data_2KAZ

_pdbx_vrpt_database.id    PDB
_pdbx_vrpt_database.code  2KAZ
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   nmr
#
_pdbx_vrpt_summary.entry_id                    2KAZ
_pdbx_vrpt_summary.PDB_deposition_date         2008-11-18
_pdbx_vrpt_summary.PDB_revision_number         3
_pdbx_vrpt_summary.PDB_revision_date           2024-05-01
_pdbx_vrpt_summary.report_creation_date        2024-04-20:16:58
_pdbx_vrpt_summary.attempted_validation_steps  mogul,molprobity,validation-pack,coreclust,chemicalshiftanalysis,percentiles,writepdf,writexml,writecif
_pdbx_vrpt_summary.ligands_for_buster_report   N
#
loop_
_pdbx_vrpt_entity.id
_pdbx_vrpt_entity.type
_pdbx_vrpt_entity.description
1  polymer      "5'-D(*DGP*DGP*DGP*DAP*DCP*DGP*DTP*DAP*DGP*DTP*DGP*DGP*DG)-3'"  
2  non-polymer  "POTASSIUM ION"  
#
loop_
_pdbx_vrpt_asym.label_asym_id
_pdbx_vrpt_asym.entity_id
A  1  
B  1  
C  2  
D  2  
#
loop_
_pdbx_vrpt_percentile_list.id
_pdbx_vrpt_percentile_list.range
_pdbx_vrpt_percentile_list.exp_method
1  all  pdb    
2  nmr  x-ray  
#
_pdbx_vrpt_percentile_type.id    1
_pdbx_vrpt_percentile_type.type  all_atom_clashscore
#
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  98.20  158937  ?     ?     
2  2  1  89.45   12864  ?     ?     
#
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  4.26  3.16  309  478  
 2  1  1  B  B  4.20  3.50  309  478  
 3  2  1  A  A  4.25  3.36  309  478  
 4  2  1  B  B  4.33  3.40  309  478  
 5  3  1  A  A  4.55  3.02  309  478  
 6  3  1  B  B  4.95  3.35  309  478  
 7  4  1  A  A  4.13  3.26  309  478  
 8  4  1  B  B  3.95  3.52  309  478  
 9  5  1  A  A  4.02  3.16  309  478  
10  5  1  B  B  4.25  3.34  309  478  
#
_pdbx_vrpt_summary_geometry.ordinal                 1
_pdbx_vrpt_summary_geometry.clashscore              0.24
_pdbx_vrpt_summary_geometry.clashscore_full_length  0.24
_pdbx_vrpt_summary_geometry.num_H_reduce            1397
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ          3090
_pdbx_vrpt_summary_geometry.bonds_RMSZ              3.31
_pdbx_vrpt_summary_geometry.num_angles_RMSZ         4780
_pdbx_vrpt_summary_geometry.angles_RMSZ             4.30
#
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_bond_outliers
_pdbx_vrpt_model_instance.count_angle_outliers
_pdbx_vrpt_model_instance.count_clashes
_pdbx_vrpt_model_instance.count_plane_outliers
  1  1  1  A   1  DG  A   1  .  ?        3     9     ?     ?  
  2  1  1  A   2  DG  A   2  .  ?        3    10     ?     ?  
  3  1  1  A   3  DG  A   3  .  ?        2    10     ?     1  
  4  1  1  A   4  DA  A   4  .  ?        4     7     ?     1  
  5  1  1  A   5  DC  A   5  .  ?        2     9     ?     ?  
  6  1  1  A   6  DG  A   6  .  ?        5     7     ?     ?  
  7  1  1  A   7  DT  A   7  .  ?        3     5     ?     1  
  8  1  1  A   8  DA  A   8  .  ?        2     6     ?     ?  
  9  1  1  A   9  DG  A   9  .  ?        4     9     ?     ?  
 10  1  1  A  10  DT  A  10  .  ?        2     4     ?     ?  
 11  1  1  A  11  DG  A  11  .  ?        3     5     ?     1  
 12  1  1  A  12  DG  A  12  .  ?        5     6     ?     1  
 13  1  1  A  13  DG  A  13  .  ?        2    11     ?     1  
 14  1  1  B   1  DG  B  14  .  ?        5    13     ?     ?  
 15  1  1  B   2  DG  B  15  .  ?        4     5     ?     1  
 16  1  1  B   3  DG  B  16  .  ?        3    10     ?     1  
 17  1  1  B   4  DA  B  17  .  ?        6     6     ?     ?  
 18  1  1  B   5  DC  B  18  .  ?        3    11     ?     ?  
 19  1  1  B   6  DG  B  19  .  ?        2     6     ?     1  
 20  1  1  B   7  DT  B  20  .  ?        2     6     ?     1  
 21  1  1  B   8  DA  B  21  .  ?        4     7     ?     ?  
 22  1  1  B   9  DG  B  22  .  ?        3    10     ?     1  
 23  1  1  B  10  DT  B  23  .  ?        3     8     ?     ?  
 24  1  1  B  11  DG  B  24  .  ?        3     4     ?     1  
 25  1  1  B  12  DG  B  25  .  ?        3     8     ?     1  
 26  1  1  B  13  DG  B  26  .  ?        4     8     ?     ?  
 27  1  2  C   .  K   A  27  .  ?        ?     ?     ?     ?  
 28  1  2  D   .  K   A  28  .  ?        ?     ?     ?     ?  
 29  2  1  A   1  DG  A   1  .  ?        7     5     ?     ?  
 30  2  1  A   2  DG  A   2  .  ?        3     7     ?     ?  
 31  2  1  A   3  DG  A   3  .  ?        4    12     ?     ?  
 32  2  1  A   4  DA  A   4  .  ?        4     6     ?     ?  
 33  2  1  A   5  DC  A   5  .  ?        2     5     ?     1  
 34  2  1  A   6  DG  A   6  .  ?        4     7     ?     1  
 35  2  1  A   7  DT  A   7  .  ?        2     6     ?     1  
 36  2  1  A   8  DA  A   8  .  ?        4     7     ?     1  
 37  2  1  A   9  DG  A   9  .  ?        4     7     ?     1  
 38  2  1  A  10  DT  A  10  .  ?        1     4     ?     1  
 39  2  1  A  11  DG  A  11  .  ?        1     8     ?     ?  
 40  2  1  A  12  DG  A  12  .  ?        2     8     ?     1  
 41  2  1  A  13  DG  A  13  .  ?        3    10     ?     ?  
 42  2  1  B   1  DG  B  14  .  ?        4     6     ?     1  
 43  2  1  B   2  DG  B  15  .  ?        4    12     ?     1  
 44  2  1  B   3  DG  B  16  .  ?        1    10     ?     ?  
 45  2  1  B   4  DA  B  17  .  ?        4     4     ?     ?  
 46  2  1  B   5  DC  B  18  .  ?        4     7     ?     ?  
 47  2  1  B   6  DG  B  19  .  ?        7     8     ?     1  
 48  2  1  B   7  DT  B  20  .  ?        2     6     ?     ?  
 49  2  1  B   8  DA  B  21  .  ?        3     7     ?     ?  
 50  2  1  B   9  DG  B  22  .  ?        5    12     ?     ?  
 51  2  1  B  10  DT  B  23  .  ?        3     5     ?     1  
 52  2  1  B  11  DG  B  24  .  ?        3     7     ?     1  
 53  2  1  B  12  DG  B  25  .  ?        3    11     ?     1  
 54  2  1  B  13  DG  B  26  .  ?        3     3     ?     ?  
 55  2  2  C   .  K   A  27  .  ?        ?     ?     ?     ?  
 56  2  2  D   .  K   A  28  .  ?        ?     ?     ?     ?  
 57  3  1  A   1  DG  A   1  .  ?        4    12     ?     ?  
 58  3  1  A   2  DG  A   2  .  ?        2     9     ?     1  
 59  3  1  A   3  DG  A   3  .  ?        5     8     ?     1  
 60  3  1  A   4  DA  A   4  .  ?        4    11     ?     ?  
 61  3  1  A   5  DC  A   5  .  ?        4     7     ?     ?  
 62  3  1  A   6  DG  A   6  .  ?        4     6     ?     ?  
 63  3  1  A   7  DT  A   7  .  ?        1     9     ?     ?  
 64  3  1  A   8  DA  A   8  .  ?        2     7     ?     1  
 65  3  1  A   9  DG  A   9  .  ?        3    13     ?     1  
 66  3  1  A  10  DT  A  10  .  ?        1     4     ?     1  
 67  3  1  A  11  DG  A  11  .  ?        3     7     ?     1  
 68  3  1  A  12  DG  A  12  .  ?        1     6     ?     1  
 69  3  1  A  13  DG  A  13  .  ?        1     7     ?     ?  
 70  3  1  B   1  DG  B  14  .  ?        2    11     ?     ?  
 71  3  1  B   2  DG  B  15  .  ?        3    11     ?     1  
 72  3  1  B   3  DG  B  16  .  ?        5    11     ?     1  
 73  3  1  B   4  DA  B  17  .  ?        3     6     ?     1  
 74  3  1  B   5  DC  B  18  .  ?        4     6     ?     1  
 75  3  1  B   6  DG  B  19  .  ?        3    13     ?     1  
 76  3  1  B   7  DT  B  20  .  ?        4     6     ?     1  
 77  3  1  B   8  DA  B  21  .  ?        4    11     ?     1  
 78  3  1  B   9  DG  B  22  .  ?        5     7     ?     1  
 79  3  1  B  10  DT  B  23  .  ?        4     5     ?     1  
 80  3  1  B  11  DG  B  24  .  ?        5    10     ?     1  
 81  3  1  B  12  DG  B  25  .  ?        ?     8     ?     1  
 82  3  1  B  13  DG  B  26  .  ?        2    12     ?     1  
 83  3  2  C   .  K   A  27  .  ?        ?     ?     ?     ?  
 84  3  2  D   .  K   A  28  .  ?        ?     ?     ?     ?  
 85  4  1  A   1  DG  A   1  .  ?        4     9     ?     ?  
 86  4  1  A   2  DG  A   2  .  ?        1     8     ?     1  
 87  4  1  A   3  DG  A   3  .  ?        6     6     ?     1  
 88  4  1  A   4  DA  A   4  .  ?        3     4     ?     ?  
 89  4  1  A   5  DC  A   5  .  ?        1     2     1     ?  
 90  4  1  A   6  DG  A   6  .  ?        5     6     1     1  
 91  4  1  A   7  DT  A   7  .  ?        3     6     ?     1  
 92  4  1  A   8  DA  A   8  .  ?        3     7     ?     1  
 93  4  1  A   9  DG  A   9  .  ?        5     9     ?     1  
 94  4  1  A  10  DT  A  10  .  ?        1     7     ?     ?  
 95  4  1  A  11  DG  A  11  .  ?        3    12     ?     1  
 96  4  1  A  12  DG  A  12  .  ?        4     9     ?     1  
 97  4  1  A  13  DG  A  13  .  ?        2     6     ?     1  
 98  4  1  B   1  DG  B  14  .  ?        2     3     ?     1  
 99  4  1  B   2  DG  B  15  .  ?        5    10     ?     ?  
100  4  1  B   3  DG  B  16  .  ?        4    10     ?     1  
101  4  1  B   4  DA  B  17  .  ?        3     8     ?     ?  
102  4  1  B   5  DC  B  18  .  ?        1     6     ?     1  
103  4  1  B   6  DG  B  19  .  ?        2     4     ?     1  
104  4  1  B   7  DT  B  20  .  ?        5     8     ?     1  
105  4  1  B   8  DA  B  21  .  ?        5     9     ?     ?  
106  4  1  B   9  DG  B  22  .  ?        4    11     ?     1  
107  4  1  B  10  DT  B  23  .  ?        3     7     ?     1  
108  4  1  B  11  DG  B  24  .  ?        2     4     ?     1  
109  4  1  B  12  DG  B  25  .  ?        4     4     ?     1  
110  4  1  B  13  DG  B  26  .  ?        2     6     ?     ?  
111  4  2  C   .  K   A  27  .  ?        ?     ?     ?     ?  
112  4  2  D   .  K   A  28  .  ?        ?     ?     ?     ?  
113  5  1  A   1  DG  A   1  .  ?        1     2     ?     ?  
114  5  1  A   2  DG  A   2  .  ?        4    12     ?     1  
115  5  1  A   3  DG  A   3  .  ?        5     6     ?     ?  
116  5  1  A   4  DA  A   4  .  ?        ?     9     ?     1  
117  5  1  A   5  DC  A   5  .  ?        5     7     ?     1  
118  5  1  A   6  DG  A   6  .  ?        1    11     ?     1  
119  5  1  A   7  DT  A   7  .  ?        4     4     ?     1  
120  5  1  A   8  DA  A   8  .  ?        4     9     ?     1  
121  5  1  A   9  DG  A   9  .  ?        2     6     ?     1  
122  5  1  A  10  DT  A  10  .  ?        5     5     ?     1  
123  5  1  A  11  DG  A  11  .  ?        4     9     ?     1  
124  5  1  A  12  DG  A  12  .  ?        2     7     ?     1  
125  5  1  A  13  DG  A  13  .  ?        2     7     ?     1  
126  5  1  B   1  DG  B  14  .  ?        4     9     ?     1  
127  5  1  B   2  DG  B  15  .  ?        3    13     ?     1  
128  5  1  B   3  DG  B  16  .  ?        5     8     ?     1  
129  5  1  B   4  DA  B  17  .  ?        1     7     ?     ?  
130  5  1  B   5  DC  B  18  .  ?        2     5     ?     1  
131  5  1  B   6  DG  B  19  .  ?        3    10     ?     1  
132  5  1  B   7  DT  B  20  .  ?        2     8     ?     1  
133  5  1  B   8  DA  B  21  .  ?        1    12     ?     ?  
134  5  1  B   9  DG  B  22  .  ?        2     5     ?     1  
135  5  1  B  10  DT  B  23  .  ?        4     6     ?     ?  
136  5  1  B  11  DG  B  24  .  ?        2     7     ?     1  
137  5  1  B  12  DG  B  25  .  ?        7     8     ?     1  
138  5  1  B  13  DG  B  26  .  ?        6     4     ?     ?  
139  5  2  C   .  K   A  27  .  ?        ?     ?     ?     ?  
140  5  2  D   .  K   A  28  .  ?        ?     ?     ?     ?  
#
loop_
_pdbx_vrpt_model_instance_geometry.ordinal
_pdbx_vrpt_model_instance_geometry.instance_id
_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
  1    1  12  22  3.51  35  4.91  molprobity  
  2    2   9  25  3.47  39  3.99  molprobity  
  3    3  11  25  2.57  39  4.41  molprobity  
  4    4  11  24  3.59  37  4.38  molprobity  
  5    5  11  21  2.91  32  4.39  molprobity  
  6    6   9  25  3.17  39  3.71  molprobity  
  7    7  12  22  2.96  34  3.61  molprobity  
  8    8  11  24  2.93  37  3.93  molprobity  
  9    9   9  25  3.04  39  4.90  molprobity  
 10   10  11  22  2.95  34  3.78  molprobity  
 11   11  11  25  3.05  39  4.11  molprobity  
 12   12  11  25  3.53  39  4.54  molprobity  
 13   13  12  24  3.25  35  4.39  molprobity  
 14   14  12  22  4.04  35  5.60  molprobity  
 15   15   9  25  3.16  39  3.86  molprobity  
 16   16  11  25  2.76  39  4.27  molprobity  
 17   17   9  24  4.17  37  4.68  molprobity  
 18   18  11  21  3.46  32  5.55  molprobity  
 19   19  11  25  3.14  39  3.30  molprobity  
 20   20  12  22  2.74  34  3.90  molprobity  
 21   21   9  24  3.41  37  3.92  molprobity  
 22   22   9  25  3.42  39  4.33  molprobity  
 23   23  12  22  3.36  34  3.63  molprobity  
 24   24  11  25  3.53  39  2.95  molprobity  
 25   25  10  25  4.47  39  3.92  molprobity  
 26   26  12  24  3.34  35  4.17  molprobity  
 27   29  12  22  4.21  35  3.70  molprobity  
 28   30  11  25  3.21  39  4.40  molprobity  
 29   31  11  25  3.44  39  5.02  molprobity  
 30   32   9  24  3.28  37  4.71  molprobity  
 31   33  11  21  3.12  32  4.56  molprobity  
 32   34  11  25  3.55  39  3.20  molprobity  
 33   35  12  22  3.10  34  5.27  molprobity  
 34   36  11  24  3.42  37  4.01  molprobity  
 35   37  11  25  3.70  39  3.72  molprobity  
 36   38  12  22  2.96  34  2.84  molprobity  
 37   39  11  25  2.49  39  4.18  molprobity  
 38   40  11  25  3.07  39  4.17  molprobity  
 39   41  12  24  3.82  35  4.84  molprobity  
 40   42  12  22  3.21  35  4.33  molprobity  
 41   43  11  25  3.42  39  5.18  molprobity  
 42   44  11  25  3.14  39  4.53  molprobity  
 43   45  11  24  3.25  37  2.93  molprobity  
 44   46  11  21  3.31  32  4.01  molprobity  
 45   47   9  25  4.46  39  4.79  molprobity  
 46   48  12  22  2.94  34  4.13  molprobity  
 47   49  11  24  3.17  37  4.15  molprobity  
 48   50  11  25  3.57  39  4.68  molprobity  
 49   51  12  22  3.04  34  3.73  molprobity  
 50   52   9  25  3.86  39  4.73  molprobity  
 51   53  10  25  3.28  39  4.98  molprobity  
 52   54  12  24  3.04  35  3.09  molprobity  
 53   57  10  22  3.76  35  5.82  molprobity  
 54   58   9  25  2.95  39  4.25  molprobity  
 55   59   9  25  3.23  39  4.27  molprobity  
 56   60  11  24  3.48  37  6.52  molprobity  
 57   61  11  21  3.25  32  3.11  molprobity  
 58   62  11  25  3.19  39  3.92  molprobity  
 59   63  12  22  2.68  34  4.36  molprobity  
 60   64  11  24  3.05  37  3.37  molprobity  
 61   65   9  25  2.57  39  5.33  molprobity  
 62   66  12  22  2.58  34  3.49  molprobity  
 63   67   9  25  2.90  39  4.12  molprobity  
 64   68  11  25  2.34  39  4.80  molprobity  
 65   69  12  24  3.05  35  4.32  molprobity  
 66   70  10  22  2.48  35  5.34  molprobity  
 67   71   9  25  3.62  39  5.84  molprobity  
 68   72   9  25  3.99  39  4.98  molprobity  
 69   73  11  24  2.85  37  3.76  molprobity  
 70   74   9  21  3.41  32  3.19  molprobity  
 71   75  11  25  2.74  39  5.39  molprobity  
 72   76  12  22  3.32  34  4.07  molprobity  
 73   77   9  24  3.65  37  5.73  molprobity  
 74   78  11  25  4.29  39  3.68  molprobity  
 75   79  12  22  3.65  34  3.16  molprobity  
 76   80  11  25  3.95  39  4.50  molprobity  
 77   81  11  25  2.33  39  6.05  molprobity  
 78   82  12  24  2.48  35  6.72  molprobity  
 79   85  12  22  2.90  35  4.66  molprobity  
 80   86  11  25  2.75  39  3.62  molprobity  
 81   87   9  25  3.68  39  3.91  molprobity  
 82   88  11  24  3.08  37  3.20  molprobity  
 83   89   9  21  3.00  32  3.97  molprobity  
 84   90   9  25  4.20  39  3.28  molprobity  
 85   91  12  22  3.33  34  3.96  molprobity  
 86   92  11  24  3.78  37  4.99  molprobity  
 87   93  11  25  3.35  39  4.81  molprobity  
 88   94  12  22  3.02  34  4.24  molprobity  
 89   95   9  25  2.75  39  3.92  molprobity  
 90   96  11  25  3.28  39  4.83  molprobity  
 91   97  12  24  2.87  35  3.72  molprobity  
 92   98  12  22  2.84  35  3.46  molprobity  
 93   99   9  25  3.70  39  4.47  molprobity  
 94  100  11  25  3.20  39  3.78  molprobity  
 95  101  11  24  3.99  37  5.30  molprobity  
 96  102  11  21  3.60  32  3.83  molprobity  
 97  103  11  25  2.69  39  3.23  molprobity  
 98  104  12  22  4.64  34  4.11  molprobity  
 99  105  11  24  3.63  37  4.19  molprobity  
100  106  11  25  3.94  39  4.84  molprobity  
101  107  12  22  3.33  34  3.55  molprobity  
102  108   9  25  3.69  39  3.18  molprobity  
103  109  11  25  3.35  39  2.89  molprobity  
104  110  12  24  2.62  35  3.80  molprobity  
105  113  12  22  2.43  35  3.02  molprobity  
106  114   9  25  3.01  39  5.35  molprobity  
107  115   9  25  3.72  39  3.53  molprobity  
108  116  11  24  2.22  37  4.53  molprobity  
109  117  11  21  3.32  32  4.10  molprobity  
110  118  11  25  2.66  39  4.55  molprobity  
111  119  12  22  3.19  34  2.96  molprobity  
112  120   9  24  3.66  37  3.64  molprobity  
113  121   9  25  3.03  39  2.93  molprobity  
114  122  11  22  4.16  34  3.36  molprobity  
115  123  11  25  3.37  39  4.72  molprobity  
116  124  11  25  2.92  39  4.13  molprobity  
117  125  12  24  2.86  35  4.36  molprobity  
118  126  11  22  3.55  35  5.13  molprobity  
119  127   9  25  3.64  39  6.01  molprobity  
120  128   9  25  3.71  39  3.89  molprobity  
121  129  11  24  2.60  37  3.77  molprobity  
122  130  11  21  3.04  32  4.18  molprobity  
123  131  11  25  3.03  39  3.74  molprobity  
124  132  12  22  3.50  34  4.78  molprobity  
125  133  11  24  2.93  37  4.75  molprobity  
126  134  11  25  2.54  39  3.15  molprobity  
127  135  12  22  3.41  34  3.70  molprobity  
128  136  11  25  3.28  39  3.94  molprobity  
129  137   9  25  3.99  39  3.96  molprobity  
130  138  10  24  3.82  35  3.48  molprobity  
#
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  89  C5  1  0.41  3.09  
2  90  C6  1  0.41  3.09  
#
loop_
_pdbx_vrpt_instance_intra_plane_outliers.ordinal
_pdbx_vrpt_instance_intra_plane_outliers.instance_id
_pdbx_vrpt_instance_intra_plane_outliers.type
_pdbx_vrpt_instance_intra_plane_outliers.plane_rmsd
 1    3  sidechain  0.12  
 2    4  sidechain  0.08  
 3    7  sidechain  0.11  
 4   11  sidechain  0.07  
 5   12  sidechain  0.08  
 6   13  sidechain  0.11  
 7   15  sidechain  0.08  
 8   16  sidechain  0.13  
 9   19  sidechain  0.11  
10   20  sidechain  0.15  
11   22  sidechain  0.07  
12   24  sidechain  0.07  
13   25  sidechain  0.07  
14   33  sidechain  0.09  
15   34  sidechain  0.09  
16   35  sidechain  0.15  
17   36  sidechain  0.05  
18   37  sidechain  0.08  
19   38  sidechain  0.09  
20   40  sidechain  0.17  
21   42  sidechain  0.07  
22   43  sidechain  0.14  
23   47  sidechain  0.07  
24   51  sidechain  0.10  
25   52  sidechain  0.09  
26   53  sidechain  0.10  
27   58  sidechain  0.09  
28   59  sidechain  0.10  
29   64  sidechain  0.06  
30   65  sidechain  0.12  
31   66  sidechain  0.15  
32   67  sidechain  0.12  
33   68  sidechain  0.09  
34   71  sidechain  0.07  
35   72  sidechain  0.11  
36   73  sidechain  0.09  
37   74  sidechain  0.16  
38   75  sidechain  0.07  
39   76  sidechain  0.11  
40   77  sidechain  0.07  
41   78  sidechain  0.08  
42   79  sidechain  0.08  
43   80  sidechain  0.11  
44   81  sidechain  0.09  
45   82  sidechain  0.06  
46   86  sidechain  0.08  
47   87  sidechain  0.06  
48   90  sidechain  0.09  
49   91  sidechain  0.08  
50   92  sidechain  0.09  
51   93  sidechain  0.11  
52   95  sidechain  0.10  
53   96  sidechain  0.08  
54   97  sidechain  0.09  
55   98  sidechain  0.10  
56  100  sidechain  0.12  
57  102  sidechain  0.06  
58  103  sidechain  0.07  
59  104  sidechain  0.17  
60  106  sidechain  0.13  
61  107  sidechain  0.08  
62  108  sidechain  0.09  
63  109  sidechain  0.08  
64  114  sidechain  0.09  
65  116  sidechain  0.07  
66  117  sidechain  0.09  
67  118  sidechain  0.12  
68  119  sidechain  0.10  
69  120  sidechain  0.08  
70  121  sidechain  0.15  
71  122  sidechain  0.07  
72  123  sidechain  0.09  
73  124  sidechain  0.07  
74  125  sidechain  0.07  
75  126  sidechain  0.09  
76  127  sidechain  0.06  
77  128  sidechain  0.10  
78  130  sidechain  0.11  
79  131  sidechain  0.12  
80  132  sidechain  0.14  
81  134  sidechain  0.12  
82  136  sidechain  0.10  
83  137  sidechain  0.07  
#
loop_
_pdbx_vrpt_instance_intra_bond_outliers.ordinal
_pdbx_vrpt_instance_intra_bond_outliers.instance_id
_pdbx_vrpt_instance_intra_bond_outliers.atom_1
_pdbx_vrpt_instance_intra_bond_outliers.atom_2
_pdbx_vrpt_instance_intra_bond_outliers.obs
_pdbx_vrpt_instance_intra_bond_outliers.mean
_pdbx_vrpt_instance_intra_bond_outliers.stdev
_pdbx_vrpt_instance_intra_bond_outliers.Z
_pdbx_vrpt_instance_intra_bond_outliers.link
  1    1  "C5'"  "C4'"  1.586  1.509  0.011    7.03  ?     
  2    1  N7     C5     1.346  1.388  0.006   -6.99  ?     
  3    1  "O4'"  "C1'"  1.478  1.418  0.012    5.00  ?     
  4    2  C2     N2     1.272  1.341  0.010   -6.87  ?     
  5    2  "C4'"  "O4'"  1.391  1.446  0.010   -5.54  ?     
  6    2  N7     C5     1.438  1.388  0.006    8.32  ?     
  7    3  "O3'"  P      1.535  1.607  0.012   -5.97  Y     
  8    3  C5     C4     1.337  1.379  0.007   -6.04  ?     
  9    4  "O3'"  P      1.535  1.607  0.012   -6.03  Y     
 10    4  C8     N7     1.259  1.311  0.007   -7.45  ?     
 11    4  N3     C4     1.377  1.344  0.006    5.50  ?     
 12    4  N7     C5     1.342  1.388  0.006   -7.74  ?     
 13    5  "C1'"  N1     1.560  1.488  0.013    5.54  ?     
 14    5  P      "O5'"  1.644  1.593  0.010    5.12  ?     
 15    6  C2     N2     1.267  1.341  0.010   -7.37  ?     
 16    6  C2     N3     1.279  1.323  0.008   -5.45  ?     
 17    6  N3     C4     1.315  1.350  0.007   -5.05  ?     
 18    6  N7     C5     1.427  1.388  0.006    6.50  ?     
 19    6  N9     C8     1.336  1.374  0.007   -5.43  ?     
 20    7  "C5'"  "C4'"  1.565  1.509  0.011    5.08  ?     
 21    7  C5     C7     1.527  1.496  0.006    5.25  ?     
 22    7  P      "O5'"  1.682  1.593  0.010    8.88  ?     
 23    8  "C4'"  "C3'"  1.585  1.529  0.010    5.60  ?     
 24    8  C8     N7     1.269  1.311  0.007   -5.98  ?     
 25    9  C2     N2     1.286  1.341  0.010   -5.45  ?     
 26    9  C6     N1     1.352  1.391  0.007   -5.54  ?     
 27    9  C8     N7     1.274  1.305  0.006   -5.16  ?     
 28    9  N7     C5     1.449  1.388  0.006   10.15  ?     
 29   10  C4     C5     1.509  1.445  0.009    7.08  ?     
 30   10  N3     C4     1.329  1.382  0.008   -6.60  ?     
 31   11  "C4'"  "O4'"  1.369  1.446  0.010   -7.72  ?     
 32   11  C6     N1     1.344  1.391  0.007   -6.64  ?     
 33   11  N3     C4     1.308  1.350  0.007   -6.03  ?     
 34   12  C2     N3     1.369  1.323  0.008    5.81  ?     
 35   12  "C4'"  "O4'"  1.369  1.446  0.010   -7.71  ?     
 36   12  N1     C2     1.324  1.373  0.008   -6.12  ?     
 37   12  N3     C4     1.395  1.350  0.007    6.37  ?     
 38   12  N7     C5     1.421  1.388  0.006    5.46  ?     
 39   13  C2     N3     1.380  1.323  0.008    7.15  ?     
 40   13  N7     C5     1.418  1.388  0.006    5.07  ?     
 41   14  C2     N3     1.389  1.323  0.008    8.31  ?     
 42   14  "C4'"  "O4'"  1.392  1.446  0.010   -5.43  ?     
 43   14  C8     N7     1.256  1.305  0.006   -8.16  ?     
 44   14  N1     C2     1.316  1.373  0.008   -7.16  ?     
 45   14  N7     C5     1.425  1.388  0.006    6.13  ?     
 46   15  "C2'"  "C1'"  1.464  1.518  0.010   -5.43  ?     
 47   15  C2     N2     1.288  1.341  0.010   -5.30  ?     
 48   15  C8     N7     1.274  1.305  0.006   -5.14  ?     
 49   15  N7     C5     1.424  1.388  0.006    5.99  ?     
 50   16  "C5'"  "C4'"  1.568  1.509  0.011    5.34  ?     
 51   16  C6     N1     1.346  1.391  0.007   -6.48  ?     
 52   16  N1     C2     1.332  1.373  0.008   -5.15  ?     
 53   17  "C2'"  "C1'"  1.593  1.519  0.010    7.40  ?     
 54   17  C5     C4     1.338  1.383  0.007   -6.41  ?     
 55   17  "C5'"  "C4'"  1.565  1.509  0.011    5.12  ?     
 56   17  C6     N6     1.288  1.335  0.008   -5.83  ?     
 57   17  N7     C5     1.467  1.388  0.006   13.14  ?     
 58   17  P      "O5'"  1.644  1.593  0.010    5.13  ?     
 59   18  C2     O2     1.295  1.240  0.009    6.17  ?     
 60   18  "C5'"  "C4'"  1.565  1.509  0.011    5.09  ?     
 61   18  P      "O5'"  1.521  1.593  0.010   -7.17  ?     
 62   19  "C3'"  "C2'"  1.599  1.518  0.012    6.71  ?     
 63   19  N7     C5     1.427  1.388  0.006    6.50  ?     
 64   20  N1     C2     1.427  1.376  0.008    6.33  ?     
 65   20  N1     C6     1.415  1.378  0.007    5.33  ?     
 66   21  "O3'"  P      1.529  1.607  0.012   -6.53  Y     
 67   21  "C2'"  "C1'"  1.584  1.519  0.010    6.54  ?     
 68   21  C6     N6     1.287  1.335  0.008   -5.97  ?     
 69   21  P      "O5'"  1.533  1.593  0.010   -5.96  ?     
 70   22  C2     N2     1.263  1.341  0.010   -7.80  ?     
 71   22  "C4'"  "O4'"  1.384  1.446  0.010   -6.17  ?     
 72   22  N7     C5     1.437  1.388  0.006    8.10  ?     
 73   23  C5     C6     1.379  1.339  0.007    5.68  ?     
 74   23  C5     C7     1.554  1.496  0.006    9.65  ?     
 75   23  N1     C2     1.430  1.376  0.008    6.72  ?     
 76   24  "C5'"  "C4'"  1.589  1.509  0.011    7.31  ?     
 77   24  C6     N1     1.440  1.391  0.007    7.07  ?     
 78   24  N1     C2     1.323  1.373  0.008   -6.26  ?     
 79   25  "C5'"  "C4'"  1.595  1.509  0.011    7.81  ?     
 80   25  C6     N1     1.288  1.391  0.007  -14.69  ?     
 81   25  C8     N7     1.367  1.305  0.006   10.28  ?     
 82   26  C2     N3     1.364  1.323  0.008    5.09  ?     
 83   26  C6     O6     1.293  1.237  0.009    6.24  ?     
 84   26  N3     C4     1.394  1.350  0.007    6.24  ?     
 85   26  P      OP2    1.395  1.485  0.017   -5.29  ?     
 86   29  "C2'"  "C1'"  1.581  1.519  0.010    6.23  ?     
 87   29  C2     N3     1.377  1.323  0.008    6.80  ?     
 88   29  C5     C4     1.339  1.379  0.007   -5.74  ?     
 89   29  C6     N1     1.323  1.391  0.007   -9.72  ?     
 90   29  N3     C4     1.395  1.350  0.007    6.37  ?     
 91   29  N9     C4     1.328  1.375  0.008   -5.84  ?     
 92   29  N9     C8     1.412  1.374  0.007    5.50  ?     
 93   30  C8     N7     1.343  1.305  0.006    6.38  ?     
 94   30  N7     C5     1.356  1.388  0.006   -5.36  ?     
 95   30  N9     C4     1.328  1.375  0.008   -5.85  ?     
 96   31  "O3'"  P      1.538  1.607  0.012   -5.78  Y     
 97   31  C5     C6     1.474  1.419  0.010    5.47  ?     
 98   31  C8     N7     1.253  1.305  0.006   -8.65  ?     
 99   31  N3     C4     1.293  1.350  0.007   -8.14  ?     
100   32  "C4'"  "O4'"  1.395  1.446  0.010   -5.09  ?     
101   32  C5     C4     1.338  1.383  0.007   -6.37  ?     
102   32  C6     N1     1.303  1.351  0.007   -6.80  ?     
103   32  C6     N6     1.290  1.335  0.008   -5.65  ?     
104   33  C4     C5     1.382  1.425  0.008   -5.34  ?     
105   33  N3     C4     1.274  1.335  0.007   -8.65  ?     
106   34  "C3'"  "O3'"  1.332  1.435  0.013   -7.94  ?     
107   34  N1     C2     1.415  1.373  0.008    5.29  ?     
108   34  N9     C8     1.321  1.374  0.007   -7.50  ?     
109   34  P      "O5'"  1.517  1.593  0.010   -7.61  ?     
110   35  C2     N3     1.420  1.373  0.008    5.83  ?     
111   35  "C4'"  "O4'"  1.371  1.446  0.010   -7.55  ?     
112   36  "C4'"  "C3'"  1.459  1.521  0.010   -6.19  ?     
113   36  C5     C4     1.428  1.383  0.007    6.38  ?     
114   36  C8     N7     1.269  1.311  0.007   -6.04  ?     
115   36  P      "O5'"  1.541  1.593  0.010   -5.19  ?     
116   37  "C2'"  "C1'"  1.460  1.518  0.010   -5.82  ?     
117   37  "C5'"  "C4'"  1.574  1.509  0.011    5.89  ?     
118   37  C6     N1     1.331  1.391  0.007   -8.53  ?     
119   37  N9     C4     1.423  1.375  0.008    5.97  ?     
120   38  C2     N3     1.450  1.373  0.008    9.67  ?     
121   39  "C4'"  "C3'"  1.603  1.529  0.010    7.44  ?     
122   40  C2     N3     1.374  1.323  0.008    6.35  ?     
123   40  C5     C6     1.490  1.419  0.010    7.11  ?     
124   41  C5     C6     1.509  1.419  0.010    8.98  ?     
125   41  C6     N1     1.343  1.391  0.007   -6.91  ?     
126   41  C8     N7     1.273  1.305  0.006   -5.38  ?     
127   42  "C3'"  "O3'"  1.366  1.435  0.013   -5.28  ?     
128   42  "C4'"  "O4'"  1.387  1.446  0.010   -5.95  ?     
129   42  C6     N1     1.341  1.391  0.007   -7.08  ?     
130   42  N3     C4     1.400  1.350  0.007    7.19  ?     
131   43  "C5'"  "C4'"  1.585  1.509  0.011    6.89  ?     
132   43  C6     N1     1.436  1.391  0.007    6.43  ?     
133   43  N1     C2     1.307  1.373  0.008   -8.20  ?     
134   43  N9     C8     1.415  1.374  0.007    5.79  ?     
135   44  N3     C4     1.400  1.350  0.007    7.17  ?     
136   45  "C2'"  "C1'"  1.574  1.519  0.010    5.53  ?     
137   45  "C5'"  "C4'"  1.567  1.509  0.011    5.28  ?     
138   45  N3     C4     1.385  1.344  0.006    6.86  ?     
139   45  N9     C4     1.339  1.374  0.006   -5.83  ?     
140   46  "C3'"  "O3'"  1.501  1.435  0.013    5.07  ?     
141   46  C5     C6     1.402  1.339  0.008    7.87  ?     
142   46  N1     C6     1.399  1.367  0.006    5.31  ?     
143   46  N3     C4     1.293  1.335  0.007   -6.05  ?     
144   47  C2     N2     1.239  1.341  0.010  -10.24  ?     
145   47  "C5'"  "C4'"  1.588  1.509  0.011    7.19  ?     
146   47  C6     N1     1.431  1.391  0.007    5.72  ?     
147   47  C6     O6     1.173  1.237  0.009   -7.16  ?     
148   47  C8     N7     1.239  1.305  0.006  -10.92  ?     
149   47  N9     C8     1.415  1.374  0.007    5.80  ?     
150   47  P      "O5'"  1.652  1.593  0.010    5.86  ?     
151   48  N1     C2     1.459  1.376  0.008   10.37  ?     
152   48  P      "O5'"  1.650  1.593  0.010    5.70  ?     
153   49  C2     N3     1.383  1.331  0.009    5.83  ?     
154   49  C6     N6     1.379  1.335  0.008    5.45  ?     
155   49  N9     C4     1.415  1.374  0.006    6.91  ?     
156   50  C5     C6     1.474  1.419  0.010    5.49  ?     
157   50  C8     N7     1.263  1.305  0.006   -7.03  ?     
158   50  N1     C2     1.331  1.373  0.008   -5.23  ?     
159   50  N3     C4     1.405  1.350  0.007    7.85  ?     
160   50  N9     C8     1.333  1.374  0.007   -5.80  ?     
161   51  C4     C5     1.499  1.445  0.009    5.98  ?     
162   51  "C4'"  "O4'"  1.394  1.446  0.010   -5.20  ?     
163   51  C5     C7     1.457  1.496  0.006   -6.49  ?     
164   52  C2     N2     1.256  1.341  0.010   -8.48  ?     
165   52  N9     C4     1.441  1.375  0.008    8.29  ?     
166   52  P      "O5'"  1.667  1.593  0.010    7.36  ?     
167   53  "C4'"  "O4'"  1.499  1.446  0.010    5.33  ?     
168   53  C5     C4     1.420  1.379  0.007    5.85  ?     
169   53  N1     C2     1.303  1.373  0.008   -8.79  ?     
170   54  "C4'"  "O4'"  1.371  1.446  0.010   -7.52  ?     
171   54  C5     C4     1.336  1.379  0.007   -6.15  ?     
172   54  C6     N1     1.349  1.391  0.007   -5.98  ?     
173   57  "O3'"  P      1.677  1.607  0.012    5.84  Y     
174   57  C2     N2     1.247  1.341  0.010   -9.37  ?     
175   57  N1     C2     1.318  1.373  0.008   -6.93  ?     
176   57  N9     C8     1.431  1.374  0.007    8.12  ?     
177   58  C2     N2     1.272  1.341  0.010   -6.90  ?     
178   58  N3     C4     1.390  1.350  0.007    5.78  ?     
179   59  "O3'"  P      1.528  1.607  0.012   -6.62  Y     
180   59  C2     N2     1.290  1.341  0.010   -5.08  ?     
181   59  "C3'"  "C2'"  1.581  1.518  0.012    5.27  ?     
182   59  C6     N1     1.444  1.391  0.007    7.60  ?     
183   59  P      "O5'"  1.542  1.593  0.010   -5.10  ?     
184   60  "C5'"  "C4'"  1.575  1.509  0.011    6.03  ?     
185   60  N3     C4     1.379  1.344  0.006    5.89  ?     
186   60  N9     C4     1.417  1.374  0.006    7.11  ?     
187   60  P      OP1    1.393  1.485  0.017   -5.39  ?     
188   61  "C3'"  "C2'"  1.583  1.518  0.012    5.42  ?     
189   61  C4     C5     1.369  1.425  0.008   -6.98  ?     
190   61  "C5'"  "C4'"  1.566  1.509  0.011    5.21  ?     
191   61  C5     C6     1.397  1.339  0.008    7.26  ?     
192   62  C5     C6     1.479  1.419  0.010    6.02  ?     
193   62  N3     C4     1.391  1.350  0.007    5.85  ?     
194   62  N9     C8     1.332  1.374  0.007   -6.03  ?     
195   62  P      "O5'"  1.663  1.593  0.010    6.99  ?     
196   63  "C3'"  "O3'"  1.354  1.435  0.013   -6.22  ?     
197   64  C6     N1     1.297  1.351  0.007   -7.69  ?     
198   64  N7     C5     1.433  1.388  0.006    7.45  ?     
199   65  C2     N2     1.286  1.341  0.010   -5.49  ?     
200   65  C2     N3     1.369  1.323  0.008    5.81  ?     
201   65  "C5'"  "C4'"  1.573  1.509  0.011    5.79  ?     
202   66  C2     N3     1.424  1.373  0.008    6.43  ?     
203   67  C2     N2     1.267  1.341  0.010   -7.41  ?     
204   67  "C3'"  "O3'"  1.355  1.435  0.013   -6.18  ?     
205   67  "C4'"  "O4'"  1.394  1.446  0.010   -5.24  ?     
206   68  "C5'"  "C4'"  1.582  1.509  0.011    6.66  ?     
207   69  N9     C8     1.412  1.374  0.007    5.48  ?     
208   70  "C2'"  "C1'"  1.569  1.519  0.010    5.00  ?     
209   70  C2     N2     1.289  1.341  0.010   -5.21  ?     
210   71  C2     N2     1.267  1.341  0.010   -7.38  ?     
211   71  N9     C4     1.430  1.375  0.008    6.89  ?     
212   71  N9     C8     1.438  1.374  0.007    9.11  ?     
213   72  C2     N2     1.257  1.341  0.010   -8.43  ?     
214   72  "C3'"  "C2'"  1.593  1.518  0.012    6.25  ?     
215   72  C5     C4     1.326  1.379  0.007   -7.62  ?     
216   72  N9     C4     1.439  1.375  0.008    7.95  ?     
217   72  "O4'"  "C1'"  1.481  1.418  0.012    5.29  ?     
218   73  "C4'"  "O4'"  1.384  1.446  0.010   -6.17  ?     
219   73  C5     C6     1.457  1.406  0.009    5.65  ?     
220   73  N7     C5     1.431  1.388  0.006    7.22  ?     
221   74  C4     N4     1.272  1.335  0.009   -6.98  ?     
222   74  N1     C2     1.346  1.397  0.010   -5.12  ?     
223   74  N1     C6     1.408  1.367  0.006    6.84  ?     
224   74  P      "O5'"  1.542  1.593  0.010   -5.06  ?     
225   75  C5     C4     1.333  1.379  0.007   -6.51  ?     
226   75  N3     C4     1.301  1.350  0.007   -6.99  ?     
227   75  N7     C5     1.423  1.388  0.006    5.80  ?     
228   76  "C3'"  "C2'"  1.436  1.518  0.012   -6.81  ?     
229   76  C4     C5     1.494  1.445  0.009    5.41  ?     
230   76  C5     C7     1.533  1.496  0.006    6.21  ?     
231   76  N1     C2     1.436  1.376  0.008    7.54  ?     
232   77  "C2'"  "C1'"  1.577  1.519  0.010    5.84  ?     
233   77  C6     N6     1.288  1.335  0.008   -5.82  ?     
234   77  C8     N7     1.254  1.311  0.007   -8.15  ?     
235   77  N7     C5     1.436  1.388  0.006    7.97  ?     
236   78  "C4'"  "O4'"  1.356  1.446  0.010   -8.96  ?     
237   78  C5     C6     1.469  1.419  0.010    5.04  ?     
238   78  C6     N1     1.330  1.391  0.007   -8.78  ?     
239   78  C8     N7     1.353  1.305  0.006    8.01  ?     
240   78  N3     C4     1.396  1.350  0.007    6.60  ?     
241   79  C4     O4     1.179  1.228  0.009   -5.50  ?     
242   79  N1     C2     1.419  1.376  0.008    5.34  ?     
243   79  N1     C6     1.434  1.378  0.007    8.02  ?     
244   79  N3     C4     1.336  1.382  0.008   -5.80  ?     
245   80  "O3'"  P      1.500  1.607  0.012   -8.89  Y     
246   80  "C4'"  "O4'"  1.375  1.446  0.010   -7.14  ?     
247   80  C5     C4     1.415  1.379  0.007    5.20  ?     
248   80  C6     N1     1.442  1.391  0.007    7.23  ?     
249   80  N3     C4     1.400  1.350  0.007    7.21  ?     
250   82  "C1'"  N9     1.553  1.488  0.013    5.01  ?     
251   82  "C5'"  "C4'"  1.576  1.509  0.011    6.08  ?     
252   85  "C3'"  "C2'"  1.580  1.518  0.012    5.17  ?     
253   85  "C5'"  "C4'"  1.574  1.509  0.011    5.92  ?     
254   85  N7     C5     1.424  1.388  0.006    5.96  ?     
255   85  N9     C4     1.416  1.375  0.008    5.18  ?     
256   86  C6     N1     1.354  1.391  0.007   -5.30  ?     
257   87  C2     N2     1.270  1.341  0.010   -7.12  ?     
258   87  "C5'"  "C4'"  1.584  1.509  0.011    6.84  ?     
259   87  C8     N7     1.339  1.305  0.006    5.68  ?     
260   87  N7     C5     1.429  1.388  0.006    6.90  ?     
261   87  "O4'"  "C1'"  1.334  1.418  0.012   -6.97  ?     
262   87  P      "O5'"  1.656  1.593  0.010    6.31  ?     
263   88  C5     C4     1.342  1.383  0.007   -5.90  ?     
264   88  C8     N7     1.260  1.311  0.007   -7.31  ?     
265   88  N9     C8     1.426  1.373  0.008    6.57  ?     
266   89  C4     N4     1.268  1.335  0.009   -7.40  ?     
267   90  C2     N2     1.238  1.341  0.010  -10.30  ?     
268   90  C5     C4     1.416  1.379  0.007    5.26  ?     
269   90  "C5'"  "C4'"  1.580  1.509  0.011    6.45  ?     
270   90  C8     N7     1.337  1.305  0.006    5.40  ?     
271   90  N7     C5     1.456  1.388  0.006   11.28  ?     
272   91  "C3'"  "O3'"  1.360  1.435  0.013   -5.78  ?     
273   91  "C4'"  "O4'"  1.390  1.446  0.010   -5.62  ?     
274   91  P      "O5'"  1.521  1.593  0.010   -7.20  ?     
275   92  N1     C2     1.278  1.339  0.009   -6.83  ?     
276   92  N3     C4     1.422  1.344  0.006   12.98  ?     
277   92  N7     C5     1.427  1.388  0.006    6.56  ?     
278   93  "C3'"  "C2'"  1.578  1.518  0.012    5.02  ?     
279   93  "C5'"  "C4'"  1.571  1.509  0.011    5.65  ?     
280   93  N3     C4     1.390  1.350  0.007    5.78  ?     
281   93  N9     C8     1.326  1.374  0.007   -6.87  ?     
282   93  P      "O5'"  1.513  1.593  0.010   -7.98  ?     
283   94  "O3'"  P      1.515  1.607  0.012   -7.68  Y     
284   95  C2     N2     1.281  1.341  0.010   -6.04  ?     
285   95  N9     C4     1.327  1.375  0.008   -5.96  ?     
286   95  P      "O5'"  1.651  1.593  0.010    5.81  ?     
287   96  "C4'"  "O4'"  1.346  1.446  0.010  -10.04  ?     
288   96  C5     C4     1.416  1.379  0.007    5.24  ?     
289   96  "C5'"  "C4'"  1.572  1.509  0.011    5.71  ?     
290   96  N1     C2     1.414  1.373  0.008    5.16  ?     
291   97  "C4'"  "O4'"  1.390  1.446  0.010   -5.56  ?     
292   97  "C5'"  "C4'"  1.571  1.509  0.011    5.61  ?     
293   98  C8     N7     1.254  1.305  0.006   -8.45  ?     
294   98  N9     C4     1.435  1.375  0.008    7.51  ?     
295   99  C2     N2     1.235  1.341  0.010  -10.60  ?     
296   99  "C3'"  "C2'"  1.587  1.518  0.012    5.74  ?     
297   99  "C4'"  "O4'"  1.388  1.446  0.010   -5.83  ?     
298   99  C5     C4     1.333  1.379  0.007   -6.63  ?     
299   99  C6     O6     1.190  1.237  0.009   -5.19  ?     
300  100  "O3'"  P      1.542  1.607  0.012   -5.38  Y     
301  100  "C4'"  "O4'"  1.505  1.446  0.010    5.93  ?     
302  100  C6     N1     1.351  1.391  0.007   -5.66  ?     
303  100  N9     C8     1.441  1.374  0.007    9.61  ?     
304  101  N3     C4     1.401  1.344  0.006    9.48  ?     
305  101  N7     C5     1.450  1.388  0.006   10.39  ?     
306  101  N9     C8     1.327  1.373  0.008   -5.74  ?     
307  102  N1     C6     1.295  1.367  0.006  -12.08  ?     
308  103  "C5'"  "C4'"  1.446  1.509  0.011   -5.70  ?     
309  103  C5     C6     1.473  1.419  0.010    5.42  ?     
310  104  C2     N3     1.416  1.373  0.008    5.41  ?     
311  104  "C3'"  "O3'"  1.351  1.435  0.013   -6.50  ?     
312  104  C4     C5     1.395  1.445  0.009   -5.59  ?     
313  104  C5     C7     1.591  1.496  0.006   15.76  ?     
314  104  N1     C2     1.420  1.376  0.008    5.47  ?     
315  105  "C3'"  "O3'"  1.521  1.435  0.013    6.61  ?     
316  105  C5     C4     1.328  1.383  0.007   -7.89  ?     
317  105  N3     C4     1.314  1.344  0.006   -5.01  ?     
318  105  N7     C5     1.349  1.388  0.006   -6.50  ?     
319  105  P      "O5'"  1.537  1.593  0.010   -5.57  ?     
320  106  C5     C6     1.513  1.419  0.010    9.36  ?     
321  106  C6     O6     1.159  1.237  0.009   -8.65  ?     
322  106  C8     N7     1.345  1.305  0.006    6.61  ?     
323  106  N3     C4     1.395  1.350  0.007    6.38  ?     
324  107  C4     C5     1.495  1.445  0.009    5.51  ?     
325  107  "C5'"  "C4'"  1.599  1.509  0.011    8.19  ?     
326  107  C5     C7     1.527  1.496  0.006    5.18  ?     
327  108  C2     N2     1.257  1.341  0.010   -8.36  ?     
328  108  "C4'"  "C3'"  1.605  1.529  0.010    7.59  ?     
329  109  "C4'"  "C3'"  1.606  1.529  0.010    7.71  ?     
330  109  "C4'"  "O4'"  1.396  1.446  0.010   -5.01  ?     
331  109  C8     N7     1.362  1.305  0.006    9.49  ?     
332  109  P      "O5'"  1.527  1.593  0.010   -6.62  ?     
333  110  N1     C2     1.424  1.373  0.008    6.41  ?     
334  110  N9     C8     1.337  1.374  0.007   -5.35  ?     
335  113  "C4'"  "O4'"  1.371  1.446  0.010   -7.49  ?     
336  114  C2     N2     1.277  1.341  0.010   -6.42  ?     
337  114  C6     N1     1.350  1.391  0.007   -5.88  ?     
338  114  N9     C8     1.416  1.374  0.007    6.01  ?     
339  114  P      "O5'"  1.537  1.593  0.010   -5.61  ?     
340  115  C2     N2     1.253  1.341  0.010   -8.75  ?     
341  115  "C3'"  "O3'"  1.363  1.435  0.013   -5.53  ?     
342  115  C8     N7     1.270  1.305  0.006   -5.82  ?     
343  115  N7     C5     1.352  1.388  0.006   -5.99  ?     
344  115  P      "O5'"  1.677  1.593  0.010    8.41  ?     
345  117  "C5'"  "C4'"  1.568  1.509  0.011    5.40  ?     
346  117  C5     C6     1.392  1.339  0.008    6.62  ?     
347  117  N1     C6     1.404  1.367  0.006    6.24  ?     
348  117  N3     C4     1.293  1.335  0.007   -6.05  ?     
349  117  P      OP2    1.572  1.485  0.017    5.10  ?     
350  118  "C3'"  "C2'"  1.581  1.518  0.012    5.23  ?     
351  119  "C4'"  "O4'"  1.386  1.446  0.010   -6.01  ?     
352  119  C5     C6     1.392  1.339  0.007    7.56  ?     
353  119  C5     C7     1.463  1.496  0.006   -5.51  ?     
354  119  N1     C6     1.339  1.378  0.007   -5.64  ?     
355  120  "C3'"  "C2'"  1.578  1.518  0.012    5.02  ?     
356  120  C6     N6     1.270  1.335  0.008   -8.12  ?     
357  120  N3     C4     1.391  1.344  0.006    7.77  ?     
358  120  P      "O5'"  1.653  1.593  0.010    5.96  ?     
359  121  "C2'"  "C1'"  1.592  1.519  0.010    7.28  ?     
360  121  C2     N2     1.276  1.341  0.010   -6.46  ?     
361  122  C2     N3     1.331  1.373  0.008   -5.23  ?     
362  122  "C4'"  "C3'"  1.638  1.529  0.010   10.90  ?     
363  122  "C5'"  "C4'"  1.585  1.509  0.011    6.91  ?     
364  122  N1     C2     1.442  1.376  0.008    8.24  ?     
365  122  "O4'"  "C1'"  1.354  1.418  0.012   -5.34  ?     
366  123  "O3'"  P      1.668  1.607  0.012    5.12  Y     
367  123  C6     O6     1.179  1.237  0.009   -6.48  ?     
368  123  C8     N7     1.353  1.305  0.006    7.92  ?     
369  123  N1     C2     1.330  1.373  0.008   -5.34  ?     
370  124  "C3'"  "C2'"  1.579  1.518  0.012    5.08  ?     
371  124  N3     C4     1.405  1.350  0.007    7.83  ?     
372  125  "C2'"  "C1'"  1.570  1.519  0.010    5.06  ?     
373  125  "C5'"  "C4'"  1.589  1.509  0.011    7.31  ?     
374  126  "O3'"  P      1.696  1.607  0.012    7.42  Y     
375  126  C5     C6     1.488  1.419  0.010    6.92  ?     
376  126  N1     C2     1.318  1.373  0.008   -6.85  ?     
377  126  N9     C8     1.429  1.374  0.007    7.85  ?     
378  127  C2     N2     1.248  1.341  0.010   -9.26  ?     
379  127  N3     C4     1.413  1.350  0.007    9.07  ?     
380  127  N9     C8     1.412  1.374  0.007    5.47  ?     
381  128  C2     N2     1.266  1.341  0.010   -7.54  ?     
382  128  "C4'"  "O4'"  1.393  1.446  0.010   -5.30  ?     
383  128  C6     O6     1.182  1.237  0.009   -6.08  ?     
384  128  C8     N7     1.261  1.305  0.006   -7.26  ?     
385  128  N9     C8     1.330  1.374  0.007   -6.24  ?     
386  129  N9     C8     1.327  1.373  0.008   -5.72  ?     
387  130  "C3'"  "C2'"  1.620  1.518  0.012    8.46  ?     
388  130  "C5'"  "C4'"  1.582  1.509  0.011    6.63  ?     
389  131  N1     C2     1.317  1.373  0.008   -7.05  ?     
390  131  N7     C5     1.440  1.388  0.006    8.67  ?     
391  131  N9     C8     1.409  1.374  0.007    5.02  ?     
392  132  C5     C7     1.541  1.496  0.006    7.54  ?     
393  132  N1     C2     1.445  1.376  0.008    8.67  ?     
394  133  C8     N7     1.249  1.311  0.007   -8.86  ?     
395  134  "C2'"  "C1'"  1.590  1.519  0.010    7.05  ?     
396  134  N3     C4     1.304  1.350  0.007   -6.57  ?     
397  135  "O3'"  P      1.537  1.607  0.012   -5.82  Y     
398  135  "C4'"  "O4'"  1.386  1.446  0.010   -6.03  ?     
399  135  C5     C7     1.540  1.496  0.006    7.26  ?     
400  135  N3     C4     1.342  1.382  0.008   -5.04  ?     
401  136  "C5'"  "C4'"  1.578  1.509  0.011    6.25  ?     
402  136  N3     C4     1.417  1.350  0.007    9.51  ?     
403  137  "O3'"  P      1.538  1.607  0.012   -5.77  Y     
404  137  C2     N2     1.279  1.341  0.010   -6.21  ?     
405  137  C2     N3     1.372  1.323  0.008    6.13  ?     
406  137  "C4'"  "C3'"  1.607  1.529  0.010    7.85  ?     
407  137  "C5'"  "C4'"  1.602  1.509  0.011    8.47  ?     
408  137  C6     N1     1.350  1.391  0.007   -5.85  ?     
409  137  N7     C5     1.419  1.388  0.006    5.23  ?     
410  138  C2     N2     1.279  1.341  0.010   -6.23  ?     
411  138  "C4'"  "O4'"  1.365  1.446  0.010   -8.09  ?     
412  138  C5     C4     1.343  1.379  0.007   -5.19  ?     
413  138  N1     C2     1.331  1.373  0.008   -5.26  ?     
414  138  N3     C4     1.392  1.350  0.007    5.95  ?     
415  138  N7     C5     1.427  1.388  0.006    6.45  ?     
#
loop_
_pdbx_vrpt_instance_intra_angle_outliers.ordinal
_pdbx_vrpt_instance_intra_angle_outliers.instance_id
_pdbx_vrpt_instance_intra_angle_outliers.atom_1
_pdbx_vrpt_instance_intra_angle_outliers.atom_2
_pdbx_vrpt_instance_intra_angle_outliers.atom_3
_pdbx_vrpt_instance_intra_angle_outliers.obs
_pdbx_vrpt_instance_intra_angle_outliers.mean
_pdbx_vrpt_instance_intra_angle_outliers.stdev
_pdbx_vrpt_instance_intra_angle_outliers.Z
_pdbx_vrpt_instance_intra_angle_outliers.link
  1    1  "C1'"  "O4'"  "C4'"  104.999  110.100  1.000   -5.10  ?     
  2    1  C2     N3     C4     117.055  111.900  0.500   10.31  ?     
  3    1  C5     C6     N1     114.286  111.500  0.500    5.57  ?     
  4    1  C8     N9     C4     100.575  106.400  0.400  -14.56  ?     
  5    1  N3     C4     C5     123.547  128.600  0.500  -10.11  ?     
  6    1  N3     C4     N9     129.151  126.000  0.600    5.25  ?     
  7    1  N7     C8     N9     117.429  113.100  0.500    8.66  ?     
  8    1  "O4'"  "C1'"  N9     115.984  108.000  0.700   11.41  ?     
  9    1  "O4'"  "C4'"  "C3'"  109.540  106.000  0.600    5.90  ?     
 10    2  C5     C6     N1     114.786  111.500  0.500    6.57  ?     
 11    2  C5     N7     C8     101.595  104.300  0.500   -5.41  ?     
 12    2  C6     N1     C2     121.632  125.100  0.600   -5.78  ?     
 13    2  C8     N9     C4     102.716  106.400  0.400   -9.21  ?     
 14    2  N1     C6     O6     116.462  119.900  0.600   -5.73  ?     
 15    2  N3     C2     N2     116.200  119.900  0.700   -5.29  ?     
 16    2  N3     C4     N9     122.326  126.000  0.600   -6.12  ?     
 17    2  N7     C8     N9     117.872  113.100  0.500    9.54  ?     
 18    2  N9     C4     C5     108.638  105.400  0.400    8.10  ?     
 19    2  "O4'"  "C1'"  N9     112.179  108.000  0.700    5.97  ?     
 20    3  P      "O3'"  "C3'"  126.362  119.700  1.200    5.55  Y     
 21    3  C2     N3     C4     116.683  111.900  0.500    9.57  ?     
 22    3  C5     C6     N1     115.001  111.500  0.500    7.00  ?     
 23    3  N1     C2     N3     120.727  123.900  0.600   -5.29  ?     
 24    3  N1     C6     O6     116.153  119.900  0.600   -6.25  ?     
 25    3  N3     C4     C5     125.481  128.600  0.500   -6.24  ?     
 26    3  N9     C4     C5     108.166  105.400  0.400    6.92  ?     
 27    3  "O4'"  "C1'"  "C2'"   96.991  105.900  0.800  -11.14  ?     
 28    3  "O4'"  "C1'"  N9     116.566  108.000  0.700   12.24  ?     
 29    3  "O4'"  "C4'"  "C3'"  102.044  104.500  0.400   -6.14  ?     
 30    4  C4     C5     C6     113.220  117.000  0.500   -7.56  ?     
 31    4  C4     C5     N7     114.271  110.700  0.500    7.14  ?     
 32    4  C5     C6     N1     121.876  117.700  0.500    8.35  ?     
 33    4  N1     C6     N6     114.051  118.600  0.600   -7.58  ?     
 34    4  N9     C4     C5     101.450  105.800  0.400  -10.88  ?     
 35    4  "O4'"  "C1'"  N9     114.428  108.000  0.700    9.18  ?     
 36    4  "O4'"  "C4'"  "C3'"  111.829  106.000  0.600    9.71  ?     
 37    5  P      "O3'"  "C3'"  126.186  119.700  1.200    5.41  Y     
 38    5  "C1'"  "O4'"  "C4'"  104.107  110.100  1.000   -5.99  ?     
 39    5  "C4'"  "C3'"  "C2'"   98.273  103.100  0.900   -5.36  ?     
 40    5  C5     C6     N1     117.466  121.000  0.500   -7.07  ?     
 41    5  C6     N1     C2     124.958  120.300  0.400   11.64  ?     
 42    5  N1     C2     N3     115.216  119.200  0.700   -5.69  ?     
 43    5  N1     C2     O2     122.532  118.900  0.600    6.05  ?     
 44    5  "O4'"  "C1'"  N1     116.109  108.000  0.700   11.58  ?     
 45    5  "O4'"  "C4'"  "C3'"  109.377  106.000  0.600    5.63  ?     
 46    6  C2     N3     C4     114.668  111.900  0.500    5.54  ?     
 47    6  C5     N7     C8      98.693  104.300  0.500  -11.21  ?     
 48    6  C6     N1     C2     121.727  125.100  0.600   -5.62  ?     
 49    6  C8     N9     C4     104.123  106.400  0.400   -5.69  ?     
 50    6  N7     C8     N9     118.587  113.100  0.500   10.97  ?     
 51    6  N9     "C1'"  "C2'"  122.446  112.600  1.900    5.18  ?     
 52    6  "O4'"  "C1'"  N9     103.481  108.000  0.700   -6.46  ?     
 53    7  "C4'"  "C3'"  "C2'"   98.431  103.100  0.900   -5.19  ?     
 54    7  C4     C5     C7     122.210  119.000  0.600    5.35  ?     
 55    7  C6     C5     C7     117.286  122.900  0.600   -9.36  ?     
 56    7  N1     C2     N3     117.696  114.600  0.600    5.16  ?     
 57    7  N3     C2     O2     115.705  122.300  0.600  -10.99  ?     
 58    8  C2     N3     C4     113.206  110.600  0.500    5.21  ?     
 59    8  C5     C6     N1     123.803  117.700  0.500   12.21  ?     
 60    8  C6     N1     C2     114.895  118.600  0.600   -6.17  ?     
 61    8  N1     C6     N6     111.658  118.600  0.600  -11.57  ?     
 62    8  N3     C4     N9     133.028  127.400  0.800    7.04  ?     
 63    8  N9     C4     C5     102.810  105.800  0.400   -7.47  ?     
 64    9  C5     C6     N1     115.762  111.500  0.500    8.52  ?     
 65    9  C5     N7     C8     100.192  104.300  0.500   -8.22  ?     
 66    9  C6     N1     C2     120.451  125.100  0.600   -7.75  ?     
 67    9  N1     C6     O6     112.957  119.900  0.600  -11.57  ?     
 68    9  N3     C2     N2     114.527  119.900  0.700   -7.68  ?     
 69    9  N3     C4     C5     125.090  128.600  0.500   -7.02  ?     
 70    9  N3     C4     N9     129.922  126.000  0.600    6.54  ?     
 71    9  N7     C8     N9     118.255  113.100  0.500   10.31  ?     
 72    9  "O4'"  "C1'"  N9     116.261  108.000  0.700   11.80  ?     
 73   10  C5     C6     N1     120.545  123.700  0.600   -5.26  ?     
 74   10  N3     C2     O2     116.979  122.300  0.600   -8.87  ?     
 75   10  N3     C4     O4     124.733  119.900  0.600    8.06  ?     
 76   10  "O4'"  "C1'"  N1     116.663  108.000  0.700   12.38  ?     
 77   11  C4     C5     C6     114.150  118.800  0.600   -7.75  ?     
 78   11  C5     C6     N1     116.612  111.500  0.500   10.22  ?     
 79   11  C6     C5     N7     134.352  130.400  0.600    6.59  ?     
 80   11  N1     C6     O6     116.440  119.900  0.600   -5.77  ?     
 81   11  "O4'"  "C1'"  N9     119.057  108.000  0.700   15.80  ?     
 82   12  C5     C6     O6     125.216  128.600  0.600   -5.64  ?     
 83   12  C8     N9     C4     109.450  106.400  0.400    7.62  ?     
 84   12  N3     C2     N2     114.853  119.900  0.700   -7.21  ?     
 85   12  N9     C4     C5     103.083  105.400  0.400   -5.79  ?     
 86   12  "O4'"  "C1'"  "C2'"  100.202  105.900  0.800   -7.12  ?     
 87   12  "O4'"  "C1'"  N9     121.804  108.000  0.700   19.72  ?     
 88   13  C2     N3     C4     109.372  111.900  0.500   -5.06  ?     
 89   13  C5     C6     O6     132.134  128.600  0.600    5.89  ?     
 90   13  C5     N7     C8     100.383  104.300  0.500   -7.83  ?     
 91   13  C6     N1     C2     121.346  125.100  0.600   -6.26  ?     
 92   13  C8     N9     C4     102.502  106.400  0.400   -9.74  ?     
 93   13  N1     C2     N3     127.868  123.900  0.600    6.61  ?     
 94   13  N1     C6     O6     115.570  119.900  0.600   -7.22  ?     
 95   13  N3     C4     N9     122.382  126.000  0.600   -6.03  ?     
 96   13  N7     C8     N9     115.718  113.100  0.500    5.24  ?     
 97   13  N9     C4     C5     109.491  105.400  0.400   10.23  ?     
 98   13  "O4'"  "C4'"  "C3'"  109.994  106.000  0.600    6.66  ?     
 99   14  C2     N3     C4     109.207  111.900  0.500   -5.38  ?     
100   14  C4     C5     C6     115.107  118.800  0.600   -6.15  ?     
101   14  C4     C5     N7     113.440  110.800  0.400    6.60  ?     
102   14  C5     C6     N1     117.308  111.500  0.500   11.62  ?     
103   14  C5     C6     O6     120.235  128.600  0.600  -13.94  ?     
104   14  C5     N7     C8     101.161  104.300  0.500   -6.28  ?     
105   14  C6     N1     C2     119.000  125.100  0.600  -10.17  ?     
106   14  N1     C2     N3     128.818  123.900  0.600    8.20  ?     
107   14  N3     C2     N2     111.450  119.900  0.700  -12.07  ?     
108   14  N3     C4     N9     129.102  126.000  0.600    5.17  ?     
109   14  N7     C8     N9     116.785  113.100  0.500    7.37  ?     
110   14  N9     C4     C5     101.323  105.400  0.400  -10.19  ?     
111   14  "O4'"  "C1'"  N9     113.139  108.000  0.700    7.34  ?     
112   15  "C1'"  "O4'"  "C4'"  101.743  110.100  1.000   -8.36  ?     
113   15  C6     C5     N7     127.170  130.400  0.600   -5.38  ?     
114   15  N3     C4     C5     123.562  128.600  0.500  -10.08  ?     
115   15  N3     C4     N9     131.904  126.000  0.600    9.84  ?     
116   15  "O4'"  "C4'"  "C3'"  112.154  106.000  0.600   10.26  ?     
117   16  P      "O3'"  "C3'"  128.499  119.700  1.200    7.33  Y     
118   16  C4     C5     C6     113.726  118.800  0.600   -8.46  ?     
119   16  "C5'"  "C4'"  "C3'"  104.584  114.100  1.800   -5.29  ?     
120   16  C5     C6     N1     115.849  111.500  0.500    8.70  ?     
121   16  C5     N7     C8     101.618  104.300  0.500   -5.36  ?     
122   16  C6     C5     N7     134.541  130.400  0.600    6.90  ?     
123   16  N1     C6     O6     114.467  119.900  0.600   -9.05  ?     
124   16  N7     C8     N9     115.866  113.100  0.500    5.53  ?     
125   16  "O4'"  "C1'"  "C2'"  100.412  105.900  0.800   -6.86  ?     
126   16  "O4'"  "C1'"  N9     115.567  108.000  0.700   10.81  ?     
127   17  C4     C5     C6     112.735  117.000  0.500   -8.53  ?     
128   17  C5     C6     N1     124.604  117.700  0.500   13.81  ?     
129   17  C5     N7     C8      98.990  103.900  0.500   -9.82  ?     
130   17  C6     N1     C2     112.848  118.600  0.600   -9.59  ?     
131   17  N1     C6     N6     110.945  118.600  0.600  -12.76  ?     
132   17  "O4'"  "C1'"  N9     102.746  108.000  0.700   -7.51  ?     
133   18  "O3'"  P      "O5'"   91.480  104.000  1.900   -6.59  Y     
134   18  P      "O3'"  "C3'"  126.553  119.700  1.200    5.71  Y     
135   18  C2     N3     C4     116.480  119.900  0.500   -6.84  ?     
136   18  C5     C6     N1     123.824  121.000  0.500    5.65  ?     
137   18  C6     N1     "C1'"  128.522  120.800  1.200    6.43  ?     
138   18  C6     N1     C2     114.613  120.300  0.400  -14.22  ?     
139   18  N1     C2     N3     124.196  119.200  0.700    7.14  ?     
140   18  N1     C2     O2     122.930  118.900  0.600    6.72  ?     
141   18  N3     C2     O2     112.277  121.900  0.700  -13.75  ?     
142   18  N3     C4     C5     124.516  121.900  0.400    6.54  ?     
143   18  "O4'"  "C1'"  N1     117.204  108.000  0.700   13.15  ?     
144   19  "C3'"  "C2'"  "C1'"   93.967  102.500  1.200   -7.11  ?     
145   19  C4     C5     N7     107.421  110.800  0.400   -8.45  ?     
146   19  C5     N7     C8     106.881  104.300  0.500    5.16  ?     
147   19  C6     C5     N7     134.309  130.400  0.600    6.51  ?     
148   19  "O4'"  "C1'"  "C2'"  101.515  105.900  0.800   -5.48  ?     
149   19  "O4'"  "C1'"  N9     111.995  108.000  0.700    5.71  ?     
150   20  C4     C5     C6     121.627  118.000  0.600    6.05  ?     
151   20  C5     C4     O4     133.155  124.900  0.700   11.79  ?     
152   20  C6     C5     C7     118.185  122.900  0.600   -7.86  ?     
153   20  C6     N1     C2     118.651  121.300  0.500   -5.30  ?     
154   20  N1     C2     O2     119.033  123.100  0.800   -5.08  ?     
155   20  N3     C4     O4     114.202  119.900  0.600   -9.50  ?     
156   21  OP2    P      "O3'"  118.014  105.200  2.200    5.83  Y     
157   21  C2     N3     C4     116.421  110.600  0.500   11.64  ?     
158   21  C4     C5     N7     108.092  110.700  0.500   -5.22  ?     
159   21  N1     C2     N3     124.802  129.300  0.500   -9.00  ?     
160   21  N3     C4     C5     121.342  126.800  0.700   -7.80  ?     
161   21  N9     "C1'"  "C2'"  122.122  112.600  1.900    5.01  ?     
162   21  N9     C4     C5     108.662  105.800  0.400    7.16  ?     
163   22  P      "O3'"  "C3'"  127.143  119.700  1.200    6.20  Y     
164   22  C2     N3     C4     116.476  111.900  0.500    9.15  ?     
165   22  C5     C6     N1     115.283  111.500  0.500    7.57  ?     
166   22  C5     N7     C8     101.607  104.300  0.500   -5.39  ?     
167   22  C8     N9     C4     104.141  106.400  0.400   -5.65  ?     
168   22  N1     C6     O6     115.048  119.900  0.600   -8.09  ?     
169   22  N3     C4     C5     125.575  128.600  0.500   -6.05  ?     
170   22  N9     C4     C5     107.413  105.400  0.400    5.03  ?     
171   22  "O4'"  "C1'"  N9     111.612  108.000  0.700    5.16  ?     
172   22  "O4'"  "C4'"  "C3'"   99.515  106.000  0.600  -10.81  ?     
173   23  C4     C5     C6     121.790  118.000  0.600    6.32  ?     
174   23  C6     C5     C7     119.085  122.900  0.600   -6.36  ?     
175   23  C6     N1     C2     118.008  121.300  0.500   -6.58  ?     
176   23  N3     C2     O2     117.834  122.300  0.600   -7.44  ?     
177   23  N3     C4     O4     123.352  119.900  0.600    5.75  ?     
178   23  "O4'"  "C1'"  "C2'"  100.008  105.900  0.800   -7.37  ?     
179   23  "O4'"  "C1'"  N1     113.294  108.000  0.700    7.56  ?     
180   23  "O4'"  "C4'"  "C3'"  109.490  106.000  0.600    5.82  ?     
181   24  C4     C5     N7     108.338  110.800  0.400   -6.16  ?     
182   24  C6     C5     N7     133.702  130.400  0.600    5.50  ?     
183   24  C8     N9     C4     104.216  106.400  0.400   -5.46  ?     
184   24  "O4'"  "C1'"  "C2'"  100.333  105.900  0.800   -6.96  ?     
185   25  "C1'"  "O4'"  "C4'"  104.501  110.100  1.000   -5.60  ?     
186   25  C4     C5     C6     121.874  118.800  0.600    5.12  ?     
187   25  C4     C5     N7     107.489  110.800  0.400   -8.28  ?     
188   25  N3     C2     N2     115.582  119.900  0.700   -6.17  ?     
189   25  N3     C4     C5     124.039  128.600  0.500   -9.12  ?     
190   25  N9     C4     C5     109.714  105.400  0.400   10.79  ?     
191   25  "O4'"  "C1'"  "C2'"  101.420  105.900  0.800   -5.60  ?     
192   25  "O4'"  "C4'"  "C3'"  109.514  106.000  0.600    5.86  ?     
193   26  "C4'"  "C3'"  "C2'"   97.365  103.100  0.900   -6.37  ?     
194   26  C4     C5     N7     107.910  110.800  0.400   -7.22  ?     
195   26  N3     C2     N2     115.784  119.900  0.700   -5.88  ?     
196   26  N3     C4     C5     125.140  128.600  0.500   -6.92  ?     
197   26  N9     C4     C5     107.928  105.400  0.400    6.32  ?     
198   26  "O4'"  "C1'"  "C2'"   99.451  105.900  0.800   -8.06  ?     
199   26  "O4'"  "C1'"  N9     118.010  108.000  0.700   14.30  ?     
200   26  "O4'"  "C4'"  "C3'"  109.235  106.000  0.600    5.39  ?     
201   29  C4     C5     N7     113.560  110.800  0.400    6.90  ?     
202   29  C5     C6     N1     115.796  111.500  0.500    8.59  ?     
203   29  C5     N7     C8     100.868  104.300  0.500   -6.86  ?     
204   29  N3     C2     N2     115.925  119.900  0.700   -5.68  ?     
205   29  "O4'"  "C1'"  N9     115.003  108.000  0.700   10.01  ?     
206   30  C5     N7     C8      99.963  104.300  0.500   -8.67  ?     
207   30  C6     C5     N7     126.086  130.400  0.600   -7.19  ?     
208   30  C8     N9     "C1'"  135.160  127.000  1.300    6.28  ?     
209   30  C8     N9     C4     102.148  106.400  0.400  -10.63  ?     
210   30  N9     C4     C5     109.029  105.400  0.400    9.07  ?     
211   30  "O4'"  "C1'"  "C2'"   99.134  105.900  0.800   -8.46  ?     
212   30  "O4'"  "C1'"  N9     113.487  108.000  0.700    7.84  ?     
213   31  C2     N3     C4     115.108  111.900  0.500    6.42  ?     
214   31  C4     C5     C6     115.071  118.800  0.600   -6.21  ?     
215   31  C6     C5     N7     134.422  130.400  0.600    6.70  ?     
216   31  C6     N1     C2     121.603  125.100  0.600   -5.83  ?     
217   31  C8     N9     "C1'"  133.862  127.000  1.300    5.28  ?     
218   31  C8     N9     C4     100.662  106.400  0.400  -14.35  ?     
219   31  N1     C6     O6     116.781  119.900  0.600   -5.20  ?     
220   31  N3     C4     N9     121.609  126.000  0.600   -7.32  ?     
221   31  N7     C8     N9     118.734  113.100  0.500   11.27  ?     
222   31  N9     C4     C5     107.582  105.400  0.400    5.45  ?     
223   31  "O4'"  "C1'"  "C2'"   98.712  105.900  0.800   -8.98  ?     
224   31  "O4'"  "C1'"  N9     115.957  108.000  0.700   11.37  ?     
225   32  C5     C6     N1     124.998  117.700  0.500   14.60  ?     
226   32  C5     N7     C8     100.798  103.900  0.500   -6.20  ?     
227   32  C6     N1     C2     113.540  118.600  0.600   -8.43  ?     
228   32  C8     N9     C4     102.840  105.800  0.400   -7.40  ?     
229   32  N1     C6     N6     109.004  118.600  0.600  -15.99  ?     
230   32  N7     C8     N9     117.033  113.800  0.500    6.46  ?     
231   33  "C1'"  "O4'"  "C4'"  101.972  110.100  1.000   -8.13  ?     
232   33  C6     N1     C2     116.611  120.300  0.400   -9.22  ?     
233   33  N1     C2     O2     125.155  118.900  0.600   10.42  ?     
234   33  N3     C2     O2     114.632  121.900  0.700  -10.38  ?     
235   33  "O4'"  "C4'"  "C3'"  112.763  106.000  0.600   11.27  ?     
236   34  C4     N9     "C1'"  119.987  126.500  1.300   -5.01  ?     
237   34  C5     C6     N1     114.109  111.500  0.500    5.22  ?     
238   34  C8     N9     "C1'"  133.781  127.000  1.300    5.22  ?     
239   34  N3     C4     C5     125.976  128.600  0.500   -5.25  ?     
240   34  "O4'"  "C1'"  "C2'"  100.886  105.900  0.800   -6.27  ?     
241   34  "O4'"  "C4'"  "C3'"  109.769  106.000  0.600    6.28  ?     
242   34  P      "O5'"  "C5'"  112.648  120.900  1.600   -5.16  ?     
243   35  "C4'"  "C3'"  "C2'"   94.020  103.100  0.900  -10.09  ?     
244   35  C6     N1     C2     118.296  121.300  0.500   -6.01  ?     
245   35  N1     C2     N3     117.679  114.600  0.600    5.13  ?     
246   35  "O4'"  "C1'"  "C2'"  101.487  105.900  0.800   -5.52  ?     
247   35  "O4'"  "C1'"  N1     124.037  108.000  0.700   22.91  ?     
248   35  "O4'"  "C4'"  "C3'"  111.125  106.000  0.600    8.54  ?     
249   36  P      "O3'"  "C3'"  126.075  119.700  1.200    5.31  Y     
250   36  C4     C5     N7     107.115  110.700  0.500   -7.17  ?     
251   36  C5     C6     N1     121.384  117.700  0.500    7.37  ?     
252   36  C6     N1     C2     113.451  118.600  0.600   -8.58  ?     
253   36  N1     C2     N3     134.558  129.300  0.500   10.52  ?     
254   36  N1     C6     N6     113.748  118.600  0.600   -8.09  ?     
255   36  "O4'"  "C1'"  N9     102.608  108.000  0.700   -7.70  ?     
256   37  P      "O3'"  "C3'"  126.321  119.700  1.200    5.52  Y     
257   37  C5     C6     N1     115.028  111.500  0.500    7.05  ?     
258   37  C8     N9     C4     102.803  106.400  0.400   -8.99  ?     
259   37  N3     C4     C5     125.787  128.600  0.500   -5.63  ?     
260   37  N7     C8     N9     116.022  113.100  0.500    5.84  ?     
261   37  "O4'"  "C1'"  N9     113.131  108.000  0.700    7.33  ?     
262   37  "O4'"  "C4'"  "C3'"  100.785  106.000  0.600   -8.69  ?     
263   38  P      "O3'"  "C3'"  127.671  119.700  1.200    6.64  Y     
264   38  C4     C5     C6     122.446  118.000  0.600    7.41  ?     
265   38  C5     C6     N1     120.500  123.700  0.600   -5.33  ?     
266   38  C6     C5     C7     119.777  122.900  0.600   -5.21  ?     
267   39  "C1'"  "O4'"  "C4'"  104.864  110.100  1.000   -5.24  ?     
268   39  "C4'"  "C3'"  "C2'"   96.781  103.100  0.900   -7.02  ?     
269   39  C5     N7     C8     100.235  104.300  0.500   -8.13  ?     
270   39  C8     N9     C4     101.461  106.400  0.400  -12.35  ?     
271   39  N3     C4     C5     125.915  128.600  0.500   -5.37  ?     
272   39  N7     C8     N9     117.390  113.100  0.500    8.58  ?     
273   39  N9     C4     C5     109.424  105.400  0.400   10.06  ?     
274   39  "O4'"  "C4'"  "C3'"  109.524  106.000  0.600    5.87  ?     
275   40  P      "O3'"  "C3'"  126.057  119.700  1.200    5.30  Y     
276   40  "C1'"  "O4'"  "C4'"   99.248  110.100  1.000  -10.85  ?     
277   40  "C4'"  "C3'"  "C2'"   96.015  103.100  0.900   -7.87  ?     
278   40  C5     C6     O6     132.270  128.600  0.600    6.12  ?     
279   40  N1     C6     O6     116.588  119.900  0.600   -5.52  ?     
280   40  N9     C4     C5     102.898  105.400  0.400   -6.25  ?     
281   40  "O4'"  "C1'"  N9     115.318  108.000  0.700   10.45  ?     
282   40  "O4'"  "C4'"  "C3'"  112.953  106.000  0.600   11.59  ?     
283   41  C2     N3     C4     114.408  111.900  0.500    5.02  ?     
284   41  "C4'"  "C3'"  "C2'"   98.073  103.100  0.900   -5.58  ?     
285   41  C5     C6     N1     114.764  111.500  0.500    6.53  ?     
286   41  C5     C6     O6     132.970  128.600  0.600    7.28  ?     
287   41  C6     N1     C2     121.121  125.100  0.600   -6.63  ?     
288   41  N1     C6     O6     112.204  119.900  0.600  -12.83  ?     
289   41  N3     C2     N2     114.686  119.900  0.700   -7.45  ?     
290   41  N3     C4     C5     123.407  128.600  0.500  -10.39  ?     
291   41  N3     C4     N9     130.853  126.000  0.600    8.09  ?     
292   41  "O4'"  "C1'"  "C2'"   97.974  105.900  0.800   -9.91  ?     
293   42  C5     N7     C8     107.651  104.300  0.500    6.70  ?     
294   42  N3     C2     N2     114.712  119.900  0.700   -7.41  ?     
295   42  N3     C4     C5     125.739  128.600  0.500   -5.72  ?     
296   42  N7     C8     N9     109.877  113.100  0.500   -6.45  ?     
297   42  "O4'"  "C1'"  N9     119.267  108.000  0.700   16.10  ?     
298   42  "O4'"  "C4'"  "C3'"  110.660  106.000  0.600    7.77  ?     
299   43  "C1'"  "O4'"  "C4'"  101.430  110.100  1.000   -8.67  ?     
300   43  C2     N3     C4     115.562  111.900  0.500    7.32  ?     
301   43  C4     C5     N7     107.923  110.800  0.400   -7.19  ?     
302   43  C6     C5     N7     133.445  130.400  0.600    5.08  ?     
303   43  C6     N1     C2     120.635  125.100  0.600   -7.44  ?     
304   43  C8     N9     C4     104.301  106.400  0.400   -5.25  ?     
305   43  N1     C2     N3     127.307  123.900  0.600    5.68  ?     
306   43  N1     C6     O6     115.070  119.900  0.600   -8.05  ?     
307   43  N3     C2     N2     111.982  119.900  0.700  -11.31  ?     
308   43  N3     C4     C5     122.924  128.600  0.500  -11.35  ?     
309   43  N9     C4     C5     108.451  105.400  0.400    7.63  ?     
310   43  "O4'"  "C1'"  N9     118.994  108.000  0.700   15.71  ?     
311   44  P      "O3'"  "C3'"  130.170  119.700  1.200    8.72  Y     
312   44  "C1'"  "O4'"  "C4'"  104.203  110.100  1.000   -5.90  ?     
313   44  C4     C5     C6     121.969  118.800  0.600    5.28  ?     
314   44  "C5'"  "C4'"  "C3'"  102.785  114.100  1.800   -6.29  ?     
315   44  C5     C6     O6     134.403  128.600  0.600    9.67  ?     
316   44  C6     N1     C2     121.749  125.100  0.600   -5.58  ?     
317   44  N1     C2     N3     128.890  123.900  0.600    8.32  ?     
318   44  N1     C6     O6     114.928  119.900  0.600   -8.29  ?     
319   44  N3     C2     N2     112.438  119.900  0.700  -10.66  ?     
320   44  N3     C4     C5     124.364  128.600  0.500   -8.47  ?     
321   45  C2     N3     C4     113.551  110.600  0.500    5.90  ?     
322   45  C5     C6     N1     121.187  117.700  0.500    6.97  ?     
323   45  N3     C4     C5     121.928  126.800  0.700   -6.96  ?     
324   45  "O4'"  "C4'"  "C3'"  109.602  106.000  0.600    6.00  ?     
325   46  C2     N1     "C1'"  125.143  118.800  1.100    5.77  ?     
326   46  C5     C4     N4     124.026  120.200  0.700    5.46  ?     
327   46  C6     N1     C2     117.569  120.300  0.400   -6.83  ?     
328   46  N1     C2     N3     123.094  119.200  0.700    5.56  ?     
329   46  N3     C2     O2     116.261  121.900  0.700   -8.05  ?     
330   46  N3     C4     N4     112.251  118.000  0.700   -8.21  ?     
331   46  "O4'"  "C1'"  N1     115.668  108.000  0.700   10.95  ?     
332   47  C2     N3     C4     115.013  111.900  0.500    6.23  ?     
333   47  C5     C6     O6     136.063  128.600  0.600   12.44  ?     
334   47  N1     C2     N2     123.482  116.200  0.900    8.09  ?     
335   47  N1     C6     O6     112.650  119.900  0.600  -12.08  ?     
336   47  N3     C2     N2     112.124  119.900  0.700  -11.11  ?     
337   47  N3     C4     C5     125.990  128.600  0.500   -5.22  ?     
338   47  N3     C4     N9     129.337  126.000  0.600    5.56  ?     
339   47  "O4'"  "C4'"  "C3'"  112.395  106.000  0.600   10.66  ?     
340   48  "C4'"  "C3'"  "C2'"   98.016  103.100  0.900   -5.65  ?     
341   48  C5     C4     O4     129.047  124.900  0.700    5.92  ?     
342   48  C6     C5     C7     118.494  122.900  0.600   -7.34  ?     
343   48  C6     N1     C2     117.772  121.300  0.500   -7.06  ?     
344   48  "O4'"  "C1'"  "C2'"   98.929  105.900  0.800   -8.71  ?     
345   48  "O4'"  "C1'"  N1     117.483  108.000  0.700   13.55  ?     
346   49  C2     N3     C4     114.217  110.600  0.500    7.23  ?     
347   49  C4     C5     N7     113.228  110.700  0.500    5.05  ?     
348   49  C5     C6     N1     121.894  117.700  0.500    8.39  ?     
349   49  C5     N7     C8      99.415  103.900  0.500   -8.97  ?     
350   49  C8     N9     C4     101.850  105.800  0.400   -9.88  ?     
351   49  N1     C6     N6     114.041  118.600  0.600   -7.60  ?     
352   49  N7     C8     N9     119.668  113.800  0.500   11.74  ?     
353   50  P      "O3'"  "C3'"  127.054  119.700  1.200    6.13  Y     
354   50  C2     N3     C4     107.908  111.900  0.500   -7.99  ?     
355   50  "C4'"  "C3'"  "O3'"  124.183  109.700  2.500    5.79  ?     
356   50  C5     C6     O6     132.728  128.600  0.600    6.88  ?     
357   50  C5     N7     C8     106.875  104.300  0.500    5.15  ?     
358   50  C8     N9     C4     109.867  106.400  0.400    8.67  ?     
359   50  N1     C2     N3     130.813  123.900  0.600   11.52  ?     
360   50  N1     C6     O6     116.844  119.900  0.600   -5.09  ?     
361   50  N3     C2     N2     114.088  119.900  0.700   -8.30  ?     
362   50  N3     C4     C5     125.997  128.600  0.500   -5.21  ?     
363   50  N3     C4     N9     130.714  126.000  0.600    7.86  ?     
364   50  N9     C4     C5     101.896  105.400  0.400   -8.76  ?     
365   51  P      "O3'"  "C3'"  127.395  119.700  1.200    6.41  Y     
366   51  C4     C5     C7     123.161  119.000  0.600    6.93  ?     
367   51  C5     C4     O4     129.883  124.900  0.700    7.12  ?     
368   51  N3     C4     O4     113.705  119.900  0.600  -10.32  ?     
369   51  "O4'"  "C1'"  N1     101.710  108.000  0.700   -8.99  ?     
370   52  C4     C5     N7     105.709  110.800  0.400  -12.73  ?     
371   52  C6     C5     N7     136.843  130.400  0.600   10.74  ?     
372   52  C8     N9     C4     101.177  106.400  0.400  -13.06  ?     
373   52  N3     C4     C5     125.422  128.600  0.500   -6.36  ?     
374   52  N7     C8     N9     117.270  113.100  0.500    8.34  ?     
375   52  N9     C4     C5     108.915  105.400  0.400    8.79  ?     
376   52  "O5'"  P      OP1    100.760  105.700  0.900   -5.49  ?     
377   53  C2     N3     C4     114.948  111.900  0.500    6.10  ?     
378   53  "C3'"  "C2'"  "C1'"   95.963  102.500  1.200   -5.45  ?     
379   53  "C4'"  "C3'"  "C2'"  108.117  103.100  0.900    5.57  ?     
380   53  C4     C5     C6     114.417  118.800  0.600   -7.30  ?     
381   53  C4     C5     N7     114.937  110.800  0.400   10.34  ?     
382   53  C5     C6     N1     116.120  111.500  0.500    9.24  ?     
383   53  C5     N7     C8     101.162  104.300  0.500   -6.28  ?     
384   53  N1     C6     O6     116.174  119.900  0.600   -6.21  ?     
385   53  N3     C4     N9     131.416  126.000  0.600    9.03  ?     
386   53  N9     C4     C5     102.100  105.400  0.400   -8.25  ?     
387   53  "O4'"  "C1'"  N9     118.196  108.000  0.700   14.57  ?     
388   54  C6     C5     N7     125.938  130.400  0.600   -7.44  ?     
389   54  N1     C6     O6     116.132  119.900  0.600   -6.28  ?     
390   54  N3     C2     N2     116.036  119.900  0.700   -5.52  ?     
391   57  C2     N3     C4     114.808  111.900  0.500    5.82  ?     
392   57  "C4'"  "C3'"  "C2'"   97.275  103.100  0.900   -6.47  ?     
393   57  C4     C5     N7     114.688  110.800  0.400    9.72  ?     
394   57  C5     C6     N1     115.338  111.500  0.500    7.68  ?     
395   57  C5     C6     O6     133.997  128.600  0.600    8.99  ?     
396   57  C5     N7     C8      99.045  104.300  0.500  -10.51  ?     
397   57  C6     N1     C2     121.607  125.100  0.600   -5.82  ?     
398   57  C8     N9     C4     100.899  106.400  0.400  -13.75  ?     
399   57  N1     C6     O6     110.641  119.900  0.600  -15.43  ?     
400   57  N3     C2     N2     114.670  119.900  0.700   -7.47  ?     
401   57  N3     C4     C5     125.719  128.600  0.500   -5.76  ?     
402   57  N7     C8     N9     118.025  113.100  0.500    9.85  ?     
403   58  C2     N3     C4     114.815  111.900  0.500    5.83  ?     
404   58  C4     C5     N7     107.849  110.800  0.400   -7.38  ?     
405   58  C5     C6     N1     114.495  111.500  0.500    5.99  ?     
406   58  C8     N9     C4     103.198  106.400  0.400   -8.01  ?     
407   58  N3     C2     N2     115.087  119.900  0.700   -6.88  ?     
408   58  N3     C4     C5     123.372  128.600  0.500  -10.46  ?     
409   58  N7     C8     N9     117.758  113.100  0.500    9.32  ?     
410   58  N9     "C1'"  "C2'"  123.385  112.600  1.900    5.68  ?     
411   58  N9     C4     C5     108.642  105.400  0.400    8.11  ?     
412   59  C2     N3     C4     114.957  111.900  0.500    6.11  ?     
413   59  "C3'"  "C2'"  "C1'"  108.578  102.500  1.200    5.07  ?     
414   59  C6     N1     C2     120.731  125.100  0.600   -7.28  ?     
415   59  C8     N9     C4     103.938  106.400  0.400   -6.15  ?     
416   59  N1     C6     O6     115.880  119.900  0.600   -6.70  ?     
417   59  N3     C4     C5     124.895  128.600  0.500   -7.41  ?     
418   59  "O4'"  "C1'"  N9     116.265  108.000  0.700   11.81  ?     
419   59  "O4'"  "C4'"  "C3'"  112.821  106.000  0.600   11.37  ?     
420   60  "C1'"  "O4'"  "C4'"  105.069  110.100  1.000   -5.03  ?     
421   60  C2     N3     C4     114.644  110.600  0.500    8.09  ?     
422   60  C4     C5     C6     109.117  117.000  0.500  -15.77  ?     
423   60  C4     C5     N7     116.674  110.700  0.500   11.95  ?     
424   60  C5     C6     N1     127.392  117.700  0.500   19.38  ?     
425   60  C5     N7     C8     101.355  103.900  0.500   -5.09  ?     
426   60  N1     C2     N3     125.532  129.300  0.500   -7.54  ?     
427   60  N1     C6     N6     108.620  118.600  0.600  -16.63  ?     
428   60  N3     C4     N9     132.185  127.400  0.800    5.98  ?     
429   60  N9     C4     C5     100.995  105.800  0.400  -12.01  ?     
430   60  "O4'"  "C1'"  N9     113.489  108.000  0.700    7.84  ?     
431   61  "C1'"  "O4'"  "C4'"  104.202  110.100  1.000   -5.90  ?     
432   61  C2     N3     C4     122.742  119.900  0.500    5.68  ?     
433   61  "C3'"  "C2'"  "C1'"   96.494  102.500  1.200   -5.00  ?     
434   61  C4     C5     C6     120.335  117.400  0.500    5.87  ?     
435   61  C5     C4     N4     124.403  120.200  0.700    6.00  ?     
436   61  C6     N1     C2     117.880  120.300  0.400   -6.05  ?     
437   61  N3     C4     C5     119.831  121.900  0.400   -5.17  ?     
438   62  "C5'"  "C4'"  "O4'"   99.798  109.300  1.900   -5.00  ?     
439   62  C5     C6     N1     114.826  111.500  0.500    6.65  ?     
440   62  C5     C6     O6     124.901  128.600  0.600   -6.17  ?     
441   62  C8     N9     C4     111.051  106.400  0.400   11.63  ?     
442   62  N3     C4     N9     130.490  126.000  0.600    7.48  ?     
443   62  N9     C4     C5     101.956  105.400  0.400   -8.61  ?     
444   63  C2     N3     C4     123.922  127.200  0.600   -5.46  ?     
445   63  "C4'"  "C3'"  "C2'"   96.581  103.100  0.900   -7.24  ?     
446   63  C4     C5     C7     123.218  119.000  0.600    7.03  ?     
447   63  C6     C5     C7     116.986  122.900  0.600   -9.86  ?     
448   63  C6     N1     C2     116.903  121.300  0.500   -8.79  ?     
449   63  N1     C2     N3     119.749  114.600  0.600    8.58  ?     
450   63  N3     C2     O2     116.503  122.300  0.600   -9.66  ?     
451   63  "O4'"  "C1'"  "C2'"  100.399  105.900  0.800   -6.88  ?     
452   63  "O4'"  "C1'"  N1     113.429  108.000  0.700    7.76  ?     
453   64  C4     C5     C6     114.476  117.000  0.500   -5.05  ?     
454   64  C5     C6     N1     122.320  117.700  0.500    9.24  ?     
455   64  C5     N7     C8     101.392  103.900  0.500   -5.02  ?     
456   64  C6     N1     C2     114.523  118.600  0.600   -6.79  ?     
457   64  N1     C2     N3     132.357  129.300  0.500    6.12  ?     
458   64  N1     C6     N6     114.638  118.600  0.600   -6.60  ?     
459   64  N7     C8     N9     117.344  113.800  0.500    7.09  ?     
460   65  "O3'"  P      "O5'"   94.405  104.000  1.900   -5.05  Y     
461   65  OP1    P      "O3'"  116.586  105.200  2.200    5.17  Y     
462   65  P      "O3'"  "C3'"  128.408  119.700  1.200    7.26  Y     
463   65  "C4'"  "C3'"  "C2'"   93.513  103.100  0.900  -10.65  ?     
464   65  C4     C5     C6     122.907  118.800  0.600    6.84  ?     
465   65  C4     C5     N7     108.283  110.800  0.400   -6.29  ?     
466   65  C8     N9     C4     100.489  106.400  0.400  -14.78  ?     
467   65  N1     C2     N2     122.522  116.200  0.900    7.02  ?     
468   65  N3     C2     N2     113.815  119.900  0.700   -8.69  ?     
469   65  N3     C4     C5     124.336  128.600  0.500   -8.53  ?     
470   65  N7     C8     N9     116.856  113.100  0.500    7.51  ?     
471   65  N9     C4     C5     109.168  105.400  0.400    9.42  ?     
472   65  "O4'"  "C1'"  N9     114.226  108.000  0.700    8.89  ?     
473   66  "C4'"  "C3'"  "C2'"  110.002  103.100  0.900    7.67  ?     
474   66  C4     C5     C6     122.879  118.000  0.600    8.13  ?     
475   66  C5     C6     N1     120.191  123.700  0.600   -5.85  ?     
476   66  C6     C5     C7     117.254  122.900  0.600   -9.41  ?     
477   67  C4     C5     C6     112.952  118.800  0.600   -9.75  ?     
478   67  C4     C5     N7     113.856  110.800  0.400    7.64  ?     
479   67  C5     C6     N1     118.173  111.500  0.500   13.35  ?     
480   67  C5     C6     O6     124.805  128.600  0.600   -6.33  ?     
481   67  C6     N1     C2     119.903  125.100  0.600   -8.66  ?     
482   67  N1     C6     O6     116.195  119.900  0.600   -6.17  ?     
483   67  N9     C4     C5     102.964  105.400  0.400   -6.09  ?     
484   68  "C1'"  "O4'"  "C4'"  101.364  110.100  1.000   -8.74  ?     
485   68  "C3'"  "C2'"  "C1'"   94.461  102.500  1.200   -6.70  ?     
486   68  C5     C6     N1     116.063  111.500  0.500    9.13  ?     
487   68  C6     N1     C2     120.367  125.100  0.600   -7.89  ?     
488   68  C8     N9     C4     103.974  106.400  0.400   -6.07  ?     
489   68  "O4'"  "C1'"  N9     121.959  108.000  0.700   19.94  ?     
490   69  C4     C5     C6     114.784  118.800  0.600   -6.69  ?     
491   69  C4     C5     N7     116.051  110.800  0.400   13.13  ?     
492   69  C5     C6     N1     114.138  111.500  0.500    5.28  ?     
493   69  C5     N7     C8     100.118  104.300  0.500   -8.36  ?     
494   69  N9     C4     C5     102.371  105.400  0.400   -7.57  ?     
495   69  "O4'"  "C1'"  N9     111.888  108.000  0.700    5.55  ?     
496   69  "O4'"  "C4'"  "C3'"  109.810  106.000  0.600    6.35  ?     
497   70  C2     N3     C4     116.859  111.900  0.500    9.92  ?     
498   70  "C4'"  "C3'"  "C2'"   96.403  103.100  0.900   -7.44  ?     
499   70  C4     C5     N7     106.597  110.800  0.400  -10.51  ?     
500   70  C5     C6     N1     116.058  111.500  0.500    9.12  ?     
501   70  C5     C6     O6     125.514  128.600  0.600   -5.14  ?     
502   70  C5     N7     C8     106.927  104.300  0.500    5.25  ?     
503   70  C6     C5     N7     137.051  130.400  0.600   11.09  ?     
504   70  N1     C2     N2     122.781  116.200  0.900    7.31  ?     
505   70  N1     C2     N3     119.451  123.900  0.600   -7.42  ?     
506   70  N9     C4     C5     107.825  105.400  0.400    6.06  ?     
507   70  "O4'"  "C1'"  N9     117.807  108.000  0.700   14.01  ?     
508   71  C4     C5     N7     114.680  110.800  0.400    9.70  ?     
509   71  C5     C6     N1     117.546  111.500  0.500   12.09  ?     
510   71  C5     C6     O6     124.601  128.600  0.600   -6.67  ?     
511   71  C5     N7     C8     100.429  104.300  0.500   -7.74  ?     
512   71  C6     N1     C2     118.367  125.100  0.600  -11.22  ?     
513   71  C8     N9     C4      98.678  106.400  0.400  -19.31  ?     
514   71  N3     C2     N2     114.456  119.900  0.700   -7.78  ?     
515   71  N7     C8     N9     117.953  113.100  0.500    9.71  ?     
516   71  N9     C4     C5     108.257  105.400  0.400    7.14  ?     
517   71  "O4'"  "C1'"  "C2'"  101.057  105.900  0.800   -6.05  ?     
518   71  "O4'"  "C1'"  N9     114.207  108.000  0.700    8.87  ?     
519   72  C2     N3     C4     115.119  111.900  0.500    6.44  ?     
520   72  C4     C5     C6     115.470  118.800  0.600   -5.55  ?     
521   72  C4     N9     "C1'"  119.065  126.500  1.300   -5.72  ?     
522   72  C5     C6     N1     115.128  111.500  0.500    7.26  ?     
523   72  C5     C6     O6     134.344  128.600  0.600    9.57  ?     
524   72  C6     C5     N7     134.710  130.400  0.600    7.18  ?     
525   72  C8     N9     "C1'"  138.045  127.000  1.300    8.50  ?     
526   72  C8     N9     C4     102.243  106.400  0.400  -10.39  ?     
527   72  N1     C6     O6     110.515  119.900  0.600  -15.64  ?     
528   72  N9     C4     C5     107.698  105.400  0.400    5.75  ?     
529   72  "O4'"  "C1'"  N9     113.858  108.000  0.700    8.37  ?     
530   73  C4     C5     C6     112.156  117.000  0.500   -9.69  ?     
531   73  C5     C6     N1     122.308  117.700  0.500    9.22  ?     
532   73  C5     C6     N6     119.386  123.700  0.800   -5.39  ?     
533   73  C5     N7     C8     100.523  103.900  0.500   -6.75  ?     
534   73  C6     C5     N7     137.037  132.300  0.700    6.77  ?     
535   73  N7     C8     N9     117.124  113.800  0.500    6.65  ?     
536   74  C4     C5     C6     114.857  117.400  0.500   -5.09  ?     
537   74  C5     C4     N4     124.123  120.200  0.700    5.60  ?     
538   74  N1     C2     O2     123.871  118.900  0.600    8.29  ?     
539   74  N3     C2     O2     117.660  121.900  0.700   -6.06  ?     
540   74  N3     C4     N4     112.641  118.000  0.700   -7.66  ?     
541   74  "O4'"  "C1'"  N1     111.553  108.000  0.700    5.08  ?     
542   75  C2     N3     C4     114.571  111.900  0.500    5.34  ?     
543   75  C4     C5     N7     108.607  110.800  0.400   -5.48  ?     
544   75  C5     C6     N1     116.227  111.500  0.500    9.45  ?     
545   75  C5     N7     C8     101.237  104.300  0.500   -6.13  ?     
546   75  C6     C5     N7     134.052  130.400  0.600    6.09  ?     
547   75  C6     N1     C2     119.885  125.100  0.600   -8.69  ?     
548   75  C8     N9     C4     101.239  106.400  0.400  -12.90  ?     
549   75  N1     C6     O6     115.887  119.900  0.600   -6.69  ?     
550   75  N3     C4     N9     120.275  126.000  0.600   -9.54  ?     
551   75  N7     C8     N9     117.143  113.100  0.500    8.09  ?     
552   75  N9     C4     C5     110.809  105.400  0.400   13.52  ?     
553   75  "O4'"  "C1'"  N9     117.055  108.000  0.700   12.94  ?     
554   75  "O4'"  "C4'"  "C3'"  109.577  106.000  0.600    5.96  ?     
555   76  "C4'"  "C3'"  "C2'"   97.102  103.100  0.900   -6.67  ?     
556   76  C6     N1     C2     117.102  121.300  0.500   -8.40  ?     
557   76  N1     C2     N3     117.964  114.600  0.600    5.61  ?     
558   76  N3     C2     O2     116.926  122.300  0.600   -8.96  ?     
559   76  "O4'"  "C1'"  "C2'"   98.472  105.900  0.800   -9.29  ?     
560   76  "O4'"  "C1'"  N1     116.808  108.000  0.700   12.58  ?     
561   77  P      "O3'"  "C3'"  129.354  119.700  1.200    8.04  Y     
562   77  C2     N3     C4     116.244  110.600  0.500   11.29  ?     
563   77  C4     C5     C6     114.371  117.000  0.500   -5.26  ?     
564   77  C5     C6     N1     126.722  117.700  0.500   18.04  ?     
565   77  C5     N7     C8     100.514  103.900  0.500   -6.77  ?     
566   77  C6     N1     C2     109.685  118.600  0.600  -14.86  ?     
567   77  C8     N9     C4     102.899  105.800  0.400   -7.25  ?     
568   77  N1     C6     N6     110.943  118.600  0.600  -12.76  ?     
569   77  N3     C4     C5     122.474  126.800  0.700   -6.18  ?     
570   77  N3     C4     N9     131.920  127.400  0.800    5.65  ?     
571   77  N7     C8     N9     117.237  113.800  0.500    6.88  ?     
572   78  P      "O3'"  "C3'"  128.169  119.700  1.200    7.06  Y     
573   78  C4     C5     C6     113.985  118.800  0.600   -8.03  ?     
574   78  C5     C6     N1     115.228  111.500  0.500    7.46  ?     
575   78  C6     C5     N7     133.801  130.400  0.600    5.67  ?     
576   78  N1     C6     O6     115.508  119.900  0.600   -7.32  ?     
577   78  N3     C2     N2     115.350  119.900  0.700   -6.50  ?     
578   78  N9     C4     C5     102.761  105.400  0.400   -6.60  ?     
579   79  C5     C6     N1     118.656  123.700  0.600   -8.41  ?     
580   79  N3     C2     O2     117.926  122.300  0.600   -7.29  ?     
581   79  N3     C4     C5     119.668  115.200  0.600    7.45  ?     
582   79  N3     C4     O4     116.616  119.900  0.600   -5.47  ?     
583   79  "O4'"  "C1'"  "C2'"  101.466  105.900  0.800   -5.54  ?     
584   80  C4     C5     N7     105.745  110.800  0.400  -12.64  ?     
585   80  C5     C6     O6     131.819  128.600  0.600    5.36  ?     
586   80  C6     C5     N7     135.037  130.400  0.600    7.73  ?     
587   80  C6     N1     C2     120.777  125.100  0.600   -7.21  ?     
588   80  N1     C2     N2     109.691  116.200  0.900   -7.23  ?     
589   80  N1     C2     N3     129.239  123.900  0.600    8.90  ?     
590   80  N1     C6     O6     114.442  119.900  0.600   -9.10  ?     
591   80  N3     C4     C5     125.614  128.600  0.500   -5.97  ?     
592   80  N9     C4     C5     107.978  105.400  0.400    6.44  ?     
593   80  "O4'"  "C1'"  N9     113.762  108.000  0.700    8.23  ?     
594   81  C4     C5     C6     121.802  118.800  0.600    5.00  ?     
595   81  C5     C6     O6     132.776  128.600  0.600    6.96  ?     
596   81  C5     N7     C8      99.545  104.300  0.500   -9.51  ?     
597   81  C8     N9     C4      98.428  106.400  0.400  -19.93  ?     
598   81  N1     C6     O6     114.989  119.900  0.600   -8.19  ?     
599   81  N3     C4     C5     123.943  128.600  0.500   -9.31  ?     
600   81  N7     C8     N9     120.745  113.100  0.500   15.29  ?     
601   81  N9     C4     C5     112.128  105.400  0.400   16.82  ?     
602   82  C2     N3     C4     115.022  111.900  0.500    6.24  ?     
603   82  C4     C5     C6     112.012  118.800  0.600  -11.31  ?     
604   82  C4     C5     N7     117.447  110.800  0.400   16.62  ?     
605   82  C5     C6     N1     119.543  111.500  0.500   16.09  ?     
606   82  C5     C6     O6     122.286  128.600  0.600  -10.52  ?     
607   82  C5     N7     C8     100.106  104.300  0.500   -8.39  ?     
608   82  C6     N1     C2     120.874  125.100  0.600   -7.04  ?     
609   82  N1     C2     N2     122.343  116.200  0.900    6.83  ?     
610   82  N3     C2     N2     114.325  119.900  0.700   -7.96  ?     
611   82  N3     C4     N9     132.087  126.000  0.600   10.14  ?     
612   82  N9     C4     C5      99.432  105.400  0.400  -14.92  ?     
613   82  "O4'"  "C4'"  "C3'"  110.515  106.000  0.600    7.53  ?     
614   85  C2     N3     C4     115.316  111.900  0.500    6.83  ?     
615   85  C4     C5     N7     108.769  110.800  0.400   -5.08  ?     
616   85  C5     C6     N1     114.642  111.500  0.500    6.28  ?     
617   85  C6     N1     C2     120.738  125.100  0.600   -7.27  ?     
618   85  N1     C2     N2     121.550  116.200  0.900    5.95  ?     
619   85  N3     C2     N2     112.907  119.900  0.700   -9.99  ?     
620   85  N3     C4     C5     124.002  128.600  0.500   -9.20  ?     
621   85  "O4'"  "C1'"  "C2'"   99.662  105.900  0.800   -7.80  ?     
622   85  "O4'"  "C1'"  N9     116.720  108.000  0.700   12.46  ?     
623   86  P      "O3'"  "C3'"  126.789  119.700  1.200    5.91  Y     
624   86  "C1'"  "O4'"  "C4'"  104.798  110.100  1.000   -5.30  ?     
625   86  C6     N1     C2     121.824  125.100  0.600   -5.46  ?     
626   86  C8     N9     C4     102.880  106.400  0.400   -8.80  ?     
627   86  N1     C2     N2     110.821  116.200  0.900   -5.98  ?     
628   86  N1     C2     N3     128.884  123.900  0.600    8.31  ?     
629   86  N7     C8     N9     115.762  113.100  0.500    5.32  ?     
630   86  N9     C4     C5     108.001  105.400  0.400    6.50  ?     
631   87  C4     C5     C6     114.620  118.800  0.600   -6.97  ?     
632   87  C5     C6     N1     116.466  111.500  0.500    9.93  ?     
633   87  C6     C5     N7     134.960  130.400  0.600    7.60  ?     
634   87  N1     C6     O6     115.731  119.900  0.600   -6.95  ?     
635   87  "O4'"  "C1'"  "C2'"  100.851  105.900  0.800   -6.31  ?     
636   87  "O4'"  "C1'"  N9     115.892  108.000  0.700   11.27  ?     
637   88  C5     N7     C8     107.236  103.900  0.500    6.67  ?     
638   88  C8     N9     C4     103.385  105.800  0.400   -6.04  ?     
639   88  N1     C6     N6     114.045  118.600  0.600   -7.59  ?     
640   88  N9     C4     C5     108.803  105.800  0.400    7.51  ?     
641   89  N1     C2     O2     126.528  118.900  0.600   12.71  ?     
642   89  N3     C2     O2     112.142  121.900  0.700  -13.94  ?     
643   90  P      "O3'"  "C3'"  128.211  119.700  1.200    7.09  Y     
644   90  "C1'"  "O4'"  "C4'"  104.582  110.100  1.000   -5.52  ?     
645   90  C5     N7     C8      98.496  104.300  0.500  -11.61  ?     
646   90  N3     C2     N2     116.163  119.900  0.700   -5.34  ?     
647   90  N7     C8     N9     116.798  113.100  0.500    7.40  ?     
648   90  "O4'"  "C1'"  "C2'"  100.531  105.900  0.800   -6.71  ?     
649   91  "O3'"  P      "O5'"  114.145  104.000  1.900    5.34  Y     
650   91  C2     N3     C4     123.737  127.200  0.600   -5.77  ?     
651   91  "C4'"  "C3'"  "C2'"   95.641  103.100  0.900   -8.29  ?     
652   91  N1     C2     O2     127.315  123.100  0.800    5.27  ?     
653   91  N3     C2     O2     114.648  122.300  0.600  -12.75  ?     
654   91  "O4'"  "C1'"  "C2'"  101.687  105.900  0.800   -5.27  ?     
655   92  C2     N3     C4     113.993  110.600  0.500    6.79  ?     
656   92  C4     C5     C6     111.399  117.000  0.500  -11.20  ?     
657   92  C5     C6     N1     126.652  117.700  0.500   17.90  ?     
658   92  C5     N7     C8     101.374  103.900  0.500   -5.05  ?     
659   92  C6     C5     N7     137.626  132.300  0.700    7.61  ?     
660   92  N1     C2     N3     126.151  129.300  0.500   -6.30  ?     
661   92  N1     C6     N6     111.993  118.600  0.600  -11.01  ?     
662   93  P      "O3'"  "C3'"  129.534  119.700  1.200    8.20  Y     
663   93  C4     C5     N7     106.341  110.800  0.400  -11.15  ?     
664   93  C5     C6     N1     117.010  111.500  0.500   11.02  ?     
665   93  C5     C6     O6     124.459  128.600  0.600   -6.90  ?     
666   93  C6     C5     N7     137.199  130.400  0.600   11.33  ?     
667   93  C6     N1     C2     119.908  125.100  0.600   -8.65  ?     
668   93  N1     C2     N3     127.709  123.900  0.600    6.35  ?     
669   93  N9     C4     C5     107.752  105.400  0.400    5.88  ?     
670   93  "O4'"  "C4'"  "C3'"   99.996  106.000  0.600  -10.01  ?     
671   94  "C1'"  "O4'"  "C4'"   99.875  110.100  1.000  -10.22  ?     
672   94  C5     C6     N1     119.847  123.700  0.600   -6.42  ?     
673   94  C6     N1     C2     125.848  121.300  0.500    9.10  ?     
674   94  N3     C4     C5     118.861  115.200  0.600    6.10  ?     
675   94  N3     C4     O4     114.160  119.900  0.600   -9.57  ?     
676   94  "O4'"  "C1'"  "C2'"  110.298  105.900  0.800    5.50  ?     
677   94  "O4'"  "C4'"  "C3'"  110.304  106.000  0.600    7.17  ?     
678   95  C5     C6     N1     115.201  111.500  0.500    7.40  ?     
679   95  C5     C6     O6     124.653  128.600  0.600   -6.58  ?     
680   95  C5     N7     C8     101.717  104.300  0.500   -5.17  ?     
681   95  C6     N1     C2     121.714  125.100  0.600   -5.64  ?     
682   95  C8     N9     C4     104.301  106.400  0.400   -5.25  ?     
683   95  N1     C2     N2     122.138  116.200  0.900    6.60  ?     
684   95  N3     C2     N2     112.892  119.900  0.700  -10.01  ?     
685   95  N3     C4     C5     125.197  128.600  0.500   -6.81  ?     
686   95  N7     C8     N9     115.631  113.100  0.500    5.06  ?     
687   95  N9     C4     C5     108.288  105.400  0.400    7.22  ?     
688   95  "O4'"  "C1'"  "C2'"  100.337  105.900  0.800   -6.95  ?     
689   95  "O4'"  "C1'"  N9     111.790  108.000  0.700    5.41  ?     
690   96  C4     C5     C6     115.578  118.800  0.600   -5.37  ?     
691   96  C4     N9     "C1'"  133.386  126.500  1.300    5.30  ?     
692   96  C5     C6     N1     116.780  111.500  0.500   10.56  ?     
693   96  C5     N7     C8     101.031  104.300  0.500   -6.54  ?     
694   96  C6     N1     C2     119.113  125.100  0.600   -9.98  ?     
695   96  C8     N9     C4     103.649  106.400  0.400   -6.88  ?     
696   96  N1     C6     O6     114.085  119.900  0.600   -9.69  ?     
697   96  N7     C8     N9     117.656  113.100  0.500    9.11  ?     
698   96  "O4'"  "C1'"  N9     118.123  108.000  0.700   14.46  ?     
699   97  C2     N3     C4     109.269  111.900  0.500   -5.26  ?     
700   97  C5     C6     N1     115.391  111.500  0.500    7.78  ?     
701   97  C6     N1     C2     118.843  125.100  0.600  -10.43  ?     
702   97  N1     C2     N3     128.834  123.900  0.600    8.22  ?     
703   97  N1     C6     O6     116.059  119.900  0.600   -6.40  ?     
704   97  N3     C2     N2     115.695  119.900  0.700   -6.01  ?     
705   98  C4     N9     "C1'"  134.776  126.500  1.300    6.37  ?     
706   98  C8     N9     "C1'"  115.444  127.000  1.300   -8.89  ?     
707   98  N9     C4     C5     101.751  105.400  0.400   -9.12  ?     
708   99  C2     N3     C4     114.485  111.900  0.500    5.17  ?     
709   99  "C4'"  "C3'"  "C2'"   96.889  103.100  0.900   -6.90  ?     
710   99  "C5'"  "C4'"  "O4'"  121.210  109.300  1.900    6.27  ?     
711   99  C5     C6     N1     114.357  111.500  0.500    5.71  ?     
712   99  C5     C6     O6     131.774  128.600  0.600    5.29  ?     
713   99  C6     N1     C2     120.508  125.100  0.600   -7.65  ?     
714   99  N1     C6     O6     113.863  119.900  0.600  -10.06  ?     
715   99  "O4'"  "C1'"  "C2'"  101.340  105.900  0.800   -5.70  ?     
716   99  "O4'"  "C1'"  N9     118.509  108.000  0.700   15.01  ?     
717   99  "O4'"  "C4'"  "C3'"  111.756  106.000  0.600    9.59  ?     
718  100  "C1'"  "O4'"  "C4'"  104.100  110.100  1.000   -6.00  ?     
719  100  C2     N3     C4     107.981  111.900  0.500   -7.84  ?     
720  100  "C4'"  "C3'"  "C2'"   96.699  103.100  0.900   -7.11  ?     
721  100  C4     C5     C6     115.666  118.800  0.600   -5.22  ?     
722  100  C4     N9     "C1'"  119.764  126.500  1.300   -5.18  ?     
723  100  N3     C2     N2     115.098  119.900  0.700   -6.86  ?     
724  100  N3     C4     N9     122.965  126.000  0.600   -5.06  ?     
725  100  N7     C8     N9     110.280  113.100  0.500   -5.64  ?     
726  100  "O4'"  "C1'"  "C2'"  100.271  105.900  0.800   -7.04  ?     
727  100  "O4'"  "C1'"  N9     111.784  108.000  0.700    5.41  ?     
728  101  C2     N3     C4     113.763  110.600  0.500    6.33  ?     
729  101  C4     C5     C6     111.292  117.000  0.500  -11.42  ?     
730  101  C5     C6     N1     125.354  117.700  0.500   15.31  ?     
731  101  C5     N7     C8      97.866  103.900  0.500  -12.07  ?     
732  101  N1     C6     N6     112.547  118.600  0.600  -10.09  ?     
733  101  N7     C8     N9     119.505  113.800  0.500   11.41  ?     
734  101  N9     C4     C5     102.962  105.800  0.400   -7.09  ?     
735  101  "O4'"  "C4'"  "C3'"  110.106  106.000  0.600    6.84  ?     
736  102  C2     N3     C4     122.688  119.900  0.500    5.58  ?     
737  102  C4     C5     C6     120.318  117.400  0.500    5.84  ?     
738  102  C5     C4     N4     127.462  120.200  0.700   10.37  ?     
739  102  N3     C4     C5     117.917  121.900  0.400   -9.96  ?     
740  102  N3     C4     N4     114.386  118.000  0.700   -5.16  ?     
741  102  "O4'"  "C1'"  "C2'"   99.935  105.900  0.800   -7.46  ?     
742  103  P      "O3'"  "C3'"  127.857  119.700  1.200    6.80  Y     
743  103  C2     N3     C4     116.048  111.900  0.500    8.29  ?     
744  103  N3     C2     N2     116.379  119.900  0.700   -5.03  ?     
745  103  N3     C4     C5     124.566  128.600  0.500   -8.07  ?     
746  104  "C4'"  "C3'"  "C2'"   95.843  103.100  0.900   -8.06  ?     
747  104  C4     C5     C6     122.755  118.000  0.600    7.92  ?     
748  104  C4     C5     C7     115.727  119.000  0.600   -5.46  ?     
749  104  C6     N1     C2     116.956  121.300  0.500   -8.69  ?     
750  104  N1     "C1'"  "C2'"  123.462  112.600  1.900    5.72  ?     
751  104  N3     C4     C5     111.312  115.200  0.600   -6.48  ?     
752  104  "O4'"  "C1'"  "C2'"   99.462  105.900  0.800   -8.05  ?     
753  104  "O4'"  "C4'"  "C3'"  112.320  106.000  0.600   10.53  ?     
754  105  C4     C5     C6     110.761  117.000  0.500  -12.48  ?     
755  105  C4     C5     N7     115.219  110.700  0.500    9.04  ?     
756  105  C5     C6     N1     121.715  117.700  0.500    8.03  ?     
757  105  C5     N7     C8     100.965  103.900  0.500   -5.87  ?     
758  105  N1     C2     N3     126.072  129.300  0.500   -6.46  ?     
759  105  N1     C6     N6     114.626  118.600  0.600   -6.62  ?     
760  105  N3     C4     C5     130.552  126.800  0.700    5.36  ?     
761  105  "O4'"  "C1'"  "C2'"  101.603  105.900  0.800   -5.37  ?     
762  105  "O4'"  "C1'"  N9     103.508  108.000  0.700   -6.42  ?     
763  106  P      "O3'"  "C3'"  131.279  119.700  1.200    9.65  Y     
764  106  C4     C5     N7     113.530  110.800  0.400    6.83  ?     
765  106  C5     C6     N1     108.730  111.500  0.500   -5.54  ?     
766  106  C5     C6     O6     134.158  128.600  0.600    9.26  ?     
767  106  C5     N7     C8      99.317  104.300  0.500   -9.97  ?     
768  106  C6     C5     N7     126.625  130.400  0.600   -6.29  ?     
769  106  C8     N9     C4     103.901  106.400  0.400   -6.25  ?     
770  106  N3     C4     C5     125.454  128.600  0.500   -6.29  ?     
771  106  N7     C8     N9     117.849  113.100  0.500    9.50  ?     
772  106  "O4'"  "C1'"  N9     117.695  108.000  0.700   13.85  ?     
773  106  "O4'"  "C4'"  "C3'"  101.975  104.500  0.400   -6.31  ?     
774  107  C2     N3     C4     123.752  127.200  0.600   -5.75  ?     
775  107  C5     C6     N1     119.456  123.700  0.600   -7.07  ?     
776  107  C6     N1     C2     124.550  121.300  0.500    6.50  ?     
777  107  N3     C2     O2     118.332  122.300  0.600   -6.61  ?     
778  107  N3     C4     O4     115.589  119.900  0.600   -7.19  ?     
779  107  "O4'"  "C1'"  "C2'"   98.710  105.900  0.800   -8.99  ?     
780  107  "O5'"  P      OP1    116.734  110.700  1.200    5.03  ?     
781  108  "C4'"  "C3'"  "C2'"   96.496  103.100  0.900   -7.34  ?     
782  108  C6     C5     N7     134.346  130.400  0.600    6.58  ?     
783  108  N3     C2     N2     115.932  119.900  0.700   -5.67  ?     
784  108  "O4'"  "C1'"  N9     112.788  108.000  0.700    6.84  ?     
785  109  C8     N9     C4     104.276  106.400  0.400   -5.31  ?     
786  109  N1     C6     O6     116.503  119.900  0.600   -5.66  ?     
787  109  N3     C2     N2     115.409  119.900  0.700   -6.42  ?     
788  109  "O4'"  "C4'"  "C3'"  101.868  104.500  0.400   -6.58  ?     
789  110  "C1'"  "O4'"  "C4'"  104.814  110.100  1.000   -5.29  ?     
790  110  C5     N7     C8     106.856  104.300  0.500    5.11  ?     
791  110  C8     N9     C4     111.850  106.400  0.400   13.63  ?     
792  110  N7     C8     N9     109.306  113.100  0.500   -7.59  ?     
793  110  N9     C4     C5     102.748  105.400  0.400   -6.63  ?     
794  110  "O4'"  "C1'"  N9     111.549  108.000  0.700    5.07  ?     
795  113  C4     C5     N7     108.491  110.800  0.400   -5.77  ?     
796  113  "O4'"  "C1'"  N9     115.415  108.000  0.700   10.59  ?     
797  114  "C1'"  "O4'"  "C4'"  102.198  110.100  1.000   -7.90  ?     
798  114  C2     N3     C4     114.967  111.900  0.500    6.13  ?     
799  114  "C4'"  "C3'"  "C2'"   95.571  103.100  0.900   -8.37  ?     
800  114  C4     N9     "C1'"  119.790  126.500  1.300   -5.16  ?     
801  114  C5     C6     N1     118.025  111.500  0.500   13.05  ?     
802  114  C6     N1     C2     119.262  125.100  0.600   -9.73  ?     
803  114  C8     N9     "C1'"  136.533  127.000  1.300    7.33  ?     
804  114  C8     N9     C4     103.539  106.400  0.400   -7.15  ?     
805  114  N1     C6     O6     114.775  119.900  0.600   -8.54  ?     
806  114  N3     C4     C5     125.039  128.600  0.500   -7.12  ?     
807  114  "O4'"  "C1'"  N9     117.252  108.000  0.700   13.22  ?     
808  114  "O4'"  "C4'"  "C3'"  114.175  106.000  0.600   13.62  ?     
809  115  P      "O3'"  "C3'"  126.978  119.700  1.200    6.07  Y     
810  115  "C3'"  "C2'"  "C1'"   96.321  102.500  1.200   -5.15  ?     
811  115  C5     N7     C8     107.293  104.300  0.500    5.99  ?     
812  115  N1     C6     O6     115.398  119.900  0.600   -7.50  ?     
813  115  N3     C2     N2     123.524  119.900  0.700    5.18  ?     
814  115  N9     C4     C5     102.120  105.400  0.400   -8.20  ?     
815  116  C2     N3     C4     113.995  110.600  0.500    6.79  ?     
816  116  C4     C5     N7     113.693  110.700  0.500    5.99  ?     
817  116  C5     C6     N6     128.429  123.700  0.800    5.91  ?     
818  116  C5     N7     C8      98.734  103.900  0.500  -10.33  ?     
819  116  C6     N1     C2     123.617  118.600  0.600    8.36  ?     
820  116  N1     C2     N3     121.894  129.300  0.500  -14.81  ?     
821  116  N1     C6     N6     113.638  118.600  0.600   -8.27  ?     
822  116  N7     C8     N9     117.278  113.800  0.500    6.96  ?     
823  116  N9     C4     C5     103.692  105.800  0.400   -5.27  ?     
824  117  "C1'"  "O4'"  "C4'"  101.402  110.100  1.000   -8.70  ?     
825  117  "C3'"  "C2'"  "C1'"   94.327  102.500  1.200   -6.81  ?     
826  117  C4     C5     C6     112.842  117.400  0.500   -9.12  ?     
827  117  N3     C2     O2     118.266  121.900  0.700   -5.19  ?     
828  117  N3     C4     C5     126.468  121.900  0.400   11.42  ?     
829  117  N3     C4     N4     114.249  118.000  0.700   -5.36  ?     
830  117  "O4'"  "C4'"  "C3'"  109.338  106.000  0.600    5.56  ?     
831  118  C4     C5     N7     107.227  110.800  0.400   -8.93  ?     
832  118  C5     C6     N1     114.270  111.500  0.500    5.54  ?     
833  118  C5     N7     C8     108.739  104.300  0.500    8.88  ?     
834  118  C6     N1     C2     120.425  125.100  0.600   -7.79  ?     
835  118  C8     N9     C4     110.045  106.400  0.400    9.11  ?     
836  118  N1     C2     N3     127.104  123.900  0.600    5.34  ?     
837  118  N1     C6     O6     116.537  119.900  0.600   -5.61  ?     
838  118  N3     C2     N2     112.832  119.900  0.700  -10.10  ?     
839  118  N3     C4     C5     124.987  128.600  0.500   -7.23  ?     
840  118  N3     C4     N9     129.476  126.000  0.600    5.79  ?     
841  118  N7     C8     N9     108.306  113.100  0.500   -9.59  ?     
842  119  C5     C4     O4     128.940  124.900  0.700    5.77  ?     
843  119  N1     C2     N3     118.803  114.600  0.600    7.00  ?     
844  119  N3     C4     O4     116.293  119.900  0.600   -6.01  ?     
845  119  "O4'"  "C1'"  N1     112.510  108.000  0.700    6.44  ?     
846  120  "O3'"  P      "O5'"   93.130  104.000  1.900   -5.72  Y     
847  120  C2     N3     C4     114.057  110.600  0.500    6.91  ?     
848  120  C5     C6     N1     121.003  117.700  0.500    6.61  ?     
849  120  C5     C6     N6     118.282  123.700  0.800   -6.77  ?     
850  120  C8     N9     C4     103.685  105.800  0.400   -5.29  ?     
851  120  N1     C2     N3     125.205  129.300  0.500   -8.19  ?     
852  120  N3     C4     C5     123.181  126.800  0.700   -5.17  ?     
853  120  N9     "C1'"  "C2'"  123.605  112.600  1.900    5.79  ?     
854  120  "O4'"  "C1'"  "C2'"  111.710  105.900  0.800    7.26  ?     
855  121  OP1    P      "O3'"  117.505  105.200  2.200    5.59  Y     
856  121  P      "O3'"  "C3'"  128.705  119.700  1.200    7.50  Y     
857  121  C4     C5     C6     115.750  118.800  0.600   -5.08  ?     
858  121  C6     C5     N7     133.978  130.400  0.600    5.96  ?     
859  121  N1     C6     O6     116.299  119.900  0.600   -6.00  ?     
860  121  "O4'"  "C1'"  N9     111.962  108.000  0.700    5.66  ?     
861  122  C4     C5     C6     123.610  118.000  0.600    9.35  ?     
862  122  C4     C5     C7     115.517  119.000  0.600   -5.81  ?     
863  122  C5     C4     O4     128.895  124.900  0.700    5.71  ?     
864  122  C5     C6     N1     120.052  123.700  0.600   -6.08  ?     
865  122  N3     C4     C5     110.903  115.200  0.600   -7.16  ?     
866  123  P      "O3'"  "C3'"  125.886  119.700  1.200    5.16  Y     
867  123  C2     N3     C4     115.704  111.900  0.500    7.61  ?     
868  123  C4     C5     C6     115.276  118.800  0.600   -5.87  ?     
869  123  C4     C5     N7     115.556  110.800  0.400   11.89  ?     
870  123  C5     C6     N1     116.058  111.500  0.500    9.12  ?     
871  123  C5     C6     O6     124.812  128.600  0.600   -6.31  ?     
872  123  C5     N7     C8      98.617  104.300  0.500  -11.37  ?     
873  123  N7     C8     N9     116.762  113.100  0.500    7.32  ?     
874  123  "O4'"  "C1'"  N9     116.543  108.000  0.700   12.21  ?     
875  124  "C1'"  "O4'"  "C4'"  101.352  110.100  1.000   -8.75  ?     
876  124  C2     N3     C4     115.049  111.900  0.500    6.30  ?     
877  124  N1     C2     N2     123.605  116.200  0.900    8.23  ?     
878  124  N3     C2     N2     111.766  119.900  0.700  -11.62  ?     
879  124  N3     C4     N9     130.296  126.000  0.600    7.16  ?     
880  124  N9     C4     C5     103.179  105.400  0.400   -5.55  ?     
881  124  "O4'"  "C1'"  N9     115.231  108.000  0.700   10.33  ?     
882  125  C2     N3     C4     114.754  111.900  0.500    5.71  ?     
883  125  C5     C6     N1     115.318  111.500  0.500    7.63  ?     
884  125  C5     C6     O6     125.267  128.600  0.600   -5.55  ?     
885  125  N3     C4     C5     124.678  128.600  0.500   -7.84  ?     
886  125  N3     C4     N9     130.827  126.000  0.600    8.04  ?     
887  125  "O4'"  "C1'"  "C2'"  100.389  105.900  0.800   -6.89  ?     
888  125  "O4'"  "C1'"  N9     117.842  108.000  0.700   14.06  ?     
889  126  P      "O3'"  "C3'"  126.488  119.700  1.200    5.66  Y     
890  126  C2     N3     C4     116.656  111.900  0.500    9.51  ?     
891  126  C5     C6     O6     133.095  128.600  0.600    7.49  ?     
892  126  C8     N9     C4     103.660  106.400  0.400   -6.85  ?     
893  126  N1     C6     O6     114.780  119.900  0.600   -8.53  ?     
894  126  N3     C4     C5     123.238  128.600  0.500  -10.72  ?     
895  126  N3     C4     N9     129.802  126.000  0.600    6.34  ?     
896  126  "O4'"  "C1'"  "C2'"  100.311  105.900  0.800   -6.99  ?     
897  126  "O4'"  "C1'"  N9     120.201  108.000  0.700   17.43  ?     
898  127  "C4'"  "C3'"  "C2'"  108.013  103.100  0.900    5.46  ?     
899  127  "C5'"  "C4'"  "O4'"  122.240  109.300  1.900    6.81  ?     
900  127  C5     C6     N1     116.721  111.500  0.500   10.44  ?     
901  127  C5     C6     O6     123.856  128.600  0.600   -7.91  ?     
902  127  C6     N1     C2     118.962  125.100  0.600  -10.23  ?     
903  127  C8     N9     C4     101.172  106.400  0.400  -13.07  ?     
904  127  N1     C2     N3     128.509  123.900  0.600    7.68  ?     
905  127  N3     C2     N2     114.439  119.900  0.700   -7.80  ?     
906  127  N3     C4     C5     123.396  128.600  0.500  -10.41  ?     
907  127  N9     C4     C5     108.283  105.400  0.400    7.21  ?     
908  127  "O4'"  "C1'"  "C2'"   98.279  105.900  0.800   -9.53  ?     
909  127  "O4'"  "C1'"  N9     118.445  108.000  0.700   14.92  ?     
910  127  "O4'"  "C4'"  "C3'"   97.683  106.000  0.600  -13.86  ?     
911  128  C8     N9     "C1'"  133.664  127.000  1.300    5.13  ?     
912  128  C8     N9     C4     102.959  106.400  0.400   -8.60  ?     
913  128  N1     C2     N2     122.703  116.200  0.900    7.23  ?     
914  128  N3     C2     N2     114.119  119.900  0.700   -8.26  ?     
915  128  N3     C4     C5     125.900  128.600  0.500   -5.40  ?     
916  128  N3     C4     N9     129.009  126.000  0.600    5.01  ?     
917  128  N7     C8     N9     118.512  113.100  0.500   10.82  ?     
918  128  "O4'"  "C1'"  N9     114.130  108.000  0.700    8.76  ?     
919  129  C2     N3     C4     113.889  110.600  0.500    6.58  ?     
920  129  C4     C5     C6     112.194  117.000  0.500   -9.61  ?     
921  129  C4     C5     N7     113.567  110.700  0.500    5.73  ?     
922  129  C5     C6     N1     120.514  117.700  0.500    5.63  ?     
923  129  C5     N7     C8     100.916  103.900  0.500   -5.97  ?     
924  129  N1     C6     N6     112.643  118.600  0.600   -9.93  ?     
925  129  N9     C4     C5     102.343  105.800  0.400   -8.64  ?     
926  130  C2     N3     C4     115.387  119.900  0.500   -9.03  ?     
927  130  C4     C5     C6     120.553  117.400  0.500    6.31  ?     
928  130  C6     N1     C2     116.206  120.300  0.400  -10.23  ?     
929  130  N1     C2     N3     126.071  119.200  0.700    9.82  ?     
930  130  N1     C2     O2     113.704  118.900  0.600   -8.66  ?     
931  131  "C1'"  "O4'"  "C4'"  103.263  110.100  1.000   -6.84  ?     
932  131  "C3'"  "C2'"  "C1'"   94.321  102.500  1.200   -6.82  ?     
933  131  C4     N9     "C1'"  119.235  126.500  1.300   -5.59  ?     
934  131  C6     N1     C2     120.118  125.100  0.600   -8.30  ?     
935  131  N1     C2     N2     111.399  116.200  0.900   -5.33  ?     
936  131  N1     C2     N3     128.805  123.900  0.600    8.17  ?     
937  131  N3     C4     C5     125.682  128.600  0.500   -5.84  ?     
938  131  N9     C4     C5     107.995  105.400  0.400    6.49  ?     
939  131  "O5'"  P      OP1    118.054  110.700  1.200    6.13  ?     
940  131  OP1    P      OP2    110.996  119.600  1.500   -5.74  ?     
941  132  C4     C5     C6     123.511  118.000  0.600    9.19  ?     
942  132  C5     C4     O4     130.619  124.900  0.700    8.17  ?     
943  132  "C5'"  "C4'"  "O4'"  119.411  109.300  1.900    5.32  ?     
944  132  C6     C5     C7     119.214  122.900  0.600   -6.14  ?     
945  132  C6     N1     C2     116.183  121.300  0.500  -10.23  ?     
946  132  N3     C2     O2     115.454  122.300  0.600  -11.41  ?     
947  132  N3     C4     C5     111.470  115.200  0.600   -6.22  ?     
948  132  "O4'"  "C1'"  N1     116.265  108.000  0.700   11.81  ?     
949  133  C2     N3     C4     105.422  110.600  0.500  -10.36  ?     
950  133  C4     C5     C6     113.312  117.000  0.500   -7.38  ?     
951  133  C4     C5     N7     115.439  110.700  0.500    9.48  ?     
952  133  C5     N7     C8     100.946  103.900  0.500   -5.91  ?     
953  133  C6     N1     C2     115.249  118.600  0.600   -5.58  ?     
954  133  C8     N9     C4     103.672  105.800  0.400   -5.32  ?     
955  133  N1     C2     N3     134.763  129.300  0.500   10.93  ?     
956  133  N3     C4     C5     131.500  126.800  0.700    6.71  ?     
957  133  N7     C8     N9     117.334  113.800  0.500    7.07  ?     
958  133  N9     C4     C5     102.307  105.800  0.400   -8.73  ?     
959  133  "O4'"  "C1'"  N9     102.871  108.000  0.700   -7.33  ?     
960  133  "O4'"  "C4'"  "C3'"  110.333  106.000  0.600    7.22  ?     
961  134  P      "O3'"  "C3'"  128.078  119.700  1.200    6.98  Y     
962  134  C4     C5     N7     107.964  110.800  0.400   -7.09  ?     
963  134  C6     N1     C2     122.064  125.100  0.600   -5.06  ?     
964  134  N3     C4     C5     126.055  128.600  0.500   -5.09  ?     
965  134  "O4'"  "C1'"  N9     113.289  108.000  0.700    7.55  ?     
966  135  C6     C5     C7     118.908  122.900  0.600   -6.65  ?     
967  135  N1     C2     N3     119.851  114.600  0.600    8.75  ?     
968  135  N3     C2     O2     117.753  122.300  0.600   -7.58  ?     
969  135  N3     C4     O4     116.096  119.900  0.600   -6.34  ?     
970  135  "O4'"  "C1'"  N1     112.884  108.000  0.700    6.98  ?     
971  135  "O4'"  "C4'"  "C3'"  110.718  106.000  0.600    7.86  ?     
972  136  P      "O3'"  "C3'"  130.068  119.700  1.200    8.64  Y     
973  136  "C4'"  "C3'"  "C2'"  110.117  103.100  0.900    7.80  ?     
974  136  C4     C5     N7     108.530  110.800  0.400   -5.68  ?     
975  136  N3     C4     C5     124.329  128.600  0.500   -8.54  ?     
976  136  N3     C4     N9     129.200  126.000  0.600    5.33  ?     
977  136  "O4'"  "C1'"  N9     114.931  108.000  0.700    9.90  ?     
978  136  "O4'"  "C4'"  "C3'"  101.771  104.500  0.400   -6.82  ?     
979  137  C4     C5     N7     108.492  110.800  0.400   -5.77  ?     
980  137  C5     C6     O6     132.086  128.600  0.600    5.81  ?     
981  137  C5     N7     C8     106.917  104.300  0.500    5.23  ?     
982  137  C8     N9     C4     110.064  106.400  0.400    9.16  ?     
983  137  N1     C6     O6     114.315  119.900  0.600   -9.31  ?     
984  137  N3     C4     C5     124.780  128.600  0.500   -7.64  ?     
985  137  N3     C4     N9     130.194  126.000  0.600    6.99  ?     
986  137  N7     C8     N9     109.842  113.100  0.500   -6.51  ?     
987  138  C5     N7     C8      99.060  104.300  0.500  -10.48  ?     
988  138  C8     N9     C4     102.868  106.400  0.400   -8.83  ?     
989  138  N7     C8     N9     117.596  113.100  0.500    8.99  ?     
990  138  "O4'"  "C1'"  "C2'"  100.746  105.900  0.800   -6.44  ?     
#
loop_
_pdbx_vrpt_software.ordinal
_pdbx_vrpt_software.name
_pdbx_vrpt_software.version
_pdbx_vrpt_software.success_y_or_n
1  molprobity   4.02b-467                                                             Y  
2  mogul        unknown                                                               Y  
3  percentiles  "20191225.v01 (using entries in the PDB archive December 25th 2019)"  N  
##
