Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
389602 | 1nts RC | 5776 | cing | 3-converted-DOCR | STAR | entry | full | 195 |
data_DOCR_restraints_with_modified_coordinates_PDB_code_1nts
# This DOCR archive file contains, for PDB entry <1nts>:
#
# - 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, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend,
# JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with
# curated sets of experimental NMR restraints for over 4,000 protein and nucleic
# acid PDB entries. (in preparation)
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID rr_1nts
_Entry.Title "wwPDB remediated NMR restraints for PDB entry 1nts"
_Entry.NMR_STAR_version 3.1
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype solution
_Entry.Details "Contains the remediated restraint lists and coordinates for PDB entry 1nts"
save_
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID rr_1nts
_Assembly.ID 1
_Assembly.Name 1nts
_Assembly.Number_of_components 2
_Assembly.Organic_ligands 0
_Assembly.Metal_ions 0
_Assembly.Non_standard_bonds no
_Assembly.Paramagnetic no
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 5477.68246
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 "5 R AP AP AP GP GP AP GP GP A 3" 1 $5__R__AP_AP_AP_GP_GP_AP_GP_GP_A__3_ A . no . . . . . . rr_1nts 1
2 "5 D 5PC P 5PC P PDU P 5PC P 5PC P PDU P PDU 3" 2 $5__D___5PC_P__5PC_P__PDU_P__5PC_P__5PC_P__PDU_P__PDU___3_ B . no . . . . . . rr_1nts 1
stop_
save_
save_5__R__AP_AP_AP_GP_GP_AP_GP_GP_A__3_
_Entity.Sf_category entity
_Entity.Sf_framecode 5__R__AP_AP_AP_GP_GP_AP_GP_GP_A__3_
_Entity.Entry_ID rr_1nts
_Entity.ID 1
_Entity.Name 5__R__AP_AP_AP_GP_GP_AP_GP_GP_A__3_
_Entity.Type polymer
_Entity.Polymer_type polyribonucleotide
_Entity.Polymer_strand_ID A
_Entity.Polymer_seq_one_letter_code AAAGGAGGA
_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 9
_Entity.Paramagnetic no
_Entity.Thiol_state "not present"
_Entity.Parent_entity_ID 1
_Entity.Formula_weight 3045.89684
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 . A . rr_1nts 1
2 . A . rr_1nts 1
3 . A . rr_1nts 1
4 . G . rr_1nts 1
5 . G . rr_1nts 1
6 . A . rr_1nts 1
7 . G . rr_1nts 1
8 . G . rr_1nts 1
9 . A . rr_1nts 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
. A 1 1 rr_1nts 1
. A 2 2 rr_1nts 1
. A 3 3 rr_1nts 1
. G 4 4 rr_1nts 1
. G 5 5 rr_1nts 1
. A 6 6 rr_1nts 1
. G 7 7 rr_1nts 1
. G 8 8 rr_1nts 1
. A 9 9 rr_1nts 1
stop_
save_
save_5__D___5PC_P__5PC_P__PDU_P__5PC_P__5PC_P__PDU_P__PDU___3_
_Entity.Sf_category entity
_Entity.Sf_framecode 5__D___5PC_P__5PC_P__PDU_P__5PC_P__5PC_P__PDU_P__PDU___3_
_Entity.Entry_ID rr_1nts
_Entity.ID 2
_Entity.Name 5__D___5PC_P__5PC_P__PDU_P__5PC_P__5PC_P__PDU_P__PDU___3_
_Entity.Type non-polymer
_Entity.Ambiguous_conformational_states no
_Entity.Ambiguous_chem_comp_sites no
_Entity.Nstd_chirality yes
_Entity.Nstd_linkage yes
_Entity.Nonpolymer_comp_ID 5PC
_Entity.Nonpolymer_comp_label $chem_comp_5PC
_Entity.Number_of_monomers 7
_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 . 5PC . rr_1nts 2
2 . 5PC . rr_1nts 2
3 . PDU . rr_1nts 2
4 . 5PC . rr_1nts 2
5 . 5PC . rr_1nts 2
6 . PDU . rr_1nts 2
7 . PDU . rr_1nts 2
stop_
save_
save_chem_comp_5PC
_Chem_comp.Sf_category chem_comp
_Chem_comp.Sf_framecode chem_comp_5PC
_Chem_comp.Entry_ID rr_1nts
_Chem_comp.ID 5PC
_Chem_comp.Name 5(1-PROPYNYL)-2'-DEOXYCYTIDINE-5'-MONOPHOSPHATE
_Chem_comp.Type non-polymer
_Chem_comp.PDB_code 5PC
_Chem_comp.Formal_charge 0
_Chem_comp.Paramagnetic no
_Chem_comp.Aromatic no
_Chem_comp.Formula "C12 H16 N3 O7 P"
_Chem_comp.Formula_weight 345.24806
save_
save_chem_comp_PDU
_Chem_comp.Sf_category chem_comp
_Chem_comp.Sf_framecode chem_comp_PDU
_Chem_comp.Entry_ID rr_1nts
_Chem_comp.ID PDU
_Chem_comp.Name 5(1-PROPYNYL)-2'-DEOXYURIDINE-5-MONOPHOSPHATE
_Chem_comp.Type non-polymer
_Chem_comp.PDB_code PDU
_Chem_comp.Formal_charge 0
_Chem_comp.Paramagnetic no
_Chem_comp.Aromatic no
_Chem_comp.Formula "C12 H19 N2 O8 P"
_Chem_comp.Formula_weight 350.26446
save_
save_conformer_statistics
_Conformer_stat_list.Sf_category conformer_statistics
_Conformer_stat_list.Sf_framecode conformer_statistics
_Conformer_stat_list.Entry_ID rr_1nts
_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_1nts
_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_1nts 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_1nts 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 A C1' C 4.750 -6.776 14.103 . . . 1.0 . . . . . . . . . . . . A . 2 A C1' . . . . . . . . . rr_1nts 1
. 1 . 2 . 1 1 1 A C2 C 0.429 -8.201 13.126 . . . 1.0 . . . . . . . . . . . . A . 2 A C2 . . . . . . . . . rr_1nts 1
. 1 . 3 . 1 1 1 A C2' C 5.356 -7.831 13.146 . . . 1.0 . . . . . . . . . . . . A . 2 A C2' . . . . . . . . . rr_1nts 1
. 1 . 4 . 1 1 1 A C3' C 6.544 -7.083 12.554 . . . 1.0 . . . . . . . . . . . . A . 2 A C3' . . . . . . . . . rr_1nts 1
. 1 . 5 . 1 1 1 A C4 C 2.234 -6.712 13.362 . . . 1.0 . . . . . . . . . . . . A . 2 A C4 . . . . . . . . . rr_1nts 1
. 1 . 6 . 1 1 1 A C4' C 6.998 -6.190 13.711 . . . 1.0 . . . . . . . . . . . . A . 2 A C4' . . . . . . . . . rr_1nts 1
. 1 . 7 . 1 1 1 A C5 C 1.281 -5.629 13.133 . . . 1.0 . . . . . . . . . . . . A . 2 A C5 . . . . . . . . . rr_1nts 1
. 1 . 8 . 1 1 1 A C5' C 7.904 -5.000 13.324 . . . 1.0 . . . . . . . . . . . . A . 2 A C5' . . . . . . . . . rr_1nts 1
. 1 . 9 . 1 1 1 A C6 C -0.107 -5.992 12.928 . . . 1.0 . . . . . . . . . . . . A . 2 A C6 . . . . . . . . . rr_1nts 1
. 1 . 10 . 1 1 1 A C8 C 3.170 -4.802 13.407 . . . 1.0 . . . . . . . . . . . . A . 2 A C8 . . . . . . . . . rr_1nts 1
. 1 . 11 . 1 1 1 A H1' H 4.515 -7.255 15.070 . . . 1.0 . . . . . . . . . . . . A . 2 A H1' . . . . . . . . . rr_1nts 1
. 1 . 12 . 1 1 1 A H2 H 0.055 -9.214 13.100 . . . 1.0 . . . . . . . . . . . . A . 2 A H2 . . . . . . . . . rr_1nts 1
. 1 . 13 . 1 1 1 A H2' H 4.660 -8.165 12.353 . . . 1.0 . . . . . . . . . . . . A . 2 A H2' . . . . . . . . . rr_1nts 1
. 1 . 14 . 1 1 1 A H3' H 6.157 -6.447 11.734 . . . 1.0 . . . . . . . . . . . . A . 2 A H3' . . . . . . . . . rr_1nts 1
. 1 . 15 . 1 1 1 A H4' H 7.546 -6.804 14.452 . . . 1.0 . . . . . . . . . . . . A . 2 A H4' . . . . . . . . . rr_1nts 1
. 1 . 16 . 1 1 1 A H5' H 7.866 -4.219 14.105 . . . 1.0 . . . . . . . . . . . . A . 2 A H5' . . . . . . . . . rr_1nts 1
. 1 . 17 . 1 1 1 A H5'' H 8.957 -5.339 13.287 . . . 1.0 . . . . . . . . . . . . A . 2 A H5'' . . . . . . . . . rr_1nts 1
. 1 . 18 . 1 1 1 A H61 H -2.002 -5.431 12.592 . . . 1.0 . . . . . . . . . . . . A . 2 A H61 . . . . . . . . . rr_1nts 1
. 1 . 19 . 1 1 1 A H62 H -0.742 -4.098 12.718 . . . 1.0 . . . . . . . . . . . . A . 2 A H62 . . . . . . . . . rr_1nts 1
. 1 . 20 . 1 1 1 A H8 H 3.946 -4.056 13.507 . . . 1.0 . . . . . . . . . . . . A . 2 A H8 . . . . . . . . . rr_1nts 1
. 1 . 21 . 1 1 1 A HO2' H 6.584 -9.274 13.378 . . . 1.0 . . . . . . . . . . . . A . 2 A HO2' . . . . . . . . . rr_1nts 1
. 1 . 22 . 1 1 1 A HO5' H 7.876 -5.075 11.379 . . . 1.0 . . . . . . . . . . . . A . 2 A HO5' . . . . . . . . . rr_1nts 1
. 1 . 23 . 1 1 1 A N1 N -0.470 -7.260 12.930 . . . 1.0 . . . . . . . . . . . . A . 2 A N1 . . . . . . . . . rr_1nts 1
. 1 . 24 . 1 1 1 A N3 N 1.714 -8.082 13.345 . . . 1.0 . . . . . . . . . . . . A . 2 A N3 . . . . . . . . . rr_1nts 1
. 1 . 25 . 1 1 1 A N6 N -1.051 -5.077 12.736 . . . 1.0 . . . . . . . . . . . . A . 2 A N6 . . . . . . . . . rr_1nts 1
. 1 . 26 . 1 1 1 A N7 N 1.883 -4.378 13.154 . . . 1.0 . . . . . . . . . . . . A . 2 A N7 . . . . . . . . . rr_1nts 1
. 1 . 27 . 1 1 1 A N9 N 3.494 -6.147 13.571 . . . 1.0 . . . . . . . . . . . . A . 2 A N9 . . . . . . . . . rr_1nts 1
. 1 . 28 . 1 1 1 A O2' O 5.815 -8.970 13.871 . . . 1.0 . . . . . . . . . . . . A . 2 A O2' . . . . . . . . . rr_1nts 1
. 1 . 29 . 1 1 1 A O3' O 7.605 -7.940 12.097 . . . 1.0 . . . . . . . . . . . . A . 2 A O3' . . . . . . . . . rr_1nts 1
. 1 . 30 . 1 1 1 A O4' O 5.770 -5.764 14.321 . . . 1.0 . . . . . . . . . . . . A . 2 A O4' . . . . . . . . . rr_1nts 1
. 1 . 31 . 1 1 1 A O5' O 7.575 -4.433 12.055 . . . 1.0 . . . . . . . . . . . . A . 2 A O5' . . . . . . . . . rr_1nts 1
. 1 . 32 . 1 1 2 A C1' C 3.485 -9.349 9.359 . . . 1.0 . . . . . . . . . . . . A . 3 A C1' . . . . . . . . . rr_1nts 1
. 1 . 33 . 1 1 2 A C2 C -0.327 -6.740 9.260 . . . 1.0 . . . . . . . . . . . . A . 3 A C2 . . . . . . . . . rr_1nts 1
. 1 . 34 . 1 1 2 A C2' C 3.650 -9.679 7.863 . . . 1.0 . . . . . . . . . . . . A . 3 A C2' . . . . . . . . . rr_1nts 1
. 1 . 35 . 1 1 2 A C3' C 5.172 -9.676 7.667 . . . 1.0 . . . . . . . . . . . . A . 3 A C3' . . . . . . . . . rr_1nts 1
. 1 . 36 . 1 1 2 A C4 C 1.953 -7.246 9.482 . . . 1.0 . . . . . . . . . . . . A . 3 A C4 . . . . . . . . . rr_1nts 1
. 1 . 37 . 1 1 2 A C4' C 5.656 -10.211 9.022 . . . 1.0 . . . . . . . . . . . . A . 3 A C4' . . . . . . . . . rr_1nts 1
. 1 . 38 . 1 1 2 A C5 C 2.198 -5.811 9.582 . . . 1.0 . . . . . . . . . . . . A . 3 A C5 . . . . . . . . . rr_1nts 1
. 1 . 39 . 1 1 2 A C5' C 7.087 -9.825 9.431 . . . 1.0 . . . . . . . . . . . . A . 3 A C5' . . . . . . . . . rr_1nts 1
. 1 . 40 . 1 1 2 A C6 C 1.049 -4.934 9.505 . . . 1.0 . . . . . . . . . . . . A . 3 A C6 . . . . . . . . . rr_1nts 1
. 1 . 41 . 1 1 2 A C8 C 4.018 -6.803 9.720 . . . 1.0 . . . . . . . . . . . . A . 3 A C8 . . . . . . . . . rr_1nts 1
. 1 . 42 . 1 1 2 A H1' H 2.667 -9.954 9.795 . . . 1.0 . . . . . . . . . . . . A . 3 A H1' . . . . . . . . . rr_1nts 1
. 1 . 43 . 1 1 2 A H2 H -1.347 -7.068 9.121 . . . 1.0 . . . . . . . . . . . . A . 3 A H2 . . . . . . . . . rr_1nts 1
. 1 . 44 . 1 1 2 A H2' H 3.167 -8.936 7.202 . . . 1.0 . . . . . . . . . . . . A . 3 A H2' . . . . . . . . . rr_1nts 1
. 1 . 45 . 1 1 2 A H3' H 5.524 -8.634 7.530 . . . 1.0 . . . . . . . . . . . . A . 3 A H3' . . . . . . . . . rr_1nts 1
. 1 . 46 . 1 1 2 A H4' H 5.584 -11.316 9.011 . . . 1.0 . . . . . . . . . . . . A . 3 A H4' . . . . . . . . . rr_1nts 1
. 1 . 47 . 1 1 2 A H5' H 7.334 -10.322 10.389 . . . 1.0 . . . . . . . . . . . . A . 3 A H5' . . . . . . . . . rr_1nts 1
. 1 . 48 . 1 1 2 A H5'' H 7.814 -10.212 8.692 . . . 1.0 . . . . . . . . . . . . A . 3 A H5'' . . . . . . . . . rr_1nts 1
. 1 . 49 . 1 1 2 A H61 H 0.296 -3.070 9.538 . . . 1.0 . . . . . . . . . . . . A . 3 A H61 . . . . . . . . . rr_1nts 1
. 1 . 50 . 1 1 2 A H62 H 2.114 -3.248 9.725 . . . 1.0 . . . . . . . . . . . . A . 3 A H62 . . . . . . . . . rr_1nts 1
. 1 . 51 . 1 1 2 A H8 H 5.081 -6.967 9.813 . . . 1.0 . . . . . . . . . . . . A . 3 A H8 . . . . . . . . . rr_1nts 1
. 1 . 52 . 1 1 2 A HO2' H 2.834 -10.938 6.662 . . . 1.0 . . . . . . . . . . . . A . 3 A HO2' . . . . . . . . . rr_1nts 1
. 1 . 53 . 1 1 2 A N1 N -0.158 -5.438 9.347 . . . 1.0 . . . . . . . . . . . . A . 3 A N1 . . . . . . . . . rr_1nts 1
. 1 . 54 . 1 1 2 A N3 N 0.569 -7.690 9.305 . . . 1.0 . . . . . . . . . . . . A . 3 A N3 . . . . . . . . . rr_1nts 1
. 1 . 55 . 1 1 2 A N6 N 1.164 -3.615 9.603 . . . 1.0 . . . . . . . . . . . . A . 3 A N6 . . . . . . . . . rr_1nts 1
. 1 . 56 . 1 1 2 A N7 N 3.543 -5.510 9.746 . . . 1.0 . . . . . . . . . . . . A . 3 A N7 . . . . . . . . . rr_1nts 1
. 1 . 57 . 1 1 2 A N9 N 3.176 -7.899 9.569 . . . 1.0 . . . . . . . . . . . . A . 3 A N9 . . . . . . . . . rr_1nts 1
. 1 . 58 . 1 1 2 A O2' O 3.086 -10.961 7.592 . . . 1.0 . . . . . . . . . . . . A . 3 A O2' . . . . . . . . . rr_1nts 1
. 1 . 59 . 1 1 2 A O3' O 5.617 -10.501 6.571 . . . 1.0 . . . . . . . . . . . . A . 3 A O3' . . . . . . . . . rr_1nts 1
. 1 . 60 . 1 1 2 A O4' O 4.723 -9.712 10.004 . . . 1.0 . . . . . . . . . . . . A . 3 A O4' . . . . . . . . . rr_1nts 1
. 1 . 61 . 1 1 2 A O5' O 7.237 -8.396 9.548 . . . 1.0 . . . . . . . . . . . . A . 3 A O5' . . . . . . . . . rr_1nts 1
. 1 . 62 . 1 1 2 A OP1 O 9.614 -8.403 10.561 . . . 1.0 . . . . . . . . . . . . A . 3 A OP1 . . . . . . . . . rr_1nts 1
. 1 . 63 . 1 1 2 A OP2 O 8.382 -6.227 10.359 . . . 1.0 . . . . . . . . . . . . A . 3 A OP2 . . . . . . . . . rr_1nts 1
. 1 . 64 . 1 1 2 A P P 8.242 -7.732 10.625 . . . 1.0 . . . . . . . . . . . . A . 3 A P . . . . . . . . . rr_1nts 1
. 1 . 65 . 1 1 3 A C1' C 0.169 -9.494 5.182 . . . 1.0 . . . . . . . . . . . . A . 4 A C1' . . . . . . . . . rr_1nts 1
. 1 . 66 . 1 1 3 A C2 C -2.249 -5.638 6.085 . . . 1.0 . . . . . . . . . . . . A . 4 A C2 . . . . . . . . . rr_1nts 1
. 1 . 67 . 1 1 3 A C2' C -0.185 -9.817 3.722 . . . 1.0 . . . . . . . . . . . . A . 4 A C2' . . . . . . . . . rr_1nts 1
. 1 . 68 . 1 1 3 A C3' C 1.140 -10.328 3.149 . . . 1.0 . . . . . . . . . . . . A . 4 A C3' . . . . . . . . . rr_1nts 1
. 1 . 69 . 1 1 3 A C4 C -0.366 -6.976 5.645 . . . 1.0 . . . . . . . . . . . . A . 4 A C4 . . . . . . . . . rr_1nts 1
. 1 . 70 . 1 1 3 A C4' C 1.706 -11.092 4.356 . . . 1.0 . . . . . . . . . . . . A . 4 A C4' . . . . . . . . . rr_1nts 1
. 1 . 71 . 1 1 3 A C5 C 0.434 -5.758 5.714 . . . 1.0 . . . . . . . . . . . . A . 4 A C5 . . . . . . . . . rr_1nts 1
. 1 . 72 . 1 1 3 A C5' C 3.230 -11.309 4.344 . . . 1.0 . . . . . . . . . . . . A . 4 A C5' . . . . . . . . . rr_1nts 1
. 1 . 73 . 1 1 3 A C6 C -0.264 -4.518 5.986 . . . 1.0 . . . . . . . . . . . . A . 4 A C6 . . . . . . . . . rr_1nts 1
. 1 . 74 . 1 1 3 A C8 C 1.700 -7.356 5.301 . . . 1.0 . . . . . . . . . . . . A . 4 A C8 . . . . . . . . . rr_1nts 1
. 1 . 75 . 1 1 3 A H1' H -0.691 -9.751 5.825 . . . 1.0 . . . . . . . . . . . . A . 4 A H1' . . . . . . . . . rr_1nts 1
. 1 . 76 . 1 1 3 A H2 H -3.315 -5.549 6.235 . . . 1.0 . . . . . . . . . . . . A . 4 A H2 . . . . . . . . . rr_1nts 1
. 1 . 77 . 1 1 3 A H2' H -0.559 -8.945 3.163 . . . 1.0 . . . . . . . . . . . . A . 4 A H2' . . . . . . . . . rr_1nts 1
. 1 . 78 . 1 1 3 A H3' H 1.801 -9.473 2.900 . . . 1.0 . . . . . . . . . . . . A . 4 A H3' . . . . . . . . . rr_1nts 1
. 1 . 79 . 1 1 3 A H4' H 1.221 -12.087 4.399 . . . 1.0 . . . . . . . . . . . . A . 4 A H4' . . . . . . . . . rr_1nts 1
. 1 . 80 . 1 1 3 A H5' H 3.502 -12.044 5.124 . . . 1.0 . . . . . . . . . . . . A . 4 A H5' . . . . . . . . . rr_1nts 1
. 1 . 81 . 1 1 3 A H5'' H 3.550 -11.758 3.384 . . . 1.0 . . . . . . . . . . . . A . 4 A H5'' . . . . . . . . . rr_1nts 1
. 1 . 82 . 1 1 3 A H61 H -0.198 -2.533 6.278 . . . 1.0 . . . . . . . . . . . . A . 4 A H61 . . . . . . . . . rr_1nts 1
. 1 . 83 . 1 1 3 A H62 H 1.393 -3.386 5.922 . . . 1.0 . . . . . . . . . . . . A . 4 A H62 . . . . . . . . . rr_1nts 1
. 1 . 84 . 1 1 3 A H8 H 2.604 -7.898 5.059 . . . 1.0 . . . . . . . . . . . . A . 4 A H8 . . . . . . . . . rr_1nts 1
. 1 . 85 . 1 1 3 A HO2' H -1.004 -11.306 2.848 . . . 1.0 . . . . . . . . . . . . A . 4 A HO2' . . . . . . . . . rr_1nts 1
. 1 . 86 . 1 1 3 A N1 N -1.571 -4.514 6.163 . . . 1.0 . . . . . . . . . . . . A . 4 A N1 . . . . . . . . . rr_1nts 1
. 1 . 87 . 1 1 3 A N3 N -1.812 -6.849 5.851 . . . 1.0 . . . . . . . . . . . . A . 4 A N3 . . . . . . . . . rr_1nts 1
. 1 . 88 . 1 1 3 A N6 N 0.379 -3.360 6.071 . . . 1.0 . . . . . . . . . . . . A . 4 A N6 . . . . . . . . . rr_1nts 1
. 1 . 89 . 1 1 3 A N7 N 1.785 -5.995 5.498 . . . 1.0 . . . . . . . . . . . . A . 4 A N7 . . . . . . . . . rr_1nts 1
. 1 . 90 . 1 1 3 A N9 N 0.491 -8.042 5.378 . . . 1.0 . . . . . . . . . . . . A . 4 A N9 . . . . . . . . . rr_1nts 1
. 1 . 91 . 1 1 3 A O2' O -1.171 -10.847 3.677 . . . 1.0 . . . . . . . . . . . . A . 4 A O2' . . . . . . . . . rr_1nts 1
. 1 . 92 . 1 1 3 A O3' O 0.948 -11.177 2.000 . . . 1.0 . . . . . . . . . . . . A . 4 A O3' . . . . . . . . . rr_1nts 1
. 1 . 93 . 1 1 3 A O4' O 1.297 -10.337 5.519 . . . 1.0 . . . . . . . . . . . . A . 4 A O4' . . . . . . . . . rr_1nts 1
. 1 . 94 . 1 1 3 A O5' O 3.938 -10.075 4.564 . . . 1.0 . . . . . . . . . . . . A . 4 A O5' . . . . . . . . . rr_1nts 1
. 1 . 95 . 1 1 3 A OP1 O 6.310 -10.988 4.145 . . . 1.0 . . . . . . . . . . . . A . 4 A OP1 . . . . . . . . . rr_1nts 1
. 1 . 96 . 1 1 3 A OP2 O 6.029 -8.613 4.868 . . . 1.0 . . . . . . . . . . . . A . 4 A OP2 . . . . . . . . . rr_1nts 1
. 1 . 97 . 1 1 3 A P P 5.492 -10.037 5.021 . . . 1.0 . . . . . . . . . . . . A . 4 A P . . . . . . . . . rr_1nts 1
. 1 . 98 . 1 1 4 G C1' C -3.497 -7.492 1.869 . . . 1.0 . . . . . . . . . . . . A . 5 G C1' . . . . . . . . . rr_1nts 1
. 1 . 99 . 1 1 4 G C2 C -3.809 -3.012 2.996 . . . 1.0 . . . . . . . . . . . . A . 5 G C2 . . . . . . . . . rr_1nts 1
. 1 . 100 . 1 1 4 G C2' C -4.150 -7.393 0.475 . . . 1.0 . . . . . . . . . . . . A . 5 G C2' . . . . . . . . . rr_1nts 1
. 1 . 101 . 1 1 4 G C3' C -3.363 -8.415 -0.351 . . . 1.0 . . . . . . . . . . . . A . 5 G C3' . . . . . . . . . rr_1nts 1
. 1 . 102 . 1 1 4 G C4 C -2.693 -5.069 2.429 . . . 1.0 . . . . . . . . . . . . A . 5 G C4 . . . . . . . . . rr_1nts 1
. 1 . 103 . 1 1 4 G C4' C -3.093 -9.502 0.698 . . . 1.0 . . . . . . . . . . . . A . 5 G C4' . . . . . . . . . rr_1nts 1
. 1 . 104 . 1 1 4 G C5 C -1.413 -4.420 2.485 . . . 1.0 . . . . . . . . . . . . A . 5 G C5 . . . . . . . . . rr_1nts 1
. 1 . 105 . 1 1 4 G C5' C -1.922 -10.449 0.380 . . . 1.0 . . . . . . . . . . . . A . 5 G C5' . . . . . . . . . rr_1nts 1
. 1 . 106 . 1 1 4 G C6 C -1.328 -2.918 2.866 . . . 1.0 . . . . . . . . . . . . A . 5 G C6 . . . . . . . . . rr_1nts 1
. 1 . 107 . 1 1 4 G C8 C -1.104 -6.401 1.975 . . . 1.0 . . . . . . . . . . . . A . 5 G C8 . . . . . . . . . rr_1nts 1
. 1 . 108 . 1 1 4 G H1 H -2.464 -1.318 3.340 . . . 1.0 . . . . . . . . . . . . A . 5 G H1 . . . . . . . . . rr_1nts 1
. 1 . 109 . 1 1 4 G H1' H -4.272 -7.421 2.656 . . . 1.0 . . . . . . . . . . . . A . 5 G H1' . . . . . . . . . rr_1nts 1
. 1 . 110 . 1 1 4 G H2' H -4.088 -6.383 0.031 . . . 1.0 . . . . . . . . . . . . A . 5 G H2' . . . . . . . . . rr_1nts 1
. 1 . 111 . 1 1 4 G H21 H -4.931 -1.293 3.390 . . . 1.0 . . . . . . . . . . . . A . 5 G H21 . . . . . . . . . rr_1nts 1
. 1 . 112 . 1 1 4 G H22 H -5.877 -2.802 3.110 . . . 1.0 . . . . . . . . . . . . A . 5 G H22 . . . . . . . . . rr_1nts 1
. 1 . 113 . 1 1 4 G H3' H -2.403 -7.971 -0.688 . . . 1.0 . . . . . . . . . . . . A . 5 G H3' . . . . . . . . . rr_1nts 1
. 1 . 114 . 1 1 4 G H4' H -4.006 -10.119 0.806 . . . 1.0 . . . . . . . . . . . . A . 5 G H4' . . . . . . . . . rr_1nts 1
. 1 . 115 . 1 1 4 G H5' H -1.928 -11.285 1.104 . . . 1.0 . . . . . . . . . . . . A . 5 G H5' . . . . . . . . . rr_1nts 1
. 1 . 116 . 1 1 4 G H5'' H -2.064 -10.913 -0.615 . . . 1.0 . . . . . . . . . . . . A . 5 G H5'' . . . . . . . . . rr_1nts 1
. 1 . 117 . 1 1 4 G H8 H -0.589 -7.320 1.732 . . . 1.0 . . . . . . . . . . . . A . 5 G H8 . . . . . . . . . rr_1nts 1
. 1 . 118 . 1 1 4 G HO2' H -5.717 -8.149 -0.313 . . . 1.0 . . . . . . . . . . . . A . 5 G HO2' . . . . . . . . . rr_1nts 1
. 1 . 119 . 1 1 4 G N1 N -2.524 -2.315 3.107 . . . 1.0 . . . . . . . . . . . . A . 5 G N1 . . . . . . . . . rr_1nts 1
. 1 . 120 . 1 1 4 G N2 N -4.989 -2.297 3.183 . . . 1.0 . . . . . . . . . . . . A . 5 G N2 . . . . . . . . . rr_1nts 1
. 1 . 121 . 1 1 4 G N3 N -3.865 -4.270 2.709 . . . 1.0 . . . . . . . . . . . . A . 5 G N3 . . . . . . . . . rr_1nts 1
. 1 . 122 . 1 1 4 G N7 N -0.359 -5.264 2.194 . . . 1.0 . . . . . . . . . . . . A . 5 G N7 . . . . . . . . . rr_1nts 1
. 1 . 123 . 1 1 4 G N9 N -2.489 -6.402 2.090 . . . 1.0 . . . . . . . . . . . . A . 5 G N9 . . . . . . . . . rr_1nts 1
. 1 . 124 . 1 1 4 G O2' O -5.522 -7.774 0.551 . . . 1.0 . . . . . . . . . . . . A . 5 G O2' . . . . . . . . . rr_1nts 1
. 1 . 125 . 1 1 4 G O3' O -4.116 -8.926 -1.470 . . . 1.0 . . . . . . . . . . . . A . 5 G O3' . . . . . . . . . rr_1nts 1
. 1 . 126 . 1 1 4 G O4' O -2.879 -8.798 1.939 . . . 1.0 . . . . . . . . . . . . A . 5 G O4' . . . . . . . . . rr_1nts 1
. 1 . 127 . 1 1 4 G O5' O -0.652 -9.771 0.421 . . . 1.0 . . . . . . . . . . . . A . 5 G O5' . . . . . . . . . rr_1nts 1
. 1 . 128 . 1 1 4 G O6 O -0.274 -2.292 2.952 . . . 1.0 . . . . . . . . . . . . A . 5 G O6 . . . . . . . . . rr_1nts 1
. 1 . 129 . 1 1 4 G OP1 O 0.746 -11.732 -0.498 . . . 1.0 . . . . . . . . . . . . A . 5 G OP1 . . . . . . . . . rr_1nts 1
. 1 . 130 . 1 1 4 G OP2 O 1.905 -9.626 0.182 . . . 1.0 . . . . . . . . . . . . A . 5 G OP2 . . . . . . . . . rr_1nts 1
. 1 . 131 . 1 1 4 G P P 0.753 -10.577 0.504 . . . 1.0 . . . . . . . . . . . . A . 5 G P . . . . . . . . . rr_1nts 1
. 1 . 132 . 1 1 5 G C1' C -6.072 -3.552 -1.011 . . . 1.0 . . . . . . . . . . . . A . 6 G C1' . . . . . . . . . rr_1nts 1
. 1 . 133 . 1 1 5 G C2 C -3.742 0.231 0.282 . . . 1.0 . . . . . . . . . . . . A . 6 G C2 . . . . . . . . . rr_1nts 1
. 1 . 134 . 1 1 5 G C2' C -6.790 -3.052 -2.272 . . . 1.0 . . . . . . . . . . . . A . 6 G C2' . . . . . . . . . rr_1nts 1
. 1 . 135 . 1 1 5 G C3' C -6.731 -4.265 -3.201 . . . 1.0 . . . . . . . . . . . . A . 6 G C3' . . . . . . . . . rr_1nts 1
. 1 . 136 . 1 1 5 G C4 C -4.014 -2.017 -0.537 . . . 1.0 . . . . . . . . . . . . A . 6 G C4 . . . . . . . . . rr_1nts 1
. 1 . 137 . 1 1 5 G C4' C -6.923 -5.411 -2.196 . . . 1.0 . . . . . . . . . . . . A . 6 G C4' . . . . . . . . . rr_1nts 1
. 1 . 138 . 1 1 5 G C5 C -2.590 -2.197 -0.594 . . . 1.0 . . . . . . . . . . . . A . 6 G C5 . . . . . . . . . rr_1nts 1
. 1 . 139 . 1 1 5 G C5' C -6.415 -6.787 -2.659 . . . 1.0 . . . . . . . . . . . . A . 6 G C5' . . . . . . . . . rr_1nts 1
. 1 . 140 . 1 1 5 G C6 C -1.652 -1.051 -0.133 . . . 1.0 . . . . . . . . . . . . A . 6 G C6 . . . . . . . . . rr_1nts 1
. 1 . 141 . 1 1 5 G C8 C -3.481 -3.924 -1.300 . . . 1.0 . . . . . . . . . . . . A . 6 G C8 . . . . . . . . . rr_1nts 1
. 1 . 142 . 1 1 5 G H1 H -1.659 0.848 0.553 . . . 1.0 . . . . . . . . . . . . A . 6 G H1 . . . . . . . . . rr_1nts 1
. 1 . 143 . 1 1 5 G H1' H -6.556 -3.094 -0.133 . . . 1.0 . . . . . . . . . . . . A . 6 G H1' . . . . . . . . . rr_1nts 1
. 1 . 144 . 1 1 5 G H2' H -6.316 -2.164 -2.712 . . . 1.0 . . . . . . . . . . . . A . 6 G H2' . . . . . . . . . rr_1nts 1
. 1 . 145 . 1 1 5 G H21 H -3.676 2.232 0.876 . . . 1.0 . . . . . . . . . . . . A . 6 G H21 . . . . . . . . . rr_1nts 1
. 1 . 146 . 1 1 5 G H22 H -5.323 1.543 0.620 . . . 1.0 . . . . . . . . . . . . A . 6 G H22 . . . . . . . . . rr_1nts 1
. 1 . 147 . 1 1 5 G H3' H -5.728 -4.336 -3.671 . . . 1.0 . . . . . . . . . . . . A . 6 G H3' . . . . . . . . . rr_1nts 1
. 1 . 148 . 1 1 5 G H4' H -8.004 -5.507 -1.973 . . . 1.0 . . . . . . . . . . . . A . 6 G H4' . . . . . . . . . rr_1nts 1
. 1 . 149 . 1 1 5 G H5' H -6.735 -7.555 -1.930 . . . 1.0 . . . . . . . . . . . . A . 6 G H5' . . . . . . . . . rr_1nts 1
. 1 . 150 . 1 1 5 G H5'' H -6.887 -7.067 -3.620 . . . 1.0 . . . . . . . . . . . . A . 6 G H5'' . . . . . . . . . rr_1nts 1
. 1 . 151 . 1 1 5 G H8 H -3.587 -4.911 -1.727 . . . 1.0 . . . . . . . . . . . . A . 6 G H8 . . . . . . . . . rr_1nts 1
. 1 . 152 . 1 1 5 G HO2' H -8.633 -2.973 -2.768 . . . 1.0 . . . . . . . . . . . . A . 6 G HO2' . . . . . . . . . rr_1nts 1
. 1 . 153 . 1 1 5 G N1 N -2.284 0.081 0.284 . . . 1.0 . . . . . . . . . . . . A . 6 G N1 . . . . . . . . . rr_1nts 1
. 1 . 154 . 1 1 5 G N2 N -4.303 1.456 0.636 . . . 1.0 . . . . . . . . . . . . A . 6 G N2 . . . . . . . . . rr_1nts 1
. 1 . 155 . 1 1 5 G N3 N -4.513 -0.744 -0.069 . . . 1.0 . . . . . . . . . . . . A . 6 G N3 . . . . . . . . . rr_1nts 1
. 1 . 156 . 1 1 5 G N7 N -2.214 -3.430 -1.089 . . . 1.0 . . . . . . . . . . . . A . 6 G N7 . . . . . . . . . rr_1nts 1
. 1 . 157 . 1 1 5 G N9 N -4.617 -3.186 -0.986 . . . 1.0 . . . . . . . . . . . . A . 6 G N9 . . . . . . . . . rr_1nts 1
. 1 . 158 . 1 1 5 G O2' O -8.149 -2.733 -1.972 . . . 1.0 . . . . . . . . . . . . A . 6 G O2' . . . . . . . . . rr_1nts 1
. 1 . 159 . 1 1 5 G O3' O -7.767 -4.231 -4.203 . . . 1.0 . . . . . . . . . . . . A . 6 G O3' . . . . . . . . . rr_1nts 1
. 1 . 160 . 1 1 5 G O4' O -6.254 -4.988 -0.985 . . . 1.0 . . . . . . . . . . . . A . 6 G O4' . . . . . . . . . rr_1nts 1
. 1 . 161 . 1 1 5 G O5' O -4.983 -6.807 -2.799 . . . 1.0 . . . . . . . . . . . . A . 6 G O5' . . . . . . . . . rr_1nts 1
. 1 . 162 . 1 1 5 G O6 O -0.426 -1.132 -0.133 . . . 1.0 . . . . . . . . . . . . A . 6 G O6 . . . . . . . . . rr_1nts 1
. 1 . 163 . 1 1 5 G OP1 O -4.819 -9.113 -3.931 . . . 1.0 . . . . . . . . . . . . A . 6 G OP1 . . . . . . . . . rr_1nts 1
. 1 . 164 . 1 1 5 G OP2 O -2.719 -7.882 -3.367 . . . 1.0 . . . . . . . . . . . . A . 6 G OP2 . . . . . . . . . rr_1nts 1
. 1 . 165 . 1 1 5 G P P -4.147 -8.188 -2.914 . . . 1.0 . . . . . . . . . . . . A . 6 G P . . . . . . . . . rr_1nts 1
. 1 . 166 . 1 1 6 A C1' C -6.188 1.284 -3.362 . . . 1.0 . . . . . . . . . . . . A . 7 A C1' . . . . . . . . . rr_1nts 1
. 1 . 167 . 1 1 6 A C2 C -1.918 2.874 -2.494 . . . 1.0 . . . . . . . . . . . . A . 7 A C2 . . . . . . . . . rr_1nts 1
. 1 . 168 . 1 1 6 A C2' C -6.560 2.186 -4.554 . . . 1.0 . . . . . . . . . . . . A . 7 A C2' . . . . . . . . . rr_1nts 1
. 1 . 169 . 1 1 6 A C3' C -7.315 1.232 -5.485 . . . 1.0 . . . . . . . . . . . . A . 7 A C3' . . . . . . . . . rr_1nts 1
. 1 . 170 . 1 1 6 A C4 C -3.580 1.363 -3.186 . . . 1.0 . . . . . . . . . . . . A . 7 A C4 . . . . . . . . . rr_1nts 1
. 1 . 171 . 1 1 6 A C4' C -8.058 0.353 -4.468 . . . 1.0 . . . . . . . . . . . . A . 7 A C4' . . . . . . . . . rr_1nts 1
. 1 . 172 . 1 1 6 A C5 C -2.509 0.408 -3.450 . . . 1.0 . . . . . . . . . . . . A . 7 A C5 . . . . . . . . . rr_1nts 1
. 1 . 173 . 1 1 6 A C5' C -8.516 -1.021 -4.989 . . . 1.0 . . . . . . . . . . . . A . 7 A C5' . . . . . . . . . rr_1nts 1
. 1 . 174 . 1 1 6 A C6 C -1.154 0.829 -3.164 . . . 1.0 . . . . . . . . . . . . A . 7 A C6 . . . . . . . . . rr_1nts 1
. 1 . 175 . 1 1 6 A C8 C -4.327 -0.502 -3.885 . . . 1.0 . . . . . . . . . . . . A . 7 A C8 . . . . . . . . . rr_1nts 1
. 1 . 176 . 1 1 6 A H1' H -6.264 1.861 -2.422 . . . 1.0 . . . . . . . . . . . . A . 7 A H1' . . . . . . . . . rr_1nts 1
. 1 . 177 . 1 1 6 A H2 H -1.640 3.859 -2.146 . . . 1.0 . . . . . . . . . . . . A . 7 A H2 . . . . . . . . . rr_1nts 1
. 1 . 178 . 1 1 6 A H2' H -5.684 2.632 -5.053 . . . 1.0 . . . . . . . . . . . . A . 7 A H2' . . . . . . . . . rr_1nts 1
. 1 . 179 . 1 1 6 A H3' H -6.594 0.615 -6.059 . . . 1.0 . . . . . . . . . . . . A . 7 A H3' . . . . . . . . . rr_1nts 1
. 1 . 180 . 1 1 6 A H4' H -8.958 0.899 -4.122 . . . 1.0 . . . . . . . . . . . . A . 7 A H4' . . . . . . . . . rr_1nts 1
. 1 . 181 . 1 1 6 A H5' H -9.132 -1.515 -4.215 . . . 1.0 . . . . . . . . . . . . A . 7 A H5' . . . . . . . . . rr_1nts 1
. 1 . 182 . 1 1 6 A H5'' H -9.178 -0.893 -5.867 . . . 1.0 . . . . . . . . . . . . A . 7 A H5'' . . . . . . . . . rr_1nts 1
. 1 . 183 . 1 1 6 A H61 H 0.808 0.368 -3.075 . . . 1.0 . . . . . . . . . . . . A . 7 A H61 . . . . . . . . . rr_1nts 1
. 1 . 184 . 1 1 6 A H62 H -0.339 -0.925 -3.688 . . . 1.0 . . . . . . . . . . . . A . 7 A H62 . . . . . . . . . rr_1nts 1
. 1 . 185 . 1 1 6 A H8 H -5.036 -1.284 -4.118 . . . 1.0 . . . . . . . . . . . . A . 7 A H8 . . . . . . . . . rr_1nts 1
. 1 . 186 . 1 1 6 A HO2' H -7.987 3.413 -4.883 . . . 1.0 . . . . . . . . . . . . A . 7 A HO2' . . . . . . . . . rr_1nts 1
. 1 . 187 . 1 1 6 A N1 N -0.921 2.040 -2.696 . . . 1.0 . . . . . . . . . . . . A . 7 A N1 . . . . . . . . . rr_1nts 1
. 1 . 188 . 1 1 6 A N3 N -3.199 2.684 -2.677 . . . 1.0 . . . . . . . . . . . . A . 7 A N3 . . . . . . . . . rr_1nts 1
. 1 . 189 . 1 1 6 A N6 N -0.119 0.017 -3.344 . . . 1.0 . . . . . . . . . . . . A . 7 A N6 . . . . . . . . . rr_1nts 1
. 1 . 190 . 1 1 6 A N7 N -2.985 -0.812 -3.911 . . . 1.0 . . . . . . . . . . . . A . 7 A N7 . . . . . . . . . rr_1nts 1
. 1 . 191 . 1 1 6 A N9 N -4.793 0.746 -3.481 . . . 1.0 . . . . . . . . . . . . A . 7 A N9 . . . . . . . . . rr_1nts 1
. 1 . 192 . 1 1 6 A O2' O -7.423 3.238 -4.124 . . . 1.0 . . . . . . . . . . . . A . 7 A O2' . . . . . . . . . rr_1nts 1
. 1 . 193 . 1 1 6 A O3' O -8.220 1.924 -6.370 . . . 1.0 . . . . . . . . . . . . A . 7 A O3' . . . . . . . . . rr_1nts 1
. 1 . 194 . 1 1 6 A O4' O -7.162 0.214 -3.344 . . . 1.0 . . . . . . . . . . . . A . 7 A O4' . . . . . . . . . rr_1nts 1
. 1 . 195 . 1 1 6 A O5' O -7.403 -1.863 -5.344 . . . 1.0 . . . . . . . . . . . . A . 7 A O5' . . . . . . . . . rr_1nts 1
. 1 . 196 . 1 1 6 A OP1 O -8.807 -3.698 -6.489 . . . 1.0 . . . . . . . . . . . . A . 7 A OP1 . . . . . . . . . rr_1nts 1
. 1 . 197 . 1 1 6 A OP2 O -6.331 -3.985 -6.326 . . . 1.0 . . . . . . . . . . . . A . 7 A OP2 . . . . . . . . . rr_1nts 1
. 1 . 198 . 1 1 6 A P P -7.575 -3.453 -5.615 . . . 1.0 . . . . . . . . . . . . A . 7 A P . . . . . . . . . rr_1nts 1
. 1 . 199 . 1 1 7 G C1' C -3.921 5.722 -5.701 . . . 1.0 . . . . . . . . . . . . A . 8 G C1' . . . . . . . . . rr_1nts 1
. 1 . 200 . 1 1 7 G C2 C 0.636 5.007 -5.328 . . . 1.0 . . . . . . . . . . . . A . 8 G C2 . . . . . . . . . rr_1nts 1
. 1 . 201 . 1 1 7 G C2' C -3.868 6.769 -6.831 . . . 1.0 . . . . . . . . . . . . A . 8 G C2' . . . . . . . . . rr_1nts 1
. 1 . 202 . 1 1 7 G C3' C -5.082 6.406 -7.690 . . . 1.0 . . . . . . . . . . . . A . 8 G C3' . . . . . . . . . rr_1nts 1
. 1 . 203 . 1 1 7 G C4 C -1.654 4.430 -5.799 . . . 1.0 . . . . . . . . . . . . A . 8 G C4 . . . . . . . . . rr_1nts 1
. 1 . 204 . 1 1 7 G C4' C -6.086 5.968 -6.613 . . . 1.0 . . . . . . . . . . . . A . 8 G C4' . . . . . . . . . rr_1nts 1
. 1 . 205 . 1 1 7 G C5 C -1.271 3.095 -6.163 . . . 1.0 . . . . . . . . . . . . A . 8 G C5 . . . . . . . . . rr_1nts 1
. 1 . 206 . 1 1 7 G C5' C -7.231 5.065 -7.102 . . . 1.0 . . . . . . . . . . . . A . 8 G C5' . . . . . . . . . rr_1nts 1
. 1 . 207 . 1 1 7 G C6 C 0.215 2.667 -6.056 . . . 1.0 . . . . . . . . . . . . A . 8 G C6 . . . . . . . . . rr_1nts 1
. 1 . 208 . 1 1 7 G C8 C -3.306 3.281 -6.470 . . . 1.0 . . . . . . . . . . . . A . 8 G C8 . . . . . . . . . rr_1nts 1
. 1 . 209 . 1 1 7 G H1 H 2.056 3.365 -5.602 . . . 1.0 . . . . . . . . . . . . A . 8 G H1 . . . . . . . . . rr_1nts 1
. 1 . 210 . 1 1 7 G H1' H -3.606 6.183 -4.745 . . . 1.0 . . . . . . . . . . . . A . 8 G H1' . . . . . . . . . rr_1nts 1
. 1 . 211 . 1 1 7 G H2' H -2.931 6.735 -7.411 . . . 1.0 . . . . . . . . . . . . A . 8 G H2' . . . . . . . . . rr_1nts 1
. 1 . 212 . 1 1 7 G H21 H 2.581 5.696 -4.989 . . . 1.0 . . . . . . . . . . . . A . 8 G H21 . . . . . . . . . rr_1nts 1
. 1 . 213 . 1 1 7 G H22 H 1.269 6.916 -4.787 . . . 1.0 . . . . . . . . . . . . A . 8 G H22 . . . . . . . . . rr_1nts 1
. 1 . 214 . 1 1 7 G H3' H -4.837 5.546 -8.348 . . . 1.0 . . . . . . . . . . . . A . 8 G H3' . . . . . . . . . rr_1nts 1
. 1 . 215 . 1 1 7 G H4' H -6.538 6.874 -6.164 . . . 1.0 . . . . . . . . . . . . A . 8 G H4' . . . . . . . . . rr_1nts 1
. 1 . 216 . 1 1 7 G H5' H -7.958 4.926 -6.280 . . . 1.0 . . . . . . . . . . . . A . 8 G H5' . . . . . . . . . rr_1nts 1
. 1 . 217 . 1 1 7 G H5'' H -7.788 5.562 -7.919 . . . 1.0 . . . . . . . . . . . . A . 8 G H5'' . . . . . . . . . rr_1nts 1
. 1 . 218 . 1 1 7 G H8 H -4.318 3.029 -6.756 . . . 1.0 . . . . . . . . . . . . A . 8 G H8 . . . . . . . . . rr_1nts 1
. 1 . 219 . 1 1 7 G HO2' H -4.519 8.559 -6.968 . . . 1.0 . . . . . . . . . . . . A . 8 G HO2' . . . . . . . . . rr_1nts 1
. 1 . 220 . 1 1 7 G N1 N 1.069 3.641 -5.639 . . . 1.0 . . . . . . . . . . . . A . 8 G N1 . . . . . . . . . rr_1nts 1
. 1 . 221 . 1 1 7 G N2 N 1.592 5.970 -5.010 . . . 1.0 . . . . . . . . . . . . A . 8 G N2 . . . . . . . . . rr_1nts 1
. 1 . 222 . 1 1 7 G N3 N -0.611 5.339 -5.375 . . . 1.0 . . . . . . . . . . . . A . 8 G N3 . . . . . . . . . rr_1nts 1
. 1 . 223 . 1 1 7 G N7 N -2.326 2.324 -6.607 . . . 1.0 . . . . . . . . . . . . A . 8 G N7 . . . . . . . . . rr_1nts 1
. 1 . 224 . 1 1 7 G N9 N -3.026 4.551 -5.980 . . . 1.0 . . . . . . . . . . . . A . 8 G N9 . . . . . . . . . rr_1nts 1
. 1 . 225 . 1 1 7 G O2' O -4.022 8.082 -6.296 . . . 1.0 . . . . . . . . . . . . A . 8 G O2' . . . . . . . . . rr_1nts 1
. 1 . 226 . 1 1 7 G O3' O -5.563 7.526 -8.462 . . . 1.0 . . . . . . . . . . . . A . 8 G O3' . . . . . . . . . rr_1nts 1
. 1 . 227 . 1 1 7 G O4' O -5.303 5.308 -5.595 . . . 1.0 . . . . . . . . . . . . A . 8 G O4' . . . . . . . . . rr_1nts 1
. 1 . 228 . 1 1 7 G O5' O -6.750 3.785 -7.552 . . . 1.0 . . . . . . . . . . . . A . 8 G O5' . . . . . . . . . rr_1nts 1
. 1 . 229 . 1 1 7 G O6 O 0.622 1.541 -6.334 . . . 1.0 . . . . . . . . . . . . A . 8 G O6 . . . . . . . . . rr_1nts 1
. 1 . 230 . 1 1 7 G OP1 O -8.977 2.995 -8.577 . . . 1.0 . . . . . . . . . . . . A . 8 G OP1 . . . . . . . . . rr_1nts 1
. 1 . 231 . 1 1 7 G OP2 O -7.013 1.452 -8.598 . . . 1.0 . . . . . . . . . . . . A . 8 G OP2 . . . . . . . . . rr_1nts 1
. 1 . 232 . 1 1 7 G P P -7.744 2.530 -7.799 . . . 1.0 . . . . . . . . . . . . A . 8 G P . . . . . . . . . rr_1nts 1
. 1 . 233 . 1 1 8 G C1' C 0.114 8.127 -8.487 . . . 1.0 . . . . . . . . . . . . A . 9 G C1' . . . . . . . . . rr_1nts 1
. 1 . 234 . 1 1 8 G C2 C 3.356 4.844 -8.770 . . . 1.0 . . . . . . . . . . . . A . 9 G C2 . . . . . . . . . rr_1nts 1
. 1 . 235 . 1 1 8 G C2' C 0.643 9.018 -9.621 . . . 1.0 . . . . . . . . . . . . A . 9 G C2' . . . . . . . . . rr_1nts 1
. 1 . 236 . 1 1 8 G C3' C -0.636 9.510 -10.302 . . . 1.0 . . . . . . . . . . . . A . 9 G C3' . . . . . . . . . rr_1nts 1
. 1 . 237 . 1 1 8 G C4 C 1.132 5.758 -8.875 . . . 1.0 . . . . . . . . . . . . A . 9 G C4 . . . . . . . . . rr_1nts 1
. 1 . 238 . 1 1 8 G C4' C -1.576 9.663 -9.094 . . . 1.0 . . . . . . . . . . . . A . 9 G C4' . . . . . . . . . rr_1nts 1
. 1 . 239 . 1 1 8 G C5 C 0.590 4.472 -9.205 . . . 1.0 . . . . . . . . . . . . A . 9 G C5 . . . . . . . . . rr_1nts 1
. 1 . 240 . 1 1 8 G C5' C -3.081 9.609 -9.409 . . . 1.0 . . . . . . . . . . . . A . 9 G C5' . . . . . . . . . rr_1nts 1
. 1 . 241 . 1 1 8 G C6 C 1.527 3.241 -9.277 . . . 1.0 . . . . . . . . . . . . A . 9 G C6 . . . . . . . . . rr_1nts 1
. 1 . 242 . 1 1 8 G C8 C -0.956 5.843 -9.241 . . . 1.0 . . . . . . . . . . . . A . 9 G C8 . . . . . . . . . rr_1nts 1
. 1 . 243 . 1 1 8 G H1 H 3.461 2.685 -9.117 . . . 1.0 . . . . . . . . . . . . A . 9 G H1 . . . . . . . . . rr_1nts 1
. 1 . 244 . 1 1 8 G H1' H 0.764 8.243 -7.603 . . . 1.0 . . . . . . . . . . . . A . 9 G H1' . . . . . . . . . rr_1nts 1
. 1 . 245 . 1 1 8 G H2' H 1.302 8.481 -10.323 . . . 1.0 . . . . . . . . . . . . A . 9 G H2' . . . . . . . . . rr_1nts 1
. 1 . 246 . 1 1 8 G H21 H 5.360 4.240 -8.810 . . . 1.0 . . . . . . . . . . . . A . 9 G H21 . . . . . . . . . rr_1nts 1
. 1 . 247 . 1 1 8 G H22 H 5.067 5.989 -8.484 . . . 1.0 . . . . . . . . . . . . A . 9 G H22 . . . . . . . . . rr_1nts 1
. 1 . 248 . 1 1 8 G H3' H -1.025 8.730 -10.989 . . . 1.0 . . . . . . . . . . . . A . 9 G H3' . . . . . . . . . rr_1nts 1
. 1 . 249 . 1 1 8 G H4' H -1.366 10.634 -8.605 . . . 1.0 . . . . . . . . . . . . A . 9 G H4' . . . . . . . . . rr_1nts 1
. 1 . 250 . 1 1 8 G H5' H -3.650 9.856 -8.494 . . . 1.0 . . . . . . . . . . . . A . 9 G H5' . . . . . . . . . rr_1nts 1
. 1 . 251 . 1 1 8 G H5'' H -3.346 10.384 -10.153 . . . 1.0 . . . . . . . . . . . . A . 9 G H5'' . . . . . . . . . rr_1nts 1
. 1 . 252 . 1 1 8 G H8 H -1.949 6.251 -9.362 . . . 1.0 . . . . . . . . . . . . A . 9 G H8 . . . . . . . . . rr_1nts 1
. 1 . 253 . 1 1 8 G HO2' H 1.077 10.877 -9.609 . . . 1.0 . . . . . . . . . . . . A . 9 G HO2' . . . . . . . . . rr_1nts 1
. 1 . 254 . 1 1 8 G N1 N 2.842 3.497 -9.038 . . . 1.0 . . . . . . . . . . . . A . 9 G N1 . . . . . . . . . rr_1nts 1
. 1 . 255 . 1 1 8 G N2 N 4.733 5.042 -8.681 . . . 1.0 . . . . . . . . . . . . A . 9 G N2 . . . . . . . . . rr_1nts 1
. 1 . 256 . 1 1 8 G N3 N 2.559 5.853 -8.659 . . . 1.0 . . . . . . . . . . . . A . 9 G N3 . . . . . . . . . rr_1nts 1
. 1 . 257 . 1 1 8 G N7 N -0.768 4.497 -9.458 . . . 1.0 . . . . . . . . . . . . A . 9 G N7 . . . . . . . . . rr_1nts 1
. 1 . 258 . 1 1 8 G N9 N 0.091 6.678 -8.868 . . . 1.0 . . . . . . . . . . . . A . 9 G N9 . . . . . . . . . rr_1nts 1
. 1 . 259 . 1 1 8 G O2' O 1.359 10.126 -9.077 . . . 1.0 . . . . . . . . . . . . A . 9 G O2' . . . . . . . . . rr_1nts 1
. 1 . 260 . 1 1 8 G O3' O -0.424 10.755 -11.000 . . . 1.0 . . . . . . . . . . . . A . 9 G O3' . . . . . . . . . rr_1nts 1
. 1 . 261 . 1 1 8 G O4' O -1.211 8.611 -8.174 . . . 1.0 . . . . . . . . . . . . A . 9 G O4' . . . . . . . . . rr_1nts 1
. 1 . 262 . 1 1 8 G O5' O -3.475 8.314 -9.897 . . . 1.0 . . . . . . . . . . . . A . 9 G O5' . . . . . . . . . rr_1nts 1
. 1 . 263 . 1 1 8 G O6 O 1.141 2.105 -9.540 . . . 1.0 . . . . . . . . . . . . A . 9 G O6 . . . . . . . . . rr_1nts 1
. 1 . 264 . 1 1 8 G OP1 O -5.875 8.970 -10.563 . . . 1.0 . . . . . . . . . . . . A . 9 G OP1 . . . . . . . . . rr_1nts 1
. 1 . 265 . 1 1 8 G OP2 O -5.143 6.597 -10.829 . . . 1.0 . . . . . . . . . . . . A . 9 G OP2 . . . . . . . . . rr_1nts 1
. 1 . 266 . 1 1 8 G P P -5.026 7.848 -9.959 . . . 1.0 . . . . . . . . . . . . A . 9 G P . . . . . . . . . rr_1nts 1
. 1 . 267 . 1 1 9 A C1' C 4.165 7.314 -11.970 . . . 1.0 . . . . . . . . . . . . A . 10 A C1' . . . . . . . . . rr_1nts 1
. 1 . 268 . 1 1 9 A C2 C 3.962 2.713 -12.510 . . . 1.0 . . . . . . . . . . . . A . 10 A C2 . . . . . . . . . rr_1nts 1
. 1 . 269 . 1 1 9 A C2' C 4.922 7.744 -13.247 . . . 1.0 . . . . . . . . . . . . A . 10 A C2' . . . . . . . . . rr_1nts 1
. 1 . 270 . 1 1 9 A C3' C 4.276 9.088 -13.592 . . . 1.0 . . . . . . . . . . . . A . 10 A C3' . . . . . . . . . rr_1nts 1
. 1 . 271 . 1 1 9 A C4 C 3.190 4.932 -12.424 . . . 1.0 . . . . . . . . . . . . A . 10 A C4 . . . . . . . . . rr_1nts 1
. 1 . 272 . 1 1 9 A C4' C 3.922 9.654 -12.210 . . . 1.0 . . . . . . . . . . . . A . 10 A C4' . . . . . . . . . rr_1nts 1
. 1 . 273 . 1 1 9 A C5 C 1.855 4.408 -12.691 . . . 1.0 . . . . . . . . . . . . A . 10 A C5 . . . . . . . . . rr_1nts 1
. 1 . 274 . 1 1 9 A C5' C 2.763 10.668 -12.201 . . . 1.0 . . . . . . . . . . . . A . 10 A C5' . . . . . . . . . rr_1nts 1
. 1 . 275 . 1 1 9 A C6 C 1.720 2.973 -12.842 . . . 1.0 . . . . . . . . . . . . A . 10 A C6 . . . . . . . . . rr_1nts 1
. 1 . 276 . 1 1 9 A C8 C 1.717 6.470 -12.435 . . . 1.0 . . . . . . . . . . . . A . 10 A C8 . . . . . . . . . rr_1nts 1
. 1 . 277 . 1 1 9 A H1' H 4.869 6.869 -11.240 . . . 1.0 . . . . . . . . . . . . A . 10 A H1' . . . . . . . . . rr_1nts 1
. 1 . 278 . 1 1 9 A H2 H 4.775 2.005 -12.426 . . . 1.0 . . . . . . . . . . . . A . 10 A H2 . . . . . . . . . rr_1nts 1
. 1 . 279 . 1 1 9 A H2' H 4.813 7.026 -14.082 . . . 1.0 . . . . . . . . . . . . A . 10 A H2' . . . . . . . . . rr_1nts 1
. 1 . 280 . 1 1 9 A H3' H 3.357 8.918 -14.187 . . . 1.0 . . . . . . . . . . . . A . 10 A H3' . . . . . . . . . rr_1nts 1
. 1 . 281 . 1 1 9 A H4' H 4.816 10.145 -11.779 . . . 1.0 . . . . . . . . . . . . A . 10 A H4' . . . . . . . . . rr_1nts 1
. 1 . 282 . 1 1 9 A H5' H 2.631 11.064 -11.177 . . . 1.0 . . . . . . . . . . . . A . 10 A H5' . . . . . . . . . rr_1nts 1
. 1 . 283 . 1 1 9 A H5'' H 3.012 11.540 -12.835 . . . 1.0 . . . . . . . . . . . . A . 10 A H5'' . . . . . . . . . rr_1nts 1
. 1 . 284 . 1 1 9 A H61 H 0.537 1.376 -13.097 . . . 1.0 . . . . . . . . . . . . A . 10 A H61 . . . . . . . . . rr_1nts 1
. 1 . 285 . 1 1 9 A H62 H -0.273 3.025 -13.075 . . . 1.0 . . . . . . . . . . . . A . 10 A H62 . . . . . . . . . rr_1nts 1
. 1 . 286 . 1 1 9 A H8 H 1.272 7.445 -12.286 . . . 1.0 . . . . . . . . . . . . A . 10 A H8 . . . . . . . . . rr_1nts 1
. 1 . 287 . 1 1 9 A HO2' H 6.640 7.044 -12.702 . . . 1.0 . . . . . . . . . . . . A . 10 A HO2' . . . . . . . . . rr_1nts 1
. 1 . 288 . 1 1 9 A HO3' H 6.039 9.725 -13.951 . . . 1.0 . . . . . . . . . . . . A . 10 A HO3' . . . . . . . . . rr_1nts 1
. 1 . 289 . 1 1 9 A N1 N 2.778 2.190 -12.747 . . . 1.0 . . . . . . . . . . . . A . 10 A N1 . . . . . . . . . rr_1nts 1
. 1 . 290 . 1 1 9 A N3 N 4.292 3.968 -12.344 . . . 1.0 . . . . . . . . . . . . A . 10 A N3 . . . . . . . . . rr_1nts 1
. 1 . 291 . 1 1 9 A N6 N 0.541 2.400 -13.050 . . . 1.0 . . . . . . . . . . . . A . 10 A N6 . . . . . . . . . rr_1nts 1
. 1 . 292 . 1 1 9 A N7 N 0.886 5.404 -12.703 . . . 1.0 . . . . . . . . . . . . A . 10 A N7 . . . . . . . . . rr_1nts 1
. 1 . 293 . 1 1 9 A N9 N 3.091 6.312 -12.265 . . . 1.0 . . . . . . . . . . . . A . 10 A N9 . . . . . . . . . rr_1nts 1
. 1 . 294 . 1 1 9 A O2' O 6.312 7.910 -12.957 . . . 1.0 . . . . . . . . . . . . A . 10 A O2' . . . . . . . . . rr_1nts 1
. 1 . 295 . 1 1 9 A O3' O 5.170 9.933 -14.307 . . . 1.0 . . . . . . . . . . . . A . 10 A O3' . . . . . . . . . rr_1nts 1
. 1 . 296 . 1 1 9 A O4' O 3.608 8.513 -11.389 . . . 1.0 . . . . . . . . . . . . A . 10 A O4' . . . . . . . . . rr_1nts 1
. 1 . 297 . 1 1 9 A O5' O 1.535 10.070 -12.661 . . . 1.0 . . . . . . . . . . . . A . 10 A O5' . . . . . . . . . rr_1nts 1
. 1 . 298 . 1 1 9 A OP1 O 0.234 12.270 -12.971 . . . 1.0 . . . . . . . . . . . . A . 10 A OP1 . . . . . . . . . rr_1nts 1
. 1 . 299 . 1 1 9 A OP2 O -0.908 10.100 -13.443 . . . 1.0 . . . . . . . . . . . . A . 10 A OP2 . . . . . . . . . rr_1nts 1
. 1 . 300 . 1 1 9 A P P 0.098 10.809 -12.537 . . . 1.0 . . . . . . . . . . . . A . 10 A P . . . . . . . . . rr_1nts 1
. 1 . 301 . 2 2 1 5PC C1' C 8.467 0.320 -9.487 . . . 1.0 . . . . . . . . . . . . B . 1 5PC C1' . . . . . . . . . rr_1nts 1
. 1 . 302 . 2 2 1 5PC C2 C 6.108 1.177 -9.476 . . . 1.0 . . . . . . . . . . . . B . 1 5PC C2 . . . . . . . . . rr_1nts 1
. 1 . 303 . 2 2 1 5PC C2' C 9.191 0.825 -8.236 . . . 1.0 . . . . . . . . . . . . B . 1 5PC C2' . . . . . . . . . rr_1nts 1
. 1 . 304 . 2 2 1 5PC C3' C 9.693 -0.451 -7.575 . . . 1.0 . . . . . . . . . . . . B . 1 5PC C3' . . . . . . . . . rr_1nts 1
. 1 . 305 . 2 2 1 5PC C4 C 4.210 -0.295 -9.130 . . . 1.0 . . . . . . . . . . . . B . 1 5PC C4 . . . . . . . . . rr_1nts 1
. 1 . 306 . 2 2 1 5PC C4' C 10.094 -1.267 -8.811 . . . 1.0 . . . . . . . . . . . . B . 1 5PC C4' . . . . . . . . . rr_1nts 1
. 1 . 307 . 2 2 1 5PC C5 C 5.045 -1.382 -8.947 . . . 1.0 . . . . . . . . . . . . B . 1 5PC C5 . . . . . . . . . rr_1nts 1
. 1 . 308 . 2 2 1 5PC C5' C 10.086 -2.787 -8.580 . . . 1.0 . . . . . . . . . . . . B . 1 5PC C5' . . . . . . . . . rr_1nts 1
. 1 . 309 . 2 2 1 5PC C6 C 6.403 -1.229 -9.040 . . . 1.0 . . . . . . . . . . . . B . 1 5PC C6 . . . . . . . . . rr_1nts 1
. 1 . 310 . 2 2 1 5PC C7 C 4.606 -2.727 -8.636 . . . 1.0 . . . . . . . . . . . . B . 1 5PC C7 . . . . . . . . . rr_1nts 1
. 1 . 311 . 2 2 1 5PC C8 C 4.239 -3.844 -8.370 . . . 1.0 . . . . . . . . . . . . B . 1 5PC C8 . . . . . . . . . rr_1nts 1
. 1 . 312 . 2 2 1 5PC C9 C 3.815 -5.139 -8.056 . . . 1.0 . . . . . . . . . . . . B . 1 5PC C9 . . . . . . . . . rr_1nts 1
. 1 . 313 . 2 2 1 5PC H1' H 8.637 1.067 -10.279 . . . 1.0 . . . . . . . . . . . . B . 1 5PC H1' . . . . . . . . . rr_1nts 1
. 1 . 314 . 2 2 1 5PC H2' H 8.556 1.444 -7.591 . . . 1.0 . . . . . . . . . . . . B . 1 5PC H2' . . . . . . . . . rr_1nts 1
. 1 . 315 . 2 2 1 5PC H2'' H 10.047 1.463 -8.525 . . . 1.0 . . . . . . . . . . . . B . 1 5PC H2'' . . . . . . . . . rr_1nts 1
. 1 . 316 . 2 2 1 5PC H3' H 8.865 -0.949 -7.029 . . . 1.0 . . . . . . . . . . . . B . 1 5PC H3' . . . . . . . . . rr_1nts 1
. 1 . 317 . 2 2 1 5PC H4' H 11.108 -0.961 -9.138 . . . 1.0 . . . . . . . . . . . . B . 1 5PC H4' . . . . . . . . . rr_1nts 1
. 1 . 318 . 2 2 1 5PC H41 H 2.364 -1.300 -8.841 . . . 1.0 . . . . . . . . . . . . B . 1 5PC H41 . . . . . . . . . rr_1nts 1
. 1 . 319 . 2 2 1 5PC H42 H 2.229 0.454 -9.199 . . . 1.0 . . . . . . . . . . . . B . 1 5PC H42 . . . . . . . . . rr_1nts 1
. 1 . 320 . 2 2 1 5PC H5' H 10.814 -3.063 -7.794 . . . 1.0 . . . . . . . . . . . . B . 1 5PC H5' . . . . . . . . . rr_1nts 1
. 1 . 321 . 2 2 1 5PC H5'' H 9.098 -3.127 -8.218 . . . 1.0 . . . . . . . . . . . . B . 1 5PC H5'' . . . . . . . . . rr_1nts 1
. 1 . 322 . 2 2 1 5PC H6 H 7.083 -2.073 -8.902 . . . 1.0 . . . . . . . . . . . . B . 1 5PC H6 . . . . . . . . . rr_1nts 1
. 1 . 323 . 2 2 1 5PC H91 H 4.036 -5.841 -8.880 . . . 1.0 . . . . . . . . . . . . B . 1 5PC H91 . . . . . . . . . rr_1nts 1
. 1 . 324 . 2 2 1 5PC H92 H 4.322 -5.510 -7.146 . . . 1.0 . . . . . . . . . . . . B . 1 5PC H92 . . . . . . . . . rr_1nts 1
. 1 . 325 . 2 2 1 5PC H93 H 2.726 -5.164 -7.870 . . . 1.0 . . . . . . . . . . . . B . 1 5PC H93 . . . . . . . . . rr_1nts 1
. 1 . 326 . 2 2 1 5PC N1 N 6.991 0.116 -9.327 . . . 1.0 . . . . . . . . . . . . B . 1 5PC N1 . . . . . . . . . rr_1nts 1
. 1 . 327 . 2 2 1 5PC N3 N 4.673 0.894 -9.373 . . . 1.0 . . . . . . . . . . . . B . 1 5PC N3 . . . . . . . . . rr_1nts 1
. 1 . 328 . 2 2 1 5PC N4 N 2.793 -0.396 -9.062 . . . 1.0 . . . . . . . . . . . . B . 1 5PC N4 . . . . . . . . . rr_1nts 1
. 1 . 329 . 2 2 1 5PC O2 O 6.512 2.322 -9.688 . . . 1.0 . . . . . . . . . . . . B . 1 5PC O2 . . . . . . . . . rr_1nts 1
. 1 . 330 . 2 2 1 5PC O3' O 10.810 -0.198 -6.709 . . . 1.0 . . . . . . . . . . . . B . 1 5PC O3' . . . . . . . . . rr_1nts 1
. 1 . 331 . 2 2 1 5PC O4' O 9.151 -0.906 -9.848 . . . 1.0 . . . . . . . . . . . . B . 1 5PC O4' . . . . . . . . . rr_1nts 1
. 1 . 332 . 2 2 1 5PC O5' O 10.409 -3.460 -9.791 . . . 1.0 . . . . . . . . . . . . B . 1 5PC O5' . . . . . . . . . rr_1nts 1
. 1 . 333 . 2 2 2 5PC C1' C 6.965 3.872 -5.815 . . . 1.0 . . . . . . . . . . . . B . 2 5PC C1' . . . . . . . . . rr_1nts 1
. 1 . 334 . 2 2 2 5PC C2 C 4.641 2.948 -5.667 . . . 1.0 . . . . . . . . . . . . B . 2 5PC C2 . . . . . . . . . rr_1nts 1
. 1 . 335 . 2 2 2 5PC C2' C 7.178 4.595 -4.477 . . . 1.0 . . . . . . . . . . . . B . 2 5PC C2' . . . . . . . . . rr_1nts 1
. 1 . 336 . 2 2 2 5PC C3' C 8.474 4.009 -3.926 . . . 1.0 . . . . . . . . . . . . B . 2 5PC C3' . . . . . . . . . rr_1nts 1
. 1 . 337 . 2 2 2 5PC C4 C 4.200 0.567 -5.539 . . . 1.0 . . . . . . . . . . . . B . 2 5PC C4 . . . . . . . . . rr_1nts 1
. 1 . 338 . 2 2 2 5PC C4' C 9.260 3.790 -5.226 . . . 1.0 . . . . . . . . . . . . B . 2 5PC C4' . . . . . . . . . rr_1nts 1
. 1 . 339 . 2 2 2 5PC C5 C 5.552 0.282 -5.578 . . . 1.0 . . . . . . . . . . . . B . 2 5PC C5 . . . . . . . . . rr_1nts 1
. 1 . 340 . 2 2 2 5PC C5' C 10.355 2.708 -5.158 . . . 1.0 . . . . . . . . . . . . B . 2 5PC C5' . . . . . . . . . rr_1nts 1
. 1 . 341 . 2 2 2 5PC C6 C 6.464 1.296 -5.700 . . . 1.0 . . . . . . . . . . . . B . 2 5PC C6 . . . . . . . . . rr_1nts 1
. 1 . 342 . 2 2 2 5PC C7 C 6.128 -1.044 -5.505 . . . 1.0 . . . . . . . . . . . . B . 2 5PC C7 . . . . . . . . . rr_1nts 1
. 1 . 343 . 2 2 2 5PC C8 C 6.613 -2.145 -5.448 . . . 1.0 . . . . . . . . . . . . B . 2 5PC C8 . . . . . . . . . rr_1nts 1
. 1 . 344 . 2 2 2 5PC C9 C 7.182 -3.421 -5.386 . . . 1.0 . . . . . . . . . . . . B . 2 5PC C9 . . . . . . . . . rr_1nts 1
. 1 . 345 . 2 2 2 5PC H1' H 6.583 4.602 -6.555 . . . 1.0 . . . . . . . . . . . . B . 2 5PC H1' . . . . . . . . . rr_1nts 1
. 1 . 346 . 2 2 2 5PC H2' H 6.332 4.497 -3.783 . . . 1.0 . . . . . . . . . . . . B . 2 5PC H2' . . . . . . . . . rr_1nts 1
. 1 . 347 . 2 2 2 5PC H2'' H 7.295 5.679 -4.651 . . . 1.0 . . . . . . . . . . . . B . 2 5PC H2'' . . . . . . . . . rr_1nts 1
. 1 . 348 . 2 2 2 5PC H3' H 8.276 3.043 -3.418 . . . 1.0 . . . . . . . . . . . . B . 2 5PC H3' . . . . . . . . . rr_1nts 1
. 1 . 349 . 2 2 2 5PC H4' H 9.744 4.744 -5.511 . . . 1.0 . . . . . . . . . . . . B . 2 5PC H4' . . . . . . . . . rr_1nts 1
. 1 . 350 . 2 2 2 5PC H41 H 3.478 -1.422 -5.354 . . . 1.0 . . . . . . . . . . . . B . 2 5PC H41 . . . . . . . . . rr_1nts 1
. 1 . 351 . 2 2 2 5PC H42 H 2.217 -0.141 -5.445 . . . 1.0 . . . . . . . . . . . . B . 2 5PC H42 . . . . . . . . . rr_1nts 1
. 1 . 352 . 2 2 2 5PC H5' H 10.893 2.676 -6.125 . . . 1.0 . . . . . . . . . . . . B . 2 5PC H5' . . . . . . . . . rr_1nts 1
. 1 . 353 . 2 2 2 5PC H5'' H 11.111 2.975 -4.395 . . . 1.0 . . . . . . . . . . . . B . 2 5PC H5'' . . . . . . . . . rr_1nts 1
. 1 . 354 . 2 2 2 5PC H6 H 7.531 1.089 -5.783 . . . 1.0 . . . . . . . . . . . . B . 2 5PC H6 . . . . . . . . . rr_1nts 1
. 1 . 355 . 2 2 2 5PC H91 H 6.739 -4.013 -4.564 . . . 1.0 . . . . . . . . . . . . B . 2 5PC H91 . . . . . . . . . rr_1nts 1
. 1 . 356 . 2 2 2 5PC H92 H 7.024 -3.972 -6.330 . . . 1.0 . . . . . . . . . . . . B . 2 5PC H92 . . . . . . . . . rr_1nts 1
. 1 . 357 . 2 2 2 5PC H93 H 8.271 -3.352 -5.207 . . . 1.0 . . . . . . . . . . . . B . 2 5PC H93 . . . . . . . . . rr_1nts 1
. 1 . 358 . 2 2 2 5PC N1 N 6.007 2.720 -5.737 . . . 1.0 . . . . . . . . . . . . B . 2 5PC N1 . . . . . . . . . rr_1nts 1
. 1 . 359 . 2 2 2 5PC N3 N 3.753 1.784 -5.598 . . . 1.0 . . . . . . . . . . . . B . 2 5PC N3 . . . . . . . . . rr_1nts 1
. 1 . 360 . 2 2 2 5PC N4 N 3.200 -0.439 -5.440 . . . 1.0 . . . . . . . . . . . . B . 2 5PC N4 . . . . . . . . . rr_1nts 1
. 1 . 361 . 2 2 2 5PC O2 O 4.183 4.092 -5.645 . . . 1.0 . . . . . . . . . . . . B . 2 5PC O2 . . . . . . . . . rr_1nts 1
. 1 . 362 . 2 2 2 5PC O3' O 9.158 4.928 -3.055 . . . 1.0 . . . . . . . . . . . . B . 2 5PC O3' . . . . . . . . . rr_1nts 1
. 1 . 363 . 2 2 2 5PC O4' O 8.286 3.470 -6.242 . . . 1.0 . . . . . . . . . . . . B . 2 5PC O4' . . . . . . . . . rr_1nts 1
. 1 . 364 . 2 2 2 5PC O5' O 9.807 1.411 -4.858 . . . 1.0 . . . . . . . . . . . . B . 2 5PC O5' . . . . . . . . . rr_1nts 1
. 1 . 365 . 2 2 2 5PC OP1 O 12.007 0.130 -4.461 . . . 1.0 . . . . . . . . . . . . B . 2 5PC OP1 . . . . . . . . . rr_1nts 1
. 1 . 366 . 2 2 2 5PC OP2 O 9.854 -1.136 -4.518 . . . 1.0 . . . . . . . . . . . . B . 2 5PC OP2 . . . . . . . . . rr_1nts 1
. 1 . 367 . 2 2 2 5PC P P 10.628 0.039 -5.117 . . . 1.0 . . . . . . . . . . . . B . 2 5PC P . . . . . . . . . rr_1nts 1
. 1 . 368 . 2 2 3 PDU C1' C 3.815 6.081 -1.673 . . . 1.0 . . . . . . . . . . . . B . 3 PDU C1' . . . . . . . . . rr_1nts 1
. 1 . 369 . 2 2 3 PDU C2 C 2.323 4.101 -2.027 . . . 1.0 . . . . . . . . . . . . B . 3 PDU C2 . . . . . . . . . rr_1nts 1
. 1 . 370 . 2 2 3 PDU C2' C 4.230 6.472 -0.251 . . . 1.0 . . . . . . . . . . . . B . 3 PDU C2' . . . . . . . . . rr_1nts 1
. 1 . 371 . 2 2 3 PDU C3' C 5.052 7.744 -0.445 . . . 1.0 . . . . . . . . . . . . B . 3 PDU C3' . . . . . . . . . rr_1nts 1
. 1 . 372 . 2 2 3 PDU C4 C 3.120 1.832 -2.181 . . . 1.0 . . . . . . . . . . . . B . 3 PDU C4 . . . . . . . . . rr_1nts 1
. 1 . 373 . 2 2 3 PDU C4' C 5.639 7.576 -1.862 . . . 1.0 . . . . . . . . . . . . B . 3 PDU C4' . . . . . . . . . rr_1nts 1
. 1 . 374 . 2 2 3 PDU C5 C 4.574 2.348 -1.972 . . . 1.0 . . . . . . . . . . . . B . 3 PDU C5 . . . . . . . . . rr_1nts 1
. 1 . 375 . 2 2 3 PDU C5' C 7.139 7.213 -1.898 . . . 1.0 . . . . . . . . . . . . B . 3 PDU C5' . . . . . . . . . rr_1nts 1
. 1 . 376 . 2 2 3 PDU C5A C 5.709 1.472 -1.979 . . . 1.0 . . . . . . . . . . . . B . 3 PDU C5A . . . . . . . . . rr_1nts 1
. 1 . 377 . 2 2 3 PDU C5B C 6.668 0.744 -1.990 . . . 1.0 . . . . . . . . . . . . B . 3 PDU C5B . . . . . . . . . rr_1nts 1
. 1 . 378 . 2 2 3 PDU C5M C 7.787 -0.096 -2.008 . . . 1.0 . . . . . . . . . . . . B . 3 PDU C5M . . . . . . . . . rr_1nts 1
. 1 . 379 . 2 2 3 PDU C6 C 4.761 3.679 -1.800 . . . 1.0 . . . . . . . . . . . . B . 3 PDU C6 . . . . . . . . . rr_1nts 1
. 1 . 380 . 2 2 3 PDU H1' H 2.904 6.657 -1.938 . . . 1.0 . . . . . . . . . . . . B . 3 PDU H1' . . . . . . . . . rr_1nts 1
. 1 . 381 . 2 2 3 PDU H2' H 4.870 5.698 0.214 . . . 1.0 . . . . . . . . . . . . B . 3 PDU H2' . . . . . . . . . rr_1nts 1
. 1 . 382 . 2 2 3 PDU H2'' H 3.362 6.616 0.414 . . . 1.0 . . . . . . . . . . . . B . 3 PDU H2'' . . . . . . . . . rr_1nts 1
. 1 . 383 . 2 2 3 PDU H3 H 1.168 2.444 -2.321 . . . 1.0 . . . . . . . . . . . . B . 3 PDU H3 . . . . . . . . . rr_1nts 1
. 1 . 384 . 2 2 3 PDU H3' H 5.844 7.825 0.326 . . . 1.0 . . . . . . . . . . . . B . 3 PDU H3' . . . . . . . . . rr_1nts 1
. 1 . 385 . 2 2 3 PDU H4' H 5.516 8.524 -2.419 . . . 1.0 . . . . . . . . . . . . B . 3 PDU H4' . . . . . . . . . rr_1nts 1
. 1 . 386 . 2 2 3 PDU H5' H 7.500 7.254 -2.942 . . . 1.0 . . . . . . . . . . . . B . 3 PDU H5' . . . . . . . . . rr_1nts 1
. 1 . 387 . 2 2 3 PDU H5'' H 7.734 7.963 -1.342 . . . 1.0 . . . . . . . . . . . . B . 3 PDU H5'' . . . . . . . . . rr_1nts 1
. 1 . 388 . 2 2 3 PDU H6 H 5.761 4.086 -1.641 . . . 1.0 . . . . . . . . . . . . B . 3 PDU H6 . . . . . . . . . rr_1nts 1
. 1 . 389 . 2 2 3 PDU H71 H 7.661 -0.914 -2.740 . . . 1.0 . . . . . . . . . . . . B . 3 PDU H71 . . . . . . . . . rr_1nts 1
. 1 . 390 . 2 2 3 PDU H72 H 8.695 0.468 -2.293 . . . 1.0 . . . . . . . . . . . . B . 3 PDU H72 . . . . . . . . . rr_1nts 1
. 1 . 391 . 2 2 3 PDU H73 H 7.964 -0.547 -1.015 . . . 1.0 . . . . . . . . . . . . B . 3 PDU H73 . . . . . . . . . rr_1nts 1
. 1 . 392 . 2 2 3 PDU N1 N 3.598 4.612 -1.837 . . . 1.0 . . . . . . . . . . . . B . 3 PDU N1 . . . . . . . . . rr_1nts 1
. 1 . 393 . 2 2 3 PDU N3 N 2.133 2.766 -2.198 . . . 1.0 . . . . . . . . . . . . B . 3 PDU N3 . . . . . . . . . rr_1nts 1
. 1 . 394 . 2 2 3 PDU O2 O 1.312 4.804 -2.037 . . . 1.0 . . . . . . . . . . . . B . 3 PDU O2 . . . . . . . . . rr_1nts 1
. 1 . 395 . 2 2 3 PDU O3' O 4.219 8.920 -0.407 . . . 1.0 . . . . . . . . . . . . B . 3 PDU O3' . . . . . . . . . rr_1nts 1
. 1 . 396 . 2 2 3 PDU O4 O 2.830 0.645 -2.325 . . . 1.0 . . . . . . . . . . . . B . 3 PDU O4 . . . . . . . . . rr_1nts 1
. 1 . 397 . 2 2 3 PDU O4' O 4.872 6.549 -2.532 . . . 1.0 . . . . . . . . . . . . B . 3 PDU O4' . . . . . . . . . rr_1nts 1
. 1 . 398 . 2 2 3 PDU O5' O 7.368 5.903 -1.350 . . . 1.0 . . . . . . . . . . . . B . 3 PDU O5' . . . . . . . . . rr_1nts 1
. 1 . 399 . 2 2 3 PDU OP1 O 9.876 5.946 -0.808 . . . 1.0 . . . . . . . . . . . . B . 3 PDU OP1 . . . . . . . . . rr_1nts 1
. 1 . 400 . 2 2 3 PDU OP2 O 8.666 3.761 -0.807 . . . 1.0 . . . . . . . . . . . . B . 3 PDU OP2 . . . . . . . . . rr_1nts 1
. 1 . 401 . 2 2 3 PDU P P 8.779 5.126 -1.488 . . . 1.0 . . . . . . . . . . . . B . 3 PDU P . . . . . . . . . rr_1nts 1
. 1 . 402 . 2 2 4 5PC C1' C -0.337 5.589 1.156 . . . 1.0 . . . . . . . . . . . . B . 4 5PC C1' . . . . . . . . . rr_1nts 1
. 1 . 403 . 2 2 4 5PC C2 C -0.340 3.095 0.940 . . . 1.0 . . . . . . . . . . . . B . 4 5PC C2 . . . . . . . . . rr_1nts 1
. 1 . 404 . 2 2 4 5PC C2' C -0.625 6.109 2.567 . . . 1.0 . . . . . . . . . . . . B . 4 5PC C2' . . . . . . . . . rr_1nts 1
. 1 . 405 . 2 2 4 5PC C3' C -0.214 7.582 2.574 . . . 1.0 . . . . . . . . . . . . B . 4 5PC C3' . . . . . . . . . rr_1nts 1
. 1 . 406 . 2 2 4 5PC C4 C 1.697 1.805 1.208 . . . 1.0 . . . . . . . . . . . . B . 4 5PC C4 . . . . . . . . . rr_1nts 1
. 1 . 407 . 2 2 4 5PC C4' C 0.025 7.872 1.085 . . . 1.0 . . . . . . . . . . . . B . 4 5PC C4' . . . . . . . . . rr_1nts 1
. 1 . 408 . 2 2 4 5PC C5 C 2.423 2.952 1.484 . . . 1.0 . . . . . . . . . . . . B . 4 5PC C5 . . . . . . . . . rr_1nts 1
. 1 . 409 . 2 2 4 5PC C5' C 1.043 8.984 0.772 . . . 1.0 . . . . . . . . . . . . B . 4 5PC C5' . . . . . . . . . rr_1nts 1
. 1 . 410 . 2 2 4 5PC C6 C 1.798 4.170 1.506 . . . 1.0 . . . . . . . . . . . . B . 4 5PC C6 . . . . . . . . . rr_1nts 1
. 1 . 411 . 2 2 4 5PC C7 C 3.846 3.001 1.737 . . . 1.0 . . . . . . . . . . . . B . 4 5PC C7 . . . . . . . . . rr_1nts 1
. 1 . 412 . 2 2 4 5PC C8 C 5.034 3.045 1.935 . . . 1.0 . . . . . . . . . . . . B . 4 5PC C8 . . . . . . . . . rr_1nts 1
. 1 . 413 . 2 2 4 5PC C9 C 6.414 3.099 2.156 . . . 1.0 . . . . . . . . . . . . B . 4 5PC C9 . . . . . . . . . rr_1nts 1
. 1 . 414 . 2 2 4 5PC H1' H -1.292 5.525 0.594 . . . 1.0 . . . . . . . . . . . . B . 4 5PC H1' . . . . . . . . . rr_1nts 1
. 1 . 415 . 2 2 4 5PC H2' H -0.065 5.580 3.356 . . . 1.0 . . . . . . . . . . . . B . 4 5PC H2' . . . . . . . . . rr_1nts 1
. 1 . 416 . 2 2 4 5PC H2'' H -1.690 5.962 2.794 . . . 1.0 . . . . . . . . . . . . B . 4 5PC H2'' . . . . . . . . . rr_1nts 1
. 1 . 417 . 2 2 4 5PC H3' H 0.733 7.693 3.140 . . . 1.0 . . . . . . . . . . . . B . 4 5PC H3' . . . . . . . . . rr_1nts 1
. 1 . 418 . 2 2 4 5PC H4' H -0.937 8.157 0.614 . . . 1.0 . . . . . . . . . . . . B . 4 5PC H4' . . . . . . . . . rr_1nts 1
. 1 . 419 . 2 2 4 5PC H41 H 3.286 0.401 1.340 . . . 1.0 . . . . . . . . . . . . B . 4 5PC H41 . . . . . . . . . rr_1nts 1
. 1 . 420 . 2 2 4 5PC H42 H 1.671 -0.283 0.934 . . . 1.0 . . . . . . . . . . . . B . 4 5PC H42 . . . . . . . . . rr_1nts 1
. 1 . 421 . 2 2 4 5PC H5' H 1.179 9.054 -0.324 . . . 1.0 . . . . . . . . . . . . B . 4 5PC H5' . . . . . . . . . rr_1nts 1
. 1 . 422 . 2 2 4 5PC H5'' H 0.639 9.963 1.093 . . . 1.0 . . . . . . . . . . . . B . 4 5PC H5'' . . . . . . . . . rr_1nts 1
. 1 . 423 . 2 2 4 5PC H6 H 2.309 5.101 1.762 . . . 1.0 . . . . . . . . . . . . B . 4 5PC H6 . . . . . . . . . rr_1nts 1
. 1 . 424 . 2 2 4 5PC H91 H 6.771 2.191 2.673 . . . 1.0 . . . . . . . . . . . . B . 4 5PC H91 . . . . . . . . . rr_1nts 1
. 1 . 425 . 2 2 4 5PC H92 H 6.961 3.181 1.197 . . . 1.0 . . . . . . . . . . . . B . 4 5PC H92 . . . . . . . . . rr_1nts 1
. 1 . 426 . 2 2 4 5PC H93 H 6.684 3.975 2.773 . . . 1.0 . . . . . . . . . . . . B . 4 5PC H93 . . . . . . . . . rr_1nts 1
. 1 . 427 . 2 2 4 5PC N1 N 0.351 4.269 1.177 . . . 1.0 . . . . . . . . . . . . B . 4 5PC N1 . . . . . . . . . rr_1nts 1
. 1 . 428 . 2 2 4 5PC N3 N 0.422 1.842 0.959 . . . 1.0 . . . . . . . . . . . . B . 4 5PC N3 . . . . . . . . . rr_1nts 1
. 1 . 429 . 2 2 4 5PC N4 N 2.281 0.511 1.166 . . . 1.0 . . . . . . . . . . . . B . 4 5PC N4 . . . . . . . . . rr_1nts 1
. 1 . 430 . 2 2 4 5PC O2 O -1.555 3.095 0.736 . . . 1.0 . . . . . . . . . . . . B . 4 5PC O2 . . . . . . . . . rr_1nts 1
. 1 . 431 . 2 2 4 5PC O3' O -1.228 8.435 3.139 . . . 1.0 . . . . . . . . . . . . B . 4 5PC O3' . . . . . . . . . rr_1nts 1
. 1 . 432 . 2 2 4 5PC O4' O 0.449 6.616 0.523 . . . 1.0 . . . . . . . . . . . . B . 4 5PC O4' . . . . . . . . . rr_1nts 1
. 1 . 433 . 2 2 4 5PC O5' O 2.311 8.761 1.416 . . . 1.0 . . . . . . . . . . . . B . 4 5PC O5' . . . . . . . . . rr_1nts 1
. 1 . 434 . 2 2 4 5PC OP1 O 3.316 11.035 0.741 . . . 1.0 . . . . . . . . . . . . B . 4 5PC OP1 . . . . . . . . . rr_1nts 1
. 1 . 435 . 2 2 4 5PC OP2 O 4.704 9.446 2.073 . . . 1.0 . . . . . . . . . . . . B . 4 5PC OP2 . . . . . . . . . rr_1nts 1
. 1 . 436 . 2 2 4 5PC P P 3.647 9.559 0.971 . . . 1.0 . . . . . . . . . . . . B . 4 5PC P . . . . . . . . . rr_1nts 1
. 1 . 437 . 2 2 5 5PC C1' C -4.170 3.388 4.058 . . . 1.0 . . . . . . . . . . . . B . 5 5PC C1' . . . . . . . . . rr_1nts 1
. 1 . 438 . 2 2 5 5PC C2 C -2.820 1.277 3.976 . . . 1.0 . . . . . . . . . . . . B . 5 5PC C2 . . . . . . . . . rr_1nts 1
. 1 . 439 . 2 2 5 5PC C2' C -4.904 3.559 5.392 . . . 1.0 . . . . . . . . . . . . B . 5 5PC C2' . . . . . . . . . rr_1nts 1
. 1 . 440 . 2 2 5 5PC C3' C -4.777 5.038 5.751 . . . 1.0 . . . . . . . . . . . . B . 5 5PC C3' . . . . . . . . . rr_1nts 1
. 1 . 441 . 2 2 5 5PC C4 C -0.439 1.279 4.430 . . . 1.0 . . . . . . . . . . . . B . 5 5PC C4 . . . . . . . . . rr_1nts 1
. 1 . 442 . 2 2 5 5PC C4' C -4.669 5.670 4.358 . . . 1.0 . . . . . . . . . . . . B . 5 5PC C4' . . . . . . . . . rr_1nts 1
. 1 . 443 . 2 2 5 5PC C5 C -0.453 2.642 4.671 . . . 1.0 . . . . . . . . . . . . B . 5 5PC C5 . . . . . . . . . rr_1nts 1
. 1 . 444 . 2 2 5 5PC C5' C -4.016 7.063 4.308 . . . 1.0 . . . . . . . . . . . . B . 5 5PC C5' . . . . . . . . . rr_1nts 1
. 1 . 445 . 2 2 5 5PC C6 C -1.626 3.345 4.572 . . . 1.0 . . . . . . . . . . . . B . 5 5PC C6 . . . . . . . . . rr_1nts 1
. 1 . 446 . 2 2 5 5PC C7 C 0.705 3.435 5.020 . . . 1.0 . . . . . . . . . . . . B . 5 5PC C7 . . . . . . . . . rr_1nts 1
. 1 . 447 . 2 2 5 5PC C8 C 1.670 4.100 5.301 . . . 1.0 . . . . . . . . . . . . B . 5 5PC C8 . . . . . . . . . rr_1nts 1
. 1 . 448 . 2 2 5 5PC C9 C 2.789 4.875 5.619 . . . 1.0 . . . . . . . . . . . . B . 5 5PC C9 . . . . . . . . . rr_1nts 1
. 1 . 449 . 2 2 5 5PC H1' H -4.851 2.853 3.371 . . . 1.0 . . . . . . . . . . . . B . 5 5PC H1' . . . . . . . . . rr_1nts 1
. 1 . 450 . 2 2 5 5PC H2' H -4.499 2.935 6.201 . . . 1.0 . . . . . . . . . . . . B . 5 5PC H2' . . . . . . . . . rr_1nts 1
. 1 . 451 . 2 2 5 5PC H2'' H -5.966 3.274 5.270 . . . 1.0 . . . . . . . . . . . . B . 5 5PC H2'' . . . . . . . . . rr_1nts 1
. 1 . 452 . 2 2 5 5PC H3' H -3.843 5.202 6.326 . . . 1.0 . . . . . . . . . . . . B . 5 5PC H3' . . . . . . . . . rr_1nts 1
. 1 . 453 . 2 2 5 5PC H4' H -5.684 5.764 3.938 . . . 1.0 . . . . . . . . . . . . B . 5 5PC H4' . . . . . . . . . rr_1nts 1
. 1 . 454 . 2 2 5 5PC H41 H 1.625 0.929 4.788 . . . 1.0 . . . . . . . . . . . . B . 5 5PC H41 . . . . . . . . . rr_1nts 1
. 1 . 455 . 2 2 5 5PC H42 H 0.667 -0.509 4.285 . . . 1.0 . . . . . . . . . . . . B . 5 5PC H42 . . . . . . . . . rr_1nts 1
. 1 . 456 . 2 2 5 5PC H5' H -3.977 7.410 3.257 . . . 1.0 . . . . . . . . . . . . B . 5 5PC H5' . . . . . . . . . rr_1nts 1
. 1 . 457 . 2 2 5 5PC H5'' H -4.649 7.794 4.847 . . . 1.0 . . . . . . . . . . . . B . 5 5PC H5'' . . . . . . . . . rr_1nts 1
. 1 . 458 . 2 2 5 5PC H6 H -1.698 4.421 4.768 . . . 1.0 . . . . . . . . . . . . B . 5 5PC H6 . . . . . . . . . rr_1nts 1
. 1 . 459 . 2 2 5 5PC H91 H 3.220 4.573 6.591 . . . 1.0 . . . . . . . . . . . . B . 5 5PC H91 . . . . . . . . . rr_1nts 1
. 1 . 460 . 2 2 5 5PC H92 H 3.574 4.770 4.848 . . . 1.0 . . . . . . . . . . . . B . 5 5PC H92 . . . . . . . . . rr_1nts 1
. 1 . 461 . 2 2 5 5PC H93 H 2.518 5.945 5.684 . . . 1.0 . . . . . . . . . . . . B . 5 5PC H93 . . . . . . . . . rr_1nts 1
. 1 . 462 . 2 2 5 5PC N1 N -2.882 2.645 4.183 . . . 1.0 . . . . . . . . . . . . B . 5 5PC N1 . . . . . . . . . rr_1nts 1
. 1 . 463 . 2 2 5 5PC N3 N -1.512 0.629 4.096 . . . 1.0 . . . . . . . . . . . . B . 5 5PC N3 . . . . . . . . . rr_1nts 1
. 1 . 464 . 2 2 5 5PC N4 N 0.738 0.487 4.525 . . . 1.0 . . . . . . . . . . . . B . 5 5PC N4 . . . . . . . . . rr_1nts 1
. 1 . 465 . 2 2 5 5PC O2 O -3.830 0.619 3.721 . . . 1.0 . . . . . . . . . . . . B . 5 5PC O2 . . . . . . . . . rr_1nts 1
. 1 . 466 . 2 2 5 5PC O3' O -5.912 5.549 6.484 . . . 1.0 . . . . . . . . . . . . B . 5 5PC O3' . . . . . . . . . rr_1nts 1
. 1 . 467 . 2 2 5 5PC O4' O -3.958 4.721 3.539 . . . 1.0 . . . . . . . . . . . . B . 5 5PC O4' . . . . . . . . . rr_1nts 1
. 1 . 468 . 2 2 5 5PC O5' O -2.693 7.070 4.877 . . . 1.0 . . . . . . . . . . . . B . 5 5PC O5' . . . . . . . . . rr_1nts 1
. 1 . 469 . 2 2 5 5PC OP1 O -2.422 9.623 5.089 . . . 1.0 . . . . . . . . . . . . B . 5 5PC OP1 . . . . . . . . . rr_1nts 1
. 1 . 470 . 2 2 5 5PC OP2 O -0.470 8.146 5.593 . . . 1.0 . . . . . . . . . . . . B . 5 5PC OP2 . . . . . . . . . rr_1nts 1
. 1 . 471 . 2 2 5 5PC P P -1.695 8.335 4.695 . . . 1.0 . . . . . . . . . . . . B . 5 5PC P . . . . . . . . . rr_1nts 1
. 1 . 472 . 2 2 6 PDU C1' C -7.061 -0.466 7.110 . . . 1.0 . . . . . . . . . . . . B . 6 PDU C1' . . . . . . . . . rr_1nts 1
. 1 . 473 . 2 2 6 PDU C2 C -4.998 -1.816 6.670 . . . 1.0 . . . . . . . . . . . . B . 6 PDU C2 . . . . . . . . . rr_1nts 1
. 1 . 474 . 2 2 6 PDU C2' C -7.574 -0.639 8.543 . . . 1.0 . . . . . . . . . . . . B . 6 PDU C2' . . . . . . . . . rr_1nts 1
. 1 . 475 . 2 2 6 PDU C3' C -8.817 0.237 8.607 . . . 1.0 . . . . . . . . . . . . B . 6 PDU C3' . . . . . . . . . rr_1nts 1
. 1 . 476 . 2 2 6 PDU C4 C -2.762 -0.974 6.994 . . . 1.0 . . . . . . . . . . . . B . 6 PDU C4 . . . . . . . . . rr_1nts 1
. 1 . 477 . 2 2 6 PDU C4' C -8.468 1.378 7.633 . . . 1.0 . . . . . . . . . . . . B . 6 PDU C4' . . . . . . . . . rr_1nts 1
. 1 . 478 . 2 2 6 PDU C5 C -3.362 0.395 7.430 . . . 1.0 . . . . . . . . . . . . B . 6 PDU C5 . . . . . . . . . rr_1nts 1
. 1 . 479 . 2 2 6 PDU C5' C -7.884 2.616 8.352 . . . 1.0 . . . . . . . . . . . . B . 6 PDU C5' . . . . . . . . . rr_1nts 1
. 1 . 480 . 2 2 6 PDU C5A C -2.531 1.496 7.820 . . . 1.0 . . . . . . . . . . . . B . 6 PDU C5A . . . . . . . . . rr_1nts 1
. 1 . 481 . 2 2 6 PDU C5B C -1.837 2.426 8.141 . . . 1.0 . . . . . . . . . . . . B . 6 PDU C5B . . . . . . . . . rr_1nts 1
. 1 . 482 . 2 2 6 PDU C5M C -1.034 3.511 8.508 . . . 1.0 . . . . . . . . . . . . B . 6 PDU C5M . . . . . . . . . rr_1nts 1
. 1 . 483 . 2 2 6 PDU C6 C -4.711 0.533 7.429 . . . 1.0 . . . . . . . . . . . . B . 6 PDU C6 . . . . . . . . . rr_1nts 1
. 1 . 484 . 2 2 6 PDU H1' H -7.570 -1.201 6.453 . . . 1.0 . . . . . . . . . . . . B . 6 PDU H1' . . . . . . . . . rr_1nts 1
. 1 . 485 . 2 2 6 PDU H2' H -6.842 -0.267 9.284 . . . 1.0 . . . . . . . . . . . . B . 6 PDU H2' . . . . . . . . . rr_1nts 1
. 1 . 486 . 2 2 6 PDU H2'' H -7.769 -1.695 8.788 . . . 1.0 . . . . . . . . . . . . B . 6 PDU H2'' . . . . . . . . . rr_1nts 1
. 1 . 487 . 2 2 6 PDU H3 H -3.262 -2.860 6.367 . . . 1.0 . . . . . . . . . . . . B . 6 PDU H3 . . . . . . . . . rr_1nts 1
. 1 . 488 . 2 2 6 PDU H3' H -8.979 0.614 9.635 . . . 1.0 . . . . . . . . . . . . B . 6 PDU H3' . . . . . . . . . rr_1nts 1
. 1 . 489 . 2 2 6 PDU H4' H -9.371 1.693 7.076 . . . 1.0 . . . . . . . . . . . . B . 6 PDU H4' . . . . . . . . . rr_1nts 1
. 1 . 490 . 2 2 6 PDU H5' H -8.646 3.082 9.004 . . . 1.0 . . . . . . . . . . . . B . 6 PDU H5' . . . . . . . . . rr_1nts 1
. 1 . 491 . 2 2 6 PDU H5'' H -7.052 2.313 9.018 . . . 1.0 . . . . . . . . . . . . B . 6 PDU H5'' . . . . . . . . . rr_1nts 1
. 1 . 492 . 2 2 6 PDU H6 H -5.193 1.473 7.713 . . . 1.0 . . . . . . . . . . . . B . 6 PDU H6 . . . . . . . . . rr_1nts 1
. 1 . 493 . 2 2 6 PDU H71 H -1.287 4.405 7.909 . . . 1.0 . . . . . . . . . . . . B . 6 PDU H71 . . . . . . . . . rr_1nts 1
. 1 . 494 . 2 2 6 PDU H72 H -1.174 3.766 9.574 . . . 1.0 . . . . . . . . . . . . B . 6 PDU H72 . . . . . . . . . rr_1nts 1
. 1 . 495 . 2 2 6 PDU H73 H 0.036 3.286 8.344 . . . 1.0 . . . . . . . . . . . . B . 6 PDU H73 . . . . . . . . . rr_1nts 1
. 1 . 496 . 2 2 6 PDU N1 N -5.577 -0.609 7.033 . . . 1.0 . . . . . . . . . . . . B . 6 PDU N1 . . . . . . . . . rr_1nts 1
. 1 . 497 . 2 2 6 PDU N3 N -3.643 -1.953 6.650 . . . 1.0 . . . . . . . . . . . . B . 6 PDU N3 . . . . . . . . . rr_1nts 1
. 1 . 498 . 2 2 6 PDU O2 O -5.659 -2.809 6.367 . . . 1.0 . . . . . . . . . . . . B . 6 PDU O2 . . . . . . . . . rr_1nts 1
. 1 . 499 . 2 2 6 PDU O3' O -9.980 -0.487 8.157 . . . 1.0 . . . . . . . . . . . . B . 6 PDU O3' . . . . . . . . . rr_1nts 1
. 1 . 500 . 2 2 6 PDU O4 O -1.554 -1.204 6.956 . . . 1.0 . . . . . . . . . . . . B . 6 PDU O4 . . . . . . . . . rr_1nts 1
. 1 . 501 . 2 2 6 PDU O4' O -7.499 0.846 6.699 . . . 1.0 . . . . . . . . . . . . B . 6 PDU O4' . . . . . . . . . rr_1nts 1
. 1 . 502 . 2 2 6 PDU O5' O -7.409 3.578 7.401 . . . 1.0 . . . . . . . . . . . . B . 6 PDU O5' . . . . . . . . . rr_1nts 1
. 1 . 503 . 2 2 6 PDU OP1 O -7.372 5.856 8.591 . . . 1.0 . . . . . . . . . . . . B . 6 PDU OP1 . . . . . . . . . rr_1nts 1
. 1 . 504 . 2 2 6 PDU OP2 O -5.353 4.386 8.724 . . . 1.0 . . . . . . . . . . . . B . 6 PDU OP2 . . . . . . . . . rr_1nts 1
. 1 . 505 . 2 2 6 PDU P P -6.505 4.853 7.828 . . . 1.0 . . . . . . . . . . . . B . 6 PDU P . . . . . . . . . rr_1nts 1
. 1 . 506 . 2 2 7 PDU C1' C -6.456 -4.971 9.409 . . . 1.0 . . . . . . . . . . . . B . 7 PDU C1' . . . . . . . . . rr_1nts 1
. 1 . 507 . 2 2 7 PDU C2 C -3.976 -4.669 9.501 . . . 1.0 . . . . . . . . . . . . B . 7 PDU C2 . . . . . . . . . rr_1nts 1
. 1 . 508 . 2 2 7 PDU C2' C -7.338 -5.357 10.601 . . . 1.0 . . . . . . . . . . . . B . 7 PDU C2' . . . . . . . . . rr_1nts 1
. 1 . 509 . 2 2 7 PDU C3' C -8.720 -5.565 9.975 . . . 1.0 . . . . . . . . . . . . B . 7 PDU C3' . . . . . . . . . rr_1nts 1
. 1 . 510 . 2 2 7 PDU C4 C -2.895 -2.624 10.178 . . . 1.0 . . . . . . . . . . . . B . 7 PDU C4 . . . . . . . . . rr_1nts 1
. 1 . 511 . 2 2 7 PDU C4' C -8.627 -4.866 8.600 . . . 1.0 . . . . . . . . . . . . B . 7 PDU C4' . . . . . . . . . rr_1nts 1
. 1 . 512 . 2 2 7 PDU C5 C -4.296 -2.003 10.464 . . . 1.0 . . . . . . . . . . . . B . 7 PDU C5 . . . . . . . . . rr_1nts 1
. 1 . 513 . 2 2 7 PDU C5' C -9.744 -3.852 8.282 . . . 1.0 . . . . . . . . . . . . B . 7 PDU C5' . . . . . . . . . rr_1nts 1
. 1 . 514 . 2 2 7 PDU C5A C -4.432 -0.633 10.864 . . . 1.0 . . . . . . . . . . . . B . 7 PDU C5A . . . . . . . . . rr_1nts 1
. 1 . 515 . 2 2 7 PDU C5B C -4.547 0.522 11.188 . . . 1.0 . . . . . . . . . . . . B . 7 PDU C5B . . . . . . . . . rr_1nts 1
. 1 . 516 . 2 2 7 PDU C5M C -4.682 1.866 11.552 . . . 1.0 . . . . . . . . . . . . B . 7 PDU C5M . . . . . . . . . rr_1nts 1
. 1 . 517 . 2 2 7 PDU C6 C -5.394 -2.781 10.279 . . . 1.0 . . . . . . . . . . . . B . 7 PDU C6 . . . . . . . . . rr_1nts 1
. 1 . 518 . 2 2 7 PDU H1' H -6.177 -5.902 8.871 . . . 1.0 . . . . . . . . . . . . B . 7 PDU H1' . . . . . . . . . rr_1nts 1
. 1 . 519 . 2 2 7 PDU H2' H -7.394 -4.533 11.337 . . . 1.0 . . . . . . . . . . . . B . 7 PDU H2' . . . . . . . . . rr_1nts 1
. 1 . 520 . 2 2 7 PDU H2'' H -6.953 -6.242 11.138 . . . 1.0 . . . . . . . . . . . . B . 7 PDU H2'' . . . . . . . . . rr_1nts 1
. 1 . 521 . 2 2 7 PDU H3 H -1.962 -4.321 9.516 . . . 1.0 . . . . . . . . . . . . B . 7 PDU H3 . . . . . . . . . rr_1nts 1
. 1 . 522 . 2 2 7 PDU H3' H -9.502 -5.115 10.618 . . . 1.0 . . . . . . . . . . . . B . 7 PDU H3' . . . . . . . . . rr_1nts 1
. 1 . 523 . 2 2 7 PDU H4' H -8.644 -5.630 7.800 . . . 1.0 . . . . . . . . . . . . B . 7 PDU H4' . . . . . . . . . rr_1nts 1
. 1 . 524 . 2 2 7 PDU H5' H -9.519 -3.351 7.320 . . . 1.0 . . . . . . . . . . . . B . 7 PDU H5' . . . . . . . . . rr_1nts 1
. 1 . 525 . 2 2 7 PDU H5'' H -10.703 -4.382 8.131 . . . 1.0 . . . . . . . . . . . . B . 7 PDU H5'' . . . . . . . . . rr_1nts 1
. 1 . 526 . 2 2 7 PDU H6 H -6.400 -2.414 10.490 . . . 1.0 . . . . . . . . . . . . B . 7 PDU H6 . . . . . . . . . rr_1nts 1
. 1 . 527 . 2 2 7 PDU H71 H -3.852 2.185 12.208 . . . 1.0 . . . . . . . . . . . . B . 7 PDU H71 . . . . . . . . . rr_1nts 1
. 1 . 528 . 2 2 7 PDU H72 H -4.676 2.518 10.658 . . . 1.0 . . . . . . . . . . . . B . 7 PDU H72 . . . . . . . . . rr_1nts 1
. 1 . 529 . 2 2 7 PDU H73 H -5.632 2.040 12.089 . . . 1.0 . . . . . . . . . . . . B . 7 PDU H73 . . . . . . . . . rr_1nts 1
. 1 . 530 . 2 2 7 PDU HO3' H -8.976 -7.334 10.694 . . . 1.0 . . . . . . . . . . . . B . 7 PDU HO3' . . . . . . . . . rr_1nts 1
. 1 . 531 . 2 2 7 PDU N1 N -5.245 -4.170 9.757 . . . 1.0 . . . . . . . . . . . . B . 7 PDU N1 . . . . . . . . . rr_1nts 1
. 1 . 532 . 2 2 7 PDU N3 N -2.876 -3.902 9.719 . . . 1.0 . . . . . . . . . . . . B . 7 PDU N3 . . . . . . . . . rr_1nts 1
. 1 . 533 . 2 2 7 PDU O2 O -3.776 -5.805 9.070 . . . 1.0 . . . . . . . . . . . . B . 7 PDU O2 . . . . . . . . . rr_1nts 1
. 1 . 534 . 2 2 7 PDU O3' O -8.980 -6.955 9.811 . . . 1.0 . . . . . . . . . . . . B . 7 PDU O3' . . . . . . . . . rr_1nts 1
. 1 . 535 . 2 2 7 PDU O4 O -1.832 -2.026 10.338 . . . 1.0 . . . . . . . . . . . . B . 7 PDU O4 . . . . . . . . . rr_1nts 1
. 1 . 536 . 2 2 7 PDU O4' O -7.337 -4.231 8.552 . . . 1.0 . . . . . . . . . . . . B . 7 PDU O4' . . . . . . . . . rr_1nts 1
. 1 . 537 . 2 2 7 PDU O5' O -9.905 -2.872 9.325 . . . 1.0 . . . . . . . . . . . . B . 7 PDU O5' . . . . . . . . . rr_1nts 1
. 1 . 538 . 2 2 7 PDU OP1 O -12.123 -1.885 8.465 . . . 1.0 . . . . . . . . . . . . B . 7 PDU OP1 . . . . . . . . . rr_1nts 1
. 1 . 539 . 2 2 7 PDU OP2 O -11.042 -0.875 10.474 . . . 1.0 . . . . . . . . . . . . B . 7 PDU OP2 . . . . . . . . . rr_1nts 1
. 1 . 540 . 2 2 7 PDU P P -10.784 -1.526 9.114 . . . 1.0 . . . . . . . . . . . . B . 7 PDU P . . . . . . . . . rr_1nts 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_1nts
_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 1nts.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_1nts 1
1 1nts.mr . . DISCOVER 2 distance "hydrogen bond" simple 18 rr_1nts 1
1 1nts.mr . . DISCOVER 3 distance NOE simple 151 rr_1nts 1
1 1nts.mr . . DISCOVER 4 "dihedral angle" "Not applicable" "Not applicable" 59 rr_1nts 1
1 1nts.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_1nts 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_1nts
_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: '1nts'" . . . . distance "general distance" . 118 rr_1nts 1
2 "From CCPN project: '1nts'" . . . . distance "hydrogen bond" . 18 rr_1nts 1
3 "From CCPN project: '1nts'" . . . . "dihedral angle" "Not applicable" . 59 rr_1nts 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 1nts.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_1nts 1
1 1nts.mr . . DISCOVER 2 distance "hydrogen bond" simple 18 rr_1nts 1
1 1nts.mr . . DISCOVER 3 distance NOE simple 151 rr_1nts 1
1 1nts.mr . . DISCOVER 4 "dihedral angle" "Not applicable" "Not applicable" 59 rr_1nts 1
1 1nts.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_1nts 1
stop_
save_
save_Discover_distance_constraints_3
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode Discover_distance_constraints_3
_Gen_dist_constraint_list.Entry_ID rr_1nts
_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_1nts 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 1 1 A H2 H . . . 1 1 2 2 A H1' H . . . . . . 2.296 4.263 . . . . . A . 2 A H2 . . A . 3 A H1' . 1 . 2 A H2 . . . 1 . 3 A H1' . . rr_1nts 1
2 1 . . 2 2 1 1 5PC H1' H . . . 2 2 2 2 5PC H6 H . . . . . . 2.917 5.417 . . . . . B . 2 5PC H6 . . B . 1 5PC H1' . B . 2 PC H6 . . . B . 1 C5' H1' . . rr_1nts 1
3 1 . . 2 2 2 2 5PC H6 H . . . 2 2 1 1 5PC H3' H . . . . . . 2.924 5.430 . . . . . B . 2 5PC H6 . . B . 1 5PC H3' . B . 2 PC H6 . . . B . 1 C5' H3' . . rr_1nts 1
4 1 . . 2 2 2 2 5PC H6 H . . . 2 2 2 2 5PC H3' H . . . . . . 1.778 3.302 . . . . . B . 2 5PC H6 . . B . 2 5PC H3' . B . 2 PC H6 . . . B . 2 PC H3' . . rr_1nts 1
5 1 . . 1 1 1 1 A H8 H . . . 1 1 1 1 A H1' H . . . . . . 2.211 4.107 . . . . . A . 2 A H8 . . A . 2 A H1' . 1 . 2 A H8 . . . 1 . 2 A H1' . . rr_1nts 1
6 1 . . 1 1 1 1 A H8 H . . . 1 1 1 1 A H3' H . . . . . . 2.636 4.895 . . . . . A . 2 A H8 . . A . 2 A H3' . 1 . 2 A H8 . . . 1 . 2 A H3' . . rr_1nts 1
7 1 . . 1 1 1 1 A H1' H . . . 1 1 1 1 A H2' H . . . . . . 2.160 4.012 . . . . . A . 2 A H1' . . A . 2 A H2' . 1 . 2 A H1' . . . 1 . 2 A H2' . . rr_1nts 1
8 1 . . 1 1 1 1 A H1' H . . . 1 1 1 1 A H3' H . . . . . . 2.988 5.549 . . . . . A . 2 A H1' . . A . 2 A H3' . 1 . 2 A H1' . . . 1 . 2 A H3' . . rr_1nts 1
9 1 . . 1 1 1 1 A H1' H . . . 1 1 1 1 A H4' H . . . . . . 2.788 5.177 . . . . . A . 2 A H1' . . A . 2 A H4' . 1 . 2 A H1' . . . 1 . 2 A H4' . . rr_1nts 1
10 1 . . 1 1 1 1 A H3' H . . . 1 1 2 2 A H8 H . . . . . . 2.351 4.366 . . . . . A . 2 A H3' . . A . 3 A H8 . 1 . 2 A H3' . . . 1 . 3 A H8 . . rr_1nts 1
11 1 . . 2 2 3 3 PDU H6 H . . . 2 2 3 3 PDU H1' H . . . . . . 2.556 4.747 . . . . . B . 3 PDU H6 . . B . 3 PDU H1' . B . 3 PU H6 . . . B . 3 PU H1' . . rr_1nts 1
12 1 . . 1 1 2 2 A H1' H . . . 1 1 2 2 A H8 H . . . . . . 2.965 5.506 . . . . . A . 3 A H8 . . A . 3 A H1' . 1 . 3 A H8 . . . 1 . 3 A H1' . . rr_1nts 1
13 1 . . 1 1 2 2 A H1' H . . . 1 1 2 2 A H2' H . . . . . . 2.093 3.887 . . . . . A . 3 A H1' . . A . 3 A H2' . 1 . 3 A H1' . . . 1 . 3 A H2' . . rr_1nts 1
14 1 . . 2 2 3 3 PDU H1' H . . . 2 2 3 3 PDU H3' H . . . . . . 2.800 5.201 . . . . . B . 3 PDU H1' . . B . 3 PDU H3' . B . 3 PU H1' . . . B . 3 PU H3' . . rr_1nts 1
15 1 . . 2 2 3 3 PDU H1' H . . . 2 2 3 3 PDU H4' H . . . . . . 2.459 4.567 . . . . . B . 3 PDU H1' . . B . 3 PDU H4' . B . 3 PU H1' . . . B . 3 PU H4' . . rr_1nts 1
16 1 . . 1 1 2 2 A H1' H . . . 1 1 2 2 A H4' H . . . . . . 2.489 4.623 . . . . . A . 3 A H1' . . A . 3 A H4' . 1 . 3 A H1' . . . 1 . 3 A H4' . . rr_1nts 1
17 1 . . 2 2 3 3 PDU H1' H . . . 2 2 4 4 5PC H6 H . . . . . . 2.866 5.322 . . . . . B . 3 PDU H1' . . B . 4 5PC H6 . B . 3 PU H1' . . . B . 4 PC H6 . . rr_1nts 1
18 1 . . 1 1 2 2 A H1' H . . . 1 1 3 3 A H8 H . . . . . . 2.545 4.726 . . . . . A . 3 A H1' . . A . 4 A H8 . 1 . 3 A H1' . . . 1 . 4 A H8 . . rr_1nts 1
19 1 . . 2 2 3 3 PDU H6 H . . . 2 2 3 3 PDU H3' H . . . . . . 2.213 4.111 . . . . . B . 3 PDU H3' . . B . 3 PDU H6 . B . 3 PU H3' . . . B . 3 PU H6 . . rr_1nts 1
20 1 . . 1 1 3 3 A H2 H . . . 2 2 7 7 PDU H1' H . . . . . . 2.667 4.954 . . . . . A . 4 A H2 . . B . 7 PDU H1' . 1 . 4 A H2 . . . B . 7 PU3' H1' . . rr_1nts 1
21 1 . . 2 2 3 3 PDU H3' H . . . 2 2 4 4 5PC H6 H . . . . . . 2.486 4.616 . . . . . B . 4 5PC H6 . . B . 3 PDU H3' . B . 4 PC H6 . . . B . 3 PU H3' . . rr_1nts 1
22 1 . . 2 2 4 4 5PC H6 H . . . 2 2 4 4 5PC H3' H . . . . . . 2.546 4.728 . . . . . B . 4 5PC H6 . . B . 4 5PC H3' . B . 4 PC H6 . . . B . 4 PC H3' . . rr_1nts 1
23 1 . . 1 1 2 2 A H2' H . . . 1 1 3 3 A H8 H . . . . . . 1.728 3.209 . . . . . A . 4 A H8 . . A . 3 A H2' . 1 . 4 A H8 . . . 1 . 3 A H2' . . rr_1nts 1
24 1 . . 1 1 3 3 A H8 H . . . 1 1 3 3 A H1' H . . . . . . 2.715 5.041 . . . . . A . 4 A H8 . . A . 4 A H1' . 1 . 4 A H8 . . . 1 . 4 A H1' . . rr_1nts 1
25 1 . . 1 1 3 3 A H8 H . . . 1 1 3 3 A H2' H . . . . . . 2.674 4.965 . . . . . A . 4 A H8 . . A . 4 A H2' . 1 . 4 A H8 . . . 1 . 4 A H2' . . rr_1nts 1
26 1 . . 1 1 3 3 A H8 H . . . 1 1 3 3 A H3' H . . . . . . 1.809 3.359 . . . . . A . 4 A H8 . . A . 4 A H3' . 1 . 4 A H8 . . . 1 . 4 A H3' . . rr_1nts 1
27 1 . . 1 1 3 3 A H8 H . . . 1 1 3 3 A H4' H . . . . . . 2.718 5.048 . . . . . A . 4 A H8 . . A . 4 A H4' . 1 . 4 A H8 . . . 1 . 4 A H4' . . rr_1nts 1
28 1 . . 1 1 3 3 A H1' H . . . 1 1 2 2 A H2 H . . . . . . 2.109 3.916 . . . . . A . 4 A H1' . . A . 3 A H2 . 1 . 4 A H1' . . . 1 . 3 A H2 . . rr_1nts 1
29 1 . . 2 2 4 4 5PC H6 H . . . 2 2 4 4 5PC H1' H . . . . . . 2.952 5.483 . . . . . B . 4 5PC H1' . . B . 4 5PC H6 . B . 4 PC H1' . . . B . 4 PC H6 . . rr_1nts 1
30 1 . . 2 2 4 4 5PC H1' H . . . 2 2 4 4 5PC H4' H . . . . . . 2.670 4.959 . . . . . B . 4 5PC H1' . . B . 4 5PC H4' . B . 4 PC H1' . . . B . 4 PC H4' . . rr_1nts 1
31 1 . . 2 2 4 4 5PC H1' H . . . 2 2 5 5 5PC H6 H . . . . . . 3.020 5.608 . . . . . B . 4 5PC H1' . . B . 5 5PC H6 . B . 4 PC H1' . . . B . 5 PC H6 . . rr_1nts 1
32 1 . . 1 1 3 3 A H1' H . . . 1 1 4 4 G H8 H . . . . . . 3.343 6.000 . . . . . A . 4 A H1' . . A . 5 G H8 . 1 . 4 A H1' . . . 1 . 5 G H8 . . rr_1nts 1
33 1 . . 1 1 3 3 A H1' H . . . 1 1 3 3 A H2' H . . . . . . 1.747 3.245 . . . . . A . 4 A H2' . . A . 4 A H1' . 1 . 4 A H2' . . . 1 . 4 A H1' . . rr_1nts 1
34 1 . . 1 1 3 3 A H1' H . . . 1 1 3 3 A H3' H . . . . . . 2.514 4.669 . . . . . A . 4 A H3' . . A . 4 A H1' . 1 . 4 A H3' . . . 1 . 4 A H1' . . rr_1nts 1
35 1 . . 2 2 5 5 5PC H6 H . . . 2 2 5 5 5PC H4' H . . . . . . 2.724 5.059 . . . . . B . 5 5PC H6 . . B . 5 5PC H4' . B . 5 PC H6 . . . B . 5 PC H4' . . rr_1nts 1
36 1 . . 1 1 3 3 A H2' H . . . 1 1 4 4 G H8 H . . . . . . 1.631 3.030 . . . . . A . 5 G H8 . . A . 4 A H2' . 1 . 5 G H8 . . . 1 . 4 A H2' . . rr_1nts 1
37 1 . . 1 1 3 3 A H3' H . . . 1 1 4 4 G H8 H . . . . . . 2.280 4.234 . . . . . A . 5 G H8 . . A . 4 A H3' . 1 . 5 G H8 . . . 1 . 4 A H3' . . rr_1nts 1
38 1 . . 1 1 4 4 G H8 H . . . 1 1 4 4 G H1' H . . . . . . 2.685 4.986 . . . . . A . 5 G H8 . . A . 5 G H1' . 1 . 5 G H8 . . . 1 . 5 G H1' . . rr_1nts 1
39 1 . . 1 1 4 4 G H8 H . . . 1 1 4 4 G H2' H . . . . . . 2.402 4.461 . . . . . A . 5 G H8 . . A . 5 G H2' . 1 . 5 G H8 . . . 1 . 5 G H2' . . rr_1nts 1
40 1 . . 1 1 4 4 G H8 H . . . 1 1 4 4 G H3' H . . . . . . 1.917 3.560 . . . . . A . 5 G H8 . . A . 5 G H3' . 1 . 5 G H8 . . . 1 . 5 G H3' . . rr_1nts 1
41 1 . . 1 1 4 4 G H8 H . . . 1 1 4 4 G H4' H . . . . . . 2.315 4.299 . . . . . A . 5 G H8 . . A . 5 G H4' . 1 . 5 G H8 . . . 1 . 5 G H4' . . rr_1nts 1
42 1 . . 1 1 3 3 A H2 H . . . 1 1 4 4 G H1' H . . . . . . 2.298 4.268 . . . . . A . 5 G H1' . . A . 4 A H2 . 1 . 5 G H1' . . . 1 . 4 A H2 . . rr_1nts 1
43 1 . . 1 1 3 3 A H2' H . . . 1 1 4 4 G H1' H . . . . . . 2.710 5.033 . . . . . A . 5 G H1' . . A . 4 A H2' . 1 . 5 G H1' . . . 1 . 4 A H2' . . rr_1nts 1
44 1 . . 2 2 5 5 5PC H6 H . . . 2 2 5 5 5PC H1' H . . . . . . 2.681 4.978 . . . . . B . 5 5PC H1' . . B . 5 5PC H6 . B . 5 PC H1' . . . B . 5 PC H6 . . rr_1nts 1
45 1 . . 1 1 4 4 G H1' H . . . 1 1 4 4 G H3' H . . . . . . 2.546 4.729 . . . . . A . 5 G H1' . . A . 5 G H3' . 1 . 5 G H1' . . . 1 . 5 G H3' . . rr_1nts 1
46 1 . . 2 2 5 5 5PC H1' H . . . 2 2 5 5 5PC H3' H . . . . . . 3.036 5.639 . . . . . B . 5 5PC H1' . . B . 5 5PC H3' . B . 5 PC H1' . . . B . 5 PC H3' . . rr_1nts 1
47 1 . . 2 2 5 5 5PC H4' H . . . 2 2 5 5 5PC H1' H . . . . . . 2.211 4.107 . . . . . B . 5 5PC H1' . . B . 5 5PC H4' . B . 5 PC H1' . . . B . 5 PC H4' . . rr_1nts 1
48 1 . . 1 1 4 4 G H1' H . . . 1 1 4 4 G H4' H . . . . . . 2.296 4.263 . . . . . A . 5 G H1' . . A . 5 G H4' . 1 . 5 G H1' . . . 1 . 5 G H4' . . rr_1nts 1
49 1 . . 1 1 4 4 G H1' H . . . 1 1 4 4 G H2' H . . . . . . 1.740 3.232 . . . . . A . 5 G H2' . . A . 5 G H1' . 1 . 5 G H2' . . . 1 . 5 G H1' . . rr_1nts 1
50 1 . . 2 2 5 5 5PC H6 H . . . 2 2 5 5 5PC H3' H . . . . . . 1.979 3.676 . . . . . B . 5 5PC H3' . . B . 5 5PC H6 . B . 5 PC H3' . . . B . 5 PC H6 . . rr_1nts 1
51 1 . . 2 2 5 5 5PC H1' H . . . 2 2 6 6 PDU H6 H . . . . . . 2.237 4.154 . . . . . B . 6 PDU H6 . . B . 5 5PC H1' . B . 6 PU H6 . . . B . 5 PC H1' . . rr_1nts 1
52 1 . . 1 1 4 4 G H1' H . . . 1 1 5 5 G H8 H . . . . . . 2.876 5.341 . . . . . A . 6 G H8 . . A . 5 G H1' . 1 . 6 G H8 . . . 1 . 5 G H1' . . rr_1nts 1
53 1 . . 1 1 4 4 G H2' H . . . 1 1 5 5 G H8 H . . . . . . 1.652 3.068 . . . . . A . 6 G H8 . . A . 5 G H2' . 1 . 6 G H8 . . . 1 . 5 G H2' . . rr_1nts 1
54 1 . . 1 1 4 4 G H3' H . . . 1 1 5 5 G H8 H . . . . . . 1.873 3.479 . . . . . A . 6 G H8 . . A . 5 G H3' . 1 . 6 G H8 . . . 1 . 5 G H3' . . rr_1nts 1
55 1 . . 1 1 5 5 G H8 H . . . 1 1 5 5 G H1' H . . . . . . 2.682 4.981 . . . . . A . 6 G H8 . . A . 6 G H1' . 1 . 6 G H8 . . . 1 . 6 G H1' . . rr_1nts 1
56 1 . . 1 1 5 5 G H8 H . . . 1 1 5 5 G H2' H . . . . . . 2.413 4.481 . . . . . A . 6 G H8 . . A . 6 G H2' . 1 . 6 G H8 . . . 1 . 6 G H2' . . rr_1nts 1
57 1 . . 1 1 5 5 G H8 H . . . 1 1 5 5 G H3' H . . . . . . 1.903 3.534 . . . . . A . 6 G H8 . . A . 6 G H3' . 1 . 6 G H8 . . . 1 . 6 G H3' . . rr_1nts 1
58 1 . . 1 1 5 5 G H8 H . . . 1 1 5 5 G H4' H . . . . . . 2.413 4.481 . . . . . A . 6 G H8 . . A . 6 G H4' . 1 . 6 G H8 . . . 1 . 6 G H4' . . rr_1nts 1
59 1 . . 1 1 4 4 G H2' H . . . 1 1 5 5 G H1' H . . . . . . 2.439 4.530 . . . . . A . 6 G H1' . . A . 5 G H2' . 1 . 6 G H1' . . . 1 . 5 G H2' . . rr_1nts 1
60 1 . . 2 2 6 6 PDU H6 H . . . 2 2 6 6 PDU H1' H . . . . . . 2.787 5.175 . . . . . B . 6 PDU H1' . . B . 6 PDU H6 . B . 6 PU H1' . . . B . 6 PU H6 . . rr_1nts 1
61 1 . . 1 1 5 5 G H1' H . . . 1 1 5 5 G H2' H . . . . . . 1.839 3.415 . . . . . A . 6 G H1' . . A . 6 G H2' . 1 . 6 G H1' . . . 1 . 6 G H2' . . rr_1nts 1
62 1 . . 1 1 5 5 G H1' H . . . 1 1 5 5 G H3' H . . . . . . 2.421 4.496 . . . . . A . 6 G H1' . . A . 6 G H3' . 1 . 6 G H1' . . . 1 . 6 G H3' . . rr_1nts 1
63 1 . . 2 2 6 6 PDU H1' H . . . 2 2 6 6 PDU H3' H . . . . . . 2.884 5.355 . . . . . B . 6 PDU H1' . . B . 6 PDU H3' . B . 6 PU H1' . . . B . 6 PU H3' . . rr_1nts 1
64 1 . . 1 1 5 5 G H1' H . . . 1 1 5 5 G H4' H . . . . . . 2.460 4.569 . . . . . A . 6 G H1' . . A . 6 G H4' . 1 . 6 G H1' . . . 1 . 6 G H4' . . rr_1nts 1
65 1 . . 2 2 6 6 PDU H1' H . . . 2 2 6 6 PDU H4' H . . . . . . 2.699 5.013 . . . . . B . 6 PDU H1' . . B . 6 PDU H4' . B . 6 PU H1' . . . B . 6 PU H4' . . rr_1nts 1
66 1 . . 2 2 6 6 PDU H1' H . . . 2 2 7 7 PDU H6 H . . . . . . 3.553 6.000 . . . . . B . 6 PDU H1' . . B . 7 PDU H6 . B . 6 PU H1' . . . B . 7 PU3' H6 . . rr_1nts 1
67 1 . . 1 1 5 5 G H1' H . . . 1 1 6 6 A H8 H . . . . . . 3.350 6.000 . . . . . A . 6 G H1' . . A . 7 A H8 . 1 . 6 G H1' . . . 1 . 7 A H8 . . rr_1nts 1
68 1 . . 2 2 6 6 PDU H6 H . . . 2 2 6 6 PDU H3' H . . . . . . 2.631 4.886 . . . . . B . 6 PDU H3' . . B . 6 PDU H6 . B . 6 PU H3' . . . B . 6 PU H6 . . rr_1nts 1
69 1 . . 2 2 4 4 5PC H1' H . . . 1 1 6 6 A H2 H . . . . . . 2.312 4.294 . . . . . A . 7 A H2 . . B . 4 5PC H1' . 1 . 7 A H2 . . . B . 4 PC H1' . . rr_1nts 1
70 1 . . 2 2 6 6 PDU H3' H . . . 2 2 7 7 PDU H6 H . . . . . . 2.840 5.274 . . . . . B . 7 PDU H6 . . B . 6 PDU H3' . B . 7 PU3' H6 . . . B . 6 PU H3' . . rr_1nts 1
71 1 . . 2 2 7 7 PDU H6 H . . . 2 2 7 7 PDU H4' H . . . . . . 3.168 5.884 . . . . . B . 7 PDU H6 . . B . 7 PDU H4' . B . 7 PU3' H6 . . . B . 7 PU3' H4' . . rr_1nts 1
72 1 . . 1 1 5 5 G H2' H . . . 1 1 6 6 A H8 H . . . . . . 1.679 3.118 . . . . . A . 7 A H8 . . A . 6 G H2' . 1 . 7 A H8 . . . 1 . 6 G H2' . . rr_1nts 1
73 1 . . 1 1 5 5 G H3' H . . . 1 1 6 6 A H8 H . . . . . . 2.464 4.575 . . . . . A . 7 A H8 . . A . 6 G H3' . 1 . 7 A H8 . . . 1 . 6 G H3' . . rr_1nts 1
74 1 . . 1 1 6 6 A H8 H . . . 1 1 6 6 A H1' H . . . . . . 3.029 5.625 . . . . . A . 7 A H8 . . A . 7 A H1' . 1 . 7 A H8 . . . 1 . 7 A H1' . . rr_1nts 1
75 1 . . 1 1 6 6 A H8 H . . . 1 1 6 6 A H4' H . . . . . . 3.373 6.000 . . . . . A . 7 A H8 . . A . 7 A H4' . 1 . 7 A H8 . . . 1 . 7 A H4' . . rr_1nts 1
76 1 . . 1 1 6 6 A H1' H . . . 1 1 6 6 A H4' H . . . . . . 2.729 5.068 . . . . . A . 7 A H1' . . A . 7 A H4' . 1 . 7 A H1' . . . 1 . 7 A H4' . . rr_1nts 1
77 1 . . 1 1 5 5 G H2' H . . . 1 1 6 6 A H1' H . . . . . . 3.536 6.000 . . . . . A . 7 A H1' . . A . 6 G H2' . 1 . 7 A H1' . . . 1 . 6 G H2' . . rr_1nts 1
78 1 . . 2 2 7 7 PDU H1' H . . . 2 2 7 7 PDU H6 H . . . . . . 2.504 4.650 . . . . . B . 7 PDU H1' . . B . 7 PDU H6 . B . 7 PU3' H1' . . . B . 7 PU3' H6 . . rr_1nts 1
79 1 . . 1 1 6 6 A H1' H . . . 1 1 6 6 A H2' H . . . . . . 2.083 3.869 . . . . . A . 7 A H1' . . A . 7 A H2' . 1 . 7 A H1' . . . 1 . 7 A H2' . . rr_1nts 1
80 1 . . 1 1 6 6 A H1' H . . . 1 1 6 6 A H3' H . . . . . . 2.560 4.755 . . . . . A . 7 A H1' . . A . 7 A H3' . 1 . 7 A H1' . . . 1 . 7 A H3' . . rr_1nts 1
81 1 . . 2 2 7 7 PDU H1' H . . . 2 2 7 7 PDU H4' H . . . . . . 2.840 5.274 . . . . . B . 7 PDU H1' . . B . 7 PDU H4' . B . 7 PU3' H1' . . . B . 7 PU3' H4' . . rr_1nts 1
82 1 . . 1 1 6 6 A H1' H . . . 1 1 7 7 G H8 H . . . . . . 3.200 5.942 . . . . . A . 7 A H1' . . A . 8 G H8 . 1 . 7 A H1' . . . 1 . 8 G H8 . . rr_1nts 1
83 1 . . 2 2 7 7 PDU H6 H . . . 2 2 7 7 PDU H3' H . . . . . . 1.970 3.659 . . . . . B . 7 PDU H3' . . B . 7 PDU H6 . B . 7 PU3' H3' . . . B . 7 PU3' H6 . . rr_1nts 1
84 1 . . 1 1 6 6 A H8 H . . . 1 1 6 6 A H3' H . . . . . . 2.296 4.263 . . . . . A . 7 A H3' . . A . 7 A H8 . 1 . 7 A H3' . . . 1 . 7 A H8 . . rr_1nts 1
85 1 . . 1 1 6 6 A H2' H . . . 1 1 7 7 G H8 H . . . . . . 1.703 3.162 . . . . . A . 8 G H8 . . A . 7 A H2' . 1 . 8 G H8 . . . 1 . 7 A H2' . . rr_1nts 1
86 1 . . 1 1 6 6 A H3' H . . . 1 1 7 7 G H8 H . . . . . . 3.016 5.601 . . . . . A . 8 G H8 . . A . 7 A H3' . 1 . 8 G H8 . . . 1 . 7 A H3' . . rr_1nts 1
87 1 . . 1 1 7 7 G H8 H . . . 1 1 7 7 G H1' H . . . . . . 3.222 5.984 . . . . . A . 8 G H8 . . A . 8 G H1' . 1 . 8 G H8 . . . 1 . 8 G H1' . . rr_1nts 1
88 1 . . 1 1 7 7 G H8 H . . . 1 1 7 7 G H2' H . . . . . . 2.395 4.447 . . . . . A . 8 G H8 . . A . 8 G H2' . 1 . 8 G H8 . . . 1 . 8 G H2' . . rr_1nts 1
89 1 . . 1 1 7 7 G H8 H . . . 1 1 7 7 G H3' H . . . . . . 2.109 3.916 . . . . . A . 8 G H8 . . A . 8 G H3' . 1 . 8 G H8 . . . 1 . 8 G H3' . . rr_1nts 1
90 1 . . 1 1 6 6 A H2 H . . . 1 1 7 7 G H1' H . . . . . . 1.999 3.712 . . . . . A . 8 G H1' . . A . 7 A H2 . 1 . 8 G H1' . . . 1 . 7 A H2 . . rr_1nts 1
91 1 . . 1 1 7 7 G H1' H . . . 1 1 7 7 G H4' H . . . . . . 2.425 4.503 . . . . . A . 8 G H1' . . A . 8 G H4' . 1 . 8 G H1' . . . 1 . 8 G H4' . . rr_1nts 1
92 1 . . 1 1 7 7 G H1' H . . . 1 1 7 7 G H2' H . . . . . . 1.740 3.231 . . . . . A . 8 G H2' . . A . 8 G H1' . 1 . 8 G H2' . . . 1 . 8 G H1' . . rr_1nts 1
93 1 . . 1 1 7 7 G H1' H . . . 1 1 8 8 G H8 H . . . . . . 3.138 5.829 . . . . . A . 9 G H8 . . A . 8 G H1' . 1 . 9 G H8 . . . 1 . 8 G H1' . . rr_1nts 1
94 1 . . 1 1 7 7 G H2' H . . . 1 1 8 8 G H8 H . . . . . . 1.627 3.021 . . . . . A . 9 G H8 . . A . 8 G H2' . 1 . 9 G H8 . . . 1 . 8 G H2' . . rr_1nts 1
95 1 . . 1 1 7 7 G H3' H . . . 1 1 8 8 G H8 H . . . . . . 2.592 4.814 . . . . . A . 9 G H8 . . A . 8 G H3' . 1 . 9 G H8 . . . 1 . 8 G H3' . . rr_1nts 1
96 1 . . 1 1 8 8 G H8 H . . . 1 1 8 8 G H3' H . . . . . . 1.971 3.660 . . . . . A . 9 G H8 . . A . 9 G H3' . 1 . 9 G H8 . . . 1 . 9 G H3' . . rr_1nts 1
97 1 . . 1 1 8 8 G H8 H . . . 1 1 8 8 G H4' H . . . . . . 2.233 4.146 . . . . . A . 9 G H8 . . A . 9 G H4' . 1 . 9 G H8 . . . 1 . 9 G H4' . . rr_1nts 1
98 1 . . 1 1 8 8 G H8 H . . . 1 1 8 8 G H1' H . . . . . . 2.992 5.556 . . . . . A . 9 G H1' . . A . 9 G H8 . 1 . 9 G H1' . . . 1 . 9 G H8 . . rr_1nts 1
99 1 . . 1 1 8 8 G H3' H . . . 1 1 8 8 G H1' H . . . . . . 2.504 4.651 . . . . . A . 9 G H1' . . A . 9 G H3' . 1 . 9 G H1' . . . 1 . 9 G H3' . . rr_1nts 1
100 1 . . 1 1 8 8 G H4' H . . . 1 1 8 8 G H1' H . . . . . . 2.318 4.304 . . . . . A . 9 G H1' . . A . 9 G H4' . 1 . 9 G H1' . . . 1 . 9 G H4' . . rr_1nts 1
101 1 . . 1 1 8 8 G H1' H . . . 1 1 9 9 A H8 H . . . . . . 3.155 5.860 . . . . . A . 9 G H1' . . A . 10 A H8 . 1 . 9 G H1' . . . 1 . 10 A H8 . . rr_1nts 1
102 1 . . 1 1 8 8 G H1' H . . . 1 1 8 8 G H2' H . . . . . . 1.706 3.168 . . . . . A . 9 G H2' . . A . 9 G H1' . 1 . 9 G H2' . . . 1 . 9 G H1' . . rr_1nts 1
103 1 . . 1 1 9 9 A H8 H . . . 1 1 8 8 G H2' H . . . . . . 1.719 3.192 . . . . . A . 9 G H2' . . A . 10 A H8 . 1 . 9 G H2' . . . 1 . 10 A H8 . . rr_1nts 1
104 1 . . 1 1 8 8 G H3' H . . . 1 1 9 9 A H8 H . . . . . . 1.887 3.504 . . . . . A . 9 G H3' . . A . 10 A H8 . 1 . 9 G H3' . . . 1 . 10 A H8 . . rr_1nts 1
105 1 . . 1 1 9 9 A H8 H . . . 1 1 9 9 A H1' H . . . . . . 2.992 5.556 . . . . . A . 10 A H8 . . A . 10 A H1' . 1 . 10 A H8 . . . 1 . 10 A H1' . . rr_1nts 1
106 1 . . 1 1 9 9 A H8 H . . . 1 1 9 9 A H3' H . . . . . . 1.919 3.564 . . . . . A . 10 A H8 . . A . 10 A H3' . 1 . 10 A H8 . . . 1 . 10 A H3' . . rr_1nts 1
107 1 . . 1 1 9 9 A H1' H . . . 1 1 9 9 A H3' H . . . . . . 3.014 5.598 . . . . . A . 10 A H1' . . A . 10 A H3' . 1 . 10 A H1' . . . 1 . 10 A H3' . . rr_1nts 1
108 1 . . 1 1 9 9 A H1' H . . . 1 1 9 9 A H2' H . . . . . . 1.786 3.317 . . . . . A . 10 A H2' . . A . 10 A H1' . 1 . 10 A H2' . . . 1 . 10 A H1' . . rr_1nts 1
109 1 . . 1 1 1 1 A H2' H . . . 1 1 2 2 A H8 H . . . . . . 0.000 5.000 . . . . . A . 3 A H8 . . A . 2 A H2' . 1 . 3 A H8 . . . 1 . 2 A H2' . . rr_1nts 1
110 1 . . 1 1 2 2 A H8 H . . . 1 1 2 2 A H3' H . . . . . . 0.000 5.000 . . . . . A . 3 A H8 . . A . 3 A H3' . 1 . 3 A H8 . . . 1 . 3 A H3' . . rr_1nts 1
111 1 . . 1 1 5 5 G H1' H . . . 1 1 6 6 A H8 H . . . . . . 3.350 6.000 . . . . . A . 7 A H8 . . A . 6 G H1' . 1 . 7 A H8 . . . 1 . 6 G H1' . . rr_1nts 1
112 1 . . 1 1 7 7 G H8 H . . . 1 1 7 7 G H4' H . . . . . . 0.000 5.000 . . . . . A . 8 G H8 . . A . 8 G H4' . 1 . 8 G H8 . . . 1 . 8 G H4' . . rr_1nts 1
113 1 . . 1 1 7 7 G H2' H . . . 1 1 8 8 G H1' H . . . . . . 0.000 5.000 . . . . . A . 9 G H1' . . A . 8 G H2' . 1 . 9 G H1' . . . 1 . 8 G H2' . . rr_1nts 1
114 1 . . 1 1 7 7 G H3' H . . . 1 1 8 8 G H8 H . . . . . . 0.000 5.000 . . . . . A . 9 G H8 . . A . 8 G H3' . 1 . 9 G H8 . . . 1 . 8 G H3' . . rr_1nts 1
115 1 . . 2 2 2 2 5PC H1' H . . . 2 2 3 3 PDU H6 H . . . . . . 0.000 5.000 . . . . . B . 2 5PC H1' . . B . 3 PDU H6 . B . 2 PC H1' . . . B . 3 PU H6 . . rr_1nts 1
116 1 . . 2 2 2 2 5PC H6 H . . . 2 2 2 2 5PC H1' H . . . . . . 0.000 5.000 . . . . . B . 2 5PC H6 . . B . 2 5PC H1' . B . 2 PC H6 . . . B . 2 PC H1' . . rr_1nts 1
117 1 . . 2 2 5 5 5PC H3' H . . . 2 2 6 6 PDU H6 H . . . . . . 0.000 5.000 . . . . . B . 5 5PC H3' . . B . 6 PDU H6 . B . 5 PC H3' . . . B . 6 PU H6 . . rr_1nts 1
118 1 . . 2 2 6 6 PDU H6 H . . . 2 2 6 6 PDU H4' H . . . . . . 0.000 5.000 . . . . . B . 6 PDU H6 . . B . 6 PDU H4' . B . 6 PU H6 . . . B . 6 PU H4' . . rr_1nts 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 "************ STRANDS 1 & 2 TOGETHER" 1 1 5 1 rr_1nts 1
2 "2.480 0.30/0.30:" 6 82 6 107 rr_1nts 1
3 "3.540 0.30/0.30:" 7 82 7 107 rr_1nts 1
4 "2.138 0.30/0.30:" 8 82 8 107 rr_1nts 1
5 "3.279 0.30/0.30:" 9 82 9 107 rr_1nts 1
6 "4.167 0.30/0.30:" 10 82 10 107 rr_1nts 1
7 "4.177 0.30/0.30:" 11 82 11 107 rr_1nts 1
8 "2.540 0.30/0.30:" 12 82 12 107 rr_1nts 1
9 "2.980 0.30/0.30:" 13 82 13 107 rr_1nts 1
10 "3.159 0.30/0.30:" 14 82 14 107 rr_1nts 1
11 "3.766 0.30/0.30:" 15 82 15 107 rr_1nts 1
12 "2.816 0.30/0.30:" 16 82 16 107 rr_1nts 1
13 "2.092 0.30/0.30:" 17 82 17 107 rr_1nts 1
14 "3.086 0.30/0.30:" 18 82 18 107 rr_1nts 1
15 "4.269 0.30/0.30:" 19 82 19 107 rr_1nts 1
16 "3.982 0.30/0.30:" 20 82 20 107 rr_1nts 1
17 "3.358 0.30/0.30:" 21 82 21 107 rr_1nts 1
18 "2.751 0.30/0.30:" 22 82 22 107 rr_1nts 1
19 "2.234 0.30/0.30:" 23 82 23 107 rr_1nts 1
20 "3.652 0.30/0.30:" 24 82 24 107 rr_1nts 1
21 "3.104 0.30/0.30:" 25 82 25 107 rr_1nts 1
22 "4.236 0.30/0.30:" 26 82 26 107 rr_1nts 1
23 "2.990 0.30/0.30:" 27 82 27 107 rr_1nts 1
24 "2.096 0.30/0.30:" 28 82 28 107 rr_1nts 1
25 "2.790 0.30/0.30:" 29 82 29 107 rr_1nts 1
26 "4.000 0.30/0.30:" 30 82 30 107 rr_1nts 1
27 "3.513 0.30/0.30:" 31 82 31 107 rr_1nts 1
28 "3.556 0.30/0.30:" 32 82 32 107 rr_1nts 1
29 "4.094 0.30/0.30:" 33 82 33 107 rr_1nts 1
30 "3.635 0.30/0.30:" 34 82 34 107 rr_1nts 1
31 "3.162 0.30/0.30:" 35 82 35 107 rr_1nts 1
32 "3.811 0.30/0.30:" 36 82 36 107 rr_1nts 1
33 "3.643 0.30/0.30:" 37 82 37 107 rr_1nts 1
34 "2.494 0.30/0.30:" 38 82 38 107 rr_1nts 1
35 "2.469 0.30/0.30:" 39 82 39 107 rr_1nts 1
36 "3.551 0.30/0.30:" 40 82 40 107 rr_1nts 1
37 "3.637 0.30/0.30:" 41 82 41 107 rr_1nts 1
38 "3.416 0.30/0.30:" 42 82 42 107 rr_1nts 1
39 "2.468 0.30/0.30:" 43 82 43 107 rr_1nts 1
40 "3.878 0.30/0.30:" 44 82 44 107 rr_1nts 1
41 "3.819 0.30/0.30:" 45 82 45 107 rr_1nts 1
42 "2.584 0.30/0.30:" 46 82 46 107 rr_1nts 1
43 "3.883 0.30/0.30:" 47 82 47 107 rr_1nts 1
44 "3.012 0.30/0.30:" 48 82 48 107 rr_1nts 1
45 "4.218 0.30/0.30:" 49 82 49 107 rr_1nts 1
46 "2.727 0.30/0.30:" 50 82 50 107 rr_1nts 1
47 "2.413 0.30/0.30:" 51 82 51 107 rr_1nts 1
48 "3.815 0.30/0.30:" 52 82 52 107 rr_1nts 1
49 "4.314 0.30/0.30:" 53 82 53 107 rr_1nts 1
50 "4.775 0.30/0.30:" 54 82 54 107 rr_1nts 1
51 "2.496 0.30/0.30:" 55 82 55 107 rr_1nts 1
52 "3.591 0.30/0.30:" 56 82 56 107 rr_1nts 1
53 "3.239 0.30/0.30:" 57 82 57 107 rr_1nts 1
54 "2.109 0.30/0.30:" 58 82 58 107 rr_1nts 1
55 "3.892 0.30/0.30:" 59 82 59 107 rr_1nts 1
56 "2.976 0.30/0.30:" 60 82 60 107 rr_1nts 1
57 "2.331 0.30/0.30:" 61 82 61 107 rr_1nts 1
58 "3.257 0.30/0.30:" 62 82 62 107 rr_1nts 1
59 "3.835 0.30/0.30:" 63 82 63 107 rr_1nts 1
60 "3.431 0.30/0.30:" 64 82 64 107 rr_1nts 1
61 "2.738 0.30/0.30:" 65 82 65 107 rr_1nts 1
62 "3.307 0.30/0.30:" 66 82 66 107 rr_1nts 1
63 "3.283 0.30/0.30:" 67 82 67 107 rr_1nts 1
64 "3.872 0.30/0.30:" 68 82 68 107 rr_1nts 1
65 "3.830 0.30/0.30:" 69 82 69 107 rr_1nts 1
66 "2.345 0.30/0.30:" 70 82 70 107 rr_1nts 1
67 "3.637 0.30/0.30:" 71 82 71 107 rr_1nts 1
68 "4.338 0.30/0.30:" 72 82 72 107 rr_1nts 1
69 "3.159 0.30/0.30:" 73 82 73 107 rr_1nts 1
70 "3.279 0.30/0.30:" 74 82 74 107 rr_1nts 1
71 "2.486 0.30/0.30:" 75 82 75 107 rr_1nts 1
72 "2.828 0.30/0.30:" 76 82 76 107 rr_1nts 1
73 "2.907 0.30/0.30:" 77 82 77 107 rr_1nts 1
74 "3.196 0.30/0.30:" 78 82 78 107 rr_1nts 1
75 "2.175 0.30/0.30:" 79 82 79 107 rr_1nts 1
76 "2.371 0.30/0.30:" 80 82 80 107 rr_1nts 1
77 "3.421 0.30/0.30:" 81 82 81 107 rr_1nts 1
78 "4.108 0.30/0.30:" 82 82 82 107 rr_1nts 1
79 "2.360 0.30/0.30:" 83 82 83 107 rr_1nts 1
80 "2.676 0.30/0.30:" 84 82 84 107 rr_1nts 1
81 "3.832 0.30/0.30:" 85 82 85 107 rr_1nts 1
82 "3.447 0.30/0.30:" 86 82 86 107 rr_1nts 1
83 "2.718 0.30/0.30:" 87 82 87 107 rr_1nts 1
84 "3.447 0.30/0.30:" 88 82 88 107 rr_1nts 1
85 "3.485 0.30/0.30:" 89 82 89 107 rr_1nts 1
86 "3.981 0.30/0.30:" 90 82 90 107 rr_1nts 1
87 "2.627 0.30/0.30:" 91 82 91 107 rr_1nts 1
88 "2.398 0.30/0.30:" 92 82 92 107 rr_1nts 1
89 "2.793 0.30/0.30:" 93 82 93 107 rr_1nts 1
90 "3.458 0.30/0.30:" 94 82 94 107 rr_1nts 1
91 "4.119 0.30/0.30:" 95 82 95 107 rr_1nts 1
92 "3.514 0.30/0.30:" 96 82 96 107 rr_1nts 1
93 "3.856 0.30/0.30:" 97 82 97 107 rr_1nts 1
94 "5.076 0.30/0.30:" 98 82 98 107 rr_1nts 1
95 "4.786 0.30/0.30:" 99 82 99 107 rr_1nts 1
96 "3.759 0.30/0.30:" 100 82 100 107 rr_1nts 1
97 "3.303 0.30/0.30:" 101 82 101 107 rr_1nts 1
98 "3.008 0.30/0.30:" 102 82 102 107 rr_1nts 1
99 "2.581 0.30/0.30:" 103 82 103 107 rr_1nts 1
100 "1.909 0.30/0.30:" 104 82 104 107 rr_1nts 1
101 "4.057 0.30/0.30:" 105 82 105 107 rr_1nts 1
102 "4.526 0.30/0.30:" 106 82 106 107 rr_1nts 1
103 "2.399 0.30/0.30:" 107 82 107 107 rr_1nts 1
104 "3.519 0.30/0.30:" 108 82 108 107 rr_1nts 1
105 "4.327 0.30/0.30:" 109 82 109 107 rr_1nts 1
106 "4.819 0.30/0.30:" 110 82 110 107 rr_1nts 1
107 "3.898 0.30/0.30:" 111 82 111 107 rr_1nts 1
108 "5.052 0.30/0.30:" 112 82 112 107 rr_1nts 1
109 "3.577 0.30/0.30:" 113 82 113 107 rr_1nts 1
110 "2.976 0.30/0.30:" 114 82 114 107 rr_1nts 1
111 "2.086 0.30/0.30:" 115 82 115 107 rr_1nts 1
112 "3.658 0.30/0.30:" 116 82 116 107 rr_1nts 1
113 "4.057 0.30/0.30:" 117 82 117 107 rr_1nts 1
114 "4.571 0.30/0.30:" 118 82 118 107 rr_1nts 1
115 "2.814 0.30/0.30:" 119 82 119 107 rr_1nts 1
116 "3.279 0.30/0.30:" 120 82 120 107 rr_1nts 1
117 "2.432 0.30/0.30:" 121 82 121 107 rr_1nts 1
118 "4.309 0.30/0.30:" 122 82 122 107 rr_1nts 1
119 "4.603 0.30/0.30:" 123 82 123 107 rr_1nts 1
120 "3.421 0.30/0.30:" 124 82 124 107 rr_1nts 1
121 "3.012 0.30/0.30:" 125 82 125 107 rr_1nts 1
122 "2.856 0.30/0.30:" 126 82 126 107 rr_1nts 1
123 "3.464 0.30/0.30:" 127 82 127 107 rr_1nts 1
124 "2.485 0.30/0.30:" 128 82 128 107 rr_1nts 1
125 "4.483 0.30/0.30:" 129 82 129 107 rr_1nts 1
126 "2.324 0.30/0.30:" 130 82 130 107 rr_1nts 1
127 "3.703 0.30/0.30:" 131 82 131 107 rr_1nts 1
128 "2.816 0.30/0.30:" 132 82 132 107 rr_1nts 1
129 "3.189 0.30/0.30:" 133 82 133 107 rr_1nts 1
130 "4.274 0.30/0.30:" 134 82 134 107 rr_1nts 1
131 "3.578 0.30/0.30:" 135 82 135 107 rr_1nts 1
132 "3.311 0.30/0.30:" 136 82 136 107 rr_1nts 1
133 "4.508 0.30/0.30:" 137 82 137 107 rr_1nts 1
134 "2.437 0.30/0.30:" 138 82 138 107 rr_1nts 1
135 "2.456 0.30/0.30:" 139 82 139 107 rr_1nts 1
136 "2.695 0.30/0.30:" 140 82 140 107 rr_1nts 1
137 "4.274 0.30/0.30:" 141 82 141 107 rr_1nts 1
138 "2.741 0.30/0.30:" 142 82 142 107 rr_1nts 1
139 "4.306 0.30/0.30:" 143 82 143 107 rr_1nts 1
140 "2.551 0.30/0.30:" 144 82 144 107 rr_1nts 1
141 "4.786 0.30/0.30" 147 82 147 100 rr_1nts 1
142 "2.388 0.30/0.30" 154 82 154 100 rr_1nts 1
stop_
loop_
_Gen_dist_constraint_conv_err.ID
_Gen_dist_constraint_conv_err.Gen_dist_constraint_parse_file_ID
_Gen_dist_constraint_conv_err.Parse_file_constraint_ID
_Gen_dist_constraint_conv_err.Conv_error_type
_Gen_dist_constraint_conv_err.Conv_error_note
_Gen_dist_constraint_conv_err.Entry_ID
_Gen_dist_constraint_conv_err.Gen_dist_constraint_list_ID
1 3 1 1 "Not handling restraint 1, item 1, resonance(s) 'B.1.H5' (nmrStar names) not linked" rr_1nts 1
2 3 2 1 "Not handling restraint 2, item 1, resonance(s) 'B.2.H5M2' (nmrStar names) not linked" rr_1nts 1
3 3 3 1 "Not handling restraint 3, item 1, resonance(s) 'B.1.H2'2' (nmrStar names) not linked" rr_1nts 1
4 3 8 1 "Not handling restraint 8, item 1, resonance(s) 'B.3.H5M2' (nmrStar names) not linked" rr_1nts 1
5 3 11 1 "Not handling restraint 11, item 1, resonance(s) 'B.2.H2'1' (nmrStar names) not linked" rr_1nts 1
6 3 12 1 "Not handling restraint 12, item 1, resonance(s) 'B.2.H2'2' (nmrStar names) not linked" rr_1nts 1
7 3 17 1 "Not handling restraint 17, item 1, resonance(s) 'B.3.H5M2' (nmrStar names) not linked" rr_1nts 1
8 3 18 1 "Not handling restraint 18, item 1, resonance(s) 'B.2.H2'2' (nmrStar names) not linked" rr_1nts 1
9 3 20 1 "Not handling restraint 20, item 1, resonance(s) 'B.4.H5M2' (nmrStar names) not linked" rr_1nts 1
10 3 23 1 "Not handling restraint 23, item 1, resonance(s) 'B.3.H2'2' (nmrStar names) not linked" rr_1nts 1
11 3 24 1 "Not handling restraint 24, item 1, resonance(s) 'B.3.H2'1' (nmrStar names) not linked" rr_1nts 1
12 3 32 1 "Not handling restraint 32, item 1, resonance(s) 'B.4.H5M2' (nmrStar names) not linked" rr_1nts 1
13 3 33 1 "Not handling restraint 33, item 1, resonance(s) 'B.3.H2'1' (nmrStar names) not linked" rr_1nts 1
14 3 34 1 "Not handling restraint 34, item 1, resonance(s) 'B.3.H2'2' (nmrStar names) not linked" rr_1nts 1
15 3 37 1 "Not handling restraint 37, item 1, resonance(s) 'B.5.H5M2' (nmrStar names) not linked" rr_1nts 1
16 3 45 1 "Not handling restraint 45, item 1, resonance(s) 'B.4.H2'1' (nmrStar names) not linked" rr_1nts 1
17 3 46 1 "Not handling restraint 46, item 1, resonance(s) 'B.4.H2'2' (nmrStar names) not linked" rr_1nts 1
18 3 52 1 "Not handling restraint 52, item 1, resonance(s) 'B.5.H5M2' (nmrStar names) not linked" rr_1nts 1
19 3 53 1 "Not handling restraint 53, item 1, resonance(s) 'B.4.H2'1' (nmrStar names) not linked" rr_1nts 1
20 3 55 1 "Not handling restraint 55, item 1, resonance(s) 'B.6.H5M2' (nmrStar names) not linked" rr_1nts 1
21 3 65 1 "Not handling restraint 65, item 1, resonance(s) 'B.5.H2'2' (nmrStar names) not linked" rr_1nts 1
22 3 72 1 "Not handling restraint 72, item 1, resonance(s) 'B.6.H5M2' (nmrStar names) not linked" rr_1nts 1
23 3 74 1 "Not handling restraint 74, item 1, resonance(s) 'B.5.H2'1' (nmrStar names) not linked" rr_1nts 1
24 3 75 1 "Not handling restraint 75, item 1, resonance(s) 'B.5.H2'2' (nmrStar names) not linked" rr_1nts 1
25 3 76 1 "Not handling restraint 76, item 1, resonance(s) 'B.7.H5M2' (nmrStar names) not linked" rr_1nts 1
26 3 87 1 "Not handling restraint 87, item 1, resonance(s) 'B.6.H2'2' (nmrStar names) not linked" rr_1nts 1
27 3 88 1 "Not handling restraint 88, item 1, resonance(s) 'B.6.H2'1' (nmrStar names) not linked" rr_1nts 1
28 3 97 1 "Not handling restraint 97, item 1, resonance(s) 'B.7.H5M2' (nmrStar names) not linked" rr_1nts 1
29 3 98 1 "Not handling restraint 98, item 1, resonance(s) 'B.6.H2'2' (nmrStar names) not linked" rr_1nts 1
30 3 99 1 "Not handling restraint 99, item 1, resonance(s) 'B.6.H2'1' (nmrStar names) not linked" rr_1nts 1
31 3 110 1 "Not handling restraint 110, item 1, resonance(s) 'B.7.H2'1' (nmrStar names) not linked" rr_1nts 1
32 3 149 1 "Not handling restraint 149, item 1, resonance(s) 'B.4.H2'2' (nmrStar names) not linked" rr_1nts 1
33 3 150 1 "Not handling restraint 150, item 1, resonance(s) 'B.2.H2'1' (nmrStar names) not linked" rr_1nts 1
stop_
save_
save_Discover_distance_constraints_2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode Discover_distance_constraints_2
_Gen_dist_constraint_list.Entry_ID rr_1nts
_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_1nts 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 2 2 A N1 N . . . 2 2 7 7 PDU H3 H . . . . . . 1.8 2.5 . . . . . A . 3 A N1 . . B . 7 PDU H3 . 1 . 3 A N1 . . . B . 7 PU3' H3 . . rr_1nts 2
2 1 . . 1 1 2 2 A H61 H . . . 2 2 7 7 PDU O4 O . . . . . . 1.8 2.5 . . . . . A . 3 A H61 . . B . 7 PDU O4 . 1 . 3 A H61 . . . B . 7 PU3' O4 . . rr_1nts 2
3 1 . . 1 1 3 3 A N1 N . . . 2 2 6 6 PDU H3 H . . . . . . 1.8 2.5 . . . . . A . 4 A N1 . . B . 6 PDU H3 . 1 . 4 A N1 . . . B . 6 PU H3 . . rr_1nts 2
4 1 . . 1 1 3 3 A H61 H . . . 2 2 6 6 PDU O4 O . . . . . . 1.8 2.5 . . . . . A . 4 A H61 . . B . 6 PDU O4 . 1 . 4 A H61 . . . B . 6 PU O4 . . rr_1nts 2
5 1 . . 1 1 4 4 G H1 H . . . 2 2 5 5 5PC N3 N . . . . . . 1.8 2.5 . . . . . A . 5 G H1 . . B . 5 5PC N3 . 1 . 5 G H1 . . . B . 5 PC N3 . . rr_1nts 2
6 1 . . 1 1 4 4 G O6 O . . . 2 2 5 5 5PC H42 H . . . . . . 1.8 2.5 . . . . . A . 5 G O6 . . B . 5 5PC H42 . 1 . 5 G O6 . . . B . 5 PC H42 . . rr_1nts 2
7 1 . . 1 1 4 4 G H22 H . . . 2 2 5 5 5PC O2 O . . . . . . 1.8 2.5 . . . . . A . 5 G H22 . . B . 5 5PC O2 . 1 . 5 G H22 . . . B . 5 PC O2 . . rr_1nts 2
8 1 . . 1 1 5 5 G H1 H . . . 2 2 4 4 5PC N3 N . . . . . . 1.8 2.5 . . . . . A . 6 G H1 . . B . 4 5PC N3 . 1 . 6 G H1 . . . B . 4 PC N3 . . rr_1nts 2
9 1 . . 1 1 5 5 G O6 O . . . 2 2 4 4 5PC H42 H . . . . . . 1.8 2.5 . . . . . A . 6 G O6 . . B . 4 5PC H42 . 1 . 6 G O6 . . . B . 4 PC H42 . . rr_1nts 2
10 1 . . 1 1 5 5 G H22 H . . . 2 2 4 4 5PC O2 O . . . . . . 1.8 2.5 . . . . . A . 6 G H22 . . B . 4 5PC O2 . 1 . 6 G H22 . . . B . 4 PC O2 . . rr_1nts 2
11 1 . . 1 1 6 6 A N1 N . . . 2 2 3 3 PDU H3 H . . . . . . 1.8 2.5 . . . . . A . 7 A N1 . . B . 3 PDU H3 . 1 . 7 A N1 . . . B . 3 PU H3 . . rr_1nts 2
12 1 . . 1 1 6 6 A H61 H . . . 2 2 3 3 PDU O4 O . . . . . . 1.8 2.5 . . . . . A . 7 A H61 . . B . 3 PDU O4 . 1 . 7 A H61 . . . B . 3 PU O4 . . rr_1nts 2
13 1 . . 1 1 7 7 G H1 H . . . 2 2 2 2 5PC N3 N . . . . . . 1.8 2.5 . . . . . A . 8 G H1 . . B . 2 5PC N3 . 1 . 8 G H1 . . . B . 2 PC N3 . . rr_1nts 2
14 1 . . 1 1 7 7 G O6 O . . . 2 2 2 2 5PC H42 H . . . . . . 1.8 2.5 . . . . . A . 8 G O6 . . B . 2 5PC H42 . 1 . 8 G O6 . . . B . 2 PC H42 . . rr_1nts 2
15 1 . . 1 1 7 7 G H22 H . . . 2 2 2 2 5PC O2 O . . . . . . 1.8 2.5 . . . . . A . 8 G H22 . . B . 2 5PC O2 . 1 . 8 G H22 . . . B . 2 PC O2 . . rr_1nts 2
16 1 . . 1 1 8 8 G H1 H . . . 2 2 1 1 5PC N3 N . . . . . . 1.8 2.5 . . . . . A . 9 G H1 . . B . 1 5PC N3 . 1 . 9 G H1 . . . B . 1 C5' N3 . . rr_1nts 2
17 1 . . 1 1 8 8 G O6 O . . . 2 2 1 1 5PC H42 H . . . . . . 1.8 2.5 . . . . . A . 9 G O6 . . B . 1 5PC H42 . 1 . 9 G O6 . . . B . 1 C5' H42 . . rr_1nts 2
18 1 . . 1 1 8 8 G H22 H . . . 2 2 1 1 5PC O2 O . . . . . . 1.8 2.5 . . . . . A . 9 G H22 . . B . 1 5PC O2 . 1 . 9 G H22 . . . B . 1 C5' O2 . . rr_1nts 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
;BIOSYM restraint 1 distance
Hydrogen bonding distances (based on Theoretical numbers and observed NOEs between
exchangeable protons on 1D and 2D NOESY spectra
;
1 1 6 1 rr_1nts 2
2 Hbond 7 90 7 95 rr_1nts 2
3 Hbond 8 90 8 95 rr_1nts 2
4 Hbond 9 90 9 95 rr_1nts 2
5 Hbond 10 90 10 95 rr_1nts 2
6 Hbond 11 90 11 95 rr_1nts 2
7 Hbond 12 90 12 95 rr_1nts 2
8 Hbond 13 90 13 95 rr_1nts 2
9 Hbond 14 90 14 95 rr_1nts 2
10 Hbond 15 90 15 95 rr_1nts 2
11 Hbond 16 90 16 95 rr_1nts 2
12 Hbond 17 90 17 95 rr_1nts 2
13 Hbond 18 90 18 95 rr_1nts 2
14 Hbond 19 90 19 95 rr_1nts 2
15 Hbond 20 90 20 95 rr_1nts 2
16 Hbond 21 90 21 95 rr_1nts 2
17 Hbond 22 90 22 95 rr_1nts 2
18 Hbond 23 90 23 95 rr_1nts 2
stop_
save_
save_Discover_distance_constraints_3_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Sf_framecode Discover_distance_constraints_3_1
_Distance_constraint_list.Entry_ID rr_1nts
_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_1nts 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_1nts 1
2 1 . . . rr_1nts 1
3 1 . . . rr_1nts 1
4 1 . . . rr_1nts 1
5 1 . . . rr_1nts 1
6 1 . . . rr_1nts 1
7 1 . . . rr_1nts 1
8 1 . . . rr_1nts 1
9 1 . . . rr_1nts 1
10 1 . . . rr_1nts 1
11 1 . . . rr_1nts 1
12 1 . . . rr_1nts 1
13 1 . . . rr_1nts 1
14 1 . . . rr_1nts 1
15 1 . . . rr_1nts 1
16 1 . . . rr_1nts 1
17 1 . . . rr_1nts 1
18 1 . . . rr_1nts 1
19 1 . . . rr_1nts 1
20 1 . . . rr_1nts 1
21 1 . . . rr_1nts 1
22 1 . . . rr_1nts 1
23 1 . . . rr_1nts 1
24 1 . . . rr_1nts 1
25 1 . . . rr_1nts 1
26 1 . . . rr_1nts 1
27 1 . . . rr_1nts 1
28 1 . . . rr_1nts 1
29 1 . . . rr_1nts 1
30 1 . . . rr_1nts 1
31 1 . . . rr_1nts 1
32 1 . . . rr_1nts 1
33 1 . . . rr_1nts 1
34 1 . . . rr_1nts 1
35 1 . . . rr_1nts 1
36 1 . . . rr_1nts 1
37 1 . . . rr_1nts 1
38 1 . . . rr_1nts 1
39 1 . . . rr_1nts 1
40 1 . . . rr_1nts 1
41 1 . . . rr_1nts 1
42 1 . . . rr_1nts 1
43 1 . . . rr_1nts 1
44 1 . . . rr_1nts 1
45 1 . . . rr_1nts 1
46 1 . . . rr_1nts 1
47 1 . . . rr_1nts 1
48 1 . . . rr_1nts 1
49 1 . . . rr_1nts 1
50 1 . . . rr_1nts 1
51 1 . . . rr_1nts 1
52 1 . . . rr_1nts 1
53 1 . . . rr_1nts 1
54 1 . . . rr_1nts 1
55 1 . . . rr_1nts 1
56 1 . . . rr_1nts 1
57 1 . . . rr_1nts 1
58 1 . . . rr_1nts 1
59 1 . . . rr_1nts 1
60 1 . . . rr_1nts 1
61 1 . . . rr_1nts 1
62 1 . . . rr_1nts 1
63 1 . . . rr_1nts 1
64 1 . . . rr_1nts 1
65 1 . . . rr_1nts 1
66 1 . . . rr_1nts 1
67 1 . . . rr_1nts 1
68 1 . . . rr_1nts 1
69 1 . . . rr_1nts 1
70 1 . . . rr_1nts 1
71 1 . . . rr_1nts 1
72 1 . . . rr_1nts 1
73 1 . . . rr_1nts 1
74 1 . . . rr_1nts 1
75 1 . . . rr_1nts 1
76 1 . . . rr_1nts 1
77 1 . . . rr_1nts 1
78 1 . . . rr_1nts 1
79 1 . . . rr_1nts 1
80 1 . . . rr_1nts 1
81 1 . . . rr_1nts 1
82 1 . . . rr_1nts 1
83 1 . . . rr_1nts 1
84 1 . . . rr_1nts 1
85 1 . . . rr_1nts 1
86 1 . . . rr_1nts 1
87 1 . . . rr_1nts 1
88 1 . . . rr_1nts 1
89 1 . . . rr_1nts 1
90 1 . . . rr_1nts 1
91 1 . . . rr_1nts 1
92 1 . . . rr_1nts 1
93 1 . . . rr_1nts 1
94 1 . . . rr_1nts 1
95 1 . . . rr_1nts 1
96 1 . . . rr_1nts 1
97 1 . . . rr_1nts 1
98 1 . . . rr_1nts 1
99 1 . . . rr_1nts 1
100 1 . . . rr_1nts 1
101 1 . . . rr_1nts 1
102 1 . . . rr_1nts 1
103 1 . . . rr_1nts 1
104 1 . . . rr_1nts 1
105 1 . . . rr_1nts 1
106 1 . . . rr_1nts 1
107 1 . . . rr_1nts 1
108 1 . . . rr_1nts 1
109 1 . . . rr_1nts 1
110 1 . . . rr_1nts 1
111 1 . . . rr_1nts 1
112 1 . . . rr_1nts 1
113 1 . . . rr_1nts 1
114 1 . . . rr_1nts 1
115 1 . . . rr_1nts 1
116 1 . . . rr_1nts 1
117 1 . . . rr_1nts 1
118 1 . . . rr_1nts 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 1 1 A H2 H . . 1 . 2 A H2 rr_1nts 1
1 1 . 2 . 1 1 2 2 A H1' H . . 1 . 3 A H1' rr_1nts 1
2 1 . 1 . 2 2 2 2 5PC H6 H . . B . 2 PC H6 rr_1nts 1
2 1 . 2 . 2 2 1 1 5PC H1' H . . B . 1 C5' H1' rr_1nts 1
3 1 . 1 . 2 2 2 2 5PC H6 H . . B . 2 PC H6 rr_1nts 1
3 1 . 2 . 2 2 1 1 5PC H3' H . . B . 1 C5' H3' rr_1nts 1
4 1 . 1 . 2 2 2 2 5PC H6 H . . B . 2 PC H6 rr_1nts 1
4 1 . 2 . 2 2 2 2 5PC H3' H . . B . 2 PC H3' rr_1nts 1
5 1 . 1 . 1 1 1 1 A H8 H . . 1 . 2 A H8 rr_1nts 1
5 1 . 2 . 1 1 1 1 A H1' H . . 1 . 2 A H1' rr_1nts 1
6 1 . 1 . 1 1 1 1 A H8 H . . 1 . 2 A H8 rr_1nts 1
6 1 . 2 . 1 1 1 1 A H3' H . . 1 . 2 A H3' rr_1nts 1
7 1 . 1 . 1 1 1 1 A H1' H . . 1 . 2 A H1' rr_1nts 1
7 1 . 2 . 1 1 1 1 A H2' H . . 1 . 2 A H2' rr_1nts 1
8 1 . 1 . 1 1 1 1 A H1' H . . 1 . 2 A H1' rr_1nts 1
8 1 . 2 . 1 1 1 1 A H3' H . . 1 . 2 A H3' rr_1nts 1
9 1 . 1 . 1 1 1 1 A H1' H . . 1 . 2 A H1' rr_1nts 1
9 1 . 2 . 1 1 1 1 A H4' H . . 1 . 2 A H4' rr_1nts 1
10 1 . 1 . 1 1 1 1 A H3' H . . 1 . 2 A H3' rr_1nts 1
10 1 . 2 . 1 1 2 2 A H8 H . . 1 . 3 A H8 rr_1nts 1
11 1 . 1 . 2 2 3 3 PDU H6 H . . B . 3 PU H6 rr_1nts 1
11 1 . 2 . 2 2 3 3 PDU H1' H . . B . 3 PU H1' rr_1nts 1
12 1 . 1 . 1 1 2 2 A H8 H . . 1 . 3 A H8 rr_1nts 1
12 1 . 2 . 1 1 2 2 A H1' H . . 1 . 3 A H1' rr_1nts 1
13 1 . 1 . 1 1 2 2 A H1' H . . 1 . 3 A H1' rr_1nts 1
13 1 . 2 . 1 1 2 2 A H2' H . . 1 . 3 A H2' rr_1nts 1
14 1 . 1 . 2 2 3 3 PDU H1' H . . B . 3 PU H1' rr_1nts 1
14 1 . 2 . 2 2 3 3 PDU H3' H . . B . 3 PU H3' rr_1nts 1
15 1 . 1 . 2 2 3 3 PDU H1' H . . B . 3 PU H1' rr_1nts 1
15 1 . 2 . 2 2 3 3 PDU H4' H . . B . 3 PU H4' rr_1nts 1
16 1 . 1 . 1 1 2 2 A H1' H . . 1 . 3 A H1' rr_1nts 1
16 1 . 2 . 1 1 2 2 A H4' H . . 1 . 3 A H4' rr_1nts 1
17 1 . 1 . 2 2 3 3 PDU H1' H . . B . 3 PU H1' rr_1nts 1
17 1 . 2 . 2 2 4 4 5PC H6 H . . B . 4 PC H6 rr_1nts 1
18 1 . 1 . 1 1 2 2 A H1' H . . 1 . 3 A H1' rr_1nts 1
18 1 . 2 . 1 1 3 3 A H8 H . . 1 . 4 A H8 rr_1nts 1
19 1 . 1 . 2 2 3 3 PDU H3' H . . B . 3 PU H3' rr_1nts 1
19 1 . 2 . 2 2 3 3 PDU H6 H . . B . 3 PU H6 rr_1nts 1
20 1 . 1 . 1 1 3 3 A H2 H . . 1 . 4 A H2 rr_1nts 1
20 1 . 2 . 2 2 7 7 PDU H1' H . . B . 7 PU3' H1' rr_1nts 1
21 1 . 1 . 2 2 4 4 5PC H6 H . . B . 4 PC H6 rr_1nts 1
21 1 . 2 . 2 2 3 3 PDU H3' H . . B . 3 PU H3' rr_1nts 1
22 1 . 1 . 2 2 4 4 5PC H6 H . . B . 4 PC H6 rr_1nts 1
22 1 . 2 . 2 2 4 4 5PC H3' H . . B . 4 PC H3' rr_1nts 1
23 1 . 1 . 1 1 3 3 A H8 H . . 1 . 4 A H8 rr_1nts 1
23 1 . 2 . 1 1 2 2 A H2' H . . 1 . 3 A H2' rr_1nts 1
24 1 . 1 . 1 1 3 3 A H8 H . . 1 . 4 A H8 rr_1nts 1
24 1 . 2 . 1 1 3 3 A H1' H . . 1 . 4 A H1' rr_1nts 1
25 1 . 1 . 1 1 3 3 A H8 H . . 1 . 4 A H8 rr_1nts 1
25 1 . 2 . 1 1 3 3 A H2' H . . 1 . 4 A H2' rr_1nts 1
26 1 . 1 . 1 1 3 3 A H8 H . . 1 . 4 A H8 rr_1nts 1
26 1 . 2 . 1 1 3 3 A H3' H . . 1 . 4 A H3' rr_1nts 1
27 1 . 1 . 1 1 3 3 A H8 H . . 1 . 4 A H8 rr_1nts 1
27 1 . 2 . 1 1 3 3 A H4' H . . 1 . 4 A H4' rr_1nts 1
28 1 . 1 . 1 1 3 3 A H1' H . . 1 . 4 A H1' rr_1nts 1
28 1 . 2 . 1 1 2 2 A H2 H . . 1 . 3 A H2 rr_1nts 1
29 1 . 1 . 2 2 4 4 5PC H1' H . . B . 4 PC H1' rr_1nts 1
29 1 . 2 . 2 2 4 4 5PC H6 H . . B . 4 PC H6 rr_1nts 1
30 1 . 1 . 2 2 4 4 5PC H1' H . . B . 4 PC H1' rr_1nts 1
30 1 . 2 . 2 2 4 4 5PC H4' H . . B . 4 PC H4' rr_1nts 1
31 1 . 1 . 2 2 4 4 5PC H1' H . . B . 4 PC H1' rr_1nts 1
31 1 . 2 . 2 2 5 5 5PC H6 H . . B . 5 PC H6 rr_1nts 1
32 1 . 1 . 1 1 3 3 A H1' H . . 1 . 4 A H1' rr_1nts 1
32 1 . 2 . 1 1 4 4 G H8 H . . 1 . 5 G H8 rr_1nts 1
33 1 . 1 . 1 1 3 3 A H2' H . . 1 . 4 A H2' rr_1nts 1
33 1 . 2 . 1 1 3 3 A H1' H . . 1 . 4 A H1' rr_1nts 1
34 1 . 1 . 1 1 3 3 A H3' H . . 1 . 4 A H3' rr_1nts 1
34 1 . 2 . 1 1 3 3 A H1' H . . 1 . 4 A H1' rr_1nts 1
35 1 . 1 . 2 2 5 5 5PC H6 H . . B . 5 PC H6 rr_1nts 1
35 1 . 2 . 2 2 5 5 5PC H4' H . . B . 5 PC H4' rr_1nts 1
36 1 . 1 . 1 1 4 4 G H8 H . . 1 . 5 G H8 rr_1nts 1
36 1 . 2 . 1 1 3 3 A H2' H . . 1 . 4 A H2' rr_1nts 1
37 1 . 1 . 1 1 4 4 G H8 H . . 1 . 5 G H8 rr_1nts 1
37 1 . 2 . 1 1 3 3 A H3' H . . 1 . 4 A H3' rr_1nts 1
38 1 . 1 . 1 1 4 4 G H8 H . . 1 . 5 G H8 rr_1nts 1
38 1 . 2 . 1 1 4 4 G H1' H . . 1 . 5 G H1' rr_1nts 1
39 1 . 1 . 1 1 4 4 G H8 H . . 1 . 5 G H8 rr_1nts 1
39 1 . 2 . 1 1 4 4 G H2' H . . 1 . 5 G H2' rr_1nts 1
40 1 . 1 . 1 1 4 4 G H8 H . . 1 . 5 G H8 rr_1nts 1
40 1 . 2 . 1 1 4 4 G H3' H . . 1 . 5 G H3' rr_1nts 1
41 1 . 1 . 1 1 4 4 G H8 H . . 1 . 5 G H8 rr_1nts 1
41 1 . 2 . 1 1 4 4 G H4' H . . 1 . 5 G H4' rr_1nts 1
42 1 . 1 . 1 1 4 4 G H1' H . . 1 . 5 G H1' rr_1nts 1
42 1 . 2 . 1 1 3 3 A H2 H . . 1 . 4 A H2 rr_1nts 1
43 1 . 1 . 1 1 4 4 G H1' H . . 1 . 5 G H1' rr_1nts 1
43 1 . 2 . 1 1 3 3 A H2' H . . 1 . 4 A H2' rr_1nts 1
44 1 . 1 . 2 2 5 5 5PC H1' H . . B . 5 PC H1' rr_1nts 1
44 1 . 2 . 2 2 5 5 5PC H6 H . . B . 5 PC H6 rr_1nts 1
45 1 . 1 . 1 1 4 4 G H1' H . . 1 . 5 G H1' rr_1nts 1
45 1 . 2 . 1 1 4 4 G H3' H . . 1 . 5 G H3' rr_1nts 1
46 1 . 1 . 2 2 5 5 5PC H1' H . . B . 5 PC H1' rr_1nts 1
46 1 . 2 . 2 2 5 5 5PC H3' H . . B . 5 PC H3' rr_1nts 1
47 1 . 1 . 2 2 5 5 5PC H1' H . . B . 5 PC H1' rr_1nts 1
47 1 . 2 . 2 2 5 5 5PC H4' H . . B . 5 PC H4' rr_1nts 1
48 1 . 1 . 1 1 4 4 G H1' H . . 1 . 5 G H1' rr_1nts 1
48 1 . 2 . 1 1 4 4 G H4' H . . 1 . 5 G H4' rr_1nts 1
49 1 . 1 . 1 1 4 4 G H2' H . . 1 . 5 G H2' rr_1nts 1
49 1 . 2 . 1 1 4 4 G H1' H . . 1 . 5 G H1' rr_1nts 1
50 1 . 1 . 2 2 5 5 5PC H3' H . . B . 5 PC H3' rr_1nts 1
50 1 . 2 . 2 2 5 5 5PC H6 H . . B . 5 PC H6 rr_1nts 1
51 1 . 1 . 2 2 6 6 PDU H6 H . . B . 6 PU H6 rr_1nts 1
51 1 . 2 . 2 2 5 5 5PC H1' H . . B . 5 PC H1' rr_1nts 1
52 1 . 1 . 1 1 5 5 G H8 H . . 1 . 6 G H8 rr_1nts 1
52 1 . 2 . 1 1 4 4 G H1' H . . 1 . 5 G H1' rr_1nts 1
53 1 . 1 . 1 1 5 5 G H8 H . . 1 . 6 G H8 rr_1nts 1
53 1 . 2 . 1 1 4 4 G H2' H . . 1 . 5 G H2' rr_1nts 1
54 1 . 1 . 1 1 5 5 G H8 H . . 1 . 6 G H8 rr_1nts 1
54 1 . 2 . 1 1 4 4 G H3' H . . 1 . 5 G H3' rr_1nts 1
55 1 . 1 . 1 1 5 5 G H8 H . . 1 . 6 G H8 rr_1nts 1
55 1 . 2 . 1 1 5 5 G H1' H . . 1 . 6 G H1' rr_1nts 1
56 1 . 1 . 1 1 5 5 G H8 H . . 1 . 6 G H8 rr_1nts 1
56 1 . 2 . 1 1 5 5 G H2' H . . 1 . 6 G H2' rr_1nts 1
57 1 . 1 . 1 1 5 5 G H8 H . . 1 . 6 G H8 rr_1nts 1
57 1 . 2 . 1 1 5 5 G H3' H . . 1 . 6 G H3' rr_1nts 1
58 1 . 1 . 1 1 5 5 G H8 H . . 1 . 6 G H8 rr_1nts 1
58 1 . 2 . 1 1 5 5 G H4' H . . 1 . 6 G H4' rr_1nts 1
59 1 . 1 . 1 1 5 5 G H1' H . . 1 . 6 G H1' rr_1nts 1
59 1 . 2 . 1 1 4 4 G H2' H . . 1 . 5 G H2' rr_1nts 1
60 1 . 1 . 2 2 6 6 PDU H1' H . . B . 6 PU H1' rr_1nts 1
60 1 . 2 . 2 2 6 6 PDU H6 H . . B . 6 PU H6 rr_1nts 1
61 1 . 1 . 1 1 5 5 G H1' H . . 1 . 6 G H1' rr_1nts 1
61 1 . 2 . 1 1 5 5 G H2' H . . 1 . 6 G H2' rr_1nts 1
62 1 . 1 . 1 1 5 5 G H1' H . . 1 . 6 G H1' rr_1nts 1
62 1 . 2 . 1 1 5 5 G H3' H . . 1 . 6 G H3' rr_1nts 1
63 1 . 1 . 2 2 6 6 PDU H1' H . . B . 6 PU H1' rr_1nts 1
63 1 . 2 . 2 2 6 6 PDU H3' H . . B . 6 PU H3' rr_1nts 1
64 1 . 1 . 1 1 5 5 G H1' H . . 1 . 6 G H1' rr_1nts 1
64 1 . 2 . 1 1 5 5 G H4' H . . 1 . 6 G H4' rr_1nts 1
65 1 . 1 . 2 2 6 6 PDU H1' H . . B . 6 PU H1' rr_1nts 1
65 1 . 2 . 2 2 6 6 PDU H4' H . . B . 6 PU H4' rr_1nts 1
66 1 . 1 . 2 2 6 6 PDU H1' H . . B . 6 PU H1' rr_1nts 1
66 1 . 2 . 2 2 7 7 PDU H6 H . . B . 7 PU3' H6 rr_1nts 1
67 1 . 1 . 1 1 5 5 G H1' H . . 1 . 6 G H1' rr_1nts 1
67 1 . 2 . 1 1 6 6 A H8 H . . 1 . 7 A H8 rr_1nts 1
68 1 . 1 . 2 2 6 6 PDU H3' H . . B . 6 PU H3' rr_1nts 1
68 1 . 2 . 2 2 6 6 PDU H6 H . . B . 6 PU H6 rr_1nts 1
69 1 . 1 . 1 1 6 6 A H2 H . . 1 . 7 A H2 rr_1nts 1
69 1 . 2 . 2 2 4 4 5PC H1' H . . B . 4 PC H1' rr_1nts 1
70 1 . 1 . 2 2 7 7 PDU H6 H . . B . 7 PU3' H6 rr_1nts 1
70 1 . 2 . 2 2 6 6 PDU H3' H . . B . 6 PU H3' rr_1nts 1
71 1 . 1 . 2 2 7 7 PDU H6 H . . B . 7 PU3' H6 rr_1nts 1
71 1 . 2 . 2 2 7 7 PDU H4' H . . B . 7 PU3' H4' rr_1nts 1
72 1 . 1 . 1 1 6 6 A H8 H . . 1 . 7 A H8 rr_1nts 1
72 1 . 2 . 1 1 5 5 G H2' H . . 1 . 6 G H2' rr_1nts 1
73 1 . 1 . 1 1 6 6 A H8 H . . 1 . 7 A H8 rr_1nts 1
73 1 . 2 . 1 1 5 5 G H3' H . . 1 . 6 G H3' rr_1nts 1
74 1 . 1 . 1 1 6 6 A H8 H . . 1 . 7 A H8 rr_1nts 1
74 1 . 2 . 1 1 6 6 A H1' H . . 1 . 7 A H1' rr_1nts 1
75 1 . 1 . 1 1 6 6 A H8 H . . 1 . 7 A H8 rr_1nts 1
75 1 . 2 . 1 1 6 6 A H4' H . . 1 . 7 A H4' rr_1nts 1
76 1 . 1 . 1 1 6 6 A H1' H . . 1 . 7 A H1' rr_1nts 1
76 1 . 2 . 1 1 6 6 A H4' H . . 1 . 7 A H4' rr_1nts 1
77 1 . 1 . 1 1 6 6 A H1' H . . 1 . 7 A H1' rr_1nts 1
77 1 . 2 . 1 1 5 5 G H2' H . . 1 . 6 G H2' rr_1nts 1
78 1 . 1 . 2 2 7 7 PDU H1' H . . B . 7 PU3' H1' rr_1nts 1
78 1 . 2 . 2 2 7 7 PDU H6 H . . B . 7 PU3' H6 rr_1nts 1
79 1 . 1 . 1 1 6 6 A H1' H . . 1 . 7 A H1' rr_1nts 1
79 1 . 2 . 1 1 6 6 A H2' H . . 1 . 7 A H2' rr_1nts 1
80 1 . 1 . 1 1 6 6 A H1' H . . 1 . 7 A H1' rr_1nts 1
80 1 . 2 . 1 1 6 6 A H3' H . . 1 . 7 A H3' rr_1nts 1
81 1 . 1 . 2 2 7 7 PDU H1' H . . B . 7 PU3' H1' rr_1nts 1
81 1 . 2 . 2 2 7 7 PDU H4' H . . B . 7 PU3' H4' rr_1nts 1
82 1 . 1 . 1 1 6 6 A H1' H . . 1 . 7 A H1' rr_1nts 1
82 1 . 2 . 1 1 7 7 G H8 H . . 1 . 8 G H8 rr_1nts 1
83 1 . 1 . 2 2 7 7 PDU H3' H . . B . 7 PU3' H3' rr_1nts 1
83 1 . 2 . 2 2 7 7 PDU H6 H . . B . 7 PU3' H6 rr_1nts 1
84 1 . 1 . 1 1 6 6 A H3' H . . 1 . 7 A H3' rr_1nts 1
84 1 . 2 . 1 1 6 6 A H8 H . . 1 . 7 A H8 rr_1nts 1
85 1 . 1 . 1 1 7 7 G H8 H . . 1 . 8 G H8 rr_1nts 1
85 1 . 2 . 1 1 6 6 A H2' H . . 1 . 7 A H2' rr_1nts 1
86 1 . 1 . 1 1 7 7 G H8 H . . 1 . 8 G H8 rr_1nts 1
86 1 . 2 . 1 1 6 6 A H3' H . . 1 . 7 A H3' rr_1nts 1
87 1 . 1 . 1 1 7 7 G H8 H . . 1 . 8 G H8 rr_1nts 1
87 1 . 2 . 1 1 7 7 G H1' H . . 1 . 8 G H1' rr_1nts 1
88 1 . 1 . 1 1 7 7 G H8 H . . 1 . 8 G H8 rr_1nts 1
88 1 . 2 . 1 1 7 7 G H2' H . . 1 . 8 G H2' rr_1nts 1
89 1 . 1 . 1 1 7 7 G H8 H . . 1 . 8 G H8 rr_1nts 1
89 1 . 2 . 1 1 7 7 G H3' H . . 1 . 8 G H3' rr_1nts 1
90 1 . 1 . 1 1 7 7 G H1' H . . 1 . 8 G H1' rr_1nts 1
90 1 . 2 . 1 1 6 6 A H2 H . . 1 . 7 A H2 rr_1nts 1
91 1 . 1 . 1 1 7 7 G H1' H . . 1 . 8 G H1' rr_1nts 1
91 1 . 2 . 1 1 7 7 G H4' H . . 1 . 8 G H4' rr_1nts 1
92 1 . 1 . 1 1 7 7 G H2' H . . 1 . 8 G H2' rr_1nts 1
92 1 . 2 . 1 1 7 7 G H1' H . . 1 . 8 G H1' rr_1nts 1
93 1 . 1 . 1 1 8 8 G H8 H . . 1 . 9 G H8 rr_1nts 1
93 1 . 2 . 1 1 7 7 G H1' H . . 1 . 8 G H1' rr_1nts 1
94 1 . 1 . 1 1 8 8 G H8 H . . 1 . 9 G H8 rr_1nts 1
94 1 . 2 . 1 1 7 7 G H2' H . . 1 . 8 G H2' rr_1nts 1
95 1 . 1 . 1 1 8 8 G H8 H . . 1 . 9 G H8 rr_1nts 1
95 1 . 2 . 1 1 7 7 G H3' H . . 1 . 8 G H3' rr_1nts 1
96 1 . 1 . 1 1 8 8 G H8 H . . 1 . 9 G H8 rr_1nts 1
96 1 . 2 . 1 1 8 8 G H3' H . . 1 . 9 G H3' rr_1nts 1
97 1 . 1 . 1 1 8 8 G H8 H . . 1 . 9 G H8 rr_1nts 1
97 1 . 2 . 1 1 8 8 G H4' H . . 1 . 9 G H4' rr_1nts 1
98 1 . 1 . 1 1 8 8 G H1' H . . 1 . 9 G H1' rr_1nts 1
98 1 . 2 . 1 1 8 8 G H8 H . . 1 . 9 G H8 rr_1nts 1
99 1 . 1 . 1 1 8 8 G H1' H . . 1 . 9 G H1' rr_1nts 1
99 1 . 2 . 1 1 8 8 G H3' H . . 1 . 9 G H3' rr_1nts 1
100 1 . 1 . 1 1 8 8 G H1' H . . 1 . 9 G H1' rr_1nts 1
100 1 . 2 . 1 1 8 8 G H4' H . . 1 . 9 G H4' rr_1nts 1
101 1 . 1 . 1 1 8 8 G H1' H . . 1 . 9 G H1' rr_1nts 1
101 1 . 2 . 1 1 9 9 A H8 H . . 1 . 10 A H8 rr_1nts 1
102 1 . 1 . 1 1 8 8 G H2' H . . 1 . 9 G H2' rr_1nts 1
102 1 . 2 . 1 1 8 8 G H1' H . . 1 . 9 G H1' rr_1nts 1
103 1 . 1 . 1 1 8 8 G H2' H . . 1 . 9 G H2' rr_1nts 1
103 1 . 2 . 1 1 9 9 A H8 H . . 1 . 10 A H8 rr_1nts 1
104 1 . 1 . 1 1 8 8 G H3' H . . 1 . 9 G H3' rr_1nts 1
104 1 . 2 . 1 1 9 9 A H8 H . . 1 . 10 A H8 rr_1nts 1
105 1 . 1 . 1 1 9 9 A H8 H . . 1 . 10 A H8 rr_1nts 1
105 1 . 2 . 1 1 9 9 A H1' H . . 1 . 10 A H1' rr_1nts 1
106 1 . 1 . 1 1 9 9 A H8 H . . 1 . 10 A H8 rr_1nts 1
106 1 . 2 . 1 1 9 9 A H3' H . . 1 . 10 A H3' rr_1nts 1
107 1 . 1 . 1 1 9 9 A H1' H . . 1 . 10 A H1' rr_1nts 1
107 1 . 2 . 1 1 9 9 A H3' H . . 1 . 10 A H3' rr_1nts 1
108 1 . 1 . 1 1 9 9 A H2' H . . 1 . 10 A H2' rr_1nts 1
108 1 . 2 . 1 1 9 9 A H1' H . . 1 . 10 A H1' rr_1nts 1
109 1 . 1 . 1 1 2 2 A H8 H . . 1 . 3 A H8 rr_1nts 1
109 1 . 2 . 1 1 1 1 A H2' H . . 1 . 2 A H2' rr_1nts 1
110 1 . 1 . 1 1 2 2 A H8 H . . 1 . 3 A H8 rr_1nts 1
110 1 . 2 . 1 1 2 2 A H3' H . . 1 . 3 A H3' rr_1nts 1
111 1 . 1 . 1 1 6 6 A H8 H . . 1 . 7 A H8 rr_1nts 1
111 1 . 2 . 1 1 5 5 G H1' H . . 1 . 6 G H1' rr_1nts 1
112 1 . 1 . 1 1 7 7 G H8 H . . 1 . 8 G H8 rr_1nts 1
112 1 . 2 . 1 1 7 7 G H4' H . . 1 . 8 G H4' rr_1nts 1
113 1 . 1 . 1 1 8 8 G H1' H . . 1 . 9 G H1' rr_1nts 1
113 1 . 2 . 1 1 7 7 G H2' H . . 1 . 8 G H2' rr_1nts 1
114 1 . 1 . 1 1 8 8 G H8 H . . 1 . 9 G H8 rr_1nts 1
114 1 . 2 . 1 1 7 7 G H3' H . . 1 . 8 G H3' rr_1nts 1
115 1 . 1 . 2 2 2 2 5PC H1' H . . B . 2 PC H1' rr_1nts 1
115 1 . 2 . 2 2 3 3 PDU H6 H . . B . 3 PU H6 rr_1nts 1
116 1 . 1 . 2 2 2 2 5PC H6 H . . B . 2 PC H6 rr_1nts 1
116 1 . 2 . 2 2 2 2 5PC H1' H . . B . 2 PC H1' rr_1nts 1
117 1 . 1 . 2 2 5 5 5PC H3' H . . B . 5 PC H3' rr_1nts 1
117 1 . 2 . 2 2 6 6 PDU H6 H . . B . 6 PU H6 rr_1nts 1
118 1 . 1 . 2 2 6 6 PDU H6 H . . B . 6 PU H6 rr_1nts 1
118 1 . 2 . 2 2 6 6 PDU H4' H . . B . 6 PU H4' rr_1nts 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 . . . . . . . 2.296 4.263 rr_1nts 1
2 1 . . . . . . . 2.917 5.417 rr_1nts 1
3 1 . . . . . . . 2.924 5.430 rr_1nts 1
4 1 . . . . . . . 1.778 3.302 rr_1nts 1
5 1 . . . . . . . 2.211 4.107 rr_1nts 1
6 1 . . . . . . . 2.636 4.895 rr_1nts 1
7 1 . . . . . . . 2.160 4.012 rr_1nts 1
8 1 . . . . . . . 2.988 5.549 rr_1nts 1
9 1 . . . . . . . 2.788 5.177 rr_1nts 1
10 1 . . . . . . . 2.351 4.366 rr_1nts 1
11 1 . . . . . . . 2.556 4.747 rr_1nts 1
12 1 . . . . . . . 2.965 5.506 rr_1nts 1
13 1 . . . . . . . 2.093 3.887 rr_1nts 1
14 1 . . . . . . . 2.800 5.201 rr_1nts 1
15 1 . . . . . . . 2.459 4.567 rr_1nts 1
16 1 . . . . . . . 2.489 4.623 rr_1nts 1
17 1 . . . . . . . 2.866 5.322 rr_1nts 1
18 1 . . . . . . . 2.545 4.726 rr_1nts 1
19 1 . . . . . . . 2.213 4.111 rr_1nts 1
20 1 . . . . . . . 2.667 4.954 rr_1nts 1
21 1 . . . . . . . 2.486 4.616 rr_1nts 1
22 1 . . . . . . . 2.546 4.728 rr_1nts 1
23 1 . . . . . . . 1.728 3.209 rr_1nts 1
24 1 . . . . . . . 2.715 5.041 rr_1nts 1
25 1 . . . . . . . 2.674 4.965 rr_1nts 1
26 1 . . . . . . . 1.809 3.359 rr_1nts 1
27 1 . . . . . . . 2.718 5.048 rr_1nts 1
28 1 . . . . . . . 2.109 3.916 rr_1nts 1
29 1 . . . . . . . 2.952 5.483 rr_1nts 1
30 1 . . . . . . . 2.670 4.959 rr_1nts 1
31 1 . . . . . . . 3.020 5.608 rr_1nts 1
32 1 . . . . . . . 3.343 6.000 rr_1nts 1
33 1 . . . . . . . 1.747 3.245 rr_1nts 1
34 1 . . . . . . . 2.514 4.669 rr_1nts 1
35 1 . . . . . . . 2.724 5.059 rr_1nts 1
36 1 . . . . . . . 1.631 3.030 rr_1nts 1
37 1 . . . . . . . 2.280 4.234 rr_1nts 1
38 1 . . . . . . . 2.685 4.986 rr_1nts 1
39 1 . . . . . . . 2.402 4.461 rr_1nts 1
40 1 . . . . . . . 1.917 3.560 rr_1nts 1
41 1 . . . . . . . 2.315 4.299 rr_1nts 1
42 1 . . . . . . . 2.298 4.268 rr_1nts 1
43 1 . . . . . . . 2.710 5.033 rr_1nts 1
44 1 . . . . . . . 2.681 4.978 rr_1nts 1
45 1 . . . . . . . 2.546 4.729 rr_1nts 1
46 1 . . . . . . . 3.036 5.639 rr_1nts 1
47 1 . . . . . . . 2.211 4.107 rr_1nts 1
48 1 . . . . . . . 2.296 4.263 rr_1nts 1
49 1 . . . . . . . 1.740 3.232 rr_1nts 1
50 1 . . . . . . . 1.979 3.676 rr_1nts 1
51 1 . . . . . . . 2.237 4.154 rr_1nts 1
52 1 . . . . . . . 2.876 5.341 rr_1nts 1
53 1 . . . . . . . 1.652 3.068 rr_1nts 1
54 1 . . . . . . . 1.873 3.479 rr_1nts 1
55 1 . . . . . . . 2.682 4.981 rr_1nts 1
56 1 . . . . . . . 2.413 4.481 rr_1nts 1
57 1 . . . . . . . 1.903 3.534 rr_1nts 1
58 1 . . . . . . . 2.413 4.481 rr_1nts 1
59 1 . . . . . . . 2.439 4.530 rr_1nts 1
60 1 . . . . . . . 2.787 5.175 rr_1nts 1
61 1 . . . . . . . 1.839 3.415 rr_1nts 1
62 1 . . . . . . . 2.421 4.496 rr_1nts 1
63 1 . . . . . . . 2.884 5.355 rr_1nts 1
64 1 . . . . . . . 2.460 4.569 rr_1nts 1
65 1 . . . . . . . 2.699 5.013 rr_1nts 1
66 1 . . . . . . . 3.553 6.000 rr_1nts 1
67 1 . . . . . . . 3.350 6.000 rr_1nts 1
68 1 . . . . . . . 2.631 4.886 rr_1nts 1
69 1 . . . . . . . 2.312 4.294 rr_1nts 1
70 1 . . . . . . . 2.840 5.274 rr_1nts 1
71 1 . . . . . . . 3.168 5.884 rr_1nts 1
72 1 . . . . . . . 1.679 3.118 rr_1nts 1
73 1 . . . . . . . 2.464 4.575 rr_1nts 1
74 1 . . . . . . . 3.029 5.625 rr_1nts 1
75 1 . . . . . . . 3.373 6.000 rr_1nts 1
76 1 . . . . . . . 2.729 5.068 rr_1nts 1
77 1 . . . . . . . 3.536 6.000 rr_1nts 1
78 1 . . . . . . . 2.504 4.650 rr_1nts 1
79 1 . . . . . . . 2.083 3.869 rr_1nts 1
80 1 . . . . . . . 2.560 4.755 rr_1nts 1
81 1 . . . . . . . 2.840 5.274 rr_1nts 1
82 1 . . . . . . . 3.200 5.942 rr_1nts 1
83 1 . . . . . . . 1.970 3.659 rr_1nts 1
84 1 . . . . . . . 2.296 4.263 rr_1nts 1
85 1 . . . . . . . 1.703 3.162 rr_1nts 1
86 1 . . . . . . . 3.016 5.601 rr_1nts 1
87 1 . . . . . . . 3.222 5.984 rr_1nts 1
88 1 . . . . . . . 2.395 4.447 rr_1nts 1
89 1 . . . . . . . 2.109 3.916 rr_1nts 1
90 1 . . . . . . . 1.999 3.712 rr_1nts 1
91 1 . . . . . . . 2.425 4.503 rr_1nts 1
92 1 . . . . . . . 1.740 3.231 rr_1nts 1
93 1 . . . . . . . 3.138 5.829 rr_1nts 1
94 1 . . . . . . . 1.627 3.021 rr_1nts 1
95 1 . . . . . . . 2.592 4.814 rr_1nts 1
96 1 . . . . . . . 1.971 3.660 rr_1nts 1
97 1 . . . . . . . 2.233 4.146 rr_1nts 1
98 1 . . . . . . . 2.992 5.556 rr_1nts 1
99 1 . . . . . . . 2.504 4.651 rr_1nts 1
100 1 . . . . . . . 2.318 4.304 rr_1nts 1
101 1 . . . . . . . 3.155 5.860 rr_1nts 1
102 1 . . . . . . . 1.706 3.168 rr_1nts 1
103 1 . . . . . . . 1.719 3.192 rr_1nts 1
104 1 . . . . . . . 1.887 3.504 rr_1nts 1
105 1 . . . . . . . 2.992 5.556 rr_1nts 1
106 1 . . . . . . . 1.919 3.564 rr_1nts 1
107 1 . . . . . . . 3.014 5.598 rr_1nts 1
108 1 . . . . . . . 1.786 3.317 rr_1nts 1
109 1 . . . . . . . 0.000 5.000 rr_1nts 1
110 1 . . . . . . . 0.000 5.000 rr_1nts 1
111 1 . . . . . . . 3.350 6.000 rr_1nts 1
112 1 . . . . . . . 0.000 5.000 rr_1nts 1
113 1 . . . . . . . 0.000 5.000 rr_1nts 1
114 1 . . . . . . . 0.000 5.000 rr_1nts 1
115 1 . . . . . . . 0.000 5.000 rr_1nts 1
116 1 . . . . . . . 0.000 5.000 rr_1nts 1
117 1 . . . . . . . 0.000 5.000 rr_1nts 1
118 1 . . . . . . . 0.000 5.000 rr_1nts 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 "************ STRANDS 1 & 2 TOGETHER" 1 1 5 1 rr_1nts 1
2 "2.480 0.30/0.30:" 6 82 6 107 rr_1nts 1
3 "3.540 0.30/0.30:" 7 82 7 107 rr_1nts 1
4 "2.138 0.30/0.30:" 8 82 8 107 rr_1nts 1
5 "3.279 0.30/0.30:" 9 82 9 107 rr_1nts 1
6 "4.167 0.30/0.30:" 10 82 10 107 rr_1nts 1
7 "4.177 0.30/0.30:" 11 82 11 107 rr_1nts 1
8 "2.540 0.30/0.30:" 12 82 12 107 rr_1nts 1
9 "2.980 0.30/0.30:" 13 82 13 107 rr_1nts 1
10 "3.159 0.30/0.30:" 14 82 14 107 rr_1nts 1
11 "3.766 0.30/0.30:" 15 82 15 107 rr_1nts 1
12 "2.816 0.30/0.30:" 16 82 16 107 rr_1nts 1
13 "2.092 0.30/0.30:" 17 82 17 107 rr_1nts 1
14 "3.086 0.30/0.30:" 18 82 18 107 rr_1nts 1
15 "4.269 0.30/0.30:" 19 82 19 107 rr_1nts 1
16 "3.982 0.30/0.30:" 20 82 20 107 rr_1nts 1
17 "3.358 0.30/0.30:" 21 82 21 107 rr_1nts 1
18 "2.751 0.30/0.30:" 22 82 22 107 rr_1nts 1
19 "2.234 0.30/0.30:" 23 82 23 107 rr_1nts 1
20 "3.652 0.30/0.30:" 24 82 24 107 rr_1nts 1
21 "3.104 0.30/0.30:" 25 82 25 107 rr_1nts 1
22 "4.236 0.30/0.30:" 26 82 26 107 rr_1nts 1
23 "2.990 0.30/0.30:" 27 82 27 107 rr_1nts 1
24 "2.096 0.30/0.30:" 28 82 28 107 rr_1nts 1
25 "2.790 0.30/0.30:" 29 82 29 107 rr_1nts 1
26 "4.000 0.30/0.30:" 30 82 30 107 rr_1nts 1
27 "3.513 0.30/0.30:" 31 82 31 107 rr_1nts 1
28 "3.556 0.30/0.30:" 32 82 32 107 rr_1nts 1
29 "4.094 0.30/0.30:" 33 82 33 107 rr_1nts 1
30 "3.635 0.30/0.30:" 34 82 34 107 rr_1nts 1
31 "3.162 0.30/0.30:" 35 82 35 107 rr_1nts 1
32 "3.811 0.30/0.30:" 36 82 36 107 rr_1nts 1
33 "3.643 0.30/0.30:" 37 82 37 107 rr_1nts 1
34 "2.494 0.30/0.30:" 38 82 38 107 rr_1nts 1
35 "2.469 0.30/0.30:" 39 82 39 107 rr_1nts 1
36 "3.551 0.30/0.30:" 40 82 40 107 rr_1nts 1
37 "3.637 0.30/0.30:" 41 82 41 107 rr_1nts 1
38 "3.416 0.30/0.30:" 42 82 42 107 rr_1nts 1
39 "2.468 0.30/0.30:" 43 82 43 107 rr_1nts 1
40 "3.878 0.30/0.30:" 44 82 44 107 rr_1nts 1
41 "3.819 0.30/0.30:" 45 82 45 107 rr_1nts 1
42 "2.584 0.30/0.30:" 46 82 46 107 rr_1nts 1
43 "3.883 0.30/0.30:" 47 82 47 107 rr_1nts 1
44 "3.012 0.30/0.30:" 48 82 48 107 rr_1nts 1
45 "4.218 0.30/0.30:" 49 82 49 107 rr_1nts 1
46 "2.727 0.30/0.30:" 50 82 50 107 rr_1nts 1
47 "2.413 0.30/0.30:" 51 82 51 107 rr_1nts 1
48 "3.815 0.30/0.30:" 52 82 52 107 rr_1nts 1
49 "4.314 0.30/0.30:" 53 82 53 107 rr_1nts 1
50 "4.775 0.30/0.30:" 54 82 54 107 rr_1nts 1
51 "2.496 0.30/0.30:" 55 82 55 107 rr_1nts 1
52 "3.591 0.30/0.30:" 56 82 56 107 rr_1nts 1
53 "3.239 0.30/0.30:" 57 82 57 107 rr_1nts 1
54 "2.109 0.30/0.30:" 58 82 58 107 rr_1nts 1
55 "3.892 0.30/0.30:" 59 82 59 107 rr_1nts 1
56 "2.976 0.30/0.30:" 60 82 60 107 rr_1nts 1
57 "2.331 0.30/0.30:" 61 82 61 107 rr_1nts 1
58 "3.257 0.30/0.30:" 62 82 62 107 rr_1nts 1
59 "3.835 0.30/0.30:" 63 82 63 107 rr_1nts 1
60 "3.431 0.30/0.30:" 64 82 64 107 rr_1nts 1
61 "2.738 0.30/0.30:" 65 82 65 107 rr_1nts 1
62 "3.307 0.30/0.30:" 66 82 66 107 rr_1nts 1
63 "3.283 0.30/0.30:" 67 82 67 107 rr_1nts 1
64 "3.872 0.30/0.30:" 68 82 68 107 rr_1nts 1
65 "3.830 0.30/0.30:" 69 82 69 107 rr_1nts 1
66 "2.345 0.30/0.30:" 70 82 70 107 rr_1nts 1
67 "3.637 0.30/0.30:" 71 82 71 107 rr_1nts 1
68 "4.338 0.30/0.30:" 72 82 72 107 rr_1nts 1
69 "3.159 0.30/0.30:" 73 82 73 107 rr_1nts 1
70 "3.279 0.30/0.30:" 74 82 74 107 rr_1nts 1
71 "2.486 0.30/0.30:" 75 82 75 107 rr_1nts 1
72 "2.828 0.30/0.30:" 76 82 76 107 rr_1nts 1
73 "2.907 0.30/0.30:" 77 82 77 107 rr_1nts 1
74 "3.196 0.30/0.30:" 78 82 78 107 rr_1nts 1
75 "2.175 0.30/0.30:" 79 82 79 107 rr_1nts 1
76 "2.371 0.30/0.30:" 80 82 80 107 rr_1nts 1
77 "3.421 0.30/0.30:" 81 82 81 107 rr_1nts 1
78 "4.108 0.30/0.30:" 82 82 82 107 rr_1nts 1
79 "2.360 0.30/0.30:" 83 82 83 107 rr_1nts 1
80 "2.676 0.30/0.30:" 84 82 84 107 rr_1nts 1
81 "3.832 0.30/0.30:" 85 82 85 107 rr_1nts 1
82 "3.447 0.30/0.30:" 86 82 86 107 rr_1nts 1
83 "2.718 0.30/0.30:" 87 82 87 107 rr_1nts 1
84 "3.447 0.30/0.30:" 88 82 88 107 rr_1nts 1
85 "3.485 0.30/0.30:" 89 82 89 107 rr_1nts 1
86 "3.981 0.30/0.30:" 90 82 90 107 rr_1nts 1
87 "2.627 0.30/0.30:" 91 82 91 107 rr_1nts 1
88 "2.398 0.30/0.30:" 92 82 92 107 rr_1nts 1
89 "2.793 0.30/0.30:" 93 82 93 107 rr_1nts 1
90 "3.458 0.30/0.30:" 94 82 94 107 rr_1nts 1
91 "4.119 0.30/0.30:" 95 82 95 107 rr_1nts 1
92 "3.514 0.30/0.30:" 96 82 96 107 rr_1nts 1
93 "3.856 0.30/0.30:" 97 82 97 107 rr_1nts 1
94 "5.076 0.30/0.30:" 98 82 98 107 rr_1nts 1
95 "4.786 0.30/0.30:" 99 82 99 107 rr_1nts 1
96 "3.759 0.30/0.30:" 100 82 100 107 rr_1nts 1
97 "3.303 0.30/0.30:" 101 82 101 107 rr_1nts 1
98 "3.008 0.30/0.30:" 102 82 102 107 rr_1nts 1
99 "2.581 0.30/0.30:" 103 82 103 107 rr_1nts 1
100 "1.909 0.30/0.30:" 104 82 104 107 rr_1nts 1
101 "4.057 0.30/0.30:" 105 82 105 107 rr_1nts 1
102 "4.526 0.30/0.30:" 106 82 106 107 rr_1nts 1
103 "2.399 0.30/0.30:" 107 82 107 107 rr_1nts 1
104 "3.519 0.30/0.30:" 108 82 108 107 rr_1nts 1
105 "4.327 0.30/0.30:" 109 82 109 107 rr_1nts 1
106 "4.819 0.30/0.30:" 110 82 110 107 rr_1nts 1
107 "3.898 0.30/0.30:" 111 82 111 107 rr_1nts 1
108 "5.052 0.30/0.30:" 112 82 112 107 rr_1nts 1
109 "3.577 0.30/0.30:" 113 82 113 107 rr_1nts 1
110 "2.976 0.30/0.30:" 114 82 114 107 rr_1nts 1
111 "2.086 0.30/0.30:" 115 82 115 107 rr_1nts 1
112 "3.658 0.30/0.30:" 116 82 116 107 rr_1nts 1
113 "4.057 0.30/0.30:" 117 82 117 107 rr_1nts 1
114 "4.571 0.30/0.30:" 118 82 118 107 rr_1nts 1
115 "2.814 0.30/0.30:" 119 82 119 107 rr_1nts 1
116 "3.279 0.30/0.30:" 120 82 120 107 rr_1nts 1
117 "2.432 0.30/0.30:" 121 82 121 107 rr_1nts 1
118 "4.309 0.30/0.30:" 122 82 122 107 rr_1nts 1
119 "4.603 0.30/0.30:" 123 82 123 107 rr_1nts 1
120 "3.421 0.30/0.30:" 124 82 124 107 rr_1nts 1
121 "3.012 0.30/0.30:" 125 82 125 107 rr_1nts 1
122 "2.856 0.30/0.30:" 126 82 126 107 rr_1nts 1
123 "3.464 0.30/0.30:" 127 82 127 107 rr_1nts 1
124 "2.485 0.30/0.30:" 128 82 128 107 rr_1nts 1
125 "4.483 0.30/0.30:" 129 82 129 107 rr_1nts 1
126 "2.324 0.30/0.30:" 130 82 130 107 rr_1nts 1
127 "3.703 0.30/0.30:" 131 82 131 107 rr_1nts 1
128 "2.816 0.30/0.30:" 132 82 132 107 rr_1nts 1
129 "3.189 0.30/0.30:" 133 82 133 107 rr_1nts 1
130 "4.274 0.30/0.30:" 134 82 134 107 rr_1nts 1
131 "3.578 0.30/0.30:" 135 82 135 107 rr_1nts 1
132 "3.311 0.30/0.30:" 136 82 136 107 rr_1nts 1
133 "4.508 0.30/0.30:" 137 82 137 107 rr_1nts 1
134 "2.437 0.30/0.30:" 138 82 138 107 rr_1nts 1
135 "2.456 0.30/0.30:" 139 82 139 107 rr_1nts 1
136 "2.695 0.30/0.30:" 140 82 140 107 rr_1nts 1
137 "4.274 0.30/0.30:" 141 82 141 107 rr_1nts 1
138 "2.741 0.30/0.30:" 142 82 142 107 rr_1nts 1
139 "4.306 0.30/0.30:" 143 82 143 107 rr_1nts 1
140 "2.551 0.30/0.30:" 144 82 144 107 rr_1nts 1
141 "4.786 0.30/0.30" 147 82 147 100 rr_1nts 1
142 "2.388 0.30/0.30" 154 82 154 100 rr_1nts 1
stop_
loop_
_Dist_constraint_conv_err.ID
_Dist_constraint_conv_err.Dist_constraint_parse_file_ID
_Dist_constraint_conv_err.Parse_file_constraint_ID
_Dist_constraint_conv_err.Conv_error_type
_Dist_constraint_conv_err.Conv_error_note
_Dist_constraint_conv_err.Entry_ID
_Dist_constraint_conv_err.Distance_constraint_list_ID
1 3 1 1 "Not handling restraint 1, item 1, resonance(s) 'B.1.H5' (nmrStar names) not linked" rr_1nts 1
2 3 2 1 "Not handling restraint 2, item 1, resonance(s) 'B.2.H5M2' (nmrStar names) not linked" rr_1nts 1
3 3 3 1 "Not handling restraint 3, item 1, resonance(s) 'B.1.H2'2' (nmrStar names) not linked" rr_1nts 1
4 3 8 1 "Not handling restraint 8, item 1, resonance(s) 'B.3.H5M2' (nmrStar names) not linked" rr_1nts 1
5 3 11 1 "Not handling restraint 11, item 1, resonance(s) 'B.2.H2'1' (nmrStar names) not linked" rr_1nts 1
6 3 12 1 "Not handling restraint 12, item 1, resonance(s) 'B.2.H2'2' (nmrStar names) not linked" rr_1nts 1
7 3 17 1 "Not handling restraint 17, item 1, resonance(s) 'B.3.H5M2' (nmrStar names) not linked" rr_1nts 1
8 3 18 1 "Not handling restraint 18, item 1, resonance(s) 'B.2.H2'2' (nmrStar names) not linked" rr_1nts 1
9 3 20 1 "Not handling restraint 20, item 1, resonance(s) 'B.4.H5M2' (nmrStar names) not linked" rr_1nts 1
10 3 23 1 "Not handling restraint 23, item 1, resonance(s) 'B.3.H2'2' (nmrStar names) not linked" rr_1nts 1
11 3 24 1 "Not handling restraint 24, item 1, resonance(s) 'B.3.H2'1' (nmrStar names) not linked" rr_1nts 1
12 3 32 1 "Not handling restraint 32, item 1, resonance(s) 'B.4.H5M2' (nmrStar names) not linked" rr_1nts 1
13 3 33 1 "Not handling restraint 33, item 1, resonance(s) 'B.3.H2'1' (nmrStar names) not linked" rr_1nts 1
14 3 34 1 "Not handling restraint 34, item 1, resonance(s) 'B.3.H2'2' (nmrStar names) not linked" rr_1nts 1
15 3 37 1 "Not handling restraint 37, item 1, resonance(s) 'B.5.H5M2' (nmrStar names) not linked" rr_1nts 1
16 3 45 1 "Not handling restraint 45, item 1, resonance(s) 'B.4.H2'1' (nmrStar names) not linked" rr_1nts 1
17 3 46 1 "Not handling restraint 46, item 1, resonance(s) 'B.4.H2'2' (nmrStar names) not linked" rr_1nts 1
18 3 52 1 "Not handling restraint 52, item 1, resonance(s) 'B.5.H5M2' (nmrStar names) not linked" rr_1nts 1
19 3 53 1 "Not handling restraint 53, item 1, resonance(s) 'B.4.H2'1' (nmrStar names) not linked" rr_1nts 1
20 3 55 1 "Not handling restraint 55, item 1, resonance(s) 'B.6.H5M2' (nmrStar names) not linked" rr_1nts 1
21 3 65 1 "Not handling restraint 65, item 1, resonance(s) 'B.5.H2'2' (nmrStar names) not linked" rr_1nts 1
22 3 72 1 "Not handling restraint 72, item 1, resonance(s) 'B.6.H5M2' (nmrStar names) not linked" rr_1nts 1
23 3 74 1 "Not handling restraint 74, item 1, resonance(s) 'B.5.H2'1' (nmrStar names) not linked" rr_1nts 1
24 3 75 1 "Not handling restraint 75, item 1, resonance(s) 'B.5.H2'2' (nmrStar names) not linked" rr_1nts 1
25 3 76 1 "Not handling restraint 76, item 1, resonance(s) 'B.7.H5M2' (nmrStar names) not linked" rr_1nts 1
26 3 87 1 "Not handling restraint 87, item 1, resonance(s) 'B.6.H2'2' (nmrStar names) not linked" rr_1nts 1
27 3 88 1 "Not handling restraint 88, item 1, resonance(s) 'B.6.H2'1' (nmrStar names) not linked" rr_1nts 1
28 3 97 1 "Not handling restraint 97, item 1, resonance(s) 'B.7.H5M2' (nmrStar names) not linked" rr_1nts 1
29 3 98 1 "Not handling restraint 98, item 1, resonance(s) 'B.6.H2'2' (nmrStar names) not linked" rr_1nts 1
30 3 99 1 "Not handling restraint 99, item 1, resonance(s) 'B.6.H2'1' (nmrStar names) not linked" rr_1nts 1
31 3 110 1 "Not handling restraint 110, item 1, resonance(s) 'B.7.H2'1' (nmrStar names) not linked" rr_1nts 1
32 3 149 1 "Not handling restraint 149, item 1, resonance(s) 'B.4.H2'2' (nmrStar names) not linked" rr_1nts 1
33 3 150 1 "Not handling restraint 150, item 1, resonance(s) 'B.2.H2'1' (nmrStar names) not linked" rr_1nts 1
stop_
save_
save_Discover_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Sf_framecode Discover_distance_constraints_2_1
_Distance_constraint_list.Entry_ID rr_1nts
_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_1nts 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_1nts 2
2 1 . . . rr_1nts 2
3 1 . . . rr_1nts 2
4 1 . . . rr_1nts 2
5 1 . . . rr_1nts 2
6 1 . . . rr_1nts 2
7 1 . . . rr_1nts 2
8 1 . . . rr_1nts 2
9 1 . . . rr_1nts 2
10 1 . . . rr_1nts 2
11 1 . . . rr_1nts 2
12 1 . . . rr_1nts 2
13 1 . . . rr_1nts 2
14 1 . . . rr_1nts 2
15 1 . . . rr_1nts 2
16 1 . . . rr_1nts 2
17 1 . . . rr_1nts 2
18 1 . . . rr_1nts 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 2 2 A N1 N . . 1 . 3 A N1 rr_1nts 2
1 1 . 2 . 2 2 7 7 PDU H3 H . . B . 7 PU3' H3 rr_1nts 2
2 1 . 1 . 1 1 2 2 A H61 H . . 1 . 3 A H61 rr_1nts 2
2 1 . 2 . 2 2 7 7 PDU O4 O . . B . 7 PU3' O4 rr_1nts 2
3 1 . 1 . 1 1 3 3 A N1 N . . 1 . 4 A N1 rr_1nts 2
3 1 . 2 . 2 2 6 6 PDU H3 H . . B . 6 PU H3 rr_1nts 2
4 1 . 1 . 1 1 3 3 A H61 H . . 1 . 4 A H61 rr_1nts 2
4 1 . 2 . 2 2 6 6 PDU O4 O . . B . 6 PU O4 rr_1nts 2
5 1 . 1 . 1 1 4 4 G H1 H . . 1 . 5 G H1 rr_1nts 2
5 1 . 2 . 2 2 5 5 5PC N3 N . . B . 5 PC N3 rr_1nts 2
6 1 . 1 . 1 1 4 4 G O6 O . . 1 . 5 G O6 rr_1nts 2
6 1 . 2 . 2 2 5 5 5PC H42 H . . B . 5 PC H42 rr_1nts 2
7 1 . 1 . 1 1 4 4 G H22 H . . 1 . 5 G H22 rr_1nts 2
7 1 . 2 . 2 2 5 5 5PC O2 O . . B . 5 PC O2 rr_1nts 2
8 1 . 1 . 1 1 5 5 G H1 H . . 1 . 6 G H1 rr_1nts 2
8 1 . 2 . 2 2 4 4 5PC N3 N . . B . 4 PC N3 rr_1nts 2
9 1 . 1 . 1 1 5 5 G O6 O . . 1 . 6 G O6 rr_1nts 2
9 1 . 2 . 2 2 4 4 5PC H42 H . . B . 4 PC H42 rr_1nts 2
10 1 . 1 . 1 1 5 5 G H22 H . . 1 . 6 G H22 rr_1nts 2
10 1 . 2 . 2 2 4 4 5PC O2 O . . B . 4 PC O2 rr_1nts 2
11 1 . 1 . 1 1 6 6 A N1 N . . 1 . 7 A N1 rr_1nts 2
11 1 . 2 . 2 2 3 3 PDU H3 H . . B . 3 PU H3 rr_1nts 2
12 1 . 1 . 1 1 6 6 A H61 H . . 1 . 7 A H61 rr_1nts 2
12 1 . 2 . 2 2 3 3 PDU O4 O . . B . 3 PU O4 rr_1nts 2
13 1 . 1 . 1 1 7 7 G H1 H . . 1 . 8 G H1 rr_1nts 2
13 1 . 2 . 2 2 2 2 5PC N3 N . . B . 2 PC N3 rr_1nts 2
14 1 . 1 . 1 1 7 7 G O6 O . . 1 . 8 G O6 rr_1nts 2
14 1 . 2 . 2 2 2 2 5PC H42 H . . B . 2 PC H42 rr_1nts 2
15 1 . 1 . 1 1 7 7 G H22 H . . 1 . 8 G H22 rr_1nts 2
15 1 . 2 . 2 2 2 2 5PC O2 O . . B . 2 PC O2 rr_1nts 2
16 1 . 1 . 1 1 8 8 G H1 H . . 1 . 9 G H1 rr_1nts 2
16 1 . 2 . 2 2 1 1 5PC N3 N . . B . 1 C5' N3 rr_1nts 2
17 1 . 1 . 1 1 8 8 G O6 O . . 1 . 9 G O6 rr_1nts 2
17 1 . 2 . 2 2 1 1 5PC H42 H . . B . 1 C5' H42 rr_1nts 2
18 1 . 1 . 1 1 8 8 G H22 H . . 1 . 9 G H22 rr_1nts 2
18 1 . 2 . 2 2 1 1 5PC O2 O . . B . 1 C5' O2 rr_1nts 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 . . . . . . . 1.8 2.5 rr_1nts 2
2 1 . . . . . . . 1.8 2.5 rr_1nts 2
3 1 . . . . . . . 1.8 2.5 rr_1nts 2
4 1 . . . . . . . 1.8 2.5 rr_1nts 2
5 1 . . . . . . . 1.8 2.5 rr_1nts 2
6 1 . . . . . . . 1.8 2.5 rr_1nts 2
7 1 . . . . . . . 1.8 2.5 rr_1nts 2
8 1 . . . . . . . 1.8 2.5 rr_1nts 2
9 1 . . . . . . . 1.8 2.5 rr_1nts 2
10 1 . . . . . . . 1.8 2.5 rr_1nts 2
11 1 . . . . . . . 1.8 2.5 rr_1nts 2
12 1 . . . . . . . 1.8 2.5 rr_1nts 2
13 1 . . . . . . . 1.8 2.5 rr_1nts 2
14 1 . . . . . . . 1.8 2.5 rr_1nts 2
15 1 . . . . . . . 1.8 2.5 rr_1nts 2
16 1 . . . . . . . 1.8 2.5 rr_1nts 2
17 1 . . . . . . . 1.8 2.5 rr_1nts 2
18 1 . . . . . . . 1.8 2.5 rr_1nts 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
;BIOSYM restraint 1 distance
Hydrogen bonding distances (based on Theoretical numbers and observed NOEs between
exchangeable protons on 1D and 2D NOESY spectra
;
1 1 6 1 rr_1nts 2
2 Hbond 7 90 7 95 rr_1nts 2
3 Hbond 8 90 8 95 rr_1nts 2
4 Hbond 9 90 9 95 rr_1nts 2
5 Hbond 10 90 10 95 rr_1nts 2
6 Hbond 11 90 11 95 rr_1nts 2
7 Hbond 12 90 12 95 rr_1nts 2
8 Hbond 13 90 13 95 rr_1nts 2
9 Hbond 14 90 14 95 rr_1nts 2
10 Hbond 15 90 15 95 rr_1nts 2
11 Hbond 16 90 16 95 rr_1nts 2
12 Hbond 17 90 17 95 rr_1nts 2
13 Hbond 18 90 18 95 rr_1nts 2
14 Hbond 19 90 19 95 rr_1nts 2
15 Hbond 20 90 20 95 rr_1nts 2
16 Hbond 21 90 21 95 rr_1nts 2
17 Hbond 22 90 22 95 rr_1nts 2
18 Hbond 23 90 23 95 rr_1nts 2
stop_
save_
save_Discover_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Sf_framecode Discover_dihedral_4
_Torsion_angle_constraint_list.Entry_ID rr_1nts
_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 4
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_1nts 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 A O3' O . . 1 1 2 2 A P P . . 1 1 2 2 A O5' O . . 1 1 2 2 A C5' C . -150.0 150.0 . . . A . 2 A O3' . . A . 3 A P . . A . 3 A O5' . . A . 3 A C5' . 1 . 2 A O3' . . . 1 . 3 A P . . . 1 . 3 A O5' . . . 1 . 3 A C5' . . rr_1nts 1
2 . . 1 1 2 2 A O3' O . . 1 1 3 3 A P P . . 1 1 3 3 A O5' O . . 1 1 3 3 A C5' C . -150.0 150.0 . . . A . 3 A O3' . . A . 4 A P . . A . 4 A O5' . . A . 4 A C5' . 1 . 3 A O3' . . . 1 . 4 A P . . . 1 . 4 A O5' . . . 1 . 4 A C5' . . rr_1nts 1
3 . . 1 1 3 3 A O3' O . . 1 1 4 4 G P P . . 1 1 4 4 G O5' O . . 1 1 4 4 G C5' C . -150.0 150.0 . . . A . 4 A O3' . . A . 5 G P . . A . 5 G O5' . . A . 5 G C5' . 1 . 4 A O3' . . . 1 . 5 G P . . . 1 . 5 G O5' . . . 1 . 5 G C5' . . rr_1nts 1
4 . . 1 1 4 4 G O3' O . . 1 1 5 5 G P P . . 1 1 5 5 G O5' O . . 1 1 5 5 G C5' C . -150.0 150.0 . . . A . 5 G O3' . . A . 6 G P . . A . 6 G O5' . . A . 6 G C5' . 1 . 5 G O3' . . . 1 . 6 G P . . . 1 . 6 G O5' . . . 1 . 6 G C5' . . rr_1nts 1
5 . . 1 1 5 5 G O3' O . . 1 1 6 6 A P P . . 1 1 6 6 A O5' O . . 1 1 6 6 A C5' C . -150.0 150.0 . . . A . 6 G O3' . . A . 7 A P . . A . 7 A O5' . . A . 7 A C5' . 1 . 6 G O3' . . . 1 . 7 A P . . . 1 . 7 A O5' . . . 1 . 7 A C5' . . rr_1nts 1
6 . . 1 1 6 6 A O3' O . . 1 1 7 7 G P P . . 1 1 7 7 G O5' O . . 1 1 7 7 G C5' C . -150.0 150.0 . . . A . 7 A O3' . . A . 8 G P . . A . 8 G O5' . . A . 8 G C5' . 1 . 7 A O3' . . . 1 . 8 G P . . . 1 . 8 G O5' . . . 1 . 8 G C5' . . rr_1nts 1
7 . . 1 1 7 7 G O3' O . . 1 1 8 8 G P P . . 1 1 8 8 G O5' O . . 1 1 8 8 G C5' C . -150.0 150.0 . . . A . 8 G O3' . . A . 9 G P . . A . 9 G O5' . . A . 9 G C5' . 1 . 8 G O3' . . . 1 . 9 G P . . . 1 . 9 G O5' . . . 1 . 9 G C5' . . rr_1nts 1
8 . . 1 1 8 8 G O3' O . . 1 1 9 9 A P P . . 1 1 9 9 A O5' O . . 1 1 9 9 A C5' C . -150.0 150.0 . . . A . 9 G O3' . . A . 10 A P . . A . 10 A O5' . . A . 10 A C5' . 1 . 9 G O3' . . . 1 . 10 A P . . . 1 . 10 A O5' . . . 1 . 10 A C5' . . rr_1nts 1
9 . . 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 . 150.0 210.0 . . . A . 3 A P . . A . 3 A O5' . . A . 3 A C5' . . A . 3 A C4' . 1 . 3 A P . . . 1 . 3 A O5' . . . 1 . 3 A C5' . . . 1 . 3 A C4' . . rr_1nts 1
10 . . 1 1 3 3 A P P . . 1 1 3 3 A O5' O . . 1 1 3 3 A C5' C . . 1 1 3 3 A C4' C . 150.0 210.0 . . . A . 4 A P . . A . 4 A O5' . . A . 4 A C5' . . A . 4 A C4' . 1 . 4 A P . . . 1 . 4 A O5' . . . 1 . 4 A C5' . . . 1 . 4 A C4' . . rr_1nts 1
11 . . 1 1 4 4 G P P . . 1 1 4 4 G O5' O . . 1 1 4 4 G C5' C . . 1 1 4 4 G C4' C . 150.0 210.0 . . . A . 5 G P . . A . 5 G O5' . . A . 5 G C5' . . A . 5 G C4' . 1 . 5 G P . . . 1 . 5 G O5' . . . 1 . 5 G C5' . . . 1 . 5 G C4' . . rr_1nts 1
12 . . 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 . 150.0 210.0 . . . A . 6 G P . . A . 6 G O5' . . A . 6 G C5' . . A . 6 G C4' . 1 . 6 G P . . . 1 . 6 G O5' . . . 1 . 6 G C5' . . . 1 . 6 G C4' . . rr_1nts 1
13 . . 1 1 6 6 A P P . . 1 1 6 6 A O5' O . . 1 1 6 6 A C5' C . . 1 1 6 6 A C4' C . 150.0 210.0 . . . A . 7 A P . . A . 7 A O5' . . A . 7 A C5' . . A . 7 A C4' . 1 . 7 A P . . . 1 . 7 A O5' . . . 1 . 7 A C5' . . . 1 . 7 A C4' . . rr_1nts 1
14 . . 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 . 150.0 210.0 . . . A . 8 G P . . A . 8 G O5' . . A . 8 G C5' . . A . 8 G C4' . 1 . 8 G P . . . 1 . 8 G O5' . . . 1 . 8 G C5' . . . 1 . 8 G C4' . . rr_1nts 1
15 . . 1 1 8 8 G P P . . 1 1 8 8 G O5' O . . 1 1 8 8 G C5' C . . 1 1 8 8 G C4' C . 150.0 210.0 . . . A . 9 G P . . A . 9 G O5' . . A . 9 G C5' . . A . 9 G C4' . 1 . 9 G P . . . 1 . 9 G O5' . . . 1 . 9 G C5' . . . 1 . 9 G C4' . . rr_1nts 1
16 . . 1 1 9 9 A P P . . 1 1 9 9 A O5' O . . 1 1 9 9 A C5' C . . 1 1 9 9 A C4' C . 150.0 210.0 . . . A . 10 A P . . A . 10 A O5' . . A . 10 A C5' . . A . 10 A C4' . 1 . 10 A P . . . 1 . 10 A O5' . . . 1 . 10 A C5' . . . 1 . 10 A C4' . . rr_1nts 1
17 . . 1 1 1 1 A O5' O . . 1 1 1 1 A C5' C . . 1 1 1 1 A C4' C . . 1 1 1 1 A C3' C . 30.0 90.0 . . . A . 2 A O5' . . A . 2 A C5' . . A . 2 A C4' . . A . 2 A C3' . 1 . 2 A O5' . . . 1 . 2 A C5' . . . 1 . 2 A C4' . . . 1 . 2 A C3' . . rr_1nts 1
18 . . 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 . 30.0 90.0 . . . A . 3 A O5' . . A . 3 A C5' . . A . 3 A C4' . . A . 3 A C3' . 1 . 3 A O5' . . . 1 . 3 A C5' . . . 1 . 3 A C4' . . . 1 . 3 A C3' . . rr_1nts 1
19 . . 1 1 3 3 A O5' O . . 1 1 3 3 A C5' C . . 1 1 3 3 A C4' C . . 1 1 3 3 A C3' C . 30.0 90.0 . . . A . 4 A O5' . . A . 4 A C5' . . A . 4 A C4' . . A . 4 A C3' . 1 . 4 A O5' . . . 1 . 4 A C5' . . . 1 . 4 A C4' . . . 1 . 4 A C3' . . rr_1nts 1
20 . . 1 1 4 4 G O5' O . . 1 1 4 4 G C5' C . . 1 1 4 4 G C4' C . . 1 1 4 4 G C3' C . 30.0 90.0 . . . A . 5 G O5' . . A . 5 G C5' . . A . 5 G C4' . . A . 5 G C3' . 1 . 5 G O5' . . . 1 . 5 G C5' . . . 1 . 5 G C4' . . . 1 . 5 G C3' . . rr_1nts 1
21 . . 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 . 30.0 90.0 . . . A . 6 G O5' . . A . 6 G C5' . . A . 6 G C4' . . A . 6 G C3' . 1 . 6 G O5' . . . 1 . 6 G C5' . . . 1 . 6 G C4' . . . 1 . 6 G C3' . . rr_1nts 1
22 . . 1 1 6 6 A O5' O . . 1 1 6 6 A C5' C . . 1 1 6 6 A C4' C . . 1 1 6 6 A C3' C . 30.0 90.0 . . . A . 7 A O5' . . A . 7 A C5' . . A . 7 A C4' . . A . 7 A C3' . 1 . 7 A O5' . . . 1 . 7 A C5' . . . 1 . 7 A C4' . . . 1 . 7 A C3' . . rr_1nts 1
23 . . 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 . 30.0 90.0 . . . A . 8 G O5' . . A . 8 G C5' . . A . 8 G C4' . . A . 8 G C3' . 1 . 8 G O5' . . . 1 . 8 G C5' . . . 1 . 8 G C4' . . . 1 . 8 G C3' . . rr_1nts 1
24 . . 1 1 8 8 G O5' O . . 1 1 8 8 G C5' C . . 1 1 8 8 G C4' C . . 1 1 8 8 G C3' C . 30.0 90.0 . . . A . 9 G O5' . . A . 9 G C5' . . A . 9 G C4' . . A . 9 G C3' . 1 . 9 G O5' . . . 1 . 9 G C5' . . . 1 . 9 G C4' . . . 1 . 9 G C3' . . rr_1nts 1
25 . . 1 1 9 9 A O5' O . . 1 1 9 9 A C5' C . . 1 1 9 9 A C4' C . . 1 1 9 9 A C3' C . 30.0 90.0 . . . A . 10 A O5' . . A . 10 A C5' . . A . 10 A C4' . . A . 10 A C3' . 1 . 10 A O5' . . . 1 . 10 A C5' . . . 1 . 10 A C4' . . . 1 . 10 A C3' . . rr_1nts 1
26 . . 1 1 1 1 A C5' C . . 1 1 1 1 A C4' C . . 1 1 1 1 A C3' C . . 1 1 1 1 A O3' O . 70.0 110.0 . . . A . 2 A C5' . . A . 2 A C4' . . A . 2 A C3' . . A . 2 A O3' . 1 . 2 A C5' . . . 1 . 2 A C4' . . . 1 . 2 A C3' . . . 1 . 2 A O3' . . rr_1nts 1
27 . . 1 1 2 2 A C5' C . . 1 1 2 2 A C4' C . . 1 1 2 2 A C3' C . . 1 1 2 2 A O3' O . 70.0 110.0 . . . A . 3 A C5' . . A . 3 A C4' . . A . 3 A C3' . . A . 3 A O3' . 1 . 3 A C5' . . . 1 . 3 A C4' . . . 1 . 3 A C3' . . . 1 . 3 A O3' . . rr_1nts 1
28 . . 1 1 3 3 A C5' C . . 1 1 3 3 A C4' C . . 1 1 3 3 A C3' C . . 1 1 3 3 A O3' O . 70.0 110.0 . . . A . 4 A C5' . . A . 4 A C4' . . A . 4 A C3' . . A . 4 A O3' . 1 . 4 A C5' . . . 1 . 4 A C4' . . . 1 . 4 A C3' . . . 1 . 4 A O3' . . rr_1nts 1
29 . . 1 1 4 4 G C5' C . . 1 1 4 4 G C4' C . . 1 1 4 4 G C3' C . . 1 1 4 4 G O3' O . 70.0 110.0 . . . A . 5 G C5' . . A . 5 G C4' . . A . 5 G C3' . . A . 5 G O3' . 1 . 5 G C5' . . . 1 . 5 G C4' . . . 1 . 5 G C3' . . . 1 . 5 G O3' . . rr_1nts 1
30 . . 1 1 5 5 G C5' C . . 1 1 5 5 G C4' C . . 1 1 5 5 G C3' C . . 1 1 5 5 G O3' O . 70.0 110.0 . . . A . 6 G C5' . . A . 6 G C4' . . A . 6 G C3' . . A . 6 G O3' . 1 . 6 G C5' . . . 1 . 6 G C4' . . . 1 . 6 G C3' . . . 1 . 6 G O3' . . rr_1nts 1
31 . . 1 1 6 6 A C5' C . . 1 1 6 6 A C4' C . . 1 1 6 6 A C3' C . . 1 1 6 6 A O3' O . 70.0 110.0 . . . A . 7 A C5' . . A . 7 A C4' . . A . 7 A C3' . . A . 7 A O3' . 1 . 7 A C5' . . . 1 . 7 A C4' . . . 1 . 7 A C3' . . . 1 . 7 A O3' . . rr_1nts 1
32 . . 1 1 7 7 G C5' C . . 1 1 7 7 G C4' C . . 1 1 7 7 G C3' C . . 1 1 7 7 G O3' O . 70.0 110.0 . . . A . 8 G C5' . . A . 8 G C4' . . A . 8 G C3' . . A . 8 G O3' . 1 . 8 G C5' . . . 1 . 8 G C4' . . . 1 . 8 G C3' . . . 1 . 8 G O3' . . rr_1nts 1
33 . . 1 1 8 8 G C5' C . . 1 1 8 8 G C4' C . . 1 1 8 8 G C3' C . . 1 1 8 8 G O3' O . 70.0 110.0 . . . A . 9 G C5' . . A . 9 G C4' . . A . 9 G C3' . . A . 9 G O3' . 1 . 9 G C5' . . . 1 . 9 G C4' . . . 1 . 9 G C3' . . . 1 . 9 G O3' . . rr_1nts 1
34 . . 1 1 9 9 A C5' C . . 1 1 9 9 A C4' C . . 1 1 9 9 A C3' C . . 1 1 9 9 A O3' O . 70.0 110.0 . . . A . 10 A C5' . . A . 10 A C4' . . A . 10 A C3' . . A . 10 A O3' . 1 . 10 A C5' . . . 1 . 10 A C4' . . . 1 . 10 A C3' . . . 1 . 10 A O3' . . rr_1nts 1
35 . . 1 1 1 1 A C4' C . . 1 1 1 1 A C3' C . . 1 1 1 1 A O3' O . . 1 1 2 2 A P P . -170.0 -100.0 . . . A . 2 A C4' . . A . 2 A C3' . . A . 2 A O3' . . A . 3 A P . 1 . 2 A C4' . . . 1 . 2 A C3' . . . 1 . 2 A O3' . . . 1 . 3 A P . . rr_1nts 1
36 . . 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 A P P . -170.0 -100.0 . . . A . 3 A C4' . . A . 3 A C3' . . A . 3 A O3' . . A . 4 A P . 1 . 3 A C4' . . . 1 . 3 A C3' . . . 1 . 3 A O3' . . . 1 . 4 A P . . rr_1nts 1
37 . . 1 1 3 3 A C4' C . . 1 1 3 3 A C3' C . . 1 1 3 3 A O3' O . . 1 1 4 4 G P P . -170.0 -100.0 . . . A . 4 A C4' . . A . 4 A C3' . . A . 4 A O3' . . A . 5 G P . 1 . 4 A C4' . . . 1 . 4 A C3' . . . 1 . 4 A O3' . . . 1 . 5 G P . . rr_1nts 1
38 . . 1 1 4 4 G C4' C . . 1 1 4 4 G C3' C . . 1 1 4 4 G O3' O . . 1 1 5 5 G P P . -170.0 -100.0 . . . A . 5 G C4' . . A . 5 G C3' . . A . 5 G O3' . . A . 6 G P . 1 . 5 G C4' . . . 1 . 5 G C3' . . . 1 . 5 G O3' . . . 1 . 6 G P . . rr_1nts 1
39 . . 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 A P P . -170.0 -100.0 . . . A . 6 G C4' . . A . 6 G C3' . . A . 6 G O3' . . A . 7 A P . 1 . 6 G C4' . . . 1 . 6 G C3' . . . 1 . 6 G O3' . . . 1 . 7 A P . . rr_1nts 1
40 . . 1 1 6 6 A C4' C . . 1 1 6 6 A C3' C . . 1 1 6 6 A O3' O . . 1 1 7 7 G P P . -170.0 -100.0 . . . A . 7 A C4' . . A . 7 A C3' . . A . 7 A O3' . . A . 8 G P . 1 . 7 A C4' . . . 1 . 7 A C3' . . . 1 . 7 A O3' . . . 1 . 8 G P . . rr_1nts 1
41 . . 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 . -170.0 -100.0 . . . A . 8 G C4' . . A . 8 G C3' . . A . 8 G O3' . . A . 9 G P . 1 . 8 G C4' . . . 1 . 8 G C3' . . . 1 . 8 G O3' . . . 1 . 9 G P . . rr_1nts 1
42 . . 1 1 8 8 G C4' C . . 1 1 8 8 G C3' C . . 1 1 8 8 G O3' O . . 1 1 9 9 A P P . -170.0 -100.0 . . . A . 9 G C4' . . A . 9 G C3' . . A . 9 G O3' . . A . 10 A P . 1 . 9 G C4' . . . 1 . 9 G C3' . . . 1 . 9 G O3' . . . 1 . 10 A P . . rr_1nts 1
43 . . 1 1 1 1 A C3' C . . 1 1 1 1 A O3' O . . 1 1 2 2 A P P . . 1 1 2 2 A O5' O . -150.0 150.0 . . . A . 2 A C3' . . A . 2 A O3' . . A . 3 A P . . A . 3 A O5' . 1 . 2 A C3' . . . 1 . 2 A O3' . . . 1 . 3 A P . . . 1 . 3 A O5' . . rr_1nts 1
44 . . 1 1 2 2 A C3' C . . 1 1 2 2 A O3' O . . 1 1 3 3 A P P . . 1 1 3 3 A O5' O . -150.0 150.0 . . . A . 3 A C3' . . A . 3 A O3' . . A . 4 A P . . A . 4 A O5' . 1 . 3 A C3' . . . 1 . 3 A O3' . . . 1 . 4 A P . . . 1 . 4 A O5' . . rr_1nts 1
45 . . 1 1 3 3 A C3' C . . 1 1 3 3 A O3' O . . 1 1 4 4 G P P . . 1 1 4 4 G O5' O . -150.0 150.0 . . . A . 4 A C3' . . A . 4 A O3' . . A . 5 G P . . A . 5 G O5' . 1 . 4 A C3' . . . 1 . 4 A O3' . . . 1 . 5 G P . . . 1 . 5 G O5' . . rr_1nts 1
46 . . 1 1 4 4 G C3' C . . 1 1 4 4 G O3' O . . 1 1 5 5 G P P . . 1 1 5 5 G O5' O . -150.0 150.0 . . . A . 5 G C3' . . A . 5 G O3' . . A . 6 G P . . A . 6 G O5' . 1 . 5 G C3' . . . 1 . 5 G O3' . . . 1 . 6 G P . . . 1 . 6 G O5' . . rr_1nts 1
47 . . 1 1 5 5 G C3' C . . 1 1 5 5 G O3' O . . 1 1 6 6 A P P . . 1 1 6 6 A O5' O . -150.0 150.0 . . . A . 6 G C3' . . A . 6 G O3' . . A . 7 A P . . A . 7 A O5' . 1 . 6 G C3' . . . 1 . 6 G O3' . . . 1 . 7 A P . . . 1 . 7 A O5' . . rr_1nts 1
48 . . 1 1 6 6 A C3' C . . 1 1 6 6 A O3' O . . 1 1 7 7 G P P . . 1 1 7 7 G O5' O . -150.0 150.0 . . . A . 7 A C3' . . A . 7 A O3' . . A . 8 G P . . A . 8 G O5' . 1 . 7 A C3' . . . 1 . 7 A O3' . . . 1 . 8 G P . . . 1 . 8 G O5' . . rr_1nts 1
49 . . 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 . -150.0 150.0 . . . A . 8 G C3' . . A . 8 G O3' . . A . 9 G P . . A . 9 G O5' . 1 . 8 G C3' . . . 1 . 8 G O3' . . . 1 . 9 G P . . . 1 . 9 G O5' . . rr_1nts 1
50 . . 1 1 8 8 G C3' C . . 1 1 8 8 G O3' O . . 1 1 9 9 A P P . . 1 1 9 9 A O5' O . -150.0 150.0 . . . A . 9 G C3' . . A . 9 G O3' . . A . 10 A P . . A . 10 A O5' . 1 . 9 G C3' . . . 1 . 9 G O3' . . . 1 . 10 A P . . . 1 . 10 A O5' . . rr_1nts 1
51 . . 1 1 1 1 A O4' O . . 1 1 1 1 A C1' C . . 1 1 1 1 A N9 N . . 1 1 1 1 A C4 C . 150.0 210.0 . . . A . 2 A O4' . . A . 2 A C1' . . A . 2 A N9 . . A . 2 A C4 . 1 . 2 A O4' . . . 1 . 2 A C1' . . . 1 . 2 A N9 . . . 1 . 2 A C4 . . rr_1nts 1
52 . . 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 . 150.0 210.0 . . . A . 3 A O4' . . A . 3 A C1' . . A . 3 A N9 . . A . 3 A C4 . 1 . 3 A O4' . . . 1 . 3 A C1' . . . 1 . 3 A N9 . . . 1 . 3 A C4 . . rr_1nts 1
53 . . 1 1 3 3 A O4' O . . 1 1 3 3 A C1' C . . 1 1 3 3 A N9 N . . 1 1 3 3 A C4 C . 150.0 210.0 . . . A . 4 A O4' . . A . 4 A C1' . . A . 4 A N9 . . A . 4 A C4 . 1 . 4 A O4' . . . 1 . 4 A C1' . . . 1 . 4 A N9 . . . 1 . 4 A C4 . . rr_1nts 1
54 . . 1 1 4 4 G O4' O . . 1 1 4 4 G C1' C . . 1 1 4 4 G N9 N . . 1 1 4 4 G C4 C . 150.0 210.0 . . . A . 5 G O4' . . A . 5 G C1' . . A . 5 G N9 . . A . 5 G C4 . 1 . 5 G O4' . . . 1 . 5 G C1' . . . 1 . 5 G N9 . . . 1 . 5 G C4 . . rr_1nts 1
55 . . 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 . 150.0 210.0 . . . A . 6 G O4' . . A . 6 G C1' . . A . 6 G N9 . . A . 6 G C4 . 1 . 6 G O4' . . . 1 . 6 G C1' . . . 1 . 6 G N9 . . . 1 . 6 G C4 . . rr_1nts 1
56 . . 1 1 6 6 A O4' O . . 1 1 6 6 A C1' C . . 1 1 6 6 A N9 N . . 1 1 6 6 A C4 C . 150.0 210.0 . . . A . 7 A O4' . . A . 7 A C1' . . A . 7 A N9 . . A . 7 A C4 . 1 . 7 A O4' . . . 1 . 7 A C1' . . . 1 . 7 A N9 . . . 1 . 7 A C4 . . rr_1nts 1
57 . . 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 . 150.0 210.0 . . . A . 8 G O4' . . A . 8 G C1' . . A . 8 G N9 . . A . 8 G C4 . 1 . 8 G O4' . . . 1 . 8 G C1' . . . 1 . 8 G N9 . . . 1 . 8 G C4 . . rr_1nts 1
58 . . 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 . 150.0 210.0 . . . A . 9 G O4' . . A . 9 G C1' . . A . 9 G N9 . . A . 9 G C4 . 1 . 9 G O4' . . . 1 . 9 G C1' . . . 1 . 9 G N9 . . . 1 . 9 G C4 . . rr_1nts 1
59 . . 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 . 150.0 210.0 . . . A . 10 A O4' . . A . 10 A C1' . . A . 10 A N9 . . A . 10 A C4 . 1 . 10 A O4' . . . 1 . 10 A C1' . . . 1 . 10 A N9 . . . 1 . 10 A C4 . . rr_1nts 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
;********************************************** DIHEDRAL RESTRAINTS
********************************************** NMR_dihedral
alpha (NOT TIGHTLY RESTRAINED) P-O5'; first strand (RNA) ONLY RESTRAINED TO C3'ENDO
;
1 1 11 1 rr_1nts 1
2 "beta (NOT TIGHTLY RESTRAINED) O5'-C5'; first strand (RNA) ONLY RESTRAINED TO C3'ENDO" 20 1 22 1 rr_1nts 1
3 "gamma C5'-C4'; first strand (RNA) ONLY RESTRAINED TO C3'ENDO" 31 1 34 1 rr_1nts 1
4 "delta C4'-C3'; first strand (RNA) ONLY RESTRAINED TO C3'ENDO" 44 1 48 1 rr_1nts 1
5 "epsilon C3'-O3'; first strand (RNA) ONLY RESTRAINED TO C3'ENDO" 58 1 62 1 rr_1nts 1
6 "zeta O3'-P; first strand (RNA) ONLY RESTRAINED TO C3'ENDO" 71 1 74 1 rr_1nts 1
7 "chi Glycosidic torsions; strand 1 (RNA) ONLY RESTRAINED TO C3'ENDO" 83 1 87 1 rr_1nts 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_1nts
_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 RNA/DNA 30-JAN-03 1NTS *TITLE 5'(DCCPUPCPCPUPUP)3':3'(RAGGAGGAAA)5', WHERE P=PROPYNYL *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: 5'-R(*AP*AP*AP*GP*GP*AP*GP*GP*A)-3'; *COMPND 3 CHAIN: A; *COMPND 4 ENGINEERED: YES; *COMPND 5 MOL_ID: 2; *COMPND 6 MOLECULE: 5'-D(*(5PC)P*(5PC)P*(PDU)P*(5PC)P*(5PC)P*(PDU) *COMPND 7 P*(PDU))-3'; *COMPND 8 CHAIN: B; *COMPND 9 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 MOL_ID: 2; *SOURCE 4 SYNTHETIC: YES *KEYWDS DNA, RNA, HYBRID, PROPYNYL *EXPDTA NMR, MINIMIZED AVERAGE STRUCTURE *AUTHOR B.M.ZNOSKO, T.W.BARNES III, T.R.KRUGH, D.H.TURNER *REVDAT 1 10-JUN-03 1NTS 0"
save_