NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
|
|
469816 |
1ajf   |
cing | 3-converted-DOCR | STAR | entry | full | 362 |
data_DOCR_restraints_with_modified_coordinates_PDB_code_1ajf
# This DOCR archive file contains, for PDB entry <1ajf>:
#
# - Coordinates and sequence information from the PDB mmCIF file
# - NMR restraints from the PDB MR file
#
# In this file, the coordinates and NMR restraints share the same atom names,
# and in this way can differ from the data deposited at the wwPDB. To achieve
# this aim, the NMR restraints were parsed from their original format files, and
# the coordinates and NMR restraints information were subsequently harmonized.
#
# Due to the complexity of this harmonization process, minor modifications could
# have occurred to the NMR restraints information, or data could have been lost
# because of parsing or conversion errors. The PDB file remains the
# authoritative reference for the atomic coordinates and the originally deposited
# restraints files remain the primary reference for these data.
#
# This file is generated at the BioMagResBank (BMRB) in collaboration with the
# PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and
# the CMBI/IMM group at the Radboud University of Nijmegen.
#
# Several software packages were used to produce this file:
#
# - Wattos (BMRB and CMBI/IMM).
# - FormatConverter and NMRStarExport (PDBe).
# - CCPN framework (http://www.ccpn.ac.uk/).
#
# More information about this process can be found in the references below.
# Please cite the original reference for this PDB entry.
#
# JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL
# Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED
# containing converted and filtered sets of experimental NMR restraints and
# coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12.
#
# WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL
# Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy:
# development of a software pipeline. Proteins 59, 687-696.
#
# JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister,
# G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for
# 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396.
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID rr_1ajf
_Entry.Title "wwPDB remediated NMR restraints for PDB entry 1ajf"
_Entry.Version_type original
_Entry.NMR_STAR_version 3.1.0.8
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype solution
_Entry.Details "Contains the remediated restraint lists and coordinates for PDB entry 1ajf"
_Entry.PDB_coordinate_file_version 3.20
loop_
_Related_entries.Database_name
_Related_entries.Database_accession_code
_Related_entries.Relationship
_Related_entries.Entry_ID
PDB 1ajf "Master copy" rr_1ajf
stop_
save_
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID rr_1ajf
_Assembly.ID 1
_Assembly.Name 1ajf
_Assembly.Number_of_components 2
_Assembly.Organic_ligands 1
_Assembly.Metal_ions 0
_Assembly.Non_standard_bonds no
_Assembly.Paramagnetic no
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 6037.65158
loop_
_Entity_assembly.ID
_Entity_assembly.Entity_assembly_name
_Entity_assembly.Entity_ID
_Entity_assembly.Entity_label
_Entity_assembly.Asym_ID
_Entity_assembly.PDB_chain_ID
_Entity_assembly.Experimental_data_reported
_Entity_assembly.Physical_state
_Entity_assembly.Conformational_isomer
_Entity_assembly.Chemical_exchange_state
_Entity_assembly.Magnetic_equivalence_group_code
_Entity_assembly.Role
_Entity_assembly.Details
_Entity_assembly.Entry_ID
_Entity_assembly.Assembly_ID
1 "RNA 5 R GP AP CP AP GP GP GP GP AP AP AP CP UP UP UP GP UP C 3" 1 $RNA__5__R__GP_AP_CP_AP_GP_GP_GP_GP_AP_AP_AP_CP_UP_UP_UP_GP_UP_C__3__ A . no . . . . . . rr_1ajf 1
2 "COBALT HEXAMMINE III" 2 $COBALT_HEXAMMINE_III_ B . no . . . . . . rr_1ajf 1
stop_
save_
save_RNA__5__R__GP_AP_CP_AP_GP_GP_GP_GP_AP_AP_AP_CP_UP_UP_UP_GP_UP_C__3__
_Entity.Sf_category entity
_Entity.Sf_framecode RNA__5__R__GP_AP_CP_AP_GP_GP_GP_GP_AP_AP_AP_CP_UP_UP_UP_GP_UP_C__3__
_Entity.Entry_ID rr_1ajf
_Entity.ID 1
_Entity.Name RNA__5__R__GP_AP_CP_AP_GP_GP_GP_GP_AP_AP_AP_CP_UP_UP_UP_GP_UP_C__3__
_Entity.Type polymer
_Entity.Polymer_type polyribonucleotide
_Entity.Polymer_strand_ID A
_Entity.Polymer_seq_one_letter_code GACAGGGGAAACUUUGUC
_Entity.Ambiguous_conformational_states no
_Entity.Ambiguous_chem_comp_sites no
_Entity.Nstd_monomer no
_Entity.Nstd_chirality yes
_Entity.Nstd_linkage no
_Entity.Number_of_monomers 18
_Entity.Paramagnetic no
_Entity.Thiol_state "not present"
_Entity.Parent_entity_ID 1
_Entity.Formula_weight 5876.53598
loop_
_Entity_comp_index.ID
_Entity_comp_index.Auth_seq_ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 . G . rr_1ajf 1
2 . A . rr_1ajf 1
3 . C . rr_1ajf 1
4 . A . rr_1ajf 1
5 . G . rr_1ajf 1
6 . G . rr_1ajf 1
7 . G . rr_1ajf 1
8 . G . rr_1ajf 1
9 . A . rr_1ajf 1
10 . A . rr_1ajf 1
11 . A . rr_1ajf 1
12 . C . rr_1ajf 1
13 . U . rr_1ajf 1
14 . U . rr_1ajf 1
15 . U . rr_1ajf 1
16 . G . rr_1ajf 1
17 . U . rr_1ajf 1
18 . C . rr_1ajf 1
stop_
loop_
_Entity_poly_seq.Hetero
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
. G 1 1 rr_1ajf 1
. A 2 2 rr_1ajf 1
. C 3 3 rr_1ajf 1
. A 4 4 rr_1ajf 1
. G 5 5 rr_1ajf 1
. G 6 6 rr_1ajf 1
. G 7 7 rr_1ajf 1
. G 8 8 rr_1ajf 1
. A 9 9 rr_1ajf 1
. A 10 10 rr_1ajf 1
. A 11 11 rr_1ajf 1
. C 12 12 rr_1ajf 1
. U 13 13 rr_1ajf 1
. U 14 14 rr_1ajf 1
. U 15 15 rr_1ajf 1
. G 16 16 rr_1ajf 1
. U 17 17 rr_1ajf 1
. C 18 18 rr_1ajf 1
stop_
save_
save_COBALT_HEXAMMINE_III_
_Entity.Sf_category entity
_Entity.Sf_framecode COBALT_HEXAMMINE_III_
_Entity.Entry_ID rr_1ajf
_Entity.ID 2
_Entity.Name COBALT_HEXAMMINE_III_
_Entity.Type non-polymer
_Entity.Ambiguous_conformational_states no
_Entity.Ambiguous_chem_comp_sites no
_Entity.Nstd_chirality yes
_Entity.Nstd_linkage no
_Entity.Nonpolymer_comp_ID NCO
_Entity.Number_of_monomers 1
_Entity.Paramagnetic no
_Entity.Thiol_state "not present"
_Entity.Parent_entity_ID 2
loop_
_Entity_comp_index.ID
_Entity_comp_index.Auth_seq_ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 . NCO . rr_1ajf 2
stop_
save_
save_chem_comp_NCO
_Chem_comp.Sf_category chem_comp
_Chem_comp.Sf_framecode chem_comp_NCO
_Chem_comp.Entry_ID rr_1ajf
_Chem_comp.ID NCO
_Chem_comp.Name "COBALT HEXAMMINE(III)"
_Chem_comp.Type non-polymer
_Chem_comp.PDB_code NCO
_Chem_comp.Formal_charge 3
_Chem_comp.Paramagnetic no
_Chem_comp.Aromatic no
_Chem_comp.Formula "H18 Co N6"
_Chem_comp.Formula_weight 161.1156
save_
save_conformer_statistics
_Conformer_stat_list.Sf_category conformer_statistics
_Conformer_stat_list.Sf_framecode conformer_statistics
_Conformer_stat_list.Entry_ID rr_1ajf
_Conformer_stat_list.ID 1
_Conformer_stat_list.Conf_family_coord_set_ID 1
_Conformer_stat_list.Conf_family_coord_set_label $Original_constraints_and_structures
_Conformer_stat_list.Conformer_submitted_total_num 1
save_
save_ensemble_of_conformers
_Conformer_family_coord_set.Sf_category conformer_family_coord_set
_Conformer_family_coord_set.Sf_framecode ensemble_of_conformers
_Conformer_family_coord_set.Entry_ID rr_1ajf
_Conformer_family_coord_set.ID 1
loop_
_Conformer_family_refinement.Refine_method
_Conformer_family_refinement.Refine_details
_Conformer_family_refinement.Software_ID
_Conformer_family_refinement.Software_label
_Conformer_family_refinement.Entry_ID
_Conformer_family_refinement.Conformer_family_coord_set_ID
1 . . . rr_1ajf 1
stop_
loop_
_Conformer_family_software.Software_ID
_Conformer_family_software.Software_label
_Conformer_family_software.Method_ID
_Conformer_family_software.Method_label
_Conformer_family_software.Entry_ID
_Conformer_family_software.Conformer_family_coord_set_ID
. . . . rr_1ajf 1
stop_
loop_
_Atom_site.Assembly_ID
_Atom_site.Model_ID
_Atom_site.Model_site_ID
_Atom_site.ID
_Atom_site.Assembly_atom_ID
_Atom_site.Label_entity_assembly_ID
_Atom_site.Label_entity_ID
_Atom_site.Label_comp_index_ID
_Atom_site.Label_comp_ID
_Atom_site.Label_atom_ID
_Atom_site.Type_symbol
_Atom_site.Cartn_x
_Atom_site.Cartn_y
_Atom_site.Cartn_z
_Atom_site.Cartn_x_esd
_Atom_site.Cartn_y_esd
_Atom_site.Cartn_z_esd
_Atom_site.Occupancy
_Atom_site.Occupancy_esd
_Atom_site.Uncertainty
_Atom_site.Ordered_flag
_Atom_site.Footnote_ID
_Atom_site.PDBX_label_asym_ID
_Atom_site.PDBX_label_seq_ID
_Atom_site.PDBX_label_comp_ID
_Atom_site.PDBX_label_atom_ID
_Atom_site.PDBX_formal_charge
_Atom_site.PDBX_label_entity_ID
_Atom_site.PDB_record_ID
_Atom_site.PDB_model_num
_Atom_site.PDB_strand_ID
_Atom_site.PDB_ins_code
_Atom_site.PDB_residue_no
_Atom_site.PDB_residue_name
_Atom_site.PDB_atom_name
_Atom_site.Auth_entity_assembly_ID
_Atom_site.Auth_asym_ID
_Atom_site.Auth_chain_ID
_Atom_site.Auth_seq_ID
_Atom_site.Auth_comp_ID
_Atom_site.Auth_atom_ID
_Atom_site.Auth_alt_ID
_Atom_site.Auth_atom_name
_Atom_site.Details
_Atom_site.Entry_ID
_Atom_site.Conformer_family_coord_set_ID
. 1 . 1 . 1 1 1 G C1' C -4.217 -12.271 4.001 . . . 1.0 . . . . . . . . . . . . A . 1 G C1' . . . . . . . . . rr_1ajf 1
. 1 . 2 . 1 1 1 G C2 C 0.075 -12.005 3.436 . . . 1.0 . . . . . . . . . . . . A . 1 G C2 . . . . . . . . . rr_1ajf 1
. 1 . 3 . 1 1 1 G C2' C -4.323 -11.016 4.869 . . . 1.0 . . . . . . . . . . . . A . 1 G C2' . . . . . . . . . rr_1ajf 1
. 1 . 4 . 1 1 1 G C3' C -5.537 -10.353 4.241 . . . 1.0 . . . . . . . . . . . . A . 1 G C3' . . . . . . . . . rr_1ajf 1
. 1 . 5 . 1 1 1 G C4 C -2.037 -11.978 2.744 . . . 1.0 . . . . . . . . . . . . A . 1 G C4 . . . . . . . . . rr_1ajf 1
. 1 . 6 . 1 1 1 G C4' C -6.460 -11.542 4.049 . . . 1.0 . . . . . . . . . . . . A . 1 G C4' . . . . . . . . . rr_1ajf 1
. 1 . 7 . 1 1 1 G C5 C -1.712 -11.739 1.431 . . . 1.0 . . . . . . . . . . . . A . 1 G C5 . . . . . . . . . rr_1ajf 1
. 1 . 8 . 1 1 1 G C5' C -7.564 -11.345 3.012 . . . 1.0 . . . . . . . . . . . . A . 1 G C5' . . . . . . . . . rr_1ajf 1
. 1 . 9 . 1 1 1 G C6 C -0.345 -11.617 1.062 . . . 1.0 . . . . . . . . . . . . A . 1 G C6 . . . . . . . . . rr_1ajf 1
. 1 . 10 . 1 1 1 G C8 C -3.832 -11.841 1.499 . . . 1.0 . . . . . . . . . . . . A . 1 G C8 . . . . . . . . . rr_1ajf 1
. 1 . 11 . 1 1 1 G H1 H 1.481 -11.697 1.980 . . . 1.0 . . . . . . . . . . . . A . 1 G H1 . . . . . . . . . rr_1ajf 1
. 1 . 12 . 1 1 1 G H1' H -3.799 -13.104 4.567 . . . 1.0 . . . . . . . . . . . . A . 1 G H1' . . . . . . . . . rr_1ajf 1
. 1 . 13 . 1 1 1 G H2' H -3.434 -10.394 4.775 . . . 1.0 . . . . . . . . . . . . A . 1 G H2' . . . . . . . . . rr_1ajf 1
. 1 . 14 . 1 1 1 G H21 H 1.990 -12.055 4.103 . . . 1.0 . . . . . . . . . . . . A . 1 G H21 . . . . . . . . . rr_1ajf 1
. 1 . 15 . 1 1 1 G H22 H 0.757 -12.267 5.325 . . . 1.0 . . . . . . . . . . . . A . 1 G H22 . . . . . . . . . rr_1ajf 1
. 1 . 16 . 1 1 1 G H3' H -5.310 -9.824 3.315 . . . 1.0 . . . . . . . . . . . . A . 1 G H3' . . . . . . . . . rr_1ajf 1
. 1 . 17 . 1 1 1 G H4' H -6.913 -11.833 4.997 . . . 1.0 . . . . . . . . . . . . A . 1 G H4' . . . . . . . . . rr_1ajf 1
. 1 . 18 . 1 1 1 G H5' H -8.182 -12.243 2.979 . . . 1.0 . . . . . . . . . . . . A . 1 G H5' . . . . . . . . . rr_1ajf 1
. 1 . 19 . 1 1 1 G H5'' H -8.182 -10.498 3.307 . . . 1.0 . . . . . . . . . . . . A . 1 G H5'' . . . . . . . . . rr_1ajf 1
. 1 . 20 . 1 1 1 G H8 H -4.883 -11.837 1.211 . . . 1.0 . . . . . . . . . . . . A . 1 G H8 . . . . . . . . . rr_1ajf 1
. 1 . 21 . 1 1 1 G HO2' H -4.500 -10.557 6.750 . . . 1.0 . . . . . . . . . . . . A . 1 G HO2' . . . . . . . . . rr_1ajf 1
. 1 . 22 . 1 1 1 G HO5' H -6.541 -11.888 1.450 . . . 1.0 . . . . . . . . . . . . A . 1 G HO5' . . . . . . . . . rr_1ajf 1
. 1 . 23 . 1 1 1 G N1 N 0.491 -11.768 2.151 . . . 1.0 . . . . . . . . . . . . A . 1 G N1 . . . . . . . . . rr_1ajf 1
. 1 . 24 . 1 1 1 G N2 N 1.016 -12.120 4.362 . . . 1.0 . . . . . . . . . . . . A . 1 G N2 . . . . . . . . . rr_1ajf 1
. 1 . 25 . 1 1 1 G N3 N -1.200 -12.123 3.799 . . . 1.0 . . . . . . . . . . . . A . 1 G N3 . . . . . . . . . rr_1ajf 1
. 1 . 26 . 1 1 1 G N7 N -2.861 -11.655 0.650 . . . 1.0 . . . . . . . . . . . . A . 1 G N7 . . . . . . . . . rr_1ajf 1
. 1 . 27 . 1 1 1 G N9 N -3.408 -12.044 2.787 . . . 1.0 . . . . . . . . . . . . A . 1 G N9 . . . . . . . . . rr_1ajf 1
. 1 . 28 . 1 1 1 G O2' O -4.577 -11.363 6.235 . . . 1.0 . . . . . . . . . . . . A . 1 G O2' . . . . . . . . . rr_1ajf 1
. 1 . 29 . 1 1 1 G O3' O -6.129 -9.496 5.226 . . . 1.0 . . . . . . . . . . . . A . 1 G O3' . . . . . . . . . rr_1ajf 1
. 1 . 30 . 1 1 1 G O4' O -5.571 -12.583 3.614 . . . 1.0 . . . . . . . . . . . . A . 1 G O4' . . . . . . . . . rr_1ajf 1
. 1 . 31 . 1 1 1 G O5' O -7.028 -11.101 1.708 . . . 1.0 . . . . . . . . . . . . A . 1 G O5' . . . . . . . . . rr_1ajf 1
. 1 . 32 . 1 1 1 G O6 O 0.132 -11.402 -0.048 . . . 1.0 . . . . . . . . . . . . A . 1 G O6 . . . . . . . . . rr_1ajf 1
. 1 . 33 . 1 1 2 A C1' C -0.700 -8.986 6.544 . . . 1.0 . . . . . . . . . . . . A . 2 A C1' . . . . . . . . . rr_1ajf 1
. 1 . 34 . 1 1 2 A C2 C 2.607 -9.281 3.746 . . . 1.0 . . . . . . . . . . . . A . 2 A C2 . . . . . . . . . rr_1ajf 1
. 1 . 35 . 1 1 2 A C2' C -0.389 -7.688 7.285 . . . 1.0 . . . . . . . . . . . . A . 2 A C2' . . . . . . . . . rr_1ajf 1
. 1 . 36 . 1 1 2 A C3' C -1.771 -7.062 7.349 . . . 1.0 . . . . . . . . . . . . A . 2 A C3' . . . . . . . . . rr_1ajf 1
. 1 . 37 . 1 1 2 A C4 C 0.512 -8.947 4.316 . . . 1.0 . . . . . . . . . . . . A . 2 A C4 . . . . . . . . . rr_1ajf 1
. 1 . 38 . 1 1 2 A C4' C -2.636 -8.264 7.682 . . . 1.0 . . . . . . . . . . . . A . 2 A C4' . . . . . . . . . rr_1ajf 1
. 1 . 39 . 1 1 2 A C5 C 0.128 -8.712 3.028 . . . 1.0 . . . . . . . . . . . . A . 2 A C5 . . . . . . . . . rr_1ajf 1
. 1 . 40 . 1 1 2 A C5' C -4.114 -8.118 7.323 . . . 1.0 . . . . . . . . . . . . A . 2 A C5' . . . . . . . . . rr_1ajf 1
. 1 . 41 . 1 1 2 A C6 C 1.132 -8.785 2.051 . . . 1.0 . . . . . . . . . . . . A . 2 A C6 . . . . . . . . . rr_1ajf 1
. 1 . 42 . 1 1 2 A C8 C -1.629 -8.520 4.199 . . . 1.0 . . . . . . . . . . . . A . 2 A C8 . . . . . . . . . rr_1ajf 1
. 1 . 43 . 1 1 2 A H1' H -0.036 -9.791 6.859 . . . 1.0 . . . . . . . . . . . . A . 2 A H1' . . . . . . . . . rr_1ajf 1
. 1 . 44 . 1 1 2 A H2 H 3.639 -9.512 4.013 . . . 1.0 . . . . . . . . . . . . A . 2 A H2 . . . . . . . . . rr_1ajf 1
. 1 . 45 . 1 1 2 A H2' H 0.307 -7.066 6.723 . . . 1.0 . . . . . . . . . . . . A . 2 A H2' . . . . . . . . . rr_1ajf 1
. 1 . 46 . 1 1 2 A H3' H -2.061 -6.561 6.425 . . . 1.0 . . . . . . . . . . . . A . 2 A H3' . . . . . . . . . rr_1ajf 1
. 1 . 47 . 1 1 2 A H4' H -2.550 -8.518 8.738 . . . 1.0 . . . . . . . . . . . . A . 2 A H4' . . . . . . . . . rr_1ajf 1
. 1 . 48 . 1 1 2 A H5' H -4.641 -9.024 7.620 . . . 1.0 . . . . . . . . . . . . A . 2 A H5' . . . . . . . . . rr_1ajf 1
. 1 . 49 . 1 1 2 A H5'' H -4.529 -7.271 7.869 . . . 1.0 . . . . . . . . . . . . A . 2 A H5'' . . . . . . . . . rr_1ajf 1
. 1 . 50 . 1 1 2 A H61 H 1.667 -8.658 0.096 . . . 1.0 . . . . . . . . . . . . A . 2 A H61 . . . . . . . . . rr_1ajf 1
. 1 . 51 . 1 1 2 A H62 H -0.020 -8.345 0.437 . . . 1.0 . . . . . . . . . . . . A . 2 A H62 . . . . . . . . . rr_1ajf 1
. 1 . 52 . 1 1 2 A H8 H -2.663 -8.357 4.508 . . . 1.0 . . . . . . . . . . . . A . 2 A H8 . . . . . . . . . rr_1ajf 1
. 1 . 53 . 1 1 2 A HO2' H -0.148 -7.225 9.159 . . . 1.0 . . . . . . . . . . . . A . 2 A HO2' . . . . . . . . . rr_1ajf 1
. 1 . 54 . 1 1 2 A N1 N 2.379 -9.077 2.452 . . . 1.0 . . . . . . . . . . . . A . 2 A N1 . . . . . . . . . rr_1ajf 1
. 1 . 55 . 1 1 2 A N3 N 1.753 -9.243 4.759 . . . 1.0 . . . . . . . . . . . . A . 2 A N3 . . . . . . . . . rr_1ajf 1
. 1 . 56 . 1 1 2 A N6 N 0.909 -8.579 0.758 . . . 1.0 . . . . . . . . . . . . A . 2 A N6 . . . . . . . . . rr_1ajf 1
. 1 . 57 . 1 1 2 A N7 N -1.234 -8.441 2.960 . . . 1.0 . . . . . . . . . . . . A . 2 A N7 . . . . . . . . . rr_1ajf 1
. 1 . 58 . 1 1 2 A N9 N -0.623 -8.825 5.079 . . . 1.0 . . . . . . . . . . . . A . 2 A N9 . . . . . . . . . rr_1ajf 1
. 1 . 59 . 1 1 2 A O2' O 0.104 -7.964 8.601 . . . 1.0 . . . . . . . . . . . . A . 2 A O2' . . . . . . . . . rr_1ajf 1
. 1 . 60 . 1 1 2 A O3' O -1.796 -6.175 8.477 . . . 1.0 . . . . . . . . . . . . A . 2 A O3' . . . . . . . . . rr_1ajf 1
. 1 . 61 . 1 1 2 A O4' O -2.059 -9.315 6.897 . . . 1.0 . . . . . . . . . . . . A . 2 A O4' . . . . . . . . . rr_1ajf 1
. 1 . 62 . 1 1 2 A O5' O -4.300 -7.906 5.918 . . . 1.0 . . . . . . . . . . . . A . 2 A O5' . . . . . . . . . rr_1ajf 1
. 1 . 63 . 1 1 2 A OP1 O -6.706 -7.265 6.212 . . . 1.0 . . . . . . . . . . . . A . 2 A OP1 . . . . . . . . . rr_1ajf 1
. 1 . 64 . 1 1 2 A OP2 O -5.670 -7.433 3.875 . . . 1.0 . . . . . . . . . . . . A . 2 A OP2 . . . . . . . . . rr_1ajf 1
. 1 . 65 . 1 1 2 A P P -5.776 -7.923 5.268 . . . 1.0 . . . . . . . . . . . . A . 2 A P . . . . . . . . . rr_1ajf 1
. 1 . 66 . 1 1 3 C C1' C 3.007 -5.920 5.692 . . . 1.0 . . . . . . . . . . . . A . 3 C C1' . . . . . . . . . rr_1ajf 1
. 1 . 67 . 1 1 3 C C2 C 2.700 -6.047 3.262 . . . 1.0 . . . . . . . . . . . . A . 3 C C2 . . . . . . . . . rr_1ajf 1
. 1 . 68 . 1 1 3 C C2' C 3.796 -4.642 5.994 . . . 1.0 . . . . . . . . . . . . A . 3 C C2' . . . . . . . . . rr_1ajf 1
. 1 . 69 . 1 1 3 C C3' C 2.844 -3.939 6.948 . . . 1.0 . . . . . . . . . . . . A . 3 C C3' . . . . . . . . . rr_1ajf 1
. 1 . 70 . 1 1 3 C C4 C 0.662 -5.500 2.246 . . . 1.0 . . . . . . . . . . . . A . 3 C C4 . . . . . . . . . rr_1ajf 1
. 1 . 71 . 1 1 3 C C4' C 2.381 -5.097 7.810 . . . 1.0 . . . . . . . . . . . . A . 3 C C4' . . . . . . . . . rr_1ajf 1
. 1 . 72 . 1 1 3 C C5 C 0.073 -5.215 3.518 . . . 1.0 . . . . . . . . . . . . A . 3 C C5 . . . . . . . . . rr_1ajf 1
. 1 . 73 . 1 1 3 C C5' C 1.093 -4.858 8.592 . . . 1.0 . . . . . . . . . . . . A . 3 C C5' . . . . . . . . . rr_1ajf 1
. 1 . 74 . 1 1 3 C C6 C 0.843 -5.364 4.613 . . . 1.0 . . . . . . . . . . . . A . 3 C C6 . . . . . . . . . rr_1ajf 1
. 1 . 75 . 1 1 3 C H1' H 3.677 -6.768 5.552 . . . 1.0 . . . . . . . . . . . . A . 3 C H1' . . . . . . . . . rr_1ajf 1
. 1 . 76 . 1 1 3 C H2' H 3.961 -4.057 5.092 . . . 1.0 . . . . . . . . . . . . A . 3 C H2' . . . . . . . . . rr_1ajf 1
. 1 . 77 . 1 1 3 C H3' H 2.028 -3.421 6.442 . . . 1.0 . . . . . . . . . . . . A . 3 C H3' . . . . . . . . . rr_1ajf 1
. 1 . 78 . 1 1 3 C H4' H 3.168 -5.394 8.504 . . . 1.0 . . . . . . . . . . . . A . 3 C H4' . . . . . . . . . rr_1ajf 1
. 1 . 79 . 1 1 3 C H41 H 0.412 -5.563 0.229 . . . 1.0 . . . . . . . . . . . . A . 3 C H41 . . . . . . . . . rr_1ajf 1
. 1 . 80 . 1 1 3 C H42 H -1.002 -5.099 1.150 . . . 1.0 . . . . . . . . . . . . A . 3 C H42 . . . . . . . . . rr_1ajf 1
. 1 . 81 . 1 1 3 C H5 H -0.963 -4.889 3.607 . . . 1.0 . . . . . . . . . . . . A . 3 C H5 . . . . . . . . . rr_1ajf 1
. 1 . 82 . 1 1 3 C H5' H 0.861 -5.752 9.173 . . . 1.0 . . . . . . . . . . . . A . 3 C H5' . . . . . . . . . rr_1ajf 1
. 1 . 83 . 1 1 3 C H5'' H 1.244 -4.021 9.274 . . . 1.0 . . . . . . . . . . . . A . 3 C H5'' . . . . . . . . . rr_1ajf 1
. 1 . 84 . 1 1 3 C H6 H 0.425 -5.154 5.598 . . . 1.0 . . . . . . . . . . . . A . 3 C H6 . . . . . . . . . rr_1ajf 1
. 1 . 85 . 1 1 3 C HO2' H 5.397 -4.126 6.969 . . . 1.0 . . . . . . . . . . . . A . 3 C HO2' . . . . . . . . . rr_1ajf 1
. 1 . 86 . 1 1 3 C N1 N 2.140 -5.773 4.502 . . . 1.0 . . . . . . . . . . . . A . 3 C N1 . . . . . . . . . rr_1ajf 1
. 1 . 87 . 1 1 3 C N3 N 1.933 -5.900 2.149 . . . 1.0 . . . . . . . . . . . . A . 3 C N3 . . . . . . . . . rr_1ajf 1
. 1 . 88 . 1 1 3 C N4 N -0.032 -5.376 1.119 . . . 1.0 . . . . . . . . . . . . A . 3 C N4 . . . . . . . . . rr_1ajf 1
. 1 . 89 . 1 1 3 C O2 O 3.865 -6.423 3.177 . . . 1.0 . . . . . . . . . . . . A . 3 C O2 . . . . . . . . . rr_1ajf 1
. 1 . 90 . 1 1 3 C O2' O 5.030 -4.953 6.647 . . . 1.0 . . . . . . . . . . . . A . 3 C O2' . . . . . . . . . rr_1ajf 1
. 1 . 91 . 1 1 3 C O3' O 3.618 -3.057 7.772 . . . 1.0 . . . . . . . . . . . . A . 3 C O3' . . . . . . . . . rr_1ajf 1
. 1 . 92 . 1 1 3 C O4' O 2.182 -6.148 6.854 . . . 1.0 . . . . . . . . . . . . A . 3 C O4' . . . . . . . . . rr_1ajf 1
. 1 . 93 . 1 1 3 C O5' O -0.012 -4.563 7.728 . . . 1.0 . . . . . . . . . . . . A . 3 C O5' . . . . . . . . . rr_1ajf 1
. 1 . 94 . 1 1 3 C OP1 O -1.543 -3.958 9.621 . . . 1.0 . . . . . . . . . . . . A . 3 C OP1 . . . . . . . . . rr_1ajf 1
. 1 . 95 . 1 1 3 C OP2 O -2.420 -4.100 7.217 . . . 1.0 . . . . . . . . . . . . A . 3 C OP2 . . . . . . . . . rr_1ajf 1
. 1 . 96 . 1 1 3 C P P -1.526 -4.597 8.285 . . . 1.0 . . . . . . . . . . . . A . 3 C P . . . . . . . . . rr_1ajf 1
. 1 . 97 . 1 1 4 A C1' C 6.274 -2.730 2.830 . . . 1.0 . . . . . . . . . . . . A . 4 A C1' . . . . . . . . . rr_1ajf 1
. 1 . 98 . 1 1 4 A C2 C 4.712 -3.038 -1.195 . . . 1.0 . . . . . . . . . . . . A . 4 A C2 . . . . . . . . . rr_1ajf 1
. 1 . 99 . 1 1 4 A C2' C 7.008 -1.398 2.656 . . . 1.0 . . . . . . . . . . . . A . 4 A C2' . . . . . . . . . rr_1ajf 1
. 1 . 100 . 1 1 4 A C3' C 6.673 -0.713 3.969 . . . 1.0 . . . . . . . . . . . . A . 4 A C3' . . . . . . . . . rr_1ajf 1
. 1 . 101 . 1 1 4 A C4 C 4.547 -2.791 0.979 . . . 1.0 . . . . . . . . . . . . A . 4 A C4 . . . . . . . . . rr_1ajf 1
. 1 . 102 . 1 1 4 A C4' C 6.821 -1.860 4.951 . . . 1.0 . . . . . . . . . . . . A . 4 A C4' . . . . . . . . . rr_1ajf 1
. 1 . 103 . 1 1 4 A C5 C 3.188 -2.680 0.934 . . . 1.0 . . . . . . . . . . . . A . 4 A C5 . . . . . . . . . rr_1ajf 1
. 1 . 104 . 1 1 4 A C5' C 6.119 -1.667 6.292 . . . 1.0 . . . . . . . . . . . . A . 4 A C5' . . . . . . . . . rr_1ajf 1
. 1 . 105 . 1 1 4 A C6 C 2.595 -2.765 -0.337 . . . 1.0 . . . . . . . . . . . . A . 4 A C6 . . . . . . . . . rr_1ajf 1
. 1 . 106 . 1 1 4 A C8 C 3.718 -2.504 2.982 . . . 1.0 . . . . . . . . . . . . A . 4 A C8 . . . . . . . . . rr_1ajf 1
. 1 . 107 . 1 1 4 A H1' H 6.819 -3.543 2.348 . . . 1.0 . . . . . . . . . . . . A . 4 A H1' . . . . . . . . . rr_1ajf 1
. 1 . 108 . 1 1 4 A H2 H 5.314 -3.188 -2.091 . . . 1.0 . . . . . . . . . . . . A . 4 A H2 . . . . . . . . . rr_1ajf 1
. 1 . 109 . 1 1 4 A H2' H 6.619 -0.842 1.806 . . . 1.0 . . . . . . . . . . . . A . 4 A H2' . . . . . . . . . rr_1ajf 1
. 1 . 110 . 1 1 4 A H3' H 5.682 -0.258 3.979 . . . 1.0 . . . . . . . . . . . . A . 4 A H3' . . . . . . . . . rr_1ajf 1
. 1 . 111 . 1 1 4 A H4' H 7.874 -2.079 5.129 . . . 1.0 . . . . . . . . . . . . A . 4 A H4' . . . . . . . . . rr_1ajf 1
. 1 . 112 . 1 1 4 A H5' H 6.298 -2.544 6.915 . . . 1.0 . . . . . . . . . . . . A . 4 A H5' . . . . . . . . . rr_1ajf 1
. 1 . 113 . 1 1 4 A H5'' H 6.539 -0.790 6.787 . . . 1.0 . . . . . . . . . . . . A . 4 A H5'' . . . . . . . . . rr_1ajf 1
. 1 . 114 . 1 1 4 A H61 H 0.911 -2.806 -1.477 . . . 1.0 . . . . . . . . . . . . A . 4 A H61 . . . . . . . . . rr_1ajf 1
. 1 . 115 . 1 1 4 A H62 H 0.663 -2.473 0.223 . . . 1.0 . . . . . . . . . . . . A . 4 A H62 . . . . . . . . . rr_1ajf 1
. 1 . 116 . 1 1 4 A H8 H 3.667 -2.375 4.063 . . . 1.0 . . . . . . . . . . . . A . 4 A H8 . . . . . . . . . rr_1ajf 1
. 1 . 117 . 1 1 4 A HO2' H 8.842 -0.750 2.611 . . . 1.0 . . . . . . . . . . . . A . 4 A HO2' . . . . . . . . . rr_1ajf 1
. 1 . 118 . 1 1 4 A N1 N 3.401 -2.947 -1.393 . . . 1.0 . . . . . . . . . . . . A . 4 A N1 . . . . . . . . . rr_1ajf 1
. 1 . 119 . 1 1 4 A N3 N 5.389 -2.975 -0.060 . . . 1.0 . . . . . . . . . . . . A . 4 A N3 . . . . . . . . . rr_1ajf 1
. 1 . 120 . 1 1 4 A N6 N 1.284 -2.675 -0.547 . . . 1.0 . . . . . . . . . . . . A . 4 A N6 . . . . . . . . . rr_1ajf 1
. 1 . 121 . 1 1 4 A N7 N 2.666 -2.499 2.211 . . . 1.0 . . . . . . . . . . . . A . 4 A N7 . . . . . . . . . rr_1ajf 1
. 1 . 122 . 1 1 4 A N9 N 4.896 -2.679 2.302 . . . 1.0 . . . . . . . . . . . . A . 4 A N9 . . . . . . . . . rr_1ajf 1
. 1 . 123 . 1 1 4 A O2' O 8.419 -1.610 2.537 . . . 1.0 . . . . . . . . . . . . A . 4 A O2' . . . . . . . . . rr_1ajf 1
. 1 . 124 . 1 1 4 A O3' O 7.712 0.237 4.242 . . . 1.0 . . . . . . . . . . . . A . 4 A O3' . . . . . . . . . rr_1ajf 1
. 1 . 125 . 1 1 4 A O4' O 6.225 -2.962 4.253 . . . 1.0 . . . . . . . . . . . . A . 4 A O4' . . . . . . . . . rr_1ajf 1
. 1 . 126 . 1 1 4 A O5' O 4.707 -1.484 6.135 . . . 1.0 . . . . . . . . . . . . A . 4 A O5' . . . . . . . . . rr_1ajf 1
. 1 . 127 . 1 1 4 A OP1 O 4.418 -0.806 8.532 . . . 1.0 . . . . . . . . . . . . A . 4 A OP1 . . . . . . . . . rr_1ajf 1
. 1 . 128 . 1 1 4 A OP2 O 2.393 -1.019 6.977 . . . 1.0 . . . . . . . . . . . . A . 4 A OP2 . . . . . . . . . rr_1ajf 1
. 1 . 129 . 1 1 4 A P P 3.727 -1.488 7.415 . . . 1.0 . . . . . . . . . . . . A . 4 A P . . . . . . . . . rr_1ajf 1
. 1 . 130 . 1 1 5 G C1' C 7.737 1.251 -1.788 . . . 1.0 . . . . . . . . . . . . A . 5 G C1' . . . . . . . . . rr_1ajf 1
. 1 . 131 . 1 1 5 G C2 C 4.526 1.152 -4.695 . . . 1.0 . . . . . . . . . . . . A . 5 G C2 . . . . . . . . . rr_1ajf 1
. 1 . 132 . 1 1 5 G C2' C 7.980 2.759 -1.868 . . . 1.0 . . . . . . . . . . . . A . 5 G C2' . . . . . . . . . rr_1ajf 1
. 1 . 133 . 1 1 5 G C3' C 8.226 3.093 -0.407 . . . 1.0 . . . . . . . . . . . . A . 5 G C3' . . . . . . . . . rr_1ajf 1
. 1 . 134 . 1 1 5 G C4 C 5.383 0.928 -2.656 . . . 1.0 . . . . . . . . . . . . A . 5 G C4 . . . . . . . . . rr_1ajf 1
. 1 . 135 . 1 1 5 G C4' C 9.077 1.918 0.032 . . . 1.0 . . . . . . . . . . . . A . 5 G C4' . . . . . . . . . rr_1ajf 1
. 1 . 136 . 1 1 5 G C5 C 4.190 0.561 -2.081 . . . 1.0 . . . . . . . . . . . . A . 5 G C5 . . . . . . . . . rr_1ajf 1
. 1 . 137 . 1 1 5 G C5' C 9.133 1.683 1.540 . . . 1.0 . . . . . . . . . . . . A . 5 G C5' . . . . . . . . . rr_1ajf 1
. 1 . 138 . 1 1 5 G C6 C 3.024 0.472 -2.889 . . . 1.0 . . . . . . . . . . . . A . 5 G C6 . . . . . . . . . rr_1ajf 1
. 1 . 139 . 1 1 5 G C8 C 5.623 0.556 -0.514 . . . 1.0 . . . . . . . . . . . . A . 5 G C8 . . . . . . . . . rr_1ajf 1
. 1 . 140 . 1 1 5 G H1 H 2.525 0.763 -4.859 . . . 1.0 . . . . . . . . . . . . A . 5 G H1 . . . . . . . . . rr_1ajf 1
. 1 . 141 . 1 1 5 G H1' H 8.137 0.744 -2.665 . . . 1.0 . . . . . . . . . . . . A . 5 G H1' . . . . . . . . . rr_1ajf 1
. 1 . 142 . 1 1 5 G H2' H 7.102 3.276 -2.250 . . . 1.0 . . . . . . . . . . . . A . 5 G H2' . . . . . . . . . rr_1ajf 1
. 1 . 143 . 1 1 5 G H21 H 3.788 1.348 -6.574 . . . 1.0 . . . . . . . . . . . . A . 5 G H21 . . . . . . . . . rr_1ajf 1
. 1 . 144 . 1 1 5 G H22 H 5.486 1.717 -6.387 . . . 1.0 . . . . . . . . . . . . A . 5 G H22 . . . . . . . . . rr_1ajf 1
. 1 . 145 . 1 1 5 G H3' H 7.309 3.206 0.172 . . . 1.0 . . . . . . . . . . . . A . 5 G H3' . . . . . . . . . rr_1ajf 1
. 1 . 146 . 1 1 5 G H4' H 10.094 2.017 -0.349 . . . 1.0 . . . . . . . . . . . . A . 5 G H4' . . . . . . . . . rr_1ajf 1
. 1 . 147 . 1 1 5 G H5' H 9.681 0.761 1.735 . . . 1.0 . . . . . . . . . . . . A . 5 G H5' . . . . . . . . . rr_1ajf 1
. 1 . 148 . 1 1 5 G H5'' H 9.660 2.515 2.007 . . . 1.0 . . . . . . . . . . . . A . 5 G H5'' . . . . . . . . . rr_1ajf 1
. 1 . 149 . 1 1 5 G H8 H 6.093 0.477 0.464 . . . 1.0 . . . . . . . . . . . . A . 5 G H8 . . . . . . . . . rr_1ajf 1
. 1 . 150 . 1 1 5 G HO2' H 8.823 3.289 -3.538 . . . 1.0 . . . . . . . . . . . . A . 5 G HO2' . . . . . . . . . rr_1ajf 1
. 1 . 151 . 1 1 5 G N1 N 3.295 0.794 -4.209 . . . 1.0 . . . . . . . . . . . . A . 5 G N1 . . . . . . . . . rr_1ajf 1
. 1 . 152 . 1 1 5 G N2 N 4.605 1.426 -5.989 . . . 1.0 . . . . . . . . . . . . A . 5 G N2 . . . . . . . . . rr_1ajf 1
. 1 . 153 . 1 1 5 G N3 N 5.626 1.238 -3.952 . . . 1.0 . . . . . . . . . . . . A . 5 G N3 . . . . . . . . . rr_1ajf 1
. 1 . 154 . 1 1 5 G N7 N 4.356 0.326 -0.720 . . . 1.0 . . . . . . . . . . . . A . 5 G N7 . . . . . . . . . rr_1ajf 1
. 1 . 155 . 1 1 5 G N9 N 6.307 0.923 -1.642 . . . 1.0 . . . . . . . . . . . . A . 5 G N9 . . . . . . . . . rr_1ajf 1
. 1 . 156 . 1 1 5 G O2' O 9.137 3.042 -2.664 . . . 1.0 . . . . . . . . . . . . A . 5 G O2' . . . . . . . . . rr_1ajf 1
. 1 . 157 . 1 1 5 G O3' O 9.045 4.271 -0.359 . . . 1.0 . . . . . . . . . . . . A . 5 G O3' . . . . . . . . . rr_1ajf 1
. 1 . 158 . 1 1 5 G O4' O 8.444 0.805 -0.610 . . . 1.0 . . . . . . . . . . . . A . 5 G O4' . . . . . . . . . rr_1ajf 1
. 1 . 159 . 1 1 5 G O5' O 7.822 1.580 2.113 . . . 1.0 . . . . . . . . . . . . A . 5 G O5' . . . . . . . . . rr_1ajf 1
. 1 . 160 . 1 1 5 G O6 O 1.887 0.147 -2.553 . . . 1.0 . . . . . . . . . . . . A . 5 G O6 . . . . . . . . . rr_1ajf 1
. 1 . 161 . 1 1 5 G OP1 O 8.736 2.525 4.251 . . . 1.0 . . . . . . . . . . . . A . 5 G OP1 . . . . . . . . . rr_1ajf 1
. 1 . 162 . 1 1 5 G OP2 O 6.214 2.223 3.925 . . . 1.0 . . . . . . . . . . . . A . 5 G OP2 . . . . . . . . . rr_1ajf 1
. 1 . 163 . 1 1 5 G P P 7.599 1.753 3.701 . . . 1.0 . . . . . . . . . . . . A . 5 G P . . . . . . . . . rr_1ajf 1
. 1 . 164 . 1 1 6 G C1' C 5.915 4.579 -5.148 . . . 1.0 . . . . . . . . . . . . A . 6 G C1' . . . . . . . . . rr_1ajf 1
. 1 . 165 . 1 1 6 G C2 C 1.727 4.184 -6.183 . . . 1.0 . . . . . . . . . . . . A . 6 G C2 . . . . . . . . . rr_1ajf 1
. 1 . 166 . 1 1 6 G C2' C 5.999 5.974 -5.750 . . . 1.0 . . . . . . . . . . . . A . 6 G C2' . . . . . . . . . rr_1ajf 1
. 1 . 167 . 1 1 6 G C3' C 6.797 6.651 -4.677 . . . 1.0 . . . . . . . . . . . . A . 6 G C3' . . . . . . . . . rr_1ajf 1
. 1 . 168 . 1 1 6 G C4 C 3.432 4.281 -4.757 . . . 1.0 . . . . . . . . . . . . A . 6 G C4 . . . . . . . . . rr_1ajf 1
. 1 . 169 . 1 1 6 G C4' C 7.866 5.623 -4.394 . . . 1.0 . . . . . . . . . . . . A . 6 G C4' . . . . . . . . . rr_1ajf 1
. 1 . 170 . 1 1 6 G C5 C 2.645 4.119 -3.643 . . . 1.0 . . . . . . . . . . . . A . 6 G C5 . . . . . . . . . rr_1ajf 1
. 1 . 171 . 1 1 6 G C5' C 8.632 5.808 -3.086 . . . 1.0 . . . . . . . . . . . . A . 6 G C5' . . . . . . . . . rr_1ajf 1
. 1 . 172 . 1 1 6 G C6 C 1.237 3.969 -3.797 . . . 1.0 . . . . . . . . . . . . A . 6 G C6 . . . . . . . . . rr_1ajf 1
. 1 . 173 . 1 1 6 G C8 C 4.640 4.298 -2.933 . . . 1.0 . . . . . . . . . . . . A . 6 G C8 . . . . . . . . . rr_1ajf 1
. 1 . 174 . 1 1 6 G H1 H -0.117 3.927 -5.342 . . . 1.0 . . . . . . . . . . . . A . 6 G H1 . . . . . . . . . rr_1ajf 1
. 1 . 175 . 1 1 6 G H1' H 5.914 3.852 -5.917 . . . 1.0 . . . . . . . . . . . . A . 6 G H1' . . . . . . . . . rr_1ajf 1
. 1 . 176 . 1 1 6 G H2' H 5.011 6.421 -5.862 . . . 1.0 . . . . . . . . . . . . A . 6 G H2' . . . . . . . . . rr_1ajf 1
. 1 . 177 . 1 1 6 G H21 H 0.205 4.064 -7.520 . . . 1.0 . . . . . . . . . . . . A . 6 G H21 . . . . . . . . . rr_1ajf 1
. 1 . 178 . 1 1 6 G H22 H 1.786 4.368 -8.200 . . . 1.0 . . . . . . . . . . . . A . 6 G H22 . . . . . . . . . rr_1ajf 1
. 1 . 179 . 1 1 6 G H3' H 6.189 6.856 -3.819 . . . 1.0 . . . . . . . . . . . . A . 6 G H3' . . . . . . . . . rr_1ajf 1
. 1 . 180 . 1 1 6 G H4' H 8.577 5.570 -5.219 . . . 1.0 . . . . . . . . . . . . A . 6 G H4' . . . . . . . . . rr_1ajf 1
. 1 . 181 . 1 1 6 G H5' H 9.378 5.016 -2.998 . . . 1.0 . . . . . . . . . . . . A . 6 G H5' . . . . . . . . . rr_1ajf 1
. 1 . 182 . 1 1 6 G H5'' H 9.142 6.772 -3.108 . . . 1.0 . . . . . . . . . . . . A . 6 G H5'' . . . . . . . . . rr_1ajf 1
. 1 . 183 . 1 1 6 G H8 H 5.507 4.364 -2.277 . . . 1.0 . . . . . . . . . . . . A . 6 G H8 . . . . . . . . . rr_1ajf 1
. 1 . 184 . 1 1 6 G HO2' H 7.001 6.858 -7.164 . . . 1.0 . . . . . . . . . . . . A . 6 G HO2' . . . . . . . . . rr_1ajf 1
. 1 . 185 . 1 1 6 G N1 N 0.863 4.017 -5.131 . . . 1.0 . . . . . . . . . . . . A . 6 G N1 . . . . . . . . . rr_1ajf 1
. 1 . 186 . 1 1 6 G N2 N 1.196 4.206 -7.398 . . . 1.0 . . . . . . . . . . . . A . 6 G N2 . . . . . . . . . rr_1ajf 1
. 1 . 187 . 1 1 6 G N3 N 3.043 4.323 -6.055 . . . 1.0 . . . . . . . . . . . . A . 6 G N3 . . . . . . . . . rr_1ajf 1
. 1 . 188 . 1 1 6 G N7 N 3.424 4.131 -2.490 . . . 1.0 . . . . . . . . . . . . A . 6 G N7 . . . . . . . . . rr_1ajf 1
. 1 . 189 . 1 1 6 G N9 N 4.721 4.396 -4.298 . . . 1.0 . . . . . . . . . . . . A . 6 G N9 . . . . . . . . . rr_1ajf 1
. 1 . 190 . 1 1 6 G O2' O 6.715 5.958 -6.990 . . . 1.0 . . . . . . . . . . . . A . 6 G O2' . . . . . . . . . rr_1ajf 1
. 1 . 191 . 1 1 6 G O3' O 7.418 7.818 -5.233 . . . 1.0 . . . . . . . . . . . . A . 6 G O3' . . . . . . . . . rr_1ajf 1
. 1 . 192 . 1 1 6 G O4' O 7.108 4.416 -4.351 . . . 1.0 . . . . . . . . . . . . A . 6 G O4' . . . . . . . . . rr_1ajf 1
. 1 . 193 . 1 1 6 G O5' O 7.768 5.762 -1.943 . . . 1.0 . . . . . . . . . . . . A . 6 G O5' . . . . . . . . . rr_1ajf 1
. 1 . 194 . 1 1 6 G O6 O 0.388 3.802 -2.924 . . . 1.0 . . . . . . . . . . . . A . 6 G O6 . . . . . . . . . rr_1ajf 1
. 1 . 195 . 1 1 6 G OP1 O 9.466 6.742 -0.378 . . . 1.0 . . . . . . . . . . . . A . 6 G OP1 . . . . . . . . . rr_1ajf 1
. 1 . 196 . 1 1 6 G OP2 O 7.258 5.798 0.511 . . . 1.0 . . . . . . . . . . . . A . 6 G OP2 . . . . . . . . . rr_1ajf 1
. 1 . 197 . 1 1 6 G P P 8.381 5.738 -0.451 . . . 1.0 . . . . . . . . . . . . A . 6 G P . . . . . . . . . rr_1ajf 1
. 1 . 198 . 1 1 7 G C1' C 1.795 8.456 -7.058 . . . 1.0 . . . . . . . . . . . . A . 7 G C1' . . . . . . . . . rr_1ajf 1
. 1 . 199 . 1 1 7 G C2 C -2.025 7.714 -5.148 . . . 1.0 . . . . . . . . . . . . A . 7 G C2 . . . . . . . . . rr_1ajf 1
. 1 . 200 . 1 1 7 G C2' C 1.583 9.973 -7.165 . . . 1.0 . . . . . . . . . . . . A . 7 G C2' . . . . . . . . . rr_1ajf 1
. 1 . 201 . 1 1 7 G C3' C 2.988 10.500 -6.914 . . . 1.0 . . . . . . . . . . . . A . 7 G C3' . . . . . . . . . rr_1ajf 1
. 1 . 202 . 1 1 7 G C4 C 0.196 7.733 -5.233 . . . 1.0 . . . . . . . . . . . . A . 7 G C4 . . . . . . . . . rr_1ajf 1
. 1 . 203 . 1 1 7 G C4' C 3.848 9.465 -7.614 . . . 1.0 . . . . . . . . . . . . A . 7 G C4' . . . . . . . . . rr_1ajf 1
. 1 . 204 . 1 1 7 G C5 C 0.352 7.211 -3.972 . . . 1.0 . . . . . . . . . . . . A . 7 G C5 . . . . . . . . . rr_1ajf 1
. 1 . 205 . 1 1 7 G C5' C 5.298 9.407 -7.140 . . . 1.0 . . . . . . . . . . . . A . 7 G C5' . . . . . . . . . rr_1ajf 1
. 1 . 206 . 1 1 7 G C6 C -0.801 6.901 -3.199 . . . 1.0 . . . . . . . . . . . . A . 7 G C6 . . . . . . . . . rr_1ajf 1
. 1 . 207 . 1 1 7 G C8 C 2.314 7.510 -4.729 . . . 1.0 . . . . . . . . . . . . A . 7 G C8 . . . . . . . . . rr_1ajf 1
. 1 . 208 . 1 1 7 G H1 H -2.833 7.010 -3.404 . . . 1.0 . . . . . . . . . . . . A . 7 G H1 . . . . . . . . . rr_1ajf 1
. 1 . 209 . 1 1 7 G H1' H 1.206 7.929 -7.810 . . . 1.0 . . . . . . . . . . . . A . 7 G H1' . . . . . . . . . rr_1ajf 1
. 1 . 210 . 1 1 7 G H2' H 0.886 10.326 -6.405 . . . 1.0 . . . . . . . . . . . . A . 7 G H2' . . . . . . . . . rr_1ajf 1
. 1 . 211 . 1 1 7 G H21 H -4.051 7.694 -5.116 . . . 1.0 . . . . . . . . . . . . A . 7 G H21 . . . . . . . . . rr_1ajf 1
. 1 . 212 . 1 1 7 G H22 H -3.325 8.339 -6.568 . . . 1.0 . . . . . . . . . . . . A . 7 G H22 . . . . . . . . . rr_1ajf 1
. 1 . 213 . 1 1 7 G H3' H 3.223 10.618 -5.855 . . . 1.0 . . . . . . . . . . . . A . 7 G H3' . . . . . . . . . rr_1ajf 1
. 1 . 214 . 1 1 7 G H4' H 3.832 9.621 -8.693 . . . 1.0 . . . . . . . . . . . . A . 7 G H4' . . . . . . . . . rr_1ajf 1
. 1 . 215 . 1 1 7 G H5' H 5.803 8.581 -7.642 . . . 1.0 . . . . . . . . . . . . A . 7 G H5' . . . . . . . . . rr_1ajf 1
. 1 . 216 . 1 1 7 G H5'' H 5.794 10.340 -7.405 . . . 1.0 . . . . . . . . . . . . A . 7 G H5'' . . . . . . . . . rr_1ajf 1
. 1 . 217 . 1 1 7 G H8 H 3.400 7.543 -4.821 . . . 1.0 . . . . . . . . . . . . A . 7 G H8 . . . . . . . . . rr_1ajf 1
. 1 . 218 . 1 1 7 G HO2' H 1.244 11.278 -8.566 . . . 1.0 . . . . . . . . . . . . A . 7 G HO2' . . . . . . . . . rr_1ajf 1
. 1 . 219 . 1 1 7 G N1 N -1.965 7.192 -3.882 . . . 1.0 . . . . . . . . . . . . A . 7 G N1 . . . . . . . . . rr_1ajf 1
. 1 . 220 . 1 1 7 G N2 N -3.230 7.932 -5.651 . . . 1.0 . . . . . . . . . . . . A . 7 G N2 . . . . . . . . . rr_1ajf 1
. 1 . 221 . 1 1 7 G N3 N -0.959 8.010 -5.886 . . . 1.0 . . . . . . . . . . . . A . 7 G N3 . . . . . . . . . rr_1ajf 1
. 1 . 222 . 1 1 7 G N7 N 1.701 7.074 -3.664 . . . 1.0 . . . . . . . . . . . . A . 7 G N7 . . . . . . . . . rr_1ajf 1
. 1 . 223 . 1 1 7 G N9 N 1.464 7.925 -5.722 . . . 1.0 . . . . . . . . . . . . A . 7 G N9 . . . . . . . . . rr_1ajf 1
. 1 . 224 . 1 1 7 G O2' O 1.137 10.328 -8.479 . . . 1.0 . . . . . . . . . . . . A . 7 G O2' . . . . . . . . . rr_1ajf 1
. 1 . 225 . 1 1 7 G O3' O 3.129 11.730 -7.642 . . . 1.0 . . . . . . . . . . . . A . 7 G O3' . . . . . . . . . rr_1ajf 1
. 1 . 226 . 1 1 7 G O4' O 3.195 8.231 -7.310 . . . 1.0 . . . . . . . . . . . . A . 7 G O4' . . . . . . . . . rr_1ajf 1
. 1 . 227 . 1 1 7 G O5' O 5.385 9.217 -5.722 . . . 1.0 . . . . . . . . . . . . A . 7 G O5' . . . . . . . . . rr_1ajf 1
. 1 . 228 . 1 1 7 G O6 O -0.858 6.429 -2.067 . . . 1.0 . . . . . . . . . . . . A . 7 G O6 . . . . . . . . . rr_1ajf 1
. 1 . 229 . 1 1 7 G OP1 O 7.657 10.275 -5.661 . . . 1.0 . . . . . . . . . . . . A . 7 G OP1 . . . . . . . . . rr_1ajf 1
. 1 . 230 . 1 1 7 G OP2 O 6.551 9.424 -3.513 . . . 1.0 . . . . . . . . . . . . A . 7 G OP2 . . . . . . . . . rr_1ajf 1
. 1 . 231 . 1 1 7 G P P 6.806 9.284 -4.964 . . . 1.0 . . . . . . . . . . . . A . 7 G P . . . . . . . . . rr_1ajf 1
. 1 . 232 . 1 1 8 G C1' C -1.049 11.069 -4.069 . . . 1.0 . . . . . . . . . . . . A . 8 G C1' . . . . . . . . . rr_1ajf 1
. 1 . 233 . 1 1 8 G C2 C -1.908 8.775 -0.490 . . . 1.0 . . . . . . . . . . . . A . 8 G C2 . . . . . . . . . rr_1ajf 1
. 1 . 234 . 1 1 8 G C2' C -1.862 12.210 -3.454 . . . 1.0 . . . . . . . . . . . . A . 8 G C2' . . . . . . . . . rr_1ajf 1
. 1 . 235 . 1 1 8 G C3' C -0.930 13.388 -3.675 . . . 1.0 . . . . . . . . . . . . A . 8 G C3' . . . . . . . . . rr_1ajf 1
. 1 . 236 . 1 1 8 G C4 C -0.559 9.722 -1.982 . . . 1.0 . . . . . . . . . . . . A . 8 G C4 . . . . . . . . . rr_1ajf 1
. 1 . 237 . 1 1 8 G C4' C -0.374 13.103 -5.061 . . . 1.0 . . . . . . . . . . . . A . 8 G C4' . . . . . . . . . rr_1ajf 1
. 1 . 238 . 1 1 8 G C5 C 0.592 9.322 -1.347 . . . 1.0 . . . . . . . . . . . . A . 8 G C5 . . . . . . . . . rr_1ajf 1
. 1 . 239 . 1 1 8 G C5' C 0.983 13.738 -5.352 . . . 1.0 . . . . . . . . . . . . A . 8 G C5' . . . . . . . . . rr_1ajf 1
. 1 . 240 . 1 1 8 G C6 C 0.499 8.564 -0.147 . . . 1.0 . . . . . . . . . . . . A . 8 G C6 . . . . . . . . . rr_1ajf 1
. 1 . 241 . 1 1 8 G C8 C 1.215 10.408 -3.061 . . . 1.0 . . . . . . . . . . . . A . 8 G C8 . . . . . . . . . rr_1ajf 1
. 1 . 242 . 1 1 8 G H1 H -0.973 7.803 1.048 . . . 1.0 . . . . . . . . . . . . A . 8 G H1 . . . . . . . . . rr_1ajf 1
. 1 . 243 . 1 1 8 G H1' H -1.699 10.320 -4.519 . . . 1.0 . . . . . . . . . . . . A . 8 G H1' . . . . . . . . . rr_1ajf 1
. 1 . 244 . 1 1 8 G H2' H -2.043 12.038 -2.392 . . . 1.0 . . . . . . . . . . . . A . 8 G H2' . . . . . . . . . rr_1ajf 1
. 1 . 245 . 1 1 8 G H21 H -3.167 7.905 0.838 . . . 1.0 . . . . . . . . . . . . A . 8 G H21 . . . . . . . . . rr_1ajf 1
. 1 . 246 . 1 1 8 G H22 H -3.932 8.791 -0.465 . . . 1.0 . . . . . . . . . . . . A . 8 G H22 . . . . . . . . . rr_1ajf 1
. 1 . 247 . 1 1 8 G H3' H -0.160 13.477 -2.908 . . . 1.0 . . . . . . . . . . . . A . 8 G H3' . . . . . . . . . rr_1ajf 1
. 1 . 248 . 1 1 8 G H4' H -1.083 13.409 -5.831 . . . 1.0 . . . . . . . . . . . . A . 8 G H4' . . . . . . . . . rr_1ajf 1
. 1 . 249 . 1 1 8 G H5' H 0.882 14.823 -5.320 . . . 1.0 . . . . . . . . . . . . A . 8 G H5' . . . . . . . . . rr_1ajf 1
. 1 . 250 . 1 1 8 G H5'' H 1.692 13.424 -4.585 . . . 1.0 . . . . . . . . . . . . A . 8 G H5'' . . . . . . . . . rr_1ajf 1
. 1 . 251 . 1 1 8 G H8 H 1.832 10.886 -3.823 . . . 1.0 . . . . . . . . . . . . A . 8 G H8 . . . . . . . . . rr_1ajf 1
. 1 . 252 . 1 1 8 G HO2' H -3.287 13.337 -4.148 . . . 1.0 . . . . . . . . . . . . A . 8 G HO2' . . . . . . . . . rr_1ajf 1
. 1 . 253 . 1 1 8 G N1 N -0.814 8.335 0.209 . . . 1.0 . . . . . . . . . . . . A . 8 G N1 . . . . . . . . . rr_1ajf 1
. 1 . 254 . 1 1 8 G N2 N -3.097 8.465 0.000 . . . 1.0 . . . . . . . . . . . . A . 8 G N2 . . . . . . . . . rr_1ajf 1
. 1 . 255 . 1 1 8 G N3 N -1.842 9.486 -1.613 . . . 1.0 . . . . . . . . . . . . A . 8 G N3 . . . . . . . . . rr_1ajf 1
. 1 . 256 . 1 1 8 G N7 N 1.712 9.764 -2.043 . . . 1.0 . . . . . . . . . . . . A . 8 G N7 . . . . . . . . . rr_1ajf 1
. 1 . 257 . 1 1 8 G N9 N -0.156 10.425 -3.089 . . . 1.0 . . . . . . . . . . . . A . 8 G N9 . . . . . . . . . rr_1ajf 1
. 1 . 258 . 1 1 8 G O2' O -3.091 12.396 -4.166 . . . 1.0 . . . . . . . . . . . . A . 8 G O2' . . . . . . . . . rr_1ajf 1
. 1 . 259 . 1 1 8 G O3' O -1.740 14.569 -3.769 . . . 1.0 . . . . . . . . . . . . A . 8 G O3' . . . . . . . . . rr_1ajf 1
. 1 . 260 . 1 1 8 G O4' O -0.238 11.677 -5.090 . . . 1.0 . . . . . . . . . . . . A . 8 G O4' . . . . . . . . . rr_1ajf 1
. 1 . 261 . 1 1 8 G O5' O 1.482 13.349 -6.639 . . . 1.0 . . . . . . . . . . . . A . 8 G O5' . . . . . . . . . rr_1ajf 1
. 1 . 262 . 1 1 8 G O6 O 1.406 8.128 0.555 . . . 1.0 . . . . . . . . . . . . A . 8 G O6 . . . . . . . . . rr_1ajf 1
. 1 . 263 . 1 1 8 G OP1 O 3.512 14.197 -7.838 . . . 1.0 . . . . . . . . . . . . A . 8 G OP1 . . . . . . . . . rr_1ajf 1
. 1 . 264 . 1 1 8 G OP2 O 3.732 13.016 -5.576 . . . 1.0 . . . . . . . . . . . . A . 8 G OP2 . . . . . . . . . rr_1ajf 1
. 1 . 265 . 1 1 8 G P P 3.063 13.153 -6.890 . . . 1.0 . . . . . . . . . . . . A . 8 G P . . . . . . . . . rr_1ajf 1
. 1 . 266 . 1 1 9 A C1' C -2.747 15.890 1.885 . . . 1.0 . . . . . . . . . . . . A . 9 A C1' . . . . . . . . . rr_1ajf 1
. 1 . 267 . 1 1 9 A C2 C -6.809 16.260 3.037 . . . 1.0 . . . . . . . . . . . . A . 9 A C2 . . . . . . . . . rr_1ajf 1
. 1 . 268 . 1 1 9 A C2' C -2.029 14.584 2.225 . . . 1.0 . . . . . . . . . . . . A . 9 A C2' . . . . . . . . . rr_1ajf 1
. 1 . 269 . 1 1 9 A C3' C -1.087 14.435 1.042 . . . 1.0 . . . . . . . . . . . . A . 9 A C3' . . . . . . . . . rr_1ajf 1
. 1 . 270 . 1 1 9 A C4 C -5.222 15.851 1.608 . . . 1.0 . . . . . . . . . . . . A . 9 A C4 . . . . . . . . . rr_1ajf 1
. 1 . 271 . 1 1 9 A C4' C -0.673 15.871 0.754 . . . 1.0 . . . . . . . . . . . . A . 9 A C4' . . . . . . . . . rr_1ajf 1
. 1 . 272 . 1 1 9 A C5 C -6.086 15.626 0.582 . . . 1.0 . . . . . . . . . . . . A . 9 A C5 . . . . . . . . . rr_1ajf 1
. 1 . 273 . 1 1 9 A C5' C -0.296 16.137 -0.701 . . . 1.0 . . . . . . . . . . . . A . 9 A C5' . . . . . . . . . rr_1ajf 1
. 1 . 274 . 1 1 9 A C6 C -7.451 15.747 0.887 . . . 1.0 . . . . . . . . . . . . A . 9 A C6 . . . . . . . . . rr_1ajf 1
. 1 . 275 . 1 1 9 A C8 C -4.137 15.363 -0.216 . . . 1.0 . . . . . . . . . . . . A . 9 A C8 . . . . . . . . . rr_1ajf 1
. 1 . 276 . 1 1 9 A H1' H -3.006 16.444 2.794 . . . 1.0 . . . . . . . . . . . . A . 9 A H1' . . . . . . . . . rr_1ajf 1
. 1 . 277 . 1 1 9 A H2 H -7.122 16.523 4.039 . . . 1.0 . . . . . . . . . . . . A . 9 A H2 . . . . . . . . . rr_1ajf 1
. 1 . 278 . 1 1 9 A H2' H -2.732 13.752 2.279 . . . 1.0 . . . . . . . . . . . . A . 9 A H2' . . . . . . . . . rr_1ajf 1
. 1 . 279 . 1 1 9 A H3' H -1.544 13.936 0.187 . . . 1.0 . . . . . . . . . . . . A . 9 A H3' . . . . . . . . . rr_1ajf 1
. 1 . 280 . 1 1 9 A H4' H 0.158 16.167 1.396 . . . 1.0 . . . . . . . . . . . . A . 9 A H4' . . . . . . . . . rr_1ajf 1
. 1 . 281 . 1 1 9 A H5' H -0.070 17.197 -0.821 . . . 1.0 . . . . . . . . . . . . A . 9 A H5' . . . . . . . . . rr_1ajf 1
. 1 . 282 . 1 1 9 A H5'' H 0.590 15.553 -0.952 . . . 1.0 . . . . . . . . . . . . A . 9 A H5'' . . . . . . . . . rr_1ajf 1
. 1 . 283 . 1 1 9 A H61 H -9.389 15.663 0.282 . . . 1.0 . . . . . . . . . . . . A . 9 A H61 . . . . . . . . . rr_1ajf 1
. 1 . 284 . 1 1 9 A H62 H -8.199 15.323 -0.955 . . . 1.0 . . . . . . . . . . . . A . 9 A H62 . . . . . . . . . rr_1ajf 1
. 1 . 285 . 1 1 9 A H8 H -3.304 15.167 -0.892 . . . 1.0 . . . . . . . . . . . . A . 9 A H8 . . . . . . . . . rr_1ajf 1
. 1 . 286 . 1 1 9 A HO2' H -0.763 13.923 3.546 . . . 1.0 . . . . . . . . . . . . A . 9 A HO2' . . . . . . . . . rr_1ajf 1
. 1 . 287 . 1 1 9 A N1 N -7.782 16.071 2.148 . . . 1.0 . . . . . . . . . . . . A . 9 A N1 . . . . . . . . . rr_1ajf 1
. 1 . 288 . 1 1 9 A N3 N -5.513 16.175 2.875 . . . 1.0 . . . . . . . . . . . . A . 9 A N3 . . . . . . . . . rr_1ajf 1
. 1 . 289 . 1 1 9 A N6 N -8.425 15.563 -0.001 . . . 1.0 . . . . . . . . . . . . A . 9 A N6 . . . . . . . . . rr_1ajf 1
. 1 . 290 . 1 1 9 A N7 N -5.392 15.313 -0.584 . . . 1.0 . . . . . . . . . . . . A . 9 A N7 . . . . . . . . . rr_1ajf 1
. 1 . 291 . 1 1 9 A N9 N -3.973 15.687 1.107 . . . 1.0 . . . . . . . . . . . . A . 9 A N9 . . . . . . . . . rr_1ajf 1
. 1 . 292 . 1 1 9 A O2' O -1.293 14.718 3.447 . . . 1.0 . . . . . . . . . . . . A . 9 A O2' . . . . . . . . . rr_1ajf 1
. 1 . 293 . 1 1 9 A O3' O 0.083 13.746 1.507 . . . 1.0 . . . . . . . . . . . . A . 9 A O3' . . . . . . . . . rr_1ajf 1
. 1 . 294 . 1 1 9 A O4' O -1.827 16.652 1.088 . . . 1.0 . . . . . . . . . . . . A . 9 A O4' . . . . . . . . . rr_1ajf 1
. 1 . 295 . 1 1 9 A O5' O -1.362 15.780 -1.594 . . . 1.0 . . . . . . . . . . . . A . 9 A O5' . . . . . . . . . rr_1ajf 1
. 1 . 296 . 1 1 9 A OP1 O -2.173 17.032 -3.608 . . . 1.0 . . . . . . . . . . . . A . 9 A OP1 . . . . . . . . . rr_1ajf 1
. 1 . 297 . 1 1 9 A OP2 O 0.218 16.117 -3.515 . . . 1.0 . . . . . . . . . . . . A . 9 A OP2 . . . . . . . . . rr_1ajf 1
. 1 . 298 . 1 1 9 A P P -1.220 15.981 -3.188 . . . 1.0 . . . . . . . . . . . . A . 9 A P . . . . . . . . . rr_1ajf 1
. 1 . 299 . 1 1 10 A C1' C -4.972 12.183 2.542 . . . 1.0 . . . . . . . . . . . . A . 10 A C1' . . . . . . . . . rr_1ajf 1
. 1 . 300 . 1 1 10 A C2 C -8.782 12.582 0.511 . . . 1.0 . . . . . . . . . . . . A . 10 A C2 . . . . . . . . . rr_1ajf 1
. 1 . 301 . 1 1 10 A C2' C -5.404 10.845 3.144 . . . 1.0 . . . . . . . . . . . . A . 10 A C2' . . . . . . . . . rr_1ajf 1
. 1 . 302 . 1 1 10 A C3' C -4.179 9.996 2.853 . . . 1.0 . . . . . . . . . . . . A . 10 A C3' . . . . . . . . . rr_1ajf 1
. 1 . 303 . 1 1 10 A C4 C -6.596 12.421 0.610 . . . 1.0 . . . . . . . . . . . . A . 10 A C4 . . . . . . . . . rr_1ajf 1
. 1 . 304 . 1 1 10 A C4' C -3.046 10.962 3.151 . . . 1.0 . . . . . . . . . . . . A . 10 A C4' . . . . . . . . . rr_1ajf 1
. 1 . 305 . 1 1 10 A C5 C -6.459 12.502 -0.746 . . . 1.0 . . . . . . . . . . . . A . 10 A C5 . . . . . . . . . rr_1ajf 1
. 1 . 306 . 1 1 10 A C5' C -1.729 10.630 2.457 . . . 1.0 . . . . . . . . . . . . A . 10 A C5' . . . . . . . . . rr_1ajf 1
. 1 . 307 . 1 1 10 A C6 C -7.644 12.637 -1.487 . . . 1.0 . . . . . . . . . . . . A . 10 A C6 . . . . . . . . . rr_1ajf 1
. 1 . 308 . 1 1 10 A C8 C -4.491 12.311 0.024 . . . 1.0 . . . . . . . . . . . . A . 10 A C8 . . . . . . . . . rr_1ajf 1
. 1 . 309 . 1 1 10 A H1' H -5.402 13.021 3.094 . . . 1.0 . . . . . . . . . . . . A . 10 A H1' . . . . . . . . . rr_1ajf 1
. 1 . 310 . 1 1 10 A H2 H -9.755 12.616 1.000 . . . 1.0 . . . . . . . . . . . . A . 10 A H2 . . . . . . . . . rr_1ajf 1
. 1 . 311 . 1 1 10 A H2' H -6.289 10.452 2.642 . . . 1.0 . . . . . . . . . . . . A . 10 A H2' . . . . . . . . . rr_1ajf 1
. 1 . 312 . 1 1 10 A H3' H -4.158 9.610 1.837 . . . 1.0 . . . . . . . . . . . . A . 10 A H3' . . . . . . . . . rr_1ajf 1
. 1 . 313 . 1 1 10 A H4' H -2.876 11.040 4.225 . . . 1.0 . . . . . . . . . . . . A . 10 A H4' . . . . . . . . . rr_1ajf 1
. 1 . 314 . 1 1 10 A H5' H -1.344 9.691 2.855 . . . 1.0 . . . . . . . . . . . . A . 10 A H5' . . . . . . . . . rr_1ajf 1
. 1 . 315 . 1 1 10 A H5'' H -1.915 10.514 1.389 . . . 1.0 . . . . . . . . . . . . A . 10 A H5'' . . . . . . . . . rr_1ajf 1
. 1 . 316 . 1 1 10 A H61 H -8.562 12.836 -3.287 . . . 1.0 . . . . . . . . . . . . A . 10 A H61 . . . . . . . . . rr_1ajf 1
. 1 . 317 . 1 1 10 A H62 H -6.817 12.715 -3.341 . . . 1.0 . . . . . . . . . . . . A . 10 A H62 . . . . . . . . . rr_1ajf 1
. 1 . 318 . 1 1 10 A H8 H -3.407 12.234 0.101 . . . 1.0 . . . . . . . . . . . . A . 10 A H8 . . . . . . . . . rr_1ajf 1
. 1 . 319 . 1 1 10 A HO2' H -5.491 10.095 4.936 . . . 1.0 . . . . . . . . . . . . A . 10 A HO2' . . . . . . . . . rr_1ajf 1
. 1 . 320 . 1 1 10 A N1 N -8.802 12.673 -0.814 . . . 1.0 . . . . . . . . . . . . A . 10 A N1 . . . . . . . . . rr_1ajf 1
. 1 . 321 . 1 1 10 A N3 N -7.742 12.454 1.320 . . . 1.0 . . . . . . . . . . . . A . 10 A N3 . . . . . . . . . rr_1ajf 1
. 1 . 322 . 1 1 10 A N6 N -7.677 12.737 -2.811 . . . 1.0 . . . . . . . . . . . . A . 10 A N6 . . . . . . . . . rr_1ajf 1
. 1 . 323 . 1 1 10 A N7 N -5.119 12.432 -1.113 . . . 1.0 . . . . . . . . . . . . A . 10 A N7 . . . . . . . . . rr_1ajf 1
. 1 . 324 . 1 1 10 A N9 N -5.325 12.298 1.114 . . . 1.0 . . . . . . . . . . . . A . 10 A N9 . . . . . . . . . rr_1ajf 1
. 1 . 325 . 1 1 10 A O2' O -5.615 10.967 4.554 . . . 1.0 . . . . . . . . . . . . A . 10 A O2' . . . . . . . . . rr_1ajf 1
. 1 . 326 . 1 1 10 A O3' O -4.132 8.948 3.831 . . . 1.0 . . . . . . . . . . . . A . 10 A O3' . . . . . . . . . rr_1ajf 1
. 1 . 327 . 1 1 10 A O4' O -3.537 12.215 2.658 . . . 1.0 . . . . . . . . . . . . A . 10 A O4' . . . . . . . . . rr_1ajf 1
. 1 . 328 . 1 1 10 A O5' O -0.750 11.659 2.650 . . . 1.0 . . . . . . . . . . . . A . 10 A O5' . . . . . . . . . rr_1ajf 1
. 1 . 329 . 1 1 10 A OP1 O 1.582 11.752 1.736 . . . 1.0 . . . . . . . . . . . . A . 10 A OP1 . . . . . . . . . rr_1ajf 1
. 1 . 330 . 1 1 10 A OP2 O -0.439 11.698 0.162 . . . 1.0 . . . . . . . . . . . . A . 10 A OP2 . . . . . . . . . rr_1ajf 1
. 1 . 331 . 1 1 10 A P P 0.188 12.139 1.428 . . . 1.0 . . . . . . . . . . . . A . 10 A P . . . . . . . . . rr_1ajf 1
. 1 . 332 . 1 1 11 A C1' C -8.577 8.947 0.762 . . . 1.0 . . . . . . . . . . . . A . 11 A C1' . . . . . . . . . rr_1ajf 1
. 1 . 333 . 1 1 11 A C2 C -8.512 9.939 -3.464 . . . 1.0 . . . . . . . . . . . . A . 11 A C2 . . . . . . . . . rr_1ajf 1
. 1 . 334 . 1 1 11 A C2' C -9.264 7.588 0.640 . . . 1.0 . . . . . . . . . . . . A . 11 A C2' . . . . . . . . . rr_1ajf 1
. 1 . 335 . 1 1 11 A C3' C -8.431 6.750 1.595 . . . 1.0 . . . . . . . . . . . . A . 11 A C3' . . . . . . . . . rr_1ajf 1
. 1 . 336 . 1 1 11 A C4 C -7.606 9.431 -1.531 . . . 1.0 . . . . . . . . . . . . A . 11 A C4 . . . . . . . . . rr_1ajf 1
. 1 . 337 . 1 1 11 A C4' C -8.180 7.717 2.740 . . . 1.0 . . . . . . . . . . . . A . 11 A C4' . . . . . . . . . rr_1ajf 1
. 1 . 338 . 1 1 11 A C5 C -6.338 9.487 -2.034 . . . 1.0 . . . . . . . . . . . . A . 11 A C5 . . . . . . . . . rr_1ajf 1
. 1 . 339 . 1 1 11 A C5' C -6.929 7.419 3.563 . . . 1.0 . . . . . . . . . . . . A . 11 A C5' . . . . . . . . . rr_1ajf 1
. 1 . 340 . 1 1 11 A C6 C -6.217 9.807 -3.395 . . . 1.0 . . . . . . . . . . . . A . 11 A C6 . . . . . . . . . rr_1ajf 1
. 1 . 341 . 1 1 11 A C8 C -6.129 8.983 0.016 . . . 1.0 . . . . . . . . . . . . A . 11 A C8 . . . . . . . . . rr_1ajf 1
. 1 . 342 . 1 1 11 A H1' H -9.292 9.761 0.639 . . . 1.0 . . . . . . . . . . . . A . 11 A H1' . . . . . . . . . rr_1ajf 1
. 1 . 343 . 1 1 11 A H2 H -9.389 10.129 -4.082 . . . 1.0 . . . . . . . . . . . . A . 11 A H2 . . . . . . . . . rr_1ajf 1
. 1 . 344 . 1 1 11 A H2' H -9.205 7.206 -0.380 . . . 1.0 . . . . . . . . . . . . A . 11 A H2' . . . . . . . . . rr_1ajf 1
. 1 . 345 . 1 1 11 A H3' H -7.516 6.368 1.147 . . . 1.0 . . . . . . . . . . . . A . 11 A H3' . . . . . . . . . rr_1ajf 1
. 1 . 346 . 1 1 11 A H4' H -9.043 7.760 3.404 . . . 1.0 . . . . . . . . . . . . A . 11 A H4' . . . . . . . . . rr_1ajf 1
. 1 . 347 . 1 1 11 A H5' H -6.803 8.200 4.313 . . . 1.0 . . . . . . . . . . . . A . 11 A H5' . . . . . . . . . rr_1ajf 1
. 1 . 348 . 1 1 11 A H5'' H -7.054 6.460 4.066 . . . 1.0 . . . . . . . . . . . . A . 11 A H5'' . . . . . . . . . rr_1ajf 1
. 1 . 349 . 1 1 11 A H61 H -5.028 10.110 -5.015 . . . 1.0 . . . . . . . . . . . . A . 11 A H61 . . . . . . . . . rr_1ajf 1
. 1 . 350 . 1 1 11 A H62 H -4.187 9.814 -3.511 . . . 1.0 . . . . . . . . . . . . A . 11 A H62 . . . . . . . . . rr_1ajf 1
. 1 . 351 . 1 1 11 A H8 H -5.707 8.721 0.985 . . . 1.0 . . . . . . . . . . . . A . 11 A H8 . . . . . . . . . rr_1ajf 1
. 1 . 352 . 1 1 11 A HO2' H -10.853 6.802 1.439 . . . 1.0 . . . . . . . . . . . . A . 11 A HO2' . . . . . . . . . rr_1ajf 1
. 1 . 353 . 1 1 11 A N1 N -7.343 10.030 -4.087 . . . 1.0 . . . . . . . . . . . . A . 11 A N1 . . . . . . . . . rr_1ajf 1
. 1 . 354 . 1 1 11 A N3 N -8.760 9.649 -2.196 . . . 1.0 . . . . . . . . . . . . A . 11 A N3 . . . . . . . . . rr_1ajf 1
. 1 . 355 . 1 1 11 A N6 N -5.050 9.917 -4.025 . . . 1.0 . . . . . . . . . . . . A . 11 A N6 . . . . . . . . . rr_1ajf 1
. 1 . 356 . 1 1 11 A N7 N -5.402 9.201 -1.045 . . . 1.0 . . . . . . . . . . . . A . 11 A N7 . . . . . . . . . rr_1ajf 1
. 1 . 357 . 1 1 11 A N9 N -7.475 9.107 -0.203 . . . 1.0 . . . . . . . . . . . . A . 11 A N9 . . . . . . . . . rr_1ajf 1
. 1 . 358 . 1 1 11 A O2' O -10.622 7.666 1.088 . . . 1.0 . . . . . . . . . . . . A . 11 A O2' . . . . . . . . . rr_1ajf 1
. 1 . 359 . 1 1 11 A O3' O -9.273 5.699 2.091 . . . 1.0 . . . . . . . . . . . . A . 11 A O3' . . . . . . . . . rr_1ajf 1
. 1 . 360 . 1 1 11 A O4' O -8.023 8.985 2.090 . . . 1.0 . . . . . . . . . . . . A . 11 A O4' . . . . . . . . . rr_1ajf 1
. 1 . 361 . 1 1 11 A O5' O -5.756 7.366 2.736 . . . 1.0 . . . . . . . . . . . . A . 11 A O5' . . . . . . . . . rr_1ajf 1
. 1 . 362 . 1 1 11 A OP1 O -4.276 6.565 4.598 . . . 1.0 . . . . . . . . . . . . A . 11 A OP1 . . . . . . . . . rr_1ajf 1
. 1 . 363 . 1 1 11 A OP2 O -3.299 7.149 2.300 . . . 1.0 . . . . . . . . . . . . A . 11 A OP2 . . . . . . . . . rr_1ajf 1
. 1 . 364 . 1 1 11 A P P -4.279 7.408 3.382 . . . 1.0 . . . . . . . . . . . . A . 11 A P . . . . . . . . . rr_1ajf 1
. 1 . 365 . 1 1 12 C C1' C -7.726 6.276 -2.932 . . . 1.0 . . . . . . . . . . . . A . 12 C C1' . . . . . . . . . rr_1ajf 1
. 1 . 366 . 1 1 12 C C2 C -5.281 6.477 -2.916 . . . 1.0 . . . . . . . . . . . . A . 12 C C2 . . . . . . . . . rr_1ajf 1
. 1 . 367 . 1 1 12 C C2' C -8.060 5.141 -3.896 . . . 1.0 . . . . . . . . . . . . A . 12 C C2' . . . . . . . . . rr_1ajf 1
. 1 . 368 . 1 1 12 C C3' C -8.796 4.183 -2.975 . . . 1.0 . . . . . . . . . . . . A . 12 C C3' . . . . . . . . . rr_1ajf 1
. 1 . 369 . 1 1 12 C C4 C -4.006 5.778 -1.078 . . . 1.0 . . . . . . . . . . . . A . 12 C C4 . . . . . . . . . rr_1ajf 1
. 1 . 370 . 1 1 12 C C4' C -9.633 5.132 -2.133 . . . 1.0 . . . . . . . . . . . . A . 12 C C4' . . . . . . . . . rr_1ajf 1
. 1 . 371 . 1 1 12 C C5 C -5.184 5.363 -0.385 . . . 1.0 . . . . . . . . . . . . A . 12 C C5 . . . . . . . . . rr_1ajf 1
. 1 . 372 . 1 1 12 C C5' C -10.048 4.591 -0.767 . . . 1.0 . . . . . . . . . . . . A . 12 C C5' . . . . . . . . . rr_1ajf 1
. 1 . 373 . 1 1 12 C C6 C -6.366 5.528 -1.002 . . . 1.0 . . . . . . . . . . . . A . 12 C C6 . . . . . . . . . rr_1ajf 1
. 1 . 374 . 1 1 12 C H1' H -7.721 7.236 -3.446 . . . 1.0 . . . . . . . . . . . . A . 12 C H1' . . . . . . . . . rr_1ajf 1
. 1 . 375 . 1 1 12 C H2' H -7.157 4.688 -4.302 . . . 1.0 . . . . . . . . . . . . A . 12 C H2' . . . . . . . . . rr_1ajf 1
. 1 . 376 . 1 1 12 C H3' H -8.129 3.554 -2.384 . . . 1.0 . . . . . . . . . . . . A . 12 C H3' . . . . . . . . . rr_1ajf 1
. 1 . 377 . 1 1 12 C H4' H -10.523 5.446 -2.678 . . . 1.0 . . . . . . . . . . . . A . 12 C H4' . . . . . . . . . rr_1ajf 1
. 1 . 378 . 1 1 12 C H41 H -1.980 5.940 -1.042 . . . 1.0 . . . . . . . . . . . . A . 12 C H41 . . . . . . . . . rr_1ajf 1
. 1 . 379 . 1 1 12 C H42 H -2.707 5.235 0.386 . . . 1.0 . . . . . . . . . . . . A . 12 C H42 . . . . . . . . . rr_1ajf 1
. 1 . 380 . 1 1 12 C H5 H -5.135 4.925 0.612 . . . 1.0 . . . . . . . . . . . . A . 12 C H5 . . . . . . . . . rr_1ajf 1
. 1 . 381 . 1 1 12 C H5' H -10.652 5.340 -0.257 . . . 1.0 . . . . . . . . . . . . A . 12 C H5' . . . . . . . . . rr_1ajf 1
. 1 . 382 . 1 1 12 C H5'' H -10.643 3.688 -0.908 . . . 1.0 . . . . . . . . . . . . A . 12 C H5'' . . . . . . . . . rr_1ajf 1
. 1 . 383 . 1 1 12 C H6 H -7.283 5.216 -0.504 . . . 1.0 . . . . . . . . . . . . A . 12 C H6 . . . . . . . . . rr_1ajf 1
. 1 . 384 . 1 1 12 C HO2' H -9.369 4.834 -5.303 . . . 1.0 . . . . . . . . . . . . A . 12 C HO2' . . . . . . . . . rr_1ajf 1
. 1 . 385 . 1 1 12 C N1 N -6.429 6.078 -2.250 . . . 1.0 . . . . . . . . . . . . A . 12 C N1 . . . . . . . . . rr_1ajf 1
. 1 . 386 . 1 1 12 C N3 N -4.079 6.314 -2.303 . . . 1.0 . . . . . . . . . . . . A . 12 C N3 . . . . . . . . . rr_1ajf 1
. 1 . 387 . 1 1 12 C N4 N -2.802 5.641 -0.534 . . . 1.0 . . . . . . . . . . . . A . 12 C N4 . . . . . . . . . rr_1ajf 1
. 1 . 388 . 1 1 12 C O2 O -5.354 6.961 -4.041 . . . 1.0 . . . . . . . . . . . . A . 12 C O2 . . . . . . . . . rr_1ajf 1
. 1 . 389 . 1 1 12 C O2' O -8.923 5.603 -4.941 . . . 1.0 . . . . . . . . . . . . A . 12 C O2' . . . . . . . . . rr_1ajf 1
. 1 . 390 . 1 1 12 C O3' O -9.694 3.411 -3.784 . . . 1.0 . . . . . . . . . . . . A . 12 C O3' . . . . . . . . . rr_1ajf 1
. 1 . 391 . 1 1 12 C O4' O -8.774 6.265 -1.944 . . . 1.0 . . . . . . . . . . . . A . 12 C O4' . . . . . . . . . rr_1ajf 1
. 1 . 392 . 1 1 12 C O5' O -8.905 4.277 0.042 . . . 1.0 . . . . . . . . . . . . A . 12 C O5' . . . . . . . . . rr_1ajf 1
. 1 . 393 . 1 1 12 C OP1 O -10.242 3.388 1.972 . . . 1.0 . . . . . . . . . . . . A . 12 C OP1 . . . . . . . . . rr_1ajf 1
. 1 . 394 . 1 1 12 C OP2 O -7.712 3.740 2.178 . . . 1.0 . . . . . . . . . . . . A . 12 C OP2 . . . . . . . . . rr_1ajf 1
. 1 . 395 . 1 1 12 C P P -9.025 4.168 1.648 . . . 1.0 . . . . . . . . . . . . A . 12 C P . . . . . . . . . rr_1ajf 1
. 1 . 396 . 1 1 13 U C1' C -4.423 3.334 -6.492 . . . 1.0 . . . . . . . . . . . . A . 13 U C1' . . . . . . . . . rr_1ajf 1
. 1 . 397 . 1 1 13 U C2 C -2.750 3.229 -4.704 . . . 1.0 . . . . . . . . . . . . A . 13 U C2 . . . . . . . . . rr_1ajf 1
. 1 . 398 . 1 1 13 U C2' C -4.359 2.003 -7.242 . . . 1.0 . . . . . . . . . . . . A . 13 U C2' . . . . . . . . . rr_1ajf 1
. 1 . 399 . 1 1 13 U C3' C -5.784 1.502 -7.076 . . . 1.0 . . . . . . . . . . . . A . 13 U C3' . . . . . . . . . rr_1ajf 1
. 1 . 400 . 1 1 13 U C4 C -3.416 2.979 -2.349 . . . 1.0 . . . . . . . . . . . . A . 13 U C4 . . . . . . . . . rr_1ajf 1
. 1 . 401 . 1 1 13 U C4' C -6.592 2.777 -7.245 . . . 1.0 . . . . . . . . . . . . A . 13 U C4' . . . . . . . . . rr_1ajf 1
. 1 . 402 . 1 1 13 U C5 C -4.788 2.955 -2.798 . . . 1.0 . . . . . . . . . . . . A . 13 U C5 . . . . . . . . . rr_1ajf 1
. 1 . 403 . 1 1 13 U C5' C -7.976 2.745 -6.602 . . . 1.0 . . . . . . . . . . . . A . 13 U C5' . . . . . . . . . rr_1ajf 1
. 1 . 404 . 1 1 13 U C6 C -5.072 3.061 -4.116 . . . 1.0 . . . . . . . . . . . . A . 13 U C6 . . . . . . . . . rr_1ajf 1
. 1 . 405 . 1 1 13 U H1' H -3.766 4.073 -6.951 . . . 1.0 . . . . . . . . . . . . A . 13 U H1' . . . . . . . . . rr_1ajf 1
. 1 . 406 . 1 1 13 U H2' H -3.644 1.325 -6.779 . . . 1.0 . . . . . . . . . . . . A . 13 U H2' . . . . . . . . . rr_1ajf 1
. 1 . 407 . 1 1 13 U H3 H -1.513 3.139 -3.070 . . . 1.0 . . . . . . . . . . . . A . 13 U H3 . . . . . . . . . rr_1ajf 1
. 1 . 408 . 1 1 13 U H3' H -5.958 1.004 -6.121 . . . 1.0 . . . . . . . . . . . . A . 13 U H3' . . . . . . . . . rr_1ajf 1
. 1 . 409 . 1 1 13 U H4' H -6.696 3.028 -8.301 . . . 1.0 . . . . . . . . . . . . A . 13 U H4' . . . . . . . . . rr_1ajf 1
. 1 . 410 . 1 1 13 U H5 H -5.597 2.863 -2.073 . . . 1.0 . . . . . . . . . . . . A . 13 U H5 . . . . . . . . . rr_1ajf 1
. 1 . 411 . 1 1 13 U H5' H -8.430 3.733 -6.685 . . . 1.0 . . . . . . . . . . . . A . 13 U H5' . . . . . . . . . rr_1ajf 1
. 1 . 412 . 1 1 13 U H5'' H -8.597 2.022 -7.134 . . . 1.0 . . . . . . . . . . . . A . 13 U H5'' . . . . . . . . . rr_1ajf 1
. 1 . 413 . 1 1 13 U H6 H -6.113 3.029 -4.438 . . . 1.0 . . . . . . . . . . . . A . 13 U H6 . . . . . . . . . rr_1ajf 1
. 1 . 414 . 1 1 13 U HO2' H -3.320 1.630 -8.846 . . . 1.0 . . . . . . . . . . . . A . 13 U HO2' . . . . . . . . . rr_1ajf 1
. 1 . 415 . 1 1 13 U N1 N -4.087 3.198 -5.059 . . . 1.0 . . . . . . . . . . . . A . 13 U N1 . . . . . . . . . rr_1ajf 1
. 1 . 416 . 1 1 13 U N3 N -2.481 3.117 -3.353 . . . 1.0 . . . . . . . . . . . . A . 13 U N3 . . . . . . . . . rr_1ajf 1
. 1 . 417 . 1 1 13 U O2 O -1.849 3.343 -5.534 . . . 1.0 . . . . . . . . . . . . A . 13 U O2 . . . . . . . . . rr_1ajf 1
. 1 . 418 . 1 1 13 U O2' O -4.049 2.218 -8.623 . . . 1.0 . . . . . . . . . . . . A . 13 U O2' . . . . . . . . . rr_1ajf 1
. 1 . 419 . 1 1 13 U O3' O -6.087 0.653 -8.191 . . . 1.0 . . . . . . . . . . . . A . 13 U O3' . . . . . . . . . rr_1ajf 1
. 1 . 420 . 1 1 13 U O4 O -3.049 2.890 -1.183 . . . 1.0 . . . . . . . . . . . . A . 13 U O4 . . . . . . . . . rr_1ajf 1
. 1 . 421 . 1 1 13 U O4' O -5.790 3.777 -6.602 . . . 1.0 . . . . . . . . . . . . A . 13 U O4' . . . . . . . . . rr_1ajf 1
. 1 . 422 . 1 1 13 U O5' O -7.905 2.373 -5.218 . . . 1.0 . . . . . . . . . . . . A . 13 U O5' . . . . . . . . . rr_1ajf 1
. 1 . 423 . 1 1 13 U OP1 O -10.271 1.540 -5.350 . . . 1.0 . . . . . . . . . . . . A . 13 U OP1 . . . . . . . . . rr_1ajf 1
. 1 . 424 . 1 1 13 U OP2 O -8.841 1.113 -3.266 . . . 1.0 . . . . . . . . . . . . A . 13 U OP2 . . . . . . . . . rr_1ajf 1
. 1 . 425 . 1 1 13 U P P -9.236 1.990 -4.390 . . . 1.0 . . . . . . . . . . . . A . 13 U P . . . . . . . . . rr_1ajf 1
. 1 . 426 . 1 1 14 U C1' C -0.649 0.487 -7.813 . . . 1.0 . . . . . . . . . . . . A . 14 U C1' . . . . . . . . . rr_1ajf 1
. 1 . 427 . 1 1 14 U C2 C -0.135 0.652 -5.426 . . . 1.0 . . . . . . . . . . . . A . 14 U C2 . . . . . . . . . rr_1ajf 1
. 1 . 428 . 1 1 14 U C2' C -0.010 -0.714 -8.510 . . . 1.0 . . . . . . . . . . . . A . 14 U C2' . . . . . . . . . rr_1ajf 1
. 1 . 429 . 1 1 14 U C3' C -1.235 -1.409 -9.079 . . . 1.0 . . . . . . . . . . . . A . 14 U C3' . . . . . . . . . rr_1ajf 1
. 1 . 430 . 1 1 14 U C4 C -1.607 -0.345 -3.728 . . . 1.0 . . . . . . . . . . . . A . 14 U C4 . . . . . . . . . rr_1ajf 1
. 1 . 431 . 1 1 14 U C4' C -2.076 -0.235 -9.551 . . . 1.0 . . . . . . . . . . . . A . 14 U C4' . . . . . . . . . rr_1ajf 1
. 1 . 432 . 1 1 14 U C5 C -2.459 -0.787 -4.806 . . . 1.0 . . . . . . . . . . . . A . 14 U C5 . . . . . . . . . rr_1ajf 1
. 1 . 433 . 1 1 14 U C5' C -3.571 -0.519 -9.659 . . . 1.0 . . . . . . . . . . . . A . 14 U C5' . . . . . . . . . rr_1ajf 1
. 1 . 434 . 1 1 14 U C6 C -2.132 -0.505 -6.090 . . . 1.0 . . . . . . . . . . . . A . 14 U C6 . . . . . . . . . rr_1ajf 1
. 1 . 435 . 1 1 14 U H1' H 0.007 1.357 -7.853 . . . 1.0 . . . . . . . . . . . . A . 14 U H1' . . . . . . . . . rr_1ajf 1
. 1 . 436 . 1 1 14 U H2' H 0.512 -1.351 -7.797 . . . 1.0 . . . . . . . . . . . . A . 14 U H2' . . . . . . . . . rr_1ajf 1
. 1 . 437 . 1 1 14 U H3 H 0.131 0.672 -3.394 . . . 1.0 . . . . . . . . . . . . A . 14 U H3 . . . . . . . . . rr_1ajf 1
. 1 . 438 . 1 1 14 U H3' H -1.746 -2.044 -8.356 . . . 1.0 . . . . . . . . . . . . A . 14 U H3' . . . . . . . . . rr_1ajf 1
. 1 . 439 . 1 1 14 U H4' H -1.714 0.138 -10.509 . . . 1.0 . . . . . . . . . . . . A . 14 U H4' . . . . . . . . . rr_1ajf 1
. 1 . 440 . 1 1 14 U H5 H -3.363 -1.351 -4.588 . . . 1.0 . . . . . . . . . . . . A . 14 U H5 . . . . . . . . . rr_1ajf 1
. 1 . 441 . 1 1 14 U H5' H -4.079 0.381 -10.007 . . . 1.0 . . . . . . . . . . . . A . 14 U H5' . . . . . . . . . rr_1ajf 1
. 1 . 442 . 1 1 14 U H5'' H -3.729 -1.320 -10.382 . . . 1.0 . . . . . . . . . . . . A . 14 U H5'' . . . . . . . . . rr_1ajf 1
. 1 . 443 . 1 1 14 U H6 H -2.790 -0.841 -6.890 . . . 1.0 . . . . . . . . . . . . A . 14 U H6 . . . . . . . . . rr_1ajf 1
. 1 . 444 . 1 1 14 U HO2' H 1.006 -1.030 -10.139 . . . 1.0 . . . . . . . . . . . . A . 14 U HO2' . . . . . . . . . rr_1ajf 1
. 1 . 445 . 1 1 14 U N1 N -0.998 0.197 -6.406 . . . 1.0 . . . . . . . . . . . . A . 14 U N1 . . . . . . . . . rr_1ajf 1
. 1 . 446 . 1 1 14 U N3 N -0.488 0.354 -4.125 . . . 1.0 . . . . . . . . . . . . A . 14 U N3 . . . . . . . . . rr_1ajf 1
. 1 . 447 . 1 1 14 U O2 O 0.887 1.282 -5.688 . . . 1.0 . . . . . . . . . . . . A . 14 U O2 . . . . . . . . . rr_1ajf 1
. 1 . 448 . 1 1 14 U O2' O 0.863 -0.279 -9.557 . . . 1.0 . . . . . . . . . . . . A . 14 U O2' . . . . . . . . . rr_1ajf 1
. 1 . 449 . 1 1 14 U O3' O -0.823 -2.140 -10.243 . . . 1.0 . . . . . . . . . . . . A . 14 U O3' . . . . . . . . . rr_1ajf 1
. 1 . 450 . 1 1 14 U O4 O -1.811 -0.540 -2.536 . . . 1.0 . . . . . . . . . . . . A . 14 U O4 . . . . . . . . . rr_1ajf 1
. 1 . 451 . 1 1 14 U O4' O -1.858 0.764 -8.544 . . . 1.0 . . . . . . . . . . . . A . 14 U O4' . . . . . . . . . rr_1ajf 1
. 1 . 452 . 1 1 14 U O5' O -4.125 -0.913 -8.396 . . . 1.0 . . . . . . . . . . . . A . 14 U O5' . . . . . . . . . rr_1ajf 1
. 1 . 453 . 1 1 14 U OP1 O -6.362 -1.570 -9.320 . . . 1.0 . . . . . . . . . . . . A . 14 U OP1 . . . . . . . . . rr_1ajf 1
. 1 . 454 . 1 1 14 U OP2 O -5.977 -1.423 -6.791 . . . 1.0 . . . . . . . . . . . . A . 14 U OP2 . . . . . . . . . rr_1ajf 1
. 1 . 455 . 1 1 14 U P P -5.720 -0.916 -8.158 . . . 1.0 . . . . . . . . . . . . A . 14 U P . . . . . . . . . rr_1ajf 1
. 1 . 456 . 1 1 15 U C1' C 3.926 -2.397 -7.303 . . . 1.0 . . . . . . . . . . . . A . 15 U C1' . . . . . . . . . rr_1ajf 1
. 1 . 457 . 1 1 15 U C2 C 3.349 -2.277 -4.927 . . . 1.0 . . . . . . . . . . . . A . 15 U C2 . . . . . . . . . rr_1ajf 1
. 1 . 458 . 1 1 15 U C2' C 4.747 -3.647 -7.633 . . . 1.0 . . . . . . . . . . . . A . 15 U C2' . . . . . . . . . rr_1ajf 1
. 1 . 459 . 1 1 15 U C3' C 3.873 -4.291 -8.695 . . . 1.0 . . . . . . . . . . . . A . 15 U C3' . . . . . . . . . rr_1ajf 1
. 1 . 460 . 1 1 15 U C4 C 1.173 -3.048 -4.092 . . . 1.0 . . . . . . . . . . . . A . 15 U C4 . . . . . . . . . rr_1ajf 1
. 1 . 461 . 1 1 15 U C4' C 3.437 -3.085 -9.506 . . . 1.0 . . . . . . . . . . . . A . 15 U C4' . . . . . . . . . rr_1ajf 1
. 1 . 462 . 1 1 15 U C5 C 0.833 -3.389 -5.452 . . . 1.0 . . . . . . . . . . . . A . 15 U C5 . . . . . . . . . rr_1ajf 1
. 1 . 463 . 1 1 15 U C5' C 2.174 -3.286 -10.338 . . . 1.0 . . . . . . . . . . . . A . 15 U C5' . . . . . . . . . rr_1ajf 1
. 1 . 464 . 1 1 15 U C6 C 1.725 -3.170 -6.451 . . . 1.0 . . . . . . . . . . . . A . 15 U C6 . . . . . . . . . rr_1ajf 1
. 1 . 465 . 1 1 15 U H1' H 4.575 -1.560 -7.045 . . . 1.0 . . . . . . . . . . . . A . 15 U H1' . . . . . . . . . rr_1ajf 1
. 1 . 466 . 1 1 15 U H2' H 4.856 -4.291 -6.760 . . . 1.0 . . . . . . . . . . . . A . 15 U H2' . . . . . . . . . rr_1ajf 1
. 1 . 467 . 1 1 15 U H3 H 2.706 -2.266 -2.991 . . . 1.0 . . . . . . . . . . . . A . 15 U H3 . . . . . . . . . rr_1ajf 1
. 1 . 468 . 1 1 15 U H3' H 3.040 -4.861 -8.282 . . . 1.0 . . . . . . . . . . . . A . 15 U H3' . . . . . . . . . rr_1ajf 1
. 1 . 469 . 1 1 15 U H4' H 4.243 -2.749 -10.159 . . . 1.0 . . . . . . . . . . . . A . 15 U H4' . . . . . . . . . rr_1ajf 1
. 1 . 470 . 1 1 15 U H5 H -0.141 -3.824 -5.678 . . . 1.0 . . . . . . . . . . . . A . 15 U H5 . . . . . . . . . rr_1ajf 1
. 1 . 471 . 1 1 15 U H5' H 1.945 -2.360 -10.865 . . . 1.0 . . . . . . . . . . . . A . 15 U H5' . . . . . . . . . rr_1ajf 1
. 1 . 472 . 1 1 15 U H5'' H 2.353 -4.076 -11.068 . . . 1.0 . . . . . . . . . . . . A . 15 U H5'' . . . . . . . . . rr_1ajf 1
. 1 . 473 . 1 1 15 U H6 H 1.451 -3.430 -7.474 . . . 1.0 . . . . . . . . . . . . A . 15 U H6 . . . . . . . . . rr_1ajf 1
. 1 . 474 . 1 1 15 U HO2' H 6.386 -4.069 -8.590 . . . 1.0 . . . . . . . . . . . . A . 15 U HO2' . . . . . . . . . rr_1ajf 1
. 1 . 475 . 1 1 15 U N1 N 2.959 -2.628 -6.206 . . . 1.0 . . . . . . . . . . . . A . 15 U N1 . . . . . . . . . rr_1ajf 1
. 1 . 476 . 1 1 15 U N3 N 2.430 -2.509 -3.931 . . . 1.0 . . . . . . . . . . . . A . 15 U N3 . . . . . . . . . rr_1ajf 1
. 1 . 477 . 1 1 15 U O2 O 4.442 -1.780 -4.682 . . . 1.0 . . . . . . . . . . . . A . 15 U O2 . . . . . . . . . rr_1ajf 1
. 1 . 478 . 1 1 15 U O2' O 6.021 -3.284 -8.175 . . . 1.0 . . . . . . . . . . . . A . 15 U O2' . . . . . . . . . rr_1ajf 1
. 1 . 479 . 1 1 15 U O3' O 4.718 -5.093 -9.531 . . . 1.0 . . . . . . . . . . . . A . 15 U O3' . . . . . . . . . rr_1ajf 1
. 1 . 480 . 1 1 15 U O4 O 0.442 -3.192 -3.118 . . . 1.0 . . . . . . . . . . . . A . 15 U O4 . . . . . . . . . rr_1ajf 1
. 1 . 481 . 1 1 15 U O4' O 3.196 -2.085 -8.506 . . . 1.0 . . . . . . . . . . . . A . 15 U O4' . . . . . . . . . rr_1ajf 1
. 1 . 482 . 1 1 15 U O5' O 1.053 -3.652 -9.522 . . . 1.0 . . . . . . . . . . . . A . 15 U O5' . . . . . . . . . rr_1ajf 1
. 1 . 483 . 1 1 15 U OP1 O -0.354 -4.253 -11.509 . . . 1.0 . . . . . . . . . . . . A . 15 U OP1 . . . . . . . . . rr_1ajf 1
. 1 . 484 . 1 1 15 U OP2 O -1.325 -4.333 -9.138 . . . 1.0 . . . . . . . . . . . . A . 15 U OP2 . . . . . . . . . rr_1ajf 1
. 1 . 485 . 1 1 15 U P P -0.436 -3.702 -10.138 . . . 1.0 . . . . . . . . . . . . A . 15 U P . . . . . . . . . rr_1ajf 1
. 1 . 486 . 1 1 16 G C1' C 6.570 -6.118 -4.250 . . . 1.0 . . . . . . . . . . . . A . 16 G C1' . . . . . . . . . rr_1ajf 1
. 1 . 487 . 1 1 16 G C2 C 4.848 -6.150 -0.281 . . . 1.0 . . . . . . . . . . . . A . 16 G C2 . . . . . . . . . rr_1ajf 1
. 1 . 488 . 1 1 16 G C2' C 7.119 -7.545 -4.183 . . . 1.0 . . . . . . . . . . . . A . 16 G C2' . . . . . . . . . rr_1ajf 1
. 1 . 489 . 1 1 16 G C3' C 7.056 -7.991 -5.636 . . . 1.0 . . . . . . . . . . . . A . 16 G C3' . . . . . . . . . rr_1ajf 1
. 1 . 490 . 1 1 16 G C4 C 4.745 -6.055 -2.501 . . . 1.0 . . . . . . . . . . . . A . 16 G C4 . . . . . . . . . rr_1ajf 1
. 1 . 491 . 1 1 16 G C4' C 7.371 -6.708 -6.380 . . . 1.0 . . . . . . . . . . . . A . 16 G C4' . . . . . . . . . rr_1ajf 1
. 1 . 492 . 1 1 16 G C5 C 3.377 -5.946 -2.538 . . . 1.0 . . . . . . . . . . . . A . 16 G C5 . . . . . . . . . rr_1ajf 1
. 1 . 493 . 1 1 16 G C5' C 6.911 -6.671 -7.835 . . . 1.0 . . . . . . . . . . . . A . 16 G C5' . . . . . . . . . rr_1ajf 1
. 1 . 494 . 1 1 16 G C6 C 2.644 -5.938 -1.316 . . . 1.0 . . . . . . . . . . . . A . 16 G C6 . . . . . . . . . rr_1ajf 1
. 1 . 495 . 1 1 16 G C8 C 4.025 -5.917 -4.564 . . . 1.0 . . . . . . . . . . . . A . 16 G C8 . . . . . . . . . rr_1ajf 1
. 1 . 496 . 1 1 16 G H1 H 3.047 -6.049 0.690 . . . 1.0 . . . . . . . . . . . . A . 16 G H1 . . . . . . . . . rr_1ajf 1
. 1 . 497 . 1 1 16 G H1' H 7.176 -5.453 -3.638 . . . 1.0 . . . . . . . . . . . . A . 16 G H1' . . . . . . . . . rr_1ajf 1
. 1 . 498 . 1 1 16 G H2' H 6.486 -8.169 -3.562 . . . 1.0 . . . . . . . . . . . . A . 16 G H2' . . . . . . . . . rr_1ajf 1
. 1 . 499 . 1 1 16 G H21 H 4.995 -6.205 1.740 . . . 1.0 . . . . . . . . . . . . A . 16 G H21 . . . . . . . . . rr_1ajf 1
. 1 . 500 . 1 1 16 G H22 H 6.501 -6.365 0.869 . . . 1.0 . . . . . . . . . . . . A . 16 G H22 . . . . . . . . . rr_1ajf 1
. 1 . 501 . 1 1 16 G H3' H 6.096 -8.427 -5.912 . . . 1.0 . . . . . . . . . . . . A . 16 G H3' . . . . . . . . . rr_1ajf 1
. 1 . 502 . 1 1 16 G H4' H 8.439 -6.493 -6.339 . . . 1.0 . . . . . . . . . . . . A . 16 G H4' . . . . . . . . . rr_1ajf 1
. 1 . 503 . 1 1 16 G H5' H 7.156 -5.698 -8.258 . . . 1.0 . . . . . . . . . . . . A . 16 G H5' . . . . . . . . . rr_1ajf 1
. 1 . 504 . 1 1 16 G H5'' H 7.440 -7.445 -8.392 . . . 1.0 . . . . . . . . . . . . A . 16 G H5'' . . . . . . . . . rr_1ajf 1
. 1 . 505 . 1 1 16 G H8 H 4.034 -5.879 -5.653 . . . 1.0 . . . . . . . . . . . . A . 16 G H8 . . . . . . . . . rr_1ajf 1
. 1 . 506 . 1 1 16 G HO2' H 8.704 -8.451 -3.508 . . . 1.0 . . . . . . . . . . . . A . 16 G HO2' . . . . . . . . . rr_1ajf 1
. 1 . 507 . 1 1 16 G N1 N 3.482 -6.047 -0.220 . . . 1.0 . . . . . . . . . . . . A . 16 G N1 . . . . . . . . . rr_1ajf 1
. 1 . 508 . 1 1 16 G N2 N 5.499 -6.248 0.868 . . . 1.0 . . . . . . . . . . . . A . 16 G N2 . . . . . . . . . rr_1ajf 1
. 1 . 509 . 1 1 16 G N3 N 5.545 -6.160 -1.414 . . . 1.0 . . . . . . . . . . . . A . 16 G N3 . . . . . . . . . rr_1ajf 1
. 1 . 510 . 1 1 16 G N7 N 2.930 -5.859 -3.854 . . . 1.0 . . . . . . . . . . . . A . 16 G N7 . . . . . . . . . rr_1ajf 1
. 1 . 511 . 1 1 16 G N9 N 5.164 -6.036 -3.807 . . . 1.0 . . . . . . . . . . . . A . 16 G N9 . . . . . . . . . rr_1ajf 1
. 1 . 512 . 1 1 16 G O2' O 8.469 -7.540 -3.706 . . . 1.0 . . . . . . . . . . . . A . 16 G O2' . . . . . . . . . rr_1ajf 1
. 1 . 513 . 1 1 16 G O3' O 8.148 -8.899 -5.855 . . . 1.0 . . . . . . . . . . . . A . 16 G O3' . . . . . . . . . rr_1ajf 1
. 1 . 514 . 1 1 16 G O4' O 6.665 -5.716 -5.630 . . . 1.0 . . . . . . . . . . . . A . 16 G O4' . . . . . . . . . rr_1ajf 1
. 1 . 515 . 1 1 16 G O5' O 5.499 -6.892 -7.953 . . . 1.0 . . . . . . . . . . . . A . 16 G O5' . . . . . . . . . rr_1ajf 1
. 1 . 516 . 1 1 16 G O6 O 1.432 -5.851 -1.150 . . . 1.0 . . . . . . . . . . . . A . 16 G O6 . . . . . . . . . rr_1ajf 1
. 1 . 517 . 1 1 16 G OP1 O 5.615 -7.254 -10.432 . . . 1.0 . . . . . . . . . . . . A . 16 G OP1 . . . . . . . . . rr_1ajf 1
. 1 . 518 . 1 1 16 G OP2 O 3.357 -7.176 -9.222 . . . 1.0 . . . . . . . . . . . . A . 16 G OP2 . . . . . . . . . rr_1ajf 1
. 1 . 519 . 1 1 16 G P P 4.750 -6.697 -9.367 . . . 1.0 . . . . . . . . . . . . A . 16 G P . . . . . . . . . rr_1ajf 1
. 1 . 520 . 1 1 17 U C1' C 8.236 -9.807 0.088 . . . 1.0 . . . . . . . . . . . . A . 17 U C1' . . . . . . . . . rr_1ajf 1
. 1 . 521 . 1 1 17 U C2 C 5.900 -9.696 0.835 . . . 1.0 . . . . . . . . . . . . A . 17 U C2 . . . . . . . . . rr_1ajf 1
. 1 . 522 . 1 1 17 U C2' C 8.602 -11.280 0.285 . . . 1.0 . . . . . . . . . . . . A . 17 U C2' . . . . . . . . . rr_1ajf 1
. 1 . 523 . 1 1 17 U C3' C 8.921 -11.691 -1.143 . . . 1.0 . . . . . . . . . . . . A . 17 U C3' . . . . . . . . . rr_1ajf 1
. 1 . 524 . 1 1 17 U C4 C 4.075 -9.296 -0.758 . . . 1.0 . . . . . . . . . . . . A . 17 U C4 . . . . . . . . . rr_1ajf 1
. 1 . 525 . 1 1 17 U C4' C 9.689 -10.483 -1.653 . . . 1.0 . . . . . . . . . . . . A . 17 U C4' . . . . . . . . . rr_1ajf 1
. 1 . 526 . 1 1 17 U C5 C 5.071 -9.227 -1.798 . . . 1.0 . . . . . . . . . . . . A . 17 U C5 . . . . . . . . . rr_1ajf 1
. 1 . 527 . 1 1 17 U C5' C 9.701 -10.321 -3.173 . . . 1.0 . . . . . . . . . . . . A . 17 U C5' . . . . . . . . . rr_1ajf 1
. 1 . 528 . 1 1 17 U C6 C 6.381 -9.387 -1.495 . . . 1.0 . . . . . . . . . . . . A . 17 U C6 . . . . . . . . . rr_1ajf 1
. 1 . 529 . 1 1 17 U H1' H 8.510 -9.213 0.959 . . . 1.0 . . . . . . . . . . . . A . 17 U H1' . . . . . . . . . rr_1ajf 1
. 1 . 530 . 1 1 17 U H2' H 7.762 -11.846 0.686 . . . 1.0 . . . . . . . . . . . . A . 17 U H2' . . . . . . . . . rr_1ajf 1
. 1 . 531 . 1 1 17 U H3 H 3.906 -9.581 1.256 . . . 1.0 . . . . . . . . . . . . A . 17 U H3 . . . . . . . . . rr_1ajf 1
. 1 . 532 . 1 1 17 U H3' H 8.034 -11.922 -1.734 . . . 1.0 . . . . . . . . . . . . A . 17 U H3' . . . . . . . . . rr_1ajf 1
. 1 . 533 . 1 1 17 U H4' H 10.716 -10.502 -1.290 . . . 1.0 . . . . . . . . . . . . A . 17 U H4' . . . . . . . . . rr_1ajf 1
. 1 . 534 . 1 1 17 U H5 H 4.768 -9.048 -2.829 . . . 1.0 . . . . . . . . . . . . A . 17 U H5 . . . . . . . . . rr_1ajf 1
. 1 . 535 . 1 1 17 U H5' H 10.258 -9.419 -3.428 . . . 1.0 . . . . . . . . . . . . A . 17 U H5' . . . . . . . . . rr_1ajf 1
. 1 . 536 . 1 1 17 U H5'' H 10.198 -11.183 -3.617 . . . 1.0 . . . . . . . . . . . . A . 17 U H5'' . . . . . . . . . rr_1ajf 1
. 1 . 537 . 1 1 17 U H6 H 7.123 -9.319 -2.290 . . . 1.0 . . . . . . . . . . . . A . 17 U H6 . . . . . . . . . rr_1ajf 1
. 1 . 538 . 1 1 17 U HO2' H 10.262 -12.157 0.794 . . . 1.0 . . . . . . . . . . . . A . 17 U HO2' . . . . . . . . . rr_1ajf 1
. 1 . 539 . 1 1 17 U N1 N 6.800 -9.619 -0.213 . . . 1.0 . . . . . . . . . . . . A . 17 U N1 . . . . . . . . . rr_1ajf 1
. 1 . 540 . 1 1 17 U N3 N 4.574 -9.529 0.504 . . . 1.0 . . . . . . . . . . . . A . 17 U N3 . . . . . . . . . rr_1ajf 1
. 1 . 541 . 1 1 17 U O2 O 6.243 -9.904 1.994 . . . 1.0 . . . . . . . . . . . . A . 17 U O2 . . . . . . . . . rr_1ajf 1
. 1 . 542 . 1 1 17 U O2' O 9.760 -11.404 1.117 . . . 1.0 . . . . . . . . . . . . A . 17 U O2' . . . . . . . . . rr_1ajf 1
. 1 . 543 . 1 1 17 U O3' O 9.836 -12.794 -1.082 . . . 1.0 . . . . . . . . . . . . A . 17 U O3' . . . . . . . . . rr_1ajf 1
. 1 . 544 . 1 1 17 U O4 O 2.869 -9.165 -0.923 . . . 1.0 . . . . . . . . . . . . A . 17 U O4 . . . . . . . . . rr_1ajf 1
. 1 . 545 . 1 1 17 U O4' O 9.001 -9.373 -1.057 . . . 1.0 . . . . . . . . . . . . A . 17 U O4' . . . . . . . . . rr_1ajf 1
. 1 . 546 . 1 1 17 U O5' O 8.373 -10.218 -3.710 . . . 1.0 . . . . . . . . . . . . A . 17 U O5' . . . . . . . . . rr_1ajf 1
. 1 . 547 . 1 1 17 U OP1 O 9.229 -11.163 -5.874 . . . 1.0 . . . . . . . . . . . . A . 17 U OP1 . . . . . . . . . rr_1ajf 1
. 1 . 548 . 1 1 17 U OP2 O 6.714 -10.919 -5.453 . . . 1.0 . . . . . . . . . . . . A . 17 U OP2 . . . . . . . . . rr_1ajf 1
. 1 . 549 . 1 1 17 U P P 8.095 -10.411 -5.291 . . . 1.0 . . . . . . . . . . . . A . 17 U P . . . . . . . . . rr_1ajf 1
. 1 . 550 . 1 1 18 C C1' C 6.115 -13.168 2.966 . . . 1.0 . . . . . . . . . . . . A . 18 C C1' . . . . . . . . . rr_1ajf 1
. 1 . 551 . 1 1 18 C C2 C 3.958 -12.306 2.178 . . . 1.0 . . . . . . . . . . . . A . 18 C C2 . . . . . . . . . rr_1ajf 1
. 1 . 552 . 1 1 18 C C2' C 5.979 -14.588 3.518 . . . 1.0 . . . . . . . . . . . . A . 18 C C2' . . . . . . . . . rr_1ajf 1
. 1 . 553 . 1 1 18 C C3' C 6.978 -15.342 2.652 . . . 1.0 . . . . . . . . . . . . A . 18 C C3' . . . . . . . . . rr_1ajf 1
. 1 . 554 . 1 1 18 C C4 C 3.344 -12.428 -0.079 . . . 1.0 . . . . . . . . . . . . A . 18 C C4 . . . . . . . . . rr_1ajf 1
. 1 . 555 . 1 1 18 C C4' C 8.120 -14.340 2.610 . . . 1.0 . . . . . . . . . . . . A . 18 C C4' . . . . . . . . . rr_1ajf 1
. 1 . 556 . 1 1 18 C C5 C 4.588 -13.047 -0.411 . . . 1.0 . . . . . . . . . . . . A . 18 C C5 . . . . . . . . . rr_1ajf 1
. 1 . 557 . 1 1 18 C C5' C 9.106 -14.535 1.463 . . . 1.0 . . . . . . . . . . . . A . 18 C C5' . . . . . . . . . rr_1ajf 1
. 1 . 558 . 1 1 18 C C6 C 5.466 -13.265 0.581 . . . 1.0 . . . . . . . . . . . . A . 18 C C6 . . . . . . . . . rr_1ajf 1
. 1 . 559 . 1 1 18 C H1' H 5.972 -12.426 3.752 . . . 1.0 . . . . . . . . . . . . A . 18 C H1' . . . . . . . . . rr_1ajf 1
. 1 . 560 . 1 1 18 C H2' H 4.967 -14.967 3.372 . . . 1.0 . . . . . . . . . . . . A . 18 C H2' . . . . . . . . . rr_1ajf 1
. 1 . 561 . 1 1 18 C H3' H 6.575 -15.522 1.655 . . . 1.0 . . . . . . . . . . . . A . 18 C H3' . . . . . . . . . rr_1ajf 1
. 1 . 562 . 1 1 18 C H4' H 8.668 -14.346 3.553 . . . 1.0 . . . . . . . . . . . . A . 18 C H4' . . . . . . . . . rr_1ajf 1
. 1 . 563 . 1 1 18 C H41 H 1.549 -11.747 -0.749 . . . 1.0 . . . . . . . . . . . . A . 18 C H41 . . . . . . . . . rr_1ajf 1
. 1 . 564 . 1 1 18 C H42 H 2.601 -12.428 -1.971 . . . 1.0 . . . . . . . . . . . . A . 18 C H42 . . . . . . . . . rr_1ajf 1
. 1 . 565 . 1 1 18 C H5 H 4.823 -13.345 -1.430 . . . 1.0 . . . . . . . . . . . . A . 18 C H5 . . . . . . . . . rr_1ajf 1
. 1 . 566 . 1 1 18 C H5' H 9.870 -13.759 1.514 . . . 1.0 . . . . . . . . . . . . A . 18 C H5' . . . . . . . . . rr_1ajf 1
. 1 . 567 . 1 1 18 C H5'' H 9.583 -15.511 1.566 . . . 1.0 . . . . . . . . . . . . A . 18 C H5'' . . . . . . . . . rr_1ajf 1
. 1 . 568 . 1 1 18 C H6 H 6.427 -13.729 0.360 . . . 1.0 . . . . . . . . . . . . A . 18 C H6 . . . . . . . . . rr_1ajf 1
. 1 . 569 . 1 1 18 C HO2' H 5.823 -13.997 5.367 . . . 1.0 . . . . . . . . . . . . A . 18 C HO2' . . . . . . . . . rr_1ajf 1
. 1 . 570 . 1 1 18 C HO3' H 7.516 -16.369 4.214 . . . 1.0 . . . . . . . . . . . . A . 18 C HO3' . . . . . . . . . rr_1ajf 1
. 1 . 571 . 1 1 18 C N1 N 5.168 -12.906 1.862 . . . 1.0 . . . . . . . . . . . . A . 18 C N1 . . . . . . . . . rr_1ajf 1
. 1 . 572 . 1 1 18 C N3 N 3.062 -12.077 1.181 . . . 1.0 . . . . . . . . . . . . A . 18 C N3 . . . . . . . . . rr_1ajf 1
. 1 . 573 . 1 1 18 C N4 N 2.426 -12.181 -1.008 . . . 1.0 . . . . . . . . . . . . A . 18 C N4 . . . . . . . . . rr_1ajf 1
. 1 . 574 . 1 1 18 C O2 O 3.702 -11.993 3.338 . . . 1.0 . . . . . . . . . . . . A . 18 C O2 . . . . . . . . . rr_1ajf 1
. 1 . 575 . 1 1 18 C O2' O 6.364 -14.636 4.897 . . . 1.0 . . . . . . . . . . . . A . 18 C O2' . . . . . . . . . rr_1ajf 1
. 1 . 576 . 1 1 18 C O3' O 7.384 -16.561 3.282 . . . 1.0 . . . . . . . . . . . . A . 18 C O3' . . . . . . . . . rr_1ajf 1
. 1 . 577 . 1 1 18 C O4' O 7.458 -13.078 2.462 . . . 1.0 . . . . . . . . . . . . A . 18 C O4' . . . . . . . . . rr_1ajf 1
. 1 . 578 . 1 1 18 C O5' O 8.452 -14.468 0.188 . . . 1.0 . . . . . . . . . . . . A . 18 C O5' . . . . . . . . . rr_1ajf 1
. 1 . 579 . 1 1 18 C OP1 O 10.469 -15.219 -1.099 . . . 1.0 . . . . . . . . . . . . A . 18 C OP1 . . . . . . . . . rr_1ajf 1
. 1 . 580 . 1 1 18 C OP2 O 8.364 -14.406 -2.313 . . . 1.0 . . . . . . . . . . . . A . 18 C OP2 . . . . . . . . . rr_1ajf 1
. 1 . 581 . 1 1 18 C P P 9.302 -14.313 -1.173 . . . 1.0 . . . . . . . . . . . . A . 18 C P . . . . . . . . . rr_1ajf 1
. 1 . 582 . 2 2 1 NCO CO Co 1.867 3.304 0.075 . . . 1.0 . . . . . . . . . . . . A . 19 NCO CO . . . . . . . . . rr_1ajf 1
. 1 . 583 . 2 2 1 NCO HN11 H 3.345 3.965 1.999 . . . 1.0 . . . . . . . . . . . . A . 19 NCO HN11 . . . . . . . . . rr_1ajf 1
. 1 . 584 . 2 2 1 NCO HN12 H 2.927 5.302 1.187 . . . 1.0 . . . . . . . . . . . . A . 19 NCO HN12 . . . . . . . . . rr_1ajf 1
. 1 . 585 . 2 2 1 NCO HN13 H 1.871 4.624 2.242 . . . 1.0 . . . . . . . . . . . . A . 19 NCO HN13 . . . . . . . . . rr_1ajf 1
. 1 . 586 . 2 2 1 NCO HN21 H 1.187 1.164 -1.075 . . . 1.0 . . . . . . . . . . . . A . 19 NCO HN21 . . . . . . . . . rr_1ajf 1
. 1 . 587 . 2 2 1 NCO HN22 H 0.227 2.440 -1.576 . . . 1.0 . . . . . . . . . . . . A . 19 NCO HN22 . . . . . . . . . rr_1ajf 1
. 1 . 588 . 2 2 1 NCO HN23 H 1.739 2.286 -2.113 . . . 1.0 . . . . . . . . . . . . A . 19 NCO HN23 . . . . . . . . . rr_1ajf 1
. 1 . 589 . 2 2 1 NCO HN31 H 2.479 0.944 0.703 . . . 1.0 . . . . . . . . . . . . A . 19 NCO HN31 . . . . . . . . . rr_1ajf 1
. 1 . 590 . 2 2 1 NCO HN32 H 2.419 1.835 2.045 . . . 1.0 . . . . . . . . . . . . A . 19 NCO HN32 . . . . . . . . . rr_1ajf 1
. 1 . 591 . 2 2 1 NCO HN33 H 1.026 1.285 1.390 . . . 1.0 . . . . . . . . . . . . A . 19 NCO HN33 . . . . . . . . . rr_1ajf 1
. 1 . 592 . 2 2 1 NCO HN41 H 2.668 5.279 -1.276 . . . 1.0 . . . . . . . . . . . . A . 19 NCO HN41 . . . . . . . . . rr_1ajf 1
. 1 . 593 . 2 2 1 NCO HN42 H 1.105 5.079 -1.608 . . . 1.0 . . . . . . . . . . . . A . 19 NCO HN42 . . . . . . . . . rr_1ajf 1
. 1 . 594 . 2 2 1 NCO HN43 H 1.576 5.852 -0.244 . . . 1.0 . . . . . . . . . . . . A . 19 NCO HN43 . . . . . . . . . rr_1ajf 1
. 1 . 595 . 2 2 1 NCO HN51 H -0.616 2.786 0.259 . . . 1.0 . . . . . . . . . . . . A . 19 NCO HN51 . . . . . . . . . rr_1ajf 1
. 1 . 596 . 2 2 1 NCO HN52 H -0.254 4.128 1.136 . . . 1.0 . . . . . . . . . . . . A . 19 NCO HN52 . . . . . . . . . rr_1ajf 1
. 1 . 597 . 2 2 1 NCO HN53 H -0.384 4.224 -0.491 . . . 1.0 . . . . . . . . . . . . A . 19 NCO HN53 . . . . . . . . . rr_1ajf 1
. 1 . 598 . 2 2 1 NCO HN61 H 4.009 3.004 -1.194 . . . 1.0 . . . . . . . . . . . . A . 19 NCO HN61 . . . . . . . . . rr_1ajf 1
. 1 . 599 . 2 2 1 NCO HN62 H 4.354 3.810 0.155 . . . 1.0 . . . . . . . . . . . . A . 19 NCO HN62 . . . . . . . . . rr_1ajf 1
. 1 . 600 . 2 2 1 NCO HN63 H 4.149 2.188 0.203 . . . 1.0 . . . . . . . . . . . . A . 19 NCO HN63 . . . . . . . . . rr_1ajf 1
. 1 . 601 . 2 2 1 NCO N1 N 2.567 4.426 1.543 . . . 1.0 . . . . . . . . . . . . A . 19 NCO N1 . . . . . . . . . rr_1ajf 1
. 1 . 602 . 2 2 1 NCO N2 N 1.150 2.146 -1.311 . . . 1.0 . . . . . . . . . . . . A . 19 NCO N2 . . . . . . . . . rr_1ajf 1
. 1 . 603 . 2 2 1 NCO N3 N 1.935 1.658 1.175 . . . 1.0 . . . . . . . . . . . . A . 19 NCO N3 . . . . . . . . . rr_1ajf 1
. 1 . 604 . 2 2 1 NCO N4 N 1.772 5.068 -0.851 . . . 1.0 . . . . . . . . . . . . A . 19 NCO N4 . . . . . . . . . rr_1ajf 1
. 1 . 605 . 2 2 1 NCO N5 N -0.078 3.638 0.275 . . . 1.0 . . . . . . . . . . . . A . 19 NCO N5 . . . . . . . . . rr_1ajf 1
. 1 . 606 . 2 2 1 NCO N6 N 3.803 3.044 -0.209 . . . 1.0 . . . . . . . . . . . . A . 19 NCO N6 . . . . . . . . . rr_1ajf 1
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_framecode global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID rr_1ajf
_Constraint_stat_list.ID 1
loop_
_Constraint_file.ID
_Constraint_file.Constraint_filename
_Constraint_file.Software_ID
_Constraint_file.Software_label
_Constraint_file.Software_name
_Constraint_file.Block_ID
_Constraint_file.Constraint_type
_Constraint_file.Constraint_subtype
_Constraint_file.Constraint_subsubtype
_Constraint_file.Constraint_number
_Constraint_file.Entry_ID
_Constraint_file.Constraint_stat_list_ID
1 1ajf.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_1ajf 1
1 1ajf.mr . . XPLOR/CNS 2 distance "hydrogen bond" simple 30 rr_1ajf 1
1 1ajf.mr . . XPLOR/CNS 3 distance NOE simple 171 rr_1ajf 1
1 1ajf.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 rr_1ajf 1
1 1ajf.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 161 rr_1ajf 1
1 1ajf.mr . . n/a 6 comment "Not applicable" "Not applicable" 0 rr_1ajf 1
1 1ajf.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_1ajf 1
stop_
save_
save_constraint_statistics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Sf_framecode constraint_statistics
_Constraint_stat_list.Entry_ID rr_1ajf
_Constraint_stat_list.ID 1
loop_
_Constraint_file.ID
_Constraint_file.Constraint_filename
_Constraint_file.Software_ID
_Constraint_file.Software_label
_Constraint_file.Software_name
_Constraint_file.Block_ID
_Constraint_file.Constraint_type
_Constraint_file.Constraint_subtype
_Constraint_file.Constraint_subsubtype
_Constraint_file.Constraint_number
_Constraint_file.Entry_ID
_Constraint_file.Constraint_stat_list_ID
1 "From CCPN project: '1ajf'" . . . . distance "general distance" . 171 rr_1ajf 1
2 "From CCPN project: '1ajf'" . . . . distance "hydrogen bond" . 30 rr_1ajf 1
3 "From CCPN project: '1ajf'" . . . . "dihedral angle" "Not applicable" . 161 rr_1ajf 1
stop_
loop_
_Constraint_file.ID
_Constraint_file.Constraint_filename
_Constraint_file.Software_ID
_Constraint_file.Software_label
_Constraint_file.Software_name
_Constraint_file.Block_ID
_Constraint_file.Constraint_type
_Constraint_file.Constraint_subtype
_Constraint_file.Constraint_subsubtype
_Constraint_file.Constraint_number
_Constraint_file.Entry_ID
_Constraint_file.Constraint_stat_list_ID
1 1ajf.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_1ajf 1
1 1ajf.mr . . XPLOR/CNS 2 distance "hydrogen bond" simple 30 rr_1ajf 1
1 1ajf.mr . . XPLOR/CNS 3 distance NOE simple 171 rr_1ajf 1
1 1ajf.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 rr_1ajf 1
1 1ajf.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 161 rr_1ajf 1
1 1ajf.mr . . n/a 6 comment "Not applicable" "Not applicable" 0 rr_1ajf 1
1 1ajf.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_1ajf 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_3
_Gen_dist_constraint_list.Entry_ID rr_1ajf
_Gen_dist_constraint_list.ID 2
_Gen_dist_constraint_list.Constraint_type NOE
_Gen_dist_constraint_list.Details "Generated by Wattos"
_Gen_dist_constraint_list.Constraint_file_ID 1
_Gen_dist_constraint_list.Block_ID 3
loop_
_Gen_dist_constraint_software.Software_ID
_Gen_dist_constraint_software.Software_label
_Gen_dist_constraint_software.Method_ID
_Gen_dist_constraint_software.Method_label
_Gen_dist_constraint_software.Entry_ID
_Gen_dist_constraint_software.Gen_dist_constraint_list_ID
. . . . rr_1ajf 1
stop_
loop_
_Gen_dist_constraint.ID
_Gen_dist_constraint.Member_ID
_Gen_dist_constraint.Member_logic_code
_Gen_dist_constraint.Assembly_atom_ID_1
_Gen_dist_constraint.Entity_assembly_ID_1
_Gen_dist_constraint.Entity_ID_1
_Gen_dist_constraint.Comp_index_ID_1
_Gen_dist_constraint.Seq_ID_1
_Gen_dist_constraint.Comp_ID_1
_Gen_dist_constraint.Atom_ID_1
_Gen_dist_constraint.Atom_type_1
_Gen_dist_constraint.Atom_isotope_number_1
_Gen_dist_constraint.Resonance_ID_1
_Gen_dist_constraint.Assembly_atom_ID_2
_Gen_dist_constraint.Entity_assembly_ID_2
_Gen_dist_constraint.Entity_ID_2
_Gen_dist_constraint.Comp_index_ID_2
_Gen_dist_constraint.Seq_ID_2
_Gen_dist_constraint.Comp_ID_2
_Gen_dist_constraint.Atom_ID_2
_Gen_dist_constraint.Atom_type_2
_Gen_dist_constraint.Atom_isotope_number_2
_Gen_dist_constraint.Resonance_ID_2
_Gen_dist_constraint.Intensity_val
_Gen_dist_constraint.Intensity_lower_val_err
_Gen_dist_constraint.Intensity_upper_val_err
_Gen_dist_constraint.Distance_val
_Gen_dist_constraint.Distance_lower_bound_val
_Gen_dist_constraint.Distance_upper_bound_val
_Gen_dist_constraint.Contribution_fractional_val
_Gen_dist_constraint.Spectral_peak_ID
_Gen_dist_constraint.Spectral_peak_list_ID
_Gen_dist_constraint.PDB_record_ID_1
_Gen_dist_constraint.PDB_model_num_1
_Gen_dist_constraint.PDB_strand_ID_1
_Gen_dist_constraint.PDB_ins_code_1
_Gen_dist_constraint.PDB_residue_no_1
_Gen_dist_constraint.PDB_residue_name_1
_Gen_dist_constraint.PDB_atom_name_1
_Gen_dist_constraint.PDB_record_ID_2
_Gen_dist_constraint.PDB_model_num_2
_Gen_dist_constraint.PDB_strand_ID_2
_Gen_dist_constraint.PDB_ins_code_2
_Gen_dist_constraint.PDB_residue_no_2
_Gen_dist_constraint.PDB_residue_name_2
_Gen_dist_constraint.PDB_atom_name_2
_Gen_dist_constraint.Auth_entity_assembly_ID_1
_Gen_dist_constraint.Auth_asym_ID_1
_Gen_dist_constraint.Auth_chain_ID_1
_Gen_dist_constraint.Auth_seq_ID_1
_Gen_dist_constraint.Auth_comp_ID_1
_Gen_dist_constraint.Auth_atom_ID_1
_Gen_dist_constraint.Auth_alt_ID_1
_Gen_dist_constraint.Auth_atom_name_1
_Gen_dist_constraint.Auth_entity_assembly_ID_2
_Gen_dist_constraint.Auth_asym_ID_2
_Gen_dist_constraint.Auth_chain_ID_2
_Gen_dist_constraint.Auth_seq_ID_2
_Gen_dist_constraint.Auth_comp_ID_2
_Gen_dist_constraint.Auth_atom_ID_2
_Gen_dist_constraint.Auth_alt_ID_2
_Gen_dist_constraint.Auth_atom_name_2
_Gen_dist_constraint.Entry_ID
_Gen_dist_constraint.Gen_dist_constraint_list_ID
1 1 . . 1 1 5 5 G H1 H . . . 1 1 6 6 G H1 H . . . . . 3.0 3.0 5.0 . . . . . A . 5 G H1 . . A . 6 G H1 . . . 5 . H1 . . . . . 6 . H1 . . rr_1ajf 1
2 1 . . 1 1 5 5 G H1 H . . . 1 1 13 13 U H3 H . . . . . 3.0 3.0 5.0 . . . . . A . 5 G H1 . . A . 13 U H3 . . . 5 . H1 . . . . . 13 . H3 . . rr_1ajf 1
3 1 . . 1 1 5 5 G H1 H . . . 1 1 14 14 U H3 H . . . . . 3.0 3.0 5.0 . . . . . A . 5 G H1 . . A . 14 U H3 . . . 5 . H1 . . . . . 14 . H3 . . rr_1ajf 1
4 1 . . 1 1 5 5 G H1 H . . . 1 1 15 15 U H3 H . . . . . 3.0 3.0 5.0 . . . . . A . 5 G H1 . . A . 15 U H3 . . . 5 . H1 . . . . . 15 . H3 . . rr_1ajf 1
5 1 . . 1 1 6 6 G H1 H . . . 1 1 13 13 U H3 H . . . . . 3.0 3.0 5.0 . . . . . A . 6 G H1 . . A . 13 U H3 . . . 6 . H1 . . . . . 13 . H3 . . rr_1ajf 1
6 1 . . 1 1 6 6 G H1 H . . . 1 1 14 14 U H3 H . . . . . 3.0 3.0 5.0 . . . . . A . 6 G H1 . . A . 14 U H3 . . . 6 . H1 . . . . . 14 . H3 . . rr_1ajf 1
7 1 . . 1 1 13 13 U H3 H . . . 1 1 7 7 G H1 H . . . . . 3.0 3.0 5.0 . . . . . A . 13 U H3 . . A . 7 G H1 . . . 13 . H3 . . . . . 7 . H1 . . rr_1ajf 1
8 1 . . 1 1 13 13 U H3 H . . . 1 1 14 14 U H3 H . . . . . 3.0 3.0 5.0 . . . . . A . 13 U H3 . . A . 14 U H3 . . . 13 . H3 . . . . . 14 . H3 . . rr_1ajf 1
9 1 . . 1 1 14 14 U H3 H . . . 1 1 15 15 U H3 H . . . . . 3.0 3.0 5.0 . . . . . A . 14 U H3 . . A . 15 U H3 . . . 14 . H3 . . . . . 15 . H3 . . rr_1ajf 1
10 1 . . 1 1 16 16 G H1 H . . . 1 1 17 17 U H3 H . . . . . 3.0 3.0 5.0 . . . . . A . 16 G H1 . . A . 17 U H3 . . . 16 . H1 . . . . . 17 . H3 . . rr_1ajf 1
11 1 . . 1 1 17 17 U H3 H . . . 1 1 2 2 A H2 H . . . . . 1.8 1.8 5.0 . . . . . A . 17 U H3 . . A . 2 A H2 . . . 17 . H3 . . . . . 2 . H2 . . rr_1ajf 1
12 1 . . 1 1 7 7 G H1 H . . . 1 1 12 12 C H41 H . . . . . 1.8 1.8 5.0 . . . . . A . 7 G H1 . . A . 12 C H41 . . . 7 . H1 . . . . . 12 . H41 . . rr_1ajf 1
13 1 . . 1 1 16 16 G H1 H . . . 1 1 3 3 C H41 H . . . . . 1.8 1.8 5.0 . . . . . A . 16 G H1 . . A . 3 C H41 . . . 16 . H1 . . . . . 3 . H41 . . rr_1ajf 1
14 1 . . 1 1 16 16 G H1 H . . . 1 1 2 2 A H2 H . . . . . 1.8 1.8 5.0 . . . . . A . 16 G H1 . . A . 2 A H2 . . . 16 . H1 . . . . . 2 . H2 . . rr_1ajf 1
15 1 . . 1 1 14 14 U H3 H . . . 1 1 5 5 G H21 H . . . . . 1.8 1.8 5.0 . . . . . A . 14 U H3 . . A . 5 G H21 . . . 14 . H3 . . . . . 5 . H21 . . rr_1ajf 1
16 1 . . 1 1 13 13 U H3 H . . . 1 1 6 6 G H21 H . . . . . 1.8 1.8 5.0 . . . . . A . 13 U H3 . . A . 6 G H21 . . . 13 . H3 . . . . . 6 . H21 . . rr_1ajf 1
17 1 . . 1 1 12 12 C H41 H . . . 1 1 8 8 G H1 H . . . . . 1.8 1.8 5.0 . . . . . A . 12 C H41 . . A . 8 G H1 . . . 12 . H41 . . . . . 8 . H1 . . rr_1ajf 1
18 1 . . 1 1 6 6 G H1 H . . . 1 1 6 6 G H21 H . . . . . 1.8 1.8 5.0 . . . . . A . 6 G H1 . . A . 6 G H21 . . . 6 . H1 . . . . . 6 . H21 . . rr_1ajf 1
19 1 . . 1 1 5 5 G H1 H . . . 1 1 5 5 G H21 H . . . . . 1.8 1.8 5.0 . . . . . A . 5 G H1 . . A . 5 G H21 . . . 5 . H1 . . . . . 5 . H21 . . rr_1ajf 1
20 1 . . 1 1 1 1 G H8 H . . . 1 1 1 1 G H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 1 G H8 . . A . 1 G H1' . . . 1 . H8 . . . . . 1 . H1' . . rr_1ajf 1
21 1 . . 1 1 1 1 G H8 H . . . 1 1 1 1 G HO2' H . . . . . 2.5 2.5 5.0 . . . . . A . 1 G H8 . . A . 1 G HO2' . . . 1 . H8 . . . . . 1 . H2'' . . rr_1ajf 1
22 1 . . 1 1 1 1 G H1' H . . . 1 1 1 1 G HO2' H . . . . . 2.5 2.5 5.0 . . . . . A . 1 G H1' . . A . 1 G HO2' . . . 1 . H1' . . . . . 1 . H2'' . . rr_1ajf 1
23 1 . . 1 1 2 2 A H8 H . . . 1 1 2 2 A H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 2 A H8 . . A . 2 A H1' . . . 2 . H8 . . . . . 2 . H1' . . rr_1ajf 1
24 1 . . 1 1 2 2 A H8 H . . . 1 1 2 2 A HO2' H . . . . . 2.5 2.5 5.0 . . . . . A . 2 A H8 . . A . 2 A HO2' . . . 2 . H8 . . . . . 2 . H2'' . . rr_1ajf 1
25 1 . . 1 1 2 2 A H8 H . . . 1 1 2 2 A H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 2 A H8 . . A . 2 A H3' . . . 2 . H8 . . . . . 2 . H3' . . rr_1ajf 1
26 1 . . 1 1 1 1 G H1' H . . . 1 1 2 2 A H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 1 G H1' . . A . 2 A H8 . . . 1 . H1' . . . . . 2 . H8 . . rr_1ajf 1
27 1 . . 1 1 1 1 G HO2' H . . . 1 1 2 2 A H8 H . . . . . 2.0 2.0 4.0 . . . . . A . 1 G HO2' . . A . 2 A H8 . . . 1 . H2'' . . . . . 2 . H8 . . rr_1ajf 1
28 1 . . 1 1 2 2 A H2 H . . . 1 1 3 3 C H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 2 A H2 . . A . 3 C H1' . . . 2 . H2 . . . . . 3 . H1' . . rr_1ajf 1
29 1 . . 1 1 2 2 A H2 H . . . 1 1 18 18 C H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 2 A H2 . . A . 18 C H1' . . . 2 . H2 . . . . . 18 . H1' . . rr_1ajf 1
30 1 . . 1 1 2 2 A H1' H . . . 1 1 2 2 A HO2' H . . . . . 1.8 1.8 3.0 . . . . . A . 2 A H1' . . A . 2 A HO2' . . . 2 . H1' . . . . . 2 . H2'' . . rr_1ajf 1
31 1 . . 1 1 2 2 A H1' H . . . 1 1 2 2 A H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 2 A H1' . . A . 2 A H3' . . . 2 . H1' . . . . . 2 . H3' . . rr_1ajf 1
32 1 . . 1 1 2 2 A HO2' H . . . 1 1 3 3 C H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 2 A HO2' . . A . 3 C H5 . . . 2 . H2'' . . . . . 3 . H5 . . rr_1ajf 1
33 1 . . 1 1 3 3 C H1' H . . . 1 1 3 3 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 3 C H1' . . A . 3 C H6 . . . 3 . H1' . . . . . 3 . H6 . . rr_1ajf 1
34 1 . . 1 1 3 3 C H6 H . . . 1 1 3 3 C HO2' H . . . . . 2.5 2.5 5.0 . . . . . A . 3 C H6 . . A . 3 C HO2' . . . 3 . H6 . . . . . 3 . H2'' . . rr_1ajf 1
35 1 . . 1 1 3 3 C H6 H . . . 1 1 3 3 C H3' H . . . . . 1.8 1.8 3.0 . . . . . A . 3 C H6 . . A . 3 C H3' . . . 3 . H6 . . . . . 3 . H3' . . rr_1ajf 1
36 1 . . 1 1 2 2 A H1' H . . . 1 1 3 3 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 2 A H1' . . A . 3 C H6 . . . 2 . H1' . . . . . 3 . H6 . . rr_1ajf 1
37 1 . . 1 1 2 2 A HO2' H . . . 1 1 3 3 C H6 H . . . . . 1.8 1.8 3.0 . . . . . A . 2 A HO2' . . A . 3 C H6 . . . 2 . H2'' . . . . . 3 . H6 . . rr_1ajf 1
38 1 . . 1 1 2 2 A H3' H . . . 1 1 3 3 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 2 A H3' . . A . 3 C H6 . . . 2 . H3' . . . . . 3 . H6 . . rr_1ajf 1
39 1 . . 1 1 3 3 C H1' H . . . 1 1 3 3 C HO2' H . . . . . 1.8 1.8 3.0 . . . . . A . 3 C H1' . . A . 3 C HO2' . . . 3 . H1' . . . . . 3 . H2'' . . rr_1ajf 1
40 1 . . 1 1 4 4 A H8 H . . . 1 1 4 4 A H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 4 A H8 . . A . 4 A H1' . . . 4 . H8 . . . . . 4 . H1' . . rr_1ajf 1
41 1 . . 1 1 4 4 A H8 H . . . 1 1 4 4 A HO2' H . . . . . 2.5 2.5 5.0 . . . . . A . 4 A H8 . . A . 4 A HO2' . . . 4 . H8 . . . . . 4 . H2'' . . rr_1ajf 1
42 1 . . 1 1 4 4 A H8 H . . . 1 1 4 4 A H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 4 A H8 . . A . 4 A H3' . . . 4 . H8 . . . . . 4 . H3' . . rr_1ajf 1
43 1 . . 1 1 3 3 C HO2' H . . . 1 1 4 4 A H8 H . . . . . 1.8 1.8 3.0 . . . . . A . 3 C HO2' . . A . 4 A H8 . . . 3 . H2'' . . . . . 4 . H8 . . rr_1ajf 1
44 1 . . 1 1 3 3 C H1' H . . . 1 1 4 4 A H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 3 C H1' . . A . 4 A H8 . . . 3 . H1' . . . . . 4 . H8 . . rr_1ajf 1
45 1 . . 1 1 4 4 A H8 H . . . 1 1 5 5 G H8 H . . . . . 3.0 3.0 7.0 . . . . . A . 4 A H8 . . A . 5 G H8 . . . 4 . H8 . . . . . 5 . H8 . . rr_1ajf 1
46 1 . . 1 1 4 4 A H2 H . . . 1 1 5 5 G H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 4 A H2 . . A . 5 G H1' . . . 4 . H2 . . . . . 5 . H1' . . rr_1ajf 1
47 1 . . 1 1 4 4 A H2 H . . . 1 1 16 16 G H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 4 A H2 . . A . 16 G H1' . . . 4 . H2 . . . . . 16 . H1' . . rr_1ajf 1
48 1 . . 1 1 4 4 A H1' H . . . 1 1 4 4 A HO2' H . . . . . 1.8 1.8 3.0 . . . . . A . 4 A H1' . . A . 4 A HO2' . . . 4 . H1' . . . . . 4 . H2'' . . rr_1ajf 1
49 1 . . 1 1 4 4 A H1' H . . . 1 1 4 4 A H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 4 A H1' . . A . 4 A H3' . . . 4 . H1' . . . . . 4 . H3' . . rr_1ajf 1
50 1 . . 1 1 5 5 G H8 H . . . 1 1 5 5 G H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 5 G H8 . . A . 5 G H1' . . . 5 . H8 . . . . . 5 . H1' . . rr_1ajf 1
51 1 . . 1 1 5 5 G H8 H . . . 1 1 5 5 G HO2' H . . . . . 2.0 2.0 4.0 . . . . . A . 5 G H8 . . A . 5 G HO2' . . . 5 . H8 . . . . . 5 . H2'' . . rr_1ajf 1
52 1 . . 1 1 5 5 G H8 H . . . 1 1 5 5 G H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 5 G H8 . . A . 5 G H3' . . . 5 . H8 . . . . . 5 . H3' . . rr_1ajf 1
53 1 . . 1 1 4 4 A H1' H . . . 1 1 5 5 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 4 A H1' . . A . 5 G H8 . . . 4 . H1' . . . . . 5 . H8 . . rr_1ajf 1
54 1 . . 1 1 4 4 A HO2' H . . . 1 1 5 5 G H8 H . . . . . 1.8 1.8 3.0 . . . . . A . 4 A HO2' . . A . 5 G H8 . . . 4 . H2'' . . . . . 5 . H8 . . rr_1ajf 1
55 1 . . 1 1 5 5 G H8 H . . . 1 1 6 6 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 5 G H8 . . A . 6 G H8 . . . 5 . H8 . . . . . 6 . H8 . . rr_1ajf 1
56 1 . . 1 1 5 5 G H1' H . . . 1 1 5 5 G HO2' H . . . . . 1.8 1.8 3.0 . . . . . A . 5 G H1' . . A . 5 G HO2' . . . 5 . H1' . . . . . 5 . H2'' . . rr_1ajf 1
57 1 . . 1 1 5 5 G H1' H . . . 1 1 6 6 G H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 5 G H1' . . A . 6 G H1' . . . 5 . H1' . . . . . 6 . H1' . . rr_1ajf 1
58 1 . . 1 1 6 6 G H8 H . . . 1 1 6 6 G H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 6 G H8 . . A . 6 G H1' . . . 6 . H8 . . . . . 6 . H1' . . rr_1ajf 1
59 1 . . 1 1 6 6 G H8 H . . . 1 1 6 6 G HO2' H . . . . . 2.5 2.5 5.0 . . . . . A . 6 G H8 . . A . 6 G HO2' . . . 6 . H8 . . . . . 6 . H2'' . . rr_1ajf 1
60 1 . . 1 1 6 6 G H8 H . . . 1 1 6 6 G H3' H . . . . . 2.0 2.0 4.0 . . . . . A . 6 G H8 . . A . 6 G H3' . . . 6 . H8 . . . . . 6 . H3' . . rr_1ajf 1
61 1 . . 1 1 5 5 G H1' H . . . 1 1 6 6 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 5 G H1' . . A . 6 G H8 . . . 5 . H1' . . . . . 6 . H8 . . rr_1ajf 1
62 1 . . 1 1 5 5 G HO2' H . . . 1 1 6 6 G H8 H . . . . . 1.8 1.8 3.0 . . . . . A . 5 G HO2' . . A . 6 G H8 . . . 5 . H2'' . . . . . 6 . H8 . . rr_1ajf 1
63 1 . . 1 1 5 5 G H3' H . . . 1 1 6 6 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 5 G H3' . . A . 6 G H8 . . . 5 . H3' . . . . . 6 . H8 . . rr_1ajf 1
64 1 . . 1 1 6 6 G H1' H . . . 1 1 6 6 G HO2' H . . . . . 1.8 1.8 3.0 . . . . . A . 6 G H1' . . A . 6 G HO2' . . . 6 . H1' . . . . . 6 . H2'' . . rr_1ajf 1
65 1 . . 1 1 6 6 G H1' H . . . 1 1 6 6 G H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 6 G H1' . . A . 6 G H3' . . . 6 . H1' . . . . . 6 . H3' . . rr_1ajf 1
66 1 . . 1 1 7 7 G H8 H . . . 1 1 7 7 G H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 7 G H8 . . A . 7 G H1' . . . 7 . H8 . . . . . 7 . H1' . . rr_1ajf 1
67 1 . . 1 1 7 7 G H8 H . . . 1 1 7 7 G HO2' H . . . . . 2.5 2.5 5.0 . . . . . A . 7 G H8 . . A . 7 G HO2' . . . 7 . H8 . . . . . 7 . H2'' . . rr_1ajf 1
68 1 . . 1 1 7 7 G H8 H . . . 1 1 7 7 G H3' H . . . . . 2.0 2.0 4.0 . . . . . A . 7 G H8 . . A . 7 G H3' . . . 7 . H8 . . . . . 7 . H3' . . rr_1ajf 1
69 1 . . 1 1 6 6 G H1' H . . . 1 1 7 7 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 6 G H1' . . A . 7 G H8 . . . 6 . H1' . . . . . 7 . H8 . . rr_1ajf 1
70 1 . . 1 1 6 6 G HO2' H . . . 1 1 7 7 G H8 H . . . . . 1.8 1.8 3.0 . . . . . A . 6 G HO2' . . A . 7 G H8 . . . 6 . H2'' . . . . . 7 . H8 . . rr_1ajf 1
71 1 . . 1 1 6 6 G H3' H . . . 1 1 7 7 G H8 H . . . . . 2.0 2.0 4.0 . . . . . A . 6 G H3' . . A . 7 G H8 . . . 6 . H3' . . . . . 7 . H8 . . rr_1ajf 1
72 1 . . 1 1 7 7 G H1' H . . . 1 1 7 7 G HO2' H . . . . . 1.8 1.8 3.0 . . . . . A . 7 G H1' . . A . 7 G HO2' . . . 7 . H1' . . . . . 7 . H2'' . . rr_1ajf 1
73 1 . . 1 1 7 7 G H1' H . . . 1 1 7 7 G H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 7 G H1' . . A . 7 G H3' . . . 7 . H1' . . . . . 7 . H3' . . rr_1ajf 1
74 1 . . 1 1 7 7 G H8 H . . . 1 1 8 8 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 7 G H8 . . A . 8 G H8 . . . 7 . H8 . . . . . 8 . H8 . . rr_1ajf 1
75 1 . . 1 1 8 8 G H8 H . . . 1 1 8 8 G H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 8 G H8 . . A . 8 G H1' . . . 8 . H8 . . . . . 8 . H1' . . rr_1ajf 1
76 1 . . 1 1 8 8 G H8 H . . . 1 1 8 8 G HO2' H . . . . . 2.5 2.5 5.0 . . . . . A . 8 G H8 . . A . 8 G HO2' . . . 8 . H8 . . . . . 8 . H2'' . . rr_1ajf 1
77 1 . . 1 1 8 8 G H8 H . . . 1 1 8 8 G H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 8 G H8 . . A . 8 G H3' . . . 8 . H8 . . . . . 8 . H3' . . rr_1ajf 1
78 1 . . 1 1 7 7 G H1' H . . . 1 1 8 8 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 7 G H1' . . A . 8 G H8 . . . 7 . H1' . . . . . 8 . H8 . . rr_1ajf 1
79 1 . . 1 1 7 7 G HO2' H . . . 1 1 8 8 G H8 H . . . . . 1.8 1.8 3.0 . . . . . A . 7 G HO2' . . A . 8 G H8 . . . 7 . H2'' . . . . . 8 . H8 . . rr_1ajf 1
80 1 . . 1 1 7 7 G H3' H . . . 1 1 8 8 G H8 H . . . . . 2.0 2.0 4.0 . . . . . A . 7 G H3' . . A . 8 G H8 . . . 7 . H3' . . . . . 8 . H8 . . rr_1ajf 1
81 1 . . 1 1 8 8 G H1' H . . . 1 1 8 8 G HO2' H . . . . . 1.8 1.8 3.0 . . . . . A . 8 G H1' . . A . 8 G HO2' . . . 8 . H1' . . . . . 8 . H2'' . . rr_1ajf 1
82 1 . . 1 1 8 8 G H1' H . . . 1 1 8 8 G H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 8 G H1' . . A . 8 G H3' . . . 8 . H1' . . . . . 8 . H3' . . rr_1ajf 1
83 1 . . 1 1 8 8 G HO2' H . . . 1 1 10 10 A H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 8 G HO2' . . A . 10 A H8 . . . 8 . H2'' . . . . . 10 . H8 . . rr_1ajf 1
84 1 . . 1 1 8 8 G HO2' H . . . 1 1 9 9 A H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 8 G HO2' . . A . 9 A H8 . . . 8 . H2'' . . . . . 9 . H8 . . rr_1ajf 1
85 1 . . 1 1 9 9 A H8 H . . . 1 1 9 9 A H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 9 A H8 . . A . 9 A H1' . . . 9 . H8 . . . . . 9 . H1' . . rr_1ajf 1
86 1 . . 1 1 9 9 A H1' H . . . 1 1 9 9 A H3' H . . . . . 2.0 2.0 4.0 . . . . . A . 9 A H1' . . A . 9 A H3' . . . 9 . H1' . . . . . 9 . H3' . . rr_1ajf 1
87 1 . . 1 1 10 10 A H8 H . . . 1 1 9 9 A H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 10 A H8 . . A . 9 A H8 . . . 10 . H8 . . . . . 9 . H8 . . rr_1ajf 1
88 1 . . 1 1 9 9 A H2 H . . . 1 1 10 10 A H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 9 A H2 . . A . 10 A H1' . . . 9 . H2 . . . . . 10 . H1' . . rr_1ajf 1
89 1 . . 1 1 9 9 A H1' H . . . 1 1 9 9 A H2 H . . . . . 2.0 2.0 4.0 . . . . . A . 9 A H1' . . A . 9 A H2 . . . 9 . H1' . . . . . 9 . H2 . . rr_1ajf 1
90 1 . . 1 1 10 10 A H8 H . . . 1 1 10 10 A H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 10 A H8 . . A . 10 A H1' . . . 10 . H8 . . . . . 10 . H1' . . rr_1ajf 1
91 1 . . 1 1 10 10 A H8 H . . . 1 1 10 10 A H3' H . . . . . 2.0 2.0 4.0 . . . . . A . 10 A H8 . . A . 10 A H3' . . . 10 . H8 . . . . . 10 . H3' . . rr_1ajf 1
92 1 . . 1 1 10 10 A H8 H . . . 1 1 10 10 A HO2' H . . . . . 2.5 2.5 5.0 . . . . . A . 10 A H8 . . A . 10 A HO2' . . . 10 . H8 . . . . . 10 . H2'' . . rr_1ajf 1
93 1 . . 1 1 10 10 A H8 H . . . 1 1 9 9 A H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 10 A H8 . . A . 9 A H1' . . . 10 . H8 . . . . . 9 . H1' . . rr_1ajf 1
94 1 . . 1 1 10 10 A H8 H . . . 1 1 11 11 A H8 H . . . . . 3.0 3.0 7.0 . . . . . A . 10 A H8 . . A . 11 A H8 . . . 10 . H8 . . . . . 11 . H8 . . rr_1ajf 1
95 1 . . 1 1 10 10 A H1' H . . . 1 1 10 10 A H2 H . . . . . 3.0 3.0 7.0 . . . . . A . 10 A H1' . . A . 10 A H2 . . . 10 . H1' . . . . . 10 . H2 . . rr_1ajf 1
96 1 . . 1 1 10 10 A H2 H . . . 1 1 11 11 A H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 10 A H2 . . A . 11 A H1' . . . 10 . H2 . . . . . 11 . H1' . . rr_1ajf 1
97 1 . . 1 1 10 10 A H2 H . . . 1 1 11 11 A H2 H . . . . . 3.0 3.0 7.0 . . . . . A . 10 A H2 . . A . 11 A H2 . . . 10 . H2 . . . . . 11 . H2 . . rr_1ajf 1
98 1 . . 1 1 10 10 A H1' H . . . 1 1 10 10 A HO2' H . . . . . 1.8 1.8 3.0 . . . . . A . 10 A H1' . . A . 10 A HO2' . . . 10 . H1' . . . . . 10 . H2'' . . rr_1ajf 1
99 1 . . 1 1 10 10 A H1' H . . . 1 1 10 10 A H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 10 A H1' . . A . 10 A H3' . . . 10 . H1' . . . . . 10 . H3' . . rr_1ajf 1
100 1 . . 1 1 11 11 A H8 H . . . 1 1 11 11 A H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 11 A H8 . . A . 11 A H1' . . . 11 . H8 . . . . . 11 . H1' . . rr_1ajf 1
101 1 . . 1 1 11 11 A H8 H . . . 1 1 11 11 A HO2' H . . . . . 2.5 2.5 5.0 . . . . . A . 11 A H8 . . A . 11 A HO2' . . . 11 . H8 . . . . . 11 . H2'' . . rr_1ajf 1
102 1 . . 1 1 11 11 A H8 H . . . 1 1 11 11 A H3' H . . . . . 1.8 1.8 3.0 . . . . . A . 11 A H8 . . A . 11 A H3' . . . 11 . H8 . . . . . 11 . H3' . . rr_1ajf 1
103 1 . . 1 1 10 10 A H1' H . . . 1 1 11 11 A H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 10 A H1' . . A . 11 A H8 . . . 10 . H1' . . . . . 11 . H8 . . rr_1ajf 1
104 1 . . 1 1 10 10 A HO2' H . . . 1 1 11 11 A H8 H . . . . . 1.8 1.8 3.0 . . . . . A . 10 A HO2' . . A . 11 A H8 . . . 10 . H2'' . . . . . 11 . H8 . . rr_1ajf 1
105 1 . . 1 1 10 10 A H3' H . . . 1 1 11 11 A H8 H . . . . . 1.8 1.8 3.0 . . . . . A . 10 A H3' . . A . 11 A H8 . . . 10 . H3' . . . . . 11 . H8 . . rr_1ajf 1
106 1 . . 1 1 11 11 A H8 H . . . 1 1 12 12 C H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 11 A H8 . . A . 12 C H5 . . . 11 . H8 . . . . . 12 . H5 . . rr_1ajf 1
107 1 . . 1 1 11 11 A H8 H . . . 1 1 12 12 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 11 A H8 . . A . 12 C H6 . . . 11 . H8 . . . . . 12 . H6 . . rr_1ajf 1
108 1 . . 1 1 11 11 A H1' H . . . 1 1 11 11 A HO2' H . . . . . 1.8 1.8 3.0 . . . . . A . 11 A H1' . . A . 11 A HO2' . . . 11 . H1' . . . . . 11 . H2'' . . rr_1ajf 1
109 1 . . 1 1 11 11 A H1' H . . . 1 1 11 11 A H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 11 A H1' . . A . 11 A H3' . . . 11 . H1' . . . . . 11 . H3' . . rr_1ajf 1
110 1 . . 1 1 11 11 A H1' H . . . 1 1 11 11 A H2 H . . . . . 2.5 2.5 5.0 . . . . . A . 11 A H1' . . A . 11 A H2 . . . 11 . H1' . . . . . 11 . H2 . . rr_1ajf 1
111 1 . . 1 1 12 12 C H6 H . . . 1 1 12 12 C H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 12 C H6 . . A . 12 C H1' . . . 12 . H6 . . . . . 12 . H1' . . rr_1ajf 1
112 1 . . 1 1 12 12 C H6 H . . . 1 1 12 12 C HO2' H . . . . . 2.5 2.5 5.0 . . . . . A . 12 C H6 . . A . 12 C HO2' . . . 12 . H6 . . . . . 12 . H2'' . . rr_1ajf 1
113 1 . . 1 1 12 12 C H6 H . . . 1 1 12 12 C H3' H . . . . . 2.0 2.0 4.0 . . . . . A . 12 C H6 . . A . 12 C H3' . . . 12 . H6 . . . . . 12 . H3' . . rr_1ajf 1
114 1 . . 1 1 11 11 A HO2' H . . . 1 1 12 12 C H6 H . . . . . 2.0 2.0 4.0 . . . . . A . 11 A HO2' . . A . 12 C H6 . . . 11 . H2'' . . . . . 12 . H6 . . rr_1ajf 1
115 1 . . 1 1 11 11 A H3' H . . . 1 1 12 12 C H6 H . . . . . 2.0 2.0 4.0 . . . . . A . 11 A H3' . . A . 12 C H6 . . . 11 . H3' . . . . . 12 . H6 . . rr_1ajf 1
116 1 . . 1 1 12 12 C H6 H . . . 1 1 13 13 U H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 12 C H6 . . A . 13 U H5 . . . 12 . H6 . . . . . 13 . H5 . . rr_1ajf 1
117 1 . . 1 1 12 12 C H1' H . . . 1 1 13 13 U H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 12 C H1' . . A . 13 U H5 . . . 12 . H1' . . . . . 13 . H5 . . rr_1ajf 1
118 1 . . 1 1 13 13 U H6 H . . . 1 1 13 13 U H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 13 U H6 . . A . 13 U H1' . . . 13 . H6 . . . . . 13 . H1' . . rr_1ajf 1
119 1 . . 1 1 13 13 U H6 H . . . 1 1 13 13 U HO2' H . . . . . 2.5 2.5 5.0 . . . . . A . 13 U H6 . . A . 13 U HO2' . . . 13 . H6 . . . . . 13 . H2'' . . rr_1ajf 1
120 1 . . 1 1 13 13 U H6 H . . . 1 1 13 13 U H3' H . . . . . 2.0 2.0 4.0 . . . . . A . 13 U H6 . . A . 13 U H3' . . . 13 . H6 . . . . . 13 . H3' . . rr_1ajf 1
121 1 . . 1 1 12 12 C H1' H . . . 1 1 13 13 U H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 12 C H1' . . A . 13 U H6 . . . 12 . H1' . . . . . 13 . H6 . . rr_1ajf 1
122 1 . . 1 1 12 12 C HO2' H . . . 1 1 13 13 U H6 H . . . . . 1.8 1.8 3.0 . . . . . A . 12 C HO2' . . A . 13 U H6 . . . 12 . H2'' . . . . . 13 . H6 . . rr_1ajf 1
123 1 . . 1 1 13 13 U H6 H . . . 1 1 14 14 U H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 13 U H6 . . A . 14 U H5 . . . 13 . H6 . . . . . 14 . H5 . . rr_1ajf 1
124 1 . . 1 1 13 13 U H1' H . . . 1 1 13 13 U HO2' H . . . . . 1.8 1.8 3.0 . . . . . A . 13 U H1' . . A . 13 U HO2' . . . 13 . H1' . . . . . 13 . H2'' . . rr_1ajf 1
125 1 . . 1 1 13 13 U H1' H . . . 1 1 13 13 U H4' H . . . . . 2.0 2.0 4.0 . . . . . A . 13 U H1' . . A . 13 U H4' . . . 13 . H1' . . . . . 13 . H4' . . rr_1ajf 1
126 1 . . 1 1 13 13 U HO2' H . . . 1 1 14 14 U H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 13 U HO2' . . A . 14 U H5 . . . 13 . H2'' . . . . . 14 . H5 . . rr_1ajf 1
127 1 . . 1 1 14 14 U H6 H . . . 1 1 14 14 U H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 14 U H6 . . A . 14 U H1' . . . 14 . H6 . . . . . 14 . H1' . . rr_1ajf 1
128 1 . . 1 1 14 14 U H6 H . . . 1 1 14 14 U HO2' H . . . . . 2.5 2.5 5.0 . . . . . A . 14 U H6 . . A . 14 U HO2' . . . 14 . H6 . . . . . 14 . H2'' . . rr_1ajf 1
129 1 . . 1 1 14 14 U H6 H . . . 1 1 14 14 U H3' H . . . . . 1.8 1.8 3.0 . . . . . A . 14 U H6 . . A . 14 U H3' . . . 14 . H6 . . . . . 14 . H3' . . rr_1ajf 1
130 1 . . 1 1 13 13 U H1' H . . . 1 1 14 14 U H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 13 U H1' . . A . 14 U H6 . . . 13 . H1' . . . . . 14 . H6 . . rr_1ajf 1
131 1 . . 1 1 13 13 U HO2' H . . . 1 1 14 14 U H6 H . . . . . 1.8 1.8 3.0 . . . . . A . 13 U HO2' . . A . 14 U H6 . . . 13 . H2'' . . . . . 14 . H6 . . rr_1ajf 1
132 1 . . 1 1 13 13 U H3' H . . . 1 1 14 14 U H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 13 U H3' . . A . 14 U H6 . . . 13 . H3' . . . . . 14 . H6 . . rr_1ajf 1
133 1 . . 1 1 14 14 U H1' H . . . 1 1 14 14 U HO2' H . . . . . 1.8 1.8 3.0 . . . . . A . 14 U H1' . . A . 14 U HO2' . . . 14 . H1' . . . . . 14 . H2'' . . rr_1ajf 1
134 1 . . 1 1 14 14 U H1' H . . . 1 1 14 14 U H3' H . . . . . 2.0 2.0 4.0 . . . . . A . 14 U H1' . . A . 14 U H3' . . . 14 . H1' . . . . . 14 . H3' . . rr_1ajf 1
135 1 . . 1 1 14 14 U H1' H . . . 1 1 14 14 U H4' H . . . . . 2.0 2.0 4.0 . . . . . A . 14 U H1' . . A . 14 U H4' . . . 14 . H1' . . . . . 14 . H4' . . rr_1ajf 1
136 1 . . 1 1 14 14 U H5 H . . . 1 1 14 14 U HO2' H . . . . . 2.5 2.5 5.0 . . . . . A . 14 U H5 . . A . 14 U HO2' . . . 14 . H5 . . . . . 14 . H2'' . . rr_1ajf 1
137 1 . . 1 1 15 15 U H6 H . . . 1 1 15 15 U H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 15 U H6 . . A . 15 U H1' . . . 15 . H6 . . . . . 15 . H1' . . rr_1ajf 1
138 1 . . 1 1 15 15 U H6 H . . . 1 1 15 15 U HO2' H . . . . . 2.0 2.0 4.0 . . . . . A . 15 U H6 . . A . 15 U HO2' . . . 15 . H6 . . . . . 15 . H2'' . . rr_1ajf 1
139 1 . . 1 1 15 15 U H6 H . . . 1 1 15 15 U H3' H . . . . . 1.8 1.8 3.0 . . . . . A . 15 U H6 . . A . 15 U H3' . . . 15 . H6 . . . . . 15 . H3' . . rr_1ajf 1
140 1 . . 1 1 14 14 U H1' H . . . 1 1 15 15 U H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 14 U H1' . . A . 15 U H6 . . . 14 . H1' . . . . . 15 . H6 . . rr_1ajf 1
141 1 . . 1 1 14 14 U HO2' H . . . 1 1 15 15 U H6 H . . . . . 1.8 1.8 3.0 . . . . . A . 14 U HO2' . . A . 15 U H6 . . . 14 . H2'' . . . . . 15 . H6 . . rr_1ajf 1
142 1 . . 1 1 15 15 U H6 H . . . 1 1 16 16 G H8 H . . . . . 3.0 3.0 7.0 . . . . . A . 15 U H6 . . A . 16 G H8 . . . 15 . H6 . . . . . 16 . H8 . . rr_1ajf 1
143 1 . . 1 1 15 15 U H1' H . . . 1 1 15 15 U HO2' H . . . . . 1.8 1.8 3.0 . . . . . A . 15 U H1' . . A . 15 U HO2' . . . 15 . H1' . . . . . 15 . H2'' . . rr_1ajf 1
144 1 . . 1 1 15 15 U H1' H . . . 1 1 15 15 U H3' H . . . . . 2.0 2.0 4.0 . . . . . A . 15 U H1' . . A . 15 U H3' . . . 15 . H1' . . . . . 15 . H3' . . rr_1ajf 1
145 1 . . 1 1 15 15 U H1' H . . . 1 1 15 15 U H4' H . . . . . 2.5 2.5 5.0 . . . . . A . 15 U H1' . . A . 15 U H4' . . . 15 . H1' . . . . . 15 . H4' . . rr_1ajf 1
146 1 . . 1 1 16 16 G H1' H . . . 1 1 16 16 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 16 G H1' . . A . 16 G H8 . . . 16 . H1' . . . . . 16 . H8 . . rr_1ajf 1
147 1 . . 1 1 16 16 G H8 H . . . 1 1 16 16 G HO2' H . . . . . 2.5 2.5 5.0 . . . . . A . 16 G H8 . . A . 16 G HO2' . . . 16 . H8 . . . . . 16 . H2'' . . rr_1ajf 1
148 1 . . 1 1 16 16 G H1' H . . . 1 1 16 16 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 16 G H1' . . A . 16 G H8 . . . 16 . H1' . . . . . 16 . H8 . . rr_1ajf 1
149 1 . . 1 1 15 15 U HO2' H . . . 1 1 16 16 G H8 H . . . . . 1.8 1.8 3.0 . . . . . A . 15 U HO2' . . A . 16 G H8 . . . 15 . H2'' . . . . . 16 . H8 . . rr_1ajf 1
150 1 . . 1 1 15 15 U H3' H . . . 1 1 16 16 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 15 U H3' . . A . 16 G H8 . . . 15 . H3' . . . . . 16 . H8 . . rr_1ajf 1
151 1 . . 1 1 16 16 G H1' H . . . 1 1 16 16 G HO2' H . . . . . 1.8 1.8 3.0 . . . . . A . 16 G H1' . . A . 16 G HO2' . . . 16 . H1' . . . . . 16 . H2'' . . rr_1ajf 1
152 1 . . 1 1 16 16 G H1' H . . . 1 1 16 16 G H3' H . . . . . 2.0 2.0 4.0 . . . . . A . 16 G H1' . . A . 16 G H3' . . . 16 . H1' . . . . . 16 . H3' . . rr_1ajf 1
153 1 . . 1 1 16 16 G H1' H . . . 1 1 15 15 U HO2' H . . . . . 2.5 2.5 5.0 . . . . . A . 16 G H1' . . A . 15 U HO2' . . . 16 . H1' . . . . . 15 . H2'' . . rr_1ajf 1
154 1 . . 1 1 17 17 U H6 H . . . 1 1 17 17 U H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 17 U H6 . . A . 17 U H1' . . . 17 . H6 . . . . . 17 . H1' . . rr_1ajf 1
155 1 . . 1 1 17 17 U H6 H . . . 1 1 17 17 U HO2' H . . . . . 2.5 2.5 5.0 . . . . . A . 17 U H6 . . A . 17 U HO2' . . . 17 . H6 . . . . . 17 . H2'' . . rr_1ajf 1
156 1 . . 1 1 17 17 U H6 H . . . 1 1 17 17 U H3' H . . . . . 1.8 1.8 3.0 . . . . . A . 17 U H6 . . A . 17 U H3' . . . 17 . H6 . . . . . 17 . H3' . . rr_1ajf 1
157 1 . . 1 1 16 16 G H1' H . . . 1 1 17 17 U H6 H . . . . . 2.0 2.0 4.0 . . . . . A . 16 G H1' . . A . 17 U H6 . . . 16 . H1' . . . . . 17 . H6 . . rr_1ajf 1
158 1 . . 1 1 16 16 G HO2' H . . . 1 1 17 17 U H6 H . . . . . 1.8 1.8 3.0 . . . . . A . 16 G HO2' . . A . 17 U H6 . . . 16 . H2'' . . . . . 17 . H6 . . rr_1ajf 1
159 1 . . 1 1 17 17 U H1' H . . . 1 1 17 17 U HO2' H . . . . . 1.8 1.8 3.0 . . . . . A . 17 U H1' . . A . 17 U HO2' . . . 17 . H1' . . . . . 17 . H2'' . . rr_1ajf 1
160 1 . . 1 1 17 17 U H1' H . . . 1 1 17 17 U H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 17 U H1' . . A . 17 U H3' . . . 17 . H1' . . . . . 17 . H3' . . rr_1ajf 1
161 1 . . 1 1 17 17 U H1' H . . . 1 1 17 17 U H4' H . . . . . 2.5 2.5 5.0 . . . . . A . 17 U H1' . . A . 17 U H4' . . . 17 . H1' . . . . . 17 . H4' . . rr_1ajf 1
162 1 . . 1 1 17 17 U H5 H . . . 1 1 18 18 C H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 17 U H5 . . A . 18 C H5 . . . 17 . H5 . . . . . 18 . H5 . . rr_1ajf 1
163 1 . . 1 1 18 18 C H1' H . . . 1 1 18 18 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 18 C H1' . . A . 18 C H6 . . . 18 . H1' . . . . . 18 . H6 . . rr_1ajf 1
164 1 . . 1 1 18 18 C H6 H . . . 1 1 18 18 C HO2' H . . . . . 2.5 2.5 5.0 . . . . . A . 18 C H6 . . A . 18 C HO2' . . . 18 . H6 . . . . . 18 . H2'' . . rr_1ajf 1
165 1 . . 1 1 18 18 C H6 H . . . 1 1 18 18 C H3' H . . . . . 1.8 1.8 3.0 . . . . . A . 18 C H6 . . A . 18 C H3' . . . 18 . H6 . . . . . 18 . H3' . . rr_1ajf 1
166 1 . . 1 1 17 17 U H1' H . . . 1 1 18 18 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 17 U H1' . . A . 18 C H6 . . . 17 . H1' . . . . . 18 . H6 . . rr_1ajf 1
167 1 . . 1 1 17 17 U HO2' H . . . 1 1 18 18 C H6 H . . . . . 1.8 1.8 3.0 . . . . . A . 17 U HO2' . . A . 18 C H6 . . . 17 . H2'' . . . . . 18 . H6 . . rr_1ajf 1
168 1 . . 1 1 17 17 U H3' H . . . 1 1 18 18 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 17 U H3' . . A . 18 C H6 . . . 17 . H3' . . . . . 18 . H6 . . rr_1ajf 1
169 1 . . 1 1 18 18 C H1' H . . . 1 1 18 18 C HO2' H . . . . . 1.8 1.8 3.0 . . . . . A . 18 C H1' . . A . 18 C HO2' . . . 18 . H1' . . . . . 18 . H2'' . . rr_1ajf 1
170 1 . . 1 1 18 18 C H1' H . . . 1 1 18 18 C H3' H . . . . . 2.0 2.0 4.0 . . . . . A . 18 C H1' . . A . 18 C H3' . . . 18 . H1' . . . . . 18 . H3' . . rr_1ajf 1
171 1 . . 1 1 18 18 C H5 H . . . 1 1 18 18 C HO2' H . . . . . 2.5 2.5 5.0 . . . . . A . 18 C H5 . . A . 18 C HO2' . . . 18 . H5 . . . . . 18 . H2'' . . rr_1ajf 1
stop_
loop_
_Gen_dist_constraint_comment_org.ID
_Gen_dist_constraint_comment_org.Comment_text
_Gen_dist_constraint_comment_org.Comment_begin_line
_Gen_dist_constraint_comment_org.Comment_begin_column
_Gen_dist_constraint_comment_org.Comment_end_line
_Gen_dist_constraint_comment_org.Comment_end_column
_Gen_dist_constraint_comment_org.Entry_ID
_Gen_dist_constraint_comment_org.Gen_dist_constraint_list_ID
1 "IMINO-IMINO NMR DISTANCE CONSTRAINTS FROM WATER NOESY" 1 1 1 1 rr_1ajf 1
2 "WATER NOESY NMR DISTANCE CONSTRAINTS" 14 1 14 1 rr_1ajf 1
3 "NON EXCHANGEABLE NMR DISTANCE CONSTRAINTS FROM NOESY" 27 1 27 1 rr_1ajf 1
4 G1 29 9 29 9 rr_1ajf 1
5 A2 34 9 34 9 rr_1ajf 1
6 C3 46 9 46 9 rr_1ajf 1
7 A4 55 9 55 9 rr_1ajf 1
8 G5 67 9 67 9 rr_1ajf 1
9 G6 77 9 77 9 rr_1ajf 1
10 G7 87 9 87 9 rr_1ajf 1
11 G8 97 9 97 9 rr_1ajf 1
12 A9 110 9 110 9 rr_1ajf 1
13 A10 117 9 117 9 rr_1ajf 1
14 A11 130 9 130 9 rr_1ajf 1
15 C12 144 9 144 9 rr_1ajf 1
16 U13 154 9 154 9 rr_1ajf 1
17 U14 165 9 165 9 rr_1ajf 1
18 U15 177 9 177 9 rr_1ajf 1
19 G16 188 9 188 9 rr_1ajf 1
20 U17 198 9 198 9 rr_1ajf 1
21 C18 209 9 209 9 rr_1ajf 1
stop_
save_
save_CNS/XPLOR_distance_constraints_2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_2
_Gen_dist_constraint_list.Entry_ID rr_1ajf
_Gen_dist_constraint_list.ID 1
_Gen_dist_constraint_list.Constraint_type "hydrogen bond"
_Gen_dist_constraint_list.Details "Generated by Wattos"
_Gen_dist_constraint_list.Constraint_file_ID 1
_Gen_dist_constraint_list.Block_ID 2
loop_
_Gen_dist_constraint_software.Software_ID
_Gen_dist_constraint_software.Software_label
_Gen_dist_constraint_software.Method_ID
_Gen_dist_constraint_software.Method_label
_Gen_dist_constraint_software.Entry_ID
_Gen_dist_constraint_software.Gen_dist_constraint_list_ID
. . . . rr_1ajf 2
stop_
loop_
_Gen_dist_constraint.ID
_Gen_dist_constraint.Member_ID
_Gen_dist_constraint.Member_logic_code
_Gen_dist_constraint.Assembly_atom_ID_1
_Gen_dist_constraint.Entity_assembly_ID_1
_Gen_dist_constraint.Entity_ID_1
_Gen_dist_constraint.Comp_index_ID_1
_Gen_dist_constraint.Seq_ID_1
_Gen_dist_constraint.Comp_ID_1
_Gen_dist_constraint.Atom_ID_1
_Gen_dist_constraint.Atom_type_1
_Gen_dist_constraint.Atom_isotope_number_1
_Gen_dist_constraint.Resonance_ID_1
_Gen_dist_constraint.Assembly_atom_ID_2
_Gen_dist_constraint.Entity_assembly_ID_2
_Gen_dist_constraint.Entity_ID_2
_Gen_dist_constraint.Comp_index_ID_2
_Gen_dist_constraint.Seq_ID_2
_Gen_dist_constraint.Comp_ID_2
_Gen_dist_constraint.Atom_ID_2
_Gen_dist_constraint.Atom_type_2
_Gen_dist_constraint.Atom_isotope_number_2
_Gen_dist_constraint.Resonance_ID_2
_Gen_dist_constraint.Intensity_val
_Gen_dist_constraint.Intensity_lower_val_err
_Gen_dist_constraint.Intensity_upper_val_err
_Gen_dist_constraint.Distance_val
_Gen_dist_constraint.Distance_lower_bound_val
_Gen_dist_constraint.Distance_upper_bound_val
_Gen_dist_constraint.Contribution_fractional_val
_Gen_dist_constraint.Spectral_peak_ID
_Gen_dist_constraint.Spectral_peak_list_ID
_Gen_dist_constraint.PDB_record_ID_1
_Gen_dist_constraint.PDB_model_num_1
_Gen_dist_constraint.PDB_strand_ID_1
_Gen_dist_constraint.PDB_ins_code_1
_Gen_dist_constraint.PDB_residue_no_1
_Gen_dist_constraint.PDB_residue_name_1
_Gen_dist_constraint.PDB_atom_name_1
_Gen_dist_constraint.PDB_record_ID_2
_Gen_dist_constraint.PDB_model_num_2
_Gen_dist_constraint.PDB_strand_ID_2
_Gen_dist_constraint.PDB_ins_code_2
_Gen_dist_constraint.PDB_residue_no_2
_Gen_dist_constraint.PDB_residue_name_2
_Gen_dist_constraint.PDB_atom_name_2
_Gen_dist_constraint.Auth_entity_assembly_ID_1
_Gen_dist_constraint.Auth_asym_ID_1
_Gen_dist_constraint.Auth_chain_ID_1
_Gen_dist_constraint.Auth_seq_ID_1
_Gen_dist_constraint.Auth_comp_ID_1
_Gen_dist_constraint.Auth_atom_ID_1
_Gen_dist_constraint.Auth_alt_ID_1
_Gen_dist_constraint.Auth_atom_name_1
_Gen_dist_constraint.Auth_entity_assembly_ID_2
_Gen_dist_constraint.Auth_asym_ID_2
_Gen_dist_constraint.Auth_chain_ID_2
_Gen_dist_constraint.Auth_seq_ID_2
_Gen_dist_constraint.Auth_comp_ID_2
_Gen_dist_constraint.Auth_atom_ID_2
_Gen_dist_constraint.Auth_alt_ID_2
_Gen_dist_constraint.Auth_atom_name_2
_Gen_dist_constraint.Entry_ID
_Gen_dist_constraint.Gen_dist_constraint_list_ID
1 1 . . 1 1 18 18 C H41 H . . . 1 1 1 1 G O6 O . . . . . 1.7 1.6 1.8 . . . . . A . 18 C H41 . . A . 1 G O6 . . . 18 . H41 . . . . . 1 . O6 . . rr_1ajf 2
2 1 . . 1 1 18 18 C N3 N . . . 1 1 1 1 G H21 H . . . . . 3.0 2.9 3.1 . . . . . A . 18 C N3 . . A . 1 G H21 . . . 18 . N3 . . . . . 1 . H21 . . rr_1ajf 2
3 1 . . 1 1 1 1 G H21 H . . . 1 1 18 18 C O2 O . . . . . 2.0 1.9 2.1 . . . . . A . 1 G H21 . . A . 18 C O2 . . . 1 . H21 . . . . . 18 . O2 . . rr_1ajf 2
4 1 . . 1 1 18 18 C N3 N . . . 1 1 1 1 G H1 H . . . . . 1.9 1.8 2.0 . . . . . A . 18 C N3 . . A . 1 G H1 . . . 18 . N3 . . . . . 1 . H1 . . rr_1ajf 2
5 1 . . 1 1 2 2 A H2 H . . . 1 1 17 17 U O2 O . . . . . 3.2 3.1 3.3 . . . . . A . 2 A H2 . . A . 17 U O2 . . . 2 . H2 . . . . . 17 . O2 . . rr_1ajf 2
6 1 . . 1 1 17 17 U H3 H . . . 1 1 2 2 A N1 N . . . . . 1.9 1.8 2.0 . . . . . A . 17 U H3 . . A . 2 A N1 . . . 17 . H3 . . . . . 2 . N1 . . rr_1ajf 2
7 1 . . 1 1 2 2 A H61 H . . . 1 1 17 17 U O4 O . . . . . 1.8 1.7 1.9 . . . . . A . 2 A H61 . . A . 17 U O4 . . . 2 . H61 . . . . . 17 . O4 . . rr_1ajf 2
8 1 . . 1 1 17 17 U H3 H . . . 1 1 2 2 A H2 H . . . . . 2.9 2.8 3.0 . . . . . A . 17 U H3 . . A . 2 A H2 . . . 17 . H3 . . . . . 2 . H2 . . rr_1ajf 2
9 1 . . 1 1 3 3 C H41 H . . . 1 1 16 16 G O6 O . . . . . 1.7 1.6 1.8 . . . . . A . 3 C H41 . . A . 16 G O6 . . . 3 . H41 . . . . . 16 . O6 . . rr_1ajf 2
10 1 . . 1 1 3 3 C N3 N . . . 1 1 16 16 G H21 H . . . . . 3.0 2.9 3.1 . . . . . A . 3 C N3 . . A . 16 G H21 . . . 3 . N3 . . . . . 16 . H21 . . rr_1ajf 2
11 1 . . 1 1 16 16 G H21 H . . . 1 1 3 3 C O2 O . . . . . 2.0 1.9 2.1 . . . . . A . 16 G H21 . . A . 3 C O2 . . . 16 . H21 . . . . . 3 . O2 . . rr_1ajf 2
12 1 . . 1 1 16 16 G H1 H . . . 1 1 3 3 C N3 N . . . . . 1.9 1.8 2.0 . . . . . A . 16 G H1 . . A . 3 C N3 . . . 16 . H1 . . . . . 3 . N3 . . rr_1ajf 2
13 1 . . 1 1 4 4 A H2 H . . . 1 1 15 15 U O2 O . . . . . 3.2 3.1 3.3 . . . . . A . 4 A H2 . . A . 15 U O2 . . . 4 . H2 . . . . . 15 . O2 . . rr_1ajf 2
14 1 . . 1 1 15 15 U H3 H . . . 1 1 4 4 A N1 N . . . . . 1.9 1.8 2.0 . . . . . A . 15 U H3 . . A . 4 A N1 . . . 15 . H3 . . . . . 4 . N1 . . rr_1ajf 2
15 1 . . 1 1 4 4 A H61 H . . . 1 1 15 15 U O4 O . . . . . 1.8 1.7 1.9 . . . . . A . 4 A H61 . . A . 15 U O4 . . . 4 . H61 . . . . . 15 . O4 . . rr_1ajf 2
16 1 . . 1 1 15 15 U H3 H . . . 1 1 4 4 A H2 H . . . . . 2.9 2.8 3.0 . . . . . A . 15 U H3 . . A . 4 A H2 . . . 15 . H3 . . . . . 4 . H2 . . rr_1ajf 2
17 1 . . 1 1 5 5 G H1 H . . . 1 1 14 14 U O2 O . . . . . 1.8 1.7 1.9 . . . . . A . 5 G H1 . . A . 14 U O2 . . . 5 . H1 . . . . . 14 . O2 . . rr_1ajf 2
18 1 . . 1 1 5 5 G H1 H . . . 1 1 14 14 U H3 H . . . . . 2.6 2.5 2.7 . . . . . A . 5 G H1 . . A . 14 U H3 . . . 5 . H1 . . . . . 14 . H3 . . rr_1ajf 2
19 1 . . 1 1 14 14 U H3 H . . . 1 1 5 5 G O6 O . . . . . 1.9 1.8 2.0 . . . . . A . 14 U H3 . . A . 5 G O6 . . . 14 . H3 . . . . . 5 . O6 . . rr_1ajf 2
20 1 . . 1 1 14 14 U O2 O . . . 1 1 5 5 G O6 O . . . . . 3.7 3.6 3.8 . . . . . A . 14 U O2 . . A . 5 G O6 . . . 14 . O2 . . . . . 5 . O6 . . rr_1ajf 2
21 1 . . 1 1 14 14 U N3 N . . . 1 1 5 5 G N1 N . . . . . 3.7 3.6 3.8 . . . . . A . 14 U N3 . . A . 5 G N1 . . . 14 . N3 . . . . . 5 . N1 . . rr_1ajf 2
22 1 . . 1 1 6 6 G H1 H . . . 1 1 13 13 U O2 O . . . . . 1.8 1.7 1.9 . . . . . A . 6 G H1 . . A . 13 U O2 . . . 6 . H1 . . . . . 13 . O2 . . rr_1ajf 2
23 1 . . 1 1 6 6 G H1 H . . . 1 1 13 13 U H3 H . . . . . 2.6 2.5 2.7 . . . . . A . 6 G H1 . . A . 13 U H3 . . . 6 . H1 . . . . . 13 . H3 . . rr_1ajf 2
24 1 . . 1 1 13 13 U H3 H . . . 1 1 6 6 G O6 O . . . . . 1.9 1.8 2.0 . . . . . A . 13 U H3 . . A . 6 G O6 . . . 13 . H3 . . . . . 6 . O6 . . rr_1ajf 2
25 1 . . 1 1 13 13 U O2 O . . . 1 1 6 6 G O6 O . . . . . 3.7 3.6 3.8 . . . . . A . 13 U O2 . . A . 6 G O6 . . . 13 . O2 . . . . . 6 . O6 . . rr_1ajf 2
26 1 . . 1 1 13 13 U N3 N . . . 1 1 6 6 G N1 N . . . . . 3.7 3.6 3.8 . . . . . A . 13 U N3 . . A . 6 G N1 . . . 13 . N3 . . . . . 6 . N1 . . rr_1ajf 2
27 1 . . 1 1 12 12 C H41 H . . . 1 1 7 7 G O6 O . . . . . 1.7 1.6 1.8 . . . . . A . 12 C H41 . . A . 7 G O6 . . . 12 . H41 . . . . . 7 . O6 . . rr_1ajf 2
28 1 . . 1 1 12 12 C N3 N . . . 1 1 7 7 G H21 H . . . . . 3.0 2.9 3.1 . . . . . A . 12 C N3 . . A . 7 G H21 . . . 12 . N3 . . . . . 7 . H21 . . rr_1ajf 2
29 1 . . 1 1 7 7 G H21 H . . . 1 1 12 12 C O2 O . . . . . 2.0 1.9 2.1 . . . . . A . 7 G H21 . . A . 12 C O2 . . . 7 . H21 . . . . . 12 . O2 . . rr_1ajf 2
30 1 . . 1 1 7 7 G H1 H . . . 1 1 12 12 C N3 N . . . . . 1.9 1.8 2.0 . . . . . A . 7 G H1 . . A . 12 C N3 . . . 7 . H1 . . . . . 12 . N3 . . rr_1ajf 2
stop_
loop_
_Gen_dist_constraint_comment_org.ID
_Gen_dist_constraint_comment_org.Comment_text
_Gen_dist_constraint_comment_org.Comment_begin_line
_Gen_dist_constraint_comment_org.Comment_begin_column
_Gen_dist_constraint_comment_org.Comment_end_line
_Gen_dist_constraint_comment_org.Comment_end_column
_Gen_dist_constraint_comment_org.Entry_ID
_Gen_dist_constraint_comment_org.Gen_dist_constraint_list_ID
1 "STEM BASE PAIRING - based on standard H-bond distances" 1 1 1 1 rr_1ajf 2
2 "base pair G1-C18" 3 9 3 9 rr_1ajf 2
3 "base pair A2-U17" 9 9 9 9 rr_1ajf 2
4 "base pair C3-G16" 15 9 15 9 rr_1ajf 2
5 "base pair A4-U15" 21 9 21 9 rr_1ajf 2
6 "base pair G5-U14" 27 9 27 9 rr_1ajf 2
7 "base pair G6-U13" 34 9 34 9 rr_1ajf 2
8 "base pair G7-C12" 41 9 41 9 rr_1ajf 2
stop_
save_
save_CNS/XPLOR_distance_constraints_3_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_3_1
_Distance_constraint_list.Entry_ID rr_1ajf
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Details "Generated by Wattos"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 3
loop_
_Distance_constraint_software.Software_ID
_Distance_constraint_software.Software_label
_Distance_constraint_software.Method_ID
_Distance_constraint_software.Method_label
_Distance_constraint_software.Entry_ID
_Distance_constraint_software.Distance_constraint_list_ID
. . . . rr_1ajf 1
stop_
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . rr_1ajf 1
2 1 . . . rr_1ajf 1
3 1 . . . rr_1ajf 1
4 1 . . . rr_1ajf 1
5 1 . . . rr_1ajf 1
6 1 . . . rr_1ajf 1
7 1 . . . rr_1ajf 1
8 1 . . . rr_1ajf 1
9 1 . . . rr_1ajf 1
10 1 . . . rr_1ajf 1
11 1 . . . rr_1ajf 1
12 1 . . . rr_1ajf 1
13 1 . . . rr_1ajf 1
14 1 . . . rr_1ajf 1
15 1 . . . rr_1ajf 1
16 1 . . . rr_1ajf 1
17 1 . . . rr_1ajf 1
18 1 . . . rr_1ajf 1
19 1 . . . rr_1ajf 1
20 1 . . . rr_1ajf 1
21 1 . . . rr_1ajf 1
22 1 . . . rr_1ajf 1
23 1 . . . rr_1ajf 1
24 1 . . . rr_1ajf 1
25 1 . . . rr_1ajf 1
26 1 . . . rr_1ajf 1
27 1 . . . rr_1ajf 1
28 1 . . . rr_1ajf 1
29 1 . . . rr_1ajf 1
30 1 . . . rr_1ajf 1
31 1 . . . rr_1ajf 1
32 1 . . . rr_1ajf 1
33 1 . . . rr_1ajf 1
34 1 . . . rr_1ajf 1
35 1 . . . rr_1ajf 1
36 1 . . . rr_1ajf 1
37 1 . . . rr_1ajf 1
38 1 . . . rr_1ajf 1
39 1 . . . rr_1ajf 1
40 1 . . . rr_1ajf 1
41 1 . . . rr_1ajf 1
42 1 . . . rr_1ajf 1
43 1 . . . rr_1ajf 1
44 1 . . . rr_1ajf 1
45 1 . . . rr_1ajf 1
46 1 . . . rr_1ajf 1
47 1 . . . rr_1ajf 1
48 1 . . . rr_1ajf 1
49 1 . . . rr_1ajf 1
50 1 . . . rr_1ajf 1
51 1 . . . rr_1ajf 1
52 1 . . . rr_1ajf 1
53 1 . . . rr_1ajf 1
54 1 . . . rr_1ajf 1
55 1 . . . rr_1ajf 1
56 1 . . . rr_1ajf 1
57 1 . . . rr_1ajf 1
58 1 . . . rr_1ajf 1
59 1 . . . rr_1ajf 1
60 1 . . . rr_1ajf 1
61 1 . . . rr_1ajf 1
62 1 . . . rr_1ajf 1
63 1 . . . rr_1ajf 1
64 1 . . . rr_1ajf 1
65 1 . . . rr_1ajf 1
66 1 . . . rr_1ajf 1
67 1 . . . rr_1ajf 1
68 1 . . . rr_1ajf 1
69 1 . . . rr_1ajf 1
70 1 . . . rr_1ajf 1
71 1 . . . rr_1ajf 1
72 1 . . . rr_1ajf 1
73 1 . . . rr_1ajf 1
74 1 . . . rr_1ajf 1
75 1 . . . rr_1ajf 1
76 1 . . . rr_1ajf 1
77 1 . . . rr_1ajf 1
78 1 . . . rr_1ajf 1
79 1 . . . rr_1ajf 1
80 1 . . . rr_1ajf 1
81 1 . . . rr_1ajf 1
82 1 . . . rr_1ajf 1
83 1 . . . rr_1ajf 1
84 1 . . . rr_1ajf 1
85 1 . . . rr_1ajf 1
86 1 . . . rr_1ajf 1
87 1 . . . rr_1ajf 1
88 1 . . . rr_1ajf 1
89 1 . . . rr_1ajf 1
90 1 . . . rr_1ajf 1
91 1 . . . rr_1ajf 1
92 1 . . . rr_1ajf 1
93 1 . . . rr_1ajf 1
94 1 . . . rr_1ajf 1
95 1 . . . rr_1ajf 1
96 1 . . . rr_1ajf 1
97 1 . . . rr_1ajf 1
98 1 . . . rr_1ajf 1
99 1 . . . rr_1ajf 1
100 1 . . . rr_1ajf 1
101 1 . . . rr_1ajf 1
102 1 . . . rr_1ajf 1
103 1 . . . rr_1ajf 1
104 1 . . . rr_1ajf 1
105 1 . . . rr_1ajf 1
106 1 . . . rr_1ajf 1
107 1 . . . rr_1ajf 1
108 1 . . . rr_1ajf 1
109 1 . . . rr_1ajf 1
110 1 . . . rr_1ajf 1
111 1 . . . rr_1ajf 1
112 1 . . . rr_1ajf 1
113 1 . . . rr_1ajf 1
114 1 . . . rr_1ajf 1
115 1 . . . rr_1ajf 1
116 1 . . . rr_1ajf 1
117 1 . . . rr_1ajf 1
118 1 . . . rr_1ajf 1
119 1 . . . rr_1ajf 1
120 1 . . . rr_1ajf 1
121 1 . . . rr_1ajf 1
122 1 . . . rr_1ajf 1
123 1 . . . rr_1ajf 1
124 1 . . . rr_1ajf 1
125 1 . . . rr_1ajf 1
126 1 . . . rr_1ajf 1
127 1 . . . rr_1ajf 1
128 1 . . . rr_1ajf 1
129 1 . . . rr_1ajf 1
130 1 . . . rr_1ajf 1
131 1 . . . rr_1ajf 1
132 1 . . . rr_1ajf 1
133 1 . . . rr_1ajf 1
134 1 . . . rr_1ajf 1
135 1 . . . rr_1ajf 1
136 1 . . . rr_1ajf 1
137 1 . . . rr_1ajf 1
138 1 . . . rr_1ajf 1
139 1 . . . rr_1ajf 1
140 1 . . . rr_1ajf 1
141 1 . . . rr_1ajf 1
142 1 . . . rr_1ajf 1
143 1 . . . rr_1ajf 1
144 1 . . . rr_1ajf 1
145 1 . . . rr_1ajf 1
146 1 . . . rr_1ajf 1
147 1 . . . rr_1ajf 1
148 1 . . . rr_1ajf 1
149 1 . . . rr_1ajf 1
150 1 . . . rr_1ajf 1
151 1 . . . rr_1ajf 1
152 1 . . . rr_1ajf 1
153 1 . . . rr_1ajf 1
154 1 . . . rr_1ajf 1
155 1 . . . rr_1ajf 1
156 1 . . . rr_1ajf 1
157 1 . . . rr_1ajf 1
158 1 . . . rr_1ajf 1
159 1 . . . rr_1ajf 1
160 1 . . . rr_1ajf 1
161 1 . . . rr_1ajf 1
162 1 . . . rr_1ajf 1
163 1 . . . rr_1ajf 1
164 1 . . . rr_1ajf 1
165 1 . . . rr_1ajf 1
166 1 . . . rr_1ajf 1
167 1 . . . rr_1ajf 1
168 1 . . . rr_1ajf 1
169 1 . . . rr_1ajf 1
170 1 . . . rr_1ajf 1
171 1 . . . rr_1ajf 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Contribution_fractional_val
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Assembly_atom_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Seq_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Atom_type
_Dist_constraint.Atom_isotope_number
_Dist_constraint.Resonance_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_entity_assembly_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 . 1 . 1 1 5 5 G H1 H . . . . 5 . H1 rr_1ajf 1
1 1 . 2 . 1 1 6 6 G H1 H . . . . 6 . H1 rr_1ajf 1
2 1 . 1 . 1 1 5 5 G H1 H . . . . 5 . H1 rr_1ajf 1
2 1 . 2 . 1 1 13 13 U H3 H . . . . 13 . H3 rr_1ajf 1
3 1 . 1 . 1 1 5 5 G H1 H . . . . 5 . H1 rr_1ajf 1
3 1 . 2 . 1 1 14 14 U H3 H . . . . 14 . H3 rr_1ajf 1
4 1 . 1 . 1 1 5 5 G H1 H . . . . 5 . H1 rr_1ajf 1
4 1 . 2 . 1 1 15 15 U H3 H . . . . 15 . H3 rr_1ajf 1
5 1 . 1 . 1 1 6 6 G H1 H . . . . 6 . H1 rr_1ajf 1
5 1 . 2 . 1 1 13 13 U H3 H . . . . 13 . H3 rr_1ajf 1
6 1 . 1 . 1 1 6 6 G H1 H . . . . 6 . H1 rr_1ajf 1
6 1 . 2 . 1 1 14 14 U H3 H . . . . 14 . H3 rr_1ajf 1
7 1 . 1 . 1 1 7 7 G H1 H . . . . 7 . H1 rr_1ajf 1
7 1 . 2 . 1 1 13 13 U H3 H . . . . 13 . H3 rr_1ajf 1
8 1 . 1 . 1 1 13 13 U H3 H . . . . 13 . H3 rr_1ajf 1
8 1 . 2 . 1 1 14 14 U H3 H . . . . 14 . H3 rr_1ajf 1
9 1 . 1 . 1 1 14 14 U H3 H . . . . 14 . H3 rr_1ajf 1
9 1 . 2 . 1 1 15 15 U H3 H . . . . 15 . H3 rr_1ajf 1
10 1 . 1 . 1 1 16 16 G H1 H . . . . 16 . H1 rr_1ajf 1
10 1 . 2 . 1 1 17 17 U H3 H . . . . 17 . H3 rr_1ajf 1
11 1 . 1 . 1 1 17 17 U H3 H . . . . 17 . H3 rr_1ajf 1
11 1 . 2 . 1 1 2 2 A H2 H . . . . 2 . H2 rr_1ajf 1
12 1 . 1 . 1 1 7 7 G H1 H . . . . 7 . H1 rr_1ajf 1
12 1 . 2 . 1 1 12 12 C H41 H . . . . 12 . H41 rr_1ajf 1
13 1 . 1 . 1 1 16 16 G H1 H . . . . 16 . H1 rr_1ajf 1
13 1 . 2 . 1 1 3 3 C H41 H . . . . 3 . H41 rr_1ajf 1
14 1 . 1 . 1 1 16 16 G H1 H . . . . 16 . H1 rr_1ajf 1
14 1 . 2 . 1 1 2 2 A H2 H . . . . 2 . H2 rr_1ajf 1
15 1 . 1 . 1 1 14 14 U H3 H . . . . 14 . H3 rr_1ajf 1
15 1 . 2 . 1 1 5 5 G H21 H . . . . 5 . H21 rr_1ajf 1
16 1 . 1 . 1 1 13 13 U H3 H . . . . 13 . H3 rr_1ajf 1
16 1 . 2 . 1 1 6 6 G H21 H . . . . 6 . H21 rr_1ajf 1
17 1 . 1 . 1 1 8 8 G H1 H . . . . 8 . H1 rr_1ajf 1
17 1 . 2 . 1 1 12 12 C H41 H . . . . 12 . H41 rr_1ajf 1
18 1 . 1 . 1 1 6 6 G H1 H . . . . 6 . H1 rr_1ajf 1
18 1 . 2 . 1 1 6 6 G H21 H . . . . 6 . H21 rr_1ajf 1
19 1 . 1 . 1 1 5 5 G H1 H . . . . 5 . H1 rr_1ajf 1
19 1 . 2 . 1 1 5 5 G H21 H . . . . 5 . H21 rr_1ajf 1
20 1 . 1 . 1 1 1 1 G H8 H . . . . 1 . H8 rr_1ajf 1
20 1 . 2 . 1 1 1 1 G H1' H . . . . 1 . H1' rr_1ajf 1
21 1 . 1 . 1 1 1 1 G H8 H . . . . 1 . H8 rr_1ajf 1
21 1 . 2 . 1 1 1 1 G HO2' H . . . . 1 . H2'' rr_1ajf 1
22 1 . 1 . 1 1 1 1 G H1' H . . . . 1 . H1' rr_1ajf 1
22 1 . 2 . 1 1 1 1 G HO2' H . . . . 1 . H2'' rr_1ajf 1
23 1 . 1 . 1 1 2 2 A H8 H . . . . 2 . H8 rr_1ajf 1
23 1 . 2 . 1 1 2 2 A H1' H . . . . 2 . H1' rr_1ajf 1
24 1 . 1 . 1 1 2 2 A H8 H . . . . 2 . H8 rr_1ajf 1
24 1 . 2 . 1 1 2 2 A HO2' H . . . . 2 . H2'' rr_1ajf 1
25 1 . 1 . 1 1 2 2 A H8 H . . . . 2 . H8 rr_1ajf 1
25 1 . 2 . 1 1 2 2 A H3' H . . . . 2 . H3' rr_1ajf 1
26 1 . 1 . 1 1 2 2 A H8 H . . . . 2 . H8 rr_1ajf 1
26 1 . 2 . 1 1 1 1 G H1' H . . . . 1 . H1' rr_1ajf 1
27 1 . 1 . 1 1 2 2 A H8 H . . . . 2 . H8 rr_1ajf 1
27 1 . 2 . 1 1 1 1 G HO2' H . . . . 1 . H2'' rr_1ajf 1
28 1 . 1 . 1 1 2 2 A H2 H . . . . 2 . H2 rr_1ajf 1
28 1 . 2 . 1 1 3 3 C H1' H . . . . 3 . H1' rr_1ajf 1
29 1 . 1 . 1 1 2 2 A H2 H . . . . 2 . H2 rr_1ajf 1
29 1 . 2 . 1 1 18 18 C H1' H . . . . 18 . H1' rr_1ajf 1
30 1 . 1 . 1 1 2 2 A H1' H . . . . 2 . H1' rr_1ajf 1
30 1 . 2 . 1 1 2 2 A HO2' H . . . . 2 . H2'' rr_1ajf 1
31 1 . 1 . 1 1 2 2 A H1' H . . . . 2 . H1' rr_1ajf 1
31 1 . 2 . 1 1 2 2 A H3' H . . . . 2 . H3' rr_1ajf 1
32 1 . 1 . 1 1 2 2 A HO2' H . . . . 2 . H2'' rr_1ajf 1
32 1 . 2 . 1 1 3 3 C H5 H . . . . 3 . H5 rr_1ajf 1
33 1 . 1 . 1 1 3 3 C H6 H . . . . 3 . H6 rr_1ajf 1
33 1 . 2 . 1 1 3 3 C H1' H . . . . 3 . H1' rr_1ajf 1
34 1 . 1 . 1 1 3 3 C H6 H . . . . 3 . H6 rr_1ajf 1
34 1 . 2 . 1 1 3 3 C HO2' H . . . . 3 . H2'' rr_1ajf 1
35 1 . 1 . 1 1 3 3 C H6 H . . . . 3 . H6 rr_1ajf 1
35 1 . 2 . 1 1 3 3 C H3' H . . . . 3 . H3' rr_1ajf 1
36 1 . 1 . 1 1 3 3 C H6 H . . . . 3 . H6 rr_1ajf 1
36 1 . 2 . 1 1 2 2 A H1' H . . . . 2 . H1' rr_1ajf 1
37 1 . 1 . 1 1 3 3 C H6 H . . . . 3 . H6 rr_1ajf 1
37 1 . 2 . 1 1 2 2 A HO2' H . . . . 2 . H2'' rr_1ajf 1
38 1 . 1 . 1 1 3 3 C H6 H . . . . 3 . H6 rr_1ajf 1
38 1 . 2 . 1 1 2 2 A H3' H . . . . 2 . H3' rr_1ajf 1
39 1 . 1 . 1 1 3 3 C H1' H . . . . 3 . H1' rr_1ajf 1
39 1 . 2 . 1 1 3 3 C HO2' H . . . . 3 . H2'' rr_1ajf 1
40 1 . 1 . 1 1 4 4 A H8 H . . . . 4 . H8 rr_1ajf 1
40 1 . 2 . 1 1 4 4 A H1' H . . . . 4 . H1' rr_1ajf 1
41 1 . 1 . 1 1 4 4 A H8 H . . . . 4 . H8 rr_1ajf 1
41 1 . 2 . 1 1 4 4 A HO2' H . . . . 4 . H2'' rr_1ajf 1
42 1 . 1 . 1 1 4 4 A H8 H . . . . 4 . H8 rr_1ajf 1
42 1 . 2 . 1 1 4 4 A H3' H . . . . 4 . H3' rr_1ajf 1
43 1 . 1 . 1 1 4 4 A H8 H . . . . 4 . H8 rr_1ajf 1
43 1 . 2 . 1 1 3 3 C HO2' H . . . . 3 . H2'' rr_1ajf 1
44 1 . 1 . 1 1 4 4 A H8 H . . . . 4 . H8 rr_1ajf 1
44 1 . 2 . 1 1 3 3 C H1' H . . . . 3 . H1' rr_1ajf 1
45 1 . 1 . 1 1 4 4 A H8 H . . . . 4 . H8 rr_1ajf 1
45 1 . 2 . 1 1 5 5 G H8 H . . . . 5 . H8 rr_1ajf 1
46 1 . 1 . 1 1 4 4 A H2 H . . . . 4 . H2 rr_1ajf 1
46 1 . 2 . 1 1 5 5 G H1' H . . . . 5 . H1' rr_1ajf 1
47 1 . 1 . 1 1 4 4 A H2 H . . . . 4 . H2 rr_1ajf 1
47 1 . 2 . 1 1 16 16 G H1' H . . . . 16 . H1' rr_1ajf 1
48 1 . 1 . 1 1 4 4 A H1' H . . . . 4 . H1' rr_1ajf 1
48 1 . 2 . 1 1 4 4 A HO2' H . . . . 4 . H2'' rr_1ajf 1
49 1 . 1 . 1 1 4 4 A H1' H . . . . 4 . H1' rr_1ajf 1
49 1 . 2 . 1 1 4 4 A H3' H . . . . 4 . H3' rr_1ajf 1
50 1 . 1 . 1 1 5 5 G H8 H . . . . 5 . H8 rr_1ajf 1
50 1 . 2 . 1 1 5 5 G H1' H . . . . 5 . H1' rr_1ajf 1
51 1 . 1 . 1 1 5 5 G H8 H . . . . 5 . H8 rr_1ajf 1
51 1 . 2 . 1 1 5 5 G HO2' H . . . . 5 . H2'' rr_1ajf 1
52 1 . 1 . 1 1 5 5 G H8 H . . . . 5 . H8 rr_1ajf 1
52 1 . 2 . 1 1 5 5 G H3' H . . . . 5 . H3' rr_1ajf 1
53 1 . 1 . 1 1 5 5 G H8 H . . . . 5 . H8 rr_1ajf 1
53 1 . 2 . 1 1 4 4 A H1' H . . . . 4 . H1' rr_1ajf 1
54 1 . 1 . 1 1 5 5 G H8 H . . . . 5 . H8 rr_1ajf 1
54 1 . 2 . 1 1 4 4 A HO2' H . . . . 4 . H2'' rr_1ajf 1
55 1 . 1 . 1 1 5 5 G H8 H . . . . 5 . H8 rr_1ajf 1
55 1 . 2 . 1 1 6 6 G H8 H . . . . 6 . H8 rr_1ajf 1
56 1 . 1 . 1 1 5 5 G H1' H . . . . 5 . H1' rr_1ajf 1
56 1 . 2 . 1 1 5 5 G HO2' H . . . . 5 . H2'' rr_1ajf 1
57 1 . 1 . 1 1 5 5 G H1' H . . . . 5 . H1' rr_1ajf 1
57 1 . 2 . 1 1 6 6 G H1' H . . . . 6 . H1' rr_1ajf 1
58 1 . 1 . 1 1 6 6 G H8 H . . . . 6 . H8 rr_1ajf 1
58 1 . 2 . 1 1 6 6 G H1' H . . . . 6 . H1' rr_1ajf 1
59 1 . 1 . 1 1 6 6 G H8 H . . . . 6 . H8 rr_1ajf 1
59 1 . 2 . 1 1 6 6 G HO2' H . . . . 6 . H2'' rr_1ajf 1
60 1 . 1 . 1 1 6 6 G H8 H . . . . 6 . H8 rr_1ajf 1
60 1 . 2 . 1 1 6 6 G H3' H . . . . 6 . H3' rr_1ajf 1
61 1 . 1 . 1 1 6 6 G H8 H . . . . 6 . H8 rr_1ajf 1
61 1 . 2 . 1 1 5 5 G H1' H . . . . 5 . H1' rr_1ajf 1
62 1 . 1 . 1 1 6 6 G H8 H . . . . 6 . H8 rr_1ajf 1
62 1 . 2 . 1 1 5 5 G HO2' H . . . . 5 . H2'' rr_1ajf 1
63 1 . 1 . 1 1 6 6 G H8 H . . . . 6 . H8 rr_1ajf 1
63 1 . 2 . 1 1 5 5 G H3' H . . . . 5 . H3' rr_1ajf 1
64 1 . 1 . 1 1 6 6 G H1' H . . . . 6 . H1' rr_1ajf 1
64 1 . 2 . 1 1 6 6 G HO2' H . . . . 6 . H2'' rr_1ajf 1
65 1 . 1 . 1 1 6 6 G H1' H . . . . 6 . H1' rr_1ajf 1
65 1 . 2 . 1 1 6 6 G H3' H . . . . 6 . H3' rr_1ajf 1
66 1 . 1 . 1 1 7 7 G H8 H . . . . 7 . H8 rr_1ajf 1
66 1 . 2 . 1 1 7 7 G H1' H . . . . 7 . H1' rr_1ajf 1
67 1 . 1 . 1 1 7 7 G H8 H . . . . 7 . H8 rr_1ajf 1
67 1 . 2 . 1 1 7 7 G HO2' H . . . . 7 . H2'' rr_1ajf 1
68 1 . 1 . 1 1 7 7 G H8 H . . . . 7 . H8 rr_1ajf 1
68 1 . 2 . 1 1 7 7 G H3' H . . . . 7 . H3' rr_1ajf 1
69 1 . 1 . 1 1 7 7 G H8 H . . . . 7 . H8 rr_1ajf 1
69 1 . 2 . 1 1 6 6 G H1' H . . . . 6 . H1' rr_1ajf 1
70 1 . 1 . 1 1 7 7 G H8 H . . . . 7 . H8 rr_1ajf 1
70 1 . 2 . 1 1 6 6 G HO2' H . . . . 6 . H2'' rr_1ajf 1
71 1 . 1 . 1 1 7 7 G H8 H . . . . 7 . H8 rr_1ajf 1
71 1 . 2 . 1 1 6 6 G H3' H . . . . 6 . H3' rr_1ajf 1
72 1 . 1 . 1 1 7 7 G H1' H . . . . 7 . H1' rr_1ajf 1
72 1 . 2 . 1 1 7 7 G HO2' H . . . . 7 . H2'' rr_1ajf 1
73 1 . 1 . 1 1 7 7 G H1' H . . . . 7 . H1' rr_1ajf 1
73 1 . 2 . 1 1 7 7 G H3' H . . . . 7 . H3' rr_1ajf 1
74 1 . 1 . 1 1 7 7 G H8 H . . . . 7 . H8 rr_1ajf 1
74 1 . 2 . 1 1 8 8 G H8 H . . . . 8 . H8 rr_1ajf 1
75 1 . 1 . 1 1 8 8 G H8 H . . . . 8 . H8 rr_1ajf 1
75 1 . 2 . 1 1 8 8 G H1' H . . . . 8 . H1' rr_1ajf 1
76 1 . 1 . 1 1 8 8 G H8 H . . . . 8 . H8 rr_1ajf 1
76 1 . 2 . 1 1 8 8 G HO2' H . . . . 8 . H2'' rr_1ajf 1
77 1 . 1 . 1 1 8 8 G H8 H . . . . 8 . H8 rr_1ajf 1
77 1 . 2 . 1 1 8 8 G H3' H . . . . 8 . H3' rr_1ajf 1
78 1 . 1 . 1 1 8 8 G H8 H . . . . 8 . H8 rr_1ajf 1
78 1 . 2 . 1 1 7 7 G H1' H . . . . 7 . H1' rr_1ajf 1
79 1 . 1 . 1 1 8 8 G H8 H . . . . 8 . H8 rr_1ajf 1
79 1 . 2 . 1 1 7 7 G HO2' H . . . . 7 . H2'' rr_1ajf 1
80 1 . 1 . 1 1 8 8 G H8 H . . . . 8 . H8 rr_1ajf 1
80 1 . 2 . 1 1 7 7 G H3' H . . . . 7 . H3' rr_1ajf 1
81 1 . 1 . 1 1 8 8 G H1' H . . . . 8 . H1' rr_1ajf 1
81 1 . 2 . 1 1 8 8 G HO2' H . . . . 8 . H2'' rr_1ajf 1
82 1 . 1 . 1 1 8 8 G H1' H . . . . 8 . H1' rr_1ajf 1
82 1 . 2 . 1 1 8 8 G H3' H . . . . 8 . H3' rr_1ajf 1
83 1 . 1 . 1 1 8 8 G HO2' H . . . . 8 . H2'' rr_1ajf 1
83 1 . 2 . 1 1 10 10 A H8 H . . . . 10 . H8 rr_1ajf 1
84 1 . 1 . 1 1 8 8 G HO2' H . . . . 8 . H2'' rr_1ajf 1
84 1 . 2 . 1 1 9 9 A H8 H . . . . 9 . H8 rr_1ajf 1
85 1 . 1 . 1 1 9 9 A H8 H . . . . 9 . H8 rr_1ajf 1
85 1 . 2 . 1 1 9 9 A H1' H . . . . 9 . H1' rr_1ajf 1
86 1 . 1 . 1 1 9 9 A H1' H . . . . 9 . H1' rr_1ajf 1
86 1 . 2 . 1 1 9 9 A H3' H . . . . 9 . H3' rr_1ajf 1
87 1 . 1 . 1 1 9 9 A H8 H . . . . 9 . H8 rr_1ajf 1
87 1 . 2 . 1 1 10 10 A H8 H . . . . 10 . H8 rr_1ajf 1
88 1 . 1 . 1 1 9 9 A H2 H . . . . 9 . H2 rr_1ajf 1
88 1 . 2 . 1 1 10 10 A H1' H . . . . 10 . H1' rr_1ajf 1
89 1 . 1 . 1 1 9 9 A H2 H . . . . 9 . H2 rr_1ajf 1
89 1 . 2 . 1 1 9 9 A H1' H . . . . 9 . H1' rr_1ajf 1
90 1 . 1 . 1 1 10 10 A H8 H . . . . 10 . H8 rr_1ajf 1
90 1 . 2 . 1 1 10 10 A H1' H . . . . 10 . H1' rr_1ajf 1
91 1 . 1 . 1 1 10 10 A H8 H . . . . 10 . H8 rr_1ajf 1
91 1 . 2 . 1 1 10 10 A H3' H . . . . 10 . H3' rr_1ajf 1
92 1 . 1 . 1 1 10 10 A H8 H . . . . 10 . H8 rr_1ajf 1
92 1 . 2 . 1 1 10 10 A HO2' H . . . . 10 . H2'' rr_1ajf 1
93 1 . 1 . 1 1 10 10 A H8 H . . . . 10 . H8 rr_1ajf 1
93 1 . 2 . 1 1 9 9 A H1' H . . . . 9 . H1' rr_1ajf 1
94 1 . 1 . 1 1 10 10 A H8 H . . . . 10 . H8 rr_1ajf 1
94 1 . 2 . 1 1 11 11 A H8 H . . . . 11 . H8 rr_1ajf 1
95 1 . 1 . 1 1 10 10 A H2 H . . . . 10 . H2 rr_1ajf 1
95 1 . 2 . 1 1 10 10 A H1' H . . . . 10 . H1' rr_1ajf 1
96 1 . 1 . 1 1 10 10 A H2 H . . . . 10 . H2 rr_1ajf 1
96 1 . 2 . 1 1 11 11 A H1' H . . . . 11 . H1' rr_1ajf 1
97 1 . 1 . 1 1 10 10 A H2 H . . . . 10 . H2 rr_1ajf 1
97 1 . 2 . 1 1 11 11 A H2 H . . . . 11 . H2 rr_1ajf 1
98 1 . 1 . 1 1 10 10 A H1' H . . . . 10 . H1' rr_1ajf 1
98 1 . 2 . 1 1 10 10 A HO2' H . . . . 10 . H2'' rr_1ajf 1
99 1 . 1 . 1 1 10 10 A H1' H . . . . 10 . H1' rr_1ajf 1
99 1 . 2 . 1 1 10 10 A H3' H . . . . 10 . H3' rr_1ajf 1
100 1 . 1 . 1 1 11 11 A H8 H . . . . 11 . H8 rr_1ajf 1
100 1 . 2 . 1 1 11 11 A H1' H . . . . 11 . H1' rr_1ajf 1
101 1 . 1 . 1 1 11 11 A H8 H . . . . 11 . H8 rr_1ajf 1
101 1 . 2 . 1 1 11 11 A HO2' H . . . . 11 . H2'' rr_1ajf 1
102 1 . 1 . 1 1 11 11 A H8 H . . . . 11 . H8 rr_1ajf 1
102 1 . 2 . 1 1 11 11 A H3' H . . . . 11 . H3' rr_1ajf 1
103 1 . 1 . 1 1 11 11 A H8 H . . . . 11 . H8 rr_1ajf 1
103 1 . 2 . 1 1 10 10 A H1' H . . . . 10 . H1' rr_1ajf 1
104 1 . 1 . 1 1 11 11 A H8 H . . . . 11 . H8 rr_1ajf 1
104 1 . 2 . 1 1 10 10 A HO2' H . . . . 10 . H2'' rr_1ajf 1
105 1 . 1 . 1 1 11 11 A H8 H . . . . 11 . H8 rr_1ajf 1
105 1 . 2 . 1 1 10 10 A H3' H . . . . 10 . H3' rr_1ajf 1
106 1 . 1 . 1 1 11 11 A H8 H . . . . 11 . H8 rr_1ajf 1
106 1 . 2 . 1 1 12 12 C H5 H . . . . 12 . H5 rr_1ajf 1
107 1 . 1 . 1 1 11 11 A H8 H . . . . 11 . H8 rr_1ajf 1
107 1 . 2 . 1 1 12 12 C H6 H . . . . 12 . H6 rr_1ajf 1
108 1 . 1 . 1 1 11 11 A H1' H . . . . 11 . H1' rr_1ajf 1
108 1 . 2 . 1 1 11 11 A HO2' H . . . . 11 . H2'' rr_1ajf 1
109 1 . 1 . 1 1 11 11 A H1' H . . . . 11 . H1' rr_1ajf 1
109 1 . 2 . 1 1 11 11 A H3' H . . . . 11 . H3' rr_1ajf 1
110 1 . 1 . 1 1 11 11 A H2 H . . . . 11 . H2 rr_1ajf 1
110 1 . 2 . 1 1 11 11 A H1' H . . . . 11 . H1' rr_1ajf 1
111 1 . 1 . 1 1 12 12 C H6 H . . . . 12 . H6 rr_1ajf 1
111 1 . 2 . 1 1 12 12 C H1' H . . . . 12 . H1' rr_1ajf 1
112 1 . 1 . 1 1 12 12 C H6 H . . . . 12 . H6 rr_1ajf 1
112 1 . 2 . 1 1 12 12 C HO2' H . . . . 12 . H2'' rr_1ajf 1
113 1 . 1 . 1 1 12 12 C H6 H . . . . 12 . H6 rr_1ajf 1
113 1 . 2 . 1 1 12 12 C H3' H . . . . 12 . H3' rr_1ajf 1
114 1 . 1 . 1 1 12 12 C H6 H . . . . 12 . H6 rr_1ajf 1
114 1 . 2 . 1 1 11 11 A HO2' H . . . . 11 . H2'' rr_1ajf 1
115 1 . 1 . 1 1 12 12 C H6 H . . . . 12 . H6 rr_1ajf 1
115 1 . 2 . 1 1 11 11 A H3' H . . . . 11 . H3' rr_1ajf 1
116 1 . 1 . 1 1 12 12 C H6 H . . . . 12 . H6 rr_1ajf 1
116 1 . 2 . 1 1 13 13 U H5 H . . . . 13 . H5 rr_1ajf 1
117 1 . 1 . 1 1 12 12 C H1' H . . . . 12 . H1' rr_1ajf 1
117 1 . 2 . 1 1 13 13 U H5 H . . . . 13 . H5 rr_1ajf 1
118 1 . 1 . 1 1 13 13 U H6 H . . . . 13 . H6 rr_1ajf 1
118 1 . 2 . 1 1 13 13 U H1' H . . . . 13 . H1' rr_1ajf 1
119 1 . 1 . 1 1 13 13 U H6 H . . . . 13 . H6 rr_1ajf 1
119 1 . 2 . 1 1 13 13 U HO2' H . . . . 13 . H2'' rr_1ajf 1
120 1 . 1 . 1 1 13 13 U H6 H . . . . 13 . H6 rr_1ajf 1
120 1 . 2 . 1 1 13 13 U H3' H . . . . 13 . H3' rr_1ajf 1
121 1 . 1 . 1 1 13 13 U H6 H . . . . 13 . H6 rr_1ajf 1
121 1 . 2 . 1 1 12 12 C H1' H . . . . 12 . H1' rr_1ajf 1
122 1 . 1 . 1 1 13 13 U H6 H . . . . 13 . H6 rr_1ajf 1
122 1 . 2 . 1 1 12 12 C HO2' H . . . . 12 . H2'' rr_1ajf 1
123 1 . 1 . 1 1 13 13 U H6 H . . . . 13 . H6 rr_1ajf 1
123 1 . 2 . 1 1 14 14 U H5 H . . . . 14 . H5 rr_1ajf 1
124 1 . 1 . 1 1 13 13 U H1' H . . . . 13 . H1' rr_1ajf 1
124 1 . 2 . 1 1 13 13 U HO2' H . . . . 13 . H2'' rr_1ajf 1
125 1 . 1 . 1 1 13 13 U H1' H . . . . 13 . H1' rr_1ajf 1
125 1 . 2 . 1 1 13 13 U H4' H . . . . 13 . H4' rr_1ajf 1
126 1 . 1 . 1 1 13 13 U HO2' H . . . . 13 . H2'' rr_1ajf 1
126 1 . 2 . 1 1 14 14 U H5 H . . . . 14 . H5 rr_1ajf 1
127 1 . 1 . 1 1 14 14 U H6 H . . . . 14 . H6 rr_1ajf 1
127 1 . 2 . 1 1 14 14 U H1' H . . . . 14 . H1' rr_1ajf 1
128 1 . 1 . 1 1 14 14 U H6 H . . . . 14 . H6 rr_1ajf 1
128 1 . 2 . 1 1 14 14 U HO2' H . . . . 14 . H2'' rr_1ajf 1
129 1 . 1 . 1 1 14 14 U H6 H . . . . 14 . H6 rr_1ajf 1
129 1 . 2 . 1 1 14 14 U H3' H . . . . 14 . H3' rr_1ajf 1
130 1 . 1 . 1 1 14 14 U H6 H . . . . 14 . H6 rr_1ajf 1
130 1 . 2 . 1 1 13 13 U H1' H . . . . 13 . H1' rr_1ajf 1
131 1 . 1 . 1 1 14 14 U H6 H . . . . 14 . H6 rr_1ajf 1
131 1 . 2 . 1 1 13 13 U HO2' H . . . . 13 . H2'' rr_1ajf 1
132 1 . 1 . 1 1 14 14 U H6 H . . . . 14 . H6 rr_1ajf 1
132 1 . 2 . 1 1 13 13 U H3' H . . . . 13 . H3' rr_1ajf 1
133 1 . 1 . 1 1 14 14 U H1' H . . . . 14 . H1' rr_1ajf 1
133 1 . 2 . 1 1 14 14 U HO2' H . . . . 14 . H2'' rr_1ajf 1
134 1 . 1 . 1 1 14 14 U H1' H . . . . 14 . H1' rr_1ajf 1
134 1 . 2 . 1 1 14 14 U H3' H . . . . 14 . H3' rr_1ajf 1
135 1 . 1 . 1 1 14 14 U H1' H . . . . 14 . H1' rr_1ajf 1
135 1 . 2 . 1 1 14 14 U H4' H . . . . 14 . H4' rr_1ajf 1
136 1 . 1 . 1 1 14 14 U HO2' H . . . . 14 . H2'' rr_1ajf 1
136 1 . 2 . 1 1 14 14 U H5 H . . . . 14 . H5 rr_1ajf 1
137 1 . 1 . 1 1 15 15 U H6 H . . . . 15 . H6 rr_1ajf 1
137 1 . 2 . 1 1 15 15 U H1' H . . . . 15 . H1' rr_1ajf 1
138 1 . 1 . 1 1 15 15 U H6 H . . . . 15 . H6 rr_1ajf 1
138 1 . 2 . 1 1 15 15 U HO2' H . . . . 15 . H2'' rr_1ajf 1
139 1 . 1 . 1 1 15 15 U H6 H . . . . 15 . H6 rr_1ajf 1
139 1 . 2 . 1 1 15 15 U H3' H . . . . 15 . H3' rr_1ajf 1
140 1 . 1 . 1 1 15 15 U H6 H . . . . 15 . H6 rr_1ajf 1
140 1 . 2 . 1 1 14 14 U H1' H . . . . 14 . H1' rr_1ajf 1
141 1 . 1 . 1 1 15 15 U H6 H . . . . 15 . H6 rr_1ajf 1
141 1 . 2 . 1 1 14 14 U HO2' H . . . . 14 . H2'' rr_1ajf 1
142 1 . 1 . 1 1 15 15 U H6 H . . . . 15 . H6 rr_1ajf 1
142 1 . 2 . 1 1 16 16 G H8 H . . . . 16 . H8 rr_1ajf 1
143 1 . 1 . 1 1 15 15 U H1' H . . . . 15 . H1' rr_1ajf 1
143 1 . 2 . 1 1 15 15 U HO2' H . . . . 15 . H2'' rr_1ajf 1
144 1 . 1 . 1 1 15 15 U H1' H . . . . 15 . H1' rr_1ajf 1
144 1 . 2 . 1 1 15 15 U H3' H . . . . 15 . H3' rr_1ajf 1
145 1 . 1 . 1 1 15 15 U H1' H . . . . 15 . H1' rr_1ajf 1
145 1 . 2 . 1 1 15 15 U H4' H . . . . 15 . H4' rr_1ajf 1
146 1 . 1 . 1 1 16 16 G H8 H . . . . 16 . H8 rr_1ajf 1
146 1 . 2 . 1 1 16 16 G H1' H . . . . 16 . H1' rr_1ajf 1
147 1 . 1 . 1 1 16 16 G H8 H . . . . 16 . H8 rr_1ajf 1
147 1 . 2 . 1 1 16 16 G HO2' H . . . . 16 . H2'' rr_1ajf 1
148 1 . 1 . 1 1 16 16 G H8 H . . . . 16 . H8 rr_1ajf 1
148 1 . 2 . 1 1 16 16 G H1' H . . . . 16 . H1' rr_1ajf 1
149 1 . 1 . 1 1 16 16 G H8 H . . . . 16 . H8 rr_1ajf 1
149 1 . 2 . 1 1 15 15 U HO2' H . . . . 15 . H2'' rr_1ajf 1
150 1 . 1 . 1 1 16 16 G H8 H . . . . 16 . H8 rr_1ajf 1
150 1 . 2 . 1 1 15 15 U H3' H . . . . 15 . H3' rr_1ajf 1
151 1 . 1 . 1 1 16 16 G H1' H . . . . 16 . H1' rr_1ajf 1
151 1 . 2 . 1 1 16 16 G HO2' H . . . . 16 . H2'' rr_1ajf 1
152 1 . 1 . 1 1 16 16 G H1' H . . . . 16 . H1' rr_1ajf 1
152 1 . 2 . 1 1 16 16 G H3' H . . . . 16 . H3' rr_1ajf 1
153 1 . 1 . 1 1 16 16 G H1' H . . . . 16 . H1' rr_1ajf 1
153 1 . 2 . 1 1 15 15 U HO2' H . . . . 15 . H2'' rr_1ajf 1
154 1 . 1 . 1 1 17 17 U H6 H . . . . 17 . H6 rr_1ajf 1
154 1 . 2 . 1 1 17 17 U H1' H . . . . 17 . H1' rr_1ajf 1
155 1 . 1 . 1 1 17 17 U H6 H . . . . 17 . H6 rr_1ajf 1
155 1 . 2 . 1 1 17 17 U HO2' H . . . . 17 . H2'' rr_1ajf 1
156 1 . 1 . 1 1 17 17 U H6 H . . . . 17 . H6 rr_1ajf 1
156 1 . 2 . 1 1 17 17 U H3' H . . . . 17 . H3' rr_1ajf 1
157 1 . 1 . 1 1 17 17 U H6 H . . . . 17 . H6 rr_1ajf 1
157 1 . 2 . 1 1 16 16 G H1' H . . . . 16 . H1' rr_1ajf 1
158 1 . 1 . 1 1 17 17 U H6 H . . . . 17 . H6 rr_1ajf 1
158 1 . 2 . 1 1 16 16 G HO2' H . . . . 16 . H2'' rr_1ajf 1
159 1 . 1 . 1 1 17 17 U H1' H . . . . 17 . H1' rr_1ajf 1
159 1 . 2 . 1 1 17 17 U HO2' H . . . . 17 . H2'' rr_1ajf 1
160 1 . 1 . 1 1 17 17 U H1' H . . . . 17 . H1' rr_1ajf 1
160 1 . 2 . 1 1 17 17 U H3' H . . . . 17 . H3' rr_1ajf 1
161 1 . 1 . 1 1 17 17 U H1' H . . . . 17 . H1' rr_1ajf 1
161 1 . 2 . 1 1 17 17 U H4' H . . . . 17 . H4' rr_1ajf 1
162 1 . 1 . 1 1 17 17 U H5 H . . . . 17 . H5 rr_1ajf 1
162 1 . 2 . 1 1 18 18 C H5 H . . . . 18 . H5 rr_1ajf 1
163 1 . 1 . 1 1 18 18 C H6 H . . . . 18 . H6 rr_1ajf 1
163 1 . 2 . 1 1 18 18 C H1' H . . . . 18 . H1' rr_1ajf 1
164 1 . 1 . 1 1 18 18 C H6 H . . . . 18 . H6 rr_1ajf 1
164 1 . 2 . 1 1 18 18 C HO2' H . . . . 18 . H2'' rr_1ajf 1
165 1 . 1 . 1 1 18 18 C H6 H . . . . 18 . H6 rr_1ajf 1
165 1 . 2 . 1 1 18 18 C H3' H . . . . 18 . H3' rr_1ajf 1
166 1 . 1 . 1 1 18 18 C H6 H . . . . 18 . H6 rr_1ajf 1
166 1 . 2 . 1 1 17 17 U H1' H . . . . 17 . H1' rr_1ajf 1
167 1 . 1 . 1 1 18 18 C H6 H . . . . 18 . H6 rr_1ajf 1
167 1 . 2 . 1 1 17 17 U HO2' H . . . . 17 . H2'' rr_1ajf 1
168 1 . 1 . 1 1 18 18 C H6 H . . . . 18 . H6 rr_1ajf 1
168 1 . 2 . 1 1 17 17 U H3' H . . . . 17 . H3' rr_1ajf 1
169 1 . 1 . 1 1 18 18 C H1' H . . . . 18 . H1' rr_1ajf 1
169 1 . 2 . 1 1 18 18 C HO2' H . . . . 18 . H2'' rr_1ajf 1
170 1 . 1 . 1 1 18 18 C H1' H . . . . 18 . H1' rr_1ajf 1
170 1 . 2 . 1 1 18 18 C H3' H . . . . 18 . H3' rr_1ajf 1
171 1 . 1 . 1 1 18 18 C HO2' H . . . . 18 . H2'' rr_1ajf 1
171 1 . 2 . 1 1 18 18 C H5 H . . . . 18 . H5 rr_1ajf 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Spectral_peak_list_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . 3.0 3.0 5.0 rr_1ajf 1
2 1 . . . . . . 3.0 3.0 5.0 rr_1ajf 1
3 1 . . . . . . 3.0 3.0 5.0 rr_1ajf 1
4 1 . . . . . . 3.0 3.0 5.0 rr_1ajf 1
5 1 . . . . . . 3.0 3.0 5.0 rr_1ajf 1
6 1 . . . . . . 3.0 3.0 5.0 rr_1ajf 1
7 1 . . . . . . 3.0 3.0 5.0 rr_1ajf 1
8 1 . . . . . . 3.0 3.0 5.0 rr_1ajf 1
9 1 . . . . . . 3.0 3.0 5.0 rr_1ajf 1
10 1 . . . . . . 3.0 3.0 5.0 rr_1ajf 1
11 1 . . . . . . 1.8 1.8 5.0 rr_1ajf 1
12 1 . . . . . . 1.8 1.8 5.0 rr_1ajf 1
13 1 . . . . . . 1.8 1.8 5.0 rr_1ajf 1
14 1 . . . . . . 1.8 1.8 5.0 rr_1ajf 1
15 1 . . . . . . 1.8 1.8 5.0 rr_1ajf 1
16 1 . . . . . . 1.8 1.8 5.0 rr_1ajf 1
17 1 . . . . . . 1.8 1.8 5.0 rr_1ajf 1
18 1 . . . . . . 1.8 1.8 5.0 rr_1ajf 1
19 1 . . . . . . 1.8 1.8 5.0 rr_1ajf 1
20 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
21 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
22 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
23 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
24 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
25 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
26 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
27 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
28 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
29 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
30 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
31 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
32 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
33 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
34 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
35 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
36 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
37 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
38 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
39 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
40 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
41 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
42 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
43 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
44 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
45 1 . . . . . . 3.0 3.0 7.0 rr_1ajf 1
46 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
47 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
48 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
49 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
50 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
51 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
52 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
53 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
54 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
55 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
56 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
57 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
58 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
59 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
60 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
61 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
62 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
63 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
64 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
65 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
66 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
67 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
68 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
69 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
70 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
71 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
72 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
73 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
74 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
75 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
76 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
77 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
78 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
79 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
80 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
81 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
82 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
83 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
84 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
85 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
86 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
87 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
88 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
89 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
90 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
91 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
92 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
93 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
94 1 . . . . . . 3.0 3.0 7.0 rr_1ajf 1
95 1 . . . . . . 3.0 3.0 7.0 rr_1ajf 1
96 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
97 1 . . . . . . 3.0 3.0 7.0 rr_1ajf 1
98 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
99 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
100 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
101 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
102 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
103 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
104 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
105 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
106 1 . . . . . . 3.0 3.0 7.0 rr_1ajf 1
107 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
108 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
109 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
110 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
111 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
112 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
113 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
114 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
115 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
116 1 . . . . . . 3.0 3.0 7.0 rr_1ajf 1
117 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
118 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
119 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
120 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
121 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
122 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
123 1 . . . . . . 3.0 3.0 7.0 rr_1ajf 1
124 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
125 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
126 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
127 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
128 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
129 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
130 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
131 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
132 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
133 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
134 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
135 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
136 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
137 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
138 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
139 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
140 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
141 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
142 1 . . . . . . 3.0 3.0 7.0 rr_1ajf 1
143 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
144 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
145 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
146 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
147 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
148 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
149 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
150 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
151 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
152 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
153 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
154 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
155 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
156 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
157 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
158 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
159 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
160 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
161 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
162 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
163 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
164 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
165 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
166 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
167 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
168 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
169 1 . . . . . . 1.8 1.8 3.0 rr_1ajf 1
170 1 . . . . . . 2.0 2.0 4.0 rr_1ajf 1
171 1 . . . . . . 2.5 2.5 5.0 rr_1ajf 1
stop_
loop_
_Dist_constraint_comment_org.ID
_Dist_constraint_comment_org.Comment_text
_Dist_constraint_comment_org.Comment_begin_line
_Dist_constraint_comment_org.Comment_begin_column
_Dist_constraint_comment_org.Comment_end_line
_Dist_constraint_comment_org.Comment_end_column
_Dist_constraint_comment_org.Entry_ID
_Dist_constraint_comment_org.Distance_constraint_list_ID
1 "IMINO-IMINO NMR DISTANCE CONSTRAINTS FROM WATER NOESY" 1 1 1 1 rr_1ajf 1
2 "WATER NOESY NMR DISTANCE CONSTRAINTS" 14 1 14 1 rr_1ajf 1
3 "NON EXCHANGEABLE NMR DISTANCE CONSTRAINTS FROM NOESY" 27 1 27 1 rr_1ajf 1
4 G1 29 9 29 9 rr_1ajf 1
5 A2 34 9 34 9 rr_1ajf 1
6 C3 46 9 46 9 rr_1ajf 1
7 A4 55 9 55 9 rr_1ajf 1
8 G5 67 9 67 9 rr_1ajf 1
9 G6 77 9 77 9 rr_1ajf 1
10 G7 87 9 87 9 rr_1ajf 1
11 G8 97 9 97 9 rr_1ajf 1
12 A9 110 9 110 9 rr_1ajf 1
13 A10 117 9 117 9 rr_1ajf 1
14 A11 130 9 130 9 rr_1ajf 1
15 C12 144 9 144 9 rr_1ajf 1
16 U13 154 9 154 9 rr_1ajf 1
17 U14 165 9 165 9 rr_1ajf 1
18 U15 177 9 177 9 rr_1ajf 1
19 G16 188 9 188 9 rr_1ajf 1
20 U17 198 9 198 9 rr_1ajf 1
21 C18 209 9 209 9 rr_1ajf 1
stop_
save_
save_CNS/XPLOR_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_2_1
_Distance_constraint_list.Entry_ID rr_1ajf
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Details "Generated by Wattos"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 2
loop_
_Distance_constraint_software.Software_ID
_Distance_constraint_software.Software_label
_Distance_constraint_software.Method_ID
_Distance_constraint_software.Method_label
_Distance_constraint_software.Entry_ID
_Distance_constraint_software.Distance_constraint_list_ID
. . . . rr_1ajf 2
stop_
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . rr_1ajf 2
2 1 . . . rr_1ajf 2
3 1 . . . rr_1ajf 2
4 1 . . . rr_1ajf 2
5 1 . . . rr_1ajf 2
6 1 . . . rr_1ajf 2
7 1 . . . rr_1ajf 2
8 1 . . . rr_1ajf 2
9 1 . . . rr_1ajf 2
10 1 . . . rr_1ajf 2
11 1 . . . rr_1ajf 2
12 1 . . . rr_1ajf 2
13 1 . . . rr_1ajf 2
14 1 . . . rr_1ajf 2
15 1 . . . rr_1ajf 2
16 1 . . . rr_1ajf 2
17 1 . . . rr_1ajf 2
18 1 . . . rr_1ajf 2
19 1 . . . rr_1ajf 2
20 1 . . . rr_1ajf 2
21 1 . . . rr_1ajf 2
22 1 . . . rr_1ajf 2
23 1 . . . rr_1ajf 2
24 1 . . . rr_1ajf 2
25 1 . . . rr_1ajf 2
26 1 . . . rr_1ajf 2
27 1 . . . rr_1ajf 2
28 1 . . . rr_1ajf 2
29 1 . . . rr_1ajf 2
30 1 . . . rr_1ajf 2
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Contribution_fractional_val
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Assembly_atom_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Seq_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Atom_type
_Dist_constraint.Atom_isotope_number
_Dist_constraint.Resonance_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_entity_assembly_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 . 1 . 1 1 18 18 C H41 H . . . . 18 . H41 rr_1ajf 2
1 1 . 2 . 1 1 1 1 G O6 O . . . . 1 . O6 rr_1ajf 2
2 1 . 1 . 1 1 18 18 C N3 N . . . . 18 . N3 rr_1ajf 2
2 1 . 2 . 1 1 1 1 G H21 H . . . . 1 . H21 rr_1ajf 2
3 1 . 1 . 1 1 18 18 C O2 O . . . . 18 . O2 rr_1ajf 2
3 1 . 2 . 1 1 1 1 G H21 H . . . . 1 . H21 rr_1ajf 2
4 1 . 1 . 1 1 18 18 C N3 N . . . . 18 . N3 rr_1ajf 2
4 1 . 2 . 1 1 1 1 G H1 H . . . . 1 . H1 rr_1ajf 2
5 1 . 1 . 1 1 2 2 A H2 H . . . . 2 . H2 rr_1ajf 2
5 1 . 2 . 1 1 17 17 U O2 O . . . . 17 . O2 rr_1ajf 2
6 1 . 1 . 1 1 2 2 A N1 N . . . . 2 . N1 rr_1ajf 2
6 1 . 2 . 1 1 17 17 U H3 H . . . . 17 . H3 rr_1ajf 2
7 1 . 1 . 1 1 2 2 A H61 H . . . . 2 . H61 rr_1ajf 2
7 1 . 2 . 1 1 17 17 U O4 O . . . . 17 . O4 rr_1ajf 2
8 1 . 1 . 1 1 2 2 A H2 H . . . . 2 . H2 rr_1ajf 2
8 1 . 2 . 1 1 17 17 U H3 H . . . . 17 . H3 rr_1ajf 2
9 1 . 1 . 1 1 3 3 C H41 H . . . . 3 . H41 rr_1ajf 2
9 1 . 2 . 1 1 16 16 G O6 O . . . . 16 . O6 rr_1ajf 2
10 1 . 1 . 1 1 3 3 C N3 N . . . . 3 . N3 rr_1ajf 2
10 1 . 2 . 1 1 16 16 G H21 H . . . . 16 . H21 rr_1ajf 2
11 1 . 1 . 1 1 3 3 C O2 O . . . . 3 . O2 rr_1ajf 2
11 1 . 2 . 1 1 16 16 G H21 H . . . . 16 . H21 rr_1ajf 2
12 1 . 1 . 1 1 3 3 C N3 N . . . . 3 . N3 rr_1ajf 2
12 1 . 2 . 1 1 16 16 G H1 H . . . . 16 . H1 rr_1ajf 2
13 1 . 1 . 1 1 4 4 A H2 H . . . . 4 . H2 rr_1ajf 2
13 1 . 2 . 1 1 15 15 U O2 O . . . . 15 . O2 rr_1ajf 2
14 1 . 1 . 1 1 4 4 A N1 N . . . . 4 . N1 rr_1ajf 2
14 1 . 2 . 1 1 15 15 U H3 H . . . . 15 . H3 rr_1ajf 2
15 1 . 1 . 1 1 4 4 A H61 H . . . . 4 . H61 rr_1ajf 2
15 1 . 2 . 1 1 15 15 U O4 O . . . . 15 . O4 rr_1ajf 2
16 1 . 1 . 1 1 4 4 A H2 H . . . . 4 . H2 rr_1ajf 2
16 1 . 2 . 1 1 15 15 U H3 H . . . . 15 . H3 rr_1ajf 2
17 1 . 1 . 1 1 14 14 U O2 O . . . . 14 . O2 rr_1ajf 2
17 1 . 2 . 1 1 5 5 G H1 H . . . . 5 . H1 rr_1ajf 2
18 1 . 1 . 1 1 14 14 U H3 H . . . . 14 . H3 rr_1ajf 2
18 1 . 2 . 1 1 5 5 G H1 H . . . . 5 . H1 rr_1ajf 2
19 1 . 1 . 1 1 14 14 U H3 H . . . . 14 . H3 rr_1ajf 2
19 1 . 2 . 1 1 5 5 G O6 O . . . . 5 . O6 rr_1ajf 2
20 1 . 1 . 1 1 14 14 U O2 O . . . . 14 . O2 rr_1ajf 2
20 1 . 2 . 1 1 5 5 G O6 O . . . . 5 . O6 rr_1ajf 2
21 1 . 1 . 1 1 14 14 U N3 N . . . . 14 . N3 rr_1ajf 2
21 1 . 2 . 1 1 5 5 G N1 N . . . . 5 . N1 rr_1ajf 2
22 1 . 1 . 1 1 13 13 U O2 O . . . . 13 . O2 rr_1ajf 2
22 1 . 2 . 1 1 6 6 G H1 H . . . . 6 . H1 rr_1ajf 2
23 1 . 1 . 1 1 13 13 U H3 H . . . . 13 . H3 rr_1ajf 2
23 1 . 2 . 1 1 6 6 G H1 H . . . . 6 . H1 rr_1ajf 2
24 1 . 1 . 1 1 13 13 U H3 H . . . . 13 . H3 rr_1ajf 2
24 1 . 2 . 1 1 6 6 G O6 O . . . . 6 . O6 rr_1ajf 2
25 1 . 1 . 1 1 13 13 U O2 O . . . . 13 . O2 rr_1ajf 2
25 1 . 2 . 1 1 6 6 G O6 O . . . . 6 . O6 rr_1ajf 2
26 1 . 1 . 1 1 13 13 U N3 N . . . . 13 . N3 rr_1ajf 2
26 1 . 2 . 1 1 6 6 G N1 N . . . . 6 . N1 rr_1ajf 2
27 1 . 1 . 1 1 12 12 C H41 H . . . . 12 . H41 rr_1ajf 2
27 1 . 2 . 1 1 7 7 G O6 O . . . . 7 . O6 rr_1ajf 2
28 1 . 1 . 1 1 12 12 C N3 N . . . . 12 . N3 rr_1ajf 2
28 1 . 2 . 1 1 7 7 G H21 H . . . . 7 . H21 rr_1ajf 2
29 1 . 1 . 1 1 12 12 C O2 O . . . . 12 . O2 rr_1ajf 2
29 1 . 2 . 1 1 7 7 G H21 H . . . . 7 . H21 rr_1ajf 2
30 1 . 1 . 1 1 12 12 C N3 N . . . . 12 . N3 rr_1ajf 2
30 1 . 2 . 1 1 7 7 G H1 H . . . . 7 . H1 rr_1ajf 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Spectral_peak_list_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . 1.7 1.6 1.8 rr_1ajf 2
2 1 . . . . . . 3.0 2.9 3.1 rr_1ajf 2
3 1 . . . . . . 2.0 1.9 2.1 rr_1ajf 2
4 1 . . . . . . 1.9 1.8 2.0 rr_1ajf 2
5 1 . . . . . . 3.2 3.1 3.3 rr_1ajf 2
6 1 . . . . . . 1.9 1.8 2.0 rr_1ajf 2
7 1 . . . . . . 1.8 1.7 1.9 rr_1ajf 2
8 1 . . . . . . 2.9 2.8 3.0 rr_1ajf 2
9 1 . . . . . . 1.7 1.6 1.8 rr_1ajf 2
10 1 . . . . . . 3.0 2.9 3.1 rr_1ajf 2
11 1 . . . . . . 2.0 1.9 2.1 rr_1ajf 2
12 1 . . . . . . 1.9 1.8 2.0 rr_1ajf 2
13 1 . . . . . . 3.2 3.1 3.3 rr_1ajf 2
14 1 . . . . . . 1.9 1.8 2.0 rr_1ajf 2
15 1 . . . . . . 1.8 1.7 1.9 rr_1ajf 2
16 1 . . . . . . 2.9 2.8 3.0 rr_1ajf 2
17 1 . . . . . . 1.8 1.7 1.9 rr_1ajf 2
18 1 . . . . . . 2.6 2.5 2.7 rr_1ajf 2
19 1 . . . . . . 1.9 1.8 2.0 rr_1ajf 2
20 1 . . . . . . 3.7 3.6 3.8 rr_1ajf 2
21 1 . . . . . . 3.7 3.6 3.8 rr_1ajf 2
22 1 . . . . . . 1.8 1.7 1.9 rr_1ajf 2
23 1 . . . . . . 2.6 2.5 2.7 rr_1ajf 2
24 1 . . . . . . 1.9 1.8 2.0 rr_1ajf 2
25 1 . . . . . . 3.7 3.6 3.8 rr_1ajf 2
26 1 . . . . . . 3.7 3.6 3.8 rr_1ajf 2
27 1 . . . . . . 1.7 1.6 1.8 rr_1ajf 2
28 1 . . . . . . 3.0 2.9 3.1 rr_1ajf 2
29 1 . . . . . . 2.0 1.9 2.1 rr_1ajf 2
30 1 . . . . . . 1.9 1.8 2.0 rr_1ajf 2
stop_
loop_
_Dist_constraint_comment_org.ID
_Dist_constraint_comment_org.Comment_text
_Dist_constraint_comment_org.Comment_begin_line
_Dist_constraint_comment_org.Comment_begin_column
_Dist_constraint_comment_org.Comment_end_line
_Dist_constraint_comment_org.Comment_end_column
_Dist_constraint_comment_org.Entry_ID
_Dist_constraint_comment_org.Distance_constraint_list_ID
1 "STEM BASE PAIRING - based on standard H-bond distances" 1 1 1 1 rr_1ajf 2
2 "base pair G1-C18" 3 9 3 9 rr_1ajf 2
3 "base pair A2-U17" 9 9 9 9 rr_1ajf 2
4 "base pair C3-G16" 15 9 15 9 rr_1ajf 2
5 "base pair A4-U15" 21 9 21 9 rr_1ajf 2
6 "base pair G5-U14" 27 9 27 9 rr_1ajf 2
7 "base pair G6-U13" 34 9 34 9 rr_1ajf 2
8 "base pair G7-C12" 41 9 41 9 rr_1ajf 2
stop_
save_
save_CNS/XPLOR_dihedral_5
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_5
_Torsion_angle_constraint_list.Entry_ID rr_1ajf
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Details "Generated by Wattos"
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 5
loop_
_Torsion_angle_constraint_software.Software_ID
_Torsion_angle_constraint_software.Software_label
_Torsion_angle_constraint_software.Method_ID
_Torsion_angle_constraint_software.Method_label
_Torsion_angle_constraint_software.Entry_ID
_Torsion_angle_constraint_software.Torsion_angle_constraint_list_ID
. . . . rr_1ajf 1
stop_
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Atom_type_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Atom_type_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Atom_type_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Atom_type_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.PDB_record_ID_1
_Torsion_angle_constraint.PDB_model_num_1
_Torsion_angle_constraint.PDB_strand_ID_1
_Torsion_angle_constraint.PDB_ins_code_1
_Torsion_angle_constraint.PDB_residue_no_1
_Torsion_angle_constraint.PDB_residue_name_1
_Torsion_angle_constraint.PDB_atom_name_1
_Torsion_angle_constraint.PDB_record_ID_2
_Torsion_angle_constraint.PDB_model_num_2
_Torsion_angle_constraint.PDB_strand_ID_2
_Torsion_angle_constraint.PDB_ins_code_2
_Torsion_angle_constraint.PDB_residue_no_2
_Torsion_angle_constraint.PDB_residue_name_2
_Torsion_angle_constraint.PDB_atom_name_2
_Torsion_angle_constraint.PDB_record_ID_3
_Torsion_angle_constraint.PDB_model_num_3
_Torsion_angle_constraint.PDB_strand_ID_3
_Torsion_angle_constraint.PDB_ins_code_3
_Torsion_angle_constraint.PDB_residue_no_3
_Torsion_angle_constraint.PDB_residue_name_3
_Torsion_angle_constraint.PDB_atom_name_3
_Torsion_angle_constraint.PDB_record_ID_4
_Torsion_angle_constraint.PDB_model_num_4
_Torsion_angle_constraint.PDB_strand_ID_4
_Torsion_angle_constraint.PDB_ins_code_4
_Torsion_angle_constraint.PDB_residue_no_4
_Torsion_angle_constraint.PDB_residue_name_4
_Torsion_angle_constraint.PDB_atom_name_4
_Torsion_angle_constraint.Auth_entity_assembly_ID_1
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_chain_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_alt_ID_1
_Torsion_angle_constraint.Auth_atom_name_1
_Torsion_angle_constraint.Auth_entity_assembly_ID_2
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_chain_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_alt_ID_2
_Torsion_angle_constraint.Auth_atom_name_2
_Torsion_angle_constraint.Auth_entity_assembly_ID_3
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_chain_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_alt_ID_3
_Torsion_angle_constraint.Auth_atom_name_3
_Torsion_angle_constraint.Auth_entity_assembly_ID_4
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_chain_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Auth_alt_ID_4
_Torsion_angle_constraint.Auth_atom_name_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . 1 1 1 1 G H22 H . . 1 1 1 1 G N2 N . . 1 1 1 1 G C2 C . . 1 1 1 1 G N3 N . -5.0 5.0 . . . A . 1 G H22 . . A . 1 G N2 . . A . 1 G C2 . . A . 1 G N3 . . . 1 . H22 . . . . . 1 . N2 . . . . . 1 . C2 . . . . . 1 . N3 . . rr_1ajf 1
2 . . 1 1 5 5 G H22 H . . 1 1 5 5 G N2 N . . 1 1 5 5 G C2 C . . 1 1 5 5 G N3 N . -5.0 5.0 . . . A . 5 G H22 . . A . 5 G N2 . . A . 5 G C2 . . A . 5 G N3 . . . 5 . H22 . . . . . 5 . N2 . . . . . 5 . C2 . . . . . 5 . N3 . . rr_1ajf 1
3 . . 1 1 6 6 G H22 H . . 1 1 6 6 G N2 N . . 1 1 6 6 G C2 C . . 1 1 6 6 G N3 N . -5.0 5.0 . . . A . 6 G H22 . . A . 6 G N2 . . A . 6 G C2 . . A . 6 G N3 . . . 6 . H22 . . . . . 6 . N2 . . . . . 6 . C2 . . . . . 6 . N3 . . rr_1ajf 1
4 . . 1 1 7 7 G H22 H . . 1 1 7 7 G N2 N . . 1 1 7 7 G C2 C . . 1 1 7 7 G N3 N . -5.0 5.0 . . . A . 7 G H22 . . A . 7 G N2 . . A . 7 G C2 . . A . 7 G N3 . . . 7 . H22 . . . . . 7 . N2 . . . . . 7 . C2 . . . . . 7 . N3 . . rr_1ajf 1
5 . . 1 1 8 8 G H22 H . . 1 1 8 8 G N2 N . . 1 1 8 8 G C2 C . . 1 1 8 8 G N3 N . -5.0 5.0 . . . A . 8 G H22 . . A . 8 G N2 . . A . 8 G C2 . . A . 8 G N3 . . . 8 . H22 . . . . . 8 . N2 . . . . . 8 . C2 . . . . . 8 . N3 . . rr_1ajf 1
6 . . 1 1 16 16 G H22 H . . 1 1 16 16 G N2 N . . 1 1 16 16 G C2 C . . 1 1 16 16 G N3 N . -5.0 5.0 . . . A . 16 G H22 . . A . 16 G N2 . . A . 16 G C2 . . A . 16 G N3 . . . 16 . H22 . . . . . 16 . N2 . . . . . 16 . C2 . . . . . 16 . N3 . . rr_1ajf 1
7 . . 1 1 3 3 C H42 H . . 1 1 3 3 C N4 N . . 1 1 3 3 C C4 C . . 1 1 3 3 C C5 C . -5.0 5.0 . . . A . 3 C H42 . . A . 3 C N4 . . A . 3 C C4 . . A . 3 C C5 . . . 3 . H42 . . . . . 3 . N4 . . . . . 3 . C4 . . . . . 3 . C5 . . rr_1ajf 1
8 . . 1 1 12 12 C H42 H . . 1 1 12 12 C N4 N . . 1 1 12 12 C C4 C . . 1 1 12 12 C C5 C . -5.0 5.0 . . . A . 12 C H42 . . A . 12 C N4 . . A . 12 C C4 . . A . 12 C C5 . . . 12 . H42 . . . . . 12 . N4 . . . . . 12 . C4 . . . . . 12 . C5 . . rr_1ajf 1
9 . . 1 1 18 18 C H42 H . . 1 1 18 18 C N4 N . . 1 1 18 18 C C4 C . . 1 1 18 18 C C5 C . -5.0 5.0 . . . A . 18 C H42 . . A . 18 C N4 . . A . 18 C C4 . . A . 18 C C5 . . . 18 . H42 . . . . . 18 . N4 . . . . . 18 . C4 . . . . . 18 . C5 . . rr_1ajf 1
10 . . 1 1 2 2 A H62 H . . 1 1 2 2 A N6 N . . 1 1 2 2 A C6 C . . 1 1 2 2 A C5 C . -5.0 5.0 . . . A . 2 A H62 . . A . 2 A N6 . . A . 2 A C6 . . A . 2 A C5 . . . 2 . H62 . . . . . 2 . N6 . . . . . 2 . C6 . . . . . 2 . C5 . . rr_1ajf 1
11 . . 1 1 4 4 A H62 H . . 1 1 4 4 A N6 N . . 1 1 4 4 A C6 C . . 1 1 4 4 A C5 C . -5.0 5.0 . . . A . 4 A H62 . . A . 4 A N6 . . A . 4 A C6 . . A . 4 A C5 . . . 4 . H62 . . . . . 4 . N6 . . . . . 4 . C6 . . . . . 4 . C5 . . rr_1ajf 1
12 . . 1 1 9 9 A H62 H . . 1 1 9 9 A N6 N . . 1 1 9 9 A C6 C . . 1 1 9 9 A C5 C . -5.0 5.0 . . . A . 9 A H62 . . A . 9 A N6 . . A . 9 A C6 . . A . 9 A C5 . . . 9 . H62 . . . . . 9 . N6 . . . . . 9 . C6 . . . . . 9 . C5 . . rr_1ajf 1
13 . . 1 1 10 10 A H62 H . . 1 1 10 10 A N6 N . . 1 1 10 10 A C6 C . . 1 1 10 10 A C5 C . -5.0 5.0 . . . A . 10 A H62 . . A . 10 A N6 . . A . 10 A C6 . . A . 10 A C5 . . . 10 . H62 . . . . . 10 . N6 . . . . . 10 . C6 . . . . . 10 . C5 . . rr_1ajf 1
14 . . 1 1 11 11 A H62 H . . 1 1 11 11 A N6 N . . 1 1 11 11 A C6 C . . 1 1 11 11 A C5 C . -5.0 5.0 . . . A . 11 A H62 . . A . 11 A N6 . . A . 11 A C6 . . A . 11 A C5 . . . 11 . H62 . . . . . 11 . N6 . . . . . 11 . C6 . . . . . 11 . C5 . . rr_1ajf 1
15 . . 1 1 2 2 A C4' C . . 1 1 2 2 A O4' O . . 1 1 2 2 A C1' C . . 1 1 2 2 A C2' C . -5.0 5.0 . . . A . 2 A C4' . . A . 2 A O4' . . A . 2 A C1' . . A . 2 A C2' . . . 2 . C4' . . . . . 2 . O4' . . . . . 2 . C1' . . . . . 2 . C2' . . rr_1ajf 1
16 . . 1 1 2 2 A O4' O . . 1 1 2 2 A C1' C . . 1 1 2 2 A C2' C . . 1 1 2 2 A C3' C . -27.0 -17.0 . . . A . 2 A O4' . . A . 2 A C1' . . A . 2 A C2' . . A . 2 A C3' . . . 2 . O4' . . . . . 2 . C1' . . . . . 2 . C2' . . . . . 2 . C3' . . rr_1ajf 1
17 . . 1 1 2 2 A C1' C . . 1 1 2 2 A C2' C . . 1 1 2 2 A C3' C . . 1 1 2 2 A C4' C . 31.0 41.0 . . . A . 2 A C1' . . A . 2 A C2' . . A . 2 A C3' . . A . 2 A C4' . . . 2 . C1' . . . . . 2 . C2' . . . . . 2 . C3' . . . . . 2 . C4' . . rr_1ajf 1
18 . . 1 1 2 2 A C2' C . . 1 1 2 2 A C3' C . . 1 1 2 2 A C4' C . . 1 1 2 2 A O4' O . -41.0 -31.0 . . . A . 2 A C2' . . A . 2 A C3' . . A . 2 A C4' . . A . 2 A O4' . . . 2 . C2' . . . . . 2 . C3' . . . . . 2 . C4' . . . . . 2 . O4' . . rr_1ajf 1
19 . . 1 1 3 3 C C4' C . . 1 1 3 3 C O4' O . . 1 1 3 3 C C1' C . . 1 1 3 3 C C2' C . -5.0 5.0 . . . A . 3 C C4' . . A . 3 C O4' . . A . 3 C C1' . . A . 3 C C2' . . . 3 . C4' . . . . . 3 . O4' . . . . . 3 . C1' . . . . . 3 . C2' . . rr_1ajf 1
20 . . 1 1 3 3 C O4' O . . 1 1 3 3 C C1' C . . 1 1 3 3 C C2' C . . 1 1 3 3 C C3' C . -27.0 -17.0 . . . A . 3 C O4' . . A . 3 C C1' . . A . 3 C C2' . . A . 3 C C3' . . . 3 . O4' . . . . . 3 . C1' . . . . . 3 . C2' . . . . . 3 . C3' . . rr_1ajf 1
21 . . 1 1 3 3 C C1' C . . 1 1 3 3 C C2' C . . 1 1 3 3 C C3' C . . 1 1 3 3 C C4' C . 31.0 41.0 . . . A . 3 C C1' . . A . 3 C C2' . . A . 3 C C3' . . A . 3 C C4' . . . 3 . C1' . . . . . 3 . C2' . . . . . 3 . C3' . . . . . 3 . C4' . . rr_1ajf 1
22 . . 1 1 3 3 C C2' C . . 1 1 3 3 C C3' C . . 1 1 3 3 C C4' C . . 1 1 3 3 C O4' O . -41.0 -31.0 . . . A . 3 C C2' . . A . 3 C C3' . . A . 3 C C4' . . A . 3 C O4' . . . 3 . C2' . . . . . 3 . C3' . . . . . 3 . C4' . . . . . 3 . O4' . . rr_1ajf 1
23 . . 1 1 4 4 A C4' C . . 1 1 4 4 A O4' O . . 1 1 4 4 A C1' C . . 1 1 4 4 A C2' C . -5.0 5.0 . . . A . 4 A C4' . . A . 4 A O4' . . A . 4 A C1' . . A . 4 A C2' . . . 4 . C4' . . . . . 4 . O4' . . . . . 4 . C1' . . . . . 4 . C2' . . rr_1ajf 1
24 . . 1 1 4 4 A O4' O . . 1 1 4 4 A C1' C . . 1 1 4 4 A C2' C . . 1 1 4 4 A C3' C . -27.0 -17.0 . . . A . 4 A O4' . . A . 4 A C1' . . A . 4 A C2' . . A . 4 A C3' . . . 4 . O4' . . . . . 4 . C1' . . . . . 4 . C2' . . . . . 4 . C3' . . rr_1ajf 1
25 . . 1 1 4 4 A C1' C . . 1 1 4 4 A C2' C . . 1 1 4 4 A C3' C . . 1 1 4 4 A C4' C . 31.0 41.0 . . . A . 4 A C1' . . A . 4 A C2' . . A . 4 A C3' . . A . 4 A C4' . . . 4 . C1' . . . . . 4 . C2' . . . . . 4 . C3' . . . . . 4 . C4' . . rr_1ajf 1
26 . . 1 1 4 4 A C2' C . . 1 1 4 4 A C3' C . . 1 1 4 4 A C4' C . . 1 1 4 4 A O4' O . -41.0 -31.0 . . . A . 4 A C2' . . A . 4 A C3' . . A . 4 A C4' . . A . 4 A O4' . . . 4 . C2' . . . . . 4 . C3' . . . . . 4 . C4' . . . . . 4 . O4' . . rr_1ajf 1
27 . . 1 1 5 5 G C4' C . . 1 1 5 5 G O4' O . . 1 1 5 5 G C1' C . . 1 1 5 5 G C2' C . -5.0 5.0 . . . A . 5 G C4' . . A . 5 G O4' . . A . 5 G C1' . . A . 5 G C2' . . . 5 . C4' . . . . . 5 . O4' . . . . . 5 . C1' . . . . . 5 . C2' . . rr_1ajf 1
28 . . 1 1 5 5 G O4' O . . 1 1 5 5 G C1' C . . 1 1 5 5 G C2' C . . 1 1 5 5 G C3' C . -27.0 -17.0 . . . A . 5 G O4' . . A . 5 G C1' . . A . 5 G C2' . . A . 5 G C3' . . . 5 . O4' . . . . . 5 . C1' . . . . . 5 . C2' . . . . . 5 . C3' . . rr_1ajf 1
29 . . 1 1 5 5 G C1' C . . 1 1 5 5 G C2' C . . 1 1 5 5 G C3' C . . 1 1 5 5 G C4' C . 31.0 41.0 . . . A . 5 G C1' . . A . 5 G C2' . . A . 5 G C3' . . A . 5 G C4' . . . 5 . C1' . . . . . 5 . C2' . . . . . 5 . C3' . . . . . 5 . C4' . . rr_1ajf 1
30 . . 1 1 5 5 G C2' C . . 1 1 5 5 G C3' C . . 1 1 5 5 G C4' C . . 1 1 5 5 G O4' O . -41.0 -31.0 . . . A . 5 G C2' . . A . 5 G C3' . . A . 5 G C4' . . A . 5 G O4' . . . 5 . C2' . . . . . 5 . C3' . . . . . 5 . C4' . . . . . 5 . O4' . . rr_1ajf 1
31 . . 1 1 6 6 G C4' C . . 1 1 6 6 G O4' O . . 1 1 6 6 G C1' C . . 1 1 6 6 G C2' C . -5.0 5.0 . . . A . 6 G C4' . . A . 6 G O4' . . A . 6 G C1' . . A . 6 G C2' . . . 6 . C4' . . . . . 6 . O4' . . . . . 6 . C1' . . . . . 6 . C2' . . rr_1ajf 1
32 . . 1 1 6 6 G O4' O . . 1 1 6 6 G C1' C . . 1 1 6 6 G C2' C . . 1 1 6 6 G C3' C . -27.0 -17.0 . . . A . 6 G O4' . . A . 6 G C1' . . A . 6 G C2' . . A . 6 G C3' . . . 6 . O4' . . . . . 6 . C1' . . . . . 6 . C2' . . . . . 6 . C3' . . rr_1ajf 1
33 . . 1 1 6 6 G C1' C . . 1 1 6 6 G C2' C . . 1 1 6 6 G C3' C . . 1 1 6 6 G C4' C . 31.0 41.0 . . . A . 6 G C1' . . A . 6 G C2' . . A . 6 G C3' . . A . 6 G C4' . . . 6 . C1' . . . . . 6 . C2' . . . . . 6 . C3' . . . . . 6 . C4' . . rr_1ajf 1
34 . . 1 1 6 6 G C2' C . . 1 1 6 6 G C3' C . . 1 1 6 6 G C4' C . . 1 1 6 6 G O4' O . -41.0 -31.0 . . . A . 6 G C2' . . A . 6 G C3' . . A . 6 G C4' . . A . 6 G O4' . . . 6 . C2' . . . . . 6 . C3' . . . . . 6 . C4' . . . . . 6 . O4' . . rr_1ajf 1
35 . . 1 1 7 7 G C4' C . . 1 1 7 7 G O4' O . . 1 1 7 7 G C1' C . . 1 1 7 7 G C2' C . -5.0 5.0 . . . A . 7 G C4' . . A . 7 G O4' . . A . 7 G C1' . . A . 7 G C2' . . . 7 . C4' . . . . . 7 . O4' . . . . . 7 . C1' . . . . . 7 . C2' . . rr_1ajf 1
36 . . 1 1 7 7 G O4' O . . 1 1 7 7 G C1' C . . 1 1 7 7 G C2' C . . 1 1 7 7 G C3' C . -27.0 -17.0 . . . A . 7 G O4' . . A . 7 G C1' . . A . 7 G C2' . . A . 7 G C3' . . . 7 . O4' . . . . . 7 . C1' . . . . . 7 . C2' . . . . . 7 . C3' . . rr_1ajf 1
37 . . 1 1 7 7 G C1' C . . 1 1 7 7 G C2' C . . 1 1 7 7 G C3' C . . 1 1 7 7 G C4' C . 31.0 41.0 . . . A . 7 G C1' . . A . 7 G C2' . . A . 7 G C3' . . A . 7 G C4' . . . 7 . C1' . . . . . 7 . C2' . . . . . 7 . C3' . . . . . 7 . C4' . . rr_1ajf 1
38 . . 1 1 7 7 G C2' C . . 1 1 7 7 G C3' C . . 1 1 7 7 G C4' C . . 1 1 7 7 G O4' O . -41.0 -31.0 . . . A . 7 G C2' . . A . 7 G C3' . . A . 7 G C4' . . A . 7 G O4' . . . 7 . C2' . . . . . 7 . C3' . . . . . 7 . C4' . . . . . 7 . O4' . . rr_1ajf 1
39 . . 1 1 8 8 G C4' C . . 1 1 8 8 G O4' O . . 1 1 8 8 G C1' C . . 1 1 8 8 G C2' C . -5.0 5.0 . . . A . 8 G C4' . . A . 8 G O4' . . A . 8 G C1' . . A . 8 G C2' . . . 8 . C4' . . . . . 8 . O4' . . . . . 8 . C1' . . . . . 8 . C2' . . rr_1ajf 1
40 . . 1 1 8 8 G O4' O . . 1 1 8 8 G C1' C . . 1 1 8 8 G C2' C . . 1 1 8 8 G C3' C . -27.0 -17.0 . . . A . 8 G O4' . . A . 8 G C1' . . A . 8 G C2' . . A . 8 G C3' . . . 8 . O4' . . . . . 8 . C1' . . . . . 8 . C2' . . . . . 8 . C3' . . rr_1ajf 1
41 . . 1 1 8 8 G C1' C . . 1 1 8 8 G C2' C . . 1 1 8 8 G C3' C . . 1 1 8 8 G C4' C . 31.0 41.0 . . . A . 8 G C1' . . A . 8 G C2' . . A . 8 G C3' . . A . 8 G C4' . . . 8 . C1' . . . . . 8 . C2' . . . . . 8 . C3' . . . . . 8 . C4' . . rr_1ajf 1
42 . . 1 1 8 8 G C2' C . . 1 1 8 8 G C3' C . . 1 1 8 8 G C4' C . . 1 1 8 8 G O4' O . -41.0 -31.0 . . . A . 8 G C2' . . A . 8 G C3' . . A . 8 G C4' . . A . 8 G O4' . . . 8 . C2' . . . . . 8 . C3' . . . . . 8 . C4' . . . . . 8 . O4' . . rr_1ajf 1
43 . . 1 1 9 9 A C4' C . . 1 1 9 9 A O4' O . . 1 1 9 9 A C1' C . . 1 1 9 9 A C2' C . -5.0 5.0 . . . A . 9 A C4' . . A . 9 A O4' . . A . 9 A C1' . . A . 9 A C2' . . . 9 . C4' . . . . . 9 . O4' . . . . . 9 . C1' . . . . . 9 . C2' . . rr_1ajf 1
44 . . 1 1 9 9 A O4' O . . 1 1 9 9 A C1' C . . 1 1 9 9 A C2' C . . 1 1 9 9 A C3' C . -27.0 -17.0 . . . A . 9 A O4' . . A . 9 A C1' . . A . 9 A C2' . . A . 9 A C3' . . . 9 . O4' . . . . . 9 . C1' . . . . . 9 . C2' . . . . . 9 . C3' . . rr_1ajf 1
45 . . 1 1 9 9 A C1' C . . 1 1 9 9 A C2' C . . 1 1 9 9 A C3' C . . 1 1 9 9 A C4' C . 31.0 41.0 . . . A . 9 A C1' . . A . 9 A C2' . . A . 9 A C3' . . A . 9 A C4' . . . 9 . C1' . . . . . 9 . C2' . . . . . 9 . C3' . . . . . 9 . C4' . . rr_1ajf 1
46 . . 1 1 9 9 A C2' C . . 1 1 9 9 A C3' C . . 1 1 9 9 A C4' C . . 1 1 9 9 A O4' O . -41.0 -31.0 . . . A . 9 A C2' . . A . 9 A C3' . . A . 9 A C4' . . A . 9 A O4' . . . 9 . C2' . . . . . 9 . C3' . . . . . 9 . C4' . . . . . 9 . O4' . . rr_1ajf 1
47 . . 1 1 10 10 A C4' C . . 1 1 10 10 A O4' O . . 1 1 10 10 A C1' C . . 1 1 10 10 A C2' C . -5.0 5.0 . . . A . 10 A C4' . . A . 10 A O4' . . A . 10 A C1' . . A . 10 A C2' . . . 10 . C4' . . . . . 10 . O4' . . . . . 10 . C1' . . . . . 10 . C2' . . rr_1ajf 1
48 . . 1 1 10 10 A O4' O . . 1 1 10 10 A C1' C . . 1 1 10 10 A C2' C . . 1 1 10 10 A C3' C . -27.0 -17.0 . . . A . 10 A O4' . . A . 10 A C1' . . A . 10 A C2' . . A . 10 A C3' . . . 10 . O4' . . . . . 10 . C1' . . . . . 10 . C2' . . . . . 10 . C3' . . rr_1ajf 1
49 . . 1 1 10 10 A C1' C . . 1 1 10 10 A C2' C . . 1 1 10 10 A C3' C . . 1 1 10 10 A C4' C . 31.0 41.0 . . . A . 10 A C1' . . A . 10 A C2' . . A . 10 A C3' . . A . 10 A C4' . . . 10 . C1' . . . . . 10 . C2' . . . . . 10 . C3' . . . . . 10 . C4' . . rr_1ajf 1
50 . . 1 1 10 10 A C2' C . . 1 1 10 10 A C3' C . . 1 1 10 10 A C4' C . . 1 1 10 10 A O4' O . -41.0 -31.0 . . . A . 10 A C2' . . A . 10 A C3' . . A . 10 A C4' . . A . 10 A O4' . . . 10 . C2' . . . . . 10 . C3' . . . . . 10 . C4' . . . . . 10 . O4' . . rr_1ajf 1
51 . . 1 1 11 11 A C4' C . . 1 1 11 11 A O4' O . . 1 1 11 11 A C1' C . . 1 1 11 11 A C2' C . -5.0 5.0 . . . A . 11 A C4' . . A . 11 A O4' . . A . 11 A C1' . . A . 11 A C2' . . . 11 . C4' . . . . . 11 . O4' . . . . . 11 . C1' . . . . . 11 . C2' . . rr_1ajf 1
52 . . 1 1 11 11 A O4' O . . 1 1 11 11 A C1' C . . 1 1 11 11 A C2' C . . 1 1 11 11 A C3' C . -27.0 -17.0 . . . A . 11 A O4' . . A . 11 A C1' . . A . 11 A C2' . . A . 11 A C3' . . . 11 . O4' . . . . . 11 . C1' . . . . . 11 . C2' . . . . . 11 . C3' . . rr_1ajf 1
53 . . 1 1 11 11 A C1' C . . 1 1 11 11 A C2' C . . 1 1 11 11 A C3' C . . 1 1 11 11 A C4' C . 31.0 41.0 . . . A . 11 A C1' . . A . 11 A C2' . . A . 11 A C3' . . A . 11 A C4' . . . 11 . C1' . . . . . 11 . C2' . . . . . 11 . C3' . . . . . 11 . C4' . . rr_1ajf 1
54 . . 1 1 11 11 A C2' C . . 1 1 11 11 A C3' C . . 1 1 11 11 A C4' C . . 1 1 11 11 A O4' O . -41.0 -31.0 . . . A . 11 A C2' . . A . 11 A C3' . . A . 11 A C4' . . A . 11 A O4' . . . 11 . C2' . . . . . 11 . C3' . . . . . 11 . C4' . . . . . 11 . O4' . . rr_1ajf 1
55 . . 1 1 12 12 C C4' C . . 1 1 12 12 C O4' O . . 1 1 12 12 C C1' C . . 1 1 12 12 C C2' C . -5.0 5.0 . . . A . 12 C C4' . . A . 12 C O4' . . A . 12 C C1' . . A . 12 C C2' . . . 12 . C4' . . . . . 12 . O4' . . . . . 12 . C1' . . . . . 12 . C2' . . rr_1ajf 1
56 . . 1 1 12 12 C O4' O . . 1 1 12 12 C C1' C . . 1 1 12 12 C C2' C . . 1 1 12 12 C C3' C . -27.0 -17.0 . . . A . 12 C O4' . . A . 12 C C1' . . A . 12 C C2' . . A . 12 C C3' . . . 12 . O4' . . . . . 12 . C1' . . . . . 12 . C2' . . . . . 12 . C3' . . rr_1ajf 1
57 . . 1 1 12 12 C C1' C . . 1 1 12 12 C C2' C . . 1 1 12 12 C C3' C . . 1 1 12 12 C C4' C . 31.0 41.0 . . . A . 12 C C1' . . A . 12 C C2' . . A . 12 C C3' . . A . 12 C C4' . . . 12 . C1' . . . . . 12 . C2' . . . . . 12 . C3' . . . . . 12 . C4' . . rr_1ajf 1
58 . . 1 1 12 12 C C2' C . . 1 1 12 12 C C3' C . . 1 1 12 12 C C4' C . . 1 1 12 12 C O4' O . -41.0 -31.0 . . . A . 12 C C2' . . A . 12 C C3' . . A . 12 C C4' . . A . 12 C O4' . . . 12 . C2' . . . . . 12 . C3' . . . . . 12 . C4' . . . . . 12 . O4' . . rr_1ajf 1
59 . . 1 1 13 13 U C4' C . . 1 1 13 13 U O4' O . . 1 1 13 13 U C1' C . . 1 1 13 13 U C2' C . -5.0 5.0 . . . A . 13 U C4' . . A . 13 U O4' . . A . 13 U C1' . . A . 13 U C2' . . . 13 . C4' . . . . . 13 . O4' . . . . . 13 . C1' . . . . . 13 . C2' . . rr_1ajf 1
60 . . 1 1 13 13 U O4' O . . 1 1 13 13 U C1' C . . 1 1 13 13 U C2' C . . 1 1 13 13 U C3' C . -27.0 -17.0 . . . A . 13 U O4' . . A . 13 U C1' . . A . 13 U C2' . . A . 13 U C3' . . . 13 . O4' . . . . . 13 . C1' . . . . . 13 . C2' . . . . . 13 . C3' . . rr_1ajf 1
61 . . 1 1 13 13 U C1' C . . 1 1 13 13 U C2' C . . 1 1 13 13 U C3' C . . 1 1 13 13 U C4' C . 31.0 41.0 . . . A . 13 U C1' . . A . 13 U C2' . . A . 13 U C3' . . A . 13 U C4' . . . 13 . C1' . . . . . 13 . C2' . . . . . 13 . C3' . . . . . 13 . C4' . . rr_1ajf 1
62 . . 1 1 13 13 U C2' C . . 1 1 13 13 U C3' C . . 1 1 13 13 U C4' C . . 1 1 13 13 U O4' O . -41.0 -31.0 . . . A . 13 U C2' . . A . 13 U C3' . . A . 13 U C4' . . A . 13 U O4' . . . 13 . C2' . . . . . 13 . C3' . . . . . 13 . C4' . . . . . 13 . O4' . . rr_1ajf 1
63 . . 1 1 14 14 U C4' C . . 1 1 14 14 U O4' O . . 1 1 14 14 U C1' C . . 1 1 14 14 U C2' C . -5.0 5.0 . . . A . 14 U C4' . . A . 14 U O4' . . A . 14 U C1' . . A . 14 U C2' . . . 14 . C4' . . . . . 14 . O4' . . . . . 14 . C1' . . . . . 14 . C2' . . rr_1ajf 1
64 . . 1 1 14 14 U O4' O . . 1 1 14 14 U C1' C . . 1 1 14 14 U C2' C . . 1 1 14 14 U C3' C . -27.0 -17.0 . . . A . 14 U O4' . . A . 14 U C1' . . A . 14 U C2' . . A . 14 U C3' . . . 14 . O4' . . . . . 14 . C1' . . . . . 14 . C2' . . . . . 14 . C3' . . rr_1ajf 1
65 . . 1 1 14 14 U C1' C . . 1 1 14 14 U C2' C . . 1 1 14 14 U C3' C . . 1 1 14 14 U C4' C . 31.0 41.0 . . . A . 14 U C1' . . A . 14 U C2' . . A . 14 U C3' . . A . 14 U C4' . . . 14 . C1' . . . . . 14 . C2' . . . . . 14 . C3' . . . . . 14 . C4' . . rr_1ajf 1
66 . . 1 1 14 14 U C2' C . . 1 1 14 14 U C3' C . . 1 1 14 14 U C4' C . . 1 1 14 14 U O4' O . -41.0 -31.0 . . . A . 14 U C2' . . A . 14 U C3' . . A . 14 U C4' . . A . 14 U O4' . . . 14 . C2' . . . . . 14 . C3' . . . . . 14 . C4' . . . . . 14 . O4' . . rr_1ajf 1
67 . . 1 1 15 15 U C4' C . . 1 1 15 15 U O4' O . . 1 1 15 15 U C1' C . . 1 1 15 15 U C2' C . -5.0 5.0 . . . A . 15 U C4' . . A . 15 U O4' . . A . 15 U C1' . . A . 15 U C2' . . . 15 . C4' . . . . . 15 . O4' . . . . . 15 . C1' . . . . . 15 . C2' . . rr_1ajf 1
68 . . 1 1 15 15 U O4' O . . 1 1 15 15 U C1' C . . 1 1 15 15 U C2' C . . 1 1 15 15 U C3' C . -27.0 -17.0 . . . A . 15 U O4' . . A . 15 U C1' . . A . 15 U C2' . . A . 15 U C3' . . . 15 . O4' . . . . . 15 . C1' . . . . . 15 . C2' . . . . . 15 . C3' . . rr_1ajf 1
69 . . 1 1 15 15 U C1' C . . 1 1 15 15 U C2' C . . 1 1 15 15 U C3' C . . 1 1 15 15 U C4' C . 31.0 41.0 . . . A . 15 U C1' . . A . 15 U C2' . . A . 15 U C3' . . A . 15 U C4' . . . 15 . C1' . . . . . 15 . C2' . . . . . 15 . C3' . . . . . 15 . C4' . . rr_1ajf 1
70 . . 1 1 15 15 U C2' C . . 1 1 15 15 U C3' C . . 1 1 15 15 U C4' C . . 1 1 15 15 U O4' O . -41.0 -31.0 . . . A . 15 U C2' . . A . 15 U C3' . . A . 15 U C4' . . A . 15 U O4' . . . 15 . C2' . . . . . 15 . C3' . . . . . 15 . C4' . . . . . 15 . O4' . . rr_1ajf 1
71 . . 1 1 16 16 G C4' C . . 1 1 16 16 G O4' O . . 1 1 16 16 G C1' C . . 1 1 16 16 G C2' C . -5.0 5.0 . . . A . 16 G C4' . . A . 16 G O4' . . A . 16 G C1' . . A . 16 G C2' . . . 16 . C4' . . . . . 16 . O4' . . . . . 16 . C1' . . . . . 16 . C2' . . rr_1ajf 1
72 . . 1 1 16 16 G O4' O . . 1 1 16 16 G C1' C . . 1 1 16 16 G C2' C . . 1 1 16 16 G C3' C . -27.0 -17.0 . . . A . 16 G O4' . . A . 16 G C1' . . A . 16 G C2' . . A . 16 G C3' . . . 16 . O4' . . . . . 16 . C1' . . . . . 16 . C2' . . . . . 16 . C3' . . rr_1ajf 1
73 . . 1 1 16 16 G C1' C . . 1 1 16 16 G C2' C . . 1 1 16 16 G C3' C . . 1 1 16 16 G C4' C . 31.0 41.0 . . . A . 16 G C1' . . A . 16 G C2' . . A . 16 G C3' . . A . 16 G C4' . . . 16 . C1' . . . . . 16 . C2' . . . . . 16 . C3' . . . . . 16 . C4' . . rr_1ajf 1
74 . . 1 1 16 16 G C2' C . . 1 1 16 16 G C3' C . . 1 1 16 16 G C4' C . . 1 1 16 16 G O4' O . -41.0 -31.0 . . . A . 16 G C2' . . A . 16 G C3' . . A . 16 G C4' . . A . 16 G O4' . . . 16 . C2' . . . . . 16 . C3' . . . . . 16 . C4' . . . . . 16 . O4' . . rr_1ajf 1
75 . . 1 1 17 17 U C4' C . . 1 1 17 17 U O4' O . . 1 1 17 17 U C1' C . . 1 1 17 17 U C2' C . -5.0 5.0 . . . A . 17 U C4' . . A . 17 U O4' . . A . 17 U C1' . . A . 17 U C2' . . . 17 . C4' . . . . . 17 . O4' . . . . . 17 . C1' . . . . . 17 . C2' . . rr_1ajf 1
76 . . 1 1 17 17 U O4' O . . 1 1 17 17 U C1' C . . 1 1 17 17 U C2' C . . 1 1 17 17 U C3' C . -27.0 -17.0 . . . A . 17 U O4' . . A . 17 U C1' . . A . 17 U C2' . . A . 17 U C3' . . . 17 . O4' . . . . . 17 . C1' . . . . . 17 . C2' . . . . . 17 . C3' . . rr_1ajf 1
77 . . 1 1 17 17 U C1' C . . 1 1 17 17 U C2' C . . 1 1 17 17 U C3' C . . 1 1 17 17 U C4' C . 31.0 41.0 . . . A . 17 U C1' . . A . 17 U C2' . . A . 17 U C3' . . A . 17 U C4' . . . 17 . C1' . . . . . 17 . C2' . . . . . 17 . C3' . . . . . 17 . C4' . . rr_1ajf 1
78 . . 1 1 17 17 U C2' C . . 1 1 17 17 U C3' C . . 1 1 17 17 U C4' C . . 1 1 17 17 U O4' O . -41.0 -31.0 . . . A . 17 U C2' . . A . 17 U C3' . . A . 17 U C4' . . A . 17 U O4' . . . 17 . C2' . . . . . 17 . C3' . . . . . 17 . C4' . . . . . 17 . O4' . . rr_1ajf 1
79 . . 1 1 1 1 G O4' O . . 1 1 1 1 G C1' C . . 1 1 1 1 G N9 N . . 1 1 1 1 G C4 C . -210.0 -110.0 . . . A . 1 G O4' . . A . 1 G C1' . . A . 1 G N9 . . A . 1 G C4 . . . 1 . O4' . . . . . 1 . C1' . . . . . 1 . N9 . . . . . 1 . C4 . . rr_1ajf 1
80 . . 1 1 2 2 A O4' O . . 1 1 2 2 A C1' C . . 1 1 2 2 A N9 N . . 1 1 2 2 A C4 C . -210.0 -110.0 . . . A . 2 A O4' . . A . 2 A C1' . . A . 2 A N9 . . A . 2 A C4 . . . 2 . O4' . . . . . 2 . C1' . . . . . 2 . N9 . . . . . 2 . C4 . . rr_1ajf 1
81 . . 1 1 3 3 C O4' O . . 1 1 3 3 C C1' C . . 1 1 3 3 C N1 N . . 1 1 3 3 C C2 C . -210.0 -110.0 . . . A . 3 C O4' . . A . 3 C C1' . . A . 3 C N1 . . A . 3 C C2 . . . 3 . O4' . . . . . 3 . C1' . . . . . 3 . N1 . . . . . 3 . C2 . . rr_1ajf 1
82 . . 1 1 4 4 A O4' O . . 1 1 4 4 A C1' C . . 1 1 4 4 A N9 N . . 1 1 4 4 A C4 C . -210.0 -110.0 . . . A . 4 A O4' . . A . 4 A C1' . . A . 4 A N9 . . A . 4 A C4 . . . 4 . O4' . . . . . 4 . C1' . . . . . 4 . N9 . . . . . 4 . C4 . . rr_1ajf 1
83 . . 1 1 5 5 G O4' O . . 1 1 5 5 G C1' C . . 1 1 5 5 G N9 N . . 1 1 5 5 G C4 C . -210.0 -110.0 . . . A . 5 G O4' . . A . 5 G C1' . . A . 5 G N9 . . A . 5 G C4 . . . 5 . O4' . . . . . 5 . C1' . . . . . 5 . N9 . . . . . 5 . C4 . . rr_1ajf 1
84 . . 1 1 6 6 G O4' O . . 1 1 6 6 G C1' C . . 1 1 6 6 G N9 N . . 1 1 6 6 G C4 C . -210.0 -110.0 . . . A . 6 G O4' . . A . 6 G C1' . . A . 6 G N9 . . A . 6 G C4 . . . 6 . O4' . . . . . 6 . C1' . . . . . 6 . N9 . . . . . 6 . C4 . . rr_1ajf 1
85 . . 1 1 7 7 G O4' O . . 1 1 7 7 G C1' C . . 1 1 7 7 G N9 N . . 1 1 7 7 G C4 C . -210.0 -110.0 . . . A . 7 G O4' . . A . 7 G C1' . . A . 7 G N9 . . A . 7 G C4 . . . 7 . O4' . . . . . 7 . C1' . . . . . 7 . N9 . . . . . 7 . C4 . . rr_1ajf 1
86 . . 1 1 8 8 G O4' O . . 1 1 8 8 G C1' C . . 1 1 8 8 G N9 N . . 1 1 8 8 G C4 C . -210.0 -110.0 . . . A . 8 G O4' . . A . 8 G C1' . . A . 8 G N9 . . A . 8 G C4 . . . 8 . O4' . . . . . 8 . C1' . . . . . 8 . N9 . . . . . 8 . C4 . . rr_1ajf 1
87 . . 1 1 9 9 A O4' O . . 1 1 9 9 A C1' C . . 1 1 9 9 A N9 N . . 1 1 9 9 A C4 C . -210.0 -110.0 . . . A . 9 A O4' . . A . 9 A C1' . . A . 9 A N9 . . A . 9 A C4 . . . 9 . O4' . . . . . 9 . C1' . . . . . 9 . N9 . . . . . 9 . C4 . . rr_1ajf 1
88 . . 1 1 10 10 A O4' O . . 1 1 10 10 A C1' C . . 1 1 10 10 A N9 N . . 1 1 10 10 A C4 C . -210.0 -110.0 . . . A . 10 A O4' . . A . 10 A C1' . . A . 10 A N9 . . A . 10 A C4 . . . 10 . O4' . . . . . 10 . C1' . . . . . 10 . N9 . . . . . 10 . C4 . . rr_1ajf 1
89 . . 1 1 11 11 A O4' O . . 1 1 11 11 A C1' C . . 1 1 11 11 A N9 N . . 1 1 11 11 A C4 C . -210.0 -110.0 . . . A . 11 A O4' . . A . 11 A C1' . . A . 11 A N9 . . A . 11 A C4 . . . 11 . O4' . . . . . 11 . C1' . . . . . 11 . N9 . . . . . 11 . C4 . . rr_1ajf 1
90 . . 1 1 12 12 C O4' O . . 1 1 12 12 C C1' C . . 1 1 12 12 C N1 N . . 1 1 12 12 C C2 C . -210.0 -110.0 . . . A . 12 C O4' . . A . 12 C C1' . . A . 12 C N1 . . A . 12 C C2 . . . 12 . O4' . . . . . 12 . C1' . . . . . 12 . N1 . . . . . 12 . C2 . . rr_1ajf 1
91 . . 1 1 13 13 U O4' O . . 1 1 13 13 U C1' C . . 1 1 13 13 U N1 N . . 1 1 13 13 U C2 C . -210.0 -110.0 . . . A . 13 U O4' . . A . 13 U C1' . . A . 13 U N1 . . A . 13 U C2 . . . 13 . O4' . . . . . 13 . C1' . . . . . 13 . N1 . . . . . 13 . C2 . . rr_1ajf 1
92 . . 1 1 14 14 U O4' O . . 1 1 14 14 U C1' C . . 1 1 14 14 U N1 N . . 1 1 14 14 U C2 C . -210.0 -110.0 . . . A . 14 U O4' . . A . 14 U C1' . . A . 14 U N1 . . A . 14 U C2 . . . 14 . O4' . . . . . 14 . C1' . . . . . 14 . N1 . . . . . 14 . C2 . . rr_1ajf 1
93 . . 1 1 15 15 U O4' O . . 1 1 15 15 U C1' C . . 1 1 15 15 U N1 N . . 1 1 15 15 U C2 C . -210.0 -110.0 . . . A . 15 U O4' . . A . 15 U C1' . . A . 15 U N1 . . A . 15 U C2 . . . 15 . O4' . . . . . 15 . C1' . . . . . 15 . N1 . . . . . 15 . C2 . . rr_1ajf 1
94 . . 1 1 16 16 G O4' O . . 1 1 16 16 G C1' C . . 1 1 16 16 G N9 N . . 1 1 16 16 G C4 C . -210.0 -110.0 . . . A . 16 G O4' . . A . 16 G C1' . . A . 16 G N9 . . A . 16 G C4 . . . 16 . O4' . . . . . 16 . C1' . . . . . 16 . N9 . . . . . 16 . C4 . . rr_1ajf 1
95 . . 1 1 17 17 U O4' O . . 1 1 17 17 U C1' C . . 1 1 17 17 U N1 N . . 1 1 17 17 U C2 C . -210.0 -110.0 . . . A . 17 U O4' . . A . 17 U C1' . . A . 17 U N1 . . A . 17 U C2 . . . 17 . O4' . . . . . 17 . C1' . . . . . 17 . N1 . . . . . 17 . C2 . . rr_1ajf 1
96 . . 1 1 18 18 C O4' O . . 1 1 18 18 C C1' C . . 1 1 18 18 C N1 N . . 1 1 18 18 C C2 C . -210.0 -110.0 . . . A . 18 C O4' . . A . 18 C C1' . . A . 18 C N1 . . A . 18 C C2 . . . 18 . O4' . . . . . 18 . C1' . . . . . 18 . N1 . . . . . 18 . C2 . . rr_1ajf 1
97 . . 1 1 2 2 A P P . . 1 1 2 2 A O5' O . . 1 1 2 2 A C5' C . . 1 1 2 2 A C4' C . 160.0 200.0 . . . A . 2 A P . . A . 2 A O5' . . A . 2 A C5' . . A . 2 A C4' . . . 2 . P . . . . . 2 . O5' . . . . . 2 . C5' . . . . . 2 . C4' . . rr_1ajf 1
98 . . 1 1 3 3 C P P . . 1 1 3 3 C O5' O . . 1 1 3 3 C C5' C . . 1 1 3 3 C C4' C . 160.0 200.0 . . . A . 3 C P . . A . 3 C O5' . . A . 3 C C5' . . A . 3 C C4' . . . 3 . P . . . . . 3 . O5' . . . . . 3 . C5' . . . . . 3 . C4' . . rr_1ajf 1
99 . . 1 1 4 4 A P P . . 1 1 4 4 A O5' O . . 1 1 4 4 A C5' C . . 1 1 4 4 A C4' C . 160.0 200.0 . . . A . 4 A P . . A . 4 A O5' . . A . 4 A C5' . . A . 4 A C4' . . . 4 . P . . . . . 4 . O5' . . . . . 4 . C5' . . . . . 4 . C4' . . rr_1ajf 1
100 . . 1 1 5 5 G P P . . 1 1 5 5 G O5' O . . 1 1 5 5 G C5' C . . 1 1 5 5 G C4' C . 160.0 200.0 . . . A . 5 G P . . A . 5 G O5' . . A . 5 G C5' . . A . 5 G C4' . . . 5 . P . . . . . 5 . O5' . . . . . 5 . C5' . . . . . 5 . C4' . . rr_1ajf 1
101 . . 1 1 6 6 G P P . . 1 1 6 6 G O5' O . . 1 1 6 6 G C5' C . . 1 1 6 6 G C4' C . 160.0 200.0 . . . A . 6 G P . . A . 6 G O5' . . A . 6 G C5' . . A . 6 G C4' . . . 6 . P . . . . . 6 . O5' . . . . . 6 . C5' . . . . . 6 . C4' . . rr_1ajf 1
102 . . 1 1 7 7 G P P . . 1 1 7 7 G O5' O . . 1 1 7 7 G C5' C . . 1 1 7 7 G C4' C . 160.0 200.0 . . . A . 7 G P . . A . 7 G O5' . . A . 7 G C5' . . A . 7 G C4' . . . 7 . P . . . . . 7 . O5' . . . . . 7 . C5' . . . . . 7 . C4' . . rr_1ajf 1
103 . . 1 1 12 12 C P P . . 1 1 12 12 C O5' O . . 1 1 12 12 C C5' C . . 1 1 12 12 C C4' C . 160.0 200.0 . . . A . 12 C P . . A . 12 C O5' . . A . 12 C C5' . . A . 12 C C4' . . . 12 . P . . . . . 12 . O5' . . . . . 12 . C5' . . . . . 12 . C4' . . rr_1ajf 1
104 . . 1 1 13 13 U P P . . 1 1 13 13 U O5' O . . 1 1 13 13 U C5' C . . 1 1 13 13 U C4' C . 160.0 200.0 . . . A . 13 U P . . A . 13 U O5' . . A . 13 U C5' . . A . 13 U C4' . . . 13 . P . . . . . 13 . O5' . . . . . 13 . C5' . . . . . 13 . C4' . . rr_1ajf 1
105 . . 1 1 14 14 U P P . . 1 1 14 14 U O5' O . . 1 1 14 14 U C5' C . . 1 1 14 14 U C4' C . 160.0 200.0 . . . A . 14 U P . . A . 14 U O5' . . A . 14 U C5' . . A . 14 U C4' . . . 14 . P . . . . . 14 . O5' . . . . . 14 . C5' . . . . . 14 . C4' . . rr_1ajf 1
106 . . 1 1 15 15 U P P . . 1 1 15 15 U O5' O . . 1 1 15 15 U C5' C . . 1 1 15 15 U C4' C . 160.0 200.0 . . . A . 15 U P . . A . 15 U O5' . . A . 15 U C5' . . A . 15 U C4' . . . 15 . P . . . . . 15 . O5' . . . . . 15 . C5' . . . . . 15 . C4' . . rr_1ajf 1
107 . . 1 1 16 16 G P P . . 1 1 16 16 G O5' O . . 1 1 16 16 G C5' C . . 1 1 16 16 G C4' C . 160.0 200.0 . . . A . 16 G P . . A . 16 G O5' . . A . 16 G C5' . . A . 16 G C4' . . . 16 . P . . . . . 16 . O5' . . . . . 16 . C5' . . . . . 16 . C4' . . rr_1ajf 1
108 . . 1 1 17 17 U P P . . 1 1 17 17 U O5' O . . 1 1 17 17 U C5' C . . 1 1 17 17 U C4' C . 160.0 200.0 . . . A . 17 U P . . A . 17 U O5' . . A . 17 U C5' . . A . 17 U C4' . . . 17 . P . . . . . 17 . O5' . . . . . 17 . C5' . . . . . 17 . C4' . . rr_1ajf 1
109 . . 1 1 18 18 C P P . . 1 1 18 18 C O5' O . . 1 1 18 18 C C5' C . . 1 1 18 18 C C4' C . 160.0 200.0 . . . A . 18 C P . . A . 18 C O5' . . A . 18 C C5' . . A . 18 C C4' . . . 18 . P . . . . . 18 . O5' . . . . . 18 . C5' . . . . . 18 . C4' . . rr_1ajf 1
110 . . 1 1 1 1 G O5' O . . 1 1 1 1 G C5' C . . 1 1 1 1 G C4' C . . 1 1 1 1 G C3' C . 25.0 85.0 . . . A . 1 G O5' . . A . 1 G C5' . . A . 1 G C4' . . A . 1 G C3' . . . 1 . O5' . . . . . 1 . C5' . . . . . 1 . C4' . . . . . 1 . C3' . . rr_1ajf 1
111 . . 1 1 2 2 A O5' O . . 1 1 2 2 A C5' C . . 1 1 2 2 A C4' C . . 1 1 2 2 A C3' C . 25.0 85.0 . . . A . 2 A O5' . . A . 2 A C5' . . A . 2 A C4' . . A . 2 A C3' . . . 2 . O5' . . . . . 2 . C5' . . . . . 2 . C4' . . . . . 2 . C3' . . rr_1ajf 1
112 . . 1 1 3 3 C O5' O . . 1 1 3 3 C C5' C . . 1 1 3 3 C C4' C . . 1 1 3 3 C C3' C . 25.0 85.0 . . . A . 3 C O5' . . A . 3 C C5' . . A . 3 C C4' . . A . 3 C C3' . . . 3 . O5' . . . . . 3 . C5' . . . . . 3 . C4' . . . . . 3 . C3' . . rr_1ajf 1
113 . . 1 1 4 4 A O5' O . . 1 1 4 4 A C5' C . . 1 1 4 4 A C4' C . . 1 1 4 4 A C3' C . 25.0 85.0 . . . A . 4 A O5' . . A . 4 A C5' . . A . 4 A C4' . . A . 4 A C3' . . . 4 . O5' . . . . . 4 . C5' . . . . . 4 . C4' . . . . . 4 . C3' . . rr_1ajf 1
114 . . 1 1 5 5 G O5' O . . 1 1 5 5 G C5' C . . 1 1 5 5 G C4' C . . 1 1 5 5 G C3' C . 25.0 85.0 . . . A . 5 G O5' . . A . 5 G C5' . . A . 5 G C4' . . A . 5 G C3' . . . 5 . O5' . . . . . 5 . C5' . . . . . 5 . C4' . . . . . 5 . C3' . . rr_1ajf 1
115 . . 1 1 6 6 G O5' O . . 1 1 6 6 G C5' C . . 1 1 6 6 G C4' C . . 1 1 6 6 G C3' C . 25.0 85.0 . . . A . 6 G O5' . . A . 6 G C5' . . A . 6 G C4' . . A . 6 G C3' . . . 6 . O5' . . . . . 6 . C5' . . . . . 6 . C4' . . . . . 6 . C3' . . rr_1ajf 1
116 . . 1 1 7 7 G O5' O . . 1 1 7 7 G C5' C . . 1 1 7 7 G C4' C . . 1 1 7 7 G C3' C . 25.0 85.0 . . . A . 7 G O5' . . A . 7 G C5' . . A . 7 G C4' . . A . 7 G C3' . . . 7 . O5' . . . . . 7 . C5' . . . . . 7 . C4' . . . . . 7 . C3' . . rr_1ajf 1
117 . . 1 1 12 12 C O5' O . . 1 1 12 12 C C5' C . . 1 1 12 12 C C4' C . . 1 1 12 12 C C3' C . 25.0 85.0 . . . A . 12 C O5' . . A . 12 C C5' . . A . 12 C C4' . . A . 12 C C3' . . . 12 . O5' . . . . . 12 . C5' . . . . . 12 . C4' . . . . . 12 . C3' . . rr_1ajf 1
118 . . 1 1 13 13 U O5' O . . 1 1 13 13 U C5' C . . 1 1 13 13 U C4' C . . 1 1 13 13 U C3' C . 25.0 85.0 . . . A . 13 U O5' . . A . 13 U C5' . . A . 13 U C4' . . A . 13 U C3' . . . 13 . O5' . . . . . 13 . C5' . . . . . 13 . C4' . . . . . 13 . C3' . . rr_1ajf 1
119 . . 1 1 14 14 U O5' O . . 1 1 14 14 U C5' C . . 1 1 14 14 U C4' C . . 1 1 14 14 U C3' C . 25.0 85.0 . . . A . 14 U O5' . . A . 14 U C5' . . A . 14 U C4' . . A . 14 U C3' . . . 14 . O5' . . . . . 14 . C5' . . . . . 14 . C4' . . . . . 14 . C3' . . rr_1ajf 1
120 . . 1 1 15 15 U O5' O . . 1 1 15 15 U C5' C . . 1 1 15 15 U C4' C . . 1 1 15 15 U C3' C . 25.0 85.0 . . . A . 15 U O5' . . A . 15 U C5' . . A . 15 U C4' . . A . 15 U C3' . . . 15 . O5' . . . . . 15 . C5' . . . . . 15 . C4' . . . . . 15 . C3' . . rr_1ajf 1
121 . . 1 1 16 16 G O5' O . . 1 1 16 16 G C5' C . . 1 1 16 16 G C4' C . . 1 1 16 16 G C3' C . 25.0 85.0 . . . A . 16 G O5' . . A . 16 G C5' . . A . 16 G C4' . . A . 16 G C3' . . . 16 . O5' . . . . . 16 . C5' . . . . . 16 . C4' . . . . . 16 . C3' . . rr_1ajf 1
122 . . 1 1 17 17 U O5' O . . 1 1 17 17 U C5' C . . 1 1 17 17 U C4' C . . 1 1 17 17 U C3' C . 25.0 85.0 . . . A . 17 U O5' . . A . 17 U C5' . . A . 17 U C4' . . A . 17 U C3' . . . 17 . O5' . . . . . 17 . C5' . . . . . 17 . C4' . . . . . 17 . C3' . . rr_1ajf 1
123 . . 1 1 18 18 C O5' O . . 1 1 18 18 C C5' C . . 1 1 18 18 C C4' C . . 1 1 18 18 C C3' C . 25.0 85.0 . . . A . 18 C O5' . . A . 18 C C5' . . A . 18 C C4' . . A . 18 C C3' . . . 18 . O5' . . . . . 18 . C5' . . . . . 18 . C4' . . . . . 18 . C3' . . rr_1ajf 1
124 . . 1 1 1 1 G C4' C . . 1 1 1 1 G C3' C . . 1 1 1 1 G O3' O . . 1 1 2 2 A P P . -175.0 -135.0 . . . A . 1 G C4' . . A . 1 G C3' . . A . 1 G O3' . . A . 2 A P . . . 1 . C4' . . . . . 1 . C3' . . . . . 1 . O3' . . . . . 2 . P . . rr_1ajf 1
125 . . 1 1 2 2 A C4' C . . 1 1 2 2 A C3' C . . 1 1 2 2 A O3' O . . 1 1 3 3 C P P . -175.0 -135.0 . . . A . 2 A C4' . . A . 2 A C3' . . A . 2 A O3' . . A . 3 C P . . . 2 . C4' . . . . . 2 . C3' . . . . . 2 . O3' . . . . . 3 . P . . rr_1ajf 1
126 . . 1 1 3 3 C C4' C . . 1 1 3 3 C C3' C . . 1 1 3 3 C O3' O . . 1 1 4 4 A P P . -175.0 -135.0 . . . A . 3 C C4' . . A . 3 C C3' . . A . 3 C O3' . . A . 4 A P . . . 3 . C4' . . . . . 3 . C3' . . . . . 3 . O3' . . . . . 4 . P . . rr_1ajf 1
127 . . 1 1 4 4 A C4' C . . 1 1 4 4 A C3' C . . 1 1 4 4 A O3' O . . 1 1 5 5 G P P . -175.0 -135.0 . . . A . 4 A C4' . . A . 4 A C3' . . A . 4 A O3' . . A . 5 G P . . . 4 . C4' . . . . . 4 . C3' . . . . . 4 . O3' . . . . . 5 . P . . rr_1ajf 1
128 . . 1 1 5 5 G C4' C . . 1 1 5 5 G C3' C . . 1 1 5 5 G O3' O . . 1 1 6 6 G P P . -175.0 -135.0 . . . A . 5 G C4' . . A . 5 G C3' . . A . 5 G O3' . . A . 6 G P . . . 5 . C4' . . . . . 5 . C3' . . . . . 5 . O3' . . . . . 6 . P . . rr_1ajf 1
129 . . 1 1 6 6 G C4' C . . 1 1 6 6 G C3' C . . 1 1 6 6 G O3' O . . 1 1 7 7 G P P . -175.0 -135.0 . . . A . 6 G C4' . . A . 6 G C3' . . A . 6 G O3' . . A . 7 G P . . . 6 . C4' . . . . . 6 . C3' . . . . . 6 . O3' . . . . . 7 . P . . rr_1ajf 1
130 . . 1 1 7 7 G C4' C . . 1 1 7 7 G C3' C . . 1 1 7 7 G O3' O . . 1 1 8 8 G P P . -175.0 -135.0 . . . A . 7 G C4' . . A . 7 G C3' . . A . 7 G O3' . . A . 8 G P . . . 7 . C4' . . . . . 7 . C3' . . . . . 7 . O3' . . . . . 8 . P . . rr_1ajf 1
131 . . 1 1 12 12 C C4' C . . 1 1 12 12 C C3' C . . 1 1 12 12 C O3' O . . 1 1 13 13 U P P . -175.0 -135.0 . . . A . 12 C C4' . . A . 12 C C3' . . A . 12 C O3' . . A . 13 U P . . . 12 . C4' . . . . . 12 . C3' . . . . . 12 . O3' . . . . . 13 . P . . rr_1ajf 1
132 . . 1 1 13 13 U C4' C . . 1 1 13 13 U C3' C . . 1 1 13 13 U O3' O . . 1 1 14 14 U P P . -175.0 -135.0 . . . A . 13 U C4' . . A . 13 U C3' . . A . 13 U O3' . . A . 14 U P . . . 13 . C4' . . . . . 13 . C3' . . . . . 13 . O3' . . . . . 14 . P . . rr_1ajf 1
133 . . 1 1 14 14 U C4' C . . 1 1 14 14 U C3' C . . 1 1 14 14 U O3' O . . 1 1 15 15 U P P . -175.0 -135.0 . . . A . 14 U C4' . . A . 14 U C3' . . A . 14 U O3' . . A . 15 U P . . . 14 . C4' . . . . . 14 . C3' . . . . . 14 . O3' . . . . . 15 . P . . rr_1ajf 1
134 . . 1 1 15 15 U C4' C . . 1 1 15 15 U C3' C . . 1 1 15 15 U O3' O . . 1 1 16 16 G P P . -175.0 -135.0 . . . A . 15 U C4' . . A . 15 U C3' . . A . 15 U O3' . . A . 16 G P . . . 15 . C4' . . . . . 15 . C3' . . . . . 15 . O3' . . . . . 16 . P . . rr_1ajf 1
135 . . 1 1 16 16 G C4' C . . 1 1 16 16 G C3' C . . 1 1 16 16 G O3' O . . 1 1 17 17 U P P . -175.0 -135.0 . . . A . 16 G C4' . . A . 16 G C3' . . A . 16 G O3' . . A . 17 U P . . . 16 . C4' . . . . . 16 . C3' . . . . . 16 . O3' . . . . . 17 . P . . rr_1ajf 1
136 . . 1 1 17 17 U C4' C . . 1 1 17 17 U C3' C . . 1 1 17 17 U O3' O . . 1 1 18 18 C P P . -175.0 -135.0 . . . A . 17 U C4' . . A . 17 U C3' . . A . 17 U O3' . . A . 18 C P . . . 17 . C4' . . . . . 17 . C3' . . . . . 17 . O3' . . . . . 18 . P . . rr_1ajf 1
137 . . 1 1 1 1 G O3' O . . 1 1 2 2 A P P . . 1 1 2 2 A O5' O . . 1 1 2 2 A C5' C . -100.0 -40.0 . . . A . 1 G O3' . . A . 2 A P . . A . 2 A O5' . . A . 2 A C5' . . . 1 . O3' . . . . . 2 . P . . . . . 2 . O5' . . . . . 2 . C5' . . rr_1ajf 1
138 . . 1 1 2 2 A O3' O . . 1 1 3 3 C P P . . 1 1 3 3 C O5' O . . 1 1 3 3 C C5' C . -100.0 -40.0 . . . A . 2 A O3' . . A . 3 C P . . A . 3 C O5' . . A . 3 C C5' . . . 2 . O3' . . . . . 3 . P . . . . . 3 . O5' . . . . . 3 . C5' . . rr_1ajf 1
139 . . 1 1 3 3 C O3' O . . 1 1 4 4 A P P . . 1 1 4 4 A O5' O . . 1 1 4 4 A C5' C . -100.0 -40.0 . . . A . 3 C O3' . . A . 4 A P . . A . 4 A O5' . . A . 4 A C5' . . . 3 . O3' . . . . . 4 . P . . . . . 4 . O5' . . . . . 4 . C5' . . rr_1ajf 1
140 . . 1 1 4 4 A O3' O . . 1 1 5 5 G P P . . 1 1 5 5 G O5' O . . 1 1 5 5 G C5' C . -100.0 -40.0 . . . A . 4 A O3' . . A . 5 G P . . A . 5 G O5' . . A . 5 G C5' . . . 4 . O3' . . . . . 5 . P . . . . . 5 . O5' . . . . . 5 . C5' . . rr_1ajf 1
141 . . 1 1 5 5 G O3' O . . 1 1 6 6 G P P . . 1 1 6 6 G O5' O . . 1 1 6 6 G C5' C . -100.0 -40.0 . . . A . 5 G O3' . . A . 6 G P . . A . 6 G O5' . . A . 6 G C5' . . . 5 . O3' . . . . . 6 . P . . . . . 6 . O5' . . . . . 6 . C5' . . rr_1ajf 1
142 . . 1 1 6 6 G O3' O . . 1 1 7 7 G P P . . 1 1 7 7 G O5' O . . 1 1 7 7 G C5' C . -100.0 -40.0 . . . A . 6 G O3' . . A . 7 G P . . A . 7 G O5' . . A . 7 G C5' . . . 6 . O3' . . . . . 7 . P . . . . . 7 . O5' . . . . . 7 . C5' . . rr_1ajf 1
143 . . 1 1 12 12 C O3' O . . 1 1 13 13 U P P . . 1 1 13 13 U O5' O . . 1 1 13 13 U C5' C . -100.0 -40.0 . . . A . 12 C O3' . . A . 13 U P . . A . 13 U O5' . . A . 13 U C5' . . . 12 . O3' . . . . . 13 . P . . . . . 13 . O5' . . . . . 13 . C5' . . rr_1ajf 1
144 . . 1 1 13 13 U O3' O . . 1 1 14 14 U P P . . 1 1 14 14 U O5' O . . 1 1 14 14 U C5' C . -100.0 -40.0 . . . A . 13 U O3' . . A . 14 U P . . A . 14 U O5' . . A . 14 U C5' . . . 13 . O3' . . . . . 14 . P . . . . . 14 . O5' . . . . . 14 . C5' . . rr_1ajf 1
145 . . 1 1 14 14 U O3' O . . 1 1 15 15 U P P . . 1 1 15 15 U O5' O . . 1 1 15 15 U C5' C . -100.0 -40.0 . . . A . 14 U O3' . . A . 15 U P . . A . 15 U O5' . . A . 15 U C5' . . . 14 . O3' . . . . . 15 . P . . . . . 15 . O5' . . . . . 15 . C5' . . rr_1ajf 1
146 . . 1 1 15 15 U O3' O . . 1 1 16 16 G P P . . 1 1 16 16 G O5' O . . 1 1 16 16 G C5' C . -100.0 -40.0 . . . A . 15 U O3' . . A . 16 G P . . A . 16 G O5' . . A . 16 G C5' . . . 15 . O3' . . . . . 16 . P . . . . . 16 . O5' . . . . . 16 . C5' . . rr_1ajf 1
147 . . 1 1 16 16 G O3' O . . 1 1 17 17 U P P . . 1 1 17 17 U O5' O . . 1 1 17 17 U C5' C . -100.0 -40.0 . . . A . 16 G O3' . . A . 17 U P . . A . 17 U O5' . . A . 17 U C5' . . . 16 . O3' . . . . . 17 . P . . . . . 17 . O5' . . . . . 17 . C5' . . rr_1ajf 1
148 . . 1 1 17 17 U O3' O . . 1 1 18 18 C P P . . 1 1 18 18 C O5' O . . 1 1 18 18 C C5' C . -100.0 -40.0 . . . A . 17 U O3' . . A . 18 C P . . A . 18 C O5' . . A . 18 C C5' . . . 17 . O3' . . . . . 18 . P . . . . . 18 . O5' . . . . . 18 . C5' . . rr_1ajf 1
149 . . 1 1 1 1 G C3' C . . 1 1 1 1 G O3' O . . 1 1 2 2 A P P . . 1 1 2 2 A O5' O . -100.0 -40.0 . . . A . 1 G C3' . . A . 1 G O3' . . A . 2 A P . . A . 2 A O5' . . . 1 . C3' . . . . . 1 . O3' . . . . . 2 . P . . . . . 2 . O5' . . rr_1ajf 1
150 . . 1 1 2 2 A C3' C . . 1 1 2 2 A O3' O . . 1 1 3 3 C P P . . 1 1 3 3 C O5' O . -100.0 -40.0 . . . A . 2 A C3' . . A . 2 A O3' . . A . 3 C P . . A . 3 C O5' . . . 2 . C3' . . . . . 2 . O3' . . . . . 3 . P . . . . . 3 . O5' . . rr_1ajf 1
151 . . 1 1 3 3 C C3' C . . 1 1 3 3 C O3' O . . 1 1 4 4 A P P . . 1 1 4 4 A O5' O . -100.0 -40.0 . . . A . 3 C C3' . . A . 3 C O3' . . A . 4 A P . . A . 4 A O5' . . . 3 . C3' . . . . . 3 . O3' . . . . . 4 . P . . . . . 4 . O5' . . rr_1ajf 1
152 . . 1 1 4 4 A C3' C . . 1 1 4 4 A O3' O . . 1 1 5 5 G P P . . 1 1 5 5 G O5' O . -100.0 -40.0 . . . A . 4 A C3' . . A . 4 A O3' . . A . 5 G P . . A . 5 G O5' . . . 4 . C3' . . . . . 4 . O3' . . . . . 5 . P . . . . . 5 . O5' . . rr_1ajf 1
153 . . 1 1 5 5 G C3' C . . 1 1 5 5 G O3' O . . 1 1 6 6 G P P . . 1 1 6 6 G O5' O . -100.0 -40.0 . . . A . 5 G C3' . . A . 5 G O3' . . A . 6 G P . . A . 6 G O5' . . . 5 . C3' . . . . . 5 . O3' . . . . . 6 . P . . . . . 6 . O5' . . rr_1ajf 1
154 . . 1 1 6 6 G C3' C . . 1 1 6 6 G O3' O . . 1 1 7 7 G P P . . 1 1 7 7 G O5' O . -100.0 -40.0 . . . A . 6 G C3' . . A . 6 G O3' . . A . 7 G P . . A . 7 G O5' . . . 6 . C3' . . . . . 6 . O3' . . . . . 7 . P . . . . . 7 . O5' . . rr_1ajf 1
155 . . 1 1 7 7 G C3' C . . 1 1 7 7 G O3' O . . 1 1 8 8 G P P . . 1 1 8 8 G O5' O . -100.0 -40.0 . . . A . 7 G C3' . . A . 7 G O3' . . A . 8 G P . . A . 8 G O5' . . . 7 . C3' . . . . . 7 . O3' . . . . . 8 . P . . . . . 8 . O5' . . rr_1ajf 1
156 . . 1 1 12 12 C C3' C . . 1 1 12 12 C O3' O . . 1 1 13 13 U P P . . 1 1 13 13 U O5' O . -100.0 -40.0 . . . A . 12 C C3' . . A . 12 C O3' . . A . 13 U P . . A . 13 U O5' . . . 12 . C3' . . . . . 12 . O3' . . . . . 13 . P . . . . . 13 . O5' . . rr_1ajf 1
157 . . 1 1 13 13 U C3' C . . 1 1 13 13 U O3' O . . 1 1 14 14 U P P . . 1 1 14 14 U O5' O . -100.0 -40.0 . . . A . 13 U C3' . . A . 13 U O3' . . A . 14 U P . . A . 14 U O5' . . . 13 . C3' . . . . . 13 . O3' . . . . . 14 . P . . . . . 14 . O5' . . rr_1ajf 1
158 . . 1 1 14 14 U C3' C . . 1 1 14 14 U O3' O . . 1 1 15 15 U P P . . 1 1 15 15 U O5' O . -100.0 -40.0 . . . A . 14 U C3' . . A . 14 U O3' . . A . 15 U P . . A . 15 U O5' . . . 14 . C3' . . . . . 14 . O3' . . . . . 15 . P . . . . . 15 . O5' . . rr_1ajf 1
159 . . 1 1 15 15 U C3' C . . 1 1 15 15 U O3' O . . 1 1 16 16 G P P . . 1 1 16 16 G O5' O . -100.0 -40.0 . . . A . 15 U C3' . . A . 15 U O3' . . A . 16 G P . . A . 16 G O5' . . . 15 . C3' . . . . . 15 . O3' . . . . . 16 . P . . . . . 16 . O5' . . rr_1ajf 1
160 . . 1 1 16 16 G C3' C . . 1 1 16 16 G O3' O . . 1 1 17 17 U P P . . 1 1 17 17 U O5' O . -100.0 -40.0 . . . A . 16 G C3' . . A . 16 G O3' . . A . 17 U P . . A . 17 U O5' . . . 16 . C3' . . . . . 16 . O3' . . . . . 17 . P . . . . . 17 . O5' . . rr_1ajf 1
161 . . 1 1 17 17 U C3' C . . 1 1 17 17 U O3' O . . 1 1 18 18 C P P . . 1 1 18 18 C O5' O . -100.0 -40.0 . . . A . 17 U C3' . . A . 17 U O3' . . A . 18 C P . . A . 18 C O5' . . . 17 . C3' . . . . . 17 . O3' . . . . . 18 . P . . . . . 18 . O5' . . rr_1ajf 1
stop_
loop_
_TA_constraint_comment_org.ID
_TA_constraint_comment_org.Comment_text
_TA_constraint_comment_org.Comment_begin_line
_TA_constraint_comment_org.Comment_begin_column
_TA_constraint_comment_org.Comment_end_line
_TA_constraint_comment_org.Comment_end_column
_TA_constraint_comment_org.Entry_ID
_TA_constraint_comment_org.Torsion_angle_constraint_list_ID
1 "Keep G amino groups in the plane of the base" 1 1 1 1 rr_1ajf 1
2 "Keep C amino groups in the plane of the base" 15 1 15 1 rr_1ajf 1
3 "Keep A amino groups in the plane of the base" 23 1 23 1 rr_1ajf 1
4 "Make some nucleotides c3'-endo, restrain v0, v1,v2, and v3 instead of delta" 35 1 35 1 rr_1ajf 1
5 "Restrain all residues. No C2' endo sugars found via NMR" 36 1 36 1 rr_1ajf 1
6 "Keep bases anti" 181 1 181 1 rr_1ajf 1
7 "Restrain all residues. No syn bases seen in NMR" 182 1 182 1 rr_1ajf 1
8 "Torsion angle beta - standard A-form, from Suman" 220 1 220 1 rr_1ajf 1
9 "Restrain all residues to standard A-form except loop region" 221 1 221 1 rr_1ajf 1
10 "Torsion angle gamma; standard A-form, from Suman" 249 1 249 1 rr_1ajf 1
11 "Restrain all residues to standard A-form except loop region" 250 1 250 1 rr_1ajf 1
12 "Torsion angle epsilon; standard A-Form, From Suman" 280 1 280 1 rr_1ajf 1
13 "Restrain all residues to standard A-form except loop region" 281 1 281 1 rr_1ajf 1
14 "Torsion angle alpha; Standard A-Form, from Suman" 309 1 309 1 rr_1ajf 1
15 "Restrain all residues to standard A-form except loop region" 310 1 310 1 rr_1ajf 1
16 "Torsion angle zeta; standard A-form, from Suman" 336 1 336 1 rr_1ajf 1
17 "Restrain all residues to standard A-form except loop region" 337 1 337 1 rr_1ajf 1
stop_
save_
save_MR_file_comment_1
_Org_constr_file_comment.Sf_framecode MR_file_comment_1
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID rr_1ajf
_Org_constr_file_comment.ID 1
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 1
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment "*HEADER RIBONUCLEIC ACID 02-MAY-97 1AJF *TITLE SOLUTION STRUCTURE OF THE P5B STEM LOOP FROM A GROUP I *TITLE 2 INTRON COMPLEXED WITH COBALT (III) HEXAMMINE, *TITLE 3 NMR, MINIMIZED AVERAGE STRUCTURE *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: P5B STEM-LOOP FROM A GROUP I INTRON; *COMPND 3 CHAIN: NULL; *COMPND 4 FRAGMENT: TETRALOOP OF TETRALOOP-TETRALOOP RECEPTOR *COMPND 5 TERTIARY INTERACTION; *COMPND 6 SYNONYM: GAAA TETRALOOP OF A GROUP I INTRON; *COMPND 7 ENGINEERED: YES; *COMPND 8 MUTATION: C1G, U2A *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: TETRAHYMENA THERMOPHILA; *SOURCE 4 OTHER_DETAILS: SYNTHESIZED ENZYMATICALLY IN-VITRO USING T7 *SOURCE 5 RNA POLYMERASE *KEYWDS RIBONUCLEIC ACID, COBALT (III) HEXAMMINE, METAL BINDING, *KEYWDS 2 NMR, RNA STRUCTURE *EXPDTA NMR, MINIMIZED AVERAGE STRUCTURE *AUTHOR J.S.KIEFT,I.TINOCO JUNIOR *REVDAT 1 07-JUL-97 1AJF 0 {NOE RESTRAINTS :}"
save_
save_MR_file_comment_6
_Org_constr_file_comment.Sf_framecode MR_file_comment_6
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID rr_1ajf
_Org_constr_file_comment.ID 3
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 6
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;end
end
;
save_
save_MR_file_comment_4
_Org_constr_file_comment.Sf_framecode MR_file_comment_4
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID rr_1ajf
_Org_constr_file_comment.ID 2
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 4
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment "{TORSION ANGLE CONSTRAINTS :} constraints dihedral reset"
save_
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