored  13   9  0.46  11  0.39  molprobity     1  True   
 148   148  tp        -65.3   -38.7  Favored  11   8  0.39  11  0.21  molprobity     1  True   
 149   149  m-85      -64.0   -47.5  Favored   9  13  0.33  18  0.30  molprobity     1  True   
 150   150  mt-10     -53.5   -39.4  Favored   6   9  0.48  12  0.53  molprobity     1  True   
 151   151  ttt180    -64.1   -46.1  Favored  13  11  1.11  14  0.44  molprobity     1  True   
 152   152  mt        -81.6    16.3  Allowed  11   8  0.44  11  0.27  molprobity     1  True   
 153   153  t70        68.4    10.7  Favored   4   8  0.44  11  0.42  molprobity     1  True   
 154   154  mmm180    -89.0    58.8  Favored  13  11  1.17  14  0.81  molprobity     1  True   
 155   155  m         -55.7   -44.9  Favored   7   7  0.49  10  0.50  molprobity     1  True   
 156   156  m-20      -60.3   -49.7  Favored   4   8  0.32  11  0.39  molprobity     1  True   
 157   157  m-20      -58.1   -41.7  Favored   4   8  0.25  11  0.28  molprobity     1  True   
 158   158  ?         -57.9   -55.5  Favored   5   5  0.29   7  0.25  molprobity     1  True   
 159   159  mt        -55.7   -43.4  Favored  11   8  0.34  11  0.42  molprobity     1  True   
 160   160  t70       -61.9   -47.1  Favored   4   8  0.29  11  0.38  molprobity     1  True   
 161   161  m         -57.1   -43.4  Favored   7   7  0.51  10  0.47  molprobity     1  True   
 162   162  m-85      -63.8   -41.9  Favored   9  13  0.35  18  0.39  molprobity     1  True   
 163   163  ?         -59.7   -52.7  Favored   5   5  0.36   7  0.24  molprobity     1  True   
 164   164  OUTLIER   -63.6   -39.9  Favored   8   9  0.50  12  0.52  molprobity     1  True   
 165   165  ?         -57.3   -38.4  Favored   3   4  0.45   5  0.22  molprobity     1  True   
 166   166  mt        -50.8   -44.8  Favored  11   8  0.41  11  0.40  molprobity     1  True   
 167   167  mm-40     -65.6   -56.3  Favored   6   9  0.35  12  0.38  molprobity     1  True   
 168   168  m         -68.5   -24.5  Favored   9   7  0.36  10  0.36  molprobity     1  True   
 169   169  ?         -63.8   -50.9  Favored   5   5  0.28   7  0.26  molprobity     1  True   
 170   170  ptt180    -78.3   -38.8  Favored  13  11  1.15  14  0.36  molprobity     1  True   
 171   171  mt-10     -78.4   -39.9  Favored   6   9  0.46  12  0.36  molprobity     1  True   
 172   172  mm-40     -94.5   -50.1  Favored   6   9  0.47  12  0.43  molprobity     1  True   
 173   173  ?         -81.7   -99.5  Allowed   3   4  0.60   5  0.14  molprobity     1  True   
 174   174  t        -174.4   177.0  Favored   7   7  0.55  10  0.64  molprobity     1  True   
 175   175  tp60      -53.8   -40.1  Favored   8   9  0.51  12  0.49  molprobity     1  True   
 176   176  ttpp      -54.9   -52.4  Favored  13   9  0.42  11  0.36  molprobity     1  True   
 177   177  m-20      -65.6   -34.9  Favored   4   8  0.21  11  0.54  molprobity     1  True   
 178   178  tp        -59.0   -52.0  Favored  11   8  0.33  11  0.24  molprobity     1  True   
 179   179  t         -60.9   -41.0  Favored   5   6  0.41   8  0.19  molprobity     1  True   
 180   180  mt-10     -61.4   -43.9  Favored   6   9  0.39  12  0.32  molprobity     1  True   
 181   181  mt        -70.8   -37.9  Favored  11   8  0.39  11  0.17  molprobity     1  True   
 182   182  mt-30     -60.0   -46.6  Favored   8   9  0.36  12  0.31  molprobity     1  True   
 183   183  t70       -60.6   -40.8  Favored   4   8  0.30  11  0.46  molprobity     1  True   
 184   184  ?         -60.9   -50.4  Favored   5   5  0.27   7  0.36  molprobity     1  True   
 185   185  ptmt      -70.2   -31.6  Favored  13   9  0.38  11  0.31  molprobity     1  True   
 186   186  tp        -59.7   -47.5  Favored  11   8  0.39  11  0.18  molprobity     1  True   
 187   187  pttp      -70.9   -33.2  Favored  13   9  0.38  11  0.20  molprobity     1  True   
 188   188  ?         -60.0   -41.8  Favored   5   5  0.34   7  0.33  molprobity     1  True   
 189   189  mm-40     -62.4   -12.3  Favored   6   9  0.48  12  0.43  molprobity     1  True   
 190   190  ?        -116.8    11.8  Favored   3   4  0.57   5  0.20  molprobity     1  True   
 191   191  mt        -67.3   -51.3  Favored  11   8  0.42  11  0.25  molprobity     1  True   
 192   192  OUTLIER  -125.5  -163.3  Allowed   6   9  0.44  12  0.45  molprobity     ?  False  
 193   193  m80      -115.2    45.2  Allowed   7  11  0.34  15  0.33  molprobity     ?  False  
 194   194  OUTLIER   -59.7    -9.0  Favored   7  11  0.45  15  0.39  molprobity     ?  False  
 195   195  t-80      -64.7   -10.5  Favored   7  11  0.38  15  0.26  molprobity     ?  False  
 196   196  p-80     -162.8   153.3  Favored   7  11  0.30  15  0.22  molprobity     ?  False  
 197   197  p80      -135.4   179.6  Favored   7  11  0.25  15  0.17  molprobity     ?  False  
 198   198  t-80          ?       ?  ?         7  11  0.57  12  0.30  molprobity     ?  False  
 199   199  mt-10         ?       ?  ?         8   9  0.67  12  0.38  molprobity     ?  False  
 200   200  m-20     -100.4   160.3  Favored   4   8  0.38  12  0.55  molprobity     1  True   
 201   201  Cg_exo    -55.3   -11.0  Favored   7   8  0.48  11  0.29  molprobity     1  True   
 202   202  mm-40     -76.5   -42.6  Favored   6   9  0.34  12  0.41  molprobity     1  True   
 203   203  m-20      -61.3   131.5  Favored   4   8  0.40  12  0.53  molprobity     1  True   
 204   204  Cg_endo   -56.5   -30.4  Favored   7   8  0.29  11  0.27  molprobity     1  True   
 205   205  t80       -69.1   -44.3  Favored   9  12  0.39  16  0.16  molprobity     1  True   
 206   206  m         -59.5   -56.5  Favored   7   7  0.50  10  0.62  molprobity     1  True   
 207   207  ptm85     -58.6   -31.7  Favored  13  11  1.38  14  0.60  molprobity     1  True   
 208   208  t80       -67.5   -44.2  Favored   9  13  0.38  18  0.31  molprobity     1  True   
 209   209  ?         -62.3   -49.7  Favored   5   5  0.30   7  0.21  molprobity     1  True   
 210   210  mm?       -57.0   -35.1  Favored  11   8  0.44  11  0.19  molprobity     1  True   
 211   211  ?         -57.5   -48.1  Favored   5   5  0.32   7  0.26  molprobity     1  True   
 212   212  mt-30     -68.2   -34.9  Favored   8   9  0.38  12  0.21  molprobity     1  True   
 213   213  mm-40     -59.2   -40.8  Favored   6   9  0.42  12  0.35  molprobity     1  True   
 214   214  m-70      -61.5   -40.3  Favored   7  11  0.26  15  0.19  molprobity     1  True   
 215   215  mt        -57.2   -39.5  Favored  11   8  0.41  11  0.23  molprobity     1  True   
 216   216  mttt      -62.3   -31.6  Favored  13   9  0.36  11  0.21  molprobity     1  True   
 217   217  m-70      -92.9     6.5  Favored   7  11  0.34  15  0.32  molprobity     1  True   
 218   218  t70        71.2    13.5  Favored   4   8  0.42  11  0.43  molprobity     1  True   
 219   219  m120      -76.0    59.5  Allowed   6   8  0.39  11  0.27  molprobity     1  True   
 220   220  ?         -56.9   -38.0  Favored   5   5  0.29   7  0.22  molprobity     1  True   
 221   221  m         -61.4   -56.6  Favored   5   6  0.48   8  0.20  molprobity     1  True   
 222   222  mmt180    -62.5   -35.2  Favored  13  11  1.22  14  0.44  molprobity     1  True   
 223   223  ?         -66.8   -47.4  Favored   5   5  0.25   7  0.30  molprobity     1  True   
 224   224  tp        -55.1   -45.7  Favored  11   8  0.33  11  0.22  molprobity     1  True   
 225   225  ?         -53.5   -44.5  Favored   5   5  0.27   7  0.24  molprobity     1  True   
 226   226  mt        -66.6   -49.0  Favored  11   8  0.35  11  0.16  molprobity     1  True   
 227   227  m-85      -58.1   -45.2  Favored   9  12  0.43  16  0.22  molprobity     1  True   
 228   228  mt-10     -61.5   -43.1  Favored   6   9  0.38  12  0.40  molprobity     1  True   
 229   229  tt0       -62.3   -35.8  Favored   6   9  0.34  12  0.30  molprobity     1  True   
 230   230  mt        -61.2   -54.6  Favored  11   8  0.36  11  0.15  molprobity     1  True   
 231   231  t         -55.0   -49.9  Favored   9   7  0.40  10  0.49  molprobity     1  True   
 232   232  pt-20     -65.2   -34.1  Favored   6   9  0.43  12  0.35  molprobity     1  True   
 233   233  p         -84.4   -33.2  Favored   7   7  0.54  10  0.59  molprobity     1  True   
 234   234  t70      -141.9    94.2  Favored   4   8  0.35  12  0.50  molprobity     1  True   
 235   235  Cg_exo    -72.8    -8.3  Favored   7   8  0.44  11  0.36  molprobity     1  True   
 236   236  m-20      -86.0   -29.7  Favored   4   8  0.31  11  0.44  molprobity     1  True   
 237   237  t80       -69.6    86.4  Allowed   9  13  0.38  18  0.34  molprobity     1  True   
 238   238  t         -57.1   -39.7  Favored   9   7  0.46  10  0.51  molprobity     1  True   
 239   239  ?         -50.3   -31.7  Favored   3   4  0.59   5  0.19  molprobity     1  True   
 240   240  m         -63.3   -48.5  Favored   7   7  0.39  10  0.57  molprobity     1  True   
 241   241  m-85      -56.6   -49.1  Favored   9  13  0.38  18  0.29  molprobity     1  True   
 242   242  t80       -61.1   -48.9  Favored   9  13  0.33  18  0.31  molprobity     1  True   
 243   243  m-70      -74.6   -29.8  Favored   7  11  0.31  15  0.26  molprobity     1  True   
 244   244  tp        -68.0   -42.0  Favored  11   8  0.41  11  0.25  molprobity     1  True   
 245   245  ?         -58.2   -48.3  Favored   3   4  0.36   5  0.24  molprobity     1  True   
 246   246  mmtp      -57.9   -33.9  Favored  13   9  0.39  11  0.23  molprobity     1  True   
 247   247  tp        -66.3   -45.9  Favored  11   8  0.38  11  0.18  molprobity     1  True   
 248   248  m-85      -59.3   -41.3  Favored   9  13  0.35  18  0.30  molprobity     1  True   
 249   249  mt-10     -57.3   -41.8  Favored   6   9  0.38  12  0.43  molprobity     1  True   
 250   250  ttt180    -63.0   -31.1  Favored  13  11  1.20  14  0.74  molprobity     1  True   
 251   251  mt        -89.3    11.2  Favored  11   8  0.38  11  0.27  molprobity     1  True   
 252   252  t70        69.1     4.5  Favored   4   8  0.42  11  0.41  molprobity     1  True   
 253   253  mmm180    -81.1    76.0  Favored  13  11  1.23  14  0.72  molprobity     1  True   
 254   254  m         -61.5   -51.1  Favored   7   7  0.49  10  0.49  molprobity     1  True   
 255   255  t70       -65.2   -43.7  Favored   4   8  0.30  11  0.36  molprobity     1  True   
 256   256  m-20      -63.0   -35.7  Favored   4   8  0.34  11  0.38  molprobity     1  True   
 257   257  ?         -65.0   -52.3  Favored   5   5  0.31   7  0.30  molprobity     1  True   
 258   258  mt        -53.6   -43.5  Favored  11   8  0.31  11  0.39  molprobity     1  True   
 259   259  t70       -56.3   -53.2  Favored   4   8  0.28  11  0.40  molprobity     1  True   
 260   260  m         -54.8   -42.2  Favored   7   7  0.44  10  0.41  molprobity     1  True   
 261   261  m-85      -66.8   -39.9  Favored   9  13  0.38  18  0.26  molprobity     1  True   
 262   262  ?         -62.7   -53.4  Favored   5   5  0.37   7  0.23  molprobity     1  True   
 263   263  OUTLIER   -66.8   -35.2  Favored   8   9  0.50  12  0.53  molprobity     1  True   
 264   264  ?         -59.5   -38.6  Favored   3   4  0.44   5  0.20  molprobity     1  True   
 265   265  mt        -51.2   -41.6  Favored  11   8  0.44  11  0.40  molprobity     1  True   
 266   266  mm-40     -65.4   -56.3  Favored   6   9  0.37  12  0.41  molprobity     1  True   
 267   267  m         -71.6   -24.8  Favored   9   7  0.38  10  0.35  molprobity     1  True   
 268   268  ?         -65.0   -52.4  Favored   5   5  0.34   7  0.27  molprobity     1  True   
 269   269  ptt180    -71.5   -37.5  Favored  13  11  1.15  14  0.25  molprobity     1  True   
 270   270  mt-10     -78.6   -52.4  Favored   6   9  0.41  12  0.31  molprobity     1  True   
 271   271  mm-40     -91.8   -39.7  Favored   6   9  0.42  12  0.45  molprobity     1  True   
 272   272  ?         -86.3  -116.0  Allowed   3   4  0.47   5  0.15  molprobity     1  True   
 273   273  t        -153.9   166.6  Favored   7   7  0.47  10  0.54  molprobity     1  True   
 274   274  tp-100    -57.6   -32.8  Favored   8   9  0.46  12  0.39  molprobity     1  True   
 275   275  tttm      -64.9   -49.2  Favored  13   9  0.39  11  0.17  molprobity     1  True   
 276   276  m-20      -58.9   -40.1  Favored   4   8  0.30  11  0.41  molprobity     1  True   
 277   277  tp        -54.9   -49.9  Favored  11   8  0.36  11  0.29  molprobity     1  True   
 278   278  t         -56.8   -40.9  Favored   5   6  0.41   8  0.16  molprobity     1  True   
 279   279  mm-40     -61.1   -44.1  Favored   6   9  0.37  12  0.37  molprobity     1  True   
 280   280  mt        -65.3   -47.2  Favored  11   8  0.38  11  0.20  molprobity     1  True   
 281   281  mt-30     -59.5   -48.9  Favored   8   9  0.37  12  0.32  molprobity     1  True   
 282   282  t70       -55.8   -39.7  Favored   4   8  0.34  11  0.48  molprobity     1  True   
 283   283  ?         -65.6   -50.5  Favored   5   5  0.35   7  0.25  molprobity     1  True   
 284   284  ptmm?     -72.9   -31.1  Favored  13   9  0.40  11  0.24  molprobity     1  True   
 285   285  tp        -54.7   -54.2  Favored  11   8  0.42  11  0.22  molprobity     1  True   
 286   286  pptp?     -65.9   -34.9  Favored  13   9  0.38  11  0.38  molprobity     1  True   
 287   287  ?         -62.4   -45.2  Favored   5   5  0.38   7  0.28  molprobity     1  True   
 288   288  mt-10     -70.5   -18.5  Favored   6   9  0.44  12  0.41  molprobity     1  True   
 289   289  ?         -96.0   -15.3  Favored   3   4  0.54   5  0.19  molprobity     1  True   
 290   290  mt        -61.3   -75.5  Allowed  11   8  0.43  11  0.21  molprobity     1  True   
 291   291  pt-20     -94.7   134.4  Favored   6   9  0.32  12  0.47  molprobity     ?  False  
 292   292  t-80      -86.2    -1.4  Favored   7  11  0.29  15  0.29  molprobity     ?  False  
 293   293  m170      -67.5    85.2  Allowed   7  11  0.25  15  0.31  molprobity     ?  False  
 294   294  p-80      -55.4   111.2  Allowed   7  11  0.33  15  0.30  molprobity     ?  False  
 295   295  m80      -132.2   141.2  Favored   7  11  0.23  15  0.30  molprobity     ?  False  
 296   296  t60      -119.8   131.1  Favored   7  11  0.29  15  0.26  molprobity     ?  False  
 297   297  t-80          ?       ?  ?         7  11  0.58  12  0.45  molprobity     ?  False  
 298   298  mp0           ?       ?  ?         8   9  0.62  12  0.37  molprobity     ?  False  
 299   299  m-20      -98.7   163.3  Favored   4   8  0.39  12  0.49  molprobity     1  True   
 300   300  Cg_endo   -64.1   -14.1  Favored   7   8  0.36  11  0.37  molprobity     1  True   
 301   301  mm-40     -70.5   -29.5  Favored   6   9  0.35  12  0.40  molprobity     1  True   
 302   302  m-20      -60.7   122.0  Favored   4   8  0.35  12  0.56  molprobity     1  True   
 303   303  Cg_exo    -45.8   -48.5  Favored   7   8  0.24  11  0.32  molprobity     1  True   
 304   304  t80       -57.8   -32.6  Favored   9  12  0.44  16  0.25  molprobity     1  True   
 305   305  m         -79.2   -56.6  Favored   7   7  0.49  10  0.55  molprobity     1  True   
 306   306  ptm85     -59.2   -27.3  Favored  13  11  1.32  14  0.62  molprobity     1  True   
 307   307  t80       -62.4   -49.8  Favored   9  13  0.41  18  0.35  molprobity     1  True   
 308   308  ?         -58.3   -44.5  Favored   5   5  0.35   7  0.21  molprobity     1  True   
 309   309  mm?       -55.8   -40.5  Favored  11   8  0.47  11  0.18  molprobity     1  True   
 310   310  ?         -57.4   -45.7  Favored   5   5  0.32   7  0.28  molprobity     1  True   
 311   311  mt-30     -60.0   -43.1  Favored   8   9  0.35  12  0.23  molprobity     1  True   
 312   312  mm-40     -60.0   -38.9  Favored   6   9  0.40  12  0.29  molprobity     1  True   
 313   313  m-70      -61.4   -39.2  Favored   7  11  0.27  15  0.21  molprobity     1  True   
 314   314  mt        -60.3   -41.4  Favored  11   8  0.41  11  0.23  molprobity     1  True   
 315   315  mttt      -62.8   -31.9  Favored  13   9  0.35  11  0.24  molprobity     1  True   
 316   316  m-70      -92.6    14.5  Favored   7  11  0.33  15  0.27  molprobity     1  True   
 317   317  t70        70.5     2.7  Favored   4   8  0.42  11  0.44  molprobity     1  True   
 318   318  m120      -77.0    68.3  Favored   6   8  0.42  11  0.30  molprobity     1  True   
 319   319  ?         -56.8   -49.3  Favored   5   5  0.33   7  0.25  molprobity     1  True   
 320   320  m         -62.7   -41.9  Favored   5   6  0.55   8  0.26  molprobity     1  True   
 321   321  mmt180    -62.9   -43.6  Favored  13  11  1.16  14  0.59  molprobity     1  True   
 322   322  ?         -62.8   -48.3  Favored   5   5  0.23   7  0.30  molprobity     1  True   
 323   323  tp        -55.7   -44.9  Favored  11   8  0.38  11  0.26  molprobity     1  True   
 324   324  ?         -57.9   -44.8  Favored   5   5  0.28   7  0.17  molprobity     1  True   
 325   325  mt        -62.4   -47.3  Favored  11   8  0.32  11  0.17  molprobity     1  True   
 326   326  m-85      -58.0   -50.4  Favored   9  12  0.42  16  0.19  molprobity     1  True   
 327   327  mt-10     -62.5   -29.1  Favored   6   9  0.44  12  0.34  molprobity     1  True   
 328   328  tt0       -77.1   -27.2  Favored   6   9  0.39  12  0.34  molprobity     1  True   
 329   329  mt        -62.2   -38.2  Favored  11   8  0.31  11  0.26  molprobity     1  True   
 330   330  t         -58.8   -46.1  Favored   9   7  0.37  10  0.41  molprobity     1  True   
 331   331  pt-20     -70.8   -33.9  Favored   6   9  0.40  12  0.32  molprobity     1  True   
 332   332  p         -79.3   -22.0  Favored   7   7  0.57  10  0.64  molprobity     1  True   
 333   333  t70      -160.1   100.2  Allowed   4   8  0.37  12  0.51  molprobity     1  True   
 334   334  Cg_endo   -77.0    -4.0  Favored   7   8  0.40  11  0.38  molprobity     1  True   
 335   335  p-10     -122.6     5.8  Favored   4   8  0.30  11  0.33  molprobity     1  True   
 336   336  t80       -69.5    93.9  Allowed   9  13  0.36  18  0.32  molprobity     1  True   
 337   337  t         -56.5   -42.7  Favored   9   7  0.38  10  0.49  molprobity     1  True   
 338   338  ?         -48.5   -33.4  Favored   3   4  0.50   5  0.27  molprobity     1  True   
 339   339  m         -64.9   -57.9  Favored   7   7  0.39  10  0.58  molprobity     1  True   
 340   340  m-85      -57.2   -42.2  Favored   9  13  0.37  18  0.30  molprobity     1  True   
 341   341  t80       -60.1   -55.3  Favored   9  13  0.34  18  0.25  molprobity     1  True   
 342   342  m-70      -74.1   -29.8  Favored   7  11  0.30  15  0.20  molprobity     1  True   
 343   343  tp        -58.6   -45.9  Favored  11   8  0.42  11  0.29  molprobity     1  True   
 344   344  ?         -61.4   -46.2  Favored   3   4  0.38   5  0.13  molprobity     1  True   
 345   345  OUTLIER   -57.7   -36.8  Favored  13   9  0.39  11  0.49  molprobity     1  True   
 346   346  tp        -66.6   -41.8  Favored  11   8  0.39  11  0.20  molprobity     1  True   
 347   347  m-85      -57.8   -46.7  Favored   9  13  0.37  18  0.34  molprobity     1  True   
 348   348  mt-10     -55.4   -44.4  Favored   6   9  0.36  12  0.43  molprobity     1  True   
 349   349  ttt180    -60.5   -35.2  Favored  13  11  1.16  14  0.49  molprobity     1  True   
 350   350  mt        -84.0    14.3  Favored  11   8  0.45  11  0.27  molprobity     1  True   
 351   351  t70        68.2     6.7  Favored   4   8  0.49  11  0.43  molprobity     1  True   
 352   352  mmm180    -86.5    54.3  Favored  13  11  1.23  14  0.67  molprobity     1  True   
 353   353  m         -51.0   -49.3  Favored   7   7  0.51  10  0.47  molprobity     1  True   
 354   354  t70       -61.8   -48.5  Favored   4   8  0.28  11  0.33  molprobity     1  True   
 355   355  m-20      -55.9   -38.5  Favored   4   8  0.28  11  0.47  molprobity     1  True   
 356   356  ?         -58.5   -53.9  Favored   5   5  0.23   7  0.30  molprobity     1  True   
 357   357  mt        -52.8   -49.6  Favored  11   8  0.40  11  0.46  molprobity     1  True   
 358   358  t70       -61.4   -32.4  Favored   4   8  0.36  11  0.39  molprobity     1  True   
 359   359  m         -72.5   -46.7  Favored   7   7  0.50  10  0.45  molprobity     1  True   
 360   360  m-85      -57.5   -40.8  Favored   9  13  0.38  18  0.34  molprobity     1  True   
 361   361  ?         -54.0   -53.2  Favored   5   5  0.38   7  0.29  molprobity     1  True   
 362   362  OUTLIER   -69.4   -35.9  Favored   8   9  0.50  12  0.46  molprobity     1  True   
 363   363  ?         -57.6   -37.5  Favored   3   4  0.41   5  0.24  molprobity     1  True   
 364   364  mt        -54.1   -41.3  Favored  11   8  0.33  11  0.47  molprobity     1  True   
 365   365  mt-10     -63.9   -53.1  Favored   6   9  0.30  12  0.35  molprobity     1  True   
 366   366  m         -69.7   -25.7  Favored   9   7  0.40  10  0.35  molprobity     1  True   
 367   367  ?         -68.6   -52.2  Favored   5   5  0.37   7  0.24  molprobity     1  True   
 368   368  ptm180    -68.4   -27.8  Favored  13  11  1.24  14  0.36  molprobity     1  True   
 369   369  mm-40     -87.2   -51.4  Favored   6   9  0.36  12  0.37  molprobity     1  True   
 370   370  mm-40     -97.4   -48.2  Favored   6   9  0.43  12  0.45  molprobity     1  True   
 371   371  ?         -75.3  -147.1  Allowed   3   4  0.60   5  0.17  molprobity     1  True   
 372   372  t        -116.9   167.8  Favored   7   7  0.49  10  0.53  molprobity     1  True   
 373   373  tt0       -57.4   -28.3  Favored   8   9  0.37  12  0.22  molprobity     1  True   
 374   374  tttm      -58.5   -50.7  Favored  13   9  0.31  11  0.26  molprobity     1  True   
 375   375  m-20      -58.4   -41.7  Favored   4   8  0.26  11  0.37  molprobity     1  True   
 376   376  tp        -52.5   -51.0  Favored  11   8  0.37  11  0.30  molprobity     1  True   
 377   377  t         -65.1   -38.9  Favored   5   6  0.43   8  0.19  molprobity     1  True   
 378   378  mm-40     -56.4   -52.1  Favored   6   9  0.41  12  0.54  molprobity     1  True   
 379   379  mt        -73.4   -35.7  Favored  11   8  0.37  11  0.29  molprobity     1  True   
 380   380  mt-30     -58.6   -49.5  Favored   8   9  0.41  12  0.37  molprobity     1  True   
 381   381  t70       -61.5   -45.3  Favored   4   8  0.25  11  0.38  molprobity     1  True   
 382   382  ?         -54.3   -50.6  Favored   5   5  0.34   7  0.31  molprobity     1  True   
 383   383  ptmm?     -74.0   -35.4  Favored  13   9  0.40  11  0.31  molprobity     1  True   
 384   384  tp        -55.2   -52.7  Favored  11   8  0.36  11  0.24  molprobity     1  True   
 385   385  OUTLIER   -69.1   -31.7  Favored  13   9  0.38  11  0.36  molprobity     1  True   
 386   386  ?         -64.3   -42.1  Favored   5   5  0.33   7  0.29  molprobity     1  True   
 387   387  mt-10     -65.7   -17.1  Favored   6   9  0.35  12  0.28  molprobity     1  True   
 388   388  ?        -100.1     5.3  Favored   3   4  0.55   5  0.10  molprobity     1  True   
 389   389  mt        -77.4   -55.4  Favored  11   8  0.40  11  0.18  molprobity     1  True   
 390   390  OUTLIER  -142.3  -170.8  Favored   6   9  0.46  12  0.39  molprobity     ?  False  
 391   391  t-80      -99.2    57.0  Allowed   7  11  0.39  15  0.48  molprobity     ?  False  
 392   392  p80       -53.2   109.9  Allowed   7  11  0.36  15  0.29  molprobity     ?  False  
 393   393  t-80     -134.9   113.0  Favored   7  11  0.28  15  0.24  molprobity     ?  False  
 394   394  m-70      -83.6   135.1  Favored   7  11  0.33  15  0.48  molprobity     ?  False  
 395   395  t60      -126.4   -42.7  Allowed   7  11  0.29  15  0.43  molprobity     ?  False  
 396   396  t60           ?       ?  ?         7  11  0.65  12  0.30  molprobity     ?  False  
 397   397  mt-10         ?       ?  ?         8   9  0.61  12  0.37  molprobity     ?  False  
 398   398  m-20      -88.8   167.9  Favored   4   8  0.51  12  0.55  molprobity     1  True   
 399   399  Cg_exo    -46.3   -23.3  Allowed   7   8  0.56  11  0.41  molprobity     1  True   
 400   400  mt-10     -84.1   -25.6  Favored   6   9  0.37  12  0.28  molprobity     1  True   
 401   401  m-20      -59.1   131.8  Favored   4   8  0.46  12  0.52  molprobity     1  True   
 402   402  Cg_endo   -46.4   -44.3  Favored   7   8  0.44  11  0.37  molprobity     1  True   
 403   403  t80       -68.1   -40.2  Favored   9  12  0.38  16  0.23  molprobity     1  True   
 404   404  m         -66.0   -55.2  Favored   7   7  0.40  10  0.57  molprobity     1  True   
 405   405  ptm180    -56.7   -31.4  Favored  13  11  1.22  14  0.54  molprobity     1  True   
 406   406  t80       -66.2   -45.2  Favored   9  13  0.42  18  0.30  molprobity     1  True   
 407   407  ?         -60.9   -45.9  Favored   5   5  0.33   7  0.19  molprobity     1  True   
 408   408  mm?       -63.0   -35.2  Favored  11   8  0.43  11  0.20  molprobity     1  True   
 409   409  ?         -55.1   -49.5  Favored   5   5  0.31   7  0.31  molprobity     1  True   
 410   410  mt-30     -63.2   -36.2  Favored   8   9  0.36  12  0.20  molprobity     1  True   
 411   411  mm-40     -56.5   -44.4  Favored   6   9  0.37  12  0.39  molprobity     1  True   
 412   412  m-70      -62.3   -39.6  Favored   7  11  0.24  15  0.19  molprobity     1  True   
 413   413  mt        -56.9   -45.3  Favored  11   8  0.43  11  0.30  molprobity     1  True   
 414   414  mttt      -59.7   -36.5  Favored  13   9  0.35  11  0.31  molprobity     1  True   
 415   415  m-70      -96.1    30.1  Favored   7  11  0.33  15  0.29  molprobity     1  True   
 416   416  m-20       65.7     4.8  Favored   4   8  0.50  11  0.45  molprobity     1  True   
 417   417  m120      -86.5    67.6  Favored   6   8  0.35  11  0.25  molprobity     1  True   
 418   418  ?         -63.9   -47.5  Favored   5   5  0.36   7  0.24  molprobity     1  True   
 419   419  t         -62.7   -43.3  Favored   5   6  0.46   8  0.24  molprobity     1  True   
 420   420  mmt180    -60.0   -47.8  Favored  13  11  1.20  14  0.46  molprobity     1  True   
 421   421  ?         -60.1   -48.1  Favored   5   5  0.22   7  0.24  molprobity     1  True   
 422   422  tp        -53.1   -49.8  Favored  11   8  0.38  11  0.22  molprobity     1  True   
 423   423  ?         -57.2   -40.3  Favored   5   5  0.31   7  0.18  molprobity     1  True   
 424   424  mt        -63.5   -46.0  Favored  11   8  0.38  11  0.18  molprobity     1  True   
 425   425  m-85      -59.7   -44.9  Favored   9  12  0.42  16  0.17  molprobity     1  True   
 426   426  mt-10     -62.9   -34.2  Favored   6   9  0.46  12  0.44  molprobity     1  True   
 427   427  tp10      -65.1   -35.9  Favored   6   9  0.56  12  0.62  molprobity     1  True   
 428   428  mt        -66.1   -42.2  Favored  11   8  0.38  11  0.36  molprobity     1  True   
 429   429  t         -60.9   -45.7  Favored   9   7  0.40  10  0.46  molprobity     1  True   
 430   430  pt-20     -70.7   -34.5  Favored   6   9  0.39  12  0.41  molprobity     1  True   
 431   431  p         -79.0   -43.1  Favored   7   7  0.49  10  0.67  molprobity     1  True   
 432   432  m-20     -128.7    77.7  Favored   4   8  0.42  12  0.50  molprobity     1  True   
 433   433  Cg_exo    -65.3   -14.0  Favored   7   8  0.44  11  0.32  molprobity     1  True   
 434   434  p-10      -89.0   -10.1  Favored   4   8  0.29  11  0.44  molprobity     1  True   
 435   435  t80       -80.2    92.2  Favored   9  13  0.38  18  0.32  molprobity     1  True   
 436   436  t         -60.8   -38.2  Favored   9   7  0.44  10  0.42  molprobity     1  True   
 437   437  ?         -51.0   -34.0  Favored   3   4  0.55   5  0.15  molprobity     1  True   
 438   438  m         -62.4   -52.7  Favored   7   7  0.36  10  0.60  molprobity     1  True   
 439   439  m-85      -56.2   -44.7  Favored   9  13  0.35  18  0.25  molprobity     1  True   
 440   440  t80       -62.6   -51.2  Favored   9  13  0.38  18  0.21  molprobity     1  True   
 441   441  m-70      -73.7   -30.1  Favored   7  11  0.30  15  0.20  molprobity     1  True   
 442   442  tp        -69.0   -42.4  Favored  11   8  0.39  11  0.26  molprobity     1  True   
 443   443  ?         -59.4   -46.7  Favored   3   4  0.39   5  0.27  molprobity     1  True   
 444   444  mmtp      -57.7   -35.5  Favored  13   9  0.32  11  0.23  molprobity     1  True   
 445   445  tp        -68.0   -41.0  Favored  11   8  0.38  11  0.18  molprobity     1  True   
 446   446  m-85      -62.5   -51.3  Favored   9  13  0.34  18  0.23  molprobity     1  True   
 447   447  mt-10     -53.1   -43.1  Favored   6   9  0.42  12  0.55  molprobity     1  True   
 448   448  ttm180    -60.2   -41.5  Favored  13  11  1.12  14  0.38  molprobity     1  True   
 449   449  mt        -85.8    19.2  Favored  11   8  0.43  11  0.27  molprobity     1  True   
 450   450  t70        67.1     4.9  Favored   4   8  0.43  11  0.43  molprobity     1  True   
 451   451  mmm180    -82.6    61.0  Favored  13  11  1.26  14  0.53  molprobity     1  True   
 452   452  m         -61.8   -52.7  Favored   7   7  0.49  10  0.47  molprobity     1  True   
 453   453  m-20      -66.2   -32.7  Favored   4   8  0.36  11  0.38  molprobity     1  True   
 454   454  m-20      -65.0   -38.9  Favored   4   8  0.27  11  0.47  molprobity     1  True   
 455   455  ?         -62.7   -45.8  Favored   5   5  0.24   7  0.26  molprobity     1  True   
 456   456  mt        -52.7   -51.5  Favored  11   8  0.35  11  0.42  molprobity     1  True   
 457   457  t70       -60.8   -41.2  Favored   4   8  0.35  11  0.40  molprobity     1  True   
 458   458  m         -60.5   -43.4  Favored   7   7  0.49  10  0.46  molprobity     1  True   
 459   459  m-85      -64.1   -36.3  Favored   9  13  0.32  18  0.25  molprobity     1  True   
 460   460  ?         -58.8   -54.7  Favored   5   5  0.34   7  0.22  molprobity     1  True   
 461   461  OUTLIER   -60.4   -33.8  Favored   8   9  0.52  12  0.41  molprobity     1  True   
 462   462  ?         -64.6   -42.6  Favored   3   4  0.40   5  0.28  molprobity     1  True   
 463   463  mt        -55.8   -44.4  Favored  11   8  0.36  11  0.50  molprobity     1  True   
 464   464  mt-10     -59.2   -55.2  Favored   6   9  0.35  12  0.36  molprobity     1  True   
 465   465  m         -71.5   -23.9  Favored   9   7  0.40  10  0.37  molprobity     1  True   
 466   466  ?         -67.1   -47.0  Favored   5   5  0.29   7  0.25  molprobity     1  True   
 467   467  ptm180    -71.7   -28.6  Favored  13  11  1.10  14  0.30  molprobity     1  True   
 468   468  mt-10     -83.8   -53.0  Favored   6   9  0.41  12  0.42  molprobity     1  True   
 469   469  mm-40     -99.6   -39.5  Favored   6   9  0.40  12  0.47  molprobity     1  True   
 470   470  ?         -83.0  -108.5  Allowed   3   4  0.50   5  0.21  molprobity     1  True   
 471   471  t        -164.6   163.9  Favored   7   7  0.50  10  0.62  molprobity     1  True   
 472   472  tt0       -62.2   -28.6  Favored   8   9  0.36  12  0.26  molprobity     1  True   
 473   473  ttpt      -62.8   -51.2  Favored  13   9  0.37  11  0.21  molprobity     1  True   
 474   474  m-20      -68.5   -32.5  Favored   4   8  0.26  11  0.41  molprobity     1  True   
 475   475  tp        -54.6   -45.8  Favored  11   8  0.34  11  0.25  molprobity     1  True   
 476   476  t         -66.9   -39.8  Favored   5   6  0.44   8  0.20  molprobity     1  True   
 477   477  mm-40     -56.5   -52.0  Favored   6   9  0.41  12  0.44  molprobity     1  True   
 478   478  mt        -66.0   -40.8  Favored  11   8  0.39  11  0.20  molprobity     1  True   
 479   479  mt-30     -63.7   -43.9  Favored   8   9  0.39  12  0.25  molprobity     1  True   
 480   480  t70       -65.5   -33.8  Favored   4   8  0.30  11  0.42  molprobity     1  True   
 481   481  ?         -66.0   -50.3  Favored   5   5  0.30   7  0.25  molprobity     1  True   
 482   482  ptmt      -66.5   -30.0  Favored  13   9  0.37  11  0.24  molprobity     1  True   
 483   483  tp        -66.2   -54.7  Favored  11   8  0.38  11  0.13  molprobity     1  True   
 484   484  pttp      -58.2   -29.9  Favored  13   9  0.40  11  0.24  molprobity     1  True   
 485   485  ?         -59.0   -45.9  Favored   5   5  0.30   7  0.27  molprobity     1  True   
 486   486  mt-10     -79.0   -20.6  Favored   6   9  0.34  12  0.34  molprobity     1  True   
 487   487  ?         -67.8   -17.5  Favored   3   4  0.40   5  0.13  molprobity     1  True   
 488   488  mt        -58.1   -56.5  Favored  11   8  0.39  11  0.22  molprobity     1  True   
 489   489  OUTLIER  -163.8   178.5  Favored   6   9  0.39  12  0.37  molprobity     ?  False  
 490   490  p80       -92.9   -31.0  Favored   7  11  0.36  15  0.37  molprobity     ?  False  
 491   491  t60       -83.3    80.1  Favored   7  11  0.34  15  0.29  molprobity     ?  False  
 492   492  p-80     -146.4   170.9  Favored   7  11  0.31  15  0.29  molprobity     ?  False  
 493   493  m-70      -84.1    60.8  Favored   7  11  0.34  15  0.29  molprobity     ?  False  
 494   494  t60       -60.7   118.6  Favored   7  11  0.33  15  0.25  molprobity     ?  False  
 495   495  t-80          ?       ?  ?         7  11  0.61  12  0.30  molprobity     ?  False  
 496   496  pt-20         ?       ?  ?         8   9  0.59  12  0.42  molprobity     ?  False  
 497   497  m-20     -122.3   157.9  Favored   4   8  0.49  12  0.58  molprobity     1  True   
 498   498  Cg_endo   -55.6   -29.5  Favored   7   8  0.51  11  0.39  molprobity     1  True   
 499   499  mt-10     -73.2   -20.0  Favored   6   9  0.40  12  0.33  molprobity     1  True   
 500   500  m-20      -64.2   132.4  Favored   4   8  0.44  12  0.51  molprobity     1  True   
 501   501  Cg_endo   -49.1   -44.5  Favored   7   8  0.38  11  0.32  molprobity     1  True   
 502   502  t80       -61.0   -49.0  Favored   9  12  0.42  16  0.21  molprobity     1  True   
 503   503  m         -60.5   -55.6  Favored   7   7  0.49  10  0.59  molprobity     1  True   
 504   504  ptm85     -63.8   -30.2  Favored  13  11  1.13  14  0.36  molprobity     1  True   
 505   505  t80       -69.7   -42.0  Favored   9  13  0.39  18  0.30  molprobity     1  True   
 506   506  ?         -60.4   -48.1  Favored   5   5  0.33   7  0.23  molprobity     1  True   
 507   507  mm?       -58.1   -38.6  Favored  11   8  0.46  11  0.18  molprobity     1  True   
 508   508  ?         -57.2   -50.8  Favored   5   5  0.35   7  0.26  molprobity     1  True   
 509   509  mt-30     -60.0   -39.7  Favored   8   9  0.36  12  0.26  molprobity     1  True   
 510   510  mm-40     -61.1   -49.2  Favored   6   9  0.22  12  0.33  molprobity     1  True   
 511   511  m-70      -54.1   -37.7  Favored   7  11  0.26  15  0.24  molprobity     1  True   
 512   512  mt        -59.3   -51.5  Favored  11   8  0.40  11  0.15  molprobity     1  True   
 513   513  mttp      -58.2   -38.0  Favored  13   9  0.37  11  0.45  molprobity     1  True   
 514   514  m-70      -88.7    21.9  Favored   7  11  0.30  15  0.30  molprobity     1  True   
 515   515  t70        75.2   -11.7  Allowed   4   8  0.51  11  0.44  molprobity     1  True   
 516   516  m120      -80.6    61.0  Favored   6   8  0.37  11  0.29  molprobity     1  True   
 517   517  ?         -62.1   -41.5  Favored   5   5  0.23   7  0.19  molprobity     1  True   
 518   518  m         -61.0   -45.1  Favored   5   6  0.48   8  0.21  molprobity     1  True   
 519   519  mmt180    -68.4   -34.0  Favored  13  11  1.12  14  0.63  molprobity     1  True   
 520   520  ?         -65.2   -48.1  Favored   5   5  0.28   7  0.30  molprobity     1  True   
 521   521  tp        -50.7   -46.7  Favored  11   8  0.39  11  0.27  molprobity     1  True   
 522   522  ?         -56.1   -37.6  Favored   5   5  0.28   7  0.17  molprobity     1  True   
 523   523  mt        -75.2   -34.7  Favored  11   8  0.41  11  0.24  molprobity     1  True   
 524   524  m-85      -66.0   -41.0  Favored   9  12  0.38  16  0.22  molprobity     1  True   
 525   525  mt-10     -68.7   -35.0  Favored   6   9  0.39  12  0.41  molprobity     1  True   
 526   526  tp10      -57.4   -43.6  Favored   6   9  0.51  12  0.48  molprobity     1  True   
 527   527  mt        -55.5   -55.4  Favored  11   8  0.35  11  0.21  molprobity     1  True   
 528   528  t         -54.9   -47.6  Favored   9   7  0.41  10  0.48  molprobity     1  True   
 529   529  pt-20     -71.2   -28.8  Favored   6   9  0.40  12  0.33  molprobity     1  True   
 530   530  p         -96.6   -20.3  Favored   7   7  0.61  10  0.67  molprobity     1  True   
 531   531  t70      -161.4    93.9  Allowed   4   8  0.40  12  0.52  molprobity     1  True   
 532   532  Cg_endo   -82.5     3.2  Favored   7   8  0.34  11  0.22  molprobity     1  True   
 533   533  m-20      -89.5   -24.6  Favored   4   8  0.29  11  0.37  molprobity     1  True   
 534   534  t80       -71.4    94.0  Allowed   9  13  0.36  18  0.36  molprobity     1  True   
 535   535  t         -57.4   -34.8  Favored   9   7  0.47  10  0.40  molprobity     1  True   
 536   536  ?         -54.3   -33.5  Favored   3   4  0.56   5  0.17  molprobity     1  True   
 537   537  m         -57.2   -54.5  Favored   7   7  0.41  10  0.62  molprobity     1  True   
 538   538  m-85      -57.0   -46.7  Favored   9  13  0.36  18  0.25  molprobity     1  True   
 539   539  t80       -58.1   -54.4  Favored   9  13  0.39  18  0.24  molprobity     1  True   
 540   540  m-70      -73.7   -33.1  Favored   7  11  0.29  15  0.25  molprobity     1  True   
 541   541  tp        -63.2   -41.9  Favored  11   8  0.40  11  0.24  molprobity     1  True   
 542   542  ?         -60.0   -47.6  Favored   3   4  0.37   5  0.18  molprobity     1  True   
 543   543  mmmp?     -58.0   -34.7  Favored  13   9  0.46  11  0.40  molprobity     1  True   
 544   544  tp        -69.0   -37.8  Favored  11   8  0.42  11  0.24  molprobity     1  True   
 545   545  m-85      -64.6   -44.7  Favored   9  13  0.35  18  0.22  molprobity     1  True   
 546   546  mt-10     -51.9   -45.1  Favored   6   9  0.57  12  0.59  molprobity     1  True   
 547   547  ttt180    -59.5   -34.7  Favored  13  11  1.22  14  0.66  molprobity     1  True   
 548   548  mt        -95.3    21.4  Favored  11   8  0.44  11  0.25  molprobity     1  True   
 549   549  t70        67.5     5.2  Favored   4   8  0.49  11  0.45  molprobity     1  True   
 550   550  mmm180    -84.6    46.5  Allowed  13  11  1.27  14  0.68  molprobity     1  True   
 551   551  m         -50.4   -44.5  Favored   7   7  0.45  10  0.53  molprobity     1  True   
 552   552  t70       -57.0   -48.3  Favored   4   8  0.33  11  0.41  molprobity     1  True   
 553   553  m-20      -64.0   -42.5  Favored   4   8  0.26  11  0.38  molprobity     1  True   
 554   554  ?         -54.8   -50.0  Favored   5   5  0.32   7  0.28  molprobity     1  True   
 555   555  mt        -54.2   -47.0  Favored  11   8  0.33  11  0.39  molprobity     1  True   
 556   556  t70       -64.9   -38.6  Favored   4   8  0.34  11  0.39  molprobity     1  True   
 557   557  m         -57.3   -46.5  Favored   7   7  0.50  10  0.55  molprobity     1  True   
 558   558  m-85      -65.5   -35.9  Favored   9  13  0.33  18  0.21  molprobity     1  True   
 559   559  ?         -56.9   -47.8  Favored   5   5  0.36   7  0.23  molprobity     1  True   
 560   560  OUTLIER   -69.5   -38.0  Favored   8   9  0.46  12  0.42  molprobity     1  True   
 561   561  ?         -57.3   -38.3  Favored   3   4  0.39   5  0.25  molprobity     1  True   
 562   562  mt        -54.3   -43.5  Favored  11   8  0.36  11  0.36  molprobity     1  True   
 563   563  mm-40     -60.0   -57.4  Favored   6   9  0.27  12  0.41  molprobity     1  True   
 564   564  m         -69.3   -26.9  Favored   9   7  0.36  10  0.31  molprobity     1  True   
 565   565  ?         -64.7   -49.2  Favored   5   5  0.33   7  0.22  molprobity     1  True   
 566   566  ptm180    -79.7   -36.0  Favored  13  11  1.25  14  0.34  molprobity     1  True   
 567   567  mm-40     -74.3   -47.8  Favored   6   9  0.44  12  0.38  molprobity     1  True   
 568   568  mm-40    -101.8   -46.9  Favored   6   9  0.39  12  0.50  molprobity     1  True   
 569   569  ?         -78.5  -104.3  Allowed   3   4  0.57   5  0.24  molprobity     1  True   
 570   570  t        -170.3   172.1  Favored   7   7  0.53  10  0.65  molprobity     1  True   
 571   571  tp60      -55.6   -37.6  Favored   8   9  0.44  12  0.41  molprobity     1  True   
 572   572  ttpp      -56.0   -51.9  Favored  13   9  0.38  11  0.27  molprobity     1  True   
 573   573  m-20      -64.5   -38.6  Favored   4   8  0.21  11  0.44  molprobity     1  True   
 574   574  tp        -55.8   -44.2  Favored  11   8  0.36  11  0.18  molprobity     1  True   
 575   575  t         -66.0   -48.4  Favored   5   6  0.43   8  0.26  molprobity     1  True   
 576   576  mt-10     -58.5   -40.8  Favored   6   9  0.44  12  0.36  molprobity     1  True   
 577   577  mt        -70.8   -34.5  Favored  11   8  0.40  11  0.19  molprobity     1  True   
 578   578  mt-30     -62.2   -46.3  Favored   8   9  0.39  12  0.23  molprobity     1  True   
 579   579  t70       -61.9   -41.5  Favored   4   8  0.34  11  0.43  molprobity     1  True   
 580   580  ?         -53.4   -50.3  Favored   5   5  0.33   7  0.23  molprobity     1  True   
 581   581  OUTLIER   -73.1   -40.3  Favored  13   9  0.45  11  0.34  molprobity     1  True   
 582   582  tp        -54.5   -45.5  Favored  11   8  0.42  11  0.22  molprobity     1  True   
 583   583  pttm      -65.1   -38.9  Favored  13   9  0.36  11  0.28  molprobity     1  True   
 584   584  ?         -69.6   -40.8  Favored   5   5  0.34   7  0.31  molprobity     1  True   
 585   585  mt-10     -68.5    -9.8  Favored   6   9  0.38  12  0.44  molprobity     1  True   
 586   586  ?        -108.6    -2.1  Favored   3   4  0.51   5  0.15  molprobity     1  True   
 587   587  mt        -64.9   -65.9  Allowed  11   8  0.45  11  0.25  molprobity     1  True   
 588   588  pp20?     -87.0   166.4  Favored   6   9  0.45  12  0.45  molprobity     ?  False  
 589   589  p-80     -124.6    11.6  Favored   7  11  0.38  15  0.33  molprobity     ?  False  
 590   590  t-80     -115.4    56.5  Allowed   7  11  0.28  15  0.40  molprobity     ?  False  
 591   591  m-70      -46.5   139.1  Favored   7  11  0.32  15  0.39  molprobity     ?  False  
 592   592  m-70      -92.8   142.2  Favored   7  11  0.31  15  0.41  molprobity     ?  False  
 593   593  t60      -110.0   118.5  Favored   7  11  0.27  15  0.28  molprobity     ?  False  
 594   594  t60           ?       ?  ?         7  11  0.62  12  0.33  molprobity     ?  False  
 595   595  mt-10         ?       ?  ?         8   9  0.63  12  0.35  molprobity     ?  False  
 596   596  m-20      -80.1   162.9  Favored   4   8  0.35  12  0.52  molprobity     1  True   
 597   597  Cg_exo    -56.0   -12.3  Favored   7   8  0.43  11  0.27  molprobity     1  True   
 598   598  mm-40     -74.2   -32.4  Favored   6   9  0.34  12  0.37  molprobity     1  True   
 599   599  m-20      -56.7   125.5  Favored   4   8  0.34  12  0.52  molprobity     1  True   
 600   600  Cg_endo   -49.1   -42.5  Favored   7   8  0.35  11  0.33  molprobity     1  True   
 601   601  t80       -69.0   -38.5  Favored   9  12  0.40  16  0.22  molprobity     1  True   
 602   602  m         -59.3   -55.8  Favored   7   7  0.48  10  0.59  molprobity     1  True   
 603   603  ptm180    -61.5   -33.6  Favored  13  11  1.28  14  0.44  molprobity     1  True   
 604   604  t80       -62.8   -44.7  Favored   9  13  0.40  18  0.38  molprobity     1  True   
 605   605  ?         -67.1   -47.6  Favored   5   5  0.26   7  0.20  molprobity     1  True   
 606   606  mm?       -56.9   -30.9  Favored  11   8  0.43  11  0.18  molprobity     1  True   
 607   607  ?         -60.5   -47.8  Favored   5   5  0.31   7  0.33  molprobity     1  True   
 608   608  mt-30     -65.5   -36.5  Favored   8   9  0.38  12  0.25  molprobity     1  True   
 609   609  mm-40     -59.6   -44.2  Favored   6   9  0.36  12  0.36  molprobity     1  True   
 610   610  m-70      -59.0   -38.2  Favored   7  11  0.25  15  0.19  molprobity     1  True   
 611   611  mt        -56.5   -40.8  Favored  11   8  0.42  11  0.23  molprobity     1  True   
 612   612  mttm      -62.0   -30.1  Favored  13   9  0.32  11  0.28  molprobity     1  True   
 613   613  m-70     -101.4    23.0  Favored   7  11  0.35  15  0.31  molprobity     1  True   
 614   614  t70        67.5     5.2  Favored   4   8  0.45  11  0.45  molprobity     1  True   
 615   615  m120      -81.2    52.2  Allowed   6   8  0.43  11  0.25  molprobity     1  True   
 616   616  ?         -57.4   -46.5  Favored   5   5  0.35   7  0.24  molprobity     1  True   
 617   617  p         -62.5   -40.0  Favored   5   6  0.38   8  0.27  molprobity     1  True   
 618   618  mmt180    -69.5   -35.7  Favored  13  11  1.17  14  0.31  molprobity     1  True   
 619   619  ?         -62.5   -44.9  Favored   5   5  0.26   7  0.42  molprobity     1  True   
 620   620  tp        -54.0   -49.5  Favored  11   8  0.37  11  0.26  molprobity     1  True   
 621   621  ?         -57.7   -39.3  Favored   5   5  0.31   7  0.21  molprobity     1  True   
 622   622  mt        -64.1   -39.6  Favored  11   8  0.42  11  0.15  molprobity     1  True   
 623   623  m-85      -67.8   -45.7  Favored   9  12  0.39  16  0.18  molprobity     1  True   
 624   624  mt-10     -61.0   -32.1  Favored   6   9  0.44  12  0.38  molprobity     1  True   
 625   625  tt0       -66.7   -45.1  Favored   6   9  0.35  12  0.37  molprobity     1  True   
 626   626  mt        -55.8   -36.4  Favored  11   8  0.43  11  0.24  molprobity     1  True   
 627   627  t         -60.6   -44.8  Favored   9   7  0.44  10  0.45  molprobity     1  True   
 628   628  pt-20     -81.3   -31.0  Favored   6   9  0.40  12  0.36  molprobity     1  True   
 629   629  p         -86.4   -43.8  Favored   7   7  0.43  10  0.62  molprobity     1  True   
 630   630  m-20     -122.2    77.8  Favored   4   8  0.46  12  0.51  molprobity     1  True   
 631   631  Cg_exo    -60.3   -21.1  Favored   7   8  0.46  11  0.30  molprobity     1  True   
 632   632  p-10      -95.7     1.4  Favored   4   8  0.29  11  0.37  molprobity     1  True   
 633   633  t80       -76.3    82.4  Favored   9  13  0.41  18  0.29  molprobity     1  True   
 634   634  t         -57.5   -36.4  Favored   9   7  0.40  10  0.43  molprobity     1  True   
 635   635  ?         -52.4   -33.4  Favored   3   4  0.41   5  0.19  molprobity     1  True   
 636   636  m         -67.2   -56.1  Favored   7   7  0.36  10  0.57  molprobity     1  True   
 637   637  m-85      -54.8   -44.8  Favored   9  13  0.39  18  0.25  molprobity     1  True   
 638   638  t80       -59.5   -53.8  Favored   9  13  0.37  18  0.23  molprobity     1  True   
 639   639  m-70      -75.2   -29.1  Favored   7  11  0.32  15  0.24  molprobity     1  True   
 640   640  tp        -63.6   -45.2  Favored  11   8  0.38  11  0.26  molprobity     1  True   
 641   641  ?         -58.7   -44.4  Favored   3   4  0.33   5  0.26  molprobity     1  True   
 642   642  mmtp      -57.5   -38.8  Favored  13   9  0.34  11  0.34  molprobity     1  True   
 643   643  tp        -69.7   -38.5  Favored  11   8  0.39  11  0.22  molprobity     1  True   
 644   644  m-85      -60.7   -49.2  Favored   9  13  0.37  18  0.23  molprobity     1  True   
 645   645  mt-10     -56.0   -38.5  Favored   6   9  0.44  12  0.55  molprobity     1  True   
 646   646  ttm180    -63.7   -24.0  Favored  13  11  1.21  14  0.90  molprobity     1  True   
 647   647  mt       -107.6    15.2  Favored  11   8  0.46  11  0.25  molprobity     1  True   
 648   648  t70        59.7    31.9  Favored   4   8  0.52  11  0.47  molprobity     1  True   
 649   649  mmm180    -96.8    61.5  Allowed  13  11  1.14  14  0.66  molprobity     1  True   
 650   650  m         -53.0   -51.5  Favored   7   7  0.51  10  0.49  molprobity     1  True   
 651   651  m-20      -55.7   -49.2  Favored   4   8  0.33  11  0.46  molprobity     1  True   
 652   652  m-20      -58.9   -45.7  Favored   4   8  0.24  11  0.44  molprobity     1  True   
 653   653  ?         -57.4   -55.4  Favored   5   5  0.35   7  0.26  molprobity     1  True   
 654   654  mt        -55.4   -48.3  Favored  11   8  0.32  11  0.41  molprobity     1  True   
 655   655  t70       -63.0   -41.4  Favored   4   8  0.32  11  0.37  molprobity     1  True   
 656   656  m         -61.1   -45.0  Favored   7   7  0.45  10  0.49  molprobity     1  True   
 657   657  m-85      -62.2   -38.0  Favored   9  13  0.32  18  0.27  molprobity     1  True   
 658   658  ?         -56.8   -56.2  Favored   5   5  0.34   7  0.24  molprobity     1  True   
 659   659  OUTLIER   -63.0   -36.3  Favored   8   9  0.51  12  0.49  molprobity     1  True   
 660   660  ?         -59.3   -39.6  Favored   3   4  0.39   5  0.21  molprobity     1  True   
 661   661  mt        -55.8   -42.4  Favored  11   8  0.30  11  0.35  molprobity     1  True   
 662   662  mt-10     -61.2   -55.7  Favored   6   9  0.31  12  0.32  molprobity     1  True   
 663   663  m         -66.4   -22.4  Favored   9   7  0.36  10  0.34  molprobity     1  True   
 664   664  ?         -68.7   -52.4  Favored   5   5  0.28   7  0.20  molprobity     1  True   
 665   665  ptm180    -72.1   -32.6  Favored  13  11  1.22  14  0.40  molprobity     1  True   
 666   666  mm-40     -79.9   -50.6  Favored   6   9  0.42  12  0.37  molprobity     1  True   
 667   667  mm-40    -101.4   -51.3  Favored   6   9  0.38  12  0.41  molprobity     1  True   
 668   668  ?         -70.1  -111.4  OUTLIER   3   4  0.56   5  0.19  molprobity     1  True   
 669   669  t        -166.0   180.0  Favored   7   7  0.50  10  0.51  molprobity     1  True   
 670   670  tt0       -60.5   -26.6  Favored   8   9  0.36  12  0.23  molprobity     1  True   
 671   671  tttm      -59.7   -50.2  Favored  13   9  0.34  11  0.21  molprobity     1  True   
 672   672  m-20      -61.5   -44.8  Favored   4   8  0.23  11  0.47  molprobity     1  True   
 673   673  tp        -52.3   -49.6  Favored  11   8  0.38  11  0.34  molprobity     1  True   
 674   674  t         -61.4   -50.8  Favored   5   6  0.46   8  0.24  molprobity     1  True   
 675   675  mt-10     -64.5   -41.7  Favored   6   9  0.46  12  0.35  molprobity     1  True   
 676   676  mt        -65.6   -44.2  Favored  11   8  0.41  11  0.18  molprobity     1  True   
 677   677  mt-30     -59.5   -40.4  Favored   8   9  0.41  12  0.30  molprobity     1  True   
 678   678  t70       -66.4   -39.6  Favored   4   8  0.31  11  0.36  molprobity     1  True   
 679   679  ?         -63.1   -47.2  Favored   5   5  0.31   7  0.31  molprobity     1  True   
 680   680  ptmm?     -70.6   -32.5  Favored  13   9  0.36  11  0.27  molprobity     1  True   
 681   681  tp        -57.7   -50.8  Favored  11   8  0.39  11  0.21  molprobity     1  True   
 682   682  pttp      -64.3   -37.7  Favored  13   9  0.32  11  0.18  molprobity     1  True   
 683   683  ?         -59.0   -50.6  Favored   5   5  0.39   7  0.33  molprobity     1  True   
 684   684  mt-10     -60.8   -31.6  Favored   6   9  0.40  12  0.37  molprobity     1  True   
 685   685  ?         -86.7    -8.9  Favored   3   4  0.54   5  0.34  molprobity     1  True   
 686   686  mt        -58.0   -58.1  Favored  11   8  0.46  11  0.24  molprobity     1  True   
 687   687  pt-20     -89.7   -42.2  Favored   6   9  0.31  12  0.37  molprobity     ?  False  
 688   688  OUTLIER  -137.0    84.5  Favored   7  11  0.33  15  0.40  molprobity     ?  False  
 689   689  t-80      -80.5    60.1  Favored   7  11  0.29  15  0.54  molprobity     ?  False  
 690   690  t-80       51.5   -89.7  OUTLIER   7  11  0.32  15  0.34  molprobity     ?  False  
 691   691  p80        40.8    30.3  Allowed   7  11  0.51  15  0.42  molprobity     ?  False  
 692   692  t60      -142.7   135.3  Favored   7  11  0.22  15  0.30  molprobity     ?  False  
 693   693  t-80          ?       ?  ?         7  11  0.60  12  0.29  molprobity     ?  False  
 694   694  mt-10         ?       ?  ?         8   9  0.68  12  0.41  molprobity     ?  False  
 695   695  m-20      -80.5   168.9  Favored   4   8  0.44  12  0.60  molprobity     1  True   
 696   696  Cg_endo   -55.4   -18.2  Favored   7   8  0.47  11  0.36  molprobity     1  True   
 697   697  mt-10     -71.2   -25.4  Favored   6   9  0.38  12  0.38  molprobity     1  True   
 698   698  m-20      -68.4   132.4  Favored   4   8  0.40  12  0.55  molprobity     1  True   
 699   699  Cg_endo   -52.5   -40.4  Favored   7   8  0.41  11  0.29  molprobity     1  True   
 700   700  t80       -68.0   -38.9  Favored   9  12  0.40  16  0.16  molprobity     1  True   
 701   701  m         -66.8   -55.1  Favored   7   7  0.39  10  0.62  molprobity     1  True   
 702   702  ptm85     -55.5   -30.9  Favored  13  11  1.21  14  0.53  molprobity     1  True   
 703   703  t80       -71.1   -43.4  Favored   9  13  0.38  18  0.30  molprobity     1  True   
 704   704  ?         -60.5   -42.5  Favored   5   5  0.33   7  0.20  molprobity     1  True   
 705   705  mm?       -61.3   -37.1  Favored  11   8  0.45  11  0.18  molprobity     1  True   
 706   706  ?         -58.4   -47.0  Favored   5   5  0.30   7  0.26  molprobity     1  True   
 707   707  mt-30     -61.8   -45.2  Favored   8   9  0.40  12  0.22  molprobity     1  True   
 708   708  mm-40     -55.9   -47.5  Favored   6   9  0.33  12  0.36  molprobity     1  True   
 709   709  m-70      -54.6   -42.5  Favored   7  11  0.26  15  0.21  molprobity     1  True   
 710   710  mt        -59.9   -49.1  Favored  11   8  0.43  11  0.26  molprobity     1  True   
 711   711  mtpp      -63.7   -19.1  Favored  13   9  0.40  11  0.28  molprobity     1  True   
 712   712  m-70     -109.4    25.6  Favored   7  11  0.38  15  0.32  molprobity     1  True   
 713   713  t70        76.5   -15.8  Allowed   4   8  0.53  11  0.44  molprobity     1  True   
 714   714  m120      -74.7    72.8  Allowed   6   8  0.47  11  0.22  molprobity     1  True   
 715   715  ?         -67.2   -46.5  Favored   5   5  0.34   7  0.28  molprobity     1  True   
 716   716  t         -61.2   -48.1  Favored   5   6  0.44   8  0.18  molprobity     1  True   
 717   717  mmt180    -58.1   -40.9  Favored  13  11  1.16  14  0.47  molprobity     1  True   
 718   718  ?         -63.2   -44.9  Favored   5   5  0.20   7  0.29  molprobity     1  True   
 719   719  tp        -53.9   -48.4  Favored  11   8  0.39  11  0.22  molprobity     1  True   
 720   720  ?         -57.4   -36.5  Favored   5   5  0.34   7  0.21  molprobity     1  True   
 721   721  mt        -72.2   -47.6  Favored  11   8  0.30  11  0.15  molprobity     1  True   
 722   722  m-85      -58.4   -47.7  Favored   9  12  0.41  16  0.17  molprobity     1  True   
 723   723  mt-10     -56.6   -45.5  Favored   6   9  0.33  12  0.43  molprobity     1  True   
 724   724  tt0       -60.2   -40.4  Favored   6   9  0.33  12  0.29  molprobity     1  True   
 725   725  mt        -57.6   -36.2  Favored  11   8  0.35  11  0.18  molprobity     1  True   
 726   726  t         -69.5   -38.2  Favored   9   7  0.37  10  0.41  molprobity     1  True   
 727   727  pt-20     -82.2   -31.7  Favored   6   9  0.39  12  0.38  molprobity     1  True   
 728   728  p         -86.3   -44.3  Favored   7   7  0.52  10  0.65  molprobity     1  True   
 729   729  m-20     -127.0    72.0  Favored   4   8  0.50  12  0.52  molprobity     1  True   
 730   730  Cg_exo    -64.7   -18.3  Favored   7   8  0.44  11  0.34  molprobity     1  True   
 731   731  m-20      -81.2   -14.9  Favored   4   8  0.28  11  0.40  molprobity     1  True   
 732   732  t80       -79.9    86.4  Favored   9  13  0.41  18  0.35  molprobity     1  True   
 733   733  t         -57.7   -37.2  Favored   9   7  0.45  10  0.49  molprobity     1  True   
 734   734  ?         -49.5   -38.9  Favored   3   4  0.50   5  0.14  molprobity     1  True   
 735   735  m         -55.1   -42.5  Favored   7   7  0.40  10  0.56  molprobity     1  True   
 736   736  m-85      -60.6   -45.8  Favored   9  13  0.36  18  0.23  molprobity     1  True   
 737   737  t80       -65.5   -49.4  Favored   9  13  0.35  18  0.21  molprobity     1  True   
 738   738  m-70      -65.4   -39.6  Favored   7  11  0.33  15  0.20  molprobity     1  True   
 739   739  tp        -66.1   -39.8  Favored  11   8  0.39  11  0.26  molprobity     1  True   
 740   740  ?         -57.9   -49.0  Favored   3   4  0.33   5  0.17  molprobity     1  True   
 741   741  mmmp?     -58.0   -33.4  Favored  13   9  0.44  11  0.38  molprobity     1  True   
 742   742  tp        -68.7   -42.8  Favored  11   8  0.39  11  0.20  molprobity     1  True   
 743   743  m-85      -59.3   -43.8  Favored   9  13  0.35  18  0.28  molprobity     1  True   
 744   744  mt-10     -56.4   -42.4  Favored   6   9  0.49  12  0.56  molprobity     1  True   
 745   745  ttm180    -63.4   -24.1  Favored  13  11  1.16  14  0.53  molprobity     1  True   
 746   746  mt        -96.7    11.7  Favored  11   8  0.45  11  0.29  molprobity     1  True   
 747   747  t70        66.8     3.5  Favored   4   8  0.50  11  0.44  molprobity     1  True   
 748   748  mmm180    -78.3    74.1  Favored  13  11  1.20  14  0.71  molprobity     1  True   
 749   749  m         -61.8   -53.3  Favored   7   7  0.51  10  0.50  molprobity     1  True   
 750   750  m-20      -59.0   -50.0  Favored   4   8  0.35  11  0.42  molprobity     1  True   
 751   751  m-20      -54.8   -40.9  Favored   4   8  0.30  11  0.47  molprobity     1  True   
 752   752  ?         -61.6   -45.4  Favored   5   5  0.32   7  0.34  molprobity     1  True   
 753   753  mt        -61.8   -42.7  Favored  11   8  0.32  11  0.39  molprobity     1  True   
 754   754  m-20      -62.7   -36.3  Favored   4   8  0.33  11  0.40  molprobity     1  True   
 755   755  m         -63.6   -47.5  Favored   7   7  0.42  10  0.48  molprobity     1  True   
 756   756  m-85      -61.0   -41.5  Favored   9  13  0.38  18  0.33  molprobity     1  True   
 757   757  ?         -57.0   -56.4  Favored   5   5  0.41   7  0.29  molprobity     1  True   
 758   758  OUTLIER   -61.5   -36.4  Favored   8   9  0.48  12  0.47  molprobity     1  True   
 759   759  ?         -62.9   -37.9  Favored   3   4  0.42   5  0.17  molprobity     1  True   
 760   760  mt        -56.8   -46.2  Favored  11   8  0.33  11  0.39  molprobity     1  True   
 761   761  mt-10     -57.5   -51.4  Favored   6   9  0.37  12  0.32  molprobity     1  True   
 762   762  m         -72.4   -29.9  Favored   9   7  0.43  10  0.35  molprobity     1  True   
 763   763  ?         -66.1   -51.2  Favored   5   5  0.36   7  0.23  molprobity     1  True   
 764   764  ptm180    -65.4   -43.0  Favored  13  11  1.25  14  0.55  molprobity     1  True   
 765   765  mm-40     -87.2   -51.3  Favored   6   9  0.41  12  0.39  molprobity     1  True   
 766   766  mm-40     -78.9   -57.9  Favored   6   9  0.36  12  0.40  molprobity     1  True   
 767   767  ?         -76.2  -108.5  Allowed   3   4  0.52   5  0.15  molprobity     1  True   
 768   768  t        -163.9   177.9  Favored   7   7  0.45  10  0.59  molprobity     1  True   
 769   769  tt0       -63.8   -24.9  Favored   8   9  0.35  12  0.24  molprobity     1  True   
 770   770  tttp      -61.6   -50.6  Favored  13   9  0.41  11  0.19  molprobity     1  True   
 771   771  m-20      -65.0   -41.9  Favored   4   8  0.24  11  0.52  molprobity     1  True   
 772   772  tp        -52.7   -52.1  Favored  11   8  0.37  11  0.32  molprobity     1  True   
 773   773  t         -59.6   -44.4  Favored   5   6  0.34   8  0.19  molprobity     1  True   
 774   774  mm-40     -59.2   -47.8  Favored   6   9  0.37  12  0.41  molprobity     1  True   
 775   775  mt        -66.8   -38.3  Favored  11   8  0.42  11  0.19  molprobity     1  True   
 776   776  mt-30     -62.5   -48.8  Favored   8   9  0.41  12  0.34  molprobity     1  True   
 777   777  t70       -61.0   -34.5  Favored   4   8  0.33  11  0.52  molprobity     1  True   
 778   778  ?         -69.0   -43.0  Favored   5   5  0.35   7  0.36  molprobity     1  True   
 779   779  ptmm?     -73.0   -30.9  Favored  13   9  0.40  11  0.32  molprobity     1  True   
 780   780  tp        -59.6   -53.2  Favored  11   8  0.39  11  0.20  molprobity     1  True   
 781   781  ptmm?     -60.0   -39.5  Favored  13   9  0.30  11  0.20  molprobity     1  True   
 782   782  ?         -58.1   -50.3  Favored   5   5  0.39   7  0.24  molprobity     1  True   
 783   783  mt-10     -72.5    -7.1  Favored   6   9  0.41  12  0.32  molprobity     1  True   
 784   784  ?        -102.2    -9.7  Favored   3   4  0.52   5  0.11  molprobity     1  True   
 785   785  mt        -62.5   -48.2  Favored  11   8  0.44  11  0.23  molprobity     1  True   
 786   786  pt-20    -137.5   176.8  Favored   6   9  0.33  12  0.35  molprobity     ?  False  
 787   787  m-70      -88.9    29.6  Allowed   7  11  0.30  15  0.30  molprobity     ?  False  
 788   788  t60       -71.5    80.4  Allowed   7  11  0.29  15  0.35  molprobity     ?  False  
 789   789  m80       -65.9   120.3  Favored   7  11  0.31  15  0.26  molprobity     ?  False  
 790   790  m80       -83.7   145.0  Favored   7  11  0.27  15  0.30  molprobity     ?  False  
 791   791  m170      -74.4   164.2  Favored   7  11  0.26  15  0.32  molprobity     ?  False  
 792   792  t60           ?       ?  ?         7  11  0.62  12  0.32  molprobity     ?  False  
 793   793  tt0           ?       ?  ?         8   9  0.60  12  0.39  molprobity     ?  False  
 794   794  m-20     -110.0   171.1  Favored   4   8  0.57  12  0.70  molprobity     1  True   
 795   795  Cg_exo    -44.2   -27.8  Favored   7   8  0.57  11  0.51  molprobity     1  True   
 796   796  mt-10     -79.5   -22.7  Favored   6   9  0.41  12  0.33  molprobity     1  True   
 797   797  m-20      -63.2   140.5  Favored   4   8  0.48  12  0.64  molprobity     1  True   
 798   798  Cg_exo    -44.9   -61.7  Allowed   7   8  0.37  11  0.36  molprobity     1  True   
 799   799  t80       -64.4   -30.5  Favored   9  12  0.37  16  0.22  molprobity     1  True   
 800   800  m         -70.0   -55.7  Favored   7   7  0.35  10  0.53  molprobity     1  True   
 801   801  ptm180    -61.4   -33.5  Favored  13  11  1.24  14  0.36  molprobity     1  True   
 802   802  t80       -58.4   -49.7  Favored   9  13  0.38  18  0.51  molprobity     1  True   
 803   803  ?         -61.7   -49.6  Favored   5   5  0.38   7  0.19  molprobity     1  True   
 804   804  mm?       -58.5   -36.0  Favored  11   8  0.47  11  0.17  molprobity     1  True   
 805   805  ?         -59.5   -46.0  Favored   5   5  0.28   7  0.32  molprobity     1  True   
 806   806  mt-30     -60.3   -39.9  Favored   8   9  0.35  12  0.26  molprobity     1  True   
 807   807  mm-40     -62.5   -35.8  Favored   6   9  0.36  12  0.34  molprobity     1  True   
 808   808  m-70      -62.5   -40.6  Favored   7  11  0.24  15  0.25  molprobity     1  True   
 809   809  mt        -59.8   -40.1  Favored  11   8  0.43  11  0.23  molprobity     1  True   
 810   810  mtpt      -63.9   -28.9  Favored  13   9  0.38  11  0.24  molprobity     1  True   
 811   811  m-70      -89.5     8.2  Favored   7  11  0.38  15  0.28  molprobity     1  True   
 812   812  t70        68.6     4.1  Favored   4   8  0.45  11  0.43  molprobity     1  True   
 813   813  m120      -78.8    66.3  Favored   6   8  0.40  11  0.31  molprobity     1  True   
 814   814  ?         -63.7   -42.4  Favored   5   5  0.30   7  0.20  molprobity     1  True   
 815   815  m         -65.8   -30.5  Favored   5   6  0.47   8  0.22  molprobity     1  True   
 816   816  mmt180    -75.8   -45.0  Favored  13  11  1.21  14  0.43  molprobity     1  True   
 817   817  ?         -61.0   -44.3  Favored   5   5  0.23   7  0.41  molprobity     1  True   
 818   818  tp        -52.2   -48.4  Favored  11   8  0.34  11  0.25  molprobity     1  True   
 819   819  ?         -55.2   -46.1  Favored   5   5  0.34   7  0.21  molprobity     1  True   
 820   820  mt        -63.4   -43.8  Favored  11   8  0.38  11  0.13  molprobity     1  True   
 821   821  m-85      -63.7   -47.7  Favored   9  12  0.40  16  0.21  molprobity     1  True   
 822   822  mt-10     -58.0   -45.4  Favored   6   9  0.38  12  0.35  molprobity     1  True   
 823   823  tt0       -65.3   -34.6  Favored   6   9  0.41  12  0.32  molprobity     1  True   
 824   824  mt        -59.2   -36.3  Favored  11   8  0.42  11  0.21  molprobity     1  True   
 825   825  t         -61.0   -41.2  Favored   9   7  0.33  10  0.40  molprobity     1  True   
 826   826  pt-20     -82.0   -32.2  Favored   6   9  0.35  12  0.35  molprobity     1  True   
 827   827  p         -78.2   -55.4  Favored   7   7  0.50  10  0.65  molprobity     1  True   
 828   828  m-20     -125.7    74.8  Favored   4   8  0.43  12  0.55  molprobity     1  True   
 829   829  Cg_endo   -71.4    -9.2  Favored   7   8  0.41  11  0.33  molprobity     1  True   
 830   830  m-20      -78.6   -18.3  Favored   4   8  0.23  11  0.42  molprobity     1  True   
 831   831  t80       -86.5   100.9  Favored   9  13  0.37  18  0.31  molprobity     1  True   
 832   832  t         -63.0   -34.7  Favored   9   7  0.51  10  0.42  molprobity     1  True   
 833   833  ?         -51.5   -35.1  Favored   3   4  0.63   5  0.18  molprobity     1  True   
 834   834  m         -60.2   -52.0  Favored   7   7  0.46  10  0.58  molprobity     1  True   
 835   835  m-85      -58.5   -46.5  Favored   9  13  0.37  18  0.28  molprobity     1  True   
 836   836  t80       -60.6   -56.1  Favored   9  13  0.36  18  0.18  molprobity     1  True   
 837   837  m-70      -69.4   -30.0  Favored   7  11  0.33  15  0.22  molprobity     1  True   
 838   838  tp        -65.6   -45.9  Favored  11   8  0.45  11  0.25  molprobity     1  True   
 839   839  ?         -58.2   -45.0  Favored   3   4  0.42   5  0.15  molprobity     1  True   
 840   840  OUTLIER   -57.8   -34.2  Favored  13   9  0.45  11  0.35  molprobity     1  True   
 841   841  tp        -70.3   -43.7  Favored  11   8  0.42  11  0.20  molprobity     1  True   
 842   842  m-85      -57.2   -47.9  Favored   9  13  0.35  18  0.30  molprobity     1  True   
 843   843  mt-10     -57.7   -37.1  Favored   6   9  0.37  12  0.41  molprobity     1  True   
 844   844  ttt180    -62.6   -39.0  Favored  13  11  1.17  14  0.55  molprobity     1  True   
 845   845  mt        -86.8    18.0  Favored  11   8  0.46  11  0.26  molprobity     1  True   
 846   846  t70        69.2     1.4  Favored   4   8  0.48  11  0.41  molprobity     1  True   
 847   847  mmm180    -78.1    65.6  Favored  13  11  1.22  14  0.69  molprobity     1  True   
 848   848  m         -64.3   -51.7  Favored   7   7  0.45  10  0.48  molprobity     1  True   
 849   849  t70       -61.2   -47.6  Favored   4   8  0.26  11  0.43  molprobity     1  True   
 850   850  m-20      -56.6   -40.9  Favored   4   8  0.28  11  0.53  molprobity     1  True   
 851   851  ?         -61.5   -43.6  Favored   5   5  0.26   7  0.20  molprobity     1  True   
 852   852  mt        -55.4   -51.1  Favored  11   8  0.35  11  0.34  molprobity     1  True   
 853   853  m-20      -58.8   -40.4  Favored   4   8  0.33  11  0.39  molprobity     1  True   
 854   854  m         -59.0   -47.2  Favored   7   7  0.49  10  0.47  molprobity     1  True   
 855   855  m-85      -66.2   -36.8  Favored   9  13  0.35  18  0.27  molprobity     1  True   
 856   856  ?         -57.6   -56.3  Favored   5   5  0.35   7  0.30  molprobity     1  True   
 857   857  OUTLIER   -63.9   -32.4  Favored   8   9  0.46  12  0.50  molprobity     1  True   
 858   858  ?         -62.8   -38.0  Favored   3   4  0.47   5  0.23  molprobity     1  True   
 859   859  mt        -55.9   -42.4  Favored  11   8  0.36  11  0.42  molprobity     1  True   
 860   860  mt-10     -61.7   -55.5  Favored   6   9  0.39  12  0.38  molprobity     1  True   
 861   861  m         -68.5   -27.0  Favored   9   7  0.32  10  0.39  molprobity     1  True   
 862   862  ?         -68.2   -51.7  Favored   5   5  0.27   7  0.21  molprobity     1  True   
 863   863  ptp180    -67.9   -36.7  Favored  13  11  1.13  14  0.42  molprobity     1  True   
 864   864  mt-10     -87.5   -51.7  Favored   6   9  0.36  12  0.37  molprobity     1  True   
 865   865  mm-40     -91.5   -52.2  Favored   6   9  0.42  12  0.43  molprobity     1  True   
 866   866  ?         -69.7   -95.3  OUTLIER   3   4  0.53   5  0.26  molprobity     1  True   
 867   867  t        -174.5   168.8  Favored   7   7  0.48  10  0.64  molprobity     1  True   
 868   868  tt0       -63.4   -32.9  Favored   8   9  0.36  12  0.29  molprobity     1  True   
 869   869  tttp      -65.7   -51.4  Favored  13   9  0.37  11  0.16  molprobity     1  True   
 870   870  m-20      -61.3   -36.0  Favored   4   8  0.28  11  0.36  molprobity     1  True   
 871   871  tp        -54.5   -52.2  Favored  11   8  0.36  11  0.31  molprobity     1  True   
 872   872  m         -63.6   -31.8  Favored   5   6  0.40   8  0.20  molprobity     1  True   
 873   873  mm-40     -64.2   -52.1  Favored   6   9  0.38  12  0.40  molprobity     1  True   
 874   874  mt        -67.5   -45.5  Favored  11   8  0.39  11  0.21  molprobity     1  True   
 875   875  mt-30     -60.6   -37.6  Favored   8   9  0.40  12  0.31  molprobity     1  True   
 876   876  t70       -72.0   -35.1  Favored   4   8  0.32  11  0.35  molprobity     1  True   
 877   877  ?         -62.6   -43.3  Favored   5   5  0.32   7  0.23  molprobity     1  True   
 878   878  ptmt      -74.6   -34.5  Favored  13   9  0.42  11  0.25  molprobity     1  True   
 879   879  tp        -56.1   -49.5  Favored  11   8  0.44  11  0.22  molprobity     1  True   
 880   880  pttp      -64.2   -37.3  Favored  13   9  0.32  11  0.19  molprobity     1  True   
 881   881  ?         -59.3   -50.2  Favored   5   5  0.33   7  0.22  molprobity     1  True   
 882   882  mt-10     -67.2   -28.2  Favored   6   9  0.35  12  0.37  molprobity     1  True   
 883   883  ?         -64.8   -39.3  Favored   3   4  0.45   5  0.21  molprobity     1  True   
 884   884  mt        -58.6   -56.9  Favored  11   8  0.37  11  0.34  molprobity     1  True   
 885   885  pt-20     179.8  -167.9  Allowed   6   9  0.37  12  0.46  molprobity     ?  False  
 886   886  m80      -129.7    -6.3  Favored   7  11  0.30  15  0.31  molprobity     ?  False  
 887   887  m-70       54.7    91.7  OUTLIER   7  11  0.37  15  0.28  molprobity     ?  False  
 888   888  p80       -64.3     8.8  Allowed   7  11  0.40  15  0.49  molprobity     ?  False  
 889   889  p-80      -75.1   -21.3  Favored   7  11  0.37  15  0.54  molprobity     ?  False  
 890   890  t60      -126.4    99.6  Favored   7  11  0.29  15  0.29  molprobity     ?  False  
 891   891  t-80          ?       ?  ?         7  11  0.55  12  0.29  molprobity     ?  False  
 892   892  OUTLIER       ?       ?  ?         8   9  0.62  12  0.38  molprobity     ?  False  
 893   893  m-20      -97.1   147.8  Favored   4   8  0.36  12  0.56  molprobity     1  True   
 894   894  Cg_exo    -60.5    -7.2  Favored   7   8  0.44  11  0.29  molprobity     1  True   
 895   895  mt-10     -81.6   -28.4  Favored   6   9  0.31  12  0.38  molprobity     1  True   
 896   896  t70       -62.0   119.3  Favored   4   8  0.50  12  0.62  molprobity     1  True   
 897   897  Cg_exo    -41.0   -57.4  Allowed   7   8  0.35  11  0.37  molprobity     1  True   
 898   898  t80       -67.5   -32.0  Favored   9  12  0.36  16  0.17  molprobity     1  True   
 899   899  m         -68.1   -55.2  Favored   7   7  0.48  10  0.50  molprobity     1  True   
 900   900  ptm85     -59.7   -34.0  Favored  13  11  1.28  14  0.67  molprobity     1  True   
 901   901  t80       -65.0   -43.1  Favored   9  13  0.39  18  0.46  molprobity     1  True   
 902   902  ?         -65.5   -46.6  Favored   5   5  0.30   7  0.20  molprobity     1  True   
 903   903  mm?       -57.4   -36.1  Favored  11   8  0.45  11  0.18  molprobity     1  True   
 904   904  ?         -57.4   -46.4  Favored   5   5  0.27   7  0.29  molprobity     1  True   
 905   905  mt-30     -67.3   -36.5  Favored   8   9  0.36  12  0.16  molprobity     1  True   
 906   906  mm-40     -58.0   -38.3  Favored   6   9  0.37  12  0.35  molprobity     1  True   
 907   907  m-70      -65.4   -44.5  Favored   7  11  0.28  15  0.23  molprobity     1  True   
 908   908  mt        -56.5   -41.8  Favored  11   8  0.45  11  0.30  molprobity     1  True   
 909   909  mttm      -56.4   -40.1  Favored  13   9  0.33  11  0.26  molprobity     1  True   
 910   910  m-70      -94.8    14.9  Favored   7  11  0.31  15  0.40  molprobity     1  True   
 911   911  t70        74.6     3.3  Favored   4   8  0.37  11  0.51  molprobity     1  True   
 912   912  m120      -76.1    68.6  Favored   6   8  0.41  11  0.30  molprobity     1  True   
 913   913  ?         -65.2   -36.9  Favored   5   5  0.23   7  0.27  molprobity     1  True   
 914   914  p         -58.4   -54.1  Favored   5   6  0.39   8  0.32  molprobity     1  True   
 915   915  mmt180    -61.6   -39.0  Favored  13  11  1.16  14  0.54  molprobity     1  True   
 916   916  ?         -63.1   -42.0  Favored   5   5  0.31   7  0.34  molprobity     1  True   
 917   917  tp        -58.5   -45.0  Favored  11   8  0.33  11  0.18  molprobity     1  True   
 918   918  ?         -56.1   -42.4  Favored   5   5  0.40   7  0.23  molprobity     1  True   
 919   919  mt        -67.2   -49.3  Favored  11   8  0.42  11  0.15  molprobity     1  True   
 920   920  m-85      -58.8   -49.2  Favored   9  12  0.42  16  0.21  molprobity     1  True   
 921   921  mt-10     -59.5   -36.5  Favored   6   9  0.36  12  0.33  molprobity     1  True   
 922   922  tt0       -67.2   -37.8  Favored   6   9  0.33  12  0.29  molprobity     1  True   
 923   923  mt        -58.9   -36.4  Favored  11   8  0.39  11  0.20  molprobity     1  True   
 924   924  t         -68.6   -36.4  Favored   9   7  0.38  10  0.44  molprobity     1  True   
 925   925  pt-20     -81.6   -28.5  Favored   6   9  0.43  12  0.39  molprobity     1  True   
 926   926  p         -87.0   -55.6  Favored   7   7  0.52  10  0.61  molprobity     1  True   
 927   927  m-20     -119.3    89.2  Favored   4   8  0.39  12  0.53  molprobity     1  True   
 928   928  Cg_endo   -70.6   -13.6  Favored   7   8  0.38  11  0.25  molprobity     1  True   
 929   929  p-10      -92.5   -10.3  Favored   4   8  0.32  11  0.41  molprobity     1  True   
 930   930  t80       -77.2    89.5  Favored   9  13  0.38  18  0.35  molprobity     1  True   
 931   931  t         -58.9   -36.9  Favored   9   7  0.44  10  0.44  molprobity     1  True   
 932   932  ?         -50.5   -32.9  Favored   3   4  0.55   5  0.18  molprobity     1  True   
 933   933  m         -63.7   -55.2  Favored   7   7  0.35  10  0.62  molprobity     1  True   
 934   934  m-85      -58.5   -42.9  Favored   9  13  0.37  18  0.25  molprobity     1  True   
 935   935  t80       -57.8   -52.1  Favored   9  13  0.39  18  0.25  molprobity     1  True   
 936   936  m-70      -75.5   -31.1  Favored   7  11  0.31  15  0.24  molprobity     1  True   
 937   937  tp        -63.9   -42.2  Favored  11   8  0.39  11  0.28  molprobity     1  True   
 938   938  ?         -60.5   -45.2  Favored   3   4  0.37   5  0.26  molprobity     1  True   
 939   939  mmtp      -57.0   -38.4  Favored  13   9  0.36  11  0.36  molprobity     1  True   
 940   940  tp        -65.6   -41.8  Favored  11   8  0.33  11  0.24  molprobity     1  True   
 941   941  m-85      -62.7   -38.4  Favored   9  13  0.36  18  0.26  molprobity     1  True   
 942   942  mt-10     -57.7   -43.3  Favored   6   9  0.46  12  0.55  molprobity     1  True   
 943   943  ttt180    -64.3   -29.1  Favored  13  11  1.15  14  0.53  molprobity     1  True   
 944   944  mt        -94.5    13.0  Favored  11   8  0.42  11  0.24  molprobity     1  True   
 945   945  t70        66.6     5.8  Favored   4   8  0.48  11  0.42  molprobity     1  True   
 946   946  mmm180    -81.3    74.1  Favored  13  11  1.33  14  0.70  molprobity     1  True   
 947   947  m         -62.2   -52.3  Favored   7   7  0.55  10  0.55  molprobity     1  True   
 948   948  m-20      -61.5   -45.8  Favored   4   8  0.37  11  0.35  molprobity     1  True   
 949   949  m-20      -63.1   -38.4  Favored   4   8  0.32  11  0.49  molprobity     1  True   
 950   950  ?         -58.3   -50.4  Favored   5   5  0.37   7  0.29  molprobity     1  True   
 951   951  mt        -56.2   -46.9  Favored  11   8  0.30  11  0.43  molprobity     1  True   
 952   952  t70       -61.1   -38.3  Favored   4   8  0.33  11  0.37  molprobity     1  True   
 953   953  m         -63.0   -44.1  Favored   7   7  0.46  10  0.43  molprobity     1  True   
 954   954  m-85      -65.4   -39.4  Favored   9  13  0.36  18  0.24  molprobity     1  True   
 955   955  ?         -54.1   -56.4  Favored   5   5  0.41   7  0.23  molprobity     1  True   
 956   956  OUTLIER   -62.6   -38.1  Favored   8   9  0.49  12  0.49  molprobity     1  True   
 957   957  ?         -56.5   -40.4  Favored   3   4  0.42   5  0.21  molprobity     1  True   
 958   958  mt        -57.7   -44.0  Favored  11   8  0.36  11  0.43  molprobity     1  True   
 959   959  mt-10     -63.2   -49.7  Favored   6   9  0.40  12  0.35  molprobity     1  True   
 960   960  m         -74.3   -22.7  Favored   9   7  0.35  10  0.41  molprobity     1  True   
 961   961  ?         -67.7   -49.7  Favored   5   5  0.30   7  0.27  molprobity     1  True   
 962   962  ptm180    -66.8   -38.6  Favored  13  11  1.14  14  0.45  molprobity     1  True   
 963   963  mm-40     -87.6   -51.8  Favored   6   9  0.45  12  0.39  molprobity     1  True   
 964   964  mm-40     -92.0   -55.7  Favored   6   9  0.45  12  0.45  molprobity     1  True   
 965   965  ?         -77.6  -109.6  Allowed   3   4  0.48   5  0.21  molprobity     1  True   
 966   966  t        -152.0   165.3  Favored   7   7  0.41  10  0.64  molprobity     1  True   
 967   967  tt0       -72.3   -23.6  Favored   8   9  0.37  12  0.31  molprobity     1  True   
 968   968  tttp      -66.2   -51.1  Favored  13   9  0.35  11  0.19  molprobity     1  True   
 969   969  m-20      -67.5   -32.4  Favored   4   8  0.25  11  0.41  molprobity     1  True   
 970   970  tp        -53.3   -48.0  Favored  11   8  0.38  11  0.28  molprobity     1  True   
 971   971  t         -59.0   -45.4  Favored   5   6  0.43   8  0.28  molprobity     1  True   
 972   972  mm-40     -59.8   -51.0  Favored   6   9  0.40  12  0.41  molprobity     1  True   
 973   973  mt        -60.5   -36.0  Favored  11   8  0.42  11  0.19  molprobity     1  True   
 974   974  mt-30     -60.0   -48.9  Favored   8   9  0.37  12  0.19  molprobity     1  True   
 975   975  t70       -64.7   -40.9  Favored   4   8  0.27  11  0.35  molprobity     1  True   
 976   976  ?         -55.0   -44.9  Favored   5   5  0.36   7  0.36  molprobity     1  True   
 977   977  ptmt      -74.8   -38.4  Favored  13   9  0.38  11  0.28  molprobity     1  True   
 978   978  tp        -54.6   -49.8  Favored  11   8  0.41  11  0.17  molprobity     1  True   
 979   979  pttt      -60.5   -47.6  Favored  13   9  0.35  11  0.30  molprobity     1  True   
 980   980  ?         -59.2   -40.3  Favored   5   5  0.38   7  0.27  molprobity     1  True   
 981   981  mt-10     -67.0   -15.6  Favored   6   9  0.38  12  0.34  molprobity     1  True   
 982   982  ?        -111.5   -10.5  Favored   3   4  0.48   5  0.13  molprobity     1  True   
 983   983  mt        -65.7   -31.3  Favored  11   8  0.45  11  0.21  molprobity     1  True   
 984   984  OUTLIER  -125.6  -173.3  Favored   6   9  0.42  12  0.39  molprobity     ?  False  
 985   985  p-80     -156.0   100.6  Favored   7  11  0.29  15  0.26  molprobity     ?  False  
 986   986  m80       -63.3   109.8  Allowed   7  11  0.34  15  0.23  molprobity     ?  False  
 987   987  t60       -91.5    97.1  Favored   7  11  0.34  15  0.28  molprobity     ?  False  
 988   988  t60      -172.9   130.0  Allowed   7  11  0.31  15  0.24  molprobity     ?  False  
 989   989  p80       -80.0   145.8  Favored   7  11  0.30  15  0.23  molprobity     ?  False  
 990   990  t-80          ?       ?  ?         7  11  0.55  12  0.26  molprobity     ?  False  
 991   991  mp0           ?       ?  ?         8   9  0.66  12  0.38  molprobity     ?  False  
 992   992  m-20     -139.0   159.6  Favored   4   8  0.38  12  0.50  molprobity     1  True   
 993   993  Cg_endo   -62.3    -0.8  Allowed   7   8  0.45  11  0.31  molprobity     1  True   
 994   994  mt-10     -89.8   -16.2  Favored   6   9  0.35  12  0.30  molprobity     1  True   
 995   995  m-20      -71.6   144.9  Favored   4   8  0.43  12  0.56  molprobity     1  True   
 996   996  Cg_endo   -51.6   -52.3  Favored   7   8  0.48  11  0.37  molprobity     1  True   
 997   997  t80       -73.5   -31.0  Favored   9  12  0.39  16  0.17  molprobity     1  True   
 998   998  m         -68.2   -55.1  Favored   7   7  0.42  10  0.58  molprobity     1  True   
 999   999  ptm85     -56.2   -36.0  Favored  13  11  1.18  14  0.72  molprobity     1  True   
1000  1000  t80       -62.6   -46.7  Favored   9  13  0.42  18  0.37  molprobity     1  True   
1001  1001  ?         -62.9   -49.2  Favored   5   5  0.33   7  0.19  molprobity     1  True   
1002  1002  mm?       -56.8   -37.2  Favored  11   8  0.47  11  0.19  molprobity     1  True   
1003  1003  ?         -56.9   -48.8  Favored   5   5  0.34   7  0.27  molprobity     1  True   
1004  1004  mt-30     -66.2   -38.5  Favored   8   9  0.37  12  0.21  molprobity     1  True   
1005  1005  mm-40     -55.8   -44.5  Favored   6   9  0.37  12  0.36  molprobity     1  True   
1006  1006  m-70      -62.0   -39.8  Favored   7  11  0.24  15  0.20  molprobity     1  True   
1007  1007  mt        -58.8   -39.0  Favored  11   8  0.44  11  0.26  molprobity     1  True   
1008  1008  mtpt      -65.1   -31.9  Favored  13   9  0.33  11  0.28  molprobity     1  True   
1009  1009  m-70      -87.6    11.8  Favored   7  11  0.33  15  0.30  molprobity     1  True   
1010  1010  t70        68.0    11.3  Favored   4   8  0.43  11  0.47  molprobity     1  True   
1011  1011  m120      -75.3    65.0  Allowed   6   8  0.36  11  0.26  molprobity     1  True   
1012  1012  ?         -60.2   -48.4  Favored   5   5  0.30   7  0.26  molprobity     1  True   
1013  1013  t         -64.6   -47.4  Favored   5   6  0.47   8  0.24  molprobity     1  True   
1014  1014  mmt180    -63.5   -41.7  Favored  13  11  1.25  14  0.58  molprobity     1  True   
1015  1015  ?         -67.1   -38.9  Favored   5   5  0.21   7  0.22  molprobity     1  True   
1016  1016  tp        -56.9   -47.3  Favored  11   8  0.37  11  0.20  molprobity     1  True   
1017  1017  ?         -58.6   -32.9  Favored   5   5  0.38   7  0.22  molprobity     1  True   
1018  1018  mt        -71.2   -50.9  Favored  11   8  0.41  11  0.12  molprobity     1  True   
1019  1019  m-85      -59.9   -46.0  Favored   9  12  0.41  16  0.20  molprobity     1  True   
1020  1020  mt-10     -62.8   -33.3  Favored   6   9  0.44  12  0.30  molprobity     1  True   
1021  1021  tt0       -66.5   -42.6  Favored   6   9  0.38  12  0.36  molprobity     1  True   
1022  1022  mt        -53.6   -34.8  Favored  11   8  0.38  11  0.23  molprobity     1  True   
1023  1023  t         -61.9   -46.8  Favored   9   7  0.38  10  0.41  molprobity     1  True   
1024  1024  pt-20     -81.3   -29.4  Favored   6   9  0.42  12  0.38  molprobity     1  True   
1025  1025  p         -86.0   -44.9  Favored   7   7  0.47  10  0.62  molprobity     1  True   
1026  1026  m-20     -128.4    69.0  Favored   4   8  0.45  12  0.48  molprobity     1  True   
1027  1027  Cg_exo    -61.3   -18.0  Favored   7   8  0.40  11  0.36  molprobity     1  True   
1028  1028  t70       -70.5   -30.7  Favored   4   8  0.32  11  0.47  molprobity     1  True   
1029  1029  t80       -77.5    91.1  Favored   9  13  0.37  18  0.27  molprobity     1  True   
1030  1030  t         -57.5   -36.1  Favored   9   7  0.46  10  0.39  molprobity     1  True   
1031  1031  ?         -51.4   -31.9  Favored   3   4  0.50   5  0.26  molprobity     1  True   
1032  1032  m         -58.1   -51.5  Favored   7   7  0.41  10  0.58  molprobity     1  True   
1033  1033  m-85      -59.2   -44.9  Favored   9  13  0.36  18  0.23  molprobity     1  True   
1034  1034  t80       -67.0   -51.5  Favored   9  13  0.36  18  0.21  molprobity     1  True   
1035  1035  m-70      -69.7   -35.3  Favored   7  11  0.31  15  0.26  molprobity     1  True   
1036  1036  tp        -64.0   -38.8  Favored  11   8  0.39  11  0.29  molprobity     1  True   
1037  1037  ?         -59.5   -47.0  Favored   3   4  0.43   5  0.18  molprobity     1  True   
1038  1038  mmmp?     -58.0   -38.9  Favored  13   9  0.47  11  0.46  molprobity     1  True   
1039  1039  tp        -67.1   -39.5  Favored  11   8  0.40  11  0.21  molprobity     1  True   
1040  1040  m-85      -59.6   -47.9  Favored   9  13  0.33  18  0.23  molprobity     1  True   
1041  1041  mt-10     -50.7   -45.2  Favored   6   9  0.45  12  0.56  molprobity     1  True   
1042  1042  ttt-85    -59.7   -44.4  Favored  13  11  1.28  14  0.51  molprobity     1  True   
1043  1043  mt        -84.9    18.0  Favored  11   8  0.46  11  0.31  molprobity     1  True   
1044  1044  t70        65.2    12.2  Favored   4   8  0.45  11  0.50  molprobity     1  True   
1045  1045  mmm-85    -83.8    52.8  Favored  13  11  1.14  14  0.46  molprobity     1  True   
1046  1046  m         -57.2   -51.3  Favored   7   7  0.49  10  0.45  molprobity     1  True   
1047  1047  t70       -63.8   -39.1  Favored   4   8  0.29  11  0.36  molprobity     1  True   
1048  1048  m-20      -62.2   -38.6  Favored   4   8  0.30  11  0.49  molprobity     1  True   
1049  1049  ?         -63.5   -51.7  Favored   5   5  0.25   7  0.28  molprobity     1  True   
1050  1050  mt        -52.7   -51.1  Favored  11   8  0.33  11  0.48  molprobity     1  True   
1051  1051  t70       -58.1   -45.2  Favored   4   8  0.31  11  0.36  molprobity     1  True   
1052  1052  m         -59.4   -40.9  Favored   7   7  0.52  10  0.39  molprobity     1  True   
1053  1053  m-85      -64.2   -40.6  Favored   9  13  0.36  18  0.31  molprobity     1  True   
1054  1054  ?         -56.9   -54.0  Favored   5   5  0.36   7  0.22  molprobity     1  True   
1055  1055  OUTLIER   -67.9   -35.0  Favored   8   9  0.48  12  0.46  molprobity     1  True   
1056  1056  ?         -58.2   -34.5  Favored   3   4  0.44   5  0.20  molprobity     1  True   
1057  1057  mt        -52.2   -41.8  Favored  11   8  0.37  11  0.38  molprobity     1  True   
1058  1058  mt-10     -68.2   -55.2  Favored   6   9  0.27  12  0.36  molprobity     1  True   
1059  1059  m         -62.7   -24.2  Favored   9   7  0.45  10  0.41  molprobity     1  True   
1060  1060  ?         -69.7   -47.5  Favored   5   5  0.26   7  0.20  molprobity     1  True   
1061  1061  ptm180    -77.1   -28.4  Favored  13  11  1.21  14  0.63  molprobity     1  True   
1062  1062  mt-10     -86.9   -52.7  Favored   6   9  0.41  12  0.39  molprobity     1  True   
1063  1063  mm-40     -95.9   -41.0  Favored   6   9  0.42  12  0.44  molprobity     1  True   
1064  1064  ?         -87.6  -128.3  Favored   3   4  0.53   5  0.11  molprobity     1  True   
1065  1065  t        -149.2   174.6  Favored   7   7  0.48  10  0.54  molprobity     1  True   
1066  1066  tp-100    -59.2   -35.1  Favored   8   9  0.40  12  0.31  molprobity     1  True   
1067  1067  tttt      -55.5   -50.0  Favored  13   9  0.36  11  0.21  molprobity     1  True   
1068  1068  m-20      -63.7   -44.7  Favored   4   8  0.26  11  0.47  molprobity     1  True   
1069  1069  tp        -52.7   -44.8  Favored  11   8  0.38  11  0.32  molprobity     1  True   
1070  1070  t         -63.3   -44.0  Favored   5   6  0.39   8  0.24  molprobity     1  True   
1071  1071  mt-10     -69.0   -38.0  Favored   6   9  0.37  12  0.30  molprobity     1  True   
1072  1072  mt        -63.7   -46.2  Favored  11   8  0.40  11  0.17  molprobity     1  True   
1073  1073  mt-30     -61.2   -44.3  Favored   8   9  0.37  12  0.23  molprobity     1  True   
1074  1074  t70       -61.1   -42.8  Favored   4   8  0.32  11  0.41  molprobity     1  True   
1075  1075  ?         -60.9   -42.1  Favored   5   5  0.26   7  0.34  molprobity     1  True   
1076  1076  pttp      -75.2   -36.0  Favored  13   9  0.39  11  0.34  molprobity     1  True   
1077  1077  tp        -55.3   -51.1  Favored  11   8  0.49  11  0.24  molprobity     1  True   
1078  1078  pttt      -58.4   -42.1  Favored  13   9  0.39  11  0.40  molprobity     1  True   
1079  1079  ?         -67.5   -42.3  Favored   5   5  0.28   7  0.29  molprobity     1  True   
1080  1080  mt-10     -65.7    -6.5  Favored   6   9  0.44  12  0.44  molprobity     1  True   
1081  1081  ?        -116.7     4.1  Favored   3   4  0.50   5  0.20  molprobity     1  True   
1082  1082  mt        -65.9   -65.7  Allowed  11   8  0.46  11  0.22  molprobity     1  True   
1083  1083  OUTLIER  -105.6  -177.5  Favored   6   9  0.40  12  0.50  molprobity     ?  False  
1084  1084  p-80     -128.4    59.2  Allowed   7  11  0.40  15  0.34  molprobity     ?  False  
1085  1085  t60       -91.0   -24.2  Favored   7  11  0.34  15  0.37  molprobity     ?  False  
1086  1086  m-70     -114.7    20.8  Favored   7  11  0.30  15  0.31  molprobity     ?  False  
1087  1087  m-70       70.6   -26.8  Allowed   7  11  0.46  15  0.31  molprobity     ?  False  
1088  1088  t-80      -65.5   130.1  Favored   7  11  0.29  15  0.29  molprobity     ?  False  
1089  1089  p-80          ?       ?  ?         7  11  0.58  12  0.34  molprobity     ?  False  
1090  1090  mp0           ?       ?  ?         8   9  0.71  12  0.32  molprobity     ?  False  
1091  1091  m-20     -101.3   163.4  Favored   4   8  0.35  12  0.46  molprobity     1  True   
1092  1092  Cg_endo   -59.4   -12.9  Favored   7   8  0.42  11  0.40  molprobity     1  True   
1093  1093  mt-10     -72.2   -36.2  Favored   6   9  0.32  12  0.33  molprobity     1  True   
1094  1094  m-20      -55.7   122.1  Favored   4   8  0.48  12  0.46  molprobity     1  True   
1095  1095  Cg_endo   -48.2   -43.7  Favored   7   8  0.35  11  0.35  molprobity     1  True   
1096  1096  t80       -67.7   -37.8  Favored   9  12  0.41  16  0.20  molprobity     1  True   
1097  1097  m         -63.6   -56.2  Favored   7   7  0.46  10  0.56  molprobity     1  True   
1098  1098  ptm85     -59.3   -34.0  Favored  13  11  1.27  14  0.65  molprobity     1  True   
1099  1099  t80       -66.9   -51.9  Favored   9  13  0.41  18  0.41  molprobity     1  True   
1100  1100  ?         -63.0   -46.1  Favored   5   5  0.33   7  0.23  molprobity     1  True   
1101  1101  mm?       -56.9   -34.3  Favored  11   8  0.44  11  0.17  molprobity     1  True   
1102  1102  ?         -54.1   -48.2  Favored   5   5  0.32   7  0.28  molprobity     1  True   
1103  1103  mt-30     -68.2   -34.4  Favored   8   9  0.35  12  0.19  molprobity     1  True   
1104  1104  mm-40     -57.4   -41.3  Favored   6   9  0.35  12  0.36  molprobity     1  True   
1105  1105  m-70      -56.4   -47.3  Favored   7  11  0.30  15  0.23  molprobity     1  True   
1106  1106  mt        -55.3   -46.0  Favored  11   8  0.41  11  0.26  molprobity     1  True   
1107  1107  mttt      -64.3   -24.6  Favored  13   9  0.35  11  0.32  molprobity     1  True   
1108  1108  m170      -94.6    14.7  Favored   7  11  0.32  15  0.30  molprobity     1  True   
1109  1109  t70        71.1     1.2  Favored   4   8  0.48  11  0.37  molprobity     1  True   
1110  1110  m120      -83.8    70.2  Favored   6   8  0.41  11  0.22  molprobity     1  True   
1111  1111  ?         -64.9   -50.3  Favored   5   5  0.32   7  0.23  molprobity     1  True   
1112  1112  m         -59.5   -44.9  Favored   5   6  0.48   8  0.29  molprobity     1  True   
1113  1113  mmt180    -62.9   -35.2  Favored  13  11  1.22  14  0.48  molprobity     1  True   
1114  1114  ?         -68.7   -52.2  Favored   5   5  0.21   7  0.30  molprobity     1  True   
1115  1115  tp        -53.1   -43.1  Favored  11   8  0.38  11  0.25  molprobity     1  True   
1116  1116  ?         -56.2   -43.3  Favored   5   5  0.31   7  0.21  molprobity     1  True   
1117  1117  mt        -64.7   -47.0  Favored  11   8  0.33  11  0.17  molprobity     1  True   
1118  1118  m-85      -57.7   -42.4  Favored   9  12  0.40  16  0.23  molprobity     1  True   
1119  1119  mt-10     -63.7   -40.5  Favored   6   9  0.44  12  0.35  molprobity     1  True   
1120  1120  tt0       -63.2   -38.8  Favored   6   9  0.43  12  0.34  molprobity     1  True   
1121  1121  mt        -57.1   -44.9  Favored  11   8  0.34  11  0.22  molprobity     1  True   
1122  1122  t         -58.7   -41.4  Favored   9   7  0.38  10  0.45  molprobity     1  True   
1123  1123  pt-20     -81.4   -26.6  Favored   6   9  0.35  12  0.42  molprobity     1  True   
1124  1124  p         -87.0   -16.2  Favored   7   7  0.51  10  0.65  molprobity     1  True   
1125  1125  t70      -162.8   100.9  Allowed   4   8  0.39  12  0.53  molprobity     1  True   
1126  1126  Cg_endo   -85.3    -0.2  Favored   7   8  0.40  11  0.33  molprobity     1  True   
1127  1127  m-20      -92.2   -34.0  Favored   4   8  0.30  11  0.51  molprobity     1  True   
1128  1128  t80       -67.5    93.8  Allowed   9  13  0.39  18  0.39  molprobity     1  True   
1129  1129  t         -56.9   -37.3  Favored   9   7  0.44  10  0.44  molprobity     1  True   
1130  1130  ?         -50.8   -33.8  Favored   3   4  0.49   5  0.20  molprobity     1  True   
1131  1131  m         -62.8   -53.4  Favored   7   7  0.40  10  0.57  molprobity     1  True   
1132  1132  m-85      -56.6   -47.2  Favored   9  13  0.35  18  0.27  molprobity     1  True   
1133  1133  t80       -60.0   -47.9  Favored   9  13  0.35  18  0.20  molprobity     1  True   
1134  1134  m170      -74.4   -33.1  Favored   7  11  0.30  15  0.20  molprobity     1  True   
1135  1135  tp        -64.6   -44.4  Favored  11   8  0.43  11  0.25  molprobity     1  True   
1136  1136  ?         -59.1   -47.0  Favored   3   4  0.40   5  0.15  molprobity     1  True   
1137  1137  mmtp      -57.9   -36.7  Favored  13   9  0.37  11  0.20  molprobity     1  True   
1138  1138  tp        -65.2   -39.3  Favored  11   8  0.42  11  0.23  molprobity     1  True   
1139  1139  m-85      -63.6   -43.2  Favored   9  13  0.37  18  0.24  molprobity     1  True   
1140  1140  mt-10     -53.9   -46.0  Favored   6   9  0.48  12  0.50  molprobity     1  True   
1141  1141  ttt180    -60.3   -42.6  Favored  13  11  1.21  14  0.42  molprobity     1  True   
1142  1142  mt        -82.4    12.4  Favored  11   8  0.44  11  0.28  molprobity     1  True   
1143  1143  t70        67.2     4.8  Favored   4   8  0.51  11  0.38  molprobity     1  True   
1144  1144  mmm180    -81.5    59.3  Favored  13  11  1.24  14  0.65  molprobity     1  True   
1145  1145  m         -54.6   -39.4  Favored   7   7  0.49  10  0.48  molprobity     1  True   
1146  1146  t70       -57.2   -53.2  Favored   4   8  0.31  11  0.39  molprobity     1  True   
1147  1147  m-20      -66.3   -39.6  Favored   4   8  0.20  11  0.39  molprobity     1  True   
1148  1148  ?         -57.3   -56.1  Favored   5   5  0.32   7  0.26  molprobity     1  True   
1149  1149  mt        -57.6   -44.3  Favored  11   8  0.31  11  0.36  molprobity     1  True   
1150  1150  t70       -65.1   -41.4  Favored   4   8  0.31  11  0.45  molprobity     1  True   
1151  1151  m         -59.2   -41.7  Favored   7   7  0.51  10  0.49  molprobity     1  True   
1152  1152  m-85      -66.2   -35.7  Favored   9  13  0.36  18  0.21  molprobity     1  True   
1153  1153  ?         -57.7   -56.3  Favored   5   5  0.39   7  0.21  molprobity     1  True   
1154  1154  OUTLIER   -67.3   -34.7  Favored   8   9  0.52  12  0.47  molprobity     1  True   
1155  1155  ?         -58.1   -41.7  Favored   3   4  0.43   5  0.29  molprobity     1  True   
1156  1156  mt        -52.2   -43.2  Favored  11   8  0.39  11  0.42  molprobity     1  True   
1157  1157  mt-10     -62.9   -54.6  Favored   6   9  0.38  12  0.35  molprobity     1  True   
1158  1158  m         -69.6   -24.6  Favored   9   7  0.39  10  0.37  molprobity     1  True   
1159  1159  ?         -67.1   -51.9  Favored   5   5  0.29   7  0.25  molprobity     1  True   
1160  1160  ptm180    -66.2   -34.9  Favored  13  11  1.21  14  0.51  molprobity     1  True   
1161  1161  mm-40     -87.2   -52.5  Favored   6   9  0.45  12  0.44  molprobity     1  True   
1162  1162  mm-40     -94.1   -29.2  Favored   6   9  0.44  12  0.51  molprobity     1  True   
1163  1163  ?         -95.1  -125.5  Favored   3   4  0.42   5  0.15  molprobity     1  True   
1164  1164  t        -146.3   161.4  Favored   7   7  0.46  10  0.66  molprobity     1  True   
1165  1165  tt0       -62.1   -22.7  Favored   8   9  0.34  12  0.31  molprobity     1  True   
1166  1166  ttmt      -67.7   -49.4  Favored  13   9  0.40  11  0.24  molprobity     1  True   
1167  1167  m-20      -67.5   -32.5  Favored   4   8  0.30  11  0.37  molprobity     1  True   
1168  1168  tp        -54.7   -43.3  Favored  11   8  0.37  11  0.25  molprobity     1  True   
1169  1169  t         -56.0   -47.0  Favored   5   6  0.59   8  0.28  molprobity     1  True   
1170  1170  mm-40     -56.5   -50.8  Favored   6   9  0.30  12  0.38  molprobity     1  True   
1171  1171  mt        -64.3   -41.3  Favored  11   8  0.39  11  0.18  molprobity     1  True   
1172  1172  mt-30     -63.7   -48.0  Favored   8   9  0.36  12  0.23  molprobity     1  True   
1173  1173  t70       -62.0   -41.5  Favored   4   8  0.28  11  0.34  molprobity     1  True   
1174  1174  ?         -56.8   -50.5  Favored   5   5  0.30   7  0.28  molprobity     1  True   
1175  1175  ptmt      -71.3   -36.0  Favored  13   9  0.35  11  0.28  molprobity     1  True   
1176  1176  tp        -58.5   -50.1  Favored  11   8  0.39  11  0.17  molprobity     1  True   
1177  1177  OUTLIER   -65.1   -31.8  Favored  13   9  0.45  11  0.38  molprobity     1  True   
1178  1178  ?         -67.6   -39.5  Favored   5   5  0.35   7  0.29  molprobity     1  True   
1179  1179  mm-40     -53.6   -27.5  Favored   6   9  0.52  12  0.46  molprobity     1  True   
1180  1180  ?        -106.5    17.1  Favored   3   4  0.51   5  0.26  molprobity     1  True   
1181  1181  mt        -80.4   -73.9  Allowed  11   8  0.43  11  0.20  molprobity     1  True   
1182  1182  pt-20     -73.3   102.3  Favored   6   9  0.37  12  0.45  molprobity     ?  False  
1183  1183  m-70      -60.8   -46.5  Favored   7  11  0.28  15  0.23  molprobity     ?  False  
1184  1184  m170      -91.8   111.9  Favored   7  11  0.29  15  0.26  molprobity     ?  False  
1185  1185  m-70      -69.8   129.1  Favored   7  11  0.25  15  0.47  molprobity     ?  False  
1186  1186  m80      -101.7   -26.8  Favored   7  11  0.22  15  0.30  molprobity     ?  False  
1187  1187  m80      -140.5   143.6  Favored   7  11  0.25  15  0.33  molprobity     ?  False  
1188  1188  t-80          ?       ?  ?         7  11  0.63  12  0.24  molprobity     ?  False  
1189  1189  pt-20         ?       ?  ?         8   9  0.57  12  0.38  molprobity     ?  False  
1190  1190  m-20     -110.4   163.2  Favored   4   8  0.35  12  0.49  molprobity     1  True   
1191  1191  Cg_exo    -53.5   -26.3  Favored   7   8  0.34  11  0.38  molprobity     1  True   
1192  1192  mt-10     -60.2   -34.3  Favored   6   9  0.34  12  0.38  molprobity     1  True   
1193  1193  m-20      -57.9   130.8  Favored   4   8  0.43  12  0.54  molprobity     1  True   
1194  1194  Cg_endo   -49.0   -50.4  Favored   7   8  0.40  11  0.34  molprobity     1  True   
1195  1195  t80       -69.8   -28.4  Favored   9  12  0.39  16  0.17  molprobity     1  True   
1196  1196  m         -68.3   -56.3  Favored   7   7  0.43  10  0.61  molprobity     1  True   
1197  1197  ptm85     -61.2   -33.7  Favored  13  11  1.25  14  0.79  molprobity     1  True   
1198  1198  t80       -61.2   -45.5  Favored   9  13  0.41  18  0.48  molprobity     1  True   
1199  1199  ?         -65.9   -48.5  Favored   5   5  0.32   7  0.20  molprobity     1  True   
1200  1200  mm?       -56.2   -38.8  Favored  11   8  0.42  11  0.19  molprobity     1  True   
1201  1201  ?         -57.2   -47.4  Favored   5   5  0.31   7  0.28  molprobity     1  True   
1202  1202  mt-30     -61.8   -44.2  Favored   8   9  0.39  12  0.22  molprobity     1  True   
1203  1203  mm-40     -58.0   -44.9  Favored   6   9  0.35  12  0.34  molprobity     1  True   
1204  1204  m-70      -59.3   -40.3  Favored   7  11  0.25  15  0.18  molprobity     1  True   
1205  1205  mt        -57.9   -36.1  Favored  11   8  0.34  11  0.32  molprobity     1  True   
1206  1206  mttt      -75.5   -35.3  Favored  13   9  0.36  11  0.30  molprobity     1  True   
1207  1207  m-70      -90.5    29.4  Allowed   7  11  0.32  15  0.27  molprobity     1  True   
1208  1208  t70        71.9    -8.7  Allowed   4   8  0.47  11  0.46  molprobity     1  True   
1209  1209  m120      -77.4    68.8  Favored   6   8  0.36  11  0.26  molprobity     1  True   
1210  1210  ?         -66.5   -45.5  Favored   5   5  0.28   7  0.21  molprobity     1  True   
1211  1211  t         -64.9   -46.6  Favored   5   6  0.46   8  0.21  molprobity     1  True   
1212  1212  mmt180    -59.4   -47.2  Favored  13  11  1.25  14  0.46  molprobity     1  True   
1213  1213  ?         -66.1   -40.6  Favored   5   5  0.27   7  0.24  molprobity     1  True   
1214  1214  tp        -54.2   -52.2  Favored  11   8  0.37  11  0.20  molprobity     1  True   
1215  1215  ?         -54.5   -39.8  Favored   5   5  0.31   7  0.22  molprobity     1  True   
1216  1216  mt        -62.2   -52.1  Favored  11   8  0.43  11  0.12  molprobity     1  True   
1217  1217  m-85      -58.8   -47.2  Favored   9  12  0.44  16  0.20  molprobity     1  True   
1218  1218  mt-10     -58.7   -38.1  Favored   6   9  0.34  12  0.36  molprobity     1  True   
1219  1219  tt0       -69.1   -37.9  Favored   6   9  0.35  12  0.33  molprobity     1  True   
1220  1220  mt        -57.5   -42.4  Favored  11   8  0.37  11  0.24  molprobity     1  True   
1221  1221  t         -54.7   -47.6  Favored   9   7  0.38  10  0.52  molprobity     1  True   
1222  1222  pt-20     -80.6   -29.9  Favored   6   9  0.45  12  0.41  molprobity     1  True   
1223  1223  p         -91.8   -29.0  Favored   7   7  0.49  10  0.59  molprobity     1  True   
1224  1224  t70      -144.3    80.8  Favored   4   8  0.45  12  0.63  molprobity     1  True   
1225  1225  Cg_endo   -76.6   -22.6  Favored   7   8  0.44  11  0.42  molprobity     1  True   
1226  1226  p-10      -82.9    -8.6  Favored   4   8  0.30  11  0.29  molprobity     1  True   
1227  1227  t80       -80.8    90.7  Favored   9  13  0.37  18  0.28  molprobity     1  True   
1228  1228  t         -58.4   -29.9  Favored   9   7  0.44  10  0.45  molprobity     1  True   
1229  1229  ?         -51.2   -34.1  Favored   3   4  0.50   5  0.22  molprobity     1  True   
1230  1230  m         -60.2   -57.2  Favored   7   7  0.33  10  0.56  molprobity     1  True   
1231  1231  m-85      -58.7   -40.9  Favored   9  13  0.35  18  0.23  molprobity     1  True   
1232  1232  t80       -57.3   -56.9  Favored   9  13  0.37  18  0.24  molprobity     1  True   
1233  1233  m-70      -73.8   -29.7  Favored   7  11  0.28  15  0.26  molprobity     1  True   
1234  1234  tp        -60.7   -46.7  Favored  11   8  0.44  11  0.25  molprobity     1  True   
1235  1235  ?         -60.3   -44.0  Favored   3   4  0.36   5  0.16  molprobity     1  True   
1236  1236  mmmp?     -57.6   -37.3  Favored  13   9  0.42  11  0.44  molprobity     1  True   
1237  1237  tp        -67.6   -41.0  Favored  11   8  0.38  11  0.20  molprobity     1  True   
1238  1238  m-85      -59.7   -40.9  Favored   9  13  0.39  18  0.23  molprobity     1  True   
1239  1239  mt-10     -62.3   -21.9  Favored   6   9  0.46  12  0.56  molprobity     1  True   
1240  1240  ttt180    -83.3   -21.0  Favored  13  11  1.18  14  0.73  molprobity     1  True   
1241  1241  mt       -116.3    27.2  Favored  11   8  0.49  11  0.29  molprobity     1  True   
1242  1242  t70        64.6     5.8  Favored   4   8  0.53  11  0.45  molprobity     1  True   
1243  1243  mmm180    -84.6    48.8  Allowed  13  11  1.18  14  0.57  molprobity     1  True   
1244  1244  p         -54.4   -51.5  Favored   7   7  0.43  10  0.60  molprobity     1  True   
1245  1245  t70       -53.8   -43.6  Favored   4   8  0.31  11  0.41  molprobity     1  True   
1246  1246  m-20      -67.2   -41.7  Favored   4   8  0.27  11  0.48  molprobity     1  True   
1247  1247  ?         -59.6   -55.0  Favored   5   5  0.33   7  0.27  molprobity     1  True   
1248  1248  mt        -55.5   -43.4  Favored  11   8  0.31  11  0.35  molprobity     1  True   
1249  1249  t70       -61.7   -46.7  Favored   4   8  0.30  11  0.43  molprobity     1  True   
1250  1250  m         -61.5   -39.2  Favored   7   7  0.49  10  0.39  molprobity     1  True   
1251  1251  m-85      -66.0   -38.0  Favored   9  13  0.36  18  0.25  molprobity     1  True   
1252  1252  ?         -54.5   -56.5  Favored   5   5  0.37   7  0.24  molprobity     1  True   
1253  1253  OUTLIER   -65.0   -40.8  Favored   8   9  0.50  12  0.48  molprobity     1  True   
1254  1254  ?         -55.5   -40.4  Favored   3   4  0.46   5  0.23  molprobity     1  True   
1255  1255  mt        -57.1   -39.2  Favored  11   8  0.24  11  0.34  molprobity     1  True   
1256  1256  mt-10     -64.4   -55.4  Favored   6   9  0.32  12  0.30  molprobity     1  True   
1257  1257  m         -64.4   -25.9  Favored   9   7  0.33  10  0.37  molprobity     1  True   
1258  1258  ?         -68.0   -52.4  Favored   5   5  0.29   7  0.21  molprobity     1  True   
1259  1259  ptm180    -69.3   -38.9  Favored  13  11  1.16  14  0.37  molprobity     1  True   
1260  1260  mt-10     -87.6   -53.0  Favored   6   9  0.36  12  0.38  molprobity     1  True   
1261  1261  mm-40     -93.5   -32.4  Favored   6   9  0.49  12  0.44  molprobity     1  True   
1262  1262  ?         -95.3  -119.9  Favored   3   4  0.50   5  0.09  molprobity     1  True   
1263  1263  t        -148.8   173.0  Favored   7   7  0.50  10  0.58  molprobity     1  True   
1264  1264  tm0?      -65.7   -33.0  Favored   8   9  0.43  12  0.41  molprobity     1  True   
1265  1265  tttt      -56.4   -51.3  Favored  13   9  0.35  11  0.27  molprobity     1  True   
1266  1266  m-20      -64.4   -36.3  Favored   4   8  0.22  11  0.39  molprobity     1  True   
1267  1267  tp        -53.1   -51.0  Favored  11   8  0.36  11  0.25  molprobity     1  True   
1268  1268  t         -65.4   -41.6  Favored   5   6  0.47   8  0.21  molprobity     1  True   
1269  1269  mm-40     -58.5   -49.5  Favored   6   9  0.36  12  0.40  molprobity     1  True   
1270  1270  mt        -67.5   -39.8  Favored  11   8  0.36  11  0.21  molprobity     1  True   
1271  1271  mt-30     -58.6   -48.5  Favored   8   9  0.35  12  0.33  molprobity     1  True   
1272  1272  t70       -63.7   -38.8  Favored   4   8  0.32  11  0.44  molprobity     1  True   
1273  1273  ?         -59.8   -48.4  Favored   5   5  0.34   7  0.23  molprobity     1  True   
1274  1274  ptmt      -74.1   -36.9  Favored  13   9  0.36  11  0.25  molprobity     1  True   
1275  1275  tp        -54.6   -48.8  Favored  11   8  0.39  11  0.19  molprobity     1  True   
1276  1276  pttm      -62.4   -39.9  Favored  13   9  0.31  11  0.19  molprobity     1  True   
1277  1277  ?         -62.0   -42.2  Favored   5   5  0.31   7  0.27  molprobity     1  True   
1278  1278  mt-10     -66.5   -32.0  Favored   6   9  0.41  12  0.38  molprobity     1  True   
1279  1279  ?         -81.2   -25.6  Favored   3   4  0.55   5  0.21  molprobity     1  True   
1280  1280  mt        -57.1   -56.2  Favored  11   8  0.43  11  0.27  molprobity     1  True   
1281  1281  pt-20    -166.1  -175.7  Favored   6   9  0.28  12  0.39  molprobity     ?  False  
1282  1282  m-70     -138.0    68.8  Allowed   7  11  0.27  15  0.26  molprobity     ?  False  
1283  1283  t-80       64.3    33.1  Favored   7  11  0.41  15  0.40  molprobity     ?  False  
1284  1284  t-80     -131.9     3.7  Favored   7  11  0.38  15  0.29  molprobity     ?  False  
1285  1285  m-70     -134.0   -29.5  Allowed   7  11  0.34  15  0.35  molprobity     ?  False  
1286  1286  t60        77.1   110.0  Allowed   7  11  0.38  15  0.38  molprobity     ?  False  
1287  1287  t-80          ?       ?  ?         7  11  0.61  12  0.34  molprobity     ?  False  
1288  1288  mt-10         ?       ?  ?         8   9  0.56  12  0.37  molprobity     ?  False  
1289  1289  p30      -140.5   162.9  Favored   4   8  0.51  12  0.52  molprobity     1  True   
1290  1290  Cg_endo   -52.0   -16.0  Favored   7   8  0.64  11  0.56  molprobity     1  True   
1291  1291  mt-10     -84.7   -21.2  Favored   6   9  0.42  12  0.40  molprobity     1  True   
1292  1292  m-20      -66.2   126.4  Favored   4   8  0.42  12  0.58  molprobity     1  True   
1293  1293  Cg_exo    -43.0   -55.4  Favored   7   8  0.21  11  0.38  molprobity     1  True   
1294  1294  t80       -58.0   -40.5  Favored   9  12  0.38  16  0.20  molprobity     1  True   
1295  1295  m         -68.3   -55.6  Favored   7   7  0.45  10  0.55  molprobity     1  True   
1296  1296  ptm85     -61.4   -31.0  Favored  13  11  1.24  14  0.58  molprobity     1  True   
1297  1297  t80       -67.7   -41.7  Favored   9  13  0.40  18  0.52  molprobity     1  True   
1298  1298  ?         -65.2   -45.8  Favored   5   5  0.29   7  0.20  molprobity     1  True   
1299  1299  mm?       -60.1   -39.7  Favored  11   8  0.39  11  0.18  molprobity     1  True   
1300  1300  ?         -55.1   -49.3  Favored   5   5  0.31   7  0.26  molprobity     1  True   
1301  1301  mt-30     -59.5   -45.9  Favored   8   9  0.34  12  0.23  molprobity     1  True   
1302  1302  mm-40     -55.8   -40.9  Favored   6   9  0.40  12  0.39  molprobity     1  True   
1303  1303  m-70      -64.2   -46.2  Favored   7  11  0.25  15  0.19  molprobity     1  True   
1304  1304  mt        -54.6   -44.3  Favored  11   8  0.43  11  0.29  molprobity     1  True   
1305  1305  mtpp      -63.4   -36.4  Favored  13   9  0.34  11  0.27  molprobity     1  True   
1306  1306  m170      -90.1    19.3  Favored   7  11  0.39  15  0.34  molprobity     1  True   
1307  1307  t70        72.5    -1.4  Favored   4   8  0.47  11  0.40  molprobity     1  True   
1308  1308  m120      -76.5    68.8  Favored   6   8  0.44  11  0.25  molprobity     1  True   
1309  1309  ?         -62.8   -51.4  Favored   5   5  0.36   7  0.25  molprobity     1  True   
1310  1310  t         -63.6   -40.9  Favored   5   6  0.43   8  0.28  molprobity     1  True   
1311  1311  mmt180    -61.5   -43.6  Favored  13  11  1.14  14  0.58  molprobity     1  True   
1312  1312  ?         -65.8   -41.8  Favored   5   5  0.24   7  0.32  molprobity     1  True   
1313  1313  tp        -53.9   -49.5  Favored  11   8  0.36  11  0.25  molprobity     1  True   
1314  1314  ?         -57.4   -36.7  Favored   5   5  0.36   7  0.23  molprobity     1  True   
1315  1315  mt        -69.5   -45.9  Favored  11   8  0.36  11  0.14  molprobity     1  True   
1316  1316  m-85      -61.8   -49.4  Favored   9  12  0.38  16  0.20  molprobity     1  True   
1317  1317  mt-10     -58.5   -35.5  Favored   6   9  0.38  12  0.36  molprobity     1  True   
1318  1318  tt0       -73.8   -32.7  Favored   6   9  0.34  12  0.35  molprobity     1  True   
1319  1319  mt        -61.5   -34.6  Favored  11   8  0.39  11  0.19  molprobity     1  True   
1320  1320  t         -60.2   -43.0  Favored   9   7  0.37  10  0.41  molprobity     1  True   
1321  1321  pt-20     -81.5   -30.0  Favored   6   9  0.41  12  0.40  molprobity     1  True   
1322  1322  p         -78.4   -52.7  Favored   7   7  0.54  10  0.68  molprobity     1  True   
1323  1323  m-20     -123.7    81.5  Favored   4   8  0.40  12  0.53  molprobity     1  True   
1324  1324  Cg_endo   -65.9   -17.9  Favored   7   8  0.41  11  0.24  molprobity     1  True   
1325  1325  p-10      -87.8   -11.4  Favored   4   8  0.29  11  0.37  molprobity     1  True   
1326  1326  t80       -75.6    82.1  Favored   9  13  0.41  18  0.36  molprobity     1  True   
1327  1327  t         -52.8   -36.3  Favored   9   7  0.51  10  0.49  molprobity     1  True   
1328  1328  ?         -52.3   -34.4  Favored   3   4  0.55   5  0.22  molprobity     1  True   
1329  1329  m         -58.6   -52.8  Favored   7   7  0.35  10  0.57  molprobity     1  True   
1330  1330  m-85      -60.2   -43.9  Favored   9  13  0.32  18  0.24  molprobity     1  True   
1331  1331  t80       -59.2   -49.0  Favored   9  13  0.34  18  0.26  molprobity     1  True   
1332  1332  m-70      -74.3   -29.8  Favored   7  11  0.31  15  0.27  molprobity     1  True   
1333  1333  tp        -66.7   -44.9  Favored  11   8  0.43  11  0.24  molprobity     1  True   
1334  1334  ?         -62.6   -47.2  Favored   3   4  0.41   5  0.09  molprobity     1  True   
1335  1335  mmmp?     -57.0   -31.3  Favored  13   9  0.46  11  0.41  molprobity     1  True   
1336  1336  tp        -72.2   -42.5  Favored  11   8  0.41  11  0.22  molprobity     1  True   
1337  1337  m-85      -58.2   -41.6  Favored   9  13  0.39  18  0.30  molprobity     1  True   
1338  1338  mt-10     -51.2   -47.0  Favored   6   9  0.47  12  0.47  molprobity     1  True   
1339  1339  ttt180    -66.3   -23.1  Favored  13  11  1.18  14  0.38  molprobity     1  True   
1340  1340  mt        -93.5    11.2  Favored  11   8  0.40  11  0.24  molprobity     1  True   
1341  1341  t70        69.1     2.2  Favored   4   8  0.45  11  0.35  molprobity     1  True   
1342  1342  mmm180    -81.6    63.9  Favored  13  11  1.24  14  0.68  molprobity     1  True   
1343  1343  m         -60.2   -52.0  Favored   7   7  0.50  10  0.47  molprobity     1  True   
1344  1344  m-20      -62.7   -40.2  Favored   4   8  0.27  11  0.37  molprobity     1  True   
1345  1345  m-20      -59.6   -42.0  Favored   4   8  0.31  11  0.44  molprobity     1  True   
1346  1346  ?         -62.0   -53.5  Favored   5   5  0.28   7  0.24  molprobity     1  True   
1347  1347  mt        -59.1   -41.1  Favored  11   8  0.27  11  0.41  molprobity     1  True   
1348  1348  t70       -61.6   -43.7  Favored   4   8  0.27  11  0.34  molprobity     1  True   
1349  1349  m         -61.3   -39.7  Favored   7   7  0.50  10  0.45  molprobity     1  True   
1350  1350  m-85      -65.3   -37.0  Favored   9  13  0.34  18  0.24  molprobity     1  True   
1351  1351  ?         -61.1   -52.6  Favored   5   5  0.37   7  0.25  molprobity     1  True   
1352  1352  OUTLIER   -63.8   -34.4  Favored   8   9  0.48  12  0.53  molprobity     1  True   
1353  1353  ?         -62.7   -37.2  Favored   3   4  0.47   5  0.14  molprobity     1  True   
1354  1354  mt        -56.6   -44.6  Favored  11   8  0.36  11  0.43  molprobity     1  True   
1355  1355  mt-10     -56.8   -54.5  Favored   6   9  0.35  12  0.34  molprobity     1  True   
1356  1356  m         -70.5   -31.1  Favored   9   7  0.42  10  0.40  molprobity     1  True   
1357  1357  ?         -67.3   -46.7  Favored   5   5  0.32   7  0.24  molprobity     1  True   
1358  1358  ptm180    -72.7   -36.5  Favored  13  11  1.14  14  0.31  molprobity     1  True   
1359  1359  mm-40     -87.9   -52.0  Favored   6   9  0.43  12  0.38  molprobity     1  True   
1360  1360  mm-40     -87.9   -40.7  Favored   6   9  0.42  12  0.50  molprobity     1  True   
1361  1361  ?         -94.9  -105.4  Allowed   3   4  0.48   5  0.28  molprobity     1  True   
1362  1362  t        -164.2   159.5  Favored   7   7  0.47  10  0.58  molprobity     1  True   
1363  1363  tt0       -67.9   -26.6  Favored   8   9  0.32  12  0.23  molprobity     1  True   
1364  1364  tttt      -62.2   -49.5  Favored  13   9  0.37  11  0.17  molprobity     1  True   
1365  1365  m-20      -71.6   -30.8  Favored   4   8  0.29  11  0.40  molprobity     1  True   
1366  1366  tp        -56.3   -44.2  Favored  11   8  0.38  11  0.20  molprobity     1  True   
1367  1367  m         -55.5   -39.5  Favored   5   6  0.45   8  0.18  molprobity     1  True   
1368  1368  mm-40     -58.5   -46.1  Favored   6   9  0.31  12  0.38  molprobity     1  True   
1369  1369  mt        -65.3   -45.5  Favored  11   8  0.35  11  0.21  molprobity     1  True   
1370  1370  mt-30     -65.7   -32.5  Favored   8   9  0.42  12  0.31  molprobity     1  True   
1371  1371  t70       -67.7   -50.0  Favored   4   8  0.28  11  0.39  molprobity     1  True   
1372  1372  ?         -55.8   -51.1  Favored   5   5  0.24   7  0.28  molprobity     1  True   
1373  1373  ptmm?     -64.1   -33.6  Favored  13   9  0.40  11  0.24  molprobity     1  True   
1374  1374  tp        -61.5   -57.8  Favored  11   8  0.38  11  0.20  molprobity     1  True   
1375  1375  OUTLIER   -68.7   -25.6  Favored  13   9  0.38  11  0.38  molprobity     1  True   
1376  1376  ?         -61.0   -42.0  Favored   5   5  0.34   7  0.23  molprobity     1  True   
1377  1377  mt-10     -73.7   -17.7  Favored   6   9  0.39  12  0.34  molprobity     1  True   
1378  1378  ?         -77.6   -13.0  Favored   3   4  0.49   5  0.13  molprobity     1  True   
1379  1379  mt        -64.8   -40.0  Favored  11   8  0.41  11  0.16  molprobity     1  True   
1380  1380  pt-20    -172.6   163.2  Favored   6   9  0.34  12  0.34  molprobity     ?  False  
1381  1381  t-80      -71.3   128.0  Favored   7  11  0.26  15  0.22  molprobity     ?  False  
1382  1382  m-70      -52.0   119.5  Favored   7  11  0.32  15  0.42  molprobity     ?  False  
1383  1383  m80       -75.9   -33.7  Favored   7  11  0.28  15  0.35  molprobity     ?  False  
1384  1384  m-70     -116.4   147.0  Favored   7  11  0.31  15  0.30  molprobity     ?  False  
1385  1385  t-80     -155.1   139.2  Favored   7  11  0.24  15  0.30  molprobity     ?  False  
1386  1386  t-80          ?       ?  ?         7  11  0.64  12  0.32  molprobity     ?  False  
1387  1387  mp0           ?       ?  ?         8   9  0.63  12  0.39  molprobity     ?  False  
1388  1388  m-20     -122.2   162.5  Favored   4   8  0.40  12  0.50  molprobity     1  True   
1389  1389  Cg_exo    -50.4   -25.3  Favored   7   8  0.37  11  0.33  molprobity     1  True   
1390  1390  mm-40     -56.0   -35.6  Favored   6   9  0.36  12  0.38  molprobity     1  True   
1391  1391  m-20      -66.0   132.9  Favored   4   8  0.42  12  0.63  molprobity     1  True   
1392  1392  Cg_exo    -47.8   -55.0  Favored   7   8  0.35  11  0.31  molprobity     1  True   
1393  1393  t80       -63.6   -31.8  Favored   9  12  0.40  16  0.13  molprobity     1  True   
1394  1394  m         -68.5   -55.5  Favored   7   7  0.42  10  0.66  molprobity     1  True   
1395  1395  ptm180    -61.9   -31.3  Favored  13  11  1.25  14  0.57  molprobity     1  True   
1396  1396  t80       -61.1   -45.9  Favored   9  13  0.39  18  0.34  molprobity     1  True   
1397  1397  ?         -64.0   -47.5  Favored   5   5  0.29   7  0.20  molprobity     1  True   
1398  1398  mm?       -57.0   -33.4  Favored  11   8  0.44  11  0.19  molprobity     1  True   
1399  1399  ?         -60.2   -48.8  Favored   5   5  0.30   7  0.31  molprobity     1  True   
1400  1400  mt-30     -62.9   -32.9  Favored   8   9  0.36  12  0.26  molprobity     1  True   
1401  1401  mm-40     -57.8   -52.1  Favored   6   9  0.30  12  0.38  molprobity     1  True   
1402  1402  m-70      -57.8   -41.0  Favored   7  11  0.30  15  0.21  molprobity     1  True   
1403  1403  mt        -58.7   -47.2  Favored  11   8  0.43  11  0.26  molprobity     1  True   
1404  1404  mtmp?     -70.8    -9.9  Favored  13   9  0.43  11  0.33  molprobity     1  True   
1405  1405  m-70     -117.3    36.5  Favored   7  11  0.33  15  0.30  molprobity     1  True   
1406  1406  t70        75.3   -24.8  Allowed   4   8  0.53  11  0.45  molprobity     1  True   
1407  1407  m120      -76.8    72.5  Favored   6   8  0.38  11  0.32  molprobity     1  True   
1408  1408  ?         -65.6   -51.5  Favored   5   5  0.32   7  0.19  molprobity     1  True   
1409  1409  m         -59.8   -39.2  Favored   5   6  0.52   8  0.21  molprobity     1  True   
1410  1410  mmt180    -61.4   -44.1  Favored  13  11  1.16  14  0.43  molprobity     1  True   
1411  1411  ?         -65.3   -43.6  Favored   5   5  0.26   7  0.37  molprobity     1  True   
1412  1412  tp        -52.9   -44.9  Favored  11   8  0.38  11  0.31  molprobity     1  True   
1413  1413  ?         -60.0   -39.4  Favored   5   5  0.33   7  0.19  molprobity     1  True   
1414  1414  mt        -66.0   -41.9  Favored  11   8  0.39  11  0.18  molprobity     1  True   
1415  1415  m-85      -61.5   -43.8  Favored   9  12  0.38  16  0.18  molprobity     1  True   
1416  1416  mt-10     -61.4   -36.9  Favored   6   9  0.38  12  0.35  molprobity     1  True   
1417  1417  tt0       -60.3   -41.9  Favored   6   9  0.33  12  0.37  molprobity     1  True   
1418  1418  mt        -62.0   -39.9  Favored  11   8  0.38  11  0.21  molprobity     1  True   
1419  1419  t         -63.6   -39.1  Favored   9   7  0.41  10  0.46  molprobity     1  True   
1420  1420  pt-20     -81.2   -27.5  Favored   6   9  0.37  12  0.31  molprobity     1  True   
1421  1421  p         -95.5   -45.1  Favored   7   7  0.55  10  0.61  molprobity     1  True   
1422  1422  t70      -140.0    83.0  Favored   4   8  0.46  12  0.58  molprobity     1  True   
1423  1423  Cg_exo    -59.9   -20.5  Favored   7   8  0.43  11  0.28  molprobity     1  True   
1424  1424  m-20      -64.1   -27.8  Favored   4   8  0.29  11  0.39  molprobity     1  True   
1425  1425  t80       -75.2    80.0  Favored   9  13  0.43  18  0.41  molprobity     1  True   
1426  1426  t         -56.8   -38.3  Favored   9   7  0.48  10  0.49  molprobity     1  True   
1427  1427  ?         -51.0   -26.4  Favored   3   4  0.53   5  0.30  molprobity     1  True   
1428  1428  m         -59.2   -56.3  Favored   7   7  0.28  10  0.58  molprobity     1  True   
1429  1429  m-85      -56.2   -41.7  Favored   9  13  0.36  18  0.27  molprobity     1  True   
1430  1430  t80       -62.3   -55.4  Favored   9  13  0.36  18  0.21  molprobity     1  True   
1431  1431  m-70      -69.1   -30.0  Favored   7  11  0.29  15  0.24  molprobity     1  True   
1432  1432  tp        -65.3   -48.3  Favored  11   8  0.37  11  0.25  molprobity     1  True   
1433  1433  ?         -59.5   -51.5  Favored   3   4  0.39   5  0.10  molprobity     1  True   
1434  1434  OUTLIER   -57.7   -32.4  Favored  13   9  0.47  11  0.32  molprobity     1  True   
1435  1435  tp        -73.1   -34.8  Favored  11   8  0.40  11  0.21  molprobity     1  True   
1436  1436  m-85      -63.4   -49.0  Favored   9  13  0.33  18  0.30  molprobity     1  True   
1437  1437  mt-10     -52.9   -39.8  Favored   6   9  0.37  12  0.51  molprobity     1  True   
1438  1438  tpm_?     -56.6   -39.6  Favored  13  11  1.18  14  0.52  molprobity     1  True   
1439  1439  mt        -94.3    21.2  Favored  11   8  0.43  11  0.28  molprobity     1  True   
1440  1440  t70        63.2    12.1  Favored   4   8  0.42  11  0.46  molprobity     1  True   
1441  1441  mmm180    -86.5    45.2  Allowed  13  11  1.17  14  0.58  molprobity     1  True   
1442  1442  m         -52.0   -45.7  Favored   7   7  0.42  10  0.49  molprobity     1  True   
1443  1443  m-20      -63.7   -41.5  Favored   4   8  0.28  11  0.41  molprobity     1  True   
1444  1444  m-20      -60.4   -38.1  Favored   4   8  0.30  11  0.42  molprobity     1  True   
1445  1445  ?         -61.2   -51.9  Favored   5   5  0.27   7  0.34  molprobity     1  True   
1446  1446  mt        -52.8   -48.7  Favored  11   8  0.32  11  0.41  molprobity     1  True   
1447  1447  t70       -61.1   -39.4  Favored   4   8  0.29  11  0.40  molprobity     1  True   
1448  1448  m         -61.0   -45.7  Favored   7   7  0.50  10  0.43  molprobity     1  True   
1449  1449  m-85      -60.9   -38.0  Favored   9  13  0.33  18  0.25  molprobity     1  True   
1450  1450  ?         -53.6   -48.1  Favored   5   5  0.40   7  0.25  molprobity     1  True   
1451  1451  OUTLIER   -75.5   -36.5  Favored   8   9  0.52  12  0.49  molprobity     1  True   
1452  1452  ?         -56.9   -32.5  Favored   3   4  0.43   5  0.26  molprobity     1  True   
1453  1453  mt        -55.2   -42.3  Favored  11   8  0.32  11  0.37  molprobity     1  True   
1454  1454  mt-10     -63.1   -54.1  Favored   6   9  0.35  12  0.33  molprobity     1  True   
1455  1455  m         -66.1   -29.3  Favored   9   7  0.38  10  0.37  molprobity     1  True   
1456  1456  ?         -67.8   -52.4  Favored   5   5  0.35   7  0.22  molprobity     1  True   
1457  1457  ptm180    -68.3   -37.1  Favored  13  11  1.18  14  0.38  molprobity     1  True   
1458  1458  mt-10     -88.4   -52.1  Favored   6   9  0.37  12  0.34  molprobity     1  True   
1459  1459  mm-40     -82.8   -50.5  Favored   6   9  0.45  12  0.38  molprobity     1  True   
1460  1460  ?         -83.3  -122.3  Allowed   3   4  0.53   5  0.11  molprobity     1  True   
1461  1461  t        -150.1   176.5  Favored   7   7  0.48  10  0.50  molprobity     1  True   
1462  1462  tt0       -61.9   -25.0  Favored   8   9  0.38  12  0.22  molprobity     1  True   
1463  1463  ttmt      -61.6   -50.3  Favored  13   9  0.36  11  0.21  molprobity     1  True   
1464  1464  m-20      -64.8   -40.4  Favored   4   8  0.26  11  0.44  molprobity     1  True   
1465  1465  tp        -52.9   -49.5  Favored  11   8  0.34  11  0.32  molprobity     1  True   
1466  1466  t         -57.8   -44.9  Favored   5   6  0.44   8  0.28  molprobity     1  True   
1467  1467  mm-40     -60.5   -51.3  Favored   6   9  0.41  12  0.35  molprobity     1  True   
1468  1468  mt        -64.9   -44.0  Favored  11   8  0.44  11  0.17  molprobity     1  True   
1469  1469  mt-30     -57.3   -46.3  Favored   8   9  0.38  12  0.28  molprobity     1  True   
1470  1470  t70       -62.1   -42.3  Favored   4   8  0.24  11  0.33  molprobity     1  True   
1471  1471  ?         -56.7   -50.6  Favored   5   5  0.30   7  0.27  molprobity     1  True   
1472  1472  ptmm?     -72.6   -30.9  Favored  13   9  0.40  11  0.25  molprobity     1  True   
1473  1473  tp        -60.8   -47.6  Favored  11   8  0.38  11  0.23  molprobity     1  True   
1474  1474  pttt      -74.5   -35.1  Favored  13   9  0.35  11  0.22  molprobity     1  True   
1475  1475  ?         -56.4   -41.4  Favored   5   5  0.38   7  0.30  molprobity     1  True   
1476  1476  mm-40     -63.2   -21.4  Favored   6   9  0.50  12  0.42  molprobity     1  True   
1477  1477  ?        -101.5     6.5  Favored   3   4  0.53   5  0.17  molprobity     1  True   
1478  1478  mt        -80.8   -24.8  Favored  11   8  0.41  11  0.24  molprobity     1  True   
1479  1479  pt-20    -164.5   177.2  Favored   6   9  0.33  12  0.29  molprobity     ?  False  
1480  1480  m-70      -78.4    85.5  Favored   7  11  0.30  15  0.24  molprobity     ?  False  
1481  1481  m170      -84.0   -58.2  Favored   7  11  0.29  15  0.21  molprobity     ?  False  
1482  1482  m-70     -103.6   169.2  Favored   7  11  0.28  15  0.23  molprobity     ?  False  
1483  1483  t60      -101.4   -31.1  Favored   7  11  0.35  15  0.30  molprobity     ?  False  
1484  1484  t-80     -129.8    17.5  Favored   7  11  0.37  15  0.30  molprobity     ?  False  
1485  1485  t-80          ?       ?  ?         7  11  0.61  12  0.25  molprobity     ?  False  
1486  1486  mp0           ?       ?  ?         8   9  0.66  12  0.41  molprobity     ?  False  
1487  1487  m-20      -81.3   165.4  Favored   4   8  0.43  12  0.51  molprobity     1  True   
1488  1488  Cg_exo    -53.3   -12.9  Favored   7   8  0.45  11  0.26  molprobity     1  True   
1489  1489  mt-10     -67.3   -35.7  Favored   6   9  0.35  12  0.36  molprobity     1  True   
1490  1490  m-20      -66.8   128.3  Favored   4   8  0.42  12  0.53  molprobity     1  True   
1491  1491  Cg_endo   -50.9   -41.5  Favored   7   8  0.40  11  0.29  molprobity     1  True   
1492  1492  t80       -63.9   -39.5  Favored   9  12  0.38  16  0.18  molprobity     1  True   
1493  1493  m         -70.3   -53.7  Favored   7   7  0.44  10  0.55  molprobity     1  True   
1494  1494  ptm85     -59.2   -29.4  Favored  13  11  1.15  14  0.53  molprobity     1  True   
1495  1495  t80       -72.6   -42.1  Favored   9  13  0.38  18  0.33  molprobity     1  True   
1496  1496  ?         -59.8   -46.2  Favored   5   5  0.31   7  0.19  molprobity     1  True   
1497  1497  mm?       -59.9   -34.9  Favored  11   8  0.46  11  0.20  molprobity     1  True   
1498  1498  ?         -59.5   -49.3  Favored   5   5  0.32   7  0.27  molprobity     1  True   
1499  1499  mt-30     -62.3   -40.3  Favored   8   9  0.41  12  0.30  molprobity     1  True   
1500  1500  mm-40     -55.5   -50.1  Favored   6   9  0.31  12  0.33  molprobity     1  True   
1501  1501  m-70      -59.1   -39.5  Favored   7  11  0.23  15  0.20  molprobity     1  True   
1502  1502  mt        -54.2   -46.0  Favored  11   8  0.47  11  0.34  molprobity     1  True   
1503  1503  mtpp      -70.1   -40.6  Favored  13   9  0.36  11  0.34  molprobity     1  True   
1504  1504  m-70      -83.6    28.9  Allowed   7  11  0.31  15  0.29  molprobity     1  True   
1505  1505  t70        68.3    13.2  Favored   4   8  0.46  11  0.48  molprobity     1  True   
1506  1506  m120     -106.0    70.1  Allowed   6   8  0.42  11  0.25  molprobity     1  True   
1507  1507  ?         -64.6   -51.4  Favored   5   5  0.36   7  0.21  molprobity     1  True   
1508  1508  m         -62.0   -41.8  Favored   5   6  0.43   8  0.23  molprobity     1  True   
1509  1509  mmt180    -58.8   -46.2  Favored  13  11  1.25  14  0.50  molprobity     1  True   
1510  1510  ?         -62.3   -48.6  Favored   5   5  0.23   7  0.24  molprobity     1  True   
1511  1511  tp        -51.1   -48.9  Favored  11   8  0.36  11  0.18  molprobity     1  True   
1512  1512  ?         -57.3   -40.4  Favored   5   5  0.39   7  0.25  molprobity     1  True   
1513  1513  mt        -63.4   -52.4  Favored  11   8  0.36  11  0.08  molprobity     1  True   
1514  1514  m-85      -56.2   -49.5  Favored   9  12  0.41  16  0.22  molprobity     1  True   
1515  1515  mt-10     -58.5   -33.6  Favored   6   9  0.43  12  0.33  molprobity     1  True   
1516  1516  tt0       -74.6   -39.9  Favored   6   9  0.29  12  0.34  molprobity     1  True   
1517  1517  mt        -54.5   -33.9  Favored  11   8  0.36  11  0.20  molprobity     1  True   
1518  1518  t         -55.2   -47.9  Favored   9   7  0.36  10  0.42  molprobity     1  True   
1519  1519  pt-20     -82.5   -33.2  Favored   6   9  0.37  12  0.34  molprobity     1  True   
1520  1520  p         -76.7   -49.1  Favored   7   7  0.56  10  0.66  molprobity     1  True   
1521  1521  m-20     -125.5    72.7  Favored   4   8  0.42  12  0.46  molprobity     1  True   
1522  1522  Cg_endo   -68.3   -11.5  Favored   7   8  0.35  11  0.26  molprobity     1  True   
1523  1523  t70       -80.9   -19.2  Favored   4   8  0.28  11  0.45  molprobity     1  True   
1524  1524  t80       -79.8    90.0  Favored   9  13  0.36  18  0.35  molprobity     1  True   
1525  1525  t         -58.3   -35.7  Favored   9   7  0.47  10  0.41  molprobity     1  True   
1526  1526  ?         -54.4   -32.2  Favored   3   4  0.56   5  0.17  molprobity     1  True   
1527  1527  m         -58.8   -56.7  Favored   7   7  0.42  10  0.59  molprobity     1  True   
1528  1528  m-85      -56.2   -44.8  Favored   9  13  0.37  18  0.27  molprobity     1  True   
1529  1529  t80       -60.5   -56.6  Favored   9  13  0.36  18  0.22  molprobity     1  True   
1530  1530  m-70      -72.8   -29.9  Favored   7  11  0.33  15  0.27  molprobity     1  True   
1531  1531  tp        -61.4   -45.1  Favored  11   8  0.42  11  0.28  molprobity     1  True   
1532  1532  ?         -59.1   -43.5  Favored   3   4  0.43   5  0.19  molprobity     1  True   
1533  1533  OUTLIER   -58.3   -38.1  Favored  13   9  0.40  11  0.45  molprobity     1  True   
1534  1534  tp        -67.1   -39.6  Favored  11   8  0.41  11  0.21  molprobity     1  True   
1535  1535  m-85      -59.3   -43.8  Favored   9  13  0.33  18  0.25  molprobity     1  True   
1536  1536  mt-10     -53.1   -46.0  Favored   6   9  0.49  12  0.58  molprobity     1  True   
1537  1537  ttt180    -62.1   -26.5  Favored  13  11  1.24  14  0.48  molprobity     1  True   
1538  1538  mt        -95.7     7.8  Favored  11   8  0.41  11  0.27  molprobity     1  True   
1539  1539  t70        67.8     9.5  Favored   4   8  0.47  11  0.35  molprobity     1  True   
1540  1540  mmm180    -81.2    59.0  Favored  13  11  1.23  14  0.58  molprobity     1  True   
1541  1541  m         -54.7   -50.0  Favored   7   7  0.45  10  0.48  molprobity     1  True   
1542  1542  m-20      -55.6   -49.6  Favored   4   8  0.33  11  0.40  molprobity     1  True   
1543  1543  m-20      -60.9   -38.4  Favored   4   8  0.26  11  0.39  molprobity     1  True   
1544  1544  ?         -61.0   -55.1  Favored   5   5  0.33   7  0.29  molprobity     1  True   
1545  1545  mt        -52.6   -49.2  Favored  11   8  0.32  11  0.50  molprobity     1  True   
1546  1546  t70       -57.3   -45.2  Favored   4   8  0.28  11  0.41  molprobity     1  True   
1547  1547  m         -61.9   -39.0  Favored   7   7  0.48  10  0.43  molprobity     1  True   
1548  1548  m-85      -64.0   -32.2  Favored   9  13  0.35  18  0.21  molprobity     1  True   
1549  1549  ?         -59.5   -49.5  Favored   5   5  0.36   7  0.27  molprobity     1  True   
1550  1550  mm100     -56.0   -42.4  Favored   8   9  0.42  12  0.32  molprobity     1  True   
1551  1551  ?         -60.9   -40.5  Favored   3   4  0.33   5  0.19  molprobity     1  True   
1552  1552  mt        -54.7   -47.3  Favored  11   8  0.38  11  0.36  molprobity     1  True   
1553  1553  mt-10     -61.0   -54.3  Favored   6   9  0.40  12  0.40  molprobity     1  True   
1554  1554  m         -70.6   -35.9  Favored   9   7  0.35  10  0.34  molprobity     1  True   
1555  1555  ?         -66.1   -45.4  Favored   5   5  0.29   7  0.22  molprobity     1  True   
1556  1556  ptm180    -63.2   -46.9  Favored  13  11  1.23  14  0.48  molprobity     1  True   
1557  1557  mt-10     -87.8   -51.3  Favored   6   9  0.38  12  0.39  molprobity     1  True   
1558  1558  mm-40     -80.5   -45.7  Favored   6   9  0.41  12  0.38  molprobity     1  True   
1559  1559  ?         -86.4  -111.9  Allowed   3   4  0.50   5  0.21  molprobity     1  True   
1560  1560  t        -157.7   166.3  Favored   7   7  0.46  10  0.54  molprobity     1  True   
1561  1561  tt0       -65.8   -23.2  Favored   8   9  0.34  12  0.28  molprobity     1  True   
1562  1562  ttpt      -61.6   -51.3  Favored  13   9  0.37  11  0.21  molprobity     1  True   
1563  1563  m-20      -67.0   -36.4  Favored   4   8  0.22  11  0.43  molprobity     1  True   
1564  1564  tp        -55.1   -48.7  Favored  11   8  0.34  11  0.23  molprobity     1  True   
1565  1565  t         -65.1   -37.7  Favored   5   6  0.40   8  0.18  molprobity     1  True   
1566  1566  mm-40     -59.3   -45.3  Favored   6   9  0.33  12  0.36  molprobity     1  True   
1567  1567  mt        -65.5   -43.5  Favored  11   8  0.38  11  0.20  molprobity     1  True   
1568  1568  mt-30     -64.4   -38.1  Favored   8   9  0.36  12  0.25  molprobity     1  True   
1569  1569  t70       -68.0   -40.9  Favored   4   8  0.27  11  0.41  molprobity     1  True   
1570  1570  ?         -59.1   -50.6  Favored   5   5  0.27   7  0.24  molprobity     1  True   
1571  1571  ptmm?     -67.2   -34.3  Favored  13   9  0.34  11  0.20  molprobity     1  True   
1572  1572  tp        -59.2   -52.2  Favored  11   8  0.40  11  0.16  molprobity     1  True   
1573  1573  OUTLIER   -69.3   -28.4  Favored  13   9  0.43  11  0.46  molprobity     1  True   
1574  1574  ?         -64.5   -42.4  Favored   5   5  0.36   7  0.35  molprobity     1  True   
1575  1575  mt-10     -70.2   -23.8  Favored   6   9  0.34  12  0.32  molprobity     1  True   
1576  1576  ?         -91.2     4.4  Favored   3   4  0.54   5  0.15  molprobity     1  True   
1577  1577  mt        -61.9   -41.1  Favored  11   8  0.44  11  0.24  molprobity     1  True   
1578  1578  pt-20    -165.2   162.9  Favored   6   9  0.34  12  0.34  molprobity     ?  False  
1579  1579  m80      -109.3   100.6  Favored   7  11  0.28  15  0.28  molprobity     ?  False  
1580  1580  m80       -79.6   132.2  Favored   7  11  0.28  15  0.20  molprobity     ?  False  
1581  1581  t-80      -97.1   104.6  Favored   7  11  0.25  15  0.21  molprobity     ?  False  
1582  1582  p-80     -148.5   163.6  Favored   7  11  0.26  15  0.34  molprobity     ?  False  
1583  1583  t-80      -55.3   130.0  Favored   7  11  0.28  15  0.29  molprobity     ?  False  
1584  1584  p-80          ?       ?  ?         7  11  0.61  12  0.37  molprobity     ?  False  
1585  1585  OUTLIER       ?       ?  ?         8   9  0.65  12  0.39  molprobity     ?  False  
1586  1586  m-20     -118.8   165.8  Favored   4   8  0.35  12  0.58  molprobity     1  True   
1587  1587  Cg_exo    -55.3   -18.4  Favored   7   8  0.46  11  0.31  molprobity     1  True   
1588  1588  mt-10     -80.4   -25.0  Favored   6   9  0.44  12  0.39  molprobity     1  True   
1589  1589  m-20      -62.0   137.7  Favored   4   8  0.48  12  0.52  molprobity     1  True   
1590  1590  Cg_endo   -53.1   -42.1  Favored   7   8  0.37  11  0.29  molprobity     1  True   
1591  1591  t80       -61.9   -43.0  Favored   9  12  0.38  16  0.20  molprobity     1  True   
1592  1592  m         -64.0   -56.7  Favored   7   7  0.42  10  0.56  molprobity     1  True   
1593  1593  ptm180    -59.3   -29.9  Favored  13  11  1.25  14  0.38  molprobity     1  True   
1594  1594  t80       -70.2   -41.9  Favored   9  13  0.37  18  0.28  molprobity     1  True   
1595  1595  ?         -60.8   -45.1  Favored   5   5  0.34   7  0.22  molprobity     1  True   
1596  1596  mm?       -64.4   -32.2  Favored  11   8  0.41  11  0.20  molprobity     1  True   
1597  1597  ?         -58.3   -44.5  Favored   5   5  0.35   7  0.29  molprobity     1  True   
1598  1598  mt-30     -61.8   -43.9  Favored   8   9  0.39  12  0.28  molprobity     1  True   
1599  1599  mm-40     -56.1   -46.1  Favored   6   9  0.34  12  0.33  molprobity     1  True   
1600  1600  m-70      -61.3   -38.2  Favored   7  11  0.28  15  0.23  molprobity     1  True   
1601  1601  mt        -61.5   -33.8  Favored  11   8  0.41  11  0.23  molprobity     1  True   
1602  1602  mttt      -73.6   -31.2  Favored  13   9  0.35  11  0.29  molprobity     1  True   
1603  1603  m-70     -109.8    52.0  Allowed   7  11  0.33  15  0.29  molprobity     1  True   
1604  1604  t70        67.1   -12.9  Allowed   4   8  0.62  11  0.55  molprobity     1  True   
1605  1605  m120      -88.5    49.0  Allowed   6   8  0.39  11  0.29  molprobity     1  True   
1606  1606  ?         -57.0   -45.0  Favored   5   5  0.35   7  0.27  molprobity     1  True   
1607  1607  t         -66.0   -33.9  Favored   5   6  0.45   8  0.27  molprobity     1  True   
1608  1608  mmt180    -72.0   -39.3  Favored  13  11  1.19  14  0.26  molprobity     1  True   
1609  1609  ?         -63.5   -40.7  Favored   5   5  0.19   7  0.33  molprobity     1  True   
1610  1610  tp        -51.4   -50.8  Favored  11   8  0.37  11  0.29  molprobity     1  True   
1611  1611  ?         -58.6   -37.1  Favored   5   5  0.30   7  0.18  molprobity     1  True   
1612  1612  mt        -68.4   -41.8  Favored  11   8  0.39  11  0.15  molprobity     1  True   
1613  1613  m-85      -61.7   -43.5  Favored   9  12  0.39  16  0.22  molprobity     1  True   
1614  1614  mt-10     -62.8   -40.4  Favored   6   9  0.38  12  0.44  molprobity     1  True   
1615  1615  tp10      -59.3   -33.1  Favored   6   9  0.45  12  0.53  molprobity     1  True   
1616  1616  mt        -68.2   -51.5  Favored  11   8  0.30  11  0.23  molprobity     1  True   
1617  1617  t         -56.2   -39.1  Favored   9   7  0.41  10  0.46  molprobity     1  True   
1618  1618  pt-20     -72.0   -35.5  Favored   6   9  0.37  12  0.35  molprobity     1  True   
1619  1619  p         -82.2   -25.4  Favored   7   7  0.52  10  0.66  molprobity     1  True   
1620  1620  t70      -158.9    99.2  Allowed   4   8  0.37  12  0.52  molprobity     1  True   
1621  1621  Cg_endo   -82.7    17.8  Allowed   7   8  0.36  11  0.26  molprobity     1  True   
1622  1622  m-20     -109.3   -29.8  Favored   4   8  0.27  11  0.43  molprobity     1  True   
1623  1623  t80       -62.1    94.0  Allowed   9  13  0.38  18  0.39  molprobity     1  True   
1624  1624  t         -56.5   -35.2  Favored   9   7  0.48  10  0.42  molprobity     1  True   
1625  1625  ?         -54.5   -35.8  Favored   3   4  0.58   5  0.16  molprobity     1  True   
1626  1626  m         -60.4   -53.7  Favored   7   7  0.41  10  0.57  molprobity     1  True   
1627  1627  m-85      -58.8   -43.8  Favored   9  13  0.38  18  0.28  molprobity     1  True   
1628  1628  t80       -55.8   -52.1  Favored   9  13  0.38  18  0.29  molprobity     1  True   
1629  1629  m-70      -75.2   -35.1  Favored   7  11  0.27  15  0.23  molprobity     1  True   
1630  1630  tp        -64.4   -39.3  Favored  11   8  0.42  11  0.26  molprobity     1  True   
1631  1631  ?         -59.9   -49.0  Favored   3   4  0.44   5  0.19  molprobity     1  True   
1632  1632  mmtp      -57.2   -34.5  Favored  13   9  0.36  11  0.27  molprobity     1  True   
1633  1633  tp        -67.6   -39.8  Favored  11   8  0.36  11  0.25  molprobity     1  True   
1634  1634  m-85      -60.3   -46.1  Favored   9  13  0.37  18  0.30  molprobity     1  True   
1635  1635  mt-10     -56.0   -39.2  Favored   6   9  0.39  12  0.40  molprobity     1  True   
1636  1636  ttt180    -64.7   -32.9  Favored  13  11  1.17  14  0.62  molprobity     1  True   
1637  1637  mt        -88.3    14.2  Favored  11   8  0.43  11  0.26  molprobity     1  True   
1638  1638  t70        68.3     7.1  Favored   4   8  0.46  11  0.47  molprobity     1  True   
1639  1639  mmm180    -88.8    58.0  Favored  13  11  1.24  14  0.72  molprobity     1  True   
1640  1640  m         -56.7   -50.4  Favored   7   7  0.49  10  0.47  molprobity     1  True   
1641  1641  t70       -59.7   -42.4  Favored   4   8  0.35  11  0.38  molprobity     1  True   
1642  1642  m-20      -60.1   -42.2  Favored   4   8  0.28  11  0.45  molprobity     1  True   
1643  1643  ?         -57.7   -52.2  Favored   5   5  0.19   7  0.24  molprobity     1  True   
1644  1644  mt        -52.9   -43.9  Favored  11   8  0.36  11  0.38  molprobity     1  True   
1645  1645  t70       -66.3   -38.8  Favored   4   8  0.32  11  0.39  molprobity     1  True   
1646  1646  m         -62.1   -39.2  Favored   7   7  0.48  10  0.44  molprobity     1  True   
1647  1647  m-85      -64.3   -41.6  Favored   9  13  0.30  18  0.24  molprobity     1  True   
1648  1648  ?         -56.2   -46.9  Favored   5   5  0.38   7  0.26  molprobity     1  True   
1649  1649  mm100     -54.9   -51.4  Favored   8   9  0.41  12  0.32  molprobity     1  True   
1650  1650  ?         -59.9   -35.2  Favored   3   4  0.44   5  0.22  molprobity     1  True   
1651  1651  mt        -58.6   -46.9  Favored  11   8  0.30  11  0.39  molprobity     1  True   
1652  1652  mt-10     -57.9   -55.4  Favored   6   9  0.32  12  0.35  molprobity     1  True   
1653  1653  m         -70.4   -22.2  Favored   9   7  0.36  10  0.31  molprobity     1  True   
1654  1654  ?         -71.3   -43.1  Favored   5   5  0.33   7  0.25  molprobity     1  True   
1655  1655  ptm180    -76.2   -45.1  Favored  13  11  1.19  14  0.29  molprobity     1  True   
1656  1656  mt-10     -77.3   -51.3  Favored   6   9  0.43  12  0.38  molprobity     1  True   
1657  1657  mm-40     -97.4   -27.9  Favored   6   9  0.52  12  0.53  molprobity     1  True   
1658  1658  ?         -92.6  -110.1  Allowed   3   4  0.61   5  0.23  molprobity     1  True   
1659  1659  t        -168.0   168.4  Favored   7   7  0.50  10  0.62  molprobity     1  True   
1660  1660  tp-100    -56.4   -36.9  Favored   8   9  0.45  12  0.37  molprobity     1  True   
1661  1661  tttm      -54.7   -51.5  Favored  13   9  0.42  11  0.32  molprobity     1  True   
1662  1662  m-20      -80.3   -27.8  Favored   4   8  0.24  11  0.43  molprobity     1  True   
1663  1663  tp        -55.5   -52.0  Favored  11   8  0.33  11  0.28  molprobity     1  True   
1664  1664  t         -59.9   -34.1  Favored   5   6  0.36   8  0.17  molprobity     1  True   
1665  1665  mm-40     -57.2   -52.4  Favored   6   9  0.39  12  0.42  molprobity     1  True   
1666  1666  mt        -72.3   -34.1  Favored  11   8  0.37  11  0.29  molprobity     1  True   
1667  1667  mm100     -57.9   -50.3  Favored   8   9  0.39  12  0.26  molprobity     1  True   
1668  1668  t70       -72.1   -36.8  Favored   4   8  0.24  11  0.33  molprobity     1  True   
1669  1669  ?         -58.0   -50.2  Favored   5   5  0.37   7  0.30  molprobity     1  True   
1670  1670  pttm      -65.8   -35.9  Favored  13   9  0.35  11  0.33  molprobity     1  True   
1671  1671  tp        -68.7   -38.6  Favored  11   8  0.37  11  0.29  molprobity     1  True   
1672  1672  OUTLIER   -71.2   -24.2  Favored  13   9  0.40  11  0.44  molprobity     1  True   
1673  1673  ?         -74.4   -42.6  Favored   5   5  0.33   7  0.32  molprobity     1  True   
1674  1674  mt-10     -59.0   -28.8  Favored   6   9  0.34  12  0.40  molprobity     1  True   
1675  1675  ?         -85.7     1.2  Favored   3   4  0.57   5  0.20  molprobity     1  True   
1676  1676  mt        -85.3   -57.3  Favored  11   8  0.40  11  0.25  molprobity     1  True   
1677  1677  pt-20    -103.8   148.8  Favored   6   9  0.37  12  0.39  molprobity     ?  False  
1678  1678  m-70      -87.5    77.7  Favored   7  11  0.24  15  0.34  molprobity     ?  False  
1679  1679  t60       -60.9    99.3  Allowed   7  11  0.26  15  0.29  molprobity     ?  False  
1680  1680  m-70      -79.1   124.2  Favored   7  11  0.29  15  0.33  molprobity     ?  False  
1681  1681  t60      -141.8   108.4  Favored   7  11  0.24  15  0.20  molprobity     ?  False  
1682  1682  p80       -70.9   165.1  Favored   7  11  0.31  15  0.30  molprobity     ?  False  
1683  1683  p-80          ?       ?  ?         7  11  0.63  12  0.37  molprobity     ?  False  
1684  1684  mm-40         ?       ?  ?         8   9  0.63  12  0.34  molprobity     ?  False  
1685  1685  m-20     -108.5   164.4  Favored   4   8  0.33  12  0.53  molprobity     1  True   
1686  1686  Cg_exo    -53.6   -20.7  Favored   7   8  0.42  11  0.24  molprobity     1  True   
1687  1687  mt-10     -85.8    -5.8  Favored   6   9  0.34  12  0.28  molprobity     1  True   
1688  1688  OUTLIER   -70.3   122.2  Favored   4   8  0.37  12  0.58  molprobity     1  True   
1689  1689  Cg_endo   -48.6   -41.5  Favored   7   8  0.39  11  0.32  molprobity     1  True   
1690  1690  t80       -73.3   -43.3  Favored   9  12  0.39  16  0.16  molprobity     1  True   
1691  1691  m         -61.1   -54.0  Favored   7   7  0.49  10  0.50  molprobity     1  True   
1692  1692  ptm180    -60.2   -35.8  Favored  13  11  1.21  14  0.36  molprobity     1  True   
1693  1693  t80       -63.0   -38.4  Favored   9  13  0.37  18  0.41  molprobity     1  True   
1694  1694  ?         -65.6   -43.9  Favored   5   5  0.29   7  0.18  molprobity     1  True   
1695  1695  mm?       -60.3   -37.0  Favored  11   8  0.47  11  0.19  molprobity     1  True   
1696  1696  ?         -58.8   -47.6  Favored   5   5  0.33   7  0.33  molprobity     1  True   
1697  1697  mt-30     -61.5   -43.3  Favored   8   9  0.39  12  0.28  molprobity     1  True   
1698  1698  mm-40     -58.8   -48.2  Favored   6   9  0.33  12  0.39  molprobity     1  True   
1699  1699  m-70      -57.6   -39.8  Favored   7  11  0.24  15  0.21  molprobity     1  True   
1700  1700  mt        -59.9   -47.5  Favored  11   8  0.44  11  0.32  molprobity     1  True   
1701  1701  mtpt      -62.3   -27.3  Favored  13   9  0.37  11  0.34  molprobity     1  True   
1702  1702  m-70     -105.6    32.6  Favored   7  11  0.32  15  0.30  molprobity     1  True   
1703  1703  t70        75.1   -16.4  Allowed   4   8  0.48  11  0.40  molprobity     1  True   
1704  1704  m120      -76.2    71.9  Favored   6   8  0.39  11  0.27  molprobity     1  True   
1705  1705  ?         -65.9   -46.8  Favored   5   5  0.28   7  0.22  molprobity     1  True   
1706  1706  m         -65.9   -45.5  Favored   5   6  0.47   8  0.21  molprobity     1  True   
1707  1707  mmt85     -60.1   -39.0  Favored  13  11  1.24  14  0.41  molprobity     1  True   
1708  1708  ?         -68.8   -43.1  Favored   5   5  0.26   7  0.27  molprobity     1  True   
1709  1709  tp        -53.2   -48.2  Favored  11   8  0.36  11  0.22  molprobity     1  True   
1710  1710  ?         -56.1   -41.6  Favored   5   5  0.28   7  0.20  molprobity     1  True   
1711  1711  mt        -62.0   -49.4  Favored  11   8  0.38  11  0.11  molprobity     1  True   
1712  1712  m-85      -59.3   -48.6  Favored   9  12  0.42  16  0.20  molprobity     1  True   
1713  1713  mt-10     -61.0   -34.3  Favored   6   9  0.44  12  0.39  molprobity     1  True   
1714  1714  tt0       -65.7   -44.7  Favored   6   9  0.31  12  0.37  molprobity     1  True   
1715  1715  mt        -57.3   -35.3  Favored  11   8  0.39  11  0.18  molprobity     1  True   
1716  1716  t         -65.2   -39.9  Favored   9   7  0.35  10  0.41  molprobity     1  True   
1717  1717  pt-20     -81.2   -28.1  Favored   6   9  0.39  12  0.33  molprobity     1  True   
1718  1718  p         -91.1   -54.5  Favored   7   7  0.50  10  0.60  molprobity     1  True   
1719  1719  m-20     -124.5    78.2  Favored   4   8  0.43  12  0.53  molprobity     1  True   
1720  1720  Cg_exo    -64.4   -19.6  Favored   7   8  0.43  11  0.29  molprobity     1  True   
1721  1721  m-20      -65.1   -28.4  Favored   4   8  0.32  11  0.39  molprobity     1  True   
1722  1722  t80       -78.7    86.4  Favored   9  13  0.33  18  0.41  molprobity     1  True   
1723  1723  t         -63.5   -31.0  Favored   9   7  0.43  10  0.43  molprobity     1  True   
1724  1724  ?         -51.3   -31.5  Favored   3   4  0.60   5  0.31  molprobity     1  True   
1725  1725  m         -57.4   -52.6  Favored   7   7  0.37  10  0.61  molprobity     1  True   
1726  1726  m-85      -58.9   -42.3  Favored   9  13  0.33  18  0.25  molprobity     1  True   
1727  1727  t80       -58.4   -55.2  Favored   9  13  0.37  18  0.19  molprobity     1  True   
1728  1728  m-70      -72.6   -29.3  Favored   7  11  0.28  15  0.21  molprobity     1  True   
1729  1729  tp        -62.6   -48.0  Favored  11   8  0.43  11  0.25  molprobity     1  True   
1730  1730  ?         -61.0   -45.5  Favored   3   4  0.44   5  0.29  molprobity     1  True   
1731  1731  mmmp?     -56.9   -35.2  Favored  13   9  0.41  11  0.30  molprobity     1  True   
1732  1732  tp        -70.9   -39.3  Favored  11   8  0.38  11  0.22  molprobity     1  True   
1733  1733  m-85      -60.3   -44.7  Favored   9  13  0.36  18  0.22  molprobity     1  True   
1734  1734  mt-10     -55.3   -37.7  Favored   6   9  0.36  12  0.48  molprobity     1  True   
1735  1735  ttt180    -68.2   -30.5  Favored  13  11  1.20  14  0.64  molprobity     1  True   
1736  1736  mt        -96.8    14.7  Favored  11   8  0.44  11  0.25  molprobity     1  True   
1737  1737  t70        73.6    -1.9  Favored   4   8  0.51  11  0.41  molprobity     1  True   
1738  1738  mmm180    -76.6    71.6  Favored  13  11  1.17  14  0.64  molprobity     1  True   
1739  1739  m         -61.9   -51.3  Favored   7   7  0.61  10  0.53  molprobity     1  True   
1740  1740  m-20      -58.9   -47.3  Favored   4   8  0.30  11  0.34  molprobity     1  True   
1741  1741  m-20      -58.5   -42.2  Favored   4   8  0.27  11  0.46  molprobity     1  True   
1742  1742  ?         -59.0   -55.5  Favored   5   5  0.28   7  0.20  molprobity     1  True   
1743  1743  mt        -58.4   -43.3  Favored  11   8  0.33  11  0.41  molprobity     1  True   
1744  1744  t70       -58.3   -43.8  Favored   4   8  0.34  11  0.42  molprobity     1  True   
1745  1745  m         -60.4   -46.2  Favored   7   7  0.47  10  0.45  molprobity     1  True   
1746  1746  m-85      -62.8   -38.9  Favored   9  13  0.33  18  0.22  molprobity     1  True   
1747  1747  ?         -57.3   -55.1  Favored   5   5  0.38   7  0.21  molprobity     1  True   
1748  1748  OUTLIER   -65.2   -37.1  Favored   8   9  0.53  12  0.48  molprobity     1  True   
1749  1749  ?         -57.6   -36.5  Favored   3   4  0.40   5  0.22  molprobity     1  True   
1750  1750  mt        -56.5   -41.3  Favored  11   8  0.38  11  0.38  molprobity     1  True   
1751  1751  mt-10     -62.3   -55.5  Favored   6   9  0.31  12  0.36  molprobity     1  True   
1752  1752  m         -70.8   -23.5  Favored   9   7  0.36  10  0.37  molprobity     1  True   
1753  1753  ?         -64.3   -52.2  Favored   5   5  0.27   7  0.26  molprobity     1  True   
1754  1754  ptm180    -70.7   -38.6  Favored  13  11  1.25  14  0.54  molprobity     1  True   
1755  1755  mt-10     -87.2   -52.3  Favored   6   9  0.41  12  0.40  molprobity     1  True   
1756  1756  mm-40     -85.5   -46.6  Favored   6   9  0.49  12  0.44  molprobity     1  True   
1757  1757  ?         -90.0   -99.8  Allowed   3   4  0.47   5  0.18  molprobity     1  True   
1758  1758  t        -166.5   157.8  Favored   7   7  0.48  10  0.61  molprobity     1  True   
1759  1759  tt0       -59.2   -23.7  Favored   8   9  0.43  12  0.25  molprobity     1  True   
1760  1760  ttmt      -64.8   -50.9  Favored  13   9  0.34  11  0.18  molprobity     1  True   
1761  1761  m-20      -64.5   -35.9  Favored   4   8  0.24  11  0.41  molprobity     1  True   
1762  1762  tp        -52.8   -49.3  Favored  11   8  0.35  11  0.30  molprobity     1  True   
1763  1763  m         -61.6   -35.6  Favored   5   6  0.47   8  0.26  molprobity     1  True   
1764  1764  mm-40     -68.2   -47.5  Favored   6   9  0.38  12  0.34  molprobity     1  True   
1765  1765  mt        -63.2   -45.9  Favored  11   8  0.39  11  0.18  molprobity     1  True   
1766  1766  mt-30     -59.7   -47.6  Favored   8   9  0.39  12  0.32  molprobity     1  True   
1767  1767  t70       -66.0   -30.1  Favored   4   8  0.36  11  0.40  molprobity     1  True   
1768  1768  ?         -65.7   -45.1  Favored   5   5  0.35   7  0.28  molprobity     1  True   
1769  1769  pttt      -75.6   -29.9  Favored  13   9  0.41  11  0.34  molprobity     1  True   
1770  1770  tp        -54.1   -47.5  Favored  11   8  0.46  11  0.22  molprobity     1  True   
1771  1771  pttp      -62.6   -35.6  Favored  13   9  0.36  11  0.18  molprobity     1  True   
1772  1772  ?         -57.5   -44.2  Favored   5   5  0.43   7  0.35  molprobity     1  True   
1773  1773  mm-40     -56.7   -33.8  Favored   6   9  0.41  12  0.37  molprobity     1  True   
1774  1774  ?         -83.1   -20.3  Favored   3   4  0.46   5  0.08  molprobity     1  True   
1775  1775  mt        -74.0   -34.6  Favored  11   8  0.39  11  0.23  molprobity     1  True   
1776  1776  pt-20    -153.1   108.5  Favored   6   9  0.35  12  0.43  molprobity     ?  False  
1777  1777  m-70      -87.4   107.4  Favored   7  11  0.27  15  0.26  molprobity     ?  False  
1778  1778  m-70      -72.2    72.7  Allowed   7  11  0.30  15  0.24  molprobity     ?  False  
1779  1779  p80       -81.9    48.1  Allowed   7  11  0.34  15  0.36  molprobity     ?  False  
1780  1780  p80      -147.4   141.3  Favored   7  11  0.24  15  0.26  molprobity     ?  False  
1781  1781  m-70       65.0    12.3  Favored   7  11  0.39  15  0.39  molprobity     ?  False  
1782  1782  t-80          ?       ?  ?         7  11  0.67  12  0.28  molprobity     ?  False  
1783  1783  mt-10         ?       ?  ?         8   9  0.53  12  0.32  molprobity     ?  False  
1784  1784  m-20     -104.3   144.8  Favored   4   8  0.25  12  0.52  molprobity     1  True   
1785  1785  Cg_endo   -59.1   -12.6  Favored   7   8  0.37  11  0.30  molprobity     1  True   
1786  1786  mm-40     -76.7   -33.5  Favored   6   9  0.31  12  0.35  molprobity     1  True   
1787  1787  m-20      -61.3   129.0  Favored   4   8  0.42  12  0.50  molprobity     1  True   
1788  1788  Cg_endo   -47.3   -50.7  Favored   7   8  0.44  11  0.36  molprobity     1  True   
1789  1789  t80       -69.7   -41.5  Favored   9  12  0.40  16  0.16  molprobity     1  True   
1790  1790  m         -58.5   -55.1  Favored   7   7  0.51  10  0.54  molprobity     1  True   
1791  1791  ptm85     -60.9   -34.7  Favored  13  11  1.29  14  0.83  molprobity     1  True   
1792  1792  t80       -60.6   -45.0  Favored   9  13  0.38  18  0.38  molprobity     1  True   
1793  1793  ?         -65.8   -46.2  Favored   5   5  0.29   7  0.18  molprobity     1  True   
1794  1794  mm?       -58.4   -35.0  Favored  11   8  0.42  11  0.19  molprobity     1  True   
1795  1795  ?         -57.4   -45.2  Favored   5   5  0.30   7  0.32  molprobity     1  True   
1796  1796  mt-30     -65.9   -34.0  Favored   8   9  0.36  12  0.20  molprobity     1  True   
1797  1797  mm-40     -62.0   -41.0  Favored   6   9  0.39  12  0.35  molprobity     1  True   
1798  1798  m-70      -60.9   -40.1  Favored   7  11  0.28  15  0.21  molprobity     1  True   
1799  1799  mt        -59.7   -37.6  Favored  11   8  0.43  11  0.13  molprobity     1  True   
1800  1800  mttp      -55.3   -42.0  Favored  13   9  0.35  11  0.35  molprobity     1  True   
1801  1801  m-70      -92.6    17.3  Favored   7  11  0.31  15  0.37  molprobity     1  True   
1802  1802  t70        65.2    11.8  Favored   4   8  0.36  11  0.44  molprobity     1  True   
1803  1803  m120      -76.8    65.0  Favored   6   8  0.38  11  0.38  molprobity     1  True   
1804  1804  ?         -62.0   -41.6  Favored   5   5  0.23   7  0.18  molprobity     1  True   
1805  1805  t         -61.6   -50.4  Favored   5   6  0.40   8  0.20  molprobity     1  True   
1806  1806  mmt180    -64.0   -37.5  Favored  13  11  1.15  14  0.30  molprobity     1  True   
1807  1807  ?         -65.8   -44.8  Favored   5   5  0.38   7  0.47  molprobity     1  True   
1808  1808  tp        -56.1   -45.5  Favored  11   8  0.33  11  0.36  molprobity     1  True   
1809  1809  ?         -57.3   -42.1  Favored   5   5  0.32   7  0.22  molprobity     1  True   
1810  1810  mt        -62.0   -46.0  Favored  11   8  0.38  11  0.14  molprobity     1  True   
1811  1811  m-85      -60.5   -45.3  Favored   9  12  0.39  16  0.18  molprobity     1  True   
1812  1812  mt-10     -59.2   -41.6  Favored   6   9  0.34  12  0.40  molprobity     1  True   
1813  1813  tt0       -65.1   -34.7  Favored   6   9  0.49  12  0.46  molprobity     1  True   
1814  1814  mt        -62.4   -35.6  Favored  11   8  0.40  11  0.20  molprobity     1  True   
1815  1815  t         -63.9   -52.2  Favored   9   7  0.38  10  0.46  molprobity     1  True   
1816  1816  pt-20     -67.5   -28.4  Favored   6   9  0.41  12  0.39  molprobity     1  True   
1817  1817  p         -85.8   -54.2  Favored   7   7  0.45  10  0.62  molprobity     1  True   
1818  1818  m-20     -117.0    83.9  Favored   4   8  0.45  12  0.48  molprobity     1  True   
1819  1819  Cg_endo   -72.0    -8.5  Favored   7   8  0.31  11  0.27  molprobity     1  True   
1820  1820  t70       -74.8   -37.2  Favored   4   8  0.33  11  0.46  molprobity     1  True   
1821  1821  t80       -69.9    84.5  Allowed   9  13  0.36  18  0.39  molprobity     1  True   
1822  1822  t         -57.1   -32.2  Favored   9   7  0.46  10  0.42  molprobity     1  True   
1823  1823  ?         -52.6   -35.9  Favored   3   4  0.47   5  0.20  molprobity     1  True   
1824  1824  m         -62.2   -52.9  Favored   7   7  0.37  10  0.59  molprobity     1  True   
1825  1825  m-85      -54.2   -46.6  Favored   9  13  0.36  18  0.28  molprobity     1  True   
1826  1826  t80       -60.4   -58.4  Favored   9  13  0.35  18  0.19  molprobity     1  True   
1827  1827  m-70      -66.9   -30.0  Favored   7  11  0.31  15  0.21  molprobity     1  True   
1828  1828  tp        -61.6   -49.3  Favored  11   8  0.41  11  0.26  molprobity     1  True   
1829  1829  ?         -61.5   -47.7  Favored   3   4  0.37   5  0.14  molprobity     1  True   
1830  1830  mmmp?     -57.9   -36.8  Favored  13   9  0.42  11  0.36  molprobity     1  True   
1831  1831  tp        -68.8   -37.4  Favored  11   8  0.40  11  0.20  molprobity     1  True   
1832  1832  m-85      -60.1   -47.7  Favored   9  13  0.35  18  0.29  molprobity     1  True   
1833  1833  mt-10     -52.7   -45.0  Favored   6   9  0.41  12  0.63  molprobity     1  True   
1834  1834  ttt180    -58.0   -35.2  Favored  13  11  1.19  14  0.47  molprobity     1  True   
1835  1835  mt        -94.1    17.5  Favored  11   8  0.49  11  0.27  molprobity     1  True   
1836  1836  t70        65.4    11.5  Favored   4   8  0.47  11  0.42  molprobity     1  True   
1837  1837  mmm180    -80.8    62.3  Favored  13  11  1.25  14  0.71  molprobity     1  True   
1838  1838  m         -55.3   -51.6  Favored   7   7  0.54  10  0.50  molprobity     1  True   
1839  1839  t70       -60.4   -45.8  Favored   4   8  0.28  11  0.39  molprobity     1  True   
1840  1840  m-20      -57.5   -46.5  Favored   4   8  0.23  11  0.45  molprobity     1  True   
1841  1841  ?         -57.6   -55.1  Favored   5   5  0.26   7  0.21  molprobity     1  True   
1842  1842  mt        -56.4   -47.3  Favored  11   8  0.37  11  0.38  molprobity     1  True   
1843  1843  t70       -64.3   -33.0  Favored   4   8  0.33  11  0.41  molprobity     1  True   
1844  1844  m         -66.5   -43.5  Favored   7   7  0.46  10  0.47  molprobity     1  True   
1845  1845  m-85      -61.1   -33.2  Favored   9  13  0.38  18  0.23  molprobity     1  True   
1846  1846  ?         -58.5   -50.6  Favored   5   5  0.34   7  0.23  molprobity     1  True   
1847  1847  mm100     -58.8   -41.6  Favored   8   9  0.41  12  0.33  molprobity     1  True   
1848  1848  ?         -60.5   -39.9  Favored   3   4  0.45   5  0.22  molprobity     1  True   
1849  1849  mt        -55.2   -45.4  Favored  11   8  0.39  11  0.44  molprobity     1  True   
1850  1850  mt-10     -64.8   -55.1  Favored   6   9  0.35  12  0.41  molprobity     1  True   
1851  1851  m         -68.8   -25.8  Favored   9   7  0.38  10  0.33  molprobity     1  True   
1852  1852  ?         -65.3   -52.7  Favored   5   5  0.34   7  0.25  molprobity     1  True   
1853  1853  ptm180    -66.5   -33.5  Favored  13  11  1.21  14  0.48  molprobity     1  True   
1854  1854  mm-40     -87.4   -52.6  Favored   6   9  0.43  12  0.41  molprobity     1  True   
1855  1855  mm-40     -92.4   -32.8  Favored   6   9  0.45  12  0.43  molprobity     1  True   
1856  1856  ?        -100.0  -117.7  Favored   3   4  0.50   5  0.15  molprobity     1  True   
1857  1857  t        -151.8   169.2  Favored   7   7  0.49  10  0.53  molprobity     1  True   
1858  1858  tt0       -60.6   -25.6  Favored   8   9  0.38  12  0.26  molprobity     1  True   
1859  1859  tttm      -63.6   -33.1  Favored  13   9  0.34  11  0.17  molprobity     1  True   
1860  1860  m-20      -73.8   -44.1  Favored   4   8  0.27  11  0.55  molprobity     1  True   
1861  1861  tp        -53.1   -43.2  Favored  11   8  0.37  11  0.30  molprobity     1  True   
1862  1862  t         -59.4   -33.7  Favored   5   6  0.46   8  0.26  molprobity     1  True   
1863  1863  mm-40     -75.5   -48.2  Favored   6   9  0.33  12  0.35  molprobity     1  True   
1864  1864  mt        -60.1   -41.8  Favored  11   8  0.39  11  0.24  molprobity     1  True   
1865  1865  mt-30     -61.5   -47.9  Favored   8   9  0.34  12  0.32  molprobity     1  True   
1866  1866  t70       -60.8   -36.3  Favored   4   8  0.29  11  0.41  molprobity     1  True   
1867  1867  ?         -63.6   -48.3  Favored   5   5  0.29   7  0.25  molprobity     1  True   
1868  1868  pttp      -72.0   -35.0  Favored  13   9  0.38  11  0.27  molprobity     1  True   
1869  1869  tp        -57.0   -50.2  Favored  11   8  0.39  11  0.20  molprobity     1  True   
1870  1870  pttp      -62.4   -25.9  Favored  13   9  0.30  11  0.19  molprobity     1  True   
1871  1871  ?         -75.0   -41.9  Favored   5   5  0.37   7  0.27  molprobity     1  True   
1872  1872  mt-10     -61.4   -29.7  Favored   6   9  0.48  12  0.40  molprobity     1  True   
1873  1873  ?         -85.6    -5.5  Favored   3   4  0.56   5  0.24  molprobity     1  True   
1874  1874  mt        -69.6   -68.2  Allowed  11   8  0.44  11  0.20  molprobity     1  True   
1875  1875  pt-20     -79.5   112.5  Favored   6   9  0.27  12  0.42  molprobity     ?  False  
1876  1876  OUTLIER   -70.7   171.0  Favored   7  11  0.34  15  0.41  molprobity     ?  False  
1877  1877  m80        67.4   -89.8  OUTLIER   7  11  0.35  15  0.60  molprobity     ?  False  
1878  1878  p80        39.1   -60.4  OUTLIER   7  11  0.65  15  0.71  molprobity     ?  False  
1879  1879  m-70      -40.7   124.2  Favored   7  11  0.38  15  0.48  molprobity     ?  False  
1880  1880  t-80      -80.5    58.2  Favored   7  11  0.31  15  0.46  molprobity     ?  False  
1881  1881  t-80          ?       ?  ?         7  11  0.67  12  0.32  molprobity     ?  False  
1882  1882  mt-10         ?       ?  ?         8   9  0.62  12  0.37  molprobity     ?  False  
1883  1883  m-20      -85.2   163.0  Favored   4   8  0.42  12  0.57  molprobity     1  True   
1884  1884  Cg_exo    -54.1   -20.1  Favored   7   8  0.48  11  0.27  molprobity     1  True   
1885  1885  mt-10     -80.5   -25.1  Favored   6   9  0.35  12  0.31  molprobity     1  True   
1886  1886  OUTLIER   -58.7   118.9  Favored   4   8  0.43  12  0.66  molprobity     1  True   
1887  1887  Cg_exo    -37.1   -52.8  Allowed   7   8  0.28  11  0.43  molprobity     1  True   
1888  1888  t80       -63.5   -38.8  Favored   9  12  0.39  16  0.22  molprobity     1  True   
1889  1889  m         -65.6   -56.4  Favored   7   7  0.47  10  0.69  molprobity     1  True   
1890  1890  ptm85     -58.7   -36.3  Favored  13  11  1.26  14  0.48  molprobity     1  True   
1891  1891  t80       -65.6   -39.5  Favored   9  13  0.39  18  0.41  molprobity     1  True   
1892  1892  ?         -64.8   -49.3  Favored   5   5  0.33   7  0.19  molprobity     1  True   
1893  1893  mm?       -55.6   -37.1  Favored  11   8  0.50  11  0.18  molprobity     1  True   
1894  1894  ?         -57.2   -52.2  Favored   5   5  0.30   7  0.32  molprobity     1  True   
1895  1895  mt-30     -61.8   -39.5  Favored   8   9  0.37  12  0.23  molprobity     1  True   
1896  1896  mm-40     -58.3   -43.0  Favored   6   9  0.37  12  0.36  molprobity     1  True   
1897  1897  m-70      -64.9   -33.9  Favored   7  11  0.27  15  0.20  molprobity     1  True   
1898  1898  mt        -61.6   -28.9  Favored  11   8  0.42  11  0.20  molprobity     1  True   
1899  1899  mtpp      -75.3   -22.0  Favored  13   9  0.38  11  0.26  molprobity     1  True   
1900  1900  m-70     -111.0    32.1  Favored   7  11  0.36  15  0.34  molprobity     1  True   
1901  1901  t70        64.6     2.7  Allowed   4   8  0.47  11  0.47  molprobity     1  True   
1902  1902  m120      -81.0    62.5  Favored   6   8  0.36  11  0.27  molprobity     1  True   
1903  1903  ?         -65.3   -45.6  Favored   5   5  0.28   7  0.20  molprobity     1  True   
1904  1904  m         -64.0   -41.3  Favored   5   6  0.45   8  0.19  molprobity     1  True   
1905  1905  mmt180    -60.1   -49.9  Favored  13  11  1.25  14  0.46  molprobity     1  True   
1906  1906  ?         -62.0   -38.3  Favored   5   5  0.24   7  0.26  molprobity     1  True   
1907  1907  tp        -56.7   -49.3  Favored  11   8  0.36  11  0.21  molprobity     1  True   
1908  1908  ?         -58.5   -38.9  Favored   5   5  0.34   7  0.26  molprobity     1  True   
1909  1909  mt        -65.5   -51.1  Favored  11   8  0.37  11  0.14  molprobity     1  True   
1910  1910  m-85      -59.3   -44.8  Favored   9  12  0.41  16  0.19  molprobity     1  True   
1911  1911  mt-10     -60.4   -36.4  Favored   6   9  0.38  12  0.37  molprobity     1  True   
1912  1912  tt0       -66.4   -39.1  Favored   6   9  0.37  12  0.36  molprobity     1  True   
1913  1913  mt        -58.4   -34.8  Favored  11   8  0.37  11  0.18  molprobity     1  True   
1914  1914  t         -62.9   -43.6  Favored   9   7  0.36  10  0.43  molprobity     1  True   
1915  1915  pt-20     -82.5   -31.0  Favored   6   9  0.45  12  0.45  molprobity     1  True   
1916  1916  p         -89.8   -41.2  Favored   7   7  0.55  10  0.65  molprobity     1  True   
1917  1917  m-20     -124.7    68.3  Favored   4   8  0.49  12  0.48  molprobity     1  True   
1918  1918  Cg_exo    -65.6   -16.6  Favored   7   8  0.46  11  0.36  molprobity     1  True   
1919  1919  m-20      -88.1   -15.3  Favored   4   8  0.30  11  0.40  molprobity     1  True   
1920  1920  t80       -80.8    93.2  Favored   9  13  0.39  18  0.29  molprobity     1  True   
1921  1921  t         -60.2   -38.5  Favored   9   7  0.47  10  0.46  molprobity     1  True   
1922  1922  ?         -48.3   -33.7  Favored   3   4  0.65   5  0.19  molprobity     1  True   
1923  1923  m         -57.3   -56.8  Favored   7   7  0.41  10  0.62  molprobity     1  True   
1924  1924  m-85      -54.0   -46.7  Favored   9  13  0.34  18  0.28  molprobity     1  True   
1925  1925  t80       -58.9   -57.7  Favored   9  13  0.36  18  0.20  molprobity     1  True   
1926  1926  m-70      -70.4   -30.2  Favored   7  11  0.30  15  0.23  molprobity     1  True   
1927  1927  tp        -62.3   -45.6  Favored  11   8  0.44  11  0.29  molprobity     1  True   
1928  1928  ?         -60.8   -44.6  Favored   3   4  0.43   5  0.18  molprobity     1  True   
1929  1929  mmmp?     -58.4   -37.4  Favored  13   9  0.43  11  0.48  molprobity     1  True   
1930  1930  tp        -65.9   -41.1  Favored  11   8  0.40  11  0.19  molprobity     1  True   
1931  1931  m-85      -57.0   -48.9  Favored   9  13  0.35  18  0.29  molprobity     1  True   
1932  1932  mt-10     -54.8   -40.7  Favored   6   9  0.36  12  0.49  molprobity     1  True   
1933  1933  ttt180    -61.2   -37.0  Favored  13  11  1.19  14  0.74  molprobity     1  True   
1934  1934  mt        -93.1    14.9  Favored  11   8  0.40  11  0.27  molprobity     1  True   
1935  1935  t70        66.0    12.3  Favored   4   8  0.46  11  0.42  molprobity     1  True   
1936  1936  mmm180    -82.7    63.9  Favored  13  11  1.25  14  0.69  molprobity     1  True   
1937  1937  m         -54.8   -51.4  Favored   7   7  0.50  10  0.48  molprobity     1  True   
1938  1938  t70       -63.5   -47.0  Favored   4   8  0.32  11  0.36  molprobity     1  True   
1939  1939  m-20      -55.3   -38.9  Favored   4   8  0.31  11  0.45  molprobity     1  True   
1940  1940  ?         -60.6   -49.5  Favored   5   5  0.27   7  0.27  molprobity     1  True   
1941  1941  mt        -56.5   -49.2  Favored  11   8  0.31  11  0.38  molprobity     1  True   
1942  1942  t70       -56.7   -46.0  Favored   4   8  0.33  11  0.39  molprobity     1  True   
1943  1943  m         -56.9   -47.5  Favored   7   7  0.42  10  0.41  molprobity     1  True   
1944  1944  m-85      -61.6   -43.1  Favored   9  13  0.35  18  0.28  molprobity     1  True   
1945  1945  ?         -55.2   -55.6  Favored   5   5  0.37   7  0.23  molprobity     1  True   
1946  1946  OUTLIER   -62.0   -36.8  Favored   8   9  0.51  12  0.48  molprobity     1  True   
1947  1947  ?         -62.4   -34.3  Favored   3   4  0.48   5  0.14  molprobity     1  True   
1948  1948  mt        -57.2   -42.7  Favored  11   8  0.35  11  0.38  molprobity     1  True   
1949  1949  mt-10     -65.5   -48.9  Favored   6   9  0.33  12  0.34  molprobity     1  True   
1950  1950  m         -69.5   -31.0  Favored   9   7  0.38  10  0.35  molprobity     1  True   
1951  1951  ?         -66.5   -50.1  Favored   5   5  0.32   7  0.26  molprobity     1  True   
1952  1952  ptm180    -64.6   -40.5  Favored  13  11  1.22  14  0.47  molprobity     1  True   
1953  1953  mt-10     -87.3   -51.7  Favored   6   9  0.39  12  0.35  molprobity     1  True   
1954  1954  mm-40     -75.9   -47.1  Favored   6   9  0.39  12  0.36  molprobity     1  True   
1955  1955  ?         -92.1  -109.2  Allowed   3   4  0.45   5  0.12  molprobity     1  True   
1956  1956  t        -165.4   173.2  Favored   7   7  0.50  10  0.47  molprobity     1  True   
1957  1957  tt0       -60.6   -25.4  Favored   8   9  0.43  12  0.26  molprobity     1  True   
1958  1958  ttpt      -59.1   -50.6  Favored  13   9  0.38  11  0.25  molprobity     1  True   
1959  1959  m-20      -68.1   -40.9  Favored   4   8  0.23  11  0.47  molprobity     1  True   
1960  1960  tp        -53.1   -43.5  Favored  11   8  0.36  11  0.31  molprobity     1  True   
1961  1961  t         -64.6   -46.5  Favored   5   6  0.47   8  0.26  molprobity     1  True   
1962  1962  mm-40     -56.2   -47.1  Favored   6   9  0.39  12  0.43  molprobity     1  True   
1963  1963  mt        -70.2   -43.7  Favored  11   8  0.37  11  0.26  molprobity     1  True   
1964  1964  mt-30     -59.3   -49.7  Favored   8   9  0.35  12  0.31  molprobity     1  True   
1965  1965  t70       -57.3   -38.3  Favored   4   8  0.29  11  0.48  molprobity     1  True   
1966  1966  ?         -63.2   -46.8  Favored   5   5  0.33   7  0.27  molprobity     1  True   
1967  1967  ptmt      -74.9   -34.8  Favored  13   9  0.42  11  0.31  molprobity     1  True   
1968  1968  tp        -55.0   -51.4  Favored  11   8  0.40  11  0.21  molprobity     1  True   
1969  1969  pttp      -59.7   -32.9  Favored  13   9  0.33  11  0.14  molprobity     1  True   
1970  1970  ?         -65.5   -42.1  Favored   5   5  0.42   7  0.34  molprobity     1  True   
1971  1971  mm-40     -62.4   -42.1  Favored   6   9  0.35  12  0.39  molprobity     1  True   
1972  1972  ?         -83.0     2.4  Favored   3   4  0.63   5  0.39  molprobity     1  True   
1973  1973  mt        -60.0   -65.8  Allowed  11   8  0.49  11  0.25  molprobity     1  True   
1974  1974  pt-20    -153.1  -172.0  Favored   6   9  0.31  12  0.36  molprobity     ?  False  
1975  1975  m80       -67.7   112.7  Favored   7  11  0.27  15  0.24  molprobity     ?  False  
1976  1976  m-70      -75.9   -34.2  Favored   7  11  0.28  15  0.27  molprobity     ?  False  
1977  1977  m80       -83.2   107.8  Favored   7  11  0.22  15  0.21  molprobity     ?  False  
1978  1978  m80       -80.8     5.6  Favored   7  11  0.31  15  0.33  molprobity     ?  False  
1979  1979  p-80     -148.6   171.4  Favored   7  11  0.27  15  0.33  molprobity     ?  False  
1980  1980  m-70          ?       ?  ?         7  11  0.58  12  0.25  molprobity     ?  False  
#
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     9  HG3    1  0.41  1.92  
  2    32  HD21   1  0.41  1.92  
  3    44  O      2  0.45  2.12  
  4    48  HG2    2  0.45  2.12  
  5    48  HD2    3  0.40  2.16  
  6    63  OH     3  0.40  2.16  
  7   104  O      4  0.40  2.16  
  8   108  HG2    4  0.40  2.16  
  9   139  HG11   5  0.40  1.93  
 10   143  O      6  0.42  2.15  
 11   147  HG2    6  0.42  2.15  
 12   166  HG23   7  0.41  2.46  
 13   175  OE1    8  0.41  2.14  
 14   177  HB3    5  0.40  1.93  
 15   178  HD23   8  0.41  2.14  
 16   178  CD1    7  0.41  2.46  
 17   265  O      9  0.41  2.15  
 18   269  HB3   10  0.41  1.92  
 19   269  HG2    9  0.41  2.15  
 20   277  HD22  10  0.41  1.92  
 21   286  O     11  0.45  2.12  
 22   290  HG    11  0.45  2.12  
 23   325  O     12  0.49  2.08  
 24   329  HG    12  0.49  2.08  
 25   337  HG11  13  0.43  1.89  
 26   341  O     14  0.44  2.12  
 27   345  HG2   14  0.44  2.12  
 28   345  HD2   15  0.41  2.16  
 29   360  OH    15  0.41  2.16  
 30   368  HB3   16  0.41  1.90  
 31   374  O     17  0.44  2.11  
 32   375  HB3   13  0.43  1.89  
 33   376  HD13  16  0.41  1.90  
 34   378  HG2   17  0.44  2.11  
 35   401  O     18  0.44  2.13  
 36   405  NH2   19  0.47  2.24  
 37   405  HG2   18  0.44  2.13  
 38   412  HB3   20  0.41  1.93  
 39   417  HB2   20  0.41  1.93  
 40   417  HB3   21  0.40  1.92  
 41   420  HB2   21  0.40  1.92  
 42   424  O     22  0.45  2.10  
 43   427  HG3   19  0.47  2.24  
 44   428  HG    22  0.45  2.10  
 45   459  O     23  0.42  2.15  
 46   463  HG13  23  0.42  2.15  
 47   539  O     24  0.44  2.12  
 48   543  HG2   24  0.44  2.12  
 49   563  O     25  0.42  2.15  
 50   567  HG2   25  0.42  2.15  
 51   603  NH2   26  0.44  2.27  
 52   625  HG2   26  0.44  2.27  
 53   721  O     27  0.43  2.14  
 54   725  HG    27  0.43  2.14  
 55   737  O     28  0.41  2.15  
 56   741  HG2   28  0.41  2.15  
 57   760  O     29  0.41  2.16  
 58   764  HG2   29  0.41  2.16  
 59   794  HB3   30  0.41  1.91  
 60   795  HD2   30  0.41  1.91  
 61   836  O     31  0.43  2.12  
 62   840  HG2   31  0.43  2.12  
 63   855  O     32  0.42  2.14  
 64   859  HG13  32  0.42  2.14  
 65   863  HB3   33  0.40  1.92  
 66   869  O     34  0.44  2.13  
 67   871  HD13  33  0.40  1.92  
 68   873  HG2   34  0.44  2.13  
 69   894  O     35  0.42  2.15  
 70   900  HB3   35  0.42  2.15  
 71   979  HG3   36  0.47  2.24  
 72   979  O     37  0.41  2.16  
 73   980  N     36  0.47  2.24  
 74   983  HG    37  0.41  2.16  
 75   995  O     38  0.41  2.15  
 76   999  HG2   38  0.41  2.15  
 77  1034  O     39  0.40  2.16  
 78  1038  HG2   39  0.40  2.16  
 79  1078  HG3   40  0.41  2.30  
 80  1079  N     40  0.41  2.30  
 81  1146  HB2   41  0.47  1.87  
 82  1187  HB3   41  0.47  1.87  
 83  1232  O     42  0.47  2.10  
 84  1236  HG2   42  0.47  2.10  
 85  1265  O     43  0.43  2.13  
 86  1269  HG2   43  0.43  2.13  
 87  1276  O     44  0.45  2.11  
 88  1280  HG    44  0.45  2.11  
 89  1285  O     45  0.45  2.11  
 90  1286  HB3   45  0.45  2.11  
 91  1289  HB2   46  0.40  1.93  
 92  1290  HD2   46  0.40  1.93  
 93  1296  HG3   47  0.42  1.91  
 94  1308  HB3   48  0.41  1.92  
 95  1311  HB2   48  0.41  1.92  
 96  1319  HD21  47  0.42  1.91  
 97  1331  O     49  0.43  2.14  
 98  1335  HG2   49  0.43  2.14  
 99  1350  O     50  0.40  2.16  
100  1354  HG13  50  0.40  2.16  
101  1382  HB3   51  0.45  2.12  
102  1384  O     51  0.45  2.12  
103  1395  HH21  52  0.41  2.19  
104  1407  HB3   53  0.44  1.90  
105  1410  HB2   53  0.44  1.90  
106  1417  CD    52  0.41  2.19  
107  1430  O     54  0.44  2.13  
108  1434  HG2   54  0.44  2.13  
109  1506  HB3   55  0.42  1.90  
110  1509  HB2   55  0.42  1.90  
111  1513  O     56  0.41  2.16  
112  1517  HG    56  0.41  2.16  
113  1529  O     57  0.45  2.12  
114  1533  HG2   57  0.45  2.12  
115  1593  NH2   58  0.56  2.15  
116  1615  HG3   58  0.56  2.15  
117  1651  HD13  59  0.41  2.16  
118  1667  OE1   59  0.41  2.16  
119  1704  HB3   60  0.47  1.87  
120  1707  HB2   60  0.47  1.87  
121  1714  O     61  0.40  2.16  
122  1717  HG2   61  0.40  2.16  
123  1727  O     62  0.40  2.16  
124  1731  HG2   62  0.40  2.16  
125  1785  O     63  0.45  2.12  
126  1791  HB3   63  0.45  2.12  
127  1826  O     64  0.45  2.11  
128  1830  HG2   64  0.45  2.11  
129  1877  O     65  0.57  2.38  
130  1879  N     65  0.57  2.38  
131  1897  HB3   66  0.41  1.92  
132  1902  HB2   66  0.41  1.92  
133  1909  O     67  0.42  2.14  
134  1913  HG    67  0.42  2.14  
135  1925  O     68  0.42  2.14  
136  1929  HG2   68  0.42  2.14  
137  1960  HG    69  0.45  2.26  
138  1964  NE2   69  0.45  2.26  
139  1966  HA    70  0.41  1.92  
140  1969  HE3   70  0.41  1.92  
#
loop_
_pdbx_vrpt_model_list.PDB_model_num
_pdbx_vrpt_model_list.nmrclust_cluster_id
_pdbx_vrpt_model_list.nmrclust_representative
 1  2        True  
 2  1        ?     
 3  2        ?     
 4  outlier  ?     
 5  1        True  
 6  1        ?     
 7  1        ?     
 8  1        ?     
 9  1        ?     
10  2        ?     
11  2        ?     
12  1        ?     
13  3        ?     
14  3        True  
15  1        ?     
16  1        ?     
17  outlier  ?     
18  3        ?     
19  outlier  ?     
20  1        ?     
#
_pdbx_vrpt_cyrange_domain.ordinal             1
_pdbx_vrpt_cyrange_domain.domain              1
_pdbx_vrpt_cyrange_domain.number_of_gaps      0
_pdbx_vrpt_cyrange_domain.number_of_residues  91
_pdbx_vrpt_cyrange_domain.percentage_of_core  100.00
_pdbx_vrpt_cyrange_domain.rmsd                0.460
_pdbx_vrpt_cyrange_domain.medoid_model        12
_pdbx_vrpt_cyrange_domain.medoid_rmsd         0.594
_pdbx_vrpt_cyrange_domain.residue_string      A:2-A:92
#
_pdbx_vrpt_chemical_shift_list.ordinal                           1
_pdbx_vrpt_chemical_shift_list.file_id                           3
_pdbx_vrpt_chemical_shift_list.file_name                         working_cs.cif
_pdbx_vrpt_chemical_shift_list.block_name                        assigned_chem_shift_list_1
_pdbx_vrpt_chemical_shift_list.list_id                           1
_pdbx_vrpt_chemical_shift_list.type                              full
_pdbx_vrpt_chemical_shift_list.number_of_errors_while_mapping    0
_pdbx_vrpt_chemical_shift_list.number_of_warnings_while_mapping  0
_pdbx_vrpt_chemical_shift_list.number_of_mapped_shifts           1064
_pdbx_vrpt_chemical_shift_list.number_of_parsed_shifts           1064
_pdbx_vrpt_chemical_shift_list.total_number_of_shifts            1064
_pdbx_vrpt_chemical_shift_list.number_of_unparsed_shifts         0
#
loop_
_pdbx_vrpt_random_coil_index.ordinal
_pdbx_vrpt_random_coil_index.auth_asym_id
_pdbx_vrpt_random_coil_index.rescode
_pdbx_vrpt_random_coil_index.auth_seq_id
_pdbx_vrpt_random_coil_index.value
 1  A  GLU   1  0.169  
 2  A  ASP   2  0.159  
 3  A  PRO   3  0.131  
 4  A  GLU   4  0.096  
 5  A  ASP   5  0.058  
 6  A  PRO   6  0.031  
 7  A  PHE   7  0.020  
 8  A  THR   8  0.016  
 9  A  ARG   9  0.016  
10  A  TYR  10  0.018  
11  A  ALA  11  0.019  
12  A  LEU  12  0.020  
13  A  ALA  13  0.019  
14  A  GLN  14  0.019  
15  A  GLU  15  0.018  
16  A  HIS  16  0.020  
17  A  LEU  17  0.026  
18  A  LYS  18  0.030  
19  A  HIS  19  0.031  
20  A  ASP  20  0.026  
21  A  ASN  21  0.022  
22  A  ALA  22  0.021  
23  A  SER  23  0.021  
24  A  ARG  24  0.021  
25  A  ALA  25  0.018  
26  A  LEU  26  0.019  
27  A  ALA  27  0.026  
28  A  LEU  28  0.029  
29  A  PHE  29  0.031  
30  A  GLU  30  0.025  
31  A  GLU  31  0.023  
32  A  LEU  32  0.021  
33  A  VAL  33  0.020  
34  A  GLU  34  0.021  
35  A  THR  35  0.026  
36  A  ASP  36  0.033  
37  A  PRO  37  0.052  
38  A  ASP  38  0.056  
39  A  TYR  39  0.054  
40  A  VAL  40  0.033  
41  A  GLY  41  0.021  
42  A  THR  42  0.012  
43  A  TYR  43  0.009  
44  A  TYR  44  0.010  
45  A  HIS  45  0.012  
46  A  LEU  46  0.017  
47  A  GLY  47  0.022  
48  A  LYS  48  0.029  
49  A  LEU  49  0.029  
50  A  TYR  50  0.027  
51  A  GLU  51  0.022  
52  A  ARG  52  0.026  
53  A  LEU  53  0.028  
54  A  ASP  54  0.026  
55  A  ARG  55  0.018  
56  A  THR  56  0.012  
57  A  ASP  57  0.012  
58  A  ASP  58  0.013  
59  A  ALA  59  0.014  
60  A  ILE  60  0.012  
61  A  ASP  61  0.013  
62  A  THR  62  0.015  
63  A  TYR  63  0.022  
64  A  ALA  64  0.025  
65  A  GLN  65  0.025  
66  A  GLY  66  0.019  
67  A  ILE  67  0.015  
68  A  GLU  68  0.015  
69  A  VAL  69  0.016  
70  A  ALA  70  0.019  
71  A  ARG  71  0.024  
72  A  GLU  72  0.036  
73  A  GLU  73  0.044  
74  A  GLY  74  0.044  
75  A  THR  75  0.034  
76  A  GLN  76  0.024  
77  A  LYS  77  0.019  
78  A  ASP  78  0.016  
79  A  LEU  79  0.017  
80  A  SER  80  0.019  
81  A  GLU  81  0.021  
82  A  LEU  82  0.020  
83  A  GLN  83  0.018  
84  A  ASP  84  0.017  
85  A  ALA  85  0.018  
86  A  LYS  86  0.019  
87  A  LEU  87  0.023  
88  A  LYS  88  0.025  
89  A  ALA  89  0.031  
90  A  GLU  90  0.043  
91  A  GLY  91  0.070  
92  A  LEU  92  0.100  
93  A  GLU  93  0.109  
94  A  HIS  98  0.210  
95  A  HIS  99  0.243  
#
_pdbx_vrpt_chemical_shift_outlier.ordinal        1
_pdbx_vrpt_chemical_shift_outlier.auth_asym_id   A
_pdbx_vrpt_chemical_shift_outlier.rescode        THR
_pdbx_vrpt_chemical_shift_outlier.auth_seq_id    42
_pdbx_vrpt_chemical_shift_outlier.label_atom_id  HG1
_pdbx_vrpt_chemical_shift_outlier.value          5.58
_pdbx_vrpt_chemical_shift_outlier.zscore         21.050
_pdbx_vrpt_chemical_shift_outlier.prediction     0.08~2.19
_pdbx_vrpt_chemical_shift_outlier.method         BMRB-Statistics
#
loop_
_pdbx_vrpt_referencing_offset.ordinal
_pdbx_vrpt_referencing_offset.label_atom_id
_pdbx_vrpt_referencing_offset.uncertainty
_pdbx_vrpt_referencing_offset.precision
_pdbx_vrpt_referencing_offset.value
_pdbx_vrpt_referencing_offset.number_of_measurements
1  C   0.50  0.00   0.00   0  
2  CA  0.50  0.14  -0.25  95  
3  CB  0.50  0.07   0.42  90  
4  N   0.50  0.23   0.41  91  
#
loop_
_pdbx_vrpt_assign_completeness_well_defined.ordinal
_pdbx_vrpt_assign_completeness_well_defined.number_of_assigned_shifts
_pdbx_vrpt_assign_completeness_well_defined.number_of_unassigned_shifts
_pdbx_vrpt_assign_completeness_well_defined.number_of_shifts
_pdbx_vrpt_assign_completeness_well_defined.type
_pdbx_vrpt_assign_completeness_well_defined.element
 1     0   15    15  stereomethyl  stereomethyl  
 2  1031  198  1229  overall       Total         
 3   363   91   454  backbone      Total         
 4   606   71   677  sidechain     Total         
 5    62   36    98  aromatic      Total         
 6   635   29   664  overall       H             
 7   184    0   184  backbone      H             
 8   412   22   434  sidechain     H             
 9    39    7    46  aromatic      H             
10   300  146   446  overall       C             
11    91   91   182  backbone      C             
12   186   32   218  sidechain     C             
13    23   23    46  aromatic      C             
14    96   23   119  overall       N             
15    88    0    88  backbone      N             
16     8   17    25  sidechain     N             
17     0    6     6  aromatic      N             
#
loop_
_pdbx_vrpt_assign_completeness_full_length.ordinal
_pdbx_vrpt_assign_completeness_full_length.number_of_assigned_shifts
_pdbx_vrpt_assign_completeness_full_length.number_of_unassigned_shifts
_pdbx_vrpt_assign_completeness_full_length.number_of_shifts
_pdbx_vrpt_assign_completeness_full_length.type
_pdbx_vrpt_assign_completeness_full_length.element
 1     0   15    15  stereomethyl  stereomethyl  
 2  1063  286  1349  overall       Total         
 3   377  117   494  backbone      Total         
 4   624   85   709  sidechain     Total         
 5    62   84   146  aromatic      Total         
 6   654   70   724  overall       H             
 7   191    9   200  backbone      H             
 8   424   30   454  sidechain     H             
 9    39   31    70  aromatic      H             
10   310  176   486  overall       C             
11    95  103   198  backbone      C             
12   192   38   230  sidechain     C             
13    23   35    58  aromatic      C             
14    99   40   139  overall       N             
15    91    5    96  backbone      N             
16     8   17    25  sidechain     N             
17     0   18    18  aromatic      N             
#
loop_
_pdbx_vrpt_restraint_summary.ordinal
_pdbx_vrpt_restraint_summary.description
_pdbx_vrpt_restraint_summary.value
 1  "Total distance restraints"                    3190  
 2  "Intra-residue (|i-j|=0)"                       616  
 3  "Sequential (|i-j|=1)"                          738  
 4  "Medium range (|i-j|>1 and |i-j|<5)"           1007  
 5  "Long range (|i-j|>=5)"                         747  
 6  Inter-chain                                       0  
 7  "Total hydrogen bond restraints"                 82  
 8  "Total disulfide bond restraints"                 0  
 9  "Total dihedral-angle restraints"               143  
10  "Number of unmapped restraints"                   0  
11  "Number of restraints per residue"             33.7  
12  "Number of long range restraints per residue"   7.5  
#
loop_
_pdbx_vrpt_distance_violation_summary.ordinal
_pdbx_vrpt_distance_violation_summary.restraint_type
_pdbx_vrpt_distance_violation_summary.restraint_sub_type
_pdbx_vrpt_distance_violation_summary.restraints_count
_pdbx_vrpt_distance_violation_summary.percent_total
_pdbx_vrpt_distance_violation_summary.consistently_violated_count
_pdbx_vrpt_distance_violation_summary.consistently_violated_percent_total
_pdbx_vrpt_distance_violation_summary.consistently_violated_percent_type
_pdbx_vrpt_distance_violation_summary.violated_count
_pdbx_vrpt_distance_violation_summary.violated_percent_total
_pdbx_vrpt_distance_violation_summary.violated_percent_type
 1  Intra-residue  all                  616   19.3  0  0.0  0.0  0  0.0  0.0  
 2  Intra-residue  BackboneBackbone       7    0.2  0  0.0  0.0  0  0.0  0.0  
 3  Intra-residue  BackboneSidechain    462   14.5  0  0.0  0.0  0  0.0  0.0  
 4  Intra-residue  SidechainSidechain   147    4.6  0  0.0  0.0  0  0.0  0.0  
 5  Sequential     all                  738   23.1  0  0.0  0.0  0  0.0  0.0  
 6  Sequential     BackboneBackbone     140    4.4  0  0.0  0.0  0  0.0  0.0  
 7  Sequential     BackboneSidechain    498   15.6  0  0.0  0.0  0  0.0  0.0  
 8  Sequential     SidechainSidechain   100    3.1  0  0.0  0.0  0  0.0  0.0  
 9  MediumRange    all                 1007   31.6  0  0.0  0.0  3  0.1  0.3  
10  MediumRange    BackboneBackbone     297    9.3  0  0.0  0.0  0  0.0  0.0  
11  MediumRange    BackboneSidechain    451   14.1  0  0.0  0.0  1  0.0  0.2  
12  MediumRange    SidechainSidechain   259    8.1  0  0.0  0.0  2  0.1  0.8  
13  LongRange      all                  747   23.4  0  0.0  0.0  2  0.1  0.3  
14  LongRange      BackboneBackbone      24    0.8  0  0.0  0.0  0  0.0  0.0  
15  LongRange      BackboneSidechain    331   10.4  0  0.0  0.0  1  0.0  0.3  
16  LongRange      SidechainSidechain   392   12.3  0  0.0  0.0  1  0.0  0.3  
17  InterChain     all                    0    0.0  0  0.0  0.0  0  0.0  0.0  
18  InterChain     BackboneBackbone       0    0.0  0  0.0  0.0  0  0.0  0.0  
19  InterChain     BackboneSidechain      0    0.0  0  0.0  0.0  0  0.0  0.0  
20  InterChain     SidechainSidechain     0    0.0  0  0.0  0.0  0  0.0  0.0  
21  HydrogenBond   all                   82    2.6  0  0.0  0.0  2  0.1  2.4  
22  DisulfideBond  all                    0    0.0  0  0.0  0.0  0  0.0  0.0  
23  Total          all                 3190  100.0  0  0.0  0.0  5  0.2  0.2  
24  Total          BackboneBackbone     468   14.7  0  0.0  0.0  0  0.0  0.0  
25  Total          BackboneSidechain   1742   54.6  0  0.0  0.0  2  0.1  0.1  
26  Total          SidechainSidechain   898   28.2  0  0.0  0.0  3  0.1  0.3  
#
loop_
_pdbx_vrpt_distance_violation_model_summary.ordinal
_pdbx_vrpt_distance_violation_model_summary.PDB_model_num
_pdbx_vrpt_distance_violation_model_summary.max_violation
_pdbx_vrpt_distance_violation_model_summary.mean_violation
_pdbx_vrpt_distance_violation_model_summary.median_violation
_pdbx_vrpt_distance_violation_model_summary.standard_deviation
 1   1  0.00  0.00  0.00  0.00  
 2   2  0.11  0.11  0.11  0.00  
 3   3  0.13  0.13  0.13  0.00  
 4   4  0.14  0.14  0.14  0.00  
 5   5  0.00  0.00  0.00  0.00  
 6   6  0.00  0.00  0.00  0.00  
 7   7  0.13  0.13  0.13  0.00  
 8   8  0.00  0.00  0.00  0.00  
 9   9  0.00  0.00  0.00  0.00  
10  10  0.00  0.00  0.00  0.00  
11  11  0.00  0.00  0.00  0.00  
12  12  0.00  0.00  0.00  0.00  
13  13  0.00  0.00  0.00  0.00  
14  14  0.00  0.00  0.00  0.00  
15  15  0.00  0.00  0.00  0.00  
16  16  0.13  0.13  0.13  0.00  
17  17  0.12  0.12  0.12  0.00  
18  18  0.12  0.12  0.12  0.00  
19  19  0.00  0.00  0.00  0.00  
20  20  0.00  0.00  0.00  0.00  
#
loop_
_pdbx_vrpt_distance_violation_model_restraints.ordinal
_pdbx_vrpt_distance_violation_model_restraints.PDB_model_num
_pdbx_vrpt_distance_violation_model_restraints.dist_rest_type
_pdbx_vrpt_distance_violation_model_restraints.violations_count
  1   1  intraresidue  0  
  2   1  sequential    0  
  3   1  medium        0  
  4   1  long          0  
  5   1  interchain    0  
  6   1  total         0  
  7   2  intraresidue  0  
  8   2  sequential    0  
  9   2  medium        0  
 10   2  long          1  
 11   2  interchain    0  
 12   2  total         1  
 13   3  intraresidue  0  
 14   3  sequential    0  
 15   3  medium        1  
 16   3  long          0  
 17   3  interchain    0  
 18   3  total         1  
 19   4  intraresidue  0  
 20   4  sequential    0  
 21   4  medium        1  
 22   4  long          0  
 23   4  interchain    0  
 24   4  total         1  
 25   5  intraresidue  0  
 26   5  sequential    0  
 27   5  medium        0  
 28   5  long          0  
 29   5  interchain    0  
 30   5  total         0  
 31   6  intraresidue  0  
 32   6  sequential    0  
 33   6  medium        0  
 34   6  long          0  
 35   6  interchain    0  
 36   6  total         0  
 37   7  intraresidue  0  
 38   7  sequential    0  
 39   7  medium        0  
 40   7  long          1  
 41   7  interchain    0  
 42   7  total         1  
 43   8  intraresidue  0  
 44   8  sequential    0  
 45   8  medium        0  
 46   8  long          0  
 47   8  interchain    0  
 48   8  total         0  
 49   9  intraresidue  0  
 50   9  sequential    0  
 51   9  medium        0  
 52   9  long          0  
 53   9  interchain    0  
 54   9  total         0  
 55  10  intraresidue  0  
 56  10  sequential    0  
 57  10  medium        0  
 58  10  long          0  
 59  10  interchain    0  
 60  10  total         0  
 61  11  intraresidue  0  
 62  11  sequential    0  
 63  11  medium        0  
 64  11  long          0  
 65  11  interchain    0  
 66  11  total         0  
 67  12  intraresidue  0  
 68  12  sequential    0  
 69  12  medium        0  
 70  12  long          0  
 71  12  interchain    0  
 72  12  total         0  
 73  13  intraresidue  0  
 74  13  sequential    0  
 75  13  medium        0  
 76  13  long          0  
 77  13  interchain    0  
 78  13  total         0  
 79  14  intraresidue  0  
 80  14  sequential    0  
 81  14  medium        0  
 82  14  long          0  
 83  14  interchain    0  
 84  14  total         0  
 85  15  intraresidue  0  
 86  15  sequential    0  
 87  15  medium        0  
 88  15  long          0  
 89  15  interchain    0  
 90  15  total         0  
 91  16  intraresidue  0  
 92  16  sequential    0  
 93  16  medium        1  
 94  16  long          0  
 95  16  interchain    0  
 96  16  total         1  
 97  17  intraresidue  0  
 98  17  sequential    0  
 99  17  medium        1  
100  17  long          0  
101  17  interchain    0  
102  17  total         1  
103  18  intraresidue  0  
104  18  sequential    0  
105  18  medium        1  
106  18  long          0  
107  18  interchain    0  
108  18  total         1  
109  19  intraresidue  0  
110  19  sequential    0  
111  19  medium        0  
112  19  long          0  
113  19  interchain    0  
114  19  total         0  
115  20  intraresidue  0  
116  20  sequential    0  
117  20  medium        0  
118  20  long          0  
119  20  interchain    0  
120  20  total         0  
#
loop_
_pdbx_vrpt_distance_violations_ensemble_summary.id
_pdbx_vrpt_distance_violations_ensemble_summary.fraction_of_ensemble_count
_pdbx_vrpt_distance_violations_ensemble_summary.fraction_of_ensemble_percent
 1   1    5.0  
 2   2   10.0  
 3   3   15.0  
 4   4   20.0  
 5   5   25.0  
 6   6   30.0  
 7   7   35.0  
 8   8   40.0  
 9   9   45.0  
10  10   50.0  
11  11   55.0  
12  12   60.0  
13  13   65.0  
14  14   70.0  
15  15   75.0  
16  16   80.0  
17  17   85.0  
18  18   90.0  
19  19   95.0  
20  20  100.0  
#
loop_
_pdbx_vrpt_distance_violation_ensemble.ordinal
_pdbx_vrpt_distance_violation_ensemble.ensemble_distance_count
_pdbx_vrpt_distance_violation_ensemble.dist_rest_type
_pdbx_vrpt_distance_violation_ensemble.violations_count
  1   1  intraresidue  0  
  2   1  sequential    0  
  3   1  medium        3  
  4   1  long          2  
  5   1  interchain    0  
  6   1  total         5  
  7   2  intraresidue  0  
  8   2  sequential    0  
  9   2  medium        0  
 10   2  long          0  
 11   2  interchain    0  
 12   2  total         0  
 13   3  intraresidue  0  
 14   3  sequential    0  
 15   3  medium        0  
 16   3  long          0  
 17   3  interchain    0  
 18   3  total         0  
 19   4  intraresidue  0  
 20   4  sequential    0  
 21   4  medium        0  
 22   4  long          0  
 23   4  interchain    0  
 24   4  total         0  
 25   5  intraresidue  0  
 26   5  sequential    0  
 27   5  medium        0  
 28   5  long          0  
 29   5  interchain    0  
 30   5  total         0  
 31   6  intraresidue  0  
 32   6  sequential    0  
 33   6  medium        0  
 34   6  long          0  
 35   6  interchain    0  
 36   6  total         0  
 37   7  intraresidue  0  
 38   7  sequential    0  
 39   7  medium        0  
 40   7  long          0  
 41   7  interchain    0  
 42   7  total         0  
 43   8  intraresidue  0  
 44   8  sequential    0  
 45   8  medium        0  
 46   8  long          0  
 47   8  interchain    0  
 48   8  total         0  
 49   9  intraresidue  0  
 50   9  sequential    0  
 51   9  medium        0  
 52   9  long          0  
 53   9  interchain    0  
 54   9  total         0  
 55  10  intraresidue  0  
 56  10  sequential    0  
 57  10  medium        0  
 58  10  long          0  
 59  10  interchain    0  
 60  10  total         0  
 61  11  intraresidue  0  
 62  11  sequential    0  
 63  11  medium        0  
 64  11  long          0  
 65  11  interchain    0  
 66  11  total         0  
 67  12  intraresidue  0  
 68  12  sequential    0  
 69  12  medium        0  
 70  12  long          0  
 71  12  interchain    0  
 72  12  total         0  
 73  13  intraresidue  0  
 74  13  sequential    0  
 75  13  medium        0  
 76  13  long          0  
 77  13  interchain    0  
 78  13  total         0  
 79  14  intraresidue  0  
 80  14  sequential    0  
 81  14  medium        0  
 82  14  long          0  
 83  14  interchain    0  
 84  14  total         0  
 85  15  intraresidue  0  
 86  15  sequential    0  
 87  15  medium        0  
 88  15  long          0  
 89  15  interchain    0  
 90  15  total         0  
 91  16  intraresidue  0  
 92  16  sequential    0  
 93  16  medium        0  
 94  16  long          0  
 95  16  interchain    0  
 96  16  total         0  
 97  17  intraresidue  0  
 98  17  sequential    0  
 99  17  medium        0  
100  17  long          0  
101  17  interchain    0  
102  17  total         0  
103  18  intraresidue  0  
104  18  sequential    0  
105  18  medium        0  
106  18  long          0  
107  18  interchain    0  
108  18  total         0  
109  19  intraresidue  0  
110  19  sequential    0  
111  19  medium        0  
112  19  long          0  
113  19  interchain    0  
114  19  total         0  
115  20  intraresidue  0  
116  20  sequential    0  
117  20  medium        0  
118  20  long          0  
119  20  interchain    0  
120  20  total         0  
#
loop_
_pdbx_vrpt_residual_distance_violations.ordinal
_pdbx_vrpt_residual_distance_violations.bins
_pdbx_vrpt_residual_distance_violations.max_violation
_pdbx_vrpt_residual_distance_violations.violations_per_model
1  0.1-0.2  0.1   0.3   
2  0.2-0.5  None  None  
3  >0.5     None  None  
#
loop_
_pdbx_vrpt_violated_distance_restraints.ordinal
_pdbx_vrpt_violated_distance_restraints.rest_id
_pdbx_vrpt_violated_distance_restraints.rlist_id
_pdbx_vrpt_violated_distance_restraints.instance_id_1
_pdbx_vrpt_violated_distance_restraints.instance_id_2
_pdbx_vrpt_violated_distance_restraints.atom_1
_pdbx_vrpt_violated_distance_restraints.atom_2
_pdbx_vrpt_violated_distance_restraints.violation
 1  1042  1   303   305  HG2   H     0.14  
 2    65  2  1553  1557  O     H     0.13  
 3    61  2   263   267  O     H     0.13  
 4  2816  1   603   633  HE    HD1   0.13  
 5  2816  1   603   633  HE    HD2   0.13  
 6   952  1  1649  1653  HE22  HG21  0.12  
 7   952  1  1649  1653  HE22  HG22  0.12  
 8   952  1  1649  1653  HE22  HG23  0.12  
 9  1808  1  1704  1707  HB3   HB2   0.12  
10  1161  1   170   175  HE    HA    0.11  
#
loop_
_pdbx_vrpt_dihedralangle_violations_summary.ordinal
_pdbx_vrpt_dihedralangle_violations_summary.restraint_type
_pdbx_vrpt_dihedralangle_violations_summary.restraints_count
_pdbx_vrpt_dihedralangle_violations_summary.percent_total
_pdbx_vrpt_dihedralangle_violations_summary.consistently_violated_count
_pdbx_vrpt_dihedralangle_violations_summary.consistently_violated_percent_total
_pdbx_vrpt_dihedralangle_violations_summary.consistently_violated_percent_type
_pdbx_vrpt_dihedralangle_violations_summary.violated_count
_pdbx_vrpt_dihedralangle_violations_summary.violated_percent_total
_pdbx_vrpt_dihedralangle_violations_summary.violated_percent_type
1  PSI     71   49.7  0  0.0  0.0  12   8.4   16.9  
2  CHI2     1    0.7  0  0.0  0.0   1   0.7  100.0  
3  PHI     71   49.7  0  0.0  0.0   5   3.5    7.0  
4  Total  143  100.0  0  0.0  0.0  18  12.6   12.6  
#
loop_
_pdbx_vrpt_dihedralangle_violation_model_summary.ordinal
_pdbx_vrpt_dihedralangle_violation_model_summary.PDB_model_num
_pdbx_vrpt_dihedralangle_violation_model_summary.max_violation
_pdbx_vrpt_dihedralangle_violation_model_summary.mean_violation
_pdbx_vrpt_dihedralangle_violation_model_summary.median_violation
_pdbx_vrpt_dihedralangle_violation_model_summary.standard_deviation
 1   1  3.70  2.10  1.75  0.98  
 2   2  3.40  2.03  1.40  0.97  
 3   3  1.50  1.40  1.40  0.08  
 4   4  1.70  1.65  1.65  0.05  
 5   5  2.20  1.97  2.00  0.21  
 6   6  2.90  2.65  2.65  0.25  
 7   7  1.20  1.20  1.20  0.00  
 8   8  2.30  1.70  1.60  0.45  
 9   9  2.40  2.40  2.40  0.00  
10  10  2.10  1.63  1.50  0.34  
11  11  1.70  1.40  1.40  0.30  
12  12  1.50  1.25  1.20  0.15  
13  13  2.30  1.68  1.65  0.49  
14  14  1.10  1.10  1.10  0.00  
15  15  1.40  1.27  1.30  0.11  
16  16  2.30  1.63  1.50  0.50  
17  17  2.50  1.80  1.70  0.54  
18  18  1.90  1.40  1.30  0.31  
19  19  1.60  1.60  1.60  0.00  
20  20  1.60  1.50  1.50  0.08  
#
loop_
_pdbx_vrpt_dihedralangle_violation_model.ordinal
_pdbx_vrpt_dihedralangle_violation_model.PDB_model_num
_pdbx_vrpt_dihedralangle_violation_model.ang_rest_type
_pdbx_vrpt_dihedralangle_violation_model.violations_count
 1   1  PSI    3  
 2   1  CHI2   1  
 3   1  PHI    0  
 4   1  Total  4  
 5   2  PSI    2  
 6   2  CHI2   0  
 7   2  PHI    1  
 8   2  Total  3  
 9   3  PSI    3  
10   3  CHI2   0  
11   3  PHI    0  
12   3  Total  3  
13   4  PSI    2  
14   4  CHI2   0  
15   4  PHI    0  
16   4  Total  2  
17   5  PSI    3  
18   5  CHI2   0  
19   5  PHI    0  
20   5  Total  3  
21   6  PSI    2  
22   6  CHI2   0  
23   6  PHI    0  
24   6  Total  2  
25   7  PSI    1  
26   7  CHI2   0  
27   7  PHI    1  
28   7  Total  2  
29   8  PSI    2  
30   8  CHI2   0  
31   8  PHI    1  
32   8  Total  3  
33   9  PSI    1  
34   9  CHI2   0  
35   9  PHI    0  
36   9  Total  1  
37  10  PSI    2  
38  10  CHI2   0  
39  10  PHI    1  
40  10  Total  3  
41  11  PSI    1  
42  11  CHI2   0  
43  11  PHI    1  
44  11  Total  2  
45  12  PSI    4  
46  12  CHI2   0  
47  12  PHI    0  
48  12  Total  4  
49  13  PSI    4  
50  13  CHI2   0  
51  13  PHI    0  
52  13  Total  4  
53  14  PSI    1  
54  14  CHI2   0  
55  14  PHI    0  
56  14  Total  1  
57  15  PSI    2  
58  15  CHI2   1  
59  15  PHI    1  
60  15  Total  4  
61  16  PSI    2  
62  16  CHI2   0  
63  16  PHI    1  
64  16  Total  3  
65  17  PSI    2  
66  17  CHI2   0  
67  17  PHI    1  
68  17  Total  3  
69  18  PSI    3  
70  18  CHI2   0  
71  18  PHI    2  
72  18  Total  5  
73  19  PSI    1  
74  19  CHI2   0  
75  19  PHI    0  
76  19  Total  1  
77  20  PSI    2  
78  20  CHI2   0  
79  20  PHI    1  
80  20  Total  3  
#
loop_
_pdbx_vrpt_dihedralangle_violation_ensemble_summary.id
_pdbx_vrpt_dihedralangle_violation_ensemble_summary.fraction_of_ensemble_count
_pdbx_vrpt_dihedralangle_violation_ensemble_summary.fraction_of_ensemble_percent
 1   1    5.0  
 2   2   10.0  
 3   3   15.0  
 4   4   20.0  
 5   5   25.0  
 6   6   30.0  
 7   7   35.0  
 8   8   40.0  
 9   9   45.0  
10  10   50.0  
11  11   55.0  
12  12   60.0  
13  13   65.0  
14  14   70.0  
15  15   75.0  
16  16   80.0  
17  17   85.0  
18  18   90.0  
19  19   95.0  
20  20  100.0  
#
loop_
_pdbx_vrpt_dihedralangle_ensemble_violation.ordinal
_pdbx_vrpt_dihedralangle_ensemble_violation.ensemble_dihedral_count
_pdbx_vrpt_dihedralangle_ensemble_violation.ang_rest_type
_pdbx_vrpt_dihedralangle_ensemble_violation.violations_count
 1   1  PSI    7  
 2   1  CHI2   0  
 3   1  PHI    2  
 4   1  Total  9  
 5   2  PSI    0  
 6   2  CHI2   1  
 7   2  PHI    1  
 8   2  Total  2  
 9   3  PSI    2  
10   3  CHI2   0  
11   3  PHI    1  
12   3  Total  3  
13   4  PSI    0  
14   4  CHI2   0  
15   4  PHI    1  
16   4  Total  1  
17   5  PSI    0  
18   5  CHI2   0  
19   5  PHI    0  
20   5  Total  0  
21   6  PSI    0  
22   6  CHI2   0  
23   6  PHI    0  
24   6  Total  0  
25   7  PSI    1  
26   7  CHI2   0  
27   7  PHI    0  
28   7  Total  1  
29   8  PSI    1  
30   8  CHI2   0  
31   8  PHI    0  
32   8  Total  1  
33   9  PSI    0  
34   9  CHI2   0  
35   9  PHI    0  
36   9  Total  0  
37  10  PSI    0  
38  10  CHI2   0  
39  10  PHI    0  
40  10  Total  0  
41  11  PSI    0  
42  11  CHI2   0  
43  11  PHI    0  
44  11  Total  0  
45  12  PSI    0  
46  12  CHI2   0  
47  12  PHI    0  
48  12  Total  0  
49  13  PSI    0  
50  13  CHI2   0  
51  13  PHI    0  
52  13  Total  0  
53  14  PSI    0  
54  14  CHI2   0  
55  14  PHI    0  
56  14  Total  0  
57  15  PSI    1  
58  15  CHI2   0  
59  15  PHI    0  
60  15  Total  1  
61  16  PSI    0  
62  16  CHI2   0  
63  16  PHI    0  
64  16  Total  0  
65  17  PSI    0  
66  17  CHI2   0  
67  17  PHI    0  
68  17  Total  0  
69  18  PSI    0  
70  18  CHI2   0  
71  18  PHI    0  
72  18  Total  0  
73  19  PSI    0  
74  19  CHI2   0  
75  19  PHI    0  
76  19  Total  0  
77  20  PSI    0  
78  20  CHI2   0  
79  20  PHI    0  
80  20  Total  0  
#
loop_
_pdbx_vrpt_residual_angle_violations.ordinal
_pdbx_vrpt_residual_angle_violations.bins
_pdbx_vrpt_residual_angle_violations.max_violation
_pdbx_vrpt_residual_angle_violations.violations_per_model
1  1.0-10.0   3.7   2.8   
2  10.0-20.0  None  None  
3  >20.0      None  None  
#
loop_
_pdbx_vrpt_most_violated_dihedralangle_restraints.ordinal
_pdbx_vrpt_most_violated_dihedralangle_restraints.rest_id
_pdbx_vrpt_most_violated_dihedralangle_restraints.rlist_id
_pdbx_vrpt_most_violated_dihedralangle_restraints.altcode_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.chain_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.resnum_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.resname_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.icode_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.ent_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.said_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.seq_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.atom_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.chain_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.altcode_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.resnum_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.resname_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.seq_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.said_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.ent_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.icode_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.atom_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.altcode_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.chain_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.resnum_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.resname_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.icode_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.ent_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.said_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.seq_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.atom_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.chain_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.altcode_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.resnum_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.resname_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.seq_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.said_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.ent_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.icode_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.atom_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.violated_models
_pdbx_vrpt_most_violated_dihedralangle_restraints.mean_angle_violation
_pdbx_vrpt_most_violated_dihedralangle_restraints.median_violation
_pdbx_vrpt_most_violated_dihedralangle_restraints.standard_deviation
1  114  1  .  A  77  LYS  ?     1  A  77  N   A  .  77  LYS  77  A  1  ?     CA  .  A  77  LYS  ?     1  A  77  C   A  .  78  ASP  78  A  1  ?     N    15  2.21  2.20  0.69  
2  110  1  .  A  72  GLU  ?     1  A  72  N   A  .  72  GLU  72  A  1  ?     CA  .  A  72  GLU  ?     1  A  72  C   A  .  73  GLU  73  A  1  ?     N     8  1.57  1.55  0.30  
3    4  1  .  A   8  THR  ?     1  A   8  N   A  .   8  THR   8  A  1  ?     CA  .  A   8  THR  ?     1  A   8  C   A  .   9  ARG   9  A  1  ?     N     7  1.41  1.40  0.18  
4   49  1  .  A  33  VAL  ?     1  A  33  C   A  .  34  GLU  34  A  1  ?     N   .  A  34  GLU  ?     1  A  34  CA  A  .  34  GLU  34  A  1  ?     C     4  1.40  1.45  0.12  
5   78  1  .  A  56  THR  ?     1  A  56  N   A  .  56  THR  56  A  1  ?     CA  .  A  56  THR  ?     1  A  56  C   A  .  57  ASP  57  A  1  ?     N     3  1.77  1.70  0.41  
6  102  1  .  A  68  GLU  ?     1  A  68  N   A  .  68  GLU  68  A  1  ?     CA  .  A  68  GLU  ?     1  A  68  C   A  .  69  VAL  69  A  1  ?     N     3  1.67  1.30  0.52  
7   59  1  .  A  44  TYR  ?     1  A  44  C   A  .  45  HIS  45  A  1  ?     N   .  A  45  HIS  ?     1  A  45  CA  A  .  45  HIS  45  A  1  ?     C     3  1.30  1.20  0.14  
8  143  1  .  A  39  TYR  ?     1  A  39  CA  A  .  39  TYR  39  A  1  ?     CB  .  A  39  TYR  ?     1  A  39  CG  A  .  39  TYR  39  A  1  ?     CD1   2  1.70  1.70  0.40  
9  131  1  .  A  85  ALA  ?     1  A  85  C   A  .  86  LYS  86  A  1  ?     N   .  A  86  LYS  ?     1  A  86  CA  A  .  86  LYS  86  A  1  ?     C     2  1.35  1.35  0.25  
#
loop_
_pdbx_vrpt_violated_dihedralangle_restraints.ordinal
_pdbx_vrpt_violated_dihedralangle_restraints.rest_id
_pdbx_vrpt_violated_dihedralangle_restraints.rlist_id
_pdbx_vrpt_violated_dihedralangle_restraints.instance_id_1
_pdbx_vrpt_violated_dihedralangle_restraints.instance_id_2
_pdbx_vrpt_violated_dihedralangle_restraints.instance_id_3
_pdbx_vrpt_violated_dihedralangle_restraints.instance_id_4
_pdbx_vrpt_violated_dihedralangle_restraints.atom_1
_pdbx_vrpt_violated_dihedralangle_restraints.atom_2
_pdbx_vrpt_violated_dihedralangle_restraints.atom_3
_pdbx_vrpt_violated_dihedralangle_restraints.atom_4
_pdbx_vrpt_violated_dihedralangle_restraints.violation
 1  114  1    77    77    77    78  N   CA  C   N    3.70  
 2  114  1   176   176   176   177  N   CA  C   N    3.40  
 3  114  1   572   572   572   573  N   CA  C   N    2.90  
 4  114  1  1661  1661  1661  1662  N   CA  C   N    2.50  
 5  114  1   869   869   869   870  N   CA  C   N    2.40  
 6  102  1   563   563   563   564  N   CA  C   N    2.40  
 7   78  1   749   749   749   750  N   CA  C   N    2.30  
 8  114  1  1265  1265  1265  1266  N   CA  C   N    2.30  
 9  114  1  1562  1562  1562  1563  N   CA  C   N    2.30  
10  114  1   473   473   473   474  N   CA  C   N    2.20  
11  143  1    39    39    39    39  CA  CB  CG  CD1  2.10  
12  114  1   968   968   968   969  N   CA  C   N    2.10  
13  110  1   468   468   468   469  N   CA  C   N    2.00  
14  110  1  1260  1260  1260  1261  N   CA  C   N    2.00  
15  114  1  1760  1760  1760  1761  N   CA  C   N    1.90  
16   78  1   452   452   452   453  N   CA  C   N    1.70  
17    4  1  1592  1592  1592  1593  N   CA  C   N    1.70  
18  114  1   374   374   374   375  N   CA  C   N    1.70  
19  110  1  1062  1062  1062  1063  N   CA  C   N    1.70  
20    4  1   305   305   305   306  N   CA  C   N    1.60  
21  131  1  1768  1769  1769  1769  C   N   CA  C    1.60  
22  114  1   770   770   770   771  N   CA  C   N    1.60  
23  114  1  1958  1958  1958  1959  N   CA  C   N    1.60  
24  110  1  1854  1854  1854  1855  N   CA  C   N    1.60  
25   59  1   935   936   936   936  C   N   CA  C    1.50  
26   49  1  1518  1519  1519  1519  C   N   CA  C    1.50  
27   49  1  1914  1915  1915  1915  C   N   CA  C    1.50  
28    4  1   206   206   206   207  N   CA  C   N    1.50  
29  110  1  1161  1161  1161  1162  N   CA  C   N    1.50  
30   50  1    34    34    34    35  N   CA  C   N    1.40  
31   49  1   132   133   133   133  C   N   CA  C    1.40  
32    4  1  1889  1889  1889  1890  N   CA  C   N    1.40  
33  110  1   270   270   270   271  N   CA  C   N    1.40  
34  109  1  1457  1458  1458  1458  C   N   CA  C    1.40  
35   78  1   947   947   947   948  N   CA  C   N    1.30  
36    4  1  1196  1196  1196  1197  N   CA  C   N    1.30  
37  143  1  1425  1425  1425  1425  CA  CB  CG  CD1  1.30  
38  114  1  1463  1463  1463  1464  N   CA  C   N    1.30  
39  110  1  1755  1755  1755  1756  N   CA  C   N    1.30  
40  102  1   167   167   167   168  N   CA  C   N    1.30  
41  102  1   266   266   266   267  N   CA  C   N    1.30  
42   80  1  1146  1146  1146  1147  N   CA  C   N    1.20  
43   59  1   638   639   639   639  C   N   CA  C    1.20  
44   59  1  1628  1629  1629  1629  C   N   CA  C    1.20  
45   49  1   726   727   727   727  C   N   CA  C    1.20  
46    4  1     8     8     8     9  N   CA  C   N    1.20  
47    4  1  1097  1097  1097  1098  N   CA  C   N    1.20  
48  114  1   671   671   671   672  N   CA  C   N    1.20  
49   84  1  1148  1148  1148  1149  N   CA  C   N    1.10  
50   72  1  1239  1239  1239  1240  N   CA  C   N    1.10  
51   65  1  1730  1731  1731  1731  C   N   CA  C    1.10  
52   46  1  1517  1517  1517  1518  N   CA  C   N    1.10  
53  132  1  1769  1769  1769  1770  N   CA  C   N    1.10  
54  131  1  1075  1076  1076  1076  C   N   CA  C    1.10  
55  130  1  1372  1372  1372  1373  N   CA  C   N    1.10  
56  110  1  1458  1458  1458  1459  N   CA  C   N    1.10  
#
loop_
_pdbx_vrpt_software.ordinal
_pdbx_vrpt_software.name
_pdbx_vrpt_software.version
_pdbx_vrpt_software.success_y_or_n
1  molprobity             4.02b-467                                                             Y  
2  coreclust              2.33                                                                  Y  
3  chemicalshiftanalysis  2.33                                                                  Y  
4  panav                  "Wang et al. (2010)"                                                  Y  
5  rci                    "v_1n_11_5_13_A (Berjanski et al., 2005)"                             Y  
6  restraintsanalysis     v1.2                                                                  Y  
7  percentiles            "20191225.v01 (using entries in the PDB archive December 25th 2019)"  Y  
##
