data_2IDN

_pdbx_vrpt_database.id    PDB
_pdbx_vrpt_database.code  2IDN
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   nmr
#
_pdbx_vrpt_summary.entry_id                    2IDN
_pdbx_vrpt_summary.PDB_deposition_date         2006-09-15
_pdbx_vrpt_summary.PDB_revision_number         4
_pdbx_vrpt_summary.PDB_revision_date           2022-03-09
_pdbx_vrpt_summary.report_creation_date        2022-03-03:13:20
_pdbx_vrpt_summary.attempted_validation_steps  molprobity,validation-pack,coreclust,chemicalshifts,percentiles,writepdf,writexml,writecif
_pdbx_vrpt_summary.ligands_for_buster_report   N
#
_pdbx_vrpt_entity.id           1
_pdbx_vrpt_entity.type         polymer
_pdbx_vrpt_entity.description  "3'-D(P*GP*G*T)-5'-5'-D(P*TP*GP*GP*TP*GP*TP*GP*GP*TP*TP*GP*G)-3'"
#
_pdbx_vrpt_asym.label_asym_id  A
_pdbx_vrpt_asym.entity_id      1
#
loop_
_pdbx_vrpt_percentile_list.id
_pdbx_vrpt_percentile_list.range
_pdbx_vrpt_percentile_list.exp_method
1  all  pdb    
2  nmr  x-ray  
#
_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   99.94  158937  ?     ?     
2  2  1  100.00   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  6.96  5.56  350  535  
2  2  1  A  A  6.99  5.56  350  535  
3  3  1  A  A  6.98  5.56  350  535  
4  4  1  A  A  6.98  5.56  350  535  
5  5  1  A  A  6.98  5.57  350  535  
6  6  1  A  A  6.97  5.57  350  535  
7  7  1  A  A  6.99  5.59  350  535  
#
_pdbx_vrpt_summary_geometry.ordinal                 1
_pdbx_vrpt_summary_geometry.clashscore_full_length  0.00
_pdbx_vrpt_summary_geometry.num_H_reduce            1211
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ          2450
_pdbx_vrpt_summary_geometry.bonds_RMSZ              5.57
_pdbx_vrpt_summary_geometry.num_angles_RMSZ         3745
_pdbx_vrpt_summary_geometry.angles_RMSZ             6.98
#
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_plane_outliers
  1  1  1  A   1  DG  A   1  .  ?     6  15     1  
  2  1  1  A   2  DG  A   2  .  ?     6  15     ?  
  3  1  1  A   3  DT  A   3  .  ?     2   4     ?  
  4  1  1  A   4  DT  A   4  .  ?     2   5     ?  
  5  1  1  A   5  DG  A   5  .  ?     6  19     ?  
  6  1  1  A   6  DG  A   6  .  ?     6  13     ?  
  7  1  1  A   7  DT  A   7  .  ?     2   5     ?  
  8  1  1  A   8  DG  A   8  .  ?     6  14     ?  
  9  1  1  A   9  DT  A   9  .  ?     2   5     ?  
 10  1  1  A  10  DG  A  10  .  ?     6  15     ?  
 11  1  1  A  11  DG  A  11  .  ?     6  12     1  
 12  1  1  A  12  DT  A  12  .  ?     2   5     ?  
 13  1  1  A  13  DT  A  13  .  ?     2   5     ?  
 14  1  1  A  14  DG  A  14  .  ?     6  14     1  
 15  1  1  A  15  DG  A  15  .  ?     6  12     ?  
 16  2  1  A   1  DG  A   1  .  ?     6  15     1  
 17  2  1  A   2  DG  A   2  .  ?     6  14     ?  
 18  2  1  A   3  DT  A   3  .  ?     2   3     ?  
 19  2  1  A   4  DT  A   4  .  ?     2   5     ?  
 20  2  1  A   5  DG  A   5  .  ?     6  19     ?  
 21  2  1  A   6  DG  A   6  .  ?     6  13     1  
 22  2  1  A   7  DT  A   7  .  ?     2   4     ?  
 23  2  1  A   8  DG  A   8  .  ?     6  13     ?  
 24  2  1  A   9  DT  A   9  .  ?     2   5     ?  
 25  2  1  A  10  DG  A  10  .  ?     6  15     ?  
 26  2  1  A  11  DG  A  11  .  ?     6  12     1  
 27  2  1  A  12  DT  A  12  .  ?     2   5     ?  
 28  2  1  A  13  DT  A  13  .  ?     2   5     ?  
 29  2  1  A  14  DG  A  14  .  ?     6  14     1  
 30  2  1  A  15  DG  A  15  .  ?     6  12     ?  
 31  3  1  A   1  DG  A   1  .  ?     6  15     1  
 32  3  1  A   2  DG  A   2  .  ?     6  15     ?  
 33  3  1  A   3  DT  A   3  .  ?     2   2     ?  
 34  3  1  A   4  DT  A   4  .  ?     2   5     ?  
 35  3  1  A   5  DG  A   5  .  ?     6  19     ?  
 36  3  1  A   6  DG  A   6  .  ?     6  13     1  
 37  3  1  A   7  DT  A   7  .  ?     2   4     ?  
 38  3  1  A   8  DG  A   8  .  ?     6  13     ?  
 39  3  1  A   9  DT  A   9  .  ?     2   5     ?  
 40  3  1  A  10  DG  A  10  .  ?     6  14     ?  
 41  3  1  A  11  DG  A  11  .  ?     6  12     1  
 42  3  1  A  12  DT  A  12  .  ?     2   5     ?  
 43  3  1  A  13  DT  A  13  .  ?     2   5     ?  
 44  3  1  A  14  DG  A  14  .  ?     6  14     1  
 45  3  1  A  15  DG  A  15  .  ?     6  12     ?  
 46  4  1  A   1  DG  A   1  .  ?     6  15     1  
 47  4  1  A   2  DG  A   2  .  ?     6  15     ?  
 48  4  1  A   3  DT  A   3  .  ?     2   4     ?  
 49  4  1  A   4  DT  A   4  .  ?     2   5     ?  
 50  4  1  A   5  DG  A   5  .  ?     6  19     ?  
 51  4  1  A   6  DG  A   6  .  ?     6  14     ?  
 52  4  1  A   7  DT  A   7  .  ?     2   5     ?  
 53  4  1  A   8  DG  A   8  .  ?     6  14     ?  
 54  4  1  A   9  DT  A   9  .  ?     2   5     ?  
 55  4  1  A  10  DG  A  10  .  ?     6  15     ?  
 56  4  1  A  11  DG  A  11  .  ?     6  12     1  
 57  4  1  A  12  DT  A  12  .  ?     2   4     ?  
 58  4  1  A  13  DT  A  13  .  ?     2   5     ?  
 59  4  1  A  14  DG  A  14  .  ?     6  14     1  
 60  4  1  A  15  DG  A  15  .  ?     6  12     ?  
 61  5  1  A   1  DG  A   1  .  ?     6  15     1  
 62  5  1  A   2  DG  A   2  .  ?     6  15     ?  
 63  5  1  A   3  DT  A   3  .  ?     2   3     ?  
 64  5  1  A   4  DT  A   4  .  ?     2   5     ?  
 65  5  1  A   5  DG  A   5  .  ?     6  19     ?  
 66  5  1  A   6  DG  A   6  .  ?     6  14     1  
 67  5  1  A   7  DT  A   7  .  ?     2   4     ?  
 68  5  1  A   8  DG  A   8  .  ?     6  13     ?  
 69  5  1  A   9  DT  A   9  .  ?     2   5     ?  
 70  5  1  A  10  DG  A  10  .  ?     6  14     ?  
 71  5  1  A  11  DG  A  11  .  ?     6  12     1  
 72  5  1  A  12  DT  A  12  .  ?     2   5     ?  
 73  5  1  A  13  DT  A  13  .  ?     2   6     ?  
 74  5  1  A  14  DG  A  14  .  ?     6  13     1  
 75  5  1  A  15  DG  A  15  .  ?     6  12     ?  
 76  6  1  A   1  DG  A   1  .  ?     6  15     1  
 77  6  1  A   2  DG  A   2  .  ?     6  15     ?  
 78  6  1  A   3  DT  A   3  .  ?     2   3     ?  
 79  6  1  A   4  DT  A   4  .  ?     2   5     ?  
 80  6  1  A   5  DG  A   5  .  ?     6  19     ?  
 81  6  1  A   6  DG  A   6  .  ?     6  13     ?  
 82  6  1  A   7  DT  A   7  .  ?     2   4     ?  
 83  6  1  A   8  DG  A   8  .  ?     6  13     ?  
 84  6  1  A   9  DT  A   9  .  ?     2   5     ?  
 85  6  1  A  10  DG  A  10  .  ?     6  15     ?  
 86  6  1  A  11  DG  A  11  .  ?     6  12     1  
 87  6  1  A  12  DT  A  12  .  ?     2   5     ?  
 88  6  1  A  13  DT  A  13  .  ?     2   5     ?  
 89  6  1  A  14  DG  A  14  .  ?     6  14     1  
 90  6  1  A  15  DG  A  15  .  ?     6  12     ?  
 91  7  1  A   1  DG  A   1  .  ?     6  14     1  
 92  7  1  A   2  DG  A   2  .  ?     6  14     ?  
 93  7  1  A   3  DT  A   3  .  ?     2   3     ?  
 94  7  1  A   4  DT  A   4  .  ?     2   5     ?  
 95  7  1  A   5  DG  A   5  .  ?     6  19     ?  
 96  7  1  A   6  DG  A   6  .  ?     6  14     1  
 97  7  1  A   7  DT  A   7  .  ?     2   4     ?  
 98  7  1  A   8  DG  A   8  .  ?     6  13     ?  
 99  7  1  A   9  DT  A   9  .  ?     2   5     ?  
100  7  1  A  10  DG  A  10  .  ?     6  13     ?  
101  7  1  A  11  DG  A  11  .  ?     6  12     1  
102  7  1  A  12  DT  A  12  .  ?     2   5     ?  
103  7  1  A  13  DT  A  13  .  ?     2   5     ?  
104  7  1  A  14  DG  A  14  .  ?     6  13     1  
105  7  1  A  15  DG  A  15  .  ?     6  12     ?  
#
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  24  5.97  35  8.87  molprobity  
  2    2  11  24  6.11  35  8.66  molprobity  
  3    3  12  18  5.16  26  3.70  molprobity  
  4    4  12  22  4.81  34  3.63  molprobity  
  5    5  11  25  5.80  39  8.69  molprobity  
  6    6  11  25  5.98  39  8.03  molprobity  
  7    7  12  22  4.74  34  3.41  molprobity  
  8    8  11  25  5.88  39  8.04  molprobity  
  9    9  12  22  4.77  34  3.42  molprobity  
 10   10  11  25  5.87  39  7.99  molprobity  
 11   11  11  25  5.95  39  7.99  molprobity  
 12   12  12  22  4.79  34  3.47  molprobity  
 13   13  12  22  4.69  34  3.51  molprobity  
 14   14  11  25  5.83  39  8.11  molprobity  
 15   15  12  24  6.08  35  8.58  molprobity  
 16   16  12  24  5.97  35  8.85  molprobity  
 17   17  11  24  6.09  35  8.65  molprobity  
 18   18  12  18  5.32  26  3.77  molprobity  
 19   19  12  22  4.83  34  3.60  molprobity  
 20   20  11  25  5.79  39  8.80  molprobity  
 21   21  11  25  5.97  39  8.03  molprobity  
 22   22  12  22  4.76  34  3.39  molprobity  
 23   23  11  25  5.88  39  8.07  molprobity  
 24   24  12  22  4.69  34  3.45  molprobity  
 25   25  11  25  5.86  39  8.10  molprobity  
 26   26  11  25  5.97  39  8.00  molprobity  
 27   27  12  22  4.79  34  3.48  molprobity  
 28   28  12  22  4.73  34  3.49  molprobity  
 29   29  11  25  5.82  39  8.15  molprobity  
 30   30  12  24  6.13  35  8.66  molprobity  
 31   31  12  24  5.97  35  8.86  molprobity  
 32   32  11  24  6.12  35  8.62  molprobity  
 33   33  12  18  5.13  26  3.65  molprobity  
 34   34  12  22  4.82  34  3.59  molprobity  
 35   35  11  25  5.80  39  8.79  molprobity  
 36   36  11  25  5.98  39  8.03  molprobity  
 37   37  12  22  4.74  34  3.41  molprobity  
 38   38  11  25  5.89  39  8.05  molprobity  
 39   39  12  22  4.74  34  3.46  molprobity  
 40   40  11  25  5.86  39  8.09  molprobity  
 41   41  11  25  5.98  39  8.01  molprobity  
 42   42  12  22  4.80  34  3.47  molprobity  
 43   43  12  22  4.69  34  3.51  molprobity  
 44   44  11  25  5.82  39  8.10  molprobity  
 45   45  12  24  6.09  35  8.67  molprobity  
 46   46  12  24  5.99  35  8.86  molprobity  
 47   47  11  24  6.13  35  8.72  molprobity  
 48   48  12  18  5.13  26  3.69  molprobity  
 49   49  12  22  4.80  34  3.60  molprobity  
 50   50  11  25  5.81  39  8.75  molprobity  
 51   51  11  25  6.01  39  8.05  molprobity  
 52   52  12  22  4.77  34  3.42  molprobity  
 53   53  11  25  5.92  39  8.03  molprobity  
 54   54  12  22  4.70  34  3.45  molprobity  
 55   55  11  25  5.88  39  8.01  molprobity  
 56   56  11  25  6.00  39  8.08  molprobity  
 57   57  12  22  4.76  34  3.44  molprobity  
 58   58  12  22  4.71  34  3.51  molprobity  
 59   59  11  25  5.75  39  8.10  molprobity  
 60   60  12  24  6.14  35  8.64  molprobity  
 61   61  12  24  6.00  35  8.90  molprobity  
 62   62  11  24  6.08  35  8.70  molprobity  
 63   63  12  18  5.17  26  3.70  molprobity  
 64   64  12  22  4.79  34  3.59  molprobity  
 65   65  11  25  5.79  39  8.76  molprobity  
 66   66  11  25  5.98  39  8.01  molprobity  
 67   67  12  22  4.76  34  3.37  molprobity  
 68   68  11  25  5.90  39  8.06  molprobity  
 69   69  12  22  4.75  34  3.43  molprobity  
 70   70  11  25  5.86  39  7.91  molprobity  
 71   71  11  25  6.04  39  8.19  molprobity  
 72   72  12  22  4.74  34  3.46  molprobity  
 73   73  12  22  4.86  34  3.62  molprobity  
 74   74  11  25  5.80  39  8.05  molprobity  
 75   75  12  24  6.13  35  8.63  molprobity  
 76   76  12  24  5.98  35  8.84  molprobity  
 77   77  11  24  6.10  35  8.62  molprobity  
 78   78  12  18  5.34  26  3.80  molprobity  
 79   79  12  22  4.80  34  3.65  molprobity  
 80   80  11  25  5.81  39  8.72  molprobity  
 81   81  11  25  5.98  39  8.06  molprobity  
 82   82  12  22  4.76  34  3.40  molprobity  
 83   83  11  25  5.89  39  8.07  molprobity  
 84   84  12  22  4.70  34  3.44  molprobity  
 85   85  11  25  5.86  39  8.03  molprobity  
 86   86  11  25  5.97  39  7.99  molprobity  
 87   87  12  22  4.79  34  3.45  molprobity  
 88   88  12  22  4.70  34  3.50  molprobity  
 89   89  11  25  5.84  39  8.11  molprobity  
 90   90  12  24  6.11  35  8.62  molprobity  
 91   91  12  24  5.99  35  8.90  molprobity  
 92   92  11  24  6.05  35  8.65  molprobity  
 93   93  12  18  5.32  26  3.80  molprobity  
 94   94  12  22  4.83  34  3.54  molprobity  
 95   95  11  25  5.84  39  8.84  molprobity  
 96   96  11  25  5.99  39  8.01  molprobity  
 97   97  12  22  4.76  34  3.40  molprobity  
 98   98  11  25  5.92  39  8.03  molprobity  
 99   99  12  22  4.75  34  3.42  molprobity  
100  100  11  25  5.89  39  7.91  molprobity  
101  101  11  25  6.04  39  8.19  molprobity  
102  102  12  22  4.75  34  3.46  molprobity  
103  103  12  22  4.87  34  3.58  molprobity  
104  104  11  25  5.86  39  8.13  molprobity  
105  105  12  24  6.15  35  8.68  molprobity  
#
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    1  sidechain  0.10  
 2   11  sidechain  0.08  
 3   14  sidechain  0.12  
 4   16  sidechain  0.13  
 5   21  sidechain  0.07  
 6   26  sidechain  0.10  
 7   29  sidechain  0.13  
 8   31  sidechain  0.11  
 9   36  sidechain  0.06  
10   41  sidechain  0.09  
11   44  sidechain  0.14  
12   46  sidechain  0.13  
13   56  sidechain  0.08  
14   59  sidechain  0.13  
15   61  sidechain  0.12  
16   66  sidechain  0.07  
17   71  sidechain  0.06  
18   74  sidechain  0.13  
19   76  sidechain  0.10  
20   86  sidechain  0.09  
21   89  sidechain  0.12  
22   91  sidechain  0.13  
23   96  sidechain  0.07  
24  101  sidechain  0.08  
25  104  sidechain  0.13  
#
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
  1    1  C2  N2  1.409  1.341  0.010   6.82  
  2    1  C5  C4  1.438  1.379  0.007   8.44  
  3    1  C5  C6  1.543  1.419  0.010  12.41  
  4    1  C8  N7  1.365  1.305  0.006  10.04  
  5    1  N1  C2  1.484  1.373  0.008  13.88  
  6    1  N3  C4  1.445  1.350  0.007  13.62  
  7    2  C2  N2  1.409  1.341  0.010   6.79  
  8    2  C5  C4  1.436  1.379  0.007   8.08  
  9    2  C5  C6  1.550  1.419  0.010  13.15  
 10    2  C8  N7  1.372  1.305  0.006  11.17  
 11    2  N1  C2  1.477  1.373  0.008  13.05  
 12    2  N3  C4  1.450  1.350  0.007  14.35  
 13    3  C4  C5  1.557  1.445  0.009  12.46  
 14    3  N1  C6  1.493  1.378  0.007  16.48  
 15    4  C4  C5  1.556  1.445  0.009  12.30  
 16    4  N1  C6  1.495  1.378  0.007  16.71  
 17    5  C2  N2  1.405  1.341  0.010   6.38  
 18    5  C5  C4  1.434  1.379  0.007   7.93  
 19    5  C5  C6  1.541  1.419  0.010  12.22  
 20    5  C8  N7  1.366  1.305  0.006  10.19  
 21    5  N1  C2  1.486  1.373  0.008  14.16  
 22    5  N3  C4  1.441  1.350  0.007  13.05  
 23    6  C2  N2  1.404  1.341  0.010   6.26  
 24    6  C5  C4  1.434  1.379  0.007   7.87  
 25    6  C5  C6  1.554  1.419  0.010  13.51  
 26    6  C8  N7  1.378  1.305  0.006  12.23  
 27    6  N1  C2  1.481  1.373  0.008  13.49  
 28    6  N3  C4  1.444  1.350  0.007  13.39  
 29    7  C4  C5  1.558  1.445  0.009  12.56  
 30    7  N1  C6  1.492  1.378  0.007  16.35  
 31    8  C2  N2  1.409  1.341  0.010   6.76  
 32    8  C5  C4  1.437  1.379  0.007   8.22  
 33    8  C5  C6  1.551  1.419  0.010  13.18  
 34    8  C8  N7  1.375  1.305  0.006  11.73  
 35    8  N1  C2  1.480  1.373  0.008  13.43  
 36    8  N3  C4  1.445  1.350  0.007  13.59  
 37    9  C4  C5  1.557  1.445  0.009  12.42  
 38    9  N1  C6  1.494  1.378  0.007  16.63  
 39   10  C2  N2  1.407  1.341  0.010   6.61  
 40   10  C5  C4  1.433  1.379  0.007   7.75  
 41   10  C5  C6  1.551  1.419  0.010  13.25  
 42   10  C8  N7  1.376  1.305  0.006  11.76  
 43   10  N1  C2  1.489  1.373  0.008  14.48  
 44   10  N3  C4  1.437  1.350  0.007  12.46  
 45   11  C2  N2  1.407  1.341  0.010   6.58  
 46   11  C5  C4  1.436  1.379  0.007   8.16  
 47   11  C5  C6  1.552  1.419  0.010  13.28  
 48   11  C8  N7  1.370  1.305  0.006  10.81  
 49   11  N1  C2  1.485  1.373  0.008  13.98  
 50   11  N3  C4  1.446  1.350  0.007  13.77  
 51   12  C4  C5  1.558  1.445  0.009  12.61  
 52   12  N1  C6  1.493  1.378  0.007  16.48  
 53   13  C4  C5  1.558  1.445  0.009  12.60  
 54   13  N1  C6  1.490  1.378  0.007  16.03  
 55   14  C2  N2  1.399  1.341  0.010   5.81  
 56   14  C5  C4  1.437  1.379  0.007   8.29  
 57   14  C5  C6  1.549  1.419  0.010  13.02  
 58   14  C8  N7  1.374  1.305  0.006  11.57  
 59   14  N1  C2  1.483  1.373  0.008  13.70  
 60   14  N3  C4  1.437  1.350  0.007  12.46  
 61   15  C2  N2  1.407  1.341  0.010   6.58  
 62   15  C5  C4  1.436  1.379  0.007   8.13  
 63   15  C5  C6  1.549  1.419  0.010  13.04  
 64   15  C8  N7  1.370  1.305  0.006  10.86  
 65   15  N1  C2  1.491  1.373  0.008  14.70  
 66   15  N3  C4  1.443  1.350  0.007  13.34  
 67   16  C2  N2  1.407  1.341  0.010   6.59  
 68   16  C5  C4  1.439  1.379  0.007   8.60  
 69   16  C5  C6  1.544  1.419  0.010  12.47  
 70   16  C8  N7  1.367  1.305  0.006  10.35  
 71   16  N1  C2  1.486  1.373  0.008  14.13  
 72   16  N3  C4  1.442  1.350  0.007  13.21  
 73   17  C2  N2  1.409  1.341  0.010   6.80  
 74   17  C5  C4  1.437  1.379  0.007   8.22  
 75   17  C5  C6  1.549  1.419  0.010  12.97  
 76   17  C8  N7  1.371  1.305  0.006  11.01  
 77   17  N1  C2  1.478  1.373  0.008  13.06  
 78   17  N3  C4  1.452  1.350  0.007  14.52  
 79   18  C4  C5  1.556  1.445  0.009  12.35  
 80   18  N1  C6  1.499  1.378  0.007  17.29  
 81   19  C4  C5  1.553  1.445  0.009  11.95  
 82   19  N1  C6  1.496  1.378  0.007  16.85  
 83   20  C2  N2  1.404  1.341  0.010   6.33  
 84   20  C5  C4  1.436  1.379  0.007   8.21  
 85   20  C5  C6  1.541  1.419  0.010  12.23  
 86   20  C8  N7  1.365  1.305  0.006  10.08  
 87   20  N1  C2  1.488  1.373  0.008  14.34  
 88   20  N3  C4  1.438  1.350  0.007  12.62  
 89   21  C2  N2  1.404  1.341  0.010   6.34  
 90   21  C5  C4  1.434  1.379  0.007   7.92  
 91   21  C5  C6  1.552  1.419  0.010  13.31  
 92   21  C8  N7  1.378  1.305  0.006  12.09  
 93   21  N1  C2  1.483  1.373  0.008  13.74  
 94   21  N3  C4  1.443  1.350  0.007  13.31  
 95   22  C4  C5  1.559  1.445  0.009  12.70  
 96   22  N1  C6  1.493  1.378  0.007  16.37  
 97   23  C2  N2  1.407  1.341  0.010   6.64  
 98   23  C5  C4  1.439  1.379  0.007   8.54  
 99   23  C5  C6  1.551  1.419  0.010  13.23  
100   23  C8  N7  1.375  1.305  0.006  11.64  
101   23  N1  C2  1.479  1.373  0.008  13.27  
102   23  N3  C4  1.444  1.350  0.007  13.49  
103   24  C4  C5  1.556  1.445  0.009  12.37  
104   24  N1  C6  1.492  1.378  0.007  16.21  
105   25  C2  N2  1.405  1.341  0.010   6.43  
106   25  C5  C4  1.433  1.379  0.007   7.78  
107   25  C5  C6  1.552  1.419  0.010  13.25  
108   25  C8  N7  1.376  1.305  0.006  11.78  
109   25  N1  C2  1.489  1.373  0.008  14.46  
110   25  N3  C4  1.436  1.350  0.007  12.27  
111   26  C2  N2  1.407  1.341  0.010   6.64  
112   26  C5  C4  1.436  1.379  0.007   8.19  
113   26  C5  C6  1.551  1.419  0.010  13.25  
114   26  C8  N7  1.370  1.305  0.006  10.77  
115   26  N1  C2  1.486  1.373  0.008  14.13  
116   26  N3  C4  1.447  1.350  0.007  13.82  
117   27  C4  C5  1.558  1.445  0.009  12.59  
118   27  N1  C6  1.494  1.378  0.007  16.50  
119   28  C4  C5  1.559  1.445  0.009  12.69  
120   28  N1  C6  1.491  1.378  0.007  16.15  
121   29  C2  N2  1.398  1.341  0.010   5.74  
122   29  C5  C4  1.438  1.379  0.007   8.48  
123   29  C5  C6  1.549  1.419  0.010  13.04  
124   29  C8  N7  1.375  1.305  0.006  11.59  
125   29  N1  C2  1.482  1.373  0.008  13.60  
126   29  N3  C4  1.436  1.350  0.007  12.31  
127   30  C2  N2  1.408  1.341  0.010   6.74  
128   30  C5  C4  1.437  1.379  0.007   8.25  
129   30  C5  C6  1.549  1.419  0.010  13.01  
130   30  C8  N7  1.370  1.305  0.006  10.86  
131   30  N1  C2  1.490  1.373  0.008  14.60  
132   30  N3  C4  1.446  1.350  0.007  13.70  
133   31  C2  N2  1.408  1.341  0.010   6.69  
134   31  C5  C4  1.438  1.379  0.007   8.50  
135   31  C5  C6  1.544  1.419  0.010  12.55  
136   31  C8  N7  1.366  1.305  0.006  10.22  
137   31  N1  C2  1.485  1.373  0.008  14.04  
138   31  N3  C4  1.443  1.350  0.007  13.32  
139   32  C2  N2  1.410  1.341  0.010   6.93  
140   32  C5  C4  1.436  1.379  0.007   8.16  
141   32  C5  C6  1.550  1.419  0.010  13.06  
142   32  C8  N7  1.372  1.305  0.006  11.16  
143   32  N1  C2  1.477  1.373  0.008  12.99  
144   32  N3  C4  1.451  1.350  0.007  14.48  
145   33  C4  C5  1.558  1.445  0.009  12.54  
146   33  N1  C6  1.492  1.378  0.007  16.27  
147   34  C4  C5  1.554  1.445  0.009  12.14  
148   34  N1  C6  1.495  1.378  0.007  16.75  
149   35  C2  N2  1.405  1.341  0.010   6.41  
150   35  C5  C4  1.436  1.379  0.007   8.17  
151   35  C5  C6  1.542  1.419  0.010  12.26  
152   35  C8  N7  1.366  1.305  0.006  10.10  
153   35  N1  C2  1.487  1.373  0.008  14.28  
154   35  N3  C4  1.439  1.350  0.007  12.71  
155   36  C2  N2  1.404  1.341  0.010   6.32  
156   36  C5  C4  1.435  1.379  0.007   7.96  
157   36  C5  C6  1.553  1.419  0.010  13.42  
158   36  C8  N7  1.377  1.305  0.006  12.04  
159   36  N1  C2  1.483  1.373  0.008  13.80  
160   36  N3  C4  1.443  1.350  0.007  13.28  
161   37  C4  C5  1.558  1.445  0.009  12.55  
162   37  N1  C6  1.493  1.378  0.007  16.39  
163   38  C2  N2  1.408  1.341  0.010   6.75  
164   38  C5  C4  1.438  1.379  0.007   8.39  
165   38  C5  C6  1.551  1.419  0.010  13.22  
166   38  C8  N7  1.375  1.305  0.006  11.71  
167   38  N1  C2  1.479  1.373  0.008  13.28  
168   38  N3  C4  1.444  1.350  0.007  13.48  
169   39  C4  C5  1.557  1.445  0.009  12.43  
170   39  N1  C6  1.493  1.378  0.007  16.42  
171   40  C2  N2  1.405  1.341  0.010   6.36  
172   40  C5  C4  1.433  1.379  0.007   7.75  
173   40  C5  C6  1.551  1.419  0.010  13.23  
174   40  C8  N7  1.376  1.305  0.006  11.76  
175   40  N1  C2  1.490  1.373  0.008  14.67  
176   40  N3  C4  1.435  1.350  0.007  12.19  
177   41  C2  N2  1.407  1.341  0.010   6.62  
178   41  C5  C4  1.437  1.379  0.007   8.27  
179   41  C5  C6  1.552  1.419  0.010  13.25  
180   41  C8  N7  1.370  1.305  0.006  10.91  
181   41  N1  C2  1.485  1.373  0.008  14.06  
182   41  N3  C4  1.447  1.350  0.007  13.84  
183   42  C4  C5  1.559  1.445  0.009  12.61  
184   42  N1  C6  1.493  1.378  0.007  16.50  
185   43  C4  C5  1.558  1.445  0.009  12.53  
186   43  N1  C6  1.490  1.378  0.007  16.00  
187   44  C2  N2  1.397  1.341  0.010   5.61  
188   44  C5  C4  1.437  1.379  0.007   8.33  
189   44  C5  C6  1.551  1.419  0.010  13.19  
190   44  C8  N7  1.374  1.305  0.006  11.58  
191   44  N1  C2  1.481  1.373  0.008  13.53  
192   44  N3  C4  1.437  1.350  0.007  12.36  
193   45  C2  N2  1.407  1.341  0.010   6.64  
194   45  C5  C4  1.436  1.379  0.007   8.14  
195   45  C5  C6  1.549  1.419  0.010  12.97  
196   45  C8  N7  1.369  1.305  0.006  10.63  
197   45  N1  C2  1.491  1.373  0.008  14.75  
198   45  N3  C4  1.444  1.350  0.007  13.37  
199   46  C2  N2  1.407  1.341  0.010   6.62  
200   46  C5  C4  1.440  1.379  0.007   8.65  
201   46  C5  C6  1.545  1.419  0.010  12.59  
202   46  C8  N7  1.368  1.305  0.006  10.43  
203   46  N1  C2  1.485  1.373  0.008  13.96  
204   46  N3  C4  1.444  1.350  0.007  13.38  
205   47  C2  N2  1.409  1.341  0.010   6.83  
206   47  C5  C4  1.436  1.379  0.007   8.13  
207   47  C5  C6  1.551  1.419  0.010  13.23  
208   47  C8  N7  1.373  1.305  0.006  11.28  
209   47  N1  C2  1.479  1.373  0.008  13.26  
210   47  N3  C4  1.449  1.350  0.007  14.18  
211   48  C4  C5  1.558  1.445  0.009  12.59  
212   48  N1  C6  1.492  1.378  0.007  16.33  
213   49  C4  C5  1.554  1.445  0.009  12.16  
214   49  N1  C6  1.495  1.378  0.007  16.69  
215   50  C2  N2  1.405  1.341  0.010   6.41  
216   50  C5  C4  1.435  1.379  0.007   8.00  
217   50  C5  C6  1.543  1.419  0.010  12.37  
218   50  C8  N7  1.366  1.305  0.006  10.24  
219   50  N1  C2  1.487  1.373  0.008  14.31  
220   50  N3  C4  1.440  1.350  0.007  12.83  
221   51  C2  N2  1.405  1.341  0.010   6.36  
222   51  C5  C4  1.435  1.379  0.007   8.04  
223   51  C5  C6  1.553  1.419  0.010  13.45  
224   51  C8  N7  1.377  1.305  0.006  11.97  
225   51  N1  C2  1.481  1.373  0.008  13.53  
226   51  N3  C4  1.446  1.350  0.007  13.66  
227   52  C4  C5  1.558  1.445  0.009  12.58  
228   52  N1  C6  1.493  1.378  0.007  16.47  
229   53  C2  N2  1.409  1.341  0.010   6.85  
230   53  C5  C4  1.436  1.379  0.007   8.18  
231   53  C5  C6  1.552  1.419  0.010  13.30  
232   53  C8  N7  1.376  1.305  0.006  11.88  
233   53  N1  C2  1.481  1.373  0.008  13.44  
234   53  N3  C4  1.446  1.350  0.007  13.66  
235   54  C4  C5  1.558  1.445  0.009  12.54  
236   54  N1  C6  1.491  1.378  0.007  16.21  
237   55  C2  N2  1.407  1.341  0.010   6.56  
238   55  C5  C4  1.435  1.379  0.007   7.97  
239   55  C5  C6  1.551  1.419  0.010  13.17  
240   55  C8  N7  1.375  1.305  0.006  11.71  
241   55  N1  C2  1.487  1.373  0.008  14.23  
242   55  N3  C4  1.440  1.350  0.007  12.85  
243   56  C2  N2  1.406  1.341  0.010   6.53  
244   56  C5  C4  1.437  1.379  0.007   8.26  
245   56  C5  C6  1.552  1.419  0.010  13.27  
246   56  C8  N7  1.368  1.305  0.006  10.58  
247   56  N1  C2  1.485  1.373  0.008  14.02  
248   56  N3  C4  1.449  1.350  0.007  14.14  
249   57  C4  C5  1.559  1.445  0.009  12.64  
250   57  N1  C6  1.492  1.378  0.007  16.35  
251   58  C4  C5  1.556  1.445  0.009  12.32  
252   58  N1  C6  1.491  1.378  0.007  16.15  
253   59  C2  N2  1.392  1.341  0.010   5.14  
254   59  C5  C4  1.437  1.379  0.007   8.29  
255   59  C5  C6  1.548  1.419  0.010  12.90  
256   59  C8  N7  1.373  1.305  0.006  11.25  
257   59  N1  C2  1.481  1.373  0.008  13.46  
258   59  N3  C4  1.435  1.350  0.007  12.17  
259   60  C2  N2  1.408  1.341  0.010   6.69  
260   60  C5  C4  1.437  1.379  0.007   8.33  
261   60  C5  C6  1.550  1.419  0.010  13.13  
262   60  C8  N7  1.371  1.305  0.006  10.92  
263   60  N1  C2  1.487  1.373  0.008  14.28  
264   60  N3  C4  1.447  1.350  0.007  13.90  
265   61  C2  N2  1.407  1.341  0.010   6.64  
266   61  C5  C4  1.439  1.379  0.007   8.64  
267   61  C5  C6  1.544  1.419  0.010  12.53  
268   61  C8  N7  1.367  1.305  0.006  10.29  
269   61  N1  C2  1.484  1.373  0.008  13.86  
270   61  N3  C4  1.445  1.350  0.007  13.62  
271   62  C2  N2  1.410  1.341  0.010   6.85  
272   62  C5  C4  1.435  1.379  0.007   8.02  
273   62  C5  C6  1.548  1.419  0.010  12.94  
274   62  C8  N7  1.371  1.305  0.006  10.99  
275   62  N1  C2  1.478  1.373  0.008  13.18  
276   62  N3  C4  1.449  1.350  0.007  14.21  
277   63  C4  C5  1.558  1.445  0.009  12.58  
278   63  N1  C6  1.493  1.378  0.007  16.46  
279   64  C4  C5  1.556  1.445  0.009  12.28  
280   64  N1  C6  1.494  1.378  0.007  16.60  
281   65  C2  N2  1.405  1.341  0.010   6.36  
282   65  C5  C4  1.434  1.379  0.007   7.92  
283   65  C5  C6  1.542  1.419  0.010  12.25  
284   65  C8  N7  1.366  1.305  0.006  10.21  
285   65  N1  C2  1.488  1.373  0.008  14.32  
286   65  N3  C4  1.440  1.350  0.007  12.87  
287   66  C2  N2  1.405  1.341  0.010   6.40  
288   66  C5  C4  1.436  1.379  0.007   8.15  
289   66  C5  C6  1.553  1.419  0.010  13.39  
290   66  C8  N7  1.377  1.305  0.006  12.07  
291   66  N1  C2  1.479  1.373  0.008  13.23  
292   66  N3  C4  1.446  1.350  0.007  13.68  
293   67  C4  C5  1.559  1.445  0.009  12.67  
294   67  N1  C6  1.493  1.378  0.007  16.41  
295   68  C2  N2  1.410  1.341  0.010   6.87  
296   68  C5  C4  1.438  1.379  0.007   8.36  
297   68  C5  C6  1.551  1.419  0.010  13.25  
298   68  C8  N7  1.376  1.305  0.006  11.87  
299   68  N1  C2  1.481  1.373  0.008  13.45  
300   68  N3  C4  1.444  1.350  0.007  13.40  
301   69  C4  C5  1.556  1.445  0.009  12.39  
302   69  N1  C6  1.493  1.378  0.007  16.38  
303   70  C2  N2  1.407  1.341  0.010   6.59  
304   70  C5  C4  1.436  1.379  0.007   8.08  
305   70  C5  C6  1.550  1.419  0.010  13.09  
306   70  C8  N7  1.374  1.305  0.006  11.50  
307   70  N1  C2  1.483  1.373  0.008  13.73  
308   70  N3  C4  1.444  1.350  0.007  13.47  
309   71  C2  N2  1.407  1.341  0.010   6.59  
310   71  C5  C4  1.438  1.379  0.007   8.37  
311   71  C5  C6  1.554  1.419  0.010  13.49  
312   71  C8  N7  1.372  1.305  0.006  11.23  
313   71  N1  C2  1.486  1.373  0.008  14.15  
314   71  N3  C4  1.446  1.350  0.007  13.74  
315   72  C4  C5  1.560  1.445  0.009  12.78  
316   72  N1  C6  1.491  1.378  0.007  16.18  
317   73  C4  C5  1.556  1.445  0.009  12.38  
318   73  N1  C6  1.496  1.378  0.007  16.81  
319   74  C2  N2  1.397  1.341  0.010   5.61  
320   74  C5  C4  1.436  1.379  0.007   8.18  
321   74  C5  C6  1.548  1.419  0.010  12.93  
322   74  C8  N7  1.373  1.305  0.006  11.27  
323   74  N1  C2  1.478  1.373  0.008  13.10  
324   74  N3  C4  1.442  1.350  0.007  13.07  
325   75  C2  N2  1.406  1.341  0.010   6.55  
326   75  C5  C4  1.437  1.379  0.007   8.32  
327   75  C5  C6  1.553  1.419  0.010  13.36  
328   75  C8  N7  1.373  1.305  0.006  11.36  
329   75  N1  C2  1.488  1.373  0.008  14.39  
330   75  N3  C4  1.444  1.350  0.007  13.45  
331   76  C2  N2  1.408  1.341  0.010   6.68  
332   76  C5  C4  1.439  1.379  0.007   8.56  
333   76  C5  C6  1.543  1.419  0.010  12.41  
334   76  C8  N7  1.365  1.305  0.006  10.01  
335   76  N1  C2  1.485  1.373  0.008  14.00  
336   76  N3  C4  1.445  1.350  0.007  13.58  
337   77  C2  N2  1.409  1.341  0.010   6.80  
338   77  C5  C4  1.436  1.379  0.007   8.13  
339   77  C5  C6  1.549  1.419  0.010  13.00  
340   77  C8  N7  1.371  1.305  0.006  11.08  
341   77  N1  C2  1.475  1.373  0.008  12.77  
342   77  N3  C4  1.453  1.350  0.007  14.72  
343   78  C4  C5  1.557  1.445  0.009  12.47  
344   78  N1  C6  1.500  1.378  0.007  17.37  
345   79  C4  C5  1.555  1.445  0.009  12.20  
346   79  N1  C6  1.495  1.378  0.007  16.65  
347   80  C2  N2  1.405  1.341  0.010   6.41  
348   80  C5  C4  1.435  1.379  0.007   8.02  
349   80  C5  C6  1.541  1.419  0.010  12.22  
350   80  C8  N7  1.365  1.305  0.006  10.08  
351   80  N1  C2  1.487  1.373  0.008  14.23  
352   80  N3  C4  1.441  1.350  0.007  13.06  
353   81  C2  N2  1.404  1.341  0.010   6.27  
354   81  C5  C4  1.435  1.379  0.007   7.95  
355   81  C5  C6  1.553  1.419  0.010  13.42  
356   81  C8  N7  1.378  1.305  0.006  12.21  
357   81  N1  C2  1.483  1.373  0.008  13.74  
358   81  N3  C4  1.443  1.350  0.007  13.23  
359   82  C4  C5  1.559  1.445  0.009  12.69  
360   82  N1  C6  1.493  1.378  0.007  16.40  
361   83  C2  N2  1.408  1.341  0.010   6.75  
362   83  C5  C4  1.438  1.379  0.007   8.37  
363   83  C5  C6  1.551  1.419  0.010  13.19  
364   83  C8  N7  1.375  1.305  0.006  11.71  
365   83  N1  C2  1.479  1.373  0.008  13.28  
366   83  N3  C4  1.445  1.350  0.007  13.56  
367   84  C4  C5  1.556  1.445  0.009  12.34  
368   84  N1  C6  1.492  1.378  0.007  16.30  
369   85  C2  N2  1.406  1.341  0.010   6.55  
370   85  C5  C4  1.433  1.379  0.007   7.75  
371   85  C5  C6  1.551  1.419  0.010  13.23  
372   85  C8  N7  1.375  1.305  0.006  11.64  
373   85  N1  C2  1.489  1.373  0.008  14.50  
374   85  N3  C4  1.437  1.350  0.007  12.42  
375   86  C2  N2  1.408  1.341  0.010   6.69  
376   86  C5  C4  1.437  1.379  0.007   8.26  
377   86  C5  C6  1.552  1.419  0.010  13.30  
378   86  C8  N7  1.371  1.305  0.006  10.98  
379   86  N1  C2  1.485  1.373  0.008  13.96  
380   86  N3  C4  1.446  1.350  0.007  13.78  
381   87  C4  C5  1.559  1.445  0.009  12.67  
382   87  N1  C6  1.493  1.378  0.007  16.46  
383   88  C4  C5  1.558  1.445  0.009  12.53  
384   88  N1  C6  1.491  1.378  0.007  16.11  
385   89  C2  N2  1.400  1.341  0.010   5.91  
386   89  C5  C4  1.437  1.379  0.007   8.26  
387   89  C5  C6  1.550  1.419  0.010  13.05  
388   89  C8  N7  1.376  1.305  0.006  11.76  
389   89  N1  C2  1.482  1.373  0.008  13.58  
390   89  N3  C4  1.439  1.350  0.007  12.66  
391   90  C2  N2  1.407  1.341  0.010   6.61  
392   90  C5  C4  1.436  1.379  0.007   8.12  
393   90  C5  C6  1.550  1.419  0.010  13.08  
394   90  C8  N7  1.372  1.305  0.006  11.10  
395   90  N1  C2  1.491  1.373  0.008  14.75  
396   90  N3  C4  1.443  1.350  0.007  13.27  
397   91  C2  N2  1.407  1.341  0.010   6.59  
398   91  C5  C4  1.440  1.379  0.007   8.64  
399   91  C5  C6  1.545  1.419  0.010  12.63  
400   91  C8  N7  1.368  1.305  0.006  10.51  
401   91  N1  C2  1.485  1.373  0.008  13.98  
402   91  N3  C4  1.444  1.350  0.007  13.36  
403   92  C2  N2  1.408  1.341  0.010   6.66  
404   92  C5  C4  1.437  1.379  0.007   8.22  
405   92  C5  C6  1.549  1.419  0.010  12.95  
406   92  C8  N7  1.371  1.305  0.006  11.08  
407   92  N1  C2  1.478  1.373  0.008  13.17  
408   92  N3  C4  1.449  1.350  0.007  14.17  
409   93  C4  C5  1.556  1.445  0.009  12.33  
410   93  N1  C6  1.499  1.378  0.007  17.29  
411   94  C4  C5  1.555  1.445  0.009  12.21  
412   94  N1  C6  1.495  1.378  0.007  16.75  
413   95  C2  N2  1.404  1.341  0.010   6.32  
414   95  C5  C4  1.437  1.379  0.007   8.24  
415   95  C5  C6  1.542  1.419  0.010  12.28  
416   95  C8  N7  1.365  1.305  0.006  10.03  
417   95  N1  C2  1.489  1.373  0.008  14.50  
418   95  N3  C4  1.441  1.350  0.007  12.97  
419   96  C2  N2  1.406  1.341  0.010   6.54  
420   96  C5  C4  1.434  1.379  0.007   7.93  
421   96  C5  C6  1.553  1.419  0.010  13.37  
422   96  C8  N7  1.377  1.305  0.006  12.07  
423   96  N1  C2  1.478  1.373  0.008  13.13  
424   96  N3  C4  1.447  1.350  0.007  13.88  
425   97  C4  C5  1.559  1.445  0.009  12.63  
426   97  N1  C6  1.493  1.378  0.007  16.39  
427   98  C2  N2  1.410  1.341  0.010   6.89  
428   98  C5  C4  1.437  1.379  0.007   8.31  
429   98  C5  C6  1.552  1.419  0.010  13.31  
430   98  C8  N7  1.376  1.305  0.006  11.86  
431   98  N1  C2  1.481  1.373  0.008  13.44  
432   98  N3  C4  1.445  1.350  0.007  13.53  
433   99  C4  C5  1.556  1.445  0.009  12.38  
434   99  N1  C6  1.493  1.378  0.007  16.46  
435  100  C2  N2  1.407  1.341  0.010   6.64  
436  100  C5  C4  1.435  1.379  0.007   7.99  
437  100  C5  C6  1.551  1.419  0.010  13.22  
438  100  C8  N7  1.376  1.305  0.006  11.75  
439  100  N1  C2  1.481  1.373  0.008  13.55  
440  100  N3  C4  1.445  1.350  0.007  13.61  
441  101  C2  N2  1.408  1.341  0.010   6.69  
442  101  C5  C4  1.437  1.379  0.007   8.34  
443  101  C5  C6  1.553  1.419  0.010  13.38  
444  101  C8  N7  1.372  1.305  0.006  11.23  
445  101  N1  C2  1.485  1.373  0.008  14.06  
446  101  N3  C4  1.447  1.350  0.007  13.88  
447  102  C4  C5  1.560  1.445  0.009  12.82  
448  102  N1  C6  1.491  1.378  0.007  16.16  
449  103  C4  C5  1.555  1.445  0.009  12.24  
450  103  N1  C6  1.497  1.378  0.007  16.95  
451  104  C2  N2  1.397  1.341  0.010   5.56  
452  104  C5  C4  1.439  1.379  0.007   8.51  
453  104  C5  C6  1.549  1.419  0.010  13.02  
454  104  C8  N7  1.374  1.305  0.006  11.44  
455  104  N1  C2  1.477  1.373  0.008  13.04  
456  104  N3  C4  1.442  1.350  0.007  13.08  
457  105  C2  N2  1.408  1.341  0.010   6.73  
458  105  C5  C4  1.439  1.379  0.007   8.52  
459  105  C5  C6  1.552  1.419  0.010  13.31  
460  105  C8  N7  1.372  1.305  0.006  11.17  
461  105  N1  C2  1.486  1.373  0.008  14.13  
462  105  N3  C4  1.447  1.350  0.007  13.84  
#
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  C2     N3     C4     123.434  111.900  0.500   23.07  ?     
   2    1  C4     C5     N7     113.391  110.800  0.400    6.48  ?     
   3    1  C5     C6     N1     114.665  111.500  0.500    6.33  ?     
   4    1  C5     C6     O6     122.323  128.600  0.600  -10.46  ?     
   5    1  C5     N7     C8      97.296  104.300  0.500  -14.01  ?     
   6    1  C6     C5     N7     125.484  130.400  0.600   -8.19  ?     
   7    1  C8     N9     C4      98.465  106.400  0.400  -19.84  ?     
   8    1  N1     C2     N3     120.830  123.900  0.600   -5.12  ?     
   9    1  N1     C6     O6     122.998  119.900  0.600    5.16  ?     
  10    1  N3     C4     C5     117.096  128.600  0.500  -23.01  ?     
  11    1  N3     C4     N9     134.611  126.000  0.600   14.35  ?     
  12    1  N7     C8     N9     122.615  113.100  0.500   19.03  ?     
  13    1  N9     C4     C5     108.145  105.400  0.400    6.86  ?     
  14    1  "O4'"  "C1'"  N9     111.836  108.000  0.700    5.48  ?     
  15    1  OP1    P      OP2    107.616  119.600  1.500   -7.99  ?     
  16    2  C2     N3     C4     123.707  111.900  0.500   23.61  ?     
  17    2  C4     C5     N7     113.155  110.800  0.400    5.89  ?     
  18    2  "C5'"  "C4'"  "C3'"  124.195  114.100  1.800    5.61  ?     
  19    2  C5     C6     N1     115.287  111.500  0.500    7.57  ?     
  20    2  C5     C6     O6     123.805  128.600  0.600   -7.99  ?     
  21    2  C5     N7     C8      97.936  104.300  0.500  -12.73  ?     
  22    2  C6     C5     N7     126.327  130.400  0.600   -6.79  ?     
  23    2  C8     N9     C4      99.062  106.400  0.400  -18.34  ?     
  24    2  N1     C2     N3     120.753  123.900  0.600   -5.25  ?     
  25    2  N3     C4     C5     116.877  128.600  0.500  -23.45  ?     
  26    2  N3     C4     N9     135.143  126.000  0.600   15.24  ?     
  27    2  N7     C8     N9     121.866  113.100  0.500   17.53  ?     
  28    2  N9     C4     C5     107.971  105.400  0.400    6.43  ?     
  29    2  "O4'"  "C1'"  N9     111.811  108.000  0.700    5.44  ?     
  30    2  OP1    P      OP2    108.590  119.600  1.500   -7.34  ?     
  31    3  C5     C6     N1     120.689  123.700  0.600   -5.02  ?     
  32    3  N1     C2     N3     120.760  114.600  0.600   10.27  ?     
  33    3  N3     C2     O2     116.557  122.300  0.600   -9.57  ?     
  34    3  "O4'"  "C1'"  N1     111.781  108.000  0.700    5.40  ?     
  35    4  C5     C6     N1     120.278  123.700  0.600   -5.70  ?     
  36    4  N1     C2     N3     120.608  114.600  0.600   10.01  ?     
  37    4  N3     C2     O2     116.865  122.300  0.600   -9.06  ?     
  38    4  "O4'"  "C1'"  N1     113.386  108.000  0.700    7.70  ?     
  39    4  OP1    P      OP2    108.884  119.600  1.500   -7.14  ?     
  40    5  P      "O3'"  "C3'"  132.759  119.700  1.200   10.88  Y     
  41    5  C2     N3     C4     123.487  111.900  0.500   23.17  ?     
  42    5  "C4'"  "C3'"  "C2'"   96.106  103.100  0.900   -7.77  ?     
  43    5  C4     C5     N7     113.262  110.800  0.400    6.16  ?     
  44    5  C4     N9     "C1'"  134.053  126.500  1.300    5.81  ?     
  45    5  C5     C6     N1     114.650  111.500  0.500    6.30  ?     
  46    5  C5     C6     O6     121.858  128.600  0.600  -11.24  ?     
  47    5  C5     N7     C8      97.071  104.300  0.500  -14.46  ?     
  48    5  C6     C5     N7     125.967  130.400  0.600   -7.39  ?     
  49    5  C8     N9     C4      98.909  106.400  0.400  -18.73  ?     
  50    5  N1     C2     N2     120.739  116.200  0.900    5.04  ?     
  51    5  N1     C2     N3     120.621  123.900  0.600   -5.47  ?     
  52    5  N1     C6     O6     123.488  119.900  0.600    5.98  ?     
  53    5  N3     C4     C5     117.548  128.600  0.500  -22.10  ?     
  54    5  N3     C4     N9     134.267  126.000  0.600   13.78  ?     
  55    5  N7     C8     N9     122.504  113.100  0.500   18.81  ?     
  56    5  N9     C4     C5     107.814  105.400  0.400    6.04  ?     
  57    5  "O4'"  "C4'"  "C3'"  110.485  106.000  0.600    7.48  ?     
  58    5  OP1    P      OP2    109.093  119.600  1.500   -7.00  ?     
  59    6  C2     N3     C4     123.538  111.900  0.500   23.28  ?     
  60    6  C4     C5     N7     112.986  110.800  0.400    5.46  ?     
  61    6  C5     C6     N1     115.216  111.500  0.500    7.43  ?     
  62    6  C5     C6     O6     123.505  128.600  0.600   -8.49  ?     
  63    6  C5     N7     C8      97.617  104.300  0.500  -13.37  ?     
  64    6  C6     C5     N7     127.000  130.400  0.600   -5.67  ?     
  65    6  C8     N9     C4      99.385  106.400  0.400  -17.54  ?     
  66    6  N3     C4     C5     117.606  128.600  0.500  -21.99  ?     
  67    6  N3     C4     N9     133.806  126.000  0.600   13.01  ?     
  68    6  N7     C8     N9     121.361  113.100  0.500   16.52  ?     
  69    6  N9     C4     C5     108.552  105.400  0.400    7.88  ?     
  70    6  "O4'"  "C1'"  N9     115.556  108.000  0.700   10.79  ?     
  71    6  OP1    P      OP2    109.449  119.600  1.500   -6.77  ?     
  72    7  C5     C6     N1     120.353  123.700  0.600   -5.58  ?     
  73    7  N1     C2     N3     120.534  114.600  0.600    9.89  ?     
  74    7  N3     C2     O2     116.655  122.300  0.600   -9.41  ?     
  75    7  "O4'"  "C1'"  N1     111.531  108.000  0.700    5.04  ?     
  76    7  OP1    P      OP2    109.512  119.600  1.500   -6.72  ?     
  77    8  C2     N3     C4     123.578  111.900  0.500   23.36  ?     
  78    8  C4     C5     N7     113.229  110.800  0.400    6.07  ?     
  79    8  C5     C6     N1     114.995  111.500  0.500    6.99  ?     
  80    8  C5     C6     O6     123.254  128.600  0.600   -8.91  ?     
  81    8  C5     N7     C8      97.247  104.300  0.500  -14.11  ?     
  82    8  C6     C5     N7     126.390  130.400  0.600   -6.68  ?     
  83    8  C8     N9     C4      99.291  106.400  0.400  -17.77  ?     
  84    8  N1     C2     N3     120.800  123.900  0.600   -5.17  ?     
  85    8  N3     C4     C5     117.399  128.600  0.500  -22.40  ?     
  86    8  N3     C4     N9     134.316  126.000  0.600   13.86  ?     
  87    8  N7     C8     N9     121.994  113.100  0.500   17.79  ?     
  88    8  N9     C4     C5     108.232  105.400  0.400    7.08  ?     
  89    8  "O4'"  "C1'"  N9     111.642  108.000  0.700    5.20  ?     
  90    8  OP1    P      OP2    108.872  119.600  1.500   -7.15  ?     
  91    9  C5     C6     N1     120.459  123.700  0.600   -5.40  ?     
  92    9  N1     C2     N3     120.644  114.600  0.600   10.07  ?     
  93    9  N3     C2     O2     117.001  122.300  0.600   -8.83  ?     
  94    9  "O4'"  "C1'"  N1     112.199  108.000  0.700    6.00  ?     
  95    9  OP1    P      OP2    109.211  119.600  1.500   -6.93  ?     
  96   10  C2     N3     C4     123.755  111.900  0.500   23.71  ?     
  97   10  C4     C5     N7     112.821  110.800  0.400    5.05  ?     
  98   10  C5     C6     N1     114.999  111.500  0.500    7.00  ?     
  99   10  C5     C6     O6     122.858  128.600  0.600   -9.57  ?     
 100   10  C5     N7     C8      97.726  104.300  0.500  -13.15  ?     
 101   10  C6     C5     N7     126.697  130.400  0.600   -6.17  ?     
 102   10  C8     N9     C4      99.425  106.400  0.400  -17.44  ?     
 103   10  N1     C2     N2     120.956  116.200  0.900    5.28  ?     
 104   10  N1     C2     N3     120.855  123.900  0.600   -5.08  ?     
 105   10  N3     C4     C5     117.615  128.600  0.500  -21.97  ?     
 106   10  N3     C4     N9     133.901  126.000  0.600   13.17  ?     
 107   10  N7     C8     N9     121.629  113.100  0.500   17.06  ?     
 108   10  N9     C4     C5     108.388  105.400  0.400    7.47  ?     
 109   10  "O4'"  "C1'"  N9     112.426  108.000  0.700    6.32  ?     
 110   10  OP1    P      OP2    108.951  119.600  1.500   -7.10  ?     
 111   11  C2     N3     C4     123.564  111.900  0.500   23.33  ?     
 112   11  C4     C5     N7     112.980  110.800  0.400    5.45  ?     
 113   11  C5     C6     N1     115.089  111.500  0.500    7.18  ?     
 114   11  C5     C6     O6     123.714  128.600  0.600   -8.14  ?     
 115   11  C5     N7     C8      98.032  104.300  0.500  -12.54  ?     
 116   11  C6     C5     N7     126.221  130.400  0.600   -6.96  ?     
 117   11  C8     N9     C4      99.017  106.400  0.400  -18.46  ?     
 118   11  N3     C4     C5     117.018  128.600  0.500  -23.16  ?     
 119   11  N3     C4     N9     134.768  126.000  0.600   14.61  ?     
 120   11  N7     C8     N9     121.610  113.100  0.500   17.02  ?     
 121   11  N9     C4     C5     108.192  105.400  0.400    6.98  ?     
 122   11  OP1    P      OP2    108.917  119.600  1.500   -7.12  ?     
 123   12  C5     C6     N1     120.585  123.700  0.600   -5.19  ?     
 124   12  N1     C2     N3     120.821  114.600  0.600   10.37  ?     
 125   12  N3     C2     O2     116.907  122.300  0.600   -8.99  ?     
 126   12  "O4'"  "C1'"  N1     112.330  108.000  0.700    6.19  ?     
 127   12  OP1    P      OP2    109.411  119.600  1.500   -6.79  ?     
 128   13  C5     C6     N1     120.036  123.700  0.600   -6.11  ?     
 129   13  N1     C2     N3     120.539  114.600  0.600    9.90  ?     
 130   13  N3     C2     O2     116.813  122.300  0.600   -9.14  ?     
 131   13  "O4'"  "C1'"  N1     113.413  108.000  0.700    7.73  ?     
 132   13  OP1    P      OP2    108.763  119.600  1.500   -7.22  ?     
 133   14  C2     N3     C4     123.460  111.900  0.500   23.12  ?     
 134   14  C4     C5     N7     112.948  110.800  0.400    5.37  ?     
 135   14  C5     C6     N1     114.876  111.500  0.500    6.75  ?     
 136   14  C5     C6     O6     122.835  128.600  0.600   -9.61  ?     
 137   14  C5     N7     C8      97.128  104.300  0.500  -14.34  ?     
 138   14  C6     C5     N7     126.473  130.400  0.600   -6.54  ?     
 139   14  C8     N9     C4      99.064  106.400  0.400  -18.34  ?     
 140   14  N1     C2     N2     120.894  116.200  0.900    5.22  ?     
 141   14  N3     C4     C5     117.732  128.600  0.500  -21.74  ?     
 142   14  N3     C4     N9     133.280  126.000  0.600   12.13  ?     
 143   14  N7     C8     N9     122.296  113.100  0.500   18.39  ?     
 144   14  N9     C4     C5     108.526  105.400  0.400    7.81  ?     
 145   14  "O4'"  "C1'"  N9     113.458  108.000  0.700    7.80  ?     
 146   14  OP1    P      OP2    109.301  119.600  1.500   -6.87  ?     
 147   15  C2     N3     C4     123.618  111.900  0.500   23.43  ?     
 148   15  C4     C5     N7     112.878  110.800  0.400    5.20  ?     
 149   15  C5     C6     N1     115.016  111.500  0.500    7.03  ?     
 150   15  C5     C6     O6     122.794  128.600  0.600   -9.68  ?     
 151   15  C5     N7     C8      97.836  104.300  0.500  -12.93  ?     
 152   15  C6     C5     N7     126.250  130.400  0.600   -6.92  ?     
 153   15  C8     N9     C4      98.865  106.400  0.400  -18.84  ?     
 154   15  N3     C4     C5     117.121  128.600  0.500  -22.96  ?     
 155   15  N3     C4     N9     134.472  126.000  0.600   14.12  ?     
 156   15  N7     C8     N9     121.996  113.100  0.500   17.79  ?     
 157   15  N9     C4     C5     108.407  105.400  0.400    7.52  ?     
 158   15  OP1    P      OP2    109.261  119.600  1.500   -6.89  ?     
 159   16  C2     N3     C4     123.494  111.900  0.500   23.19  ?     
 160   16  C4     C5     N7     113.258  110.800  0.400    6.14  ?     
 161   16  C5     C6     N1     114.684  111.500  0.500    6.37  ?     
 162   16  C5     C6     O6     122.360  128.600  0.600  -10.40  ?     
 163   16  C5     N7     C8      97.208  104.300  0.500  -14.18  ?     
 164   16  C6     C5     N7     125.748  130.400  0.600   -7.75  ?     
 165   16  C8     N9     C4      98.371  106.400  0.400  -20.07  ?     
 166   16  N1     C2     N3     120.714  123.900  0.600   -5.31  ?     
 167   16  N1     C6     O6     122.944  119.900  0.600    5.07  ?     
 168   16  N3     C4     C5     117.289  128.600  0.500  -22.62  ?     
 169   16  N3     C4     N9     134.175  126.000  0.600   13.62  ?     
 170   16  N7     C8     N9     122.689  113.100  0.500   19.18  ?     
 171   16  N9     C4     C5     108.368  105.400  0.400    7.42  ?     
 172   16  "O4'"  "C1'"  N9     112.112  108.000  0.700    5.87  ?     
 173   16  OP1    P      OP2    107.618  119.600  1.500   -7.99  ?     
 174   17  C2     N3     C4     123.533  111.900  0.500   23.27  ?     
 175   17  C4     C5     N7     113.173  110.800  0.400    5.93  ?     
 176   17  "C5'"  "C4'"  "C3'"  123.302  114.100  1.800    5.11  ?     
 177   17  C5     C6     N1     115.253  111.500  0.500    7.51  ?     
 178   17  C5     C6     O6     123.568  128.600  0.600   -8.39  ?     
 179   17  C5     N7     C8      97.773  104.300  0.500  -13.05  ?     
 180   17  C6     C5     N7     126.227  130.400  0.600   -6.95  ?     
 181   17  C8     N9     C4      99.015  106.400  0.400  -18.46  ?     
 182   17  N3     C4     C5     116.891  128.600  0.500  -23.42  ?     
 183   17  N3     C4     N9     135.192  126.000  0.600   15.32  ?     
 184   17  N7     C8     N9     122.048  113.100  0.500   17.89  ?     
 185   17  N9     C4     C5     107.915  105.400  0.400    6.29  ?     
 186   17  "O4'"  "C1'"  N9     111.671  108.000  0.700    5.24  ?     
 187   17  OP1    P      OP2    108.685  119.600  1.500   -7.28  ?     
 188   18  C6     N1     C2     118.359  121.300  0.500   -5.88  ?     
 189   18  N1     C2     N3     121.081  114.600  0.600   10.80  ?     
 190   18  N3     C2     O2     116.539  122.300  0.600   -9.60  ?     
 191   19  C5     C6     N1     120.391  123.700  0.600   -5.51  ?     
 192   19  N1     C2     N3     120.650  114.600  0.600   10.08  ?     
 193   19  N3     C2     O2     116.926  122.300  0.600   -8.96  ?     
 194   19  "O4'"  "C1'"  N1     113.118  108.000  0.700    7.31  ?     
 195   19  OP1    P      OP2    108.601  119.600  1.500   -7.33  ?     
 196   20  P      "O3'"  "C3'"  132.594  119.700  1.200   10.74  Y     
 197   20  C2     N3     C4     123.480  111.900  0.500   23.16  ?     
 198   20  "C4'"  "C3'"  "C2'"   96.121  103.100  0.900   -7.75  ?     
 199   20  C4     C5     N7     113.221  110.800  0.400    6.05  ?     
 200   20  C4     N9     "C1'"  134.101  126.500  1.300    5.85  ?     
 201   20  C5     C6     N1     114.486  111.500  0.500    5.97  ?     
 202   20  C5     C6     O6     121.879  128.600  0.600  -11.20  ?     
 203   20  C5     N7     C8      96.848  104.300  0.500  -14.90  ?     
 204   20  C6     C5     N7     125.894  130.400  0.600   -7.51  ?     
 205   20  C8     N9     C4      98.647  106.400  0.400  -19.38  ?     
 206   20  N1     C2     N2     120.952  116.200  0.900    5.28  ?     
 207   20  N1     C2     N3     120.742  123.900  0.600   -5.26  ?     
 208   20  N1     C6     O6     123.634  119.900  0.600    6.22  ?     
 209   20  N3     C4     C5     117.501  128.600  0.500  -22.20  ?     
 210   20  N3     C4     N9     134.205  126.000  0.600   13.68  ?     
 211   20  N7     C8     N9     122.915  113.100  0.500   19.63  ?     
 212   20  N9     C4     C5     107.973  105.400  0.400    6.43  ?     
 213   20  "O4'"  "C4'"  "C3'"  110.503  106.000  0.600    7.51  ?     
 214   20  OP1    P      OP2    109.099  119.600  1.500   -7.00  ?     
 215   21  C2     N3     C4     123.483  111.900  0.500   23.17  ?     
 216   21  C4     C5     N7     112.983  110.800  0.400    5.46  ?     
 217   21  C5     C6     N1     115.153  111.500  0.500    7.31  ?     
 218   21  C5     C6     O6     123.479  128.600  0.600   -8.53  ?     
 219   21  C5     N7     C8      97.705  104.300  0.500  -13.19  ?     
 220   21  C6     C5     N7     126.858  130.400  0.600   -5.90  ?     
 221   21  C8     N9     C4      99.340  106.400  0.400  -17.65  ?     
 222   21  N3     C4     C5     117.539  128.600  0.500  -22.12  ?     
 223   21  N3     C4     N9     133.965  126.000  0.600   13.28  ?     
 224   21  N7     C8     N9     121.370  113.100  0.500   16.54  ?     
 225   21  N9     C4     C5     108.471  105.400  0.400    7.68  ?     
 226   21  "O4'"  "C1'"  N9     115.497  108.000  0.700   10.71  ?     
 227   21  OP1    P      OP2    109.442  119.600  1.500   -6.77  ?     
 228   22  C5     C6     N1     120.376  123.700  0.600   -5.54  ?     
 229   22  N1     C2     N3     120.539  114.600  0.600    9.90  ?     
 230   22  N3     C2     O2     116.634  122.300  0.600   -9.44  ?     
 231   22  OP1    P      OP2    109.564  119.600  1.500   -6.69  ?     
 232   23  C2     N3     C4     123.647  111.900  0.500   23.49  ?     
 233   23  C4     C5     N7     113.254  110.800  0.400    6.13  ?     
 234   23  C5     C6     N1     115.004  111.500  0.500    7.01  ?     
 235   23  C5     C6     O6     123.264  128.600  0.600   -8.89  ?     
 236   23  C5     N7     C8      97.247  104.300  0.500  -14.11  ?     
 237   23  C6     C5     N7     126.411  130.400  0.600   -6.65  ?     
 238   23  C8     N9     C4      99.254  106.400  0.400  -17.86  ?     
 239   23  N1     C2     N3     120.824  123.900  0.600   -5.13  ?     
 240   23  N3     C4     C5     117.298  128.600  0.500  -22.60  ?     
 241   23  N3     C4     N9     134.524  126.000  0.600   14.21  ?     
 242   23  N7     C8     N9     122.072  113.100  0.500   17.94  ?     
 243   23  N9     C4     C5     108.162  105.400  0.400    6.91  ?     
 244   23  OP1    P      OP2    108.877  119.600  1.500   -7.15  ?     
 245   24  C5     C6     N1     120.434  123.700  0.600   -5.44  ?     
 246   24  N1     C2     N3     120.611  114.600  0.600   10.02  ?     
 247   24  N3     C2     O2     117.050  122.300  0.600   -8.75  ?     
 248   24  "O4'"  "C1'"  N1     112.574  108.000  0.700    6.54  ?     
 249   24  OP1    P      OP2    108.797  119.600  1.500   -7.20  ?     
 250   25  C2     N3     C4     123.894  111.900  0.500   23.99  ?     
 251   25  C4     C5     N7     112.813  110.800  0.400    5.03  ?     
 252   25  C5     C6     N1     114.985  111.500  0.500    6.97  ?     
 253   25  C5     C6     O6     122.713  128.600  0.600   -9.81  ?     
 254   25  C5     N7     C8      97.651  104.300  0.500  -13.30  ?     
 255   25  C6     C5     N7     126.625  130.400  0.600   -6.29  ?     
 256   25  C8     N9     C4      99.269  106.400  0.400  -17.83  ?     
 257   25  N1     C2     N2     121.257  116.200  0.900    5.62  ?     
 258   25  N1     C2     N3     120.810  123.900  0.600   -5.15  ?     
 259   25  N3     C4     C5     117.535  128.600  0.500  -22.13  ?     
 260   25  N3     C4     N9     133.871  126.000  0.600   13.12  ?     
 261   25  N7     C8     N9     121.778  113.100  0.500   17.36  ?     
 262   25  N9     C4     C5     108.484  105.400  0.400    7.71  ?     
 263   25  "O4'"  "C1'"  N9     112.446  108.000  0.700    6.35  ?     
 264   25  OP1    P      OP2    108.986  119.600  1.500   -7.08  ?     
 265   26  C2     N3     C4     123.627  111.900  0.500   23.45  ?     
 266   26  C4     C5     N7     112.944  110.800  0.400    5.36  ?     
 267   26  C5     C6     N1     115.240  111.500  0.500    7.48  ?     
 268   26  C5     C6     O6     123.711  128.600  0.600   -8.15  ?     
 269   26  C5     N7     C8      98.014  104.300  0.500  -12.57  ?     
 270   26  C6     C5     N7     126.384  130.400  0.600   -6.69  ?     
 271   26  C8     N9     C4      99.012  106.400  0.400  -18.47  ?     
 272   26  N3     C4     C5     116.997  128.600  0.500  -23.21  ?     
 273   26  N3     C4     N9     134.791  126.000  0.600   14.65  ?     
 274   26  N7     C8     N9     121.685  113.100  0.500   17.17  ?     
 275   26  N9     C4     C5     108.209  105.400  0.400    7.02  ?     
 276   26  OP1    P      OP2    108.993  119.600  1.500   -7.07  ?     
 277   27  C5     C6     N1     120.567  123.700  0.600   -5.22  ?     
 278   27  N1     C2     N3     120.811  114.600  0.600   10.35  ?     
 279   27  N3     C2     O2     116.871  122.300  0.600   -9.05  ?     
 280   27  "O4'"  "C1'"  N1     112.357  108.000  0.700    6.22  ?     
 281   27  OP1    P      OP2    109.384  119.600  1.500   -6.81  ?     
 282   28  C5     C6     N1     120.002  123.700  0.600   -6.16  ?     
 283   28  N1     C2     N3     120.502  114.600  0.600    9.84  ?     
 284   28  N3     C2     O2     116.727  122.300  0.600   -9.29  ?     
 285   28  "O4'"  "C1'"  N1     113.361  108.000  0.700    7.66  ?     
 286   28  OP1    P      OP2    108.778  119.600  1.500   -7.21  ?     
 287   29  C2     N3     C4     123.525  111.900  0.500   23.25  ?     
 288   29  C4     C5     N7     112.901  110.800  0.400    5.25  ?     
 289   29  C5     C6     N1     114.801  111.500  0.500    6.60  ?     
 290   29  C5     C6     O6     122.896  128.600  0.600   -9.51  ?     
 291   29  C5     N7     C8      97.108  104.300  0.500  -14.38  ?     
 292   29  C6     C5     N7     126.460  130.400  0.600   -6.57  ?     
 293   29  C8     N9     C4      98.875  106.400  0.400  -18.81  ?     
 294   29  N1     C2     N2     120.889  116.200  0.900    5.21  ?     
 295   29  N3     C4     C5     117.680  128.600  0.500  -21.84  ?     
 296   29  N3     C4     N9     133.140  126.000  0.600   11.90  ?     
 297   29  N7     C8     N9     122.427  113.100  0.500   18.65  ?     
 298   29  N9     C4     C5     108.640  105.400  0.400    8.10  ?     
 299   29  "O4'"  "C1'"  N9     113.822  108.000  0.700    8.32  ?     
 300   29  OP1    P      OP2    109.274  119.600  1.500   -6.88  ?     
 301   30  C2     N3     C4     123.556  111.900  0.500   23.31  ?     
 302   30  C4     C5     N7     112.939  110.800  0.400    5.35  ?     
 303   30  C5     C6     N1     115.006  111.500  0.500    7.01  ?     
 304   30  C5     C6     O6     122.793  128.600  0.600   -9.68  ?     
 305   30  C5     N7     C8      97.793  104.300  0.500  -13.02  ?     
 306   30  C6     C5     N7     126.054  130.400  0.600   -7.24  ?     
 307   30  C8     N9     C4      98.697  106.400  0.400  -19.26  ?     
 308   30  N3     C4     C5     116.950  128.600  0.500  -23.30  ?     
 309   30  N3     C4     N9     134.705  126.000  0.600   14.51  ?     
 310   30  N7     C8     N9     122.191  113.100  0.500   18.18  ?     
 311   30  N9     C4     C5     108.341  105.400  0.400    7.35  ?     
 312   30  OP1    P      OP2    109.348  119.600  1.500   -6.83  ?     
 313   31  C2     N3     C4     123.457  111.900  0.500   23.11  ?     
 314   31  C4     C5     N7     113.305  110.800  0.400    6.26  ?     
 315   31  C5     C6     N1     114.679  111.500  0.500    6.36  ?     
 316   31  C5     C6     O6     122.256  128.600  0.600  -10.57  ?     
 317   31  C5     N7     C8      97.231  104.300  0.500  -14.14  ?     
 318   31  C6     C5     N7     125.645  130.400  0.600   -7.92  ?     
 319   31  C8     N9     C4      98.379  106.400  0.400  -20.05  ?     
 320   31  N1     C2     N3     120.817  123.900  0.600   -5.14  ?     
 321   31  N1     C6     O6     123.050  119.900  0.600    5.25  ?     
 322   31  N3     C4     C5     117.245  128.600  0.500  -22.71  ?     
 323   31  N3     C4     N9     134.244  126.000  0.600   13.74  ?     
 324   31  N7     C8     N9     122.669  113.100  0.500   19.14  ?     
 325   31  N9     C4     C5     108.332  105.400  0.400    7.33  ?     
 326   31  "O4'"  "C1'"  N9     111.938  108.000  0.700    5.62  ?     
 327   31  OP1    P      OP2    107.593  119.600  1.500   -8.01  ?     
 328   32  C2     N3     C4     123.595  111.900  0.500   23.39  ?     
 329   32  C4     C5     N7     113.180  110.800  0.400    5.95  ?     
 330   32  "C5'"  "C4'"  "C3'"  123.708  114.100  1.800    5.34  ?     
 331   32  C5     C6     N1     115.322  111.500  0.500    7.64  ?     
 332   32  C5     C6     O6     123.818  128.600  0.600   -7.97  ?     
 333   32  C5     N7     C8      97.884  104.300  0.500  -12.83  ?     
 334   32  C6     C5     N7     126.305  130.400  0.600   -6.83  ?     
 335   32  C8     N9     C4      99.128  106.400  0.400  -18.18  ?     
 336   32  N1     C2     N3     120.856  123.900  0.600   -5.07  ?     
 337   32  N3     C4     C5     116.902  128.600  0.500  -23.40  ?     
 338   32  N3     C4     N9     135.182  126.000  0.600   15.30  ?     
 339   32  N7     C8     N9     121.882  113.100  0.500   17.56  ?     
 340   32  N9     C4     C5     107.897  105.400  0.400    6.24  ?     
 341   32  "O4'"  "C1'"  N9     111.922  108.000  0.700    5.60  ?     
 342   32  OP1    P      OP2    108.656  119.600  1.500   -7.30  ?     
 343   33  N1     C2     N3     120.696  114.600  0.600   10.16  ?     
 344   33  N3     C2     O2     116.696  122.300  0.600   -9.34  ?     
 345   34  C5     C6     N1     120.457  123.700  0.600   -5.41  ?     
 346   34  N1     C2     N3     120.688  114.600  0.600   10.15  ?     
 347   34  N3     C2     O2     116.918  122.300  0.600   -8.97  ?     
 348   34  "O4'"  "C1'"  N1     112.950  108.000  0.700    7.07  ?     
 349   34  OP1    P      OP2    108.577  119.600  1.500   -7.35  ?     
 350   35  P      "O3'"  "C3'"  132.614  119.700  1.200   10.76  Y     
 351   35  C2     N3     C4     123.571  111.900  0.500   23.34  ?     
 352   35  "C4'"  "C3'"  "C2'"   96.141  103.100  0.900   -7.73  ?     
 353   35  C4     C5     N7     113.261  110.800  0.400    6.15  ?     
 354   35  C4     N9     "C1'"  133.970  126.500  1.300    5.75  ?     
 355   35  C5     C6     N1     114.491  111.500  0.500    5.98  ?     
 356   35  C5     C6     O6     121.875  128.600  0.600  -11.21  ?     
 357   35  C5     N7     C8      96.827  104.300  0.500  -14.95  ?     
 358   35  C6     C5     N7     125.961  130.400  0.600   -7.40  ?     
 359   35  C8     N9     C4      98.720  106.400  0.400  -19.20  ?     
 360   35  N1     C2     N2     120.961  116.200  0.900    5.29  ?     
 361   35  N1     C2     N3     120.622  123.900  0.600   -5.46  ?     
 362   35  N1     C6     O6     123.634  119.900  0.600    6.22  ?     
 363   35  N3     C4     C5     117.522  128.600  0.500  -22.16  ?     
 364   35  N3     C4     N9     134.321  126.000  0.600   13.87  ?     
 365   35  N7     C8     N9     122.826  113.100  0.500   19.45  ?     
 366   35  N9     C4     C5     107.940  105.400  0.400    6.35  ?     
 367   35  "O4'"  "C4'"  "C3'"  110.351  106.000  0.600    7.25  ?     
 368   35  OP1    P      OP2    109.119  119.600  1.500   -6.99  ?     
 369   36  C2     N3     C4     123.541  111.900  0.500   23.28  ?     
 370   36  C4     C5     N7     112.940  110.800  0.400    5.35  ?     
 371   36  C5     C6     N1     115.195  111.500  0.500    7.39  ?     
 372   36  C5     C6     O6     123.416  128.600  0.600   -8.64  ?     
 373   36  C5     N7     C8      97.760  104.300  0.500  -13.08  ?     
 374   36  C6     C5     N7     126.928  130.400  0.600   -5.79  ?     
 375   36  C8     N9     C4      99.391  106.400  0.400  -17.52  ?     
 376   36  N3     C4     C5     117.555  128.600  0.500  -22.09  ?     
 377   36  N3     C4     N9     133.912  126.000  0.600   13.19  ?     
 378   36  N7     C8     N9     121.326  113.100  0.500   16.45  ?     
 379   36  N9     C4     C5     108.480  105.400  0.400    7.70  ?     
 380   36  "O4'"  "C1'"  N9     115.520  108.000  0.700   10.74  ?     
 381   36  OP1    P      OP2    109.444  119.600  1.500   -6.77  ?     
 382   37  C5     C6     N1     120.390  123.700  0.600   -5.52  ?     
 383   37  N1     C2     N3     120.586  114.600  0.600    9.98  ?     
 384   37  N3     C2     O2     116.607  122.300  0.600   -9.49  ?     
 385   37  OP1    P      OP2    109.601  119.600  1.500   -6.67  ?     
 386   38  C2     N3     C4     123.574  111.900  0.500   23.35  ?     
 387   38  C4     C5     N7     113.291  110.800  0.400    6.23  ?     
 388   38  C5     C6     N1     115.021  111.500  0.500    7.04  ?     
 389   38  C5     C6     O6     123.187  128.600  0.600   -9.02  ?     
 390   38  C5     N7     C8      97.261  104.300  0.500  -14.08  ?     
 391   38  C6     C5     N7     126.375  130.400  0.600   -6.71  ?     
 392   38  C8     N9     C4      99.284  106.400  0.400  -17.79  ?     
 393   38  N1     C2     N3     120.847  123.900  0.600   -5.09  ?     
 394   38  N3     C4     C5     117.346  128.600  0.500  -22.51  ?     
 395   38  N3     C4     N9     134.455  126.000  0.600   14.09  ?     
 396   38  N7     C8     N9     121.992  113.100  0.500   17.78  ?     
 397   38  N9     C4     C5     108.166  105.400  0.400    6.91  ?     
 398   38  OP1    P      OP2    108.852  119.600  1.500   -7.17  ?     
 399   39  C5     C6     N1     120.443  123.700  0.600   -5.43  ?     
 400   39  N1     C2     N3     120.703  114.600  0.600   10.17  ?     
 401   39  N3     C2     O2     116.947  122.300  0.600   -8.92  ?     
 402   39  "O4'"  "C1'"  N1     112.476  108.000  0.700    6.39  ?     
 403   39  OP1    P      OP2    108.813  119.600  1.500   -7.19  ?     
 404   40  C2     N3     C4     123.928  111.900  0.500   24.06  ?     
 405   40  C5     C6     N1     114.930  111.500  0.500    6.86  ?     
 406   40  C5     C6     O6     122.719  128.600  0.600   -9.80  ?     
 407   40  C5     N7     C8      97.691  104.300  0.500  -13.22  ?     
 408   40  C6     C5     N7     126.645  130.400  0.600   -6.26  ?     
 409   40  C8     N9     C4      99.312  106.400  0.400  -17.72  ?     
 410   40  N1     C2     N2     121.386  116.200  0.900    5.76  ?     
 411   40  N1     C2     N3     120.792  123.900  0.600   -5.18  ?     
 412   40  N3     C4     C5     117.541  128.600  0.500  -22.12  ?     
 413   40  N3     C4     N9     133.780  126.000  0.600   12.97  ?     
 414   40  N7     C8     N9     121.696  113.100  0.500   17.19  ?     
 415   40  N9     C4     C5     108.555  105.400  0.400    7.89  ?     
 416   40  "O4'"  "C1'"  N9     112.530  108.000  0.700    6.47  ?     
 417   40  OP1    P      OP2    108.975  119.600  1.500   -7.08  ?     
 418   41  C2     N3     C4     123.682  111.900  0.500   23.56  ?     
 419   41  C4     C5     N7     112.978  110.800  0.400    5.45  ?     
 420   41  C5     C6     N1     115.201  111.500  0.500    7.40  ?     
 421   41  C5     C6     O6     123.739  128.600  0.600   -8.10  ?     
 422   41  C5     N7     C8      98.013  104.300  0.500  -12.57  ?     
 423   41  C6     C5     N7     126.312  130.400  0.600   -6.81  ?     
 424   41  C8     N9     C4      99.060  106.400  0.400  -18.35  ?     
 425   41  N3     C4     C5     116.928  128.600  0.500  -23.34  ?     
 426   41  N3     C4     N9     134.890  126.000  0.600   14.82  ?     
 427   41  N7     C8     N9     121.639  113.100  0.500   17.08  ?     
 428   41  N9     C4     C5     108.177  105.400  0.400    6.94  ?     
 429   41  OP1    P      OP2    108.947  119.600  1.500   -7.10  ?     
 430   42  C5     C6     N1     120.600  123.700  0.600   -5.17  ?     
 431   42  N1     C2     N3     120.813  114.600  0.600   10.35  ?     
 432   42  N3     C2     O2     116.929  122.300  0.600   -8.95  ?     
 433   42  "O4'"  "C1'"  N1     112.315  108.000  0.700    6.16  ?     
 434   42  OP1    P      OP2    109.460  119.600  1.500   -6.76  ?     
 435   43  C5     C6     N1     120.061  123.700  0.600   -6.07  ?     
 436   43  N1     C2     N3     120.591  114.600  0.600    9.98  ?     
 437   43  N3     C2     O2     116.676  122.300  0.600   -9.37  ?     
 438   43  "O4'"  "C1'"  N1     113.124  108.000  0.700    7.32  ?     
 439   43  OP1    P      OP2    108.694  119.600  1.500   -7.27  ?     
 440   44  C2     N3     C4     123.438  111.900  0.500   23.08  ?     
 441   44  C4     C5     N7     112.986  110.800  0.400    5.46  ?     
 442   44  C5     C6     N1     114.794  111.500  0.500    6.59  ?     
 443   44  C5     C6     O6     122.937  128.600  0.600   -9.44  ?     
 444   44  C5     N7     C8      97.059  104.300  0.500  -14.48  ?     
 445   44  C6     C5     N7     126.431  130.400  0.600   -6.62  ?     
 446   44  C8     N9     C4      98.937  106.400  0.400  -18.66  ?     
 447   44  N1     C2     N2     120.867  116.200  0.900    5.18  ?     
 448   44  N3     C4     C5     117.787  128.600  0.500  -21.63  ?     
 449   44  N3     C4     N9     133.082  126.000  0.600   11.80  ?     
 450   44  N7     C8     N9     122.427  113.100  0.500   18.65  ?     
 451   44  N9     C4     C5     108.536  105.400  0.400    7.84  ?     
 452   44  "O4'"  "C1'"  N9     113.763  108.000  0.700    8.23  ?     
 453   44  OP1    P      OP2    109.238  119.600  1.500   -6.91  ?     
 454   45  C2     N3     C4     123.635  111.900  0.500   23.47  ?     
 455   45  C4     C5     N7     112.983  110.800  0.400    5.46  ?     
 456   45  C5     C6     N1     115.060  111.500  0.500    7.12  ?     
 457   45  C5     C6     O6     122.687  128.600  0.600   -9.86  ?     
 458   45  C5     N7     C8      97.832  104.300  0.500  -12.94  ?     
 459   45  C6     C5     N7     126.047  130.400  0.600   -7.25  ?     
 460   45  C8     N9     C4      98.709  106.400  0.400  -19.23  ?     
 461   45  N3     C4     C5     117.007  128.600  0.500  -23.18  ?     
 462   45  N3     C4     N9     134.712  126.000  0.600   14.52  ?     
 463   45  N7     C8     N9     122.168  113.100  0.500   18.14  ?     
 464   45  N9     C4     C5     108.273  105.400  0.400    7.18  ?     
 465   45  OP1    P      OP2    109.422  119.600  1.500   -6.79  ?     
 466   46  C2     N3     C4     123.450  111.900  0.500   23.10  ?     
 467   46  C4     C5     N7     113.277  110.800  0.400    6.19  ?     
 468   46  C5     C6     N1     114.656  111.500  0.500    6.31  ?     
 469   46  C5     C6     O6     122.390  128.600  0.600  -10.35  ?     
 470   46  C5     N7     C8      97.103  104.300  0.500  -14.39  ?     
 471   46  C6     C5     N7     125.752  130.400  0.600   -7.75  ?     
 472   46  C8     N9     C4      98.357  106.400  0.400  -20.11  ?     
 473   46  N1     C2     N3     120.740  123.900  0.600   -5.27  ?     
 474   46  N1     C6     O6     122.941  119.900  0.600    5.07  ?     
 475   46  N3     C4     C5     117.289  128.600  0.500  -22.62  ?     
 476   46  N3     C4     N9     134.154  126.000  0.600   13.59  ?     
 477   46  N7     C8     N9     122.764  113.100  0.500   19.33  ?     
 478   46  N9     C4     C5     108.366  105.400  0.400    7.42  ?     
 479   46  "O4'"  "C1'"  N9     112.189  108.000  0.700    5.99  ?     
 480   46  OP1    P      OP2    107.647  119.600  1.500   -7.97  ?     
 481   47  C2     N3     C4     123.756  111.900  0.500   23.71  ?     
 482   47  C4     C5     N7     113.086  110.800  0.400    5.72  ?     
 483   47  "C5'"  "C4'"  "C3'"  123.899  114.100  1.800    5.44  ?     
 484   47  C5     C6     N1     115.082  111.500  0.500    7.17  ?     
 485   47  C5     C6     O6     123.607  128.600  0.600   -8.32  ?     
 486   47  C5     N7     C8      97.832  104.300  0.500  -12.94  ?     
 487   47  C6     C5     N7     126.262  130.400  0.600   -6.90  ?     
 488   47  C8     N9     C4      98.928  106.400  0.400  -18.68  ?     
 489   47  N1     C2     N3     120.779  123.900  0.600   -5.20  ?     
 490   47  N3     C4     C5     116.858  128.600  0.500  -23.48  ?     
 491   47  N3     C4     N9     135.041  126.000  0.600   15.07  ?     
 492   47  N7     C8     N9     122.022  113.100  0.500   17.84  ?     
 493   47  N9     C4     C5     108.091  105.400  0.400    6.73  ?     
 494   47  "O4'"  "C1'"  N9     111.774  108.000  0.700    5.39  ?     
 495   47  OP1    P      OP2    108.745  119.600  1.500   -7.24  ?     
 496   48  C5     C6     N1     120.650  123.700  0.600   -5.08  ?     
 497   48  N1     C2     N3     120.669  114.600  0.600   10.11  ?     
 498   48  N3     C2     O2     116.605  122.300  0.600   -9.49  ?     
 499   48  "O4'"  "C1'"  N1     111.789  108.000  0.700    5.41  ?     
 500   49  C5     C6     N1     120.238  123.700  0.600   -5.77  ?     
 501   49  N1     C2     N3     120.567  114.600  0.600    9.95  ?     
 502   49  N3     C2     O2     116.801  122.300  0.600   -9.16  ?     
 503   49  "O4'"  "C1'"  N1     113.516  108.000  0.700    7.88  ?     
 504   49  OP1    P      OP2    108.998  119.600  1.500   -7.07  ?     
 505   50  P      "O3'"  "C3'"  132.747  119.700  1.200   10.87  Y     
 506   50  C2     N3     C4     123.550  111.900  0.500   23.30  ?     
 507   50  "C4'"  "C3'"  "C2'"   96.116  103.100  0.900   -7.76  ?     
 508   50  C4     C5     N7     113.187  110.800  0.400    5.97  ?     
 509   50  C4     N9     "C1'"  134.120  126.500  1.300    5.86  ?     
 510   50  C5     C6     N1     114.626  111.500  0.500    6.25  ?     
 511   50  C5     C6     O6     121.867  128.600  0.600  -11.22  ?     
 512   50  C5     N7     C8      96.919  104.300  0.500  -14.76  ?     
 513   50  C6     C5     N7     125.997  130.400  0.600   -7.34  ?     
 514   50  C8     N9     C4      98.840  106.400  0.400  -18.90  ?     
 515   50  N1     C2     N2     120.867  116.200  0.900    5.18  ?     
 516   50  N1     C2     N3     120.704  123.900  0.600   -5.33  ?     
 517   50  N1     C6     O6     123.501  119.900  0.600    6.00  ?     
 518   50  N3     C4     C5     117.497  128.600  0.500  -22.21  ?     
 519   50  N3     C4     N9     134.189  126.000  0.600   13.65  ?     
 520   50  N7     C8     N9     122.654  113.100  0.500   19.11  ?     
 521   50  N9     C4     C5     107.870  105.400  0.400    6.17  ?     
 522   50  "O4'"  "C4'"  "C3'"  110.581  106.000  0.600    7.63  ?     
 523   50  OP1    P      OP2    108.999  119.600  1.500   -7.07  ?     
 524   51  C2     N3     C4     123.552  111.900  0.500   23.30  ?     
 525   51  C4     C5     N7     113.030  110.800  0.400    5.58  ?     
 526   51  C5     C6     N1     115.169  111.500  0.500    7.34  ?     
 527   51  C5     C6     O6     123.541  128.600  0.600   -8.43  ?     
 528   51  C5     N7     C8      97.744  104.300  0.500  -13.11  ?     
 529   51  C6     C5     N7     126.837  130.400  0.600   -5.94  ?     
 530   51  C8     N9     C4      99.343  106.400  0.400  -17.64  ?     
 531   51  N1     C2     N3     120.835  123.900  0.600   -5.11  ?     
 532   51  N3     C4     C5     117.430  128.600  0.500  -22.34  ?     
 533   51  N3     C4     N9     134.114  126.000  0.600   13.52  ?     
 534   51  N7     C8     N9     121.351  113.100  0.500   16.50  ?     
 535   51  N9     C4     C5     108.445  105.400  0.400    7.61  ?     
 536   51  "O4'"  "C1'"  N9     115.419  108.000  0.700   10.60  ?     
 537   51  OP1    P      OP2    109.445  119.600  1.500   -6.77  ?     
 538   52  C5     C6     N1     120.345  123.700  0.600   -5.59  ?     
 539   52  N1     C2     N3     120.566  114.600  0.600    9.94  ?     
 540   52  N3     C2     O2     116.704  122.300  0.600   -9.33  ?     
 541   52  "O4'"  "C1'"  N1     111.761  108.000  0.700    5.37  ?     
 542   52  OP1    P      OP2    109.557  119.600  1.500   -6.70  ?     
 543   53  C2     N3     C4     123.653  111.900  0.500   23.50  ?     
 544   53  C4     C5     N7     113.232  110.800  0.400    6.08  ?     
 545   53  C5     C6     N1     115.024  111.500  0.500    7.05  ?     
 546   53  C5     C6     O6     123.174  128.600  0.600   -9.04  ?     
 547   53  C5     N7     C8      97.299  104.300  0.500  -14.00  ?     
 548   53  C6     C5     N7     126.456  130.400  0.600   -6.57  ?     
 549   53  C8     N9     C4      99.405  106.400  0.400  -17.49  ?     
 550   53  N1     C2     N3     120.725  123.900  0.600   -5.29  ?     
 551   53  N3     C4     C5     117.381  128.600  0.500  -22.44  ?     
 552   53  N3     C4     N9     134.386  126.000  0.600   13.98  ?     
 553   53  N7     C8     N9     121.843  113.100  0.500   17.48  ?     
 554   53  N9     C4     C5     108.208  105.400  0.400    7.02  ?     
 555   53  "O4'"  "C1'"  N9     111.555  108.000  0.700    5.08  ?     
 556   53  OP1    P      OP2    108.853  119.600  1.500   -7.17  ?     
 557   54  C5     C6     N1     120.422  123.700  0.600   -5.46  ?     
 558   54  N1     C2     N3     120.639  114.600  0.600   10.06  ?     
 559   54  N3     C2     O2     117.022  122.300  0.600   -8.80  ?     
 560   54  "O4'"  "C1'"  N1     112.589  108.000  0.700    6.55  ?     
 561   54  OP1    P      OP2    109.298  119.600  1.500   -6.87  ?     
 562   55  C2     N3     C4     123.735  111.900  0.500   23.67  ?     
 563   55  C4     C5     N7     112.870  110.800  0.400    5.18  ?     
 564   55  C5     C6     N1     114.969  111.500  0.500    6.94  ?     
 565   55  C5     C6     O6     122.940  128.600  0.600   -9.43  ?     
 566   55  C5     N7     C8      97.636  104.300  0.500  -13.33  ?     
 567   55  C6     C5     N7     126.706  130.400  0.600   -6.16  ?     
 568   55  C8     N9     C4      99.403  106.400  0.400  -17.49  ?     
 569   55  N1     C2     N2     120.826  116.200  0.900    5.14  ?     
 570   55  N1     C2     N3     120.769  123.900  0.600   -5.22  ?     
 571   55  N3     C4     C5     117.528  128.600  0.500  -22.14  ?     
 572   55  N3     C4     N9     134.134  126.000  0.600   13.56  ?     
 573   55  N7     C8     N9     121.777  113.100  0.500   17.35  ?     
 574   55  N9     C4     C5     108.311  105.400  0.400    7.28  ?     
 575   55  "O4'"  "C1'"  N9     111.813  108.000  0.700    5.45  ?     
 576   55  OP1    P      OP2    108.940  119.600  1.500   -7.11  ?     
 577   56  C2     N3     C4     123.659  111.900  0.500   23.52  ?     
 578   56  C4     C5     N7     112.985  110.800  0.400    5.46  ?     
 579   56  C5     C6     N1     115.178  111.500  0.500    7.36  ?     
 580   56  C5     C6     O6     123.627  128.600  0.600   -8.29  ?     
 581   56  C5     N7     C8      98.192  104.300  0.500  -12.21  ?     
 582   56  C6     C5     N7     126.132  130.400  0.600   -7.11  ?     
 583   56  C8     N9     C4      98.939  106.400  0.400  -18.65  ?     
 584   56  N3     C4     C5     116.745  128.600  0.500  -23.71  ?     
 585   56  N3     C4     N9     135.158  126.000  0.600   15.26  ?     
 586   56  N7     C8     N9     121.634  113.100  0.500   17.07  ?     
 587   56  N9     C4     C5     108.097  105.400  0.400    6.74  ?     
 588   56  OP1    P      OP2    108.972  119.600  1.500   -7.08  ?     
 589   57  N1     C2     N3     120.805  114.600  0.600   10.34  ?     
 590   57  N3     C2     O2     116.880  122.300  0.600   -9.03  ?     
 591   57  "O4'"  "C1'"  N1     112.194  108.000  0.700    5.99  ?     
 592   57  OP1    P      OP2    109.658  119.600  1.500   -6.63  ?     
 593   58  P      "O3'"  "C3'"  126.340  119.700  1.200    5.53  Y     
 594   58  C5     C6     N1     119.904  123.700  0.600   -6.33  ?     
 595   58  N1     C2     N3     120.525  114.600  0.600    9.88  ?     
 596   58  N3     C2     O2     116.338  122.300  0.600   -9.94  ?     
 597   58  OP1    P      OP2    108.765  119.600  1.500   -7.22  ?     
 598   59  C2     N3     C4     123.311  111.900  0.500   22.82  ?     
 599   59  C4     C5     N7     112.910  110.800  0.400    5.28  ?     
 600   59  C5     C6     N1     114.871  111.500  0.500    6.74  ?     
 601   59  C5     C6     O6     122.994  128.600  0.600   -9.34  ?     
 602   59  C5     N7     C8      97.123  104.300  0.500  -14.35  ?     
 603   59  C6     C5     N7     126.435  130.400  0.600   -6.61  ?     
 604   59  C8     N9     C4      98.911  106.400  0.400  -18.72  ?     
 605   59  N1     C2     N2     120.741  116.200  0.900    5.04  ?     
 606   59  N3     C4     C5     117.798  128.600  0.500  -21.61  ?     
 607   59  N3     C4     N9     133.025  126.000  0.600   11.71  ?     
 608   59  N7     C8     N9     122.411  113.100  0.500   18.62  ?     
 609   59  N9     C4     C5     108.607  105.400  0.400    8.02  ?     
 610   59  "O4'"  "C1'"  N9     113.714  108.000  0.700    8.16  ?     
 611   59  OP1    P      OP2    109.329  119.600  1.500   -6.85  ?     
 612   60  C2     N3     C4     123.580  111.900  0.500   23.36  ?     
 613   60  C4     C5     N7     112.947  110.800  0.400    5.37  ?     
 614   60  C5     C6     N1     115.117  111.500  0.500    7.24  ?     
 615   60  C5     C6     O6     122.922  128.600  0.600   -9.46  ?     
 616   60  C5     N7     C8      97.847  104.300  0.500  -12.91  ?     
 617   60  C6     C5     N7     126.094  130.400  0.600   -7.18  ?     
 618   60  C8     N9     C4      98.771  106.400  0.400  -19.07  ?     
 619   60  N3     C4     C5     116.901  128.600  0.500  -23.40  ?     
 620   60  N3     C4     N9     134.782  126.000  0.600   14.64  ?     
 621   60  N7     C8     N9     122.137  113.100  0.500   18.07  ?     
 622   60  N9     C4     C5     108.294  105.400  0.400    7.24  ?     
 623   60  OP1    P      OP2    109.274  119.600  1.500   -6.88  ?     
 624   61  C2     N3     C4     123.456  111.900  0.500   23.11  ?     
 625   61  C4     C5     N7     113.359  110.800  0.400    6.40  ?     
 626   61  C5     C6     N1     114.579  111.500  0.500    6.16  ?     
 627   61  C5     C6     O6     122.453  128.600  0.600  -10.24  ?     
 628   61  C5     N7     C8      97.165  104.300  0.500  -14.27  ?     
 629   61  C6     C5     N7     125.548  130.400  0.600   -8.09  ?     
 630   61  C8     N9     C4      98.323  106.400  0.400  -20.19  ?     
 631   61  N1     C2     N3     120.744  123.900  0.600   -5.26  ?     
 632   61  N1     C6     O6     122.952  119.900  0.600    5.09  ?     
 633   61  N3     C4     C5     117.156  128.600  0.500  -22.89  ?     
 634   61  N3     C4     N9     134.411  126.000  0.600   14.02  ?     
 635   61  N7     C8     N9     122.791  113.100  0.500   19.38  ?     
 636   61  N9     C4     C5     108.259  105.400  0.400    7.15  ?     
 637   61  "O4'"  "C1'"  N9     112.148  108.000  0.700    5.93  ?     
 638   61  OP1    P      OP2    107.599  119.600  1.500   -8.00  ?     
 639   62  C2     N3     C4     123.748  111.900  0.500   23.70  ?     
 640   62  C4     C5     N7     113.195  110.800  0.400    5.99  ?     
 641   62  "C5'"  "C4'"  "C3'"  124.024  114.100  1.800    5.51  ?     
 642   62  C5     C6     N1     115.240  111.500  0.500    7.48  ?     
 643   62  C5     C6     O6     123.576  128.600  0.600   -8.37  ?     
 644   62  C5     N7     C8      97.861  104.300  0.500  -12.88  ?     
 645   62  C6     C5     N7     126.227  130.400  0.600   -6.96  ?     
 646   62  C8     N9     C4      99.025  106.400  0.400  -18.44  ?     
 647   62  N1     C2     N3     120.688  123.900  0.600   -5.35  ?     
 648   62  N3     C4     C5     116.895  128.600  0.500  -23.41  ?     
 649   62  N3     C4     N9     135.128  126.000  0.600   15.21  ?     
 650   62  N7     C8     N9     121.931  113.100  0.500   17.66  ?     
 651   62  N9     C4     C5     107.964  105.400  0.400    6.41  ?     
 652   62  "O4'"  "C1'"  N9     111.570  108.000  0.700    5.10  ?     
 653   62  OP1    P      OP2    108.612  119.600  1.500   -7.33  ?     
 654   63  N1     C2     N3     120.720  114.600  0.600   10.20  ?     
 655   63  N3     C2     O2     116.560  122.300  0.600   -9.57  ?     
 656   63  "O4'"  "C1'"  N1     111.915  108.000  0.700    5.59  ?     
 657   64  C5     C6     N1     120.264  123.700  0.600   -5.73  ?     
 658   64  N1     C2     N3     120.559  114.600  0.600    9.93  ?     
 659   64  N3     C2     O2     116.793  122.300  0.600   -9.18  ?     
 660   64  "O4'"  "C1'"  N1     113.417  108.000  0.700    7.74  ?     
 661   64  OP1    P      OP2    108.925  119.600  1.500   -7.12  ?     
 662   65  P      "O3'"  "C3'"  132.773  119.700  1.200   10.89  Y     
 663   65  C2     N3     C4     123.580  111.900  0.500   23.36  ?     
 664   65  "C4'"  "C3'"  "C2'"   96.068  103.100  0.900   -7.81  ?     
 665   65  C4     C5     N7     113.287  110.800  0.400    6.22  ?     
 666   65  C4     N9     "C1'"  134.042  126.500  1.300    5.80  ?     
 667   65  C5     C6     N1     114.565  111.500  0.500    6.13  ?     
 668   65  C5     C6     O6     121.841  128.600  0.600  -11.27  ?     
 669   65  C5     N7     C8      96.976  104.300  0.500  -14.65  ?     
 670   65  C6     C5     N7     125.839  130.400  0.600   -7.60  ?     
 671   65  C8     N9     C4      98.898  106.400  0.400  -18.76  ?     
 672   65  N1     C2     N2     120.922  116.200  0.900    5.25  ?     
 673   65  N1     C2     N3     120.588  123.900  0.600   -5.52  ?     
 674   65  N1     C6     O6     123.584  119.900  0.600    6.14  ?     
 675   65  N3     C4     C5     117.488  128.600  0.500  -22.22  ?     
 676   65  N3     C4     N9     134.225  126.000  0.600   13.71  ?     
 677   65  N7     C8     N9     122.547  113.100  0.500   18.89  ?     
 678   65  N9     C4     C5     107.827  105.400  0.400    6.07  ?     
 679   65  "O4'"  "C4'"  "C3'"  110.720  106.000  0.600    7.87  ?     
 680   65  OP1    P      OP2    109.074  119.600  1.500   -7.02  ?     
 681   66  C2     N3     C4     123.444  111.900  0.500   23.09  ?     
 682   66  C4     C5     N7     113.084  110.800  0.400    5.71  ?     
 683   66  C5     C6     N1     115.165  111.500  0.500    7.33  ?     
 684   66  C5     C6     O6     123.631  128.600  0.600   -8.28  ?     
 685   66  C5     N7     C8      97.659  104.300  0.500  -13.28  ?     
 686   66  C6     C5     N7     126.880  130.400  0.600   -5.87  ?     
 687   66  C8     N9     C4      99.361  106.400  0.400  -17.60  ?     
 688   66  N1     C2     N3     120.837  123.900  0.600   -5.11  ?     
 689   66  N3     C4     C5     117.524  128.600  0.500  -22.15  ?     
 690   66  N3     C4     N9     134.087  126.000  0.600   13.48  ?     
 691   66  N7     C8     N9     121.397  113.100  0.500   16.59  ?     
 692   66  N9     C4     C5     108.370  105.400  0.400    7.43  ?     
 693   66  "O4'"  "C1'"  N9     115.381  108.000  0.700   10.54  ?     
 694   66  OP1    P      OP2    109.452  119.600  1.500   -6.76  ?     
 695   67  C5     C6     N1     120.400  123.700  0.600   -5.50  ?     
 696   67  N1     C2     N3     120.529  114.600  0.600    9.88  ?     
 697   67  N3     C2     O2     116.651  122.300  0.600   -9.41  ?     
 698   67  OP1    P      OP2    109.543  119.600  1.500   -6.71  ?     
 699   68  C2     N3     C4     123.737  111.900  0.500   23.68  ?     
 700   68  C4     C5     N7     113.223  110.800  0.400    6.06  ?     
 701   68  C5     C6     N1     115.055  111.500  0.500    7.11  ?     
 702   68  C5     C6     O6     123.217  128.600  0.600   -8.97  ?     
 703   68  C5     N7     C8      97.315  104.300  0.500  -13.97  ?     
 704   68  C6     C5     N7     126.479  130.400  0.600   -6.54  ?     
 705   68  C8     N9     C4      99.314  106.400  0.400  -17.71  ?     
 706   68  N1     C2     N3     120.712  123.900  0.600   -5.31  ?     
 707   68  N3     C4     C5     117.347  128.600  0.500  -22.51  ?     
 708   68  N3     C4     N9     134.397  126.000  0.600   13.99  ?     
 709   68  N7     C8     N9     121.912  113.100  0.500   17.62  ?     
 710   68  N9     C4     C5     108.224  105.400  0.400    7.06  ?     
 711   68  OP1    P      OP2    108.897  119.600  1.500   -7.13  ?     
 712   69  C5     C6     N1     120.556  123.700  0.600   -5.24  ?     
 713   69  N1     C2     N3     120.740  114.600  0.600   10.23  ?     
 714   69  N3     C2     O2     116.974  122.300  0.600   -8.88  ?     
 715   69  "O4'"  "C1'"  N1     112.165  108.000  0.700    5.95  ?     
 716   69  OP1    P      OP2    109.341  119.600  1.500   -6.84  ?     
 717   70  C2     N3     C4     123.459  111.900  0.500   23.12  ?     
 718   70  C4     C5     N7     112.967  110.800  0.400    5.42  ?     
 719   70  C5     C6     N1     115.014  111.500  0.500    7.03  ?     
 720   70  C5     C6     O6     123.145  128.600  0.600   -9.09  ?     
 721   70  C5     N7     C8      97.704  104.300  0.500  -13.19  ?     
 722   70  C6     C5     N7     126.589  130.400  0.600   -6.35  ?     
 723   70  C8     N9     C4      99.586  106.400  0.400  -17.04  ?     
 724   70  N1     C2     N3     120.859  123.900  0.600   -5.07  ?     
 725   70  N3     C4     C5     117.460  128.600  0.500  -22.28  ?     
 726   70  N3     C4     N9     134.429  126.000  0.600   14.05  ?     
 727   70  N7     C8     N9     121.672  113.100  0.500   17.14  ?     
 728   70  N9     C4     C5     108.042  105.400  0.400    6.60  ?     
 729   70  "O4'"  "C1'"  N9     112.219  108.000  0.700    6.03  ?     
 730   70  OP1    P      OP2    108.982  119.600  1.500   -7.08  ?     
 731   71  C2     N3     C4     123.878  111.900  0.500   23.96  ?     
 732   71  C4     C5     N7     112.946  110.800  0.400    5.37  ?     
 733   71  C5     C6     N1     115.294  111.500  0.500    7.59  ?     
 734   71  C5     C6     O6     123.562  128.600  0.600   -8.40  ?     
 735   71  C5     N7     C8      97.907  104.300  0.500  -12.79  ?     
 736   71  C6     C5     N7     126.401  130.400  0.600   -6.67  ?     
 737   71  C8     N9     C4      98.774  106.400  0.400  -19.06  ?     
 738   71  N3     C4     C5     116.824  128.600  0.500  -23.55  ?     
 739   71  N3     C4     N9     134.742  126.000  0.600   14.57  ?     
 740   71  N7     C8     N9     121.879  113.100  0.500   17.56  ?     
 741   71  N9     C4     C5     108.434  105.400  0.400    7.58  ?     
 742   71  OP1    P      OP2    108.849  119.600  1.500   -7.17  ?     
 743   72  C5     C6     N1     120.393  123.700  0.600   -5.51  ?     
 744   72  N1     C2     N3     120.618  114.600  0.600   10.03  ?     
 745   72  N3     C2     O2     116.972  122.300  0.600   -8.88  ?     
 746   72  "O4'"  "C1'"  N1     112.751  108.000  0.700    6.79  ?     
 747   72  OP1    P      OP2    109.368  119.600  1.500   -6.82  ?     
 748   73  C5     C6     N1     120.233  123.700  0.600   -5.78  ?     
 749   73  C6     N1     C2     118.772  121.300  0.500   -5.06  ?     
 750   73  N1     C2     N3     120.877  114.600  0.600   10.46  ?     
 751   73  N3     C2     O2     116.018  122.300  0.600  -10.47  ?     
 752   73  "O4'"  "C1'"  N1     111.557  108.000  0.700    5.08  ?     
 753   73  OP1    P      OP2    109.235  119.600  1.500   -6.91  ?     
 754   74  C2     N3     C4     123.248  111.900  0.500   22.70  ?     
 755   74  C4     C5     N7     113.029  110.800  0.400    5.57  ?     
 756   74  C5     C6     N1     114.878  111.500  0.500    6.76  ?     
 757   74  C5     C6     O6     123.151  128.600  0.600   -9.08  ?     
 758   74  C5     N7     C8      97.172  104.300  0.500  -14.26  ?     
 759   74  C6     C5     N7     126.344  130.400  0.600   -6.76  ?     
 760   74  C8     N9     C4      99.130  106.400  0.400  -18.18  ?     
 761   74  N3     C4     C5     117.691  128.600  0.500  -21.82  ?     
 762   74  N3     C4     N9     133.428  126.000  0.600   12.38  ?     
 763   74  N7     C8     N9     122.251  113.100  0.500   18.30  ?     
 764   74  N9     C4     C5     108.385  105.400  0.400    7.46  ?     
 765   74  "O4'"  "C1'"  N9     113.492  108.000  0.700    7.85  ?     
 766   74  OP1    P      OP2    108.938  119.600  1.500   -7.11  ?     
 767   75  C2     N3     C4     123.678  111.900  0.500   23.56  ?     
 768   75  C4     C5     N7     112.992  110.800  0.400    5.48  ?     
 769   75  C5     C6     N1     115.151  111.500  0.500    7.30  ?     
 770   75  C5     C6     O6     123.147  128.600  0.600   -9.09  ?     
 771   75  C5     N7     C8      97.475  104.300  0.500  -13.65  ?     
 772   75  C6     C5     N7     126.341  130.400  0.600   -6.76  ?     
 773   75  C8     N9     C4      98.779  106.400  0.400  -19.05  ?     
 774   75  N3     C4     C5     117.157  128.600  0.500  -22.89  ?     
 775   75  N3     C4     N9     134.419  126.000  0.600   14.03  ?     
 776   75  N7     C8     N9     122.332  113.100  0.500   18.46  ?     
 777   75  N9     C4     C5     108.412  105.400  0.400    7.53  ?     
 778   75  OP1    P      OP2    109.275  119.600  1.500   -6.88  ?     
 779   76  C2     N3     C4     123.401  111.900  0.500   23.00  ?     
 780   76  C4     C5     N7     113.328  110.800  0.400    6.32  ?     
 781   76  C5     C6     N1     114.664  111.500  0.500    6.33  ?     
 782   76  C5     C6     O6     122.320  128.600  0.600  -10.47  ?     
 783   76  C5     N7     C8      97.358  104.300  0.500  -13.88  ?     
 784   76  C6     C5     N7     125.563  130.400  0.600   -8.06  ?     
 785   76  C8     N9     C4      98.465  106.400  0.400  -19.84  ?     
 786   76  N1     C2     N3     120.843  123.900  0.600   -5.09  ?     
 787   76  N1     C6     O6     123.001  119.900  0.600    5.17  ?     
 788   76  N3     C4     C5     117.140  128.600  0.500  -22.92  ?     
 789   76  N3     C4     N9     134.581  126.000  0.600   14.30  ?     
 790   76  N7     C8     N9     122.631  113.100  0.500   19.06  ?     
 791   76  N9     C4     C5     108.137  105.400  0.400    6.84  ?     
 792   76  "O4'"  "C1'"  N9     111.790  108.000  0.700    5.41  ?     
 793   76  OP1    P      OP2    107.587  119.600  1.500   -8.01  ?     
 794   77  C2     N3     C4     123.533  111.900  0.500   23.27  ?     
 795   77  C4     C5     N7     113.158  110.800  0.400    5.89  ?     
 796   77  "C5'"  "C4'"  "C3'"  123.795  114.100  1.800    5.39  ?     
 797   77  C5     C6     N1     115.276  111.500  0.500    7.55  ?     
 798   77  C5     C6     O6     123.872  128.600  0.600   -7.88  ?     
 799   77  C5     N7     C8      97.944  104.300  0.500  -12.71  ?     
 800   77  C6     C5     N7     126.259  130.400  0.600   -6.90  ?     
 801   77  C8     N9     C4      99.106  106.400  0.400  -18.23  ?     
 802   77  N1     C2     N3     120.813  123.900  0.600   -5.14  ?     
 803   77  N3     C4     C5     116.827  128.600  0.500  -23.55  ?     
 804   77  N3     C4     N9     135.259  126.000  0.600   15.43  ?     
 805   77  N7     C8     N9     121.865  113.100  0.500   17.53  ?     
 806   77  N9     C4     C5     107.913  105.400  0.400    6.28  ?     
 807   77  "O4'"  "C1'"  N9     111.738  108.000  0.700    5.34  ?     
 808   77  OP1    P      OP2    108.655  119.600  1.500   -7.30  ?     
 809   78  C6     N1     C2     118.407  121.300  0.500   -5.79  ?     
 810   78  N1     C2     N3     121.112  114.600  0.600   10.85  ?     
 811   78  N3     C2     O2     116.543  122.300  0.600   -9.60  ?     
 812   79  C5     C6     N1     120.270  123.700  0.600   -5.72  ?     
 813   79  N1     C2     N3     120.666  114.600  0.600   10.11  ?     
 814   79  N3     C2     O2     116.767  122.300  0.600   -9.22  ?     
 815   79  "O4'"  "C1'"  N1     113.476  108.000  0.700    7.82  ?     
 816   79  OP1    P      OP2    108.789  119.600  1.500   -7.21  ?     
 817   80  P      "O3'"  "C3'"  132.671  119.700  1.200   10.81  Y     
 818   80  C2     N3     C4     123.546  111.900  0.500   23.29  ?     
 819   80  "C4'"  "C3'"  "C2'"   96.098  103.100  0.900   -7.78  ?     
 820   80  C4     C5     N7     113.193  110.800  0.400    5.98  ?     
 821   80  C4     N9     "C1'"  133.956  126.500  1.300    5.74  ?     
 822   80  C5     C6     N1     114.595  111.500  0.500    6.19  ?     
 823   80  C5     C6     O6     121.844  128.600  0.600  -11.26  ?     
 824   80  C5     N7     C8      97.041  104.300  0.500  -14.52  ?     
 825   80  C6     C5     N7     125.988  130.400  0.600   -7.35  ?     
 826   80  C8     N9     C4      98.880  106.400  0.400  -18.80  ?     
 827   80  N1     C2     N2     120.763  116.200  0.900    5.07  ?     
 828   80  N1     C2     N3     120.566  123.900  0.600   -5.56  ?     
 829   80  N1     C6     O6     123.559  119.900  0.600    6.10  ?     
 830   80  N3     C4     C5     117.470  128.600  0.500  -22.26  ?     
 831   80  N3     C4     N9     134.302  126.000  0.600   13.84  ?     
 832   80  N7     C8     N9     122.575  113.100  0.500   18.95  ?     
 833   80  N9     C4     C5     107.882  105.400  0.400    6.21  ?     
 834   80  "O4'"  "C4'"  "C3'"  110.469  106.000  0.600    7.45  ?     
 835   80  OP1    P      OP2    109.085  119.600  1.500   -7.01  ?     
 836   81  C2     N3     C4     123.602  111.900  0.500   23.40  ?     
 837   81  C4     C5     N7     112.929  110.800  0.400    5.32  ?     
 838   81  C5     C6     N1     115.191  111.500  0.500    7.38  ?     
 839   81  C5     C6     O6     123.513  128.600  0.600   -8.48  ?     
 840   81  C5     N7     C8      97.640  104.300  0.500  -13.32  ?     
 841   81  C6     C5     N7     126.968  130.400  0.600   -5.72  ?     
 842   81  C8     N9     C4      99.346  106.400  0.400  -17.64  ?     
 843   81  N3     C4     C5     117.542  128.600  0.500  -22.12  ?     
 844   81  N3     C4     N9     133.843  126.000  0.600   13.07  ?     
 845   81  N7     C8     N9     121.397  113.100  0.500   16.59  ?     
 846   81  N9     C4     C5     108.575  105.400  0.400    7.94  ?     
 847   81  "O4'"  "C1'"  N9     115.579  108.000  0.700   10.83  ?     
 848   81  OP1    P      OP2    109.449  119.600  1.500   -6.77  ?     
 849   82  C5     C6     N1     120.373  123.700  0.600   -5.54  ?     
 850   82  N1     C2     N3     120.551  114.600  0.600    9.92  ?     
 851   82  N3     C2     O2     116.622  122.300  0.600   -9.46  ?     
 852   82  OP1    P      OP2    109.572  119.600  1.500   -6.68  ?     
 853   83  C2     N3     C4     123.628  111.900  0.500   23.46  ?     
 854   83  C4     C5     N7     113.252  110.800  0.400    6.13  ?     
 855   83  C5     C6     N1     114.997  111.500  0.500    6.99  ?     
 856   83  C5     C6     O6     123.199  128.600  0.600   -9.00  ?     
 857   83  C5     N7     C8      97.242  104.300  0.500  -14.12  ?     
 858   83  C6     C5     N7     126.376  130.400  0.600   -6.71  ?     
 859   83  C8     N9     C4      99.261  106.400  0.400  -17.85  ?     
 860   83  N1     C2     N3     120.780  123.900  0.600   -5.20  ?     
 861   83  N3     C4     C5     117.310  128.600  0.500  -22.58  ?     
 862   83  N3     C4     N9     134.430  126.000  0.600   14.05  ?     
 863   83  N7     C8     N9     122.019  113.100  0.500   17.84  ?     
 864   83  N9     C4     C5     108.216  105.400  0.400    7.04  ?     
 865   83  OP1    P      OP2    108.869  119.600  1.500   -7.15  ?     
 866   84  C5     C6     N1     120.429  123.700  0.600   -5.45  ?     
 867   84  N1     C2     N3     120.635  114.600  0.600   10.06  ?     
 868   84  N3     C2     O2     117.037  122.300  0.600   -8.77  ?     
 869   84  "O4'"  "C1'"  N1     112.430  108.000  0.700    6.33  ?     
 870   84  OP1    P      OP2    108.795  119.600  1.500   -7.20  ?     
 871   85  C2     N3     C4     123.770  111.900  0.500   23.74  ?     
 872   85  C4     C5     N7     112.813  110.800  0.400    5.03  ?     
 873   85  C5     C6     N1     114.965  111.500  0.500    6.93  ?     
 874   85  C5     C6     O6     122.788  128.600  0.600   -9.69  ?     
 875   85  C5     N7     C8      97.745  104.300  0.500  -13.11  ?     
 876   85  C6     C5     N7     126.575  130.400  0.600   -6.37  ?     
 877   85  C8     N9     C4      99.370  106.400  0.400  -17.57  ?     
 878   85  N1     C2     N2     121.030  116.200  0.900    5.37  ?     
 879   85  N1     C2     N3     120.886  123.900  0.600   -5.02  ?     
 880   85  N3     C4     C5     117.552  128.600  0.500  -22.10  ?     
 881   85  N3     C4     N9     133.908  126.000  0.600   13.18  ?     
 882   85  N7     C8     N9     121.623  113.100  0.500   17.05  ?     
 883   85  N9     C4     C5     108.438  105.400  0.400    7.60  ?     
 884   85  "O4'"  "C1'"  N9     112.525  108.000  0.700    6.46  ?     
 885   85  OP1    P      OP2    108.971  119.600  1.500   -7.09  ?     
 886   86  C2     N3     C4     123.596  111.900  0.500   23.39  ?     
 887   86  C4     C5     N7     112.955  110.800  0.400    5.39  ?     
 888   86  C5     C6     N1     115.165  111.500  0.500    7.33  ?     
 889   86  C5     C6     O6     123.647  128.600  0.600   -8.26  ?     
 890   86  C5     N7     C8      97.952  104.300  0.500  -12.70  ?     
 891   86  C6     C5     N7     126.389  130.400  0.600   -6.68  ?     
 892   86  C8     N9     C4      99.092  106.400  0.400  -18.27  ?     
 893   86  N3     C4     C5     117.039  128.600  0.500  -23.12  ?     
 894   86  N3     C4     N9     134.758  126.000  0.600   14.60  ?     
 895   86  N7     C8     N9     121.665  113.100  0.500   17.13  ?     
 896   86  N9     C4     C5     108.191  105.400  0.400    6.98  ?     
 897   86  OP1    P      OP2    108.995  119.600  1.500   -7.07  ?     
 898   87  C5     C6     N1     120.616  123.700  0.600   -5.14  ?     
 899   87  N1     C2     N3     120.764  114.600  0.600   10.27  ?     
 900   87  N3     C2     O2     116.925  122.300  0.600   -8.96  ?     
 901   87  "O4'"  "C1'"  N1     112.402  108.000  0.700    6.29  ?     
 902   87  OP1    P      OP2    109.284  119.600  1.500   -6.88  ?     
 903   88  C5     C6     N1     120.008  123.700  0.600   -6.15  ?     
 904   88  N1     C2     N3     120.539  114.600  0.600    9.90  ?     
 905   88  N3     C2     O2     116.833  122.300  0.600   -9.11  ?     
 906   88  "O4'"  "C1'"  N1     113.505  108.000  0.700    7.86  ?     
 907   88  OP1    P      OP2    108.790  119.600  1.500   -7.21  ?     
 908   89  C2     N3     C4     123.464  111.900  0.500   23.13  ?     
 909   89  C4     C5     N7     113.005  110.800  0.400    5.51  ?     
 910   89  C5     C6     N1     114.883  111.500  0.500    6.77  ?     
 911   89  C5     C6     O6     122.912  128.600  0.600   -9.48  ?     
 912   89  C5     N7     C8      97.040  104.300  0.500  -14.52  ?     
 913   89  C6     C5     N7     126.440  130.400  0.600   -6.60  ?     
 914   89  C8     N9     C4      98.996  106.400  0.400  -18.51  ?     
 915   89  N1     C2     N2     120.771  116.200  0.900    5.08  ?     
 916   89  N3     C4     C5     117.746  128.600  0.500  -21.71  ?     
 917   89  N3     C4     N9     133.220  126.000  0.600   12.03  ?     
 918   89  N7     C8     N9     122.381  113.100  0.500   18.56  ?     
 919   89  N9     C4     C5     108.540  105.400  0.400    7.85  ?     
 920   89  "O4'"  "C1'"  N9     113.817  108.000  0.700    8.31  ?     
 921   89  OP1    P      OP2    109.347  119.600  1.500   -6.83  ?     
 922   90  C2     N3     C4     123.676  111.900  0.500   23.55  ?     
 923   90  C4     C5     N7     112.903  110.800  0.400    5.26  ?     
 924   90  C5     C6     N1     115.074  111.500  0.500    7.15  ?     
 925   90  C5     C6     O6     122.739  128.600  0.600   -9.77  ?     
 926   90  C5     N7     C8      97.751  104.300  0.500  -13.10  ?     
 927   90  C6     C5     N7     126.243  130.400  0.600   -6.93  ?     
 928   90  C8     N9     C4      98.838  106.400  0.400  -18.91  ?     
 929   90  N3     C4     C5     117.094  128.600  0.500  -23.01  ?     
 930   90  N3     C4     N9     134.464  126.000  0.600   14.11  ?     
 931   90  N7     C8     N9     122.049  113.100  0.500   17.90  ?     
 932   90  N9     C4     C5     108.429  105.400  0.400    7.57  ?     
 933   90  OP1    P      OP2    109.365  119.600  1.500   -6.82  ?     
 934   91  C2     N3     C4     123.505  111.900  0.500   23.21  ?     
 935   91  C4     C5     N7     113.338  110.800  0.400    6.34  ?     
 936   91  C5     C6     N1     114.650  111.500  0.500    6.30  ?     
 937   91  C5     C6     O6     122.535  128.600  0.600  -10.11  ?     
 938   91  C5     N7     C8      97.017  104.300  0.500  -14.57  ?     
 939   91  C6     C5     N7     125.735  130.400  0.600   -7.78  ?     
 940   91  C8     N9     C4      98.224  106.400  0.400  -20.44  ?     
 941   91  N1     C2     N3     120.710  123.900  0.600   -5.32  ?     
 942   91  N3     C4     C5     117.275  128.600  0.500  -22.65  ?     
 943   91  N3     C4     N9     134.111  126.000  0.600   13.52  ?     
 944   91  N7     C8     N9     122.837  113.100  0.500   19.47  ?     
 945   91  N9     C4     C5     108.440  105.400  0.400    7.60  ?     
 946   91  "O4'"  "C1'"  N9     112.321  108.000  0.700    6.17  ?     
 947   91  OP1    P      OP2    107.688  119.600  1.500   -7.94  ?     
 948   92  C2     N3     C4     123.678  111.900  0.500   23.56  ?     
 949   92  C4     C5     N7     113.177  110.800  0.400    5.94  ?     
 950   92  C5     C6     N1     115.218  111.500  0.500    7.44  ?     
 951   92  C5     C6     O6     123.433  128.600  0.600   -8.61  ?     
 952   92  C5     N7     C8      97.706  104.300  0.500  -13.19  ?     
 953   92  C6     C5     N7     126.335  130.400  0.600   -6.78  ?     
 954   92  C8     N9     C4      98.997  106.400  0.400  -18.51  ?     
 955   92  N1     C2     N3     120.757  123.900  0.600   -5.24  ?     
 956   92  N3     C4     C5     116.997  128.600  0.500  -23.21  ?     
 957   92  N3     C4     N9     134.997  126.000  0.600   14.99  ?     
 958   92  N7     C8     N9     122.020  113.100  0.500   17.84  ?     
 959   92  N9     C4     C5     108.006  105.400  0.400    6.52  ?     
 960   92  "O4'"  "C1'"  N9     111.552  108.000  0.700    5.08  ?     
 961   92  OP1    P      OP2    108.714  119.600  1.500   -7.26  ?     
 962   93  C6     N1     C2     118.404  121.300  0.500   -5.79  ?     
 963   93  N1     C2     N3     121.103  114.600  0.600   10.84  ?     
 964   93  N3     C2     O2     116.555  122.300  0.600   -9.57  ?     
 965   94  C5     C6     N1     120.402  123.700  0.600   -5.50  ?     
 966   94  N1     C2     N3     120.613  114.600  0.600   10.02  ?     
 967   94  N3     C2     O2     116.909  122.300  0.600   -8.98  ?     
 968   94  "O4'"  "C1'"  N1     113.151  108.000  0.700    7.36  ?     
 969   94  OP1    P      OP2    108.589  119.600  1.500   -7.34  ?     
 970   95  P      "O3'"  "C3'"  132.781  119.700  1.200   10.90  Y     
 971   95  C2     N3     C4     123.511  111.900  0.500   23.22  ?     
 972   95  "C4'"  "C3'"  "C2'"   96.096  103.100  0.900   -7.78  ?     
 973   95  C4     C5     N7     113.228  110.800  0.400    6.07  ?     
 974   95  C4     N9     "C1'"  134.129  126.500  1.300    5.87  ?     
 975   95  C5     C6     N1     114.533  111.500  0.500    6.07  ?     
 976   95  C5     C6     O6     121.917  128.600  0.600  -11.14  ?     
 977   95  C5     N7     C8      96.915  104.300  0.500  -14.77  ?     
 978   95  C6     C5     N7     125.840  130.400  0.600   -7.60  ?     
 979   95  C8     N9     C4      98.604  106.400  0.400  -19.49  ?     
 980   95  N1     C2     N2     120.862  116.200  0.900    5.18  ?     
 981   95  N1     C2     N3     120.726  123.900  0.600   -5.29  ?     
 982   95  N1     C6     O6     123.543  119.900  0.600    6.07  ?     
 983   95  N3     C4     C5     117.414  128.600  0.500  -22.37  ?     
 984   95  N3     C4     N9     134.244  126.000  0.600   13.74  ?     
 985   95  N7     C8     N9     122.903  113.100  0.500   19.61  ?     
 986   95  N9     C4     C5     108.001  105.400  0.400    6.50  ?     
 987   95  "O4'"  "C4'"  "C3'"  110.667  106.000  0.600    7.78  ?     
 988   95  OP1    P      OP2    109.238  119.600  1.500   -6.91  ?     
 989   96  C2     N3     C4     123.358  111.900  0.500   22.92  ?     
 990   96  C4     C5     N7     113.080  110.800  0.400    5.70  ?     
 991   96  C5     C6     N1     115.075  111.500  0.500    7.15  ?     
 992   96  C5     C6     O6     123.602  128.600  0.600   -8.33  ?     
 993   96  C5     N7     C8      97.715  104.300  0.500  -13.17  ?     
 994   96  C6     C5     N7     126.801  130.400  0.600   -6.00  ?     
 995   96  C8     N9     C4      99.303  106.400  0.400  -17.74  ?     
 996   96  N1     C2     N3     120.840  123.900  0.600   -5.10  ?     
 997   96  N3     C4     C5     117.477  128.600  0.500  -22.25  ?     
 998   96  N3     C4     N9     134.077  126.000  0.600   13.46  ?     
 999   96  N7     C8     N9     121.328  113.100  0.500   16.46  ?     
1000   96  N9     C4     C5     108.438  105.400  0.400    7.59  ?     
1001   96  "O4'"  "C1'"  N9     115.433  108.000  0.700   10.62  ?     
1002   96  OP1    P      OP2    109.480  119.600  1.500   -6.75  ?     
1003   97  C5     C6     N1     120.365  123.700  0.600   -5.56  ?     
1004   97  N1     C2     N3     120.582  114.600  0.600    9.97  ?     
1005   97  N3     C2     O2     116.623  122.300  0.600   -9.46  ?     
1006   97  OP1    P      OP2    109.507  119.600  1.500   -6.73  ?     
1007   98  C2     N3     C4     123.682  111.900  0.500   23.56  ?     
1008   98  C4     C5     N7     113.234  110.800  0.400    6.08  ?     
1009   98  C5     C6     N1     115.047  111.500  0.500    7.09  ?     
1010   98  C5     C6     O6     123.189  128.600  0.600   -9.02  ?     
1011   98  C5     N7     C8      97.336  104.300  0.500  -13.93  ?     
1012   98  C6     C5     N7     126.491  130.400  0.600   -6.51  ?     
1013   98  C8     N9     C4      99.367  106.400  0.400  -17.58  ?     
1014   98  N1     C2     N3     120.762  123.900  0.600   -5.23  ?     
1015   98  N3     C4     C5     117.380  128.600  0.500  -22.44  ?     
1016   98  N3     C4     N9     134.418  126.000  0.600   14.03  ?     
1017   98  N7     C8     N9     121.860  113.100  0.500   17.52  ?     
1018   98  N9     C4     C5     108.187  105.400  0.400    6.97  ?     
1019   98  OP1    P      OP2    108.908  119.600  1.500   -7.13  ?     
1020   99  C5     C6     N1     120.548  123.700  0.600   -5.25  ?     
1021   99  N1     C2     N3     120.728  114.600  0.600   10.21  ?     
1022   99  N3     C2     O2     116.968  122.300  0.600   -8.89  ?     
1023   99  "O4'"  "C1'"  N1     112.232  108.000  0.700    6.05  ?     
1024   99  OP1    P      OP2    109.404  119.600  1.500   -6.80  ?     
1025  100  C2     N3     C4     123.444  111.900  0.500   23.09  ?     
1026  100  C4     C5     N7     113.030  110.800  0.400    5.58  ?     
1027  100  C5     C6     N1     114.969  111.500  0.500    6.94  ?     
1028  100  C5     C6     O6     123.206  128.600  0.600   -8.99  ?     
1029  100  C5     N7     C8      97.619  104.300  0.500  -13.36  ?     
1030  100  C6     C5     N7     126.564  130.400  0.600   -6.39  ?     
1031  100  C8     N9     C4      99.604  106.400  0.400  -16.99  ?     
1032  100  N3     C4     C5     117.455  128.600  0.500  -22.29  ?     
1033  100  N3     C4     N9     134.466  126.000  0.600   14.11  ?     
1034  100  N7     C8     N9     121.676  113.100  0.500   17.15  ?     
1035  100  N9     C4     C5     108.023  105.400  0.400    6.56  ?     
1036  100  "O4'"  "C1'"  N9     112.207  108.000  0.700    6.01  ?     
1037  100  OP1    P      OP2    108.984  119.600  1.500   -7.08  ?     
1038  101  C2     N3     C4     123.781  111.900  0.500   23.76  ?     
1039  101  C4     C5     N7     113.002  110.800  0.400    5.50  ?     
1040  101  C5     C6     N1     115.312  111.500  0.500    7.62  ?     
1041  101  C5     C6     O6     123.604  128.600  0.600   -8.33  ?     
1042  101  C5     N7     C8      97.849  104.300  0.500  -12.90  ?     
1043  101  C6     C5     N7     126.370  130.400  0.600   -6.72  ?     
1044  101  C8     N9     C4      98.715  106.400  0.400  -19.21  ?     
1045  101  N3     C4     C5     116.849  128.600  0.500  -23.50  ?     
1046  101  N3     C4     N9     134.758  126.000  0.600   14.60  ?     
1047  101  N7     C8     N9     121.948  113.100  0.500   17.70  ?     
1048  101  N9     C4     C5     108.393  105.400  0.400    7.48  ?     
1049  101  OP1    P      OP2    108.851  119.600  1.500   -7.17  ?     
1050  102  C5     C6     N1     120.360  123.700  0.600   -5.57  ?     
1051  102  N1     C2     N3     120.623  114.600  0.600   10.04  ?     
1052  102  N3     C2     O2     116.954  122.300  0.600   -8.91  ?     
1053  102  "O4'"  "C1'"  N1     112.741  108.000  0.700    6.77  ?     
1054  102  OP1    P      OP2    109.375  119.600  1.500   -6.82  ?     
1055  103  C5     C6     N1     120.278  123.700  0.600   -5.70  ?     
1056  103  C6     N1     C2     118.716  121.300  0.500   -5.17  ?     
1057  103  N1     C2     N3     120.823  114.600  0.600   10.37  ?     
1058  103  N3     C2     O2     116.192  122.300  0.600  -10.18  ?     
1059  103  OP1    P      OP2    109.225  119.600  1.500   -6.92  ?     
1060  104  C2     N3     C4     123.314  111.900  0.500   22.83  ?     
1061  104  C4     C5     N7     113.047  110.800  0.400    5.62  ?     
1062  104  C5     C6     N1     114.815  111.500  0.500    6.63  ?     
1063  104  C5     C6     O6     123.356  128.600  0.600   -8.74  ?     
1064  104  C5     N7     C8      97.153  104.300  0.500  -14.29  ?     
1065  104  C6     C5     N7     126.295  130.400  0.600   -6.84  ?     
1066  104  C8     N9     C4      98.926  106.400  0.400  -18.68  ?     
1067  104  N3     C4     C5     117.560  128.600  0.500  -22.08  ?     
1068  104  N3     C4     N9     133.564  126.000  0.600   12.61  ?     
1069  104  N7     C8     N9     122.432  113.100  0.500   18.66  ?     
1070  104  N9     C4     C5     108.407  105.400  0.400    7.52  ?     
1071  104  "O4'"  "C1'"  N9     113.612  108.000  0.700    8.02  ?     
1072  104  OP1    P      OP2    108.894  119.600  1.500   -7.14  ?     
1073  105  C2     N3     C4     123.607  111.900  0.500   23.41  ?     
1074  105  C4     C5     N7     113.052  110.800  0.400    5.63  ?     
1075  105  C5     C6     N1     115.163  111.500  0.500    7.33  ?     
1076  105  C5     C6     O6     123.184  128.600  0.600   -9.03  ?     
1077  105  C5     N7     C8      97.493  104.300  0.500  -13.62  ?     
1078  105  C6     C5     N7     126.232  130.400  0.600   -6.95  ?     
1079  105  C8     N9     C4      98.663  106.400  0.400  -19.34  ?     
1080  105  N3     C4     C5     117.022  128.600  0.500  -23.16  ?     
1081  105  N3     C4     N9     134.642  126.000  0.600   14.40  ?     
1082  105  N7     C8     N9     122.460  113.100  0.500   18.72  ?     
1083  105  N9     C4     C5     108.322  105.400  0.400    7.31  ?     
1084  105  OP1    P      OP2    109.297  119.600  1.500   -6.87  ?     
#
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  percentiles  "20191225.v01 (using entries in the PDB archive December 25th 2019)"  N  
##
