NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
|
|
375602 |
1f79   |
cing | 3-converted-DOCR | STAR | entry | full | 575 |
data_DOCR_restraints_with_modified_coordinates_PDB_code_1f79
# This DOCR archive file contains, for PDB entry <1f79>:
#
# - 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_1f79
_Entry.Title "wwPDB remediated NMR restraints for PDB entry 1f79"
_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 1f79"
save_
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID rr_1f79
_Assembly.ID 1
_Assembly.Name 1f79
_Assembly.Number_of_components 2
_Assembly.Organic_ligands 1
_Assembly.Metal_ions 0
_Assembly.Non_standard_bonds no
_Assembly.Paramagnetic no
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 8859.28032
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 "RNASE P RNA RIBOZYME P4 DOMAIN MUTANT" 1 $RNASE_P_RNA_RIBOZYME__P4_DOMAIN_MUTANT A . no . . . . . . rr_1f79 1
2 "COBALT HEXAMMINE III" 2 $COBALT_HEXAMMINE_III_ B . no . . . . . . rr_1f79 1
stop_
save_
save_RNASE_P_RNA_RIBOZYME__P4_DOMAIN_MUTANT
_Entity.Sf_category entity
_Entity.Sf_framecode RNASE_P_RNA_RIBOZYME__P4_DOMAIN_MUTANT
_Entity.Entry_ID rr_1f79
_Entity.ID 1
_Entity.Name RNASE_P_RNA_RIBOZYME__P4_DOMAIN_MUTANT
_Entity.Type polymer
_Entity.Polymer_type polyribonucleotide
_Entity.Polymer_strand_ID A
_Entity.Polymer_seq_one_letter_code
;GGAAGUUCGGUCUUCGGACC
GGCUUCC
;
_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 27
_Entity.Paramagnetic no
_Entity.Thiol_state "not present"
_Entity.Parent_entity_ID 1
_Entity.Formula_weight 8698.16472
loop_
_Entity_comp_index.ID
_Entity_comp_index.Auth_seq_ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 . G . rr_1f79 1
2 . G . rr_1f79 1
3 . A . rr_1f79 1
4 . A . rr_1f79 1
5 . G . rr_1f79 1
6 . U . rr_1f79 1
7 . U . rr_1f79 1
8 . C . rr_1f79 1
9 . G . rr_1f79 1
10 . G . rr_1f79 1
11 . U . rr_1f79 1
12 . C . rr_1f79 1
13 . U . rr_1f79 1
14 . U . rr_1f79 1
15 . C . rr_1f79 1
16 . G . rr_1f79 1
17 . G . rr_1f79 1
18 . A . rr_1f79 1
19 . C . rr_1f79 1
20 . C . rr_1f79 1
21 . G . rr_1f79 1
22 . G . rr_1f79 1
23 . C . rr_1f79 1
24 . U . rr_1f79 1
25 . U . rr_1f79 1
26 . C . rr_1f79 1
27 . C . rr_1f79 1
stop_
loop_
_Entity_poly_seq.Hetero
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
. G 1 1 rr_1f79 1
. G 2 2 rr_1f79 1
. A 3 3 rr_1f79 1
. A 4 4 rr_1f79 1
. G 5 5 rr_1f79 1
. U 6 6 rr_1f79 1
. U 7 7 rr_1f79 1
. C 8 8 rr_1f79 1
. G 9 9 rr_1f79 1
. G 10 10 rr_1f79 1
. U 11 11 rr_1f79 1
. C 12 12 rr_1f79 1
. U 13 13 rr_1f79 1
. U 14 14 rr_1f79 1
. C 15 15 rr_1f79 1
. G 16 16 rr_1f79 1
. G 17 17 rr_1f79 1
. A 18 18 rr_1f79 1
. C 19 19 rr_1f79 1
. C 20 20 rr_1f79 1
. G 21 21 rr_1f79 1
. G 22 22 rr_1f79 1
. C 23 23 rr_1f79 1
. U 24 24 rr_1f79 1
. U 25 25 rr_1f79 1
. C 26 26 rr_1f79 1
. C 27 27 rr_1f79 1
stop_
save_
save_COBALT_HEXAMMINE_III_
_Entity.Sf_category entity
_Entity.Sf_framecode COBALT_HEXAMMINE_III_
_Entity.Entry_ID rr_1f79
_Entity.ID 2
_Entity.Name COBALT_HEXAMMINE_III_
_Entity.Type non-polymer
_Entity.Ambiguous_conformational_states no
_Entity.Ambiguous_chem_comp_sites no
_Entity.Nstd_chirality yes
_Entity.Nstd_linkage no
_Entity.Nonpolymer_comp_ID NCO
_Entity.Nonpolymer_comp_label $chem_comp_NCO
_Entity.Number_of_monomers 1
_Entity.Paramagnetic no
_Entity.Thiol_state "not present"
_Entity.Parent_entity_ID 2
loop_
_Entity_comp_index.ID
_Entity_comp_index.Auth_seq_ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 . NCO . rr_1f79 2
stop_
save_
save_chem_comp_NCO
_Chem_comp.Sf_category chem_comp
_Chem_comp.Sf_framecode chem_comp_NCO
_Chem_comp.Entry_ID rr_1f79
_Chem_comp.ID NCO
_Chem_comp.Name "COBALT HEXAMMINE(III)"
_Chem_comp.Type non-polymer
_Chem_comp.PDB_code NCO
_Chem_comp.Formal_charge 3
_Chem_comp.Paramagnetic no
_Chem_comp.Aromatic no
_Chem_comp.Formula "H18 Co N6"
_Chem_comp.Formula_weight 161.1156
save_
save_conformer_statistics
_Conformer_stat_list.Sf_category conformer_statistics
_Conformer_stat_list.Sf_framecode conformer_statistics
_Conformer_stat_list.Entry_ID rr_1f79
_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_1f79
_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_1f79 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_1f79 1
stop_
loop_
_Atom_site.Assembly_ID
_Atom_site.Model_ID
_Atom_site.Model_site_ID
_Atom_site.ID
_Atom_site.Assembly_atom_ID
_Atom_site.Label_entity_assembly_ID
_Atom_site.Label_entity_ID
_Atom_site.Label_comp_index_ID
_Atom_site.Label_comp_ID
_Atom_site.Label_atom_ID
_Atom_site.Type_symbol
_Atom_site.Cartn_x
_Atom_site.Cartn_y
_Atom_site.Cartn_z
_Atom_site.Cartn_x_esd
_Atom_site.Cartn_y_esd
_Atom_site.Cartn_z_esd
_Atom_site.Occupancy
_Atom_site.Occupancy_esd
_Atom_site.Uncertainty
_Atom_site.Ordered_flag
_Atom_site.Footnote_ID
_Atom_site.PDBX_label_asym_ID
_Atom_site.PDBX_label_seq_ID
_Atom_site.PDBX_label_comp_ID
_Atom_site.PDBX_label_atom_ID
_Atom_site.PDBX_formal_charge
_Atom_site.PDBX_label_entity_ID
_Atom_site.PDB_record_ID
_Atom_site.PDB_model_num
_Atom_site.PDB_strand_ID
_Atom_site.PDB_ins_code
_Atom_site.PDB_residue_no
_Atom_site.PDB_residue_name
_Atom_site.PDB_atom_name
_Atom_site.Auth_entity_assembly_ID
_Atom_site.Auth_asym_ID
_Atom_site.Auth_chain_ID
_Atom_site.Auth_seq_ID
_Atom_site.Auth_comp_ID
_Atom_site.Auth_atom_ID
_Atom_site.Auth_alt_ID
_Atom_site.Auth_atom_name
_Atom_site.Details
_Atom_site.Entry_ID
_Atom_site.Conformer_family_coord_set_ID
. 1 . 1 . 1 1 1 G C1' C 14.868 25.782 4.006 . . . 1.0 . . . . . . . . . . . . A . 1 G C1' . . . . . . . . . rr_1f79 1
. 1 . 2 . 1 1 1 G C2 C 14.122 29.398 6.302 . . . 1.0 . . . . . . . . . . . . A . 1 G C2 . . . . . . . . . rr_1f79 1
. 1 . 3 . 1 1 1 G C2' C 14.488 24.307 4.012 . . . 1.0 . . . . . . . . . . . . A . 1 G C2' . . . . . . . . . rr_1f79 1
. 1 . 4 . 1 1 1 G C3' C 14.638 23.896 2.560 . . . 1.0 . . . . . . . . . . . . A . 1 G C3' . . . . . . . . . rr_1f79 1
. 1 . 5 . 1 1 1 G C4 C 13.567 27.773 4.878 . . . 1.0 . . . . . . . . . . . . A . 1 G C4 . . . . . . . . . rr_1f79 1
. 1 . 6 . 1 1 1 G C4' C 15.731 24.811 2.038 . . . 1.0 . . . . . . . . . . . . A . 1 G C4' . . . . . . . . . rr_1f79 1
. 1 . 7 . 1 1 1 G C5 C 12.287 28.235 4.687 . . . 1.0 . . . . . . . . . . . . A . 1 G C5 . . . . . . . . . rr_1f79 1
. 1 . 8 . 1 1 1 G C5' C 15.667 25.098 0.541 . . . 1.0 . . . . . . . . . . . . A . 1 G C5' . . . . . . . . . rr_1f79 1
. 1 . 9 . 1 1 1 G C6 C 11.855 29.406 5.369 . . . 1.0 . . . . . . . . . . . . A . 1 G C6 . . . . . . . . . rr_1f79 1
. 1 . 10 . 1 1 1 G C8 C 12.466 26.494 3.485 . . . 1.0 . . . . . . . . . . . . A . 1 G C8 . . . . . . . . . rr_1f79 1
. 1 . 11 . 1 1 1 G H1 H 12.636 30.760 6.701 . . . 1.0 . . . . . . . . . . . . A . 1 G H1 . . . . . . . . . rr_1f79 1
. 1 . 12 . 1 1 1 G H1' H 15.542 26.005 4.831 . . . 1.0 . . . . . . . . . . . . A . 1 G H1' . . . . . . . . . rr_1f79 1
. 1 . 13 . 1 1 1 G H2' H 13.459 24.187 4.337 . . . 1.0 . . . . . . . . . . . . A . 1 G H2' . . . . . . . . . rr_1f79 1
. 1 . 14 . 1 1 1 G H21 H 14.659 30.850 7.624 . . . 1.0 . . . . . . . . . . . . A . 1 G H21 . . . . . . . . . rr_1f79 1
. 1 . 15 . 1 1 1 G H22 H 15.913 29.699 7.221 . . . 1.0 . . . . . . . . . . . . A . 1 G H22 . . . . . . . . . rr_1f79 1
. 1 . 16 . 1 1 1 G H3' H 13.708 23.960 1.999 . . . 1.0 . . . . . . . . . . . . A . 1 G H3' . . . . . . . . . rr_1f79 1
. 1 . 17 . 1 1 1 G H4' H 16.714 24.408 2.280 . . . 1.0 . . . . . . . . . . . . A . 1 G H4' . . . . . . . . . rr_1f79 1
. 1 . 18 . 1 1 1 G H5' H 16.261 25.986 0.324 . . . 1.0 . . . . . . . . . . . . A . 1 G H5' . . . . . . . . . rr_1f79 1
. 1 . 19 . 1 1 1 G H5'' H 16.085 24.249 -0.001 . . . 1.0 . . . . . . . . . . . . A . 1 G H5'' . . . . . . . . . rr_1f79 1
. 1 . 20 . 1 1 1 G H8 H 12.242 25.670 2.807 . . . 1.0 . . . . . . . . . . . . A . 1 G H8 . . . . . . . . . rr_1f79 1
. 1 . 21 . 1 1 1 G HO2' H 16.268 23.912 4.679 . . . 1.0 . . . . . . . . . . . . A . 1 G HO2' . . . . . . . . . rr_1f79 1
. 1 . 22 . 1 1 1 G HO5' H 14.358 25.951 -0.616 . . . 1.0 . . . . . . . . . . . . A . 1 G HO5' . . . . . . . . . rr_1f79 1
. 1 . 23 . 1 1 1 G N1 N 12.858 29.929 6.171 . . . 1.0 . . . . . . . . . . . . A . 1 G N1 . . . . . . . . . rr_1f79 1
. 1 . 24 . 1 1 1 G N2 N 14.966 30.034 7.115 . . . 1.0 . . . . . . . . . . . . A . 1 G N2 . . . . . . . . . rr_1f79 1
. 1 . 25 . 1 1 1 G N3 N 14.537 28.299 5.666 . . . 1.0 . . . . . . . . . . . . A . 1 G N3 . . . . . . . . . rr_1f79 1
. 1 . 26 . 1 1 1 G N7 N 11.598 27.415 3.800 . . . 1.0 . . . . . . . . . . . . A . 1 G N7 . . . . . . . . . rr_1f79 1
. 1 . 27 . 1 1 1 G N9 N 13.680 26.647 4.100 . . . 1.0 . . . . . . . . . . . . A . 1 G N9 . . . . . . . . . rr_1f79 1
. 1 . 28 . 1 1 1 G O2' O 15.386 23.566 4.835 . . . 1.0 . . . . . . . . . . . . A . 1 G O2' . . . . . . . . . rr_1f79 1
. 1 . 29 . 1 1 1 G O3' O 15.167 22.566 2.559 . . . 1.0 . . . . . . . . . . . . A . 1 G O3' . . . . . . . . . rr_1f79 1
. 1 . 30 . 1 1 1 G O4' O 15.538 26.029 2.760 . . . 1.0 . . . . . . . . . . . . A . 1 G O4' . . . . . . . . . rr_1f79 1
. 1 . 31 . 1 1 1 G O5' O 14.324 25.316 0.104 . . . 1.0 . . . . . . . . . . . . A . 1 G O5' . . . . . . . . . rr_1f79 1
. 1 . 32 . 1 1 1 G O6 O 10.758 29.957 5.316 . . . 1.0 . . . . . . . . . . . . A . 1 G O6 . . . . . . . . . rr_1f79 1
. 1 . 33 . 1 1 2 G C1' C 15.375 22.755 8.098 . . . 1.0 . . . . . . . . . . . . A . 2 G C1' . . . . . . . . . rr_1f79 1
. 1 . 34 . 1 1 2 G C2 C 12.676 25.122 10.563 . . . 1.0 . . . . . . . . . . . . A . 2 G C2 . . . . . . . . . rr_1f79 1
. 1 . 35 . 1 1 2 G C2' C 15.363 21.372 8.745 . . . 1.0 . . . . . . . . . . . . A . 2 G C2' . . . . . . . . . rr_1f79 1
. 1 . 36 . 1 1 2 G C3' C 15.398 20.462 7.528 . . . 1.0 . . . . . . . . . . . . A . 2 G C3' . . . . . . . . . rr_1f79 1
. 1 . 37 . 1 1 2 G C4 C 13.258 24.010 8.718 . . . 1.0 . . . . . . . . . . . . A . 2 G C4 . . . . . . . . . rr_1f79 1
. 1 . 38 . 1 1 2 G C4' C 16.306 21.209 6.567 . . . 1.0 . . . . . . . . . . . . A . 2 G C4' . . . . . . . . . rr_1f79 1
. 1 . 39 . 1 1 2 G C5 C 12.070 24.257 8.070 . . . 1.0 . . . . . . . . . . . . A . 2 G C5 . . . . . . . . . rr_1f79 1
. 1 . 40 . 1 1 2 G C5' C 16.046 20.927 5.089 . . . 1.0 . . . . . . . . . . . . A . 2 G C5' . . . . . . . . . rr_1f79 1
. 1 . 41 . 1 1 2 G C6 C 11.061 25.019 8.723 . . . 1.0 . . . . . . . . . . . . A . 2 G C6 . . . . . . . . . rr_1f79 1
. 1 . 42 . 1 1 2 G C8 C 13.242 23.104 6.725 . . . 1.0 . . . . . . . . . . . . A . 2 G C8 . . . . . . . . . rr_1f79 1
. 1 . 43 . 1 1 2 G H1 H 10.802 25.962 10.528 . . . 1.0 . . . . . . . . . . . . A . 2 G H1 . . . . . . . . . rr_1f79 1
. 1 . 44 . 1 1 2 G H1' H 15.921 23.472 8.706 . . . 1.0 . . . . . . . . . . . . A . 2 G H1' . . . . . . . . . rr_1f79 1
. 1 . 45 . 1 1 2 G H2' H 14.455 21.218 9.326 . . . 1.0 . . . . . . . . . . . . A . 2 G H2' . . . . . . . . . rr_1f79 1
. 1 . 46 . 1 1 2 G H21 H 12.164 26.097 12.276 . . . 1.0 . . . . . . . . . . . . A . 2 G H21 . . . . . . . . . rr_1f79 1
. 1 . 47 . 1 1 2 G H22 H 13.783 25.433 12.242 . . . 1.0 . . . . . . . . . . . . A . 2 G H22 . . . . . . . . . rr_1f79 1
. 1 . 48 . 1 1 2 G H3' H 14.411 20.253 7.116 . . . 1.0 . . . . . . . . . . . . A . 2 G H3' . . . . . . . . . rr_1f79 1
. 1 . 49 . 1 1 2 G H4' H 17.353 20.998 6.788 . . . 1.0 . . . . . . . . . . . . A . 2 G H4' . . . . . . . . . rr_1f79 1
. 1 . 50 . 1 1 2 G H5' H 16.768 21.482 4.489 . . . 1.0 . . . . . . . . . . . . A . 2 G H5' . . . . . . . . . rr_1f79 1
. 1 . 51 . 1 1 2 G H5'' H 16.175 19.861 4.903 . . . 1.0 . . . . . . . . . . . . A . 2 G H5'' . . . . . . . . . rr_1f79 1
. 1 . 52 . 1 1 2 G H8 H 13.579 22.555 5.844 . . . 1.0 . . . . . . . . . . . . A . 2 G H8 . . . . . . . . . rr_1f79 1
. 1 . 53 . 1 1 2 G HO2' H 17.020 22.009 9.538 . . . 1.0 . . . . . . . . . . . . A . 2 G HO2' . . . . . . . . . rr_1f79 1
. 1 . 54 . 1 1 2 G N1 N 11.460 25.416 9.989 . . . 1.0 . . . . . . . . . . . . A . 2 G N1 . . . . . . . . . rr_1f79 1
. 1 . 55 . 1 1 2 G N2 N 12.892 25.588 11.793 . . . 1.0 . . . . . . . . . . . . A . 2 G N2 . . . . . . . . . rr_1f79 1
. 1 . 56 . 1 1 2 G N3 N 13.631 24.408 9.959 . . . 1.0 . . . . . . . . . . . . A . 2 G N3 . . . . . . . . . rr_1f79 1
. 1 . 57 . 1 1 2 G N7 N 12.073 23.676 6.807 . . . 1.0 . . . . . . . . . . . . A . 2 G N7 . . . . . . . . . rr_1f79 1
. 1 . 58 . 1 1 2 G N9 N 14.014 23.263 7.845 . . . 1.0 . . . . . . . . . . . . A . 2 G N9 . . . . . . . . . rr_1f79 1
. 1 . 59 . 1 1 2 G O2' O 16.531 21.183 9.548 . . . 1.0 . . . . . . . . . . . . A . 2 G O2' . . . . . . . . . rr_1f79 1
. 1 . 60 . 1 1 2 G O3' O 16.080 19.266 7.913 . . . 1.0 . . . . . . . . . . . . A . 2 G O3' . . . . . . . . . rr_1f79 1
. 1 . 61 . 1 1 2 G O4' O 16.043 22.591 6.837 . . . 1.0 . . . . . . . . . . . . A . 2 G O4' . . . . . . . . . rr_1f79 1
. 1 . 62 . 1 1 2 G O5' O 14.724 21.311 4.700 . . . 1.0 . . . . . . . . . . . . A . 2 G O5' . . . . . . . . . rr_1f79 1
. 1 . 63 . 1 1 2 G O6 O 9.951 25.339 8.300 . . . 1.0 . . . . . . . . . . . . A . 2 G O6 . . . . . . . . . rr_1f79 1
. 1 . 64 . 1 1 2 G OP1 O 14.786 20.090 2.513 . . . 1.0 . . . . . . . . . . . . A . 2 G OP1 . . . . . . . . . rr_1f79 1
. 1 . 65 . 1 1 2 G OP2 O 12.869 21.699 3.059 . . . 1.0 . . . . . . . . . . . . A . 2 G OP2 . . . . . . . . . rr_1f79 1
. 1 . 66 . 1 1 2 G P P 14.302 21.338 3.144 . . . 1.0 . . . . . . . . . . . . A . 2 G P . . . . . . . . . rr_1f79 1
. 1 . 67 . 1 1 3 A C1' C 12.707 20.917 12.206 . . . 1.0 . . . . . . . . . . . . A . 3 A C1' . . . . . . . . . rr_1f79 1
. 1 . 68 . 1 1 3 A C2 C 9.229 23.500 12.105 . . . 1.0 . . . . . . . . . . . . A . 3 A C2 . . . . . . . . . rr_1f79 1
. 1 . 69 . 1 1 3 A C2' C 12.330 19.641 12.962 . . . 1.0 . . . . . . . . . . . . A . 3 A C2' . . . . . . . . . rr_1f79 1
. 1 . 70 . 1 1 3 A C3' C 13.207 18.599 12.286 . . . 1.0 . . . . . . . . . . . . A . 3 A C3' . . . . . . . . . rr_1f79 1
. 1 . 71 . 1 1 3 A C4 C 10.673 22.085 11.250 . . . 1.0 . . . . . . . . . . . . A . 3 A C4 . . . . . . . . . rr_1f79 1
. 1 . 72 . 1 1 3 A C4' C 14.475 19.374 11.989 . . . 1.0 . . . . . . . . . . . . A . 3 A C4' . . . . . . . . . rr_1f79 1
. 1 . 73 . 1 1 3 A C5 C 10.054 22.082 10.033 . . . 1.0 . . . . . . . . . . . . A . 3 A C5 . . . . . . . . . rr_1f79 1
. 1 . 74 . 1 1 3 A C5' C 15.330 18.806 10.862 . . . 1.0 . . . . . . . . . . . . A . 3 A C5' . . . . . . . . . rr_1f79 1
. 1 . 75 . 1 1 3 A C6 C 8.914 22.892 9.908 . . . 1.0 . . . . . . . . . . . . A . 3 A C6 . . . . . . . . . rr_1f79 1
. 1 . 76 . 1 1 3 A C8 C 11.707 20.764 9.846 . . . 1.0 . . . . . . . . . . . . A . 3 A C8 . . . . . . . . . rr_1f79 1
. 1 . 77 . 1 1 3 A H1' H 12.777 21.764 12.888 . . . 1.0 . . . . . . . . . . . . A . 3 A H1' . . . . . . . . . rr_1f79 1
. 1 . 78 . 1 1 3 A H2 H 8.862 24.094 12.943 . . . 1.0 . . . . . . . . . . . . A . 3 A H2 . . . . . . . . . rr_1f79 1
. 1 . 79 . 1 1 3 A H2' H 11.275 19.408 12.834 . . . 1.0 . . . . . . . . . . . . A . 3 A H2' . . . . . . . . . rr_1f79 1
. 1 . 80 . 1 1 3 A H3' H 12.751 18.157 11.400 . . . 1.0 . . . . . . . . . . . . A . 3 A H3' . . . . . . . . . rr_1f79 1
. 1 . 81 . 1 1 3 A H4' H 15.087 19.466 12.886 . . . 1.0 . . . . . . . . . . . . A . 3 A H4' . . . . . . . . . rr_1f79 1
. 1 . 82 . 1 1 3 A H5' H 16.069 19.551 10.566 . . . 1.0 . . . . . . . . . . . . A . 3 A H5' . . . . . . . . . rr_1f79 1
. 1 . 83 . 1 1 3 A H5'' H 15.847 17.917 11.222 . . . 1.0 . . . . . . . . . . . . A . 3 A H5'' . . . . . . . . . rr_1f79 1
. 1 . 84 . 1 1 3 A H61 H 7.379 23.578 8.761 . . . 1.0 . . . . . . . . . . . . A . 3 A H61 . . . . . . . . . rr_1f79 1
. 1 . 85 . 1 1 3 A H62 H 8.487 22.488 7.959 . . . 1.0 . . . . . . . . . . . . A . 3 A H62 . . . . . . . . . rr_1f79 1
. 1 . 86 . 1 1 3 A H8 H 12.432 20.055 9.447 . . . 1.0 . . . . . . . . . . . . A . 3 A H8 . . . . . . . . . rr_1f79 1
. 1 . 87 . 1 1 3 A HO2' H 13.202 20.555 14.440 . . . 1.0 . . . . . . . . . . . . A . 3 A HO2' . . . . . . . . . rr_1f79 1
. 1 . 88 . 1 1 3 A N1 N 8.527 23.597 10.983 . . . 1.0 . . . . . . . . . . . . A . 3 A N1 . . . . . . . . . rr_1f79 1
. 1 . 89 . 1 1 3 A N3 N 10.313 22.779 12.350 . . . 1.0 . . . . . . . . . . . . A . 3 A N3 . . . . . . . . . rr_1f79 1
. 1 . 90 . 1 1 3 A N6 N 8.203 22.994 8.785 . . . 1.0 . . . . . . . . . . . . A . 3 A N6 . . . . . . . . . rr_1f79 1
. 1 . 91 . 1 1 3 A N7 N 10.715 21.241 9.145 . . . 1.0 . . . . . . . . . . . . A . 3 A N7 . . . . . . . . . rr_1f79 1
. 1 . 92 . 1 1 3 A N9 N 11.744 21.233 11.135 . . . 1.0 . . . . . . . . . . . . A . 3 A N9 . . . . . . . . . rr_1f79 1
. 1 . 93 . 1 1 3 A O2' O 12.670 19.762 14.345 . . . 1.0 . . . . . . . . . . . . A . 3 A O2' . . . . . . . . . rr_1f79 1
. 1 . 94 . 1 1 3 A O3' O 13.527 17.614 13.271 . . . 1.0 . . . . . . . . . . . . A . 3 A O3' . . . . . . . . . rr_1f79 1
. 1 . 95 . 1 1 3 A O4' O 13.996 20.669 11.618 . . . 1.0 . . . . . . . . . . . . A . 3 A O4' . . . . . . . . . rr_1f79 1
. 1 . 96 . 1 1 3 A O5' O 14.540 18.455 9.724 . . . 1.0 . . . . . . . . . . . . A . 3 A O5' . . . . . . . . . rr_1f79 1
. 1 . 97 . 1 1 3 A OP1 O 16.211 16.893 8.704 . . . 1.0 . . . . . . . . . . . . A . 3 A OP1 . . . . . . . . . rr_1f79 1
. 1 . 98 . 1 1 3 A OP2 O 14.193 17.715 7.356 . . . 1.0 . . . . . . . . . . . . A . 3 A OP2 . . . . . . . . . rr_1f79 1
. 1 . 99 . 1 1 3 A P P 15.248 17.964 8.364 . . . 1.0 . . . . . . . . . . . . A . 3 A P . . . . . . . . . rr_1f79 1
. 1 . 100 . 1 1 4 A C1' C 8.327 19.782 14.741 . . . 1.0 . . . . . . . . . . . . A . 4 A C1' . . . . . . . . . rr_1f79 1
. 1 . 101 . 1 1 4 A C2 C 5.405 21.721 12.193 . . . 1.0 . . . . . . . . . . . . A . 4 A C2 . . . . . . . . . rr_1f79 1
. 1 . 102 . 1 1 4 A C2' C 7.651 18.725 15.617 . . . 1.0 . . . . . . . . . . . . A . 4 A C2' . . . . . . . . . rr_1f79 1
. 1 . 103 . 1 1 4 A C3' C 8.761 17.703 15.802 . . . 1.0 . . . . . . . . . . . . A . 4 A C3' . . . . . . . . . rr_1f79 1
. 1 . 104 . 1 1 4 A C4 C 7.032 20.313 12.629 . . . 1.0 . . . . . . . . . . . . A . 4 A C4 . . . . . . . . . rr_1f79 1
. 1 . 105 . 1 1 4 A C4' C 10.005 18.566 15.867 . . . 1.0 . . . . . . . . . . . . A . 4 A C4' . . . . . . . . . rr_1f79 1
. 1 . 106 . 1 1 4 A C5 C 7.068 19.849 11.346 . . . 1.0 . . . . . . . . . . . . A . 4 A C5 . . . . . . . . . rr_1f79 1
. 1 . 107 . 1 1 4 A C5' C 11.303 17.853 15.501 . . . 1.0 . . . . . . . . . . . . A . 4 A C5' . . . . . . . . . rr_1f79 1
. 1 . 108 . 1 1 4 A C6 C 6.154 20.421 10.447 . . . 1.0 . . . . . . . . . . . . A . 4 A C6 . . . . . . . . . rr_1f79 1
. 1 . 109 . 1 1 4 A C8 C 8.565 18.770 12.394 . . . 1.0 . . . . . . . . . . . . A . 4 A C8 . . . . . . . . . rr_1f79 1
. 1 . 110 . 1 1 4 A H1' H 8.047 20.785 15.060 . . . 1.0 . . . . . . . . . . . . A . 4 A H1' . . . . . . . . . rr_1f79 1
. 1 . 111 . 1 1 4 A H2 H 4.706 22.494 12.511 . . . 1.0 . . . . . . . . . . . . A . 4 A H2 . . . . . . . . . rr_1f79 1
. 1 . 112 . 1 1 4 A H2' H 6.795 18.285 15.108 . . . 1.0 . . . . . . . . . . . . A . 4 A H2' . . . . . . . . . rr_1f79 1
. 1 . 113 . 1 1 4 A H3' H 8.795 16.951 15.014 . . . 1.0 . . . . . . . . . . . . A . 4 A H3' . . . . . . . . . rr_1f79 1
. 1 . 114 . 1 1 4 A H4' H 10.113 19.010 16.857 . . . 1.0 . . . . . . . . . . . . A . 4 A H4' . . . . . . . . . rr_1f79 1
. 1 . 115 . 1 1 4 A H5' H 12.118 18.576 15.503 . . . 1.0 . . . . . . . . . . . . A . 4 A H5' . . . . . . . . . rr_1f79 1
. 1 . 116 . 1 1 4 A H5'' H 11.508 17.084 16.245 . . . 1.0 . . . . . . . . . . . . A . 4 A H5'' . . . . . . . . . rr_1f79 1
. 1 . 117 . 1 1 4 A H61 H 5.343 20.469 8.580 . . . 1.0 . . . . . . . . . . . . A . 4 A H61 . . . . . . . . . rr_1f79 1
. 1 . 118 . 1 1 4 A H62 H 6.727 19.417 8.771 . . . 1.0 . . . . . . . . . . . . A . 4 A H62 . . . . . . . . . rr_1f79 1
. 1 . 119 . 1 1 4 A H8 H 9.371 18.078 12.637 . . . 1.0 . . . . . . . . . . . . A . 4 A H8 . . . . . . . . . rr_1f79 1
. 1 . 120 . 1 1 4 A HO2' H 7.244 20.241 16.764 . . . 1.0 . . . . . . . . . . . . A . 4 A HO2' . . . . . . . . . rr_1f79 1
. 1 . 121 . 1 1 4 A N1 N 5.326 21.369 10.915 . . . 1.0 . . . . . . . . . . . . A . 4 A N1 . . . . . . . . . rr_1f79 1
. 1 . 122 . 1 1 4 A N3 N 6.216 21.262 13.134 . . . 1.0 . . . . . . . . . . . . A . 4 A N3 . . . . . . . . . rr_1f79 1
. 1 . 123 . 1 1 4 A N6 N 6.068 20.074 9.162 . . . 1.0 . . . . . . . . . . . . A . 4 A N6 . . . . . . . . . rr_1f79 1
. 1 . 124 . 1 1 4 A N7 N 8.044 18.869 11.202 . . . 1.0 . . . . . . . . . . . . A . 4 A N7 . . . . . . . . . rr_1f79 1
. 1 . 125 . 1 1 4 A N9 N 8.000 19.617 13.313 . . . 1.0 . . . . . . . . . . . . A . 4 A N9 . . . . . . . . . rr_1f79 1
. 1 . 126 . 1 1 4 A O2' O 7.273 19.288 16.875 . . . 1.0 . . . . . . . . . . . . A . 4 A O2' . . . . . . . . . rr_1f79 1
. 1 . 127 . 1 1 4 A O3' O 8.583 17.115 17.093 . . . 1.0 . . . . . . . . . . . . A . 4 A O3' . . . . . . . . . rr_1f79 1
. 1 . 128 . 1 1 4 A O4' O 9.745 19.603 14.918 . . . 1.0 . . . . . . . . . . . . A . 4 A O4' . . . . . . . . . rr_1f79 1
. 1 . 129 . 1 1 4 A O5' O 11.225 17.242 14.210 . . . 1.0 . . . . . . . . . . . . A . 4 A O5' . . . . . . . . . rr_1f79 1
. 1 . 130 . 1 1 4 A OP1 O 13.059 15.606 14.694 . . . 1.0 . . . . . . . . . . . . A . 4 A OP1 . . . . . . . . . rr_1f79 1
. 1 . 131 . 1 1 4 A OP2 O 12.067 15.804 12.340 . . . 1.0 . . . . . . . . . . . . A . 4 A OP2 . . . . . . . . . rr_1f79 1
. 1 . 132 . 1 1 4 A P P 12.484 16.436 13.612 . . . 1.0 . . . . . . . . . . . . A . 4 A P . . . . . . . . . rr_1f79 1
. 1 . 133 . 1 1 5 G C1' C 3.498 18.877 15.499 . . . 1.0 . . . . . . . . . . . . A . 5 G C1' . . . . . . . . . rr_1f79 1
. 1 . 134 . 1 1 5 G C2 C 1.392 19.162 11.712 . . . 1.0 . . . . . . . . . . . . A . 5 G C2 . . . . . . . . . rr_1f79 1
. 1 . 135 . 1 1 5 G C2' C 2.403 18.345 16.428 . . . 1.0 . . . . . . . . . . . . A . 5 G C2' . . . . . . . . . rr_1f79 1
. 1 . 136 . 1 1 5 G C3' C 3.193 17.620 17.508 . . . 1.0 . . . . . . . . . . . . A . 5 G C3' . . . . . . . . . rr_1f79 1
. 1 . 137 . 1 1 5 G C4 C 2.887 18.281 13.115 . . . 1.0 . . . . . . . . . . . . A . 5 G C4 . . . . . . . . . rr_1f79 1
. 1 . 138 . 1 1 5 G C4' C 4.494 18.395 17.580 . . . 1.0 . . . . . . . . . . . . A . 5 G C4' . . . . . . . . . rr_1f79 1
. 1 . 139 . 1 1 5 G C5 C 3.334 17.343 12.216 . . . 1.0 . . . . . . . . . . . . A . 5 G C5 . . . . . . . . . rr_1f79 1
. 1 . 140 . 1 1 5 G C5' C 5.688 17.594 18.091 . . . 1.0 . . . . . . . . . . . . A . 5 G C5' . . . . . . . . . rr_1f79 1
. 1 . 141 . 1 1 5 G C6 C 2.760 17.291 10.915 . . . 1.0 . . . . . . . . . . . . A . 5 G C6 . . . . . . . . . rr_1f79 1
. 1 . 142 . 1 1 5 G C8 C 4.465 17.041 13.989 . . . 1.0 . . . . . . . . . . . . A . 5 G C8 . . . . . . . . . rr_1f79 1
. 1 . 143 . 1 1 5 G H1 H 1.315 18.292 9.854 . . . 1.0 . . . . . . . . . . . . A . 5 G H1 . . . . . . . . . rr_1f79 1
. 1 . 144 . 1 1 5 G H1' H 3.307 19.915 15.237 . . . 1.0 . . . . . . . . . . . . A . 5 G H1' . . . . . . . . . rr_1f79 1
. 1 . 145 . 1 1 5 G H2' H 1.747 17.656 15.898 . . . 1.0 . . . . . . . . . . . . A . 5 G H2' . . . . . . . . . rr_1f79 1
. 1 . 146 . 1 1 5 G H21 H -0.041 19.941 10.492 . . . 1.0 . . . . . . . . . . . . A . 5 G H21 . . . . . . . . . rr_1f79 1
. 1 . 147 . 1 1 5 G H22 H 0.163 20.754 12.027 . . . 1.0 . . . . . . . . . . . . A . 5 G H22 . . . . . . . . . rr_1f79 1
. 1 . 148 . 1 1 5 G H3' H 3.331 16.558 17.307 . . . 1.0 . . . . . . . . . . . . A . 5 G H3' . . . . . . . . . rr_1f79 1
. 1 . 149 . 1 1 5 G H4' H 4.377 19.285 18.197 . . . 1.0 . . . . . . . . . . . . A . 5 G H4' . . . . . . . . . rr_1f79 1
. 1 . 150 . 1 1 5 G H5' H 6.511 18.277 18.300 . . . 1.0 . . . . . . . . . . . . A . 5 G H5' . . . . . . . . . rr_1f79 1
. 1 . 151 . 1 1 5 G H5'' H 5.406 17.085 19.013 . . . 1.0 . . . . . . . . . . . . A . 5 G H5'' . . . . . . . . . rr_1f79 1
. 1 . 152 . 1 1 5 G H8 H 5.176 16.647 14.715 . . . 1.0 . . . . . . . . . . . . A . 5 G H8 . . . . . . . . . rr_1f79 1
. 1 . 153 . 1 1 5 G HO2' H 2.294 20.109 17.242 . . . 1.0 . . . . . . . . . . . . A . 5 G HO2' . . . . . . . . . rr_1f79 1
. 1 . 154 . 1 1 5 G N1 N 1.778 18.256 10.750 . . . 1.0 . . . . . . . . . . . . A . 5 G N1 . . . . . . . . . rr_1f79 1
. 1 . 155 . 1 1 5 G N2 N 0.427 20.022 11.383 . . . 1.0 . . . . . . . . . . . . A . 5 G N2 . . . . . . . . . rr_1f79 1
. 1 . 156 . 1 1 5 G N3 N 1.925 19.220 12.936 . . . 1.0 . . . . . . . . . . . . A . 5 G N3 . . . . . . . . . rr_1f79 1
. 1 . 157 . 1 1 5 G N7 N 4.336 16.562 12.783 . . . 1.0 . . . . . . . . . . . . A . 5 G N7 . . . . . . . . . rr_1f79 1
. 1 . 158 . 1 1 5 G N9 N 3.621 18.086 14.261 . . . 1.0 . . . . . . . . . . . . A . 5 G N9 . . . . . . . . . rr_1f79 1
. 1 . 159 . 1 1 5 G O2' O 1.662 19.429 16.995 . . . 1.0 . . . . . . . . . . . . A . 5 G O2' . . . . . . . . . rr_1f79 1
. 1 . 160 . 1 1 5 G O3' O 2.506 17.845 18.742 . . . 1.0 . . . . . . . . . . . . A . 5 G O3' . . . . . . . . . rr_1f79 1
. 1 . 161 . 1 1 5 G O4' O 4.733 18.794 16.230 . . . 1.0 . . . . . . . . . . . . A . 5 G O4' . . . . . . . . . rr_1f79 1
. 1 . 162 . 1 1 5 G O5' O 6.119 16.622 17.136 . . . 1.0 . . . . . . . . . . . . A . 5 G O5' . . . . . . . . . rr_1f79 1
. 1 . 163 . 1 1 5 G O6 O 3.035 16.530 9.989 . . . 1.0 . . . . . . . . . . . . A . 5 G O6 . . . . . . . . . rr_1f79 1
. 1 . 164 . 1 1 5 G OP1 O 7.669 15.418 18.693 . . . 1.0 . . . . . . . . . . . . A . 5 G OP1 . . . . . . . . . rr_1f79 1
. 1 . 165 . 1 1 5 G OP2 O 7.719 14.951 16.174 . . . 1.0 . . . . . . . . . . . . A . 5 G OP2 . . . . . . . . . rr_1f79 1
. 1 . 166 . 1 1 5 G P P 7.549 15.899 17.299 . . . 1.0 . . . . . . . . . . . . A . 5 G P . . . . . . . . . rr_1f79 1
. 1 . 167 . 1 1 6 U C1' C -0.943 15.834 14.099 . . . 1.0 . . . . . . . . . . . . A . 6 U C1' . . . . . . . . . rr_1f79 1
. 1 . 168 . 1 1 6 U C2 C 0.209 15.121 12.036 . . . 1.0 . . . . . . . . . . . . A . 6 U C2 . . . . . . . . . rr_1f79 1
. 1 . 169 . 1 1 6 U C2' C -1.646 14.738 14.917 . . . 1.0 . . . . . . . . . . . . A . 6 U C2' . . . . . . . . . rr_1f79 1
. 1 . 170 . 1 1 6 U C3' C -1.444 15.194 16.361 . . . 1.0 . . . . . . . . . . . . A . 6 U C3' . . . . . . . . . rr_1f79 1
. 1 . 171 . 1 1 6 U C4 C 2.551 14.360 12.082 . . . 1.0 . . . . . . . . . . . . A . 6 U C4 . . . . . . . . . rr_1f79 1
. 1 . 172 . 1 1 6 U C4' C -1.290 16.694 16.241 . . . 1.0 . . . . . . . . . . . . A . 6 U C4' . . . . . . . . . rr_1f79 1
. 1 . 173 . 1 1 6 U C5 C 2.539 14.597 13.508 . . . 1.0 . . . . . . . . . . . . A . 6 U C5 . . . . . . . . . rr_1f79 1
. 1 . 174 . 1 1 6 U C5' C -0.538 17.353 17.391 . . . 1.0 . . . . . . . . . . . . A . 6 U C5' . . . . . . . . . rr_1f79 1
. 1 . 175 . 1 1 6 U C6 C 1.417 15.063 14.113 . . . 1.0 . . . . . . . . . . . . A . 6 U C6 . . . . . . . . . rr_1f79 1
. 1 . 176 . 1 1 6 U H1' H -1.631 16.276 13.375 . . . 1.0 . . . . . . . . . . . . A . 6 U H1' . . . . . . . . . rr_1f79 1
. 1 . 177 . 1 1 6 U H2' H -1.179 13.769 14.747 . . . 1.0 . . . . . . . . . . . . A . 6 U H2' . . . . . . . . . rr_1f79 1
. 1 . 178 . 1 1 6 U H3 H 1.332 14.494 10.441 . . . 1.0 . . . . . . . . . . . . A . 6 U H3 . . . . . . . . . rr_1f79 1
. 1 . 179 . 1 1 6 U H3' H -0.597 14.715 16.849 . . . 1.0 . . . . . . . . . . . . A . 6 U H3' . . . . . . . . . rr_1f79 1
. 1 . 180 . 1 1 6 U H4' H -2.260 17.176 16.125 . . . 1.0 . . . . . . . . . . . . A . 6 U H4' . . . . . . . . . rr_1f79 1
. 1 . 181 . 1 1 6 U H5 H 3.433 14.400 14.100 . . . 1.0 . . . . . . . . . . . . A . 6 U H5 . . . . . . . . . rr_1f79 1
. 1 . 182 . 1 1 6 U H5' H -0.169 18.326 17.066 . . . 1.0 . . . . . . . . . . . . A . 6 U H5' . . . . . . . . . rr_1f79 1
. 1 . 183 . 1 1 6 U H5'' H -1.220 17.494 18.229 . . . 1.0 . . . . . . . . . . . . A . 6 U H5'' . . . . . . . . . rr_1f79 1
. 1 . 184 . 1 1 6 U H6 H 1.428 15.231 15.189 . . . 1.0 . . . . . . . . . . . . A . 6 U H6 . . . . . . . . . rr_1f79 1
. 1 . 185 . 1 1 6 U HO2' H -3.245 13.800 14.330 . . . 1.0 . . . . . . . . . . . . A . 6 U HO2' . . . . . . . . . rr_1f79 1
. 1 . 186 . 1 1 6 U N1 N 0.271 15.325 13.408 . . . 1.0 . . . . . . . . . . . . A . 6 U N1 . . . . . . . . . rr_1f79 1
. 1 . 187 . 1 1 6 U N3 N 1.361 14.646 11.440 . . . 1.0 . . . . . . . . . . . . A . 6 U N3 . . . . . . . . . rr_1f79 1
. 1 . 188 . 1 1 6 U O2 O -0.807 15.345 11.382 . . . 1.0 . . . . . . . . . . . . A . 6 U O2 . . . . . . . . . rr_1f79 1
. 1 . 189 . 1 1 6 U O2' O -3.040 14.698 14.598 . . . 1.0 . . . . . . . . . . . . A . 6 U O2' . . . . . . . . . rr_1f79 1
. 1 . 190 . 1 1 6 U O3' O -2.669 14.950 17.059 . . . 1.0 . . . . . . . . . . . . A . 6 U O3' . . . . . . . . . rr_1f79 1
. 1 . 191 . 1 1 6 U O4 O 3.512 13.942 11.440 . . . 1.0 . . . . . . . . . . . . A . 6 U O4 . . . . . . . . . rr_1f79 1
. 1 . 192 . 1 1 6 U O4' O -0.546 16.843 15.038 . . . 1.0 . . . . . . . . . . . . A . 6 U O4' . . . . . . . . . rr_1f79 1
. 1 . 193 . 1 1 6 U O5' O 0.567 16.551 17.818 . . . 1.0 . . . . . . . . . . . . A . 6 U O5' . . . . . . . . . rr_1f79 1
. 1 . 194 . 1 1 6 U OP1 O 0.397 17.625 20.074 . . . 1.0 . . . . . . . . . . . . A . 6 U OP1 . . . . . . . . . rr_1f79 1
. 1 . 195 . 1 1 6 U OP2 O 1.927 15.603 19.696 . . . 1.0 . . . . . . . . . . . . A . 6 U OP2 . . . . . . . . . rr_1f79 1
. 1 . 196 . 1 1 6 U P P 1.321 16.861 19.205 . . . 1.0 . . . . . . . . . . . . A . 6 U P . . . . . . . . . rr_1f79 1
. 1 . 197 . 1 1 7 U C1' C 1.553 12.379 16.850 . . . 1.0 . . . . . . . . . . . . A . 7 U C1' . . . . . . . . . rr_1f79 1
. 1 . 198 . 1 1 7 U C2 C 2.845 12.310 18.922 . . . 1.0 . . . . . . . . . . . . A . 7 U C2 . . . . . . . . . rr_1f79 1
. 1 . 199 . 1 1 7 U C2' C 1.080 10.928 16.701 . . . 1.0 . . . . . . . . . . . . A . 7 U C2' . . . . . . . . . rr_1f79 1
. 1 . 200 . 1 1 7 U C3' C -0.080 10.827 17.684 . . . 1.0 . . . . . . . . . . . . A . 7 U C3' . . . . . . . . . rr_1f79 1
. 1 . 201 . 1 1 7 U C4 C 5.293 12.593 18.927 . . . 1.0 . . . . . . . . . . . . A . 7 U C4 . . . . . . . . . rr_1f79 1
. 1 . 202 . 1 1 7 U C4' C -0.603 12.252 17.787 . . . 1.0 . . . . . . . . . . . . A . 7 U C4' . . . . . . . . . rr_1f79 1
. 1 . 203 . 1 1 7 U C5 C 5.219 12.750 17.492 . . . 1.0 . . . . . . . . . . . . A . 7 U C5 . . . . . . . . . rr_1f79 1
. 1 . 204 . 1 1 7 U C5' C -1.290 12.611 19.108 . . . 1.0 . . . . . . . . . . . . A . 7 U C5' . . . . . . . . . rr_1f79 1
. 1 . 205 . 1 1 7 U C6 C 4.022 12.684 16.861 . . . 1.0 . . . . . . . . . . . . A . 7 U C6 . . . . . . . . . rr_1f79 1
. 1 . 206 . 1 1 7 U H1' H 1.625 12.864 15.874 . . . 1.0 . . . . . . . . . . . . A . 7 U H1' . . . . . . . . . rr_1f79 1
. 1 . 207 . 1 1 7 U H2' H 1.876 10.235 16.968 . . . 1.0 . . . . . . . . . . . . A . 7 U H2' . . . . . . . . . rr_1f79 1
. 1 . 208 . 1 1 7 U H3 H 4.087 12.266 20.550 . . . 1.0 . . . . . . . . . . . . A . 7 U H3 . . . . . . . . . rr_1f79 1
. 1 . 209 . 1 1 7 U H3' H 0.204 10.401 18.646 . . . 1.0 . . . . . . . . . . . . A . 7 U H3' . . . . . . . . . rr_1f79 1
. 1 . 210 . 1 1 7 U H4' H -1.285 12.469 16.967 . . . 1.0 . . . . . . . . . . . . A . 7 U H4' . . . . . . . . . rr_1f79 1
. 1 . 211 . 1 1 7 U H5 H 6.128 12.918 16.917 . . . 1.0 . . . . . . . . . . . . A . 7 U H5 . . . . . . . . . rr_1f79 1
. 1 . 212 . 1 1 7 U H5' H -1.434 11.709 19.705 . . . 1.0 . . . . . . . . . . . . A . 7 U H5' . . . . . . . . . rr_1f79 1
. 1 . 213 . 1 1 7 U H5'' H -0.655 13.304 19.661 . . . 1.0 . . . . . . . . . . . . A . 7 U H5'' . . . . . . . . . rr_1f79 1
. 1 . 214 . 1 1 7 U H6 H 3.984 12.810 15.779 . . . 1.0 . . . . . . . . . . . . A . 7 U H6 . . . . . . . . . rr_1f79 1
. 1 . 215 . 1 1 7 U HO2' H 0.938 9.820 15.111 . . . 1.0 . . . . . . . . . . . . A . 7 U HO2' . . . . . . . . . rr_1f79 1
. 1 . 216 . 1 1 7 U N1 N 2.853 12.468 17.549 . . . 1.0 . . . . . . . . . . . . A . 7 U N1 . . . . . . . . . rr_1f79 1
. 1 . 217 . 1 1 7 U N3 N 4.076 12.381 19.546 . . . 1.0 . . . . . . . . . . . . A . 7 U N3 . . . . . . . . . rr_1f79 1
. 1 . 218 . 1 1 7 U O2 O 1.811 12.117 19.557 . . . 1.0 . . . . . . . . . . . . A . 7 U O2 . . . . . . . . . rr_1f79 1
. 1 . 219 . 1 1 7 U O2' O 0.625 10.690 15.370 . . . 1.0 . . . . . . . . . . . . A . 7 U O2' . . . . . . . . . rr_1f79 1
. 1 . 220 . 1 1 7 U O3' O -1.098 10.054 17.042 . . . 1.0 . . . . . . . . . . . . A . 7 U O3' . . . . . . . . . rr_1f79 1
. 1 . 221 . 1 1 7 U O4 O 6.324 12.635 19.595 . . . 1.0 . . . . . . . . . . . . A . 7 U O4 . . . . . . . . . rr_1f79 1
. 1 . 222 . 1 1 7 U O4' O 0.563 13.057 17.636 . . . 1.0 . . . . . . . . . . . . A . 7 U O4' . . . . . . . . . rr_1f79 1
. 1 . 223 . 1 1 7 U O5' O -2.563 13.225 18.886 . . . 1.0 . . . . . . . . . . . . A . 7 U O5' . . . . . . . . . rr_1f79 1
. 1 . 224 . 1 1 7 U OP1 O -4.005 15.256 19.156 . . . 1.0 . . . . . . . . . . . . A . 7 U OP1 . . . . . . . . . rr_1f79 1
. 1 . 225 . 1 1 7 U OP2 O -1.451 15.450 19.190 . . . 1.0 . . . . . . . . . . . . A . 7 U OP2 . . . . . . . . . rr_1f79 1
. 1 . 226 . 1 1 7 U P P -2.680 14.816 18.664 . . . 1.0 . . . . . . . . . . . . A . 7 U P . . . . . . . . . rr_1f79 1
. 1 . 227 . 1 1 8 C C1' C -2.780 9.761 12.483 . . . 1.0 . . . . . . . . . . . . A . 8 C C1' . . . . . . . . . rr_1f79 1
. 1 . 228 . 1 1 8 C C2 C -1.027 10.227 10.814 . . . 1.0 . . . . . . . . . . . . A . 8 C C2 . . . . . . . . . rr_1f79 1
. 1 . 229 . 1 1 8 C C2' C -2.717 8.298 12.931 . . . 1.0 . . . . . . . . . . . . A . 8 C C2' . . . . . . . . . rr_1f79 1
. 1 . 230 . 1 1 8 C C3' C -2.776 8.422 14.445 . . . 1.0 . . . . . . . . . . . . A . 8 C C3' . . . . . . . . . rr_1f79 1
. 1 . 231 . 1 1 8 C C4 C 1.007 11.233 11.415 . . . 1.0 . . . . . . . . . . . . A . 8 C C4 . . . . . . . . . rr_1f79 1
. 1 . 232 . 1 1 8 C C4' C -3.709 9.597 14.637 . . . 1.0 . . . . . . . . . . . . A . 8 C C4' . . . . . . . . . rr_1f79 1
. 1 . 233 . 1 1 8 C C5 C 0.593 11.310 12.781 . . . 1.0 . . . . . . . . . . . . A . 8 C C5 . . . . . . . . . rr_1f79 1
. 1 . 234 . 1 1 8 C C5' C -3.608 10.298 15.988 . . . 1.0 . . . . . . . . . . . . A . 8 C C5' . . . . . . . . . rr_1f79 1
. 1 . 235 . 1 1 8 C C6 C -0.625 10.834 13.099 . . . 1.0 . . . . . . . . . . . . A . 8 C C6 . . . . . . . . . rr_1f79 1
. 1 . 236 . 1 1 8 C H1' H -3.453 9.875 11.631 . . . 1.0 . . . . . . . . . . . . A . 8 C H1' . . . . . . . . . rr_1f79 1
. 1 . 237 . 1 1 8 C H2' H -1.787 7.836 12.612 . . . 1.0 . . . . . . . . . . . . A . 8 C H2' . . . . . . . . . rr_1f79 1
. 1 . 238 . 1 1 8 C H3' H -1.799 8.562 14.907 . . . 1.0 . . . . . . . . . . . . A . 8 C H3' . . . . . . . . . rr_1f79 1
. 1 . 239 . 1 1 8 C H4' H -4.744 9.296 14.469 . . . 1.0 . . . . . . . . . . . . A . 8 C H4' . . . . . . . . . rr_1f79 1
. 1 . 240 . 1 1 8 C H41 H 2.505 11.557 10.075 . . . 1.0 . . . . . . . . . . . . A . 8 C H41 . . . . . . . . . rr_1f79 1
. 1 . 241 . 1 1 8 C H42 H 2.795 12.166 11.690 . . . 1.0 . . . . . . . . . . . . A . 8 C H42 . . . . . . . . . rr_1f79 1
. 1 . 242 . 1 1 8 C H5 H 1.238 11.738 13.549 . . . 1.0 . . . . . . . . . . . . A . 8 C H5 . . . . . . . . . rr_1f79 1
. 1 . 243 . 1 1 8 C H5' H -2.727 10.938 15.986 . . . 1.0 . . . . . . . . . . . . A . 8 C H5' . . . . . . . . . rr_1f79 1
. 1 . 244 . 1 1 8 C H5'' H -4.494 10.916 16.135 . . . 1.0 . . . . . . . . . . . . A . 8 C H5'' . . . . . . . . . rr_1f79 1
. 1 . 245 . 1 1 8 C H6 H -0.958 10.868 14.137 . . . 1.0 . . . . . . . . . . . . A . 8 C H6 . . . . . . . . . rr_1f79 1
. 1 . 246 . 1 1 8 C HO2' H -4.285 8.130 11.792 . . . 1.0 . . . . . . . . . . . . A . 8 C HO2' . . . . . . . . . rr_1f79 1
. 1 . 247 . 1 1 8 C N1 N -1.438 10.298 12.141 . . . 1.0 . . . . . . . . . . . . A . 8 C N1 . . . . . . . . . rr_1f79 1
. 1 . 248 . 1 1 8 C N3 N 0.205 10.705 10.482 . . . 1.0 . . . . . . . . . . . . A . 8 C N3 . . . . . . . . . rr_1f79 1
. 1 . 249 . 1 1 8 C N4 N 2.198 11.689 11.029 . . . 1.0 . . . . . . . . . . . . A . 8 C N4 . . . . . . . . . rr_1f79 1
. 1 . 250 . 1 1 8 C O2 O -1.769 9.741 9.964 . . . 1.0 . . . . . . . . . . . . A . 8 C O2 . . . . . . . . . rr_1f79 1
. 1 . 251 . 1 1 8 C O2' O -3.849 7.574 12.442 . . . 1.0 . . . . . . . . . . . . A . 8 C O2' . . . . . . . . . rr_1f79 1
. 1 . 252 . 1 1 8 C O3' O -3.442 7.258 14.943 . . . 1.0 . . . . . . . . . . . . A . 8 C O3' . . . . . . . . . rr_1f79 1
. 1 . 253 . 1 1 8 C O4' O -3.312 10.496 13.600 . . . 1.0 . . . . . . . . . . . . A . 8 C O4' . . . . . . . . . rr_1f79 1
. 1 . 254 . 1 1 8 C O5' O -3.512 9.358 17.067 . . . 1.0 . . . . . . . . . . . . A . 8 C O5' . . . . . . . . . rr_1f79 1
. 1 . 255 . 1 1 8 C OP1 O -2.329 9.871 19.216 . . . 1.0 . . . . . . . . . . . . A . 8 C OP1 . . . . . . . . . rr_1f79 1
. 1 . 256 . 1 1 8 C OP2 O -1.737 7.776 17.866 . . . 1.0 . . . . . . . . . . . . A . 8 C OP2 . . . . . . . . . rr_1f79 1
. 1 . 257 . 1 1 8 C P P -2.148 9.197 17.911 . . . 1.0 . . . . . . . . . . . . A . 8 C P . . . . . . . . . rr_1f79 1
. 1 . 258 . 1 1 9 G C1' C -1.238 4.844 10.129 . . . 1.0 . . . . . . . . . . . . A . 9 G C1' . . . . . . . . . rr_1f79 1
. 1 . 259 . 1 1 9 G C2 C 1.984 6.388 7.656 . . . 1.0 . . . . . . . . . . . . A . 9 G C2 . . . . . . . . . rr_1f79 1
. 1 . 260 . 1 1 9 G C2' C -1.007 3.385 10.521 . . . 1.0 . . . . . . . . . . . . A . 9 G C2' . . . . . . . . . rr_1f79 1
. 1 . 261 . 1 1 9 G C3' C -1.639 3.331 11.900 . . . 1.0 . . . . . . . . . . . . A . 9 G C3' . . . . . . . . . rr_1f79 1
. 1 . 262 . 1 1 9 G C4 C 0.878 6.124 9.575 . . . 1.0 . . . . . . . . . . . . A . 9 G C4 . . . . . . . . . rr_1f79 1
. 1 . 263 . 1 1 9 G C4' C -2.846 4.236 11.747 . . . 1.0 . . . . . . . . . . . . A . 9 G C4' . . . . . . . . . rr_1f79 1
. 1 . 264 . 1 1 9 G C5 C 1.757 6.887 10.307 . . . 1.0 . . . . . . . . . . . . A . 9 G C5 . . . . . . . . . rr_1f79 1
. 1 . 265 . 1 1 9 G C5' C -3.364 4.841 13.046 . . . 1.0 . . . . . . . . . . . . A . 9 G C5' . . . . . . . . . rr_1f79 1
. 1 . 266 . 1 1 9 G C6 C 2.880 7.474 9.662 . . . 1.0 . . . . . . . . . . . . A . 9 G C6 . . . . . . . . . rr_1f79 1
. 1 . 267 . 1 1 9 G C8 C 0.271 6.236 11.677 . . . 1.0 . . . . . . . . . . . . A . 9 G C8 . . . . . . . . . rr_1f79 1
. 1 . 268 . 1 1 9 G H1 H 3.679 7.542 7.772 . . . 1.0 . . . . . . . . . . . . A . 9 G H1 . . . . . . . . . rr_1f79 1
. 1 . 269 . 1 1 9 G H1' H -1.456 4.931 9.066 . . . 1.0 . . . . . . . . . . . . A . 9 G H1' . . . . . . . . . rr_1f79 1
. 1 . 270 . 1 1 9 G H2' H 0.056 3.155 10.565 . . . 1.0 . . . . . . . . . . . . A . 9 G H2' . . . . . . . . . rr_1f79 1
. 1 . 271 . 1 1 9 G H21 H 3.001 6.552 5.901 . . . 1.0 . . . . . . . . . . . . A . 9 G H21 . . . . . . . . . rr_1f79 1
. 1 . 272 . 1 1 9 G H22 H 1.483 5.687 5.812 . . . 1.0 . . . . . . . . . . . . A . 9 G H22 . . . . . . . . . rr_1f79 1
. 1 . 273 . 1 1 9 G H3' H -0.964 3.639 12.699 . . . 1.0 . . . . . . . . . . . . A . 9 G H3' . . . . . . . . . rr_1f79 1
. 1 . 274 . 1 1 9 G H4' H -3.661 3.708 11.252 . . . 1.0 . . . . . . . . . . . . A . 9 G H4' . . . . . . . . . rr_1f79 1
. 1 . 275 . 1 1 9 G H5' H -4.014 5.685 12.811 . . . 1.0 . . . . . . . . . . . . A . 9 G H5' . . . . . . . . . rr_1f79 1
. 1 . 276 . 1 1 9 G H5'' H -3.940 4.088 13.584 . . . 1.0 . . . . . . . . . . . . A . 9 G H5'' . . . . . . . . . rr_1f79 1
. 1 . 277 . 1 1 9 G H8 H -0.304 6.079 12.590 . . . 1.0 . . . . . . . . . . . . A . 9 G H8 . . . . . . . . . rr_1f79 1
. 1 . 278 . 1 1 9 G HO2' H -1.927 3.025 8.845 . . . 1.0 . . . . . . . . . . . . A . 9 G HO2' . . . . . . . . . rr_1f79 1
. 1 . 279 . 1 1 9 G N1 N 2.912 7.165 8.311 . . . 1.0 . . . . . . . . . . . . A . 9 G N1 . . . . . . . . . rr_1f79 1
. 1 . 280 . 1 1 9 G N2 N 2.171 6.193 6.351 . . . 1.0 . . . . . . . . . . . . A . 9 G N2 . . . . . . . . . rr_1f79 1
. 1 . 281 . 1 1 9 G N3 N 0.926 5.831 8.252 . . . 1.0 . . . . . . . . . . . . A . 9 G N3 . . . . . . . . . rr_1f79 1
. 1 . 282 . 1 1 9 G N7 N 1.360 6.950 11.638 . . . 1.0 . . . . . . . . . . . . A . 9 G N7 . . . . . . . . . rr_1f79 1
. 1 . 283 . 1 1 9 G N9 N -0.084 5.703 10.462 . . . 1.0 . . . . . . . . . . . . A . 9 G N9 . . . . . . . . . rr_1f79 1
. 1 . 284 . 1 1 9 G O2' O -1.689 2.509 9.620 . . . 1.0 . . . . . . . . . . . . A . 9 G O2' . . . . . . . . . rr_1f79 1
. 1 . 285 . 1 1 9 G O3' O -2.123 2.000 12.094 . . . 1.0 . . . . . . . . . . . . A . 9 G O3' . . . . . . . . . rr_1f79 1
. 1 . 286 . 1 1 9 G O4' O -2.380 5.282 10.888 . . . 1.0 . . . . . . . . . . . . A . 9 G O4' . . . . . . . . . rr_1f79 1
. 1 . 287 . 1 1 9 G O5' O -2.295 5.293 13.878 . . . 1.0 . . . . . . . . . . . . A . 9 G O5' . . . . . . . . . rr_1f79 1
. 1 . 288 . 1 1 9 G O6 O 3.759 8.178 10.153 . . . 1.0 . . . . . . . . . . . . A . 9 G O6 . . . . . . . . . rr_1f79 1
. 1 . 289 . 1 1 9 G OP1 O -3.490 5.016 16.061 . . . 1.0 . . . . . . . . . . . . A . 9 G OP1 . . . . . . . . . rr_1f79 1
. 1 . 290 . 1 1 9 G OP2 O -1.315 6.364 15.917 . . . 1.0 . . . . . . . . . . . . A . 9 G OP2 . . . . . . . . . rr_1f79 1
. 1 . 291 . 1 1 9 G P P -2.601 5.938 15.320 . . . 1.0 . . . . . . . . . . . . A . 9 G P . . . . . . . . . rr_1f79 1
. 1 . 292 . 1 1 10 G C1' C 2.494 1.698 9.180 . . . 1.0 . . . . . . . . . . . . A . 10 G C1' . . . . . . . . . rr_1f79 1
. 1 . 293 . 1 1 10 G C2 C 5.564 4.761 8.868 . . . 1.0 . . . . . . . . . . . . A . 10 G C2 . . . . . . . . . rr_1f79 1
. 1 . 294 . 1 1 10 G C2' C 3.314 0.412 9.238 . . . 1.0 . . . . . . . . . . . . A . 10 G C2' . . . . . . . . . rr_1f79 1
. 1 . 295 . 1 1 10 G C3' C 2.511 -0.407 10.232 . . . 1.0 . . . . . . . . . . . . A . 10 G C3' . . . . . . . . . rr_1f79 1
. 1 . 296 . 1 1 10 G C4 C 3.961 3.626 9.925 . . . 1.0 . . . . . . . . . . . . A . 10 G C4 . . . . . . . . . rr_1f79 1
. 1 . 297 . 1 1 10 G C4' C 1.086 -0.078 9.834 . . . 1.0 . . . . . . . . . . . . A . 10 G C4' . . . . . . . . . rr_1f79 1
. 1 . 298 . 1 1 10 G C5 C 4.073 4.350 11.089 . . . 1.0 . . . . . . . . . . . . A . 10 G C5 . . . . . . . . . rr_1f79 1
. 1 . 299 . 1 1 10 G C5' C 0.039 -0.319 10.917 . . . 1.0 . . . . . . . . . . . . A . 10 G C5' . . . . . . . . . rr_1f79 1
. 1 . 300 . 1 1 10 G C6 C 5.029 5.399 11.172 . . . 1.0 . . . . . . . . . . . . A . 10 G C6 . . . . . . . . . rr_1f79 1
. 1 . 301 . 1 1 10 G C8 C 2.544 2.919 11.437 . . . 1.0 . . . . . . . . . . . . A . 10 G C8 . . . . . . . . . rr_1f79 1
. 1 . 302 . 1 1 10 G H1 H 6.438 6.261 9.960 . . . 1.0 . . . . . . . . . . . . A . 10 G H1 . . . . . . . . . rr_1f79 1
. 1 . 303 . 1 1 10 G H1' H 2.510 2.127 8.178 . . . 1.0 . . . . . . . . . . . . A . 10 G H1' . . . . . . . . . rr_1f79 1
. 1 . 304 . 1 1 10 G H2' H 4.318 0.606 9.605 . . . 1.0 . . . . . . . . . . . . A . 10 G H2' . . . . . . . . . rr_1f79 1
. 1 . 305 . 1 1 10 G H21 H 7.090 5.710 7.910 . . . 1.0 . . . . . . . . . . . . A . 10 G H21 . . . . . . . . . rr_1f79 1
. 1 . 306 . 1 1 10 G H22 H 6.217 4.532 6.954 . . . 1.0 . . . . . . . . . . . . A . 10 G H22 . . . . . . . . . rr_1f79 1
. 1 . 307 . 1 1 10 G H3' H 2.736 -0.171 11.272 . . . 1.0 . . . . . . . . . . . . A . 10 G H3' . . . . . . . . . rr_1f79 1
. 1 . 308 . 1 1 10 G H4' H 0.804 -0.631 8.937 . . . 1.0 . . . . . . . . . . . . A . 10 G H4' . . . . . . . . . rr_1f79 1
. 1 . 309 . 1 1 10 G H5' H -0.947 -0.376 10.454 . . . 1.0 . . . . . . . . . . . . A . 10 G H5' . . . . . . . . . rr_1f79 1
. 1 . 310 . 1 1 10 G H5'' H 0.253 -1.265 11.414 . . . 1.0 . . . . . . . . . . . . A . 10 G H5'' . . . . . . . . . rr_1f79 1
. 1 . 311 . 1 1 10 G H8 H 1.765 2.326 11.914 . . . 1.0 . . . . . . . . . . . . A . 10 G H8 . . . . . . . . . rr_1f79 1
. 1 . 312 . 1 1 10 G HO2' H 3.516 0.449 7.304 . . . 1.0 . . . . . . . . . . . . A . 10 G HO2' . . . . . . . . . rr_1f79 1
. 1 . 313 . 1 1 10 G N1 N 5.741 5.534 9.992 . . . 1.0 . . . . . . . . . . . . A . 10 G N1 . . . . . . . . . rr_1f79 1
. 1 . 314 . 1 1 10 G N2 N 6.352 5.024 7.826 . . . 1.0 . . . . . . . . . . . . A . 10 G N2 . . . . . . . . . rr_1f79 1
. 1 . 315 . 1 1 10 G N3 N 4.669 3.773 8.778 . . . 1.0 . . . . . . . . . . . . A . 10 G N3 . . . . . . . . . rr_1f79 1
. 1 . 316 . 1 1 10 G N7 N 3.169 3.891 12.040 . . . 1.0 . . . . . . . . . . . . A . 10 G N7 . . . . . . . . . rr_1f79 1
. 1 . 317 . 1 1 10 G N9 N 2.970 2.701 10.152 . . . 1.0 . . . . . . . . . . . . A . 10 G N9 . . . . . . . . . rr_1f79 1
. 1 . 318 . 1 1 10 G O2' O 3.340 -0.229 7.960 . . . 1.0 . . . . . . . . . . . . A . 10 G O2' . . . . . . . . . rr_1f79 1
. 1 . 319 . 1 1 10 G O3' O 2.737 -1.786 9.935 . . . 1.0 . . . . . . . . . . . . A . 10 G O3' . . . . . . . . . rr_1f79 1
. 1 . 320 . 1 1 10 G O4' O 1.146 1.318 9.520 . . . 1.0 . . . . . . . . . . . . A . 10 G O4' . . . . . . . . . rr_1f79 1
. 1 . 321 . 1 1 10 G O5' O 0.033 0.727 11.891 . . . 1.0 . . . . . . . . . . . . A . 10 G O5' . . . . . . . . . rr_1f79 1
. 1 . 322 . 1 1 10 G O6 O 5.265 6.144 12.121 . . . 1.0 . . . . . . . . . . . . A . 10 G O6 . . . . . . . . . rr_1f79 1
. 1 . 323 . 1 1 10 G OP1 O -1.976 -0.361 12.916 . . . 1.0 . . . . . . . . . . . . A . 10 G OP1 . . . . . . . . . rr_1f79 1
. 1 . 324 . 1 1 10 G OP2 O -0.746 1.529 14.132 . . . 1.0 . . . . . . . . . . . . A . 10 G OP2 . . . . . . . . . rr_1f79 1
. 1 . 325 . 1 1 10 G P P -1.227 0.915 12.875 . . . 1.0 . . . . . . . . . . . . A . 10 G P . . . . . . . . . rr_1f79 1
. 1 . 326 . 1 1 11 U C1' C 7.833 0.278 9.006 . . . 1.0 . . . . . . . . . . . . A . 11 U C1' . . . . . . . . . rr_1f79 1
. 1 . 327 . 1 1 11 U C2 C 8.305 2.311 10.294 . . . 1.0 . . . . . . . . . . . . A . 11 U C2 . . . . . . . . . rr_1f79 1
. 1 . 328 . 1 1 11 U C2' C 9.020 -0.651 9.261 . . . 1.0 . . . . . . . . . . . . A . 11 U C2' . . . . . . . . . rr_1f79 1
. 1 . 329 . 1 1 11 U C3' C 8.318 -1.890 9.793 . . . 1.0 . . . . . . . . . . . . A . 11 U C3' . . . . . . . . . rr_1f79 1
. 1 . 330 . 1 1 11 U C4 C 7.067 2.838 12.358 . . . 1.0 . . . . . . . . . . . . A . 11 U C4 . . . . . . . . . rr_1f79 1
. 1 . 331 . 1 1 11 U C4' C 7.106 -1.955 8.895 . . . 1.0 . . . . . . . . . . . . A . 11 U C4' . . . . . . . . . rr_1f79 1
. 1 . 332 . 1 1 11 U C5 C 6.327 1.612 12.158 . . . 1.0 . . . . . . . . . . . . A . 11 U C5 . . . . . . . . . rr_1f79 1
. 1 . 333 . 1 1 11 U C5' C 5.949 -2.802 9.419 . . . 1.0 . . . . . . . . . . . . A . 11 U C5' . . . . . . . . . rr_1f79 1
. 1 . 334 . 1 1 11 U C6 C 6.593 0.823 11.087 . . . 1.0 . . . . . . . . . . . . A . 11 U C6 . . . . . . . . . rr_1f79 1
. 1 . 335 . 1 1 11 U H1' H 7.997 0.887 8.116 . . . 1.0 . . . . . . . . . . . . A . 11 U H1' . . . . . . . . . rr_1f79 1
. 1 . 336 . 1 1 11 U H2' H 9.693 -0.224 9.997 . . . 1.0 . . . . . . . . . . . . A . 11 U H2' . . . . . . . . . rr_1f79 1
. 1 . 337 . 1 1 11 U H3 H 8.565 3.944 11.502 . . . 1.0 . . . . . . . . . . . . A . 11 U H3 . . . . . . . . . rr_1f79 1
. 1 . 338 . 1 1 11 U H3' H 8.075 -1.836 10.855 . . . 1.0 . . . . . . . . . . . . A . 11 U H3' . . . . . . . . . rr_1f79 1
. 1 . 339 . 1 1 11 U H4' H 7.393 -2.314 7.910 . . . 1.0 . . . . . . . . . . . . A . 11 U H4' . . . . . . . . . rr_1f79 1
. 1 . 340 . 1 1 11 U H5 H 5.548 1.325 12.865 . . . 1.0 . . . . . . . . . . . . A . 11 U H5 . . . . . . . . . rr_1f79 1
. 1 . 341 . 1 1 11 U H5' H 5.295 -3.067 8.588 . . . 1.0 . . . . . . . . . . . . A . 11 U H5' . . . . . . . . . rr_1f79 1
. 1 . 342 . 1 1 11 U H5'' H 6.350 -3.716 9.859 . . . 1.0 . . . . . . . . . . . . A . 11 U H5'' . . . . . . . . . rr_1f79 1
. 1 . 343 . 1 1 11 U H6 H 6.038 -0.106 10.963 . . . 1.0 . . . . . . . . . . . . A . 11 U H6 . . . . . . . . . rr_1f79 1
. 1 . 344 . 1 1 11 U HO2' H 10.212 -1.744 8.182 . . . 1.0 . . . . . . . . . . . . A . 11 U HO2' . . . . . . . . . rr_1f79 1
. 1 . 345 . 1 1 11 U N1 N 7.556 1.153 10.168 . . . 1.0 . . . . . . . . . . . . A . 11 U N1 . . . . . . . . . rr_1f79 1
. 1 . 346 . 1 1 11 U N3 N 8.021 3.100 11.392 . . . 1.0 . . . . . . . . . . . . A . 11 U N3 . . . . . . . . . rr_1f79 1
. 1 . 347 . 1 1 11 U O2 O 9.172 2.627 9.483 . . . 1.0 . . . . . . . . . . . . A . 11 U O2 . . . . . . . . . rr_1f79 1
. 1 . 348 . 1 1 11 U O2' O 9.703 -0.944 8.039 . . . 1.0 . . . . . . . . . . . . A . 11 U O2' . . . . . . . . . rr_1f79 1
. 1 . 349 . 1 1 11 U O3' O 9.128 -3.025 9.478 . . . 1.0 . . . . . . . . . . . . A . 11 U O3' . . . . . . . . . rr_1f79 1
. 1 . 350 . 1 1 11 U O4 O 6.904 3.621 13.291 . . . 1.0 . . . . . . . . . . . . A . 11 U O4 . . . . . . . . . rr_1f79 1
. 1 . 351 . 1 1 11 U O4' O 6.702 -0.587 8.791 . . . 1.0 . . . . . . . . . . . . A . 11 U O4' . . . . . . . . . rr_1f79 1
. 1 . 352 . 1 1 11 U O5' O 5.184 -2.108 10.406 . . . 1.0 . . . . . . . . . . . . A . 11 U O5' . . . . . . . . . rr_1f79 1
. 1 . 353 . 1 1 11 U OP1 O 3.631 -4.073 10.428 . . . 1.0 . . . . . . . . . . . . A . 11 U OP1 . . . . . . . . . rr_1f79 1
. 1 . 354 . 1 1 11 U OP2 O 3.512 -2.289 12.263 . . . 1.0 . . . . . . . . . . . . A . 11 U OP2 . . . . . . . . . rr_1f79 1
. 1 . 355 . 1 1 11 U P P 3.736 -2.658 10.848 . . . 1.0 . . . . . . . . . . . . A . 11 U P . . . . . . . . . rr_1f79 1
. 1 . 356 . 1 1 12 C C1' C 13.267 -0.464 11.440 . . . 1.0 . . . . . . . . . . . . A . 12 C C1' . . . . . . . . . rr_1f79 1
. 1 . 357 . 1 1 12 C C2 C 12.468 1.172 13.083 . . . 1.0 . . . . . . . . . . . . A . 12 C C2 . . . . . . . . . rr_1f79 1
. 1 . 358 . 1 1 12 C C2' C 14.179 -1.421 12.209 . . . 1.0 . . . . . . . . . . . . A . 12 C C2' . . . . . . . . . rr_1f79 1
. 1 . 359 . 1 1 12 C C3' C 13.562 -2.768 11.876 . . . 1.0 . . . . . . . . . . . . A . 12 C C3' . . . . . . . . . rr_1f79 1
. 1 . 360 . 1 1 12 C C4 C 10.268 1.129 13.897 . . . 1.0 . . . . . . . . . . . . A . 12 C C4 . . . . . . . . . rr_1f79 1
. 1 . 361 . 1 1 12 C C4' C 13.137 -2.593 10.432 . . . 1.0 . . . . . . . . . . . . A . 12 C C4' . . . . . . . . . rr_1f79 1
. 1 . 362 . 1 1 12 C C5 C 9.962 -0.009 13.085 . . . 1.0 . . . . . . . . . . . . A . 12 C C5 . . . . . . . . . rr_1f79 1
. 1 . 363 . 1 1 12 C C5' C 12.012 -3.514 9.983 . . . 1.0 . . . . . . . . . . . . A . 12 C C5' . . . . . . . . . rr_1f79 1
. 1 . 364 . 1 1 12 C C6 C 10.941 -0.506 12.302 . . . 1.0 . . . . . . . . . . . . A . 12 C C6 . . . . . . . . . rr_1f79 1
. 1 . 365 . 1 1 12 C H1' H 13.839 0.363 11.014 . . . 1.0 . . . . . . . . . . . . A . 12 C H1' . . . . . . . . . rr_1f79 1
. 1 . 366 . 1 1 12 C H2' H 14.140 -1.226 13.280 . . . 1.0 . . . . . . . . . . . . A . 12 C H2' . . . . . . . . . rr_1f79 1
. 1 . 367 . 1 1 12 C H3' H 12.740 -3.044 12.536 . . . 1.0 . . . . . . . . . . . . A . 12 C H3' . . . . . . . . . rr_1f79 1
. 1 . 368 . 1 1 12 C H4' H 13.988 -2.718 9.762 . . . 1.0 . . . . . . . . . . . . A . 12 C H4' . . . . . . . . . rr_1f79 1
. 1 . 369 . 1 1 12 C H41 H 9.564 2.526 15.202 . . . 1.0 . . . . . . . . . . . . A . 12 C H41 . . . . . . . . . rr_1f79 1
. 1 . 370 . 1 1 12 C H42 H 8.441 1.249 14.787 . . . 1.0 . . . . . . . . . . . . A . 12 C H42 . . . . . . . . . rr_1f79 1
. 1 . 371 . 1 1 12 C H5 H 8.973 -0.467 13.092 . . . 1.0 . . . . . . . . . . . . A . 12 C H5 . . . . . . . . . rr_1f79 1
. 1 . 372 . 1 1 12 C H5' H 11.545 -3.097 9.090 . . . 1.0 . . . . . . . . . . . . A . 12 C H5' . . . . . . . . . rr_1f79 1
. 1 . 373 . 1 1 12 C H5'' H 12.425 -4.493 9.745 . . . 1.0 . . . . . . . . . . . . A . 12 C H5'' . . . . . . . . . rr_1f79 1
. 1 . 374 . 1 1 12 C H6 H 10.739 -1.377 11.671 . . . 1.0 . . . . . . . . . . . . A . 12 C H6 . . . . . . . . . rr_1f79 1
. 1 . 375 . 1 1 12 C HO2' H 16.106 -1.420 12.470 . . . 1.0 . . . . . . . . . . . . A . 12 C HO2' . . . . . . . . . rr_1f79 1
. 1 . 376 . 1 1 12 C N1 N 12.181 0.069 12.291 . . . 1.0 . . . . . . . . . . . . A . 12 C N1 . . . . . . . . . rr_1f79 1
. 1 . 377 . 1 1 12 C N3 N 11.488 1.682 13.878 . . . 1.0 . . . . . . . . . . . . A . 12 C N3 . . . . . . . . . rr_1f79 1
. 1 . 378 . 1 1 12 C N4 N 9.350 1.678 14.693 . . . 1.0 . . . . . . . . . . . . A . 12 C N4 . . . . . . . . . rr_1f79 1
. 1 . 379 . 1 1 12 C O2 O 13.591 1.672 13.062 . . . 1.0 . . . . . . . . . . . . A . 12 C O2 . . . . . . . . . rr_1f79 1
. 1 . 380 . 1 1 12 C O2' O 15.518 -1.346 11.715 . . . 1.0 . . . . . . . . . . . . A . 12 C O2' . . . . . . . . . rr_1f79 1
. 1 . 381 . 1 1 12 C O3' O 14.613 -3.736 11.901 . . . 1.0 . . . . . . . . . . . . A . 12 C O3' . . . . . . . . . rr_1f79 1
. 1 . 382 . 1 1 12 C O4' O 12.689 -1.236 10.374 . . . 1.0 . . . . . . . . . . . . A . 12 C O4' . . . . . . . . . rr_1f79 1
. 1 . 383 . 1 1 12 C O5' O 11.022 -3.660 11.002 . . . 1.0 . . . . . . . . . . . . A . 12 C O5' . . . . . . . . . rr_1f79 1
. 1 . 384 . 1 1 12 C OP1 O 9.567 -5.435 10.004 . . . 1.0 . . . . . . . . . . . . A . 12 C OP1 . . . . . . . . . rr_1f79 1
. 1 . 385 . 1 1 12 C OP2 O 8.657 -3.847 11.797 . . . 1.0 . . . . . . . . . . . . A . 12 C OP2 . . . . . . . . . rr_1f79 1
. 1 . 386 . 1 1 12 C P P 9.521 -4.090 10.621 . . . 1.0 . . . . . . . . . . . . A . 12 C P . . . . . . . . . rr_1f79 1
. 1 . 387 . 1 1 13 U C1' C 13.846 -0.729 16.398 . . . 1.0 . . . . . . . . . . . . A . 13 U C1' . . . . . . . . . rr_1f79 1
. 1 . 388 . 1 1 13 U C2 C 11.430 -0.415 16.691 . . . 1.0 . . . . . . . . . . . . A . 13 U C2 . . . . . . . . . rr_1f79 1
. 1 . 389 . 1 1 13 U C2' C 14.325 -1.256 17.749 . . . 1.0 . . . . . . . . . . . . A . 13 U C2' . . . . . . . . . rr_1f79 1
. 1 . 390 . 1 1 13 U C3' C 14.908 -2.597 17.348 . . . 1.0 . . . . . . . . . . . . A . 13 U C3' . . . . . . . . . rr_1f79 1
. 1 . 391 . 1 1 13 U C4 C 9.804 -1.876 15.551 . . . 1.0 . . . . . . . . . . . . A . 13 U C4 . . . . . . . . . rr_1f79 1
. 1 . 392 . 1 1 13 U C4' C 15.611 -2.259 16.047 . . . 1.0 . . . . . . . . . . . . A . 13 U C4' . . . . . . . . . rr_1f79 1
. 1 . 393 . 1 1 13 U C5 C 10.926 -2.580 14.976 . . . 1.0 . . . . . . . . . . . . A . 13 U C5 . . . . . . . . . rr_1f79 1
. 1 . 394 . 1 1 13 U C5' C 15.844 -3.446 15.114 . . . 1.0 . . . . . . . . . . . . A . 13 U C5' . . . . . . . . . rr_1f79 1
. 1 . 395 . 1 1 13 U C6 C 12.194 -2.193 15.266 . . . 1.0 . . . . . . . . . . . . A . 13 U C6 . . . . . . . . . rr_1f79 1
. 1 . 396 . 1 1 13 U H1' H 13.929 0.358 16.348 . . . 1.0 . . . . . . . . . . . . A . 13 U H1' . . . . . . . . . rr_1f79 1
. 1 . 397 . 1 1 13 U H2' H 13.502 -1.372 18.444 . . . 1.0 . . . . . . . . . . . . A . 13 U H2' . . . . . . . . . rr_1f79 1
. 1 . 398 . 1 1 13 U H3 H 9.386 -0.309 16.801 . . . 1.0 . . . . . . . . . . . . A . 13 U H3 . . . . . . . . . rr_1f79 1
. 1 . 399 . 1 1 13 U H3' H 14.154 -3.375 17.237 . . . 1.0 . . . . . . . . . . . . A . 13 U H3' . . . . . . . . . rr_1f79 1
. 1 . 400 . 1 1 13 U H4' H 16.564 -1.769 16.243 . . . 1.0 . . . . . . . . . . . . A . 13 U H4' . . . . . . . . . rr_1f79 1
. 1 . 401 . 1 1 13 U H5 H 10.755 -3.424 14.308 . . . 1.0 . . . . . . . . . . . . A . 13 U H5 . . . . . . . . . rr_1f79 1
. 1 . 402 . 1 1 13 U H5' H 16.615 -3.184 14.389 . . . 1.0 . . . . . . . . . . . . A . 13 U H5' . . . . . . . . . rr_1f79 1
. 1 . 403 . 1 1 13 U H5'' H 16.185 -4.297 15.703 . . . 1.0 . . . . . . . . . . . . A . 13 U H5'' . . . . . . . . . rr_1f79 1
. 1 . 404 . 1 1 13 U H6 H 13.028 -2.741 14.828 . . . 1.0 . . . . . . . . . . . . A . 13 U H6 . . . . . . . . . rr_1f79 1
. 1 . 405 . 1 1 13 U HO2' H 15.043 0.496 18.144 . . . 1.0 . . . . . . . . . . . . A . 13 U HO2' . . . . . . . . . rr_1f79 1
. 1 . 406 . 1 1 13 U N1 N 12.455 -1.137 16.100 . . . 1.0 . . . . . . . . . . . . A . 13 U N1 . . . . . . . . . rr_1f79 1
. 1 . 407 . 1 1 13 U N3 N 10.146 -0.826 16.382 . . . 1.0 . . . . . . . . . . . . A . 13 U N3 . . . . . . . . . rr_1f79 1
. 1 . 408 . 1 1 13 U O2 O 11.639 0.528 17.454 . . . 1.0 . . . . . . . . . . . . A . 13 U O2 . . . . . . . . . rr_1f79 1
. 1 . 409 . 1 1 13 U O2' O 15.332 -0.410 18.279 . . . 1.0 . . . . . . . . . . . . A . 13 U O2' . . . . . . . . . rr_1f79 1
. 1 . 410 . 1 1 13 U O3' O 15.917 -2.968 18.301 . . . 1.0 . . . . . . . . . . . . A . 13 U O3' . . . . . . . . . rr_1f79 1
. 1 . 411 . 1 1 13 U O4 O 8.620 -2.145 15.355 . . . 1.0 . . . . . . . . . . . . A . 13 U O4 . . . . . . . . . rr_1f79 1
. 1 . 412 . 1 1 13 U O4' O 14.724 -1.323 15.421 . . . 1.0 . . . . . . . . . . . . A . 13 U O4' . . . . . . . . . rr_1f79 1
. 1 . 413 . 1 1 13 U O5' O 14.652 -3.812 14.414 . . . 1.0 . . . . . . . . . . . . A . 13 U O5' . . . . . . . . . rr_1f79 1
. 1 . 414 . 1 1 13 U OP1 O 16.075 -5.389 13.086 . . . 1.0 . . . . . . . . . . . . A . 13 U OP1 . . . . . . . . . rr_1f79 1
. 1 . 415 . 1 1 13 U OP2 O 13.525 -5.636 13.119 . . . 1.0 . . . . . . . . . . . . A . 13 U OP2 . . . . . . . . . rr_1f79 1
. 1 . 416 . 1 1 13 U P P 14.729 -4.776 13.126 . . . 1.0 . . . . . . . . . . . . A . 13 U P . . . . . . . . . rr_1f79 1
. 1 . 417 . 1 1 14 U C1' C 17.516 0.784 21.947 . . . 1.0 . . . . . . . . . . . . A . 14 U C1' . . . . . . . . . rr_1f79 1
. 1 . 418 . 1 1 14 U C2 C 18.404 2.551 20.459 . . . 1.0 . . . . . . . . . . . . A . 14 U C2 . . . . . . . . . rr_1f79 1
. 1 . 419 . 1 1 14 U C2' C 16.035 0.559 22.254 . . . 1.0 . . . . . . . . . . . . A . 14 U C2' . . . . . . . . . rr_1f79 1
. 1 . 420 . 1 1 14 U C3' C 16.055 -0.716 23.087 . . . 1.0 . . . . . . . . . . . . A . 14 U C3' . . . . . . . . . rr_1f79 1
. 1 . 421 . 1 1 14 U C4 C 18.120 2.394 18.014 . . . 1.0 . . . . . . . . . . . . A . 14 U C4 . . . . . . . . . rr_1f79 1
. 1 . 422 . 1 1 14 U C4' C 17.288 -1.479 22.606 . . . 1.0 . . . . . . . . . . . . A . 14 U C4' . . . . . . . . . rr_1f79 1
. 1 . 423 . 1 1 14 U C5 C 17.424 1.147 18.236 . . . 1.0 . . . . . . . . . . . . A . 14 U C5 . . . . . . . . . rr_1f79 1
. 1 . 424 . 1 1 14 U C5' C 17.032 -2.631 21.618 . . . 1.0 . . . . . . . . . . . . A . 14 U C5' . . . . . . . . . rr_1f79 1
. 1 . 425 . 1 1 14 U C6 C 17.259 0.676 19.493 . . . 1.0 . . . . . . . . . . . . A . 14 U C6 . . . . . . . . . rr_1f79 1
. 1 . 426 . 1 1 14 U H1' H 17.982 1.419 22.705 . . . 1.0 . . . . . . . . . . . . A . 14 U H1' . . . . . . . . . rr_1f79 1
. 1 . 427 . 1 1 14 U H2' H 15.451 0.426 21.350 . . . 1.0 . . . . . . . . . . . . A . 14 U H2' . . . . . . . . . rr_1f79 1
. 1 . 428 . 1 1 14 U H3 H 19.061 3.889 19.054 . . . 1.0 . . . . . . . . . . . . A . 14 U H3 . . . . . . . . . rr_1f79 1
. 1 . 429 . 1 1 14 U H3' H 15.141 -1.298 23.007 . . . 1.0 . . . . . . . . . . . . A . 14 U H3' . . . . . . . . . rr_1f79 1
. 1 . 430 . 1 1 14 U H4' H 17.828 -1.879 23.465 . . . 1.0 . . . . . . . . . . . . A . 14 U H4' . . . . . . . . . rr_1f79 1
. 1 . 431 . 1 1 14 U H5 H 17.008 0.590 17.393 . . . 1.0 . . . . . . . . . . . . A . 14 U H5 . . . . . . . . . rr_1f79 1
. 1 . 432 . 1 1 14 U H5' H 17.893 -2.719 20.960 . . . 1.0 . . . . . . . . . . . . A . 14 U H5' . . . . . . . . . rr_1f79 1
. 1 . 433 . 1 1 14 U H5'' H 16.928 -3.561 22.180 . . . 1.0 . . . . . . . . . . . . A . 14 U H5'' . . . . . . . . . rr_1f79 1
. 1 . 434 . 1 1 14 U H6 H 16.728 -0.269 19.636 . . . 1.0 . . . . . . . . . . . . A . 14 U H6 . . . . . . . . . rr_1f79 1
. 1 . 435 . 1 1 14 U HO2' H 15.545 2.428 22.467 . . . 1.0 . . . . . . . . . . . . A . 14 U HO2' . . . . . . . . . rr_1f79 1
. 1 . 436 . 1 1 14 U N1 N 17.727 1.346 20.589 . . . 1.0 . . . . . . . . . . . . A . 14 U N1 . . . . . . . . . rr_1f79 1
. 1 . 437 . 1 1 14 U N3 N 18.567 3.015 19.167 . . . 1.0 . . . . . . . . . . . . A . 14 U N3 . . . . . . . . . rr_1f79 1
. 1 . 438 . 1 1 14 U O2 O 18.834 3.173 21.427 . . . 1.0 . . . . . . . . . . . . A . 14 U O2 . . . . . . . . . rr_1f79 1
. 1 . 439 . 1 1 14 U O2' O 15.529 1.648 23.027 . . . 1.0 . . . . . . . . . . . . A . 14 U O2' . . . . . . . . . rr_1f79 1
. 1 . 440 . 1 1 14 U O3' O 16.301 -0.318 24.438 . . . 1.0 . . . . . . . . . . . . A . 14 U O3' . . . . . . . . . rr_1f79 1
. 1 . 441 . 1 1 14 U O4 O 18.329 2.907 16.917 . . . 1.0 . . . . . . . . . . . . A . 14 U O4 . . . . . . . . . rr_1f79 1
. 1 . 442 . 1 1 14 U O4' O 18.124 -0.509 21.972 . . . 1.0 . . . . . . . . . . . . A . 14 U O4' . . . . . . . . . rr_1f79 1
. 1 . 443 . 1 1 14 U O5' O 15.860 -2.459 20.807 . . . 1.0 . . . . . . . . . . . . A . 14 U O5' . . . . . . . . . rr_1f79 1
. 1 . 444 . 1 1 14 U OP1 O 16.380 -4.768 19.977 . . . 1.0 . . . . . . . . . . . . A . 14 U OP1 . . . . . . . . . rr_1f79 1
. 1 . 445 . 1 1 14 U OP2 O 14.030 -3.790 19.726 . . . 1.0 . . . . . . . . . . . . A . 14 U OP2 . . . . . . . . . rr_1f79 1
. 1 . 446 . 1 1 14 U P P 15.499 -3.607 19.723 . . . 1.0 . . . . . . . . . . . . A . 14 U P . . . . . . . . . rr_1f79 1
. 1 . 447 . 1 1 15 C C1' C 10.951 0.531 22.961 . . . 1.0 . . . . . . . . . . . . A . 15 C C1' . . . . . . . . . rr_1f79 1
. 1 . 448 . 1 1 15 C C2 C 10.316 -1.822 22.727 . . . 1.0 . . . . . . . . . . . . A . 15 C C2 . . . . . . . . . rr_1f79 1
. 1 . 449 . 1 1 15 C C2' C 10.597 0.637 24.434 . . . 1.0 . . . . . . . . . . . . A . 15 C C2' . . . . . . . . . rr_1f79 1
. 1 . 450 . 1 1 15 C C3' C 10.955 2.085 24.712 . . . 1.0 . . . . . . . . . . . . A . 15 C C3' . . . . . . . . . rr_1f79 1
. 1 . 451 . 1 1 15 C C4 C 11.863 -3.444 22.038 . . . 1.0 . . . . . . . . . . . . A . 15 C C4 . . . . . . . . . rr_1f79 1
. 1 . 452 . 1 1 15 C C4' C 12.237 2.281 23.903 . . . 1.0 . . . . . . . . . . . . A . 15 C C4' . . . . . . . . . rr_1f79 1
. 1 . 453 . 1 1 15 C C5 C 12.876 -2.446 21.888 . . . 1.0 . . . . . . . . . . . . A . 15 C C5 . . . . . . . . . rr_1f79 1
. 1 . 454 . 1 1 15 C C5' C 13.537 1.971 24.661 . . . 1.0 . . . . . . . . . . . . A . 15 C C5' . . . . . . . . . rr_1f79 1
. 1 . 455 . 1 1 15 C C6 C 12.551 -1.174 22.161 . . . 1.0 . . . . . . . . . . . . A . 15 C C6 . . . . . . . . . rr_1f79 1
. 1 . 456 . 1 1 15 C H1' H 10.139 0.893 22.330 . . . 1.0 . . . . . . . . . . . . A . 15 C H1' . . . . . . . . . rr_1f79 1
. 1 . 457 . 1 1 15 C H2' H 11.207 -0.045 25.029 . . . 1.0 . . . . . . . . . . . . A . 15 C H2' . . . . . . . . . rr_1f79 1
. 1 . 458 . 1 1 15 C H3' H 11.067 2.309 25.773 . . . 1.0 . . . . . . . . . . . . A . 15 C H3' . . . . . . . . . rr_1f79 1
. 1 . 459 . 1 1 15 C H4' H 12.290 3.299 23.513 . . . 1.0 . . . . . . . . . . . . A . 15 C H4' . . . . . . . . . rr_1f79 1
. 1 . 460 . 1 1 15 C H41 H 11.394 -5.421 21.921 . . . 1.0 . . . . . . . . . . . . A . 15 C H41 . . . . . . . . . rr_1f79 1
. 1 . 461 . 1 1 15 C H42 H 13.016 -5.003 21.417 . . . 1.0 . . . . . . . . . . . . A . 15 C H42 . . . . . . . . . rr_1f79 1
. 1 . 462 . 1 1 15 C H5 H 13.889 -2.701 21.601 . . . 1.0 . . . . . . . . . . . . A . 15 C H5 . . . . . . . . . rr_1f79 1
. 1 . 463 . 1 1 15 C H5' H 14.332 2.625 24.296 . . . 1.0 . . . . . . . . . . . . A . 15 C H5' . . . . . . . . . rr_1f79 1
. 1 . 464 . 1 1 15 C H5'' H 13.389 2.158 25.724 . . . 1.0 . . . . . . . . . . . . A . 15 C H5'' . . . . . . . . . rr_1f79 1
. 1 . 465 . 1 1 15 C H6 H 13.289 -0.386 22.010 . . . 1.0 . . . . . . . . . . . . A . 15 C H6 . . . . . . . . . rr_1f79 1
. 1 . 466 . 1 1 15 C HO2' H 8.734 0.805 23.902 . . . 1.0 . . . . . . . . . . . . A . 15 C HO2' . . . . . . . . . rr_1f79 1
. 1 . 467 . 1 1 15 C N1 N 11.297 -0.852 22.582 . . . 1.0 . . . . . . . . . . . . A . 15 C N1 . . . . . . . . . rr_1f79 1
. 1 . 468 . 1 1 15 C N3 N 10.630 -3.116 22.445 . . . 1.0 . . . . . . . . . . . . A . 15 C N3 . . . . . . . . . rr_1f79 1
. 1 . 469 . 1 1 15 C N4 N 12.111 -4.726 21.771 . . . 1.0 . . . . . . . . . . . . A . 15 C N4 . . . . . . . . . rr_1f79 1
. 1 . 470 . 1 1 15 C O2 O 9.188 -1.509 23.102 . . . 1.0 . . . . . . . . . . . . A . 15 C O2 . . . . . . . . . rr_1f79 1
. 1 . 471 . 1 1 15 C O2' O 9.201 0.408 24.641 . . . 1.0 . . . . . . . . . . . . A . 15 C O2' . . . . . . . . . rr_1f79 1
. 1 . 472 . 1 1 15 C O3' O 9.933 2.885 24.103 . . . 1.0 . . . . . . . . . . . . A . 15 C O3' . . . . . . . . . rr_1f79 1
. 1 . 473 . 1 1 15 C O4' O 12.106 1.373 22.797 . . . 1.0 . . . . . . . . . . . . A . 15 C O4' . . . . . . . . . rr_1f79 1
. 1 . 474 . 1 1 15 C O5' O 13.950 0.610 24.482 . . . 1.0 . . . . . . . . . . . . A . 15 C O5' . . . . . . . . . rr_1f79 1
. 1 . 475 . 1 1 15 C OP1 O 15.501 1.000 26.413 . . . 1.0 . . . . . . . . . . . . A . 15 C OP1 . . . . . . . . . rr_1f79 1
. 1 . 476 . 1 1 15 C OP2 O 14.569 -1.338 25.935 . . . 1.0 . . . . . . . . . . . . A . 15 C OP2 . . . . . . . . . rr_1f79 1
. 1 . 477 . 1 1 15 C P P 15.073 -0.035 25.445 . . . 1.0 . . . . . . . . . . . . A . 15 C P . . . . . . . . . rr_1f79 1
. 1 . 478 . 1 1 16 G C1' C 14.147 6.513 21.719 . . . 1.0 . . . . . . . . . . . . A . 16 G C1' . . . . . . . . . rr_1f79 1
. 1 . 479 . 1 1 16 G C2 C 12.486 2.831 20.030 . . . 1.0 . . . . . . . . . . . . A . 16 G C2 . . . . . . . . . rr_1f79 1
. 1 . 480 . 1 1 16 G C2' C 13.782 7.949 21.358 . . . 1.0 . . . . . . . . . . . . A . 16 G C2' . . . . . . . . . rr_1f79 1
. 1 . 481 . 1 1 16 G C3' C 12.286 7.830 21.173 . . . 1.0 . . . . . . . . . . . . A . 16 G C3' . . . . . . . . . rr_1f79 1
. 1 . 482 . 1 1 16 G C4 C 13.889 4.565 20.095 . . . 1.0 . . . . . . . . . . . . A . 16 G C4 . . . . . . . . . rr_1f79 1
. 1 . 483 . 1 1 16 G C4' C 11.904 6.911 22.324 . . . 1.0 . . . . . . . . . . . . A . 16 G C4' . . . . . . . . . rr_1f79 1
. 1 . 484 . 1 1 16 G C5 C 14.541 4.205 18.938 . . . 1.0 . . . . . . . . . . . . A . 16 G C5 . . . . . . . . . rr_1f79 1
. 1 . 485 . 1 1 16 G C5' C 10.568 6.176 22.174 . . . 1.0 . . . . . . . . . . . . A . 16 G C5' . . . . . . . . . rr_1f79 1
. 1 . 486 . 1 1 16 G C6 C 14.140 3.037 18.239 . . . 1.0 . . . . . . . . . . . . A . 16 G C6 . . . . . . . . . rr_1f79 1
. 1 . 487 . 1 1 16 G C8 C 15.480 5.985 19.603 . . . 1.0 . . . . . . . . . . . . A . 16 G C8 . . . . . . . . . rr_1f79 1
. 1 . 488 . 1 1 16 G H1 H 12.737 1.559 18.441 . . . 1.0 . . . . . . . . . . . . A . 16 G H1 . . . . . . . . . rr_1f79 1
. 1 . 489 . 1 1 16 G H1' H 14.974 6.489 22.429 . . . 1.0 . . . . . . . . . . . . A . 16 G H1' . . . . . . . . . rr_1f79 1
. 1 . 490 . 1 1 16 G H2' H 14.267 8.263 20.436 . . . 1.0 . . . . . . . . . . . . A . 16 G H2' . . . . . . . . . rr_1f79 1
. 1 . 491 . 1 1 16 G H21 H 11.143 1.306 19.946 . . . 1.0 . . . . . . . . . . . . A . 16 G H21 . . . . . . . . . rr_1f79 1
. 1 . 492 . 1 1 16 G H22 H 11.023 2.337 21.356 . . . 1.0 . . . . . . . . . . . . A . 16 G H22 . . . . . . . . . rr_1f79 1
. 1 . 493 . 1 1 16 G H3' H 12.002 7.438 20.198 . . . 1.0 . . . . . . . . . . . . A . 16 G H3' . . . . . . . . . rr_1f79 1
. 1 . 494 . 1 1 16 G H4' H 11.909 7.458 23.269 . . . 1.0 . . . . . . . . . . . . A . 16 G H4' . . . . . . . . . rr_1f79 1
. 1 . 495 . 1 1 16 G H5' H 9.789 6.734 22.697 . . . 1.0 . . . . . . . . . . . . A . 16 G H5' . . . . . . . . . rr_1f79 1
. 1 . 496 . 1 1 16 G H5'' H 10.308 6.112 21.116 . . . 1.0 . . . . . . . . . . . . A . 16 G H5'' . . . . . . . . . rr_1f79 1
. 1 . 497 . 1 1 16 G H8 H 16.109 6.871 19.645 . . . 1.0 . . . . . . . . . . . . A . 16 G H8 . . . . . . . . . rr_1f79 1
. 1 . 498 . 1 1 16 G HO2' H 14.899 8.519 22.843 . . . 1.0 . . . . . . . . . . . . A . 16 G HO2' . . . . . . . . . rr_1f79 1
. 1 . 499 . 1 1 16 G N1 N 13.086 2.403 18.870 . . . 1.0 . . . . . . . . . . . . A . 16 G N1 . . . . . . . . . rr_1f79 1
. 1 . 500 . 1 1 16 G N2 N 11.469 2.099 20.482 . . . 1.0 . . . . . . . . . . . . A . 16 G N2 . . . . . . . . . rr_1f79 1
. 1 . 501 . 1 1 16 G N3 N 12.855 3.929 20.702 . . . 1.0 . . . . . . . . . . . . A . 16 G N3 . . . . . . . . . rr_1f79 1
. 1 . 502 . 1 1 16 G N7 N 15.547 5.113 18.640 . . . 1.0 . . . . . . . . . . . . A . 16 G N7 . . . . . . . . . rr_1f79 1
. 1 . 503 . 1 1 16 G N9 N 14.504 5.721 20.526 . . . 1.0 . . . . . . . . . . . . A . 16 G N9 . . . . . . . . . rr_1f79 1
. 1 . 504 . 1 1 16 G O2' O 14.089 8.835 22.437 . . . 1.0 . . . . . . . . . . . . A . 16 G O2' . . . . . . . . . rr_1f79 1
. 1 . 505 . 1 1 16 G O3' O 11.728 9.124 21.418 . . . 1.0 . . . . . . . . . . . . A . 16 G O3' . . . . . . . . . rr_1f79 1
. 1 . 506 . 1 1 16 G O4' O 12.972 5.952 22.337 . . . 1.0 . . . . . . . . . . . . A . 16 G O4' . . . . . . . . . rr_1f79 1
. 1 . 507 . 1 1 16 G O5' O 10.642 4.850 22.711 . . . 1.0 . . . . . . . . . . . . A . 16 G O5' . . . . . . . . . rr_1f79 1
. 1 . 508 . 1 1 16 G O6 O 14.608 2.569 17.204 . . . 1.0 . . . . . . . . . . . . A . 16 G O6 . . . . . . . . . rr_1f79 1
. 1 . 509 . 1 1 16 G OP1 O 10.964 4.892 25.198 . . . 1.0 . . . . . . . . . . . . A . 16 G OP1 . . . . . . . . . rr_1f79 1
. 1 . 510 . 1 1 16 G OP2 O 8.615 5.016 24.179 . . . 1.0 . . . . . . . . . . . . A . 16 G OP2 . . . . . . . . . rr_1f79 1
. 1 . 511 . 1 1 16 G P P 10.000 4.495 24.147 . . . 1.0 . . . . . . . . . . . . A . 16 G P . . . . . . . . . rr_1f79 1
. 1 . 512 . 1 1 17 G C1' C 14.246 8.217 17.530 . . . 1.0 . . . . . . . . . . . . A . 17 G C1' . . . . . . . . . rr_1f79 1
. 1 . 513 . 1 1 17 G C2 C 13.715 4.405 15.441 . . . 1.0 . . . . . . . . . . . . A . 17 G C2 . . . . . . . . . rr_1f79 1
. 1 . 514 . 1 1 17 G C2' C 14.422 9.376 16.550 . . . 1.0 . . . . . . . . . . . . A . 17 G C2' . . . . . . . . . rr_1f79 1
. 1 . 515 . 1 1 17 G C3' C 13.667 10.486 17.260 . . . 1.0 . . . . . . . . . . . . A . 17 G C3' . . . . . . . . . rr_1f79 1
. 1 . 516 . 1 1 17 G C4 C 13.017 6.209 16.554 . . . 1.0 . . . . . . . . . . . . A . 17 G C4 . . . . . . . . . rr_1f79 1
. 1 . 517 . 1 1 17 G C4' C 14.054 10.260 18.708 . . . 1.0 . . . . . . . . . . . . A . 17 G C4' . . . . . . . . . rr_1f79 1
. 1 . 518 . 1 1 17 G C5 C 11.692 5.838 16.520 . . . 1.0 . . . . . . . . . . . . A . 17 G C5 . . . . . . . . . rr_1f79 1
. 1 . 519 . 1 1 17 G C5' C 13.110 10.886 19.743 . . . 1.0 . . . . . . . . . . . . A . 17 G C5' . . . . . . . . . rr_1f79 1
. 1 . 520 . 1 1 17 G C6 C 11.317 4.624 15.884 . . . 1.0 . . . . . . . . . . . . A . 17 G C6 . . . . . . . . . rr_1f79 1
. 1 . 521 . 1 1 17 G C8 C 11.758 7.686 17.556 . . . 1.0 . . . . . . . . . . . . A . 17 G C8 . . . . . . . . . rr_1f79 1
. 1 . 522 . 1 1 17 G H1 H 12.241 3.086 14.895 . . . 1.0 . . . . . . . . . . . . A . 17 G H1 . . . . . . . . . rr_1f79 1
. 1 . 523 . 1 1 17 G H1' H 15.127 7.578 17.544 . . . 1.0 . . . . . . . . . . . . A . 17 G H1' . . . . . . . . . rr_1f79 1
. 1 . 524 . 1 1 17 G H2' H 13.974 9.147 15.585 . . . 1.0 . . . . . . . . . . . . A . 17 G H2' . . . . . . . . . rr_1f79 1
. 1 . 525 . 1 1 17 G H21 H 14.371 2.794 14.386 . . . 1.0 . . . . . . . . . . . . A . 17 G H21 . . . . . . . . . rr_1f79 1
. 1 . 526 . 1 1 17 G H22 H 15.620 3.880 14.954 . . . 1.0 . . . . . . . . . . . . A . 17 G H22 . . . . . . . . . rr_1f79 1
. 1 . 527 . 1 1 17 G H3' H 12.592 10.460 17.087 . . . 1.0 . . . . . . . . . . . . A . 17 G H3' . . . . . . . . . rr_1f79 1
. 1 . 528 . 1 1 17 G H4' H 15.063 10.631 18.891 . . . 1.0 . . . . . . . . . . . . A . 17 G H4' . . . . . . . . . rr_1f79 1
. 1 . 529 . 1 1 17 G H5' H 13.309 10.445 20.718 . . . 1.0 . . . . . . . . . . . . A . 17 G H5' . . . . . . . . . rr_1f79 1
. 1 . 530 . 1 1 17 G H5'' H 13.310 11.956 19.796 . . . 1.0 . . . . . . . . . . . . A . 17 G H5'' . . . . . . . . . rr_1f79 1
. 1 . 531 . 1 1 17 G H8 H 11.473 8.579 18.099 . . . 1.0 . . . . . . . . . . . . A . 17 G H8 . . . . . . . . . rr_1f79 1
. 1 . 532 . 1 1 17 G HO2' H 16.271 9.310 17.151 . . . 1.0 . . . . . . . . . . . . A . 17 G HO2' . . . . . . . . . rr_1f79 1
. 1 . 533 . 1 1 17 G N1 N 12.414 3.962 15.364 . . . 1.0 . . . . . . . . . . . . A . 17 G N1 . . . . . . . . . rr_1f79 1
. 1 . 534 . 1 1 17 G N2 N 14.644 3.631 14.882 . . . 1.0 . . . . . . . . . . . . A . 17 G N2 . . . . . . . . . rr_1f79 1
. 1 . 535 . 1 1 17 G N3 N 14.082 5.546 16.037 . . . 1.0 . . . . . . . . . . . . A . 17 G N3 . . . . . . . . . rr_1f79 1
. 1 . 536 . 1 1 17 G N7 N 10.904 6.786 17.161 . . . 1.0 . . . . . . . . . . . . A . 17 G N7 . . . . . . . . . rr_1f79 1
. 1 . 537 . 1 1 17 G N9 N 13.050 7.410 17.229 . . . 1.0 . . . . . . . . . . . . A . 17 G N9 . . . . . . . . . rr_1f79 1
. 1 . 538 . 1 1 17 G O2' O 15.806 9.714 16.415 . . . 1.0 . . . . . . . . . . . . A . 17 G O2' . . . . . . . . . rr_1f79 1
. 1 . 539 . 1 1 17 G O3' O 14.246 11.727 16.849 . . . 1.0 . . . . . . . . . . . . A . 17 G O3' . . . . . . . . . rr_1f79 1
. 1 . 540 . 1 1 17 G O4' O 14.063 8.831 18.827 . . . 1.0 . . . . . . . . . . . . A . 17 G O4' . . . . . . . . . rr_1f79 1
. 1 . 541 . 1 1 17 G O5' O 11.724 10.694 19.416 . . . 1.0 . . . . . . . . . . . . A . 17 G O5' . . . . . . . . . rr_1f79 1
. 1 . 542 . 1 1 17 G O6 O 10.192 4.140 15.762 . . . 1.0 . . . . . . . . . . . . A . 17 G O6 . . . . . . . . . rr_1f79 1
. 1 . 543 . 1 1 17 G OP1 O 9.828 10.718 21.061 . . . 1.0 . . . . . . . . . . . . A . 17 G OP1 . . . . . . . . . rr_1f79 1
. 1 . 544 . 1 1 17 G OP2 O 10.174 8.723 19.496 . . . 1.0 . . . . . . . . . . . . A . 17 G OP2 . . . . . . . . . rr_1f79 1
. 1 . 545 . 1 1 17 G P P 10.738 9.800 20.340 . . . 1.0 . . . . . . . . . . . . A . 17 G P . . . . . . . . . rr_1f79 1
. 1 . 546 . 1 1 18 A C1' C 13.845 8.020 12.409 . . . 1.0 . . . . . . . . . . . . A . 18 A C1' . . . . . . . . . rr_1f79 1
. 1 . 547 . 1 1 18 A C2 C 11.336 4.514 11.918 . . . 1.0 . . . . . . . . . . . . A . 18 A C2 . . . . . . . . . rr_1f79 1
. 1 . 548 . 1 1 18 A C2' C 13.661 8.787 11.097 . . . 1.0 . . . . . . . . . . . . A . 18 A C2' . . . . . . . . . rr_1f79 1
. 1 . 549 . 1 1 18 A C3' C 13.796 10.228 11.558 . . . 1.0 . . . . . . . . . . . . A . 18 A C3' . . . . . . . . . rr_1f79 1
. 1 . 550 . 1 1 18 A C4 C 11.862 6.477 12.752 . . . 1.0 . . . . . . . . . . . . A . 18 A C4 . . . . . . . . . rr_1f79 1
. 1 . 551 . 1 1 18 A C4' C 14.880 10.122 12.608 . . . 1.0 . . . . . . . . . . . . A . 18 A C4' . . . . . . . . . rr_1f79 1
. 1 . 552 . 1 1 18 A C5 C 10.721 6.541 13.498 . . . 1.0 . . . . . . . . . . . . A . 18 A C5 . . . . . . . . . rr_1f79 1
. 1 . 553 . 1 1 18 A C5' C 14.954 11.287 13.590 . . . 1.0 . . . . . . . . . . . . A . 18 A C5' . . . . . . . . . rr_1f79 1
. 1 . 554 . 1 1 18 A C6 C 9.843 5.450 13.399 . . . 1.0 . . . . . . . . . . . . A . 18 A C6 . . . . . . . . . rr_1f79 1
. 1 . 555 . 1 1 18 A C8 C 11.777 8.337 13.901 . . . 1.0 . . . . . . . . . . . . A . 18 A C8 . . . . . . . . . rr_1f79 1
. 1 . 556 . 1 1 18 A H1' H 14.449 7.128 12.255 . . . 1.0 . . . . . . . . . . . . A . 18 A H1' . . . . . . . . . rr_1f79 1
. 1 . 557 . 1 1 18 A H2 H 11.560 3.663 11.274 . . . 1.0 . . . . . . . . . . . . A . 18 A H2 . . . . . . . . . rr_1f79 1
. 1 . 558 . 1 1 18 A H2' H 12.680 8.600 10.672 . . . 1.0 . . . . . . . . . . . . A . 18 A H2' . . . . . . . . . rr_1f79 1
. 1 . 559 . 1 1 18 A H3' H 12.866 10.652 11.936 . . . 1.0 . . . . . . . . . . . . A . 18 A H3' . . . . . . . . . rr_1f79 1
. 1 . 560 . 1 1 18 A H4' H 15.856 9.993 12.140 . . . 1.0 . . . . . . . . . . . . A . 18 A H4' . . . . . . . . . rr_1f79 1
. 1 . 561 . 1 1 18 A H5' H 15.824 11.154 14.233 . . . 1.0 . . . . . . . . . . . . A . 18 A H5' . . . . . . . . . rr_1f79 1
. 1 . 562 . 1 1 18 A H5'' H 15.065 12.215 13.031 . . . 1.0 . . . . . . . . . . . . A . 18 A H5'' . . . . . . . . . rr_1f79 1
. 1 . 563 . 1 1 18 A H61 H 8.138 4.526 14.014 . . . 1.0 . . . . . . . . . . . . A . 18 A H61 . . . . . . . . . rr_1f79 1
. 1 . 564 . 1 1 18 A H62 H 8.377 6.146 14.627 . . . 1.0 . . . . . . . . . . . . A . 18 A H62 . . . . . . . . . rr_1f79 1
. 1 . 565 . 1 1 18 A H8 H 12.052 9.315 14.292 . . . 1.0 . . . . . . . . . . . . A . 18 A H8 . . . . . . . . . rr_1f79 1
. 1 . 566 . 1 1 18 A HO2' H 14.924 7.533 10.312 . . . 1.0 . . . . . . . . . . . . A . 18 A HO2' . . . . . . . . . rr_1f79 1
. 1 . 567 . 1 1 18 A N1 N 10.191 4.440 12.586 . . . 1.0 . . . . . . . . . . . . A . 18 A N1 . . . . . . . . . rr_1f79 1
. 1 . 568 . 1 1 18 A N3 N 12.244 5.479 11.925 . . . 1.0 . . . . . . . . . . . . A . 18 A N3 . . . . . . . . . rr_1f79 1
. 1 . 569 . 1 1 18 A N6 N 8.693 5.367 14.067 . . . 1.0 . . . . . . . . . . . . A . 18 A N6 . . . . . . . . . rr_1f79 1
. 1 . 570 . 1 1 18 A N7 N 10.673 7.724 14.226 . . . 1.0 . . . . . . . . . . . . A . 18 A N7 . . . . . . . . . rr_1f79 1
. 1 . 571 . 1 1 18 A N9 N 12.551 7.639 13.009 . . . 1.0 . . . . . . . . . . . . A . 18 A N9 . . . . . . . . . rr_1f79 1
. 1 . 572 . 1 1 18 A O2' O 14.700 8.456 10.172 . . . 1.0 . . . . . . . . . . . . A . 18 A O2' . . . . . . . . . rr_1f79 1
. 1 . 573 . 1 1 18 A O3' O 14.321 10.980 10.463 . . . 1.0 . . . . . . . . . . . . A . 18 A O3' . . . . . . . . . rr_1f79 1
. 1 . 574 . 1 1 18 A O4' O 14.534 8.920 13.301 . . . 1.0 . . . . . . . . . . . . A . 18 A O4' . . . . . . . . . rr_1f79 1
. 1 . 575 . 1 1 18 A O5' O 13.784 11.374 14.405 . . . 1.0 . . . . . . . . . . . . A . 18 A O5' . . . . . . . . . rr_1f79 1
. 1 . 576 . 1 1 18 A OP1 O 14.622 13.590 15.217 . . . 1.0 . . . . . . . . . . . . A . 18 A OP1 . . . . . . . . . rr_1f79 1
. 1 . 577 . 1 1 18 A OP2 O 12.251 12.800 15.781 . . . 1.0 . . . . . . . . . . . . A . 18 A OP2 . . . . . . . . . rr_1f79 1
. 1 . 578 . 1 1 18 A P P 13.681 12.498 15.553 . . . 1.0 . . . . . . . . . . . . A . 18 A P . . . . . . . . . rr_1f79 1
. 1 . 579 . 1 1 19 C C1' C 10.941 7.039 8.044 . . . 1.0 . . . . . . . . . . . . A . 19 C C1' . . . . . . . . . rr_1f79 1
. 1 . 580 . 1 1 19 C C2 C 9.025 6.420 9.458 . . . 1.0 . . . . . . . . . . . . A . 19 C C2 . . . . . . . . . rr_1f79 1
. 1 . 581 . 1 1 19 C C2' C 10.443 7.544 6.691 . . . 1.0 . . . . . . . . . . . . A . 19 C C2' . . . . . . . . . rr_1f79 1
. 1 . 582 . 1 1 19 C C3' C 11.152 8.885 6.581 . . . 1.0 . . . . . . . . . . . . A . 19 C C3' . . . . . . . . . rr_1f79 1
. 1 . 583 . 1 1 19 C C4 C 8.195 7.875 11.103 . . . 1.0 . . . . . . . . . . . . A . 19 C C4 . . . . . . . . . rr_1f79 1
. 1 . 584 . 1 1 19 C C4' C 12.504 8.572 7.181 . . . 1.0 . . . . . . . . . . . . A . 19 C C4' . . . . . . . . . rr_1f79 1
. 1 . 585 . 1 1 19 C C5 C 9.187 8.852 10.775 . . . 1.0 . . . . . . . . . . . . A . 19 C C5 . . . . . . . . . rr_1f79 1
. 1 . 586 . 1 1 19 C C5' C 13.299 9.780 7.667 . . . 1.0 . . . . . . . . . . . . A . 19 C C5' . . . . . . . . . rr_1f79 1
. 1 . 587 . 1 1 19 C C6 C 10.058 8.558 9.791 . . . 1.0 . . . . . . . . . . . . A . 19 C C6 . . . . . . . . . rr_1f79 1
. 1 . 588 . 1 1 19 C H1' H 11.125 5.964 8.015 . . . 1.0 . . . . . . . . . . . . A . 19 C H1' . . . . . . . . . rr_1f79 1
. 1 . 589 . 1 1 19 C H2' H 9.365 7.666 6.700 . . . 1.0 . . . . . . . . . . . . A . 19 C H2' . . . . . . . . . rr_1f79 1
. 1 . 590 . 1 1 19 C H3' H 10.629 9.698 7.083 . . . 1.0 . . . . . . . . . . . . A . 19 C H3' . . . . . . . . . rr_1f79 1
. 1 . 591 . 1 1 19 C H4' H 13.110 8.011 6.472 . . . 1.0 . . . . . . . . . . . . A . 19 C H4' . . . . . . . . . rr_1f79 1
. 1 . 592 . 1 1 19 C H41 H 6.556 7.426 12.225 . . . 1.0 . . . . . . . . . . . . A . 19 C H41 . . . . . . . . . rr_1f79 1
. 1 . 593 . 1 1 19 C H42 H 7.349 8.935 12.621 . . . 1.0 . . . . . . . . . . . . A . 19 C H42 . . . . . . . . . rr_1f79 1
. 1 . 594 . 1 1 19 C H5 H 9.243 9.806 11.299 . . . 1.0 . . . . . . . . . . . . A . 19 C H5 . . . . . . . . . rr_1f79 1
. 1 . 595 . 1 1 19 C H5' H 14.257 9.439 8.060 . . . 1.0 . . . . . . . . . . . . A . 19 C H5' . . . . . . . . . rr_1f79 1
. 1 . 596 . 1 1 19 C H5'' H 13.479 10.448 6.825 . . . 1.0 . . . . . . . . . . . . A . 19 C H5'' . . . . . . . . . rr_1f79 1
. 1 . 597 . 1 1 19 C H6 H 10.817 9.286 9.507 . . . 1.0 . . . . . . . . . . . . A . 19 C H6 . . . . . . . . . rr_1f79 1
. 1 . 598 . 1 1 19 C HO2' H 10.967 5.793 6.026 . . . 1.0 . . . . . . . . . . . . A . 19 C HO2' . . . . . . . . . rr_1f79 1
. 1 . 599 . 1 1 19 C N1 N 9.992 7.363 9.134 . . . 1.0 . . . . . . . . . . . . A . 19 C N1 . . . . . . . . . rr_1f79 1
. 1 . 600 . 1 1 19 C N3 N 8.138 6.706 10.451 . . . 1.0 . . . . . . . . . . . . A . 19 C N3 . . . . . . . . . rr_1f79 1
. 1 . 601 . 1 1 19 C N4 N 7.295 8.096 12.061 . . . 1.0 . . . . . . . . . . . . A . 19 C N4 . . . . . . . . . rr_1f79 1
. 1 . 602 . 1 1 19 C O2 O 8.971 5.355 8.847 . . . 1.0 . . . . . . . . . . . . A . 19 C O2 . . . . . . . . . rr_1f79 1
. 1 . 603 . 1 1 19 C O2' O 10.859 6.666 5.641 . . . 1.0 . . . . . . . . . . . . A . 19 C O2' . . . . . . . . . rr_1f79 1
. 1 . 604 . 1 1 19 C O3' O 11.360 9.150 5.190 . . . 1.0 . . . . . . . . . . . . A . 19 C O3' . . . . . . . . . rr_1f79 1
. 1 . 605 . 1 1 19 C O4' O 12.182 7.727 8.288 . . . 1.0 . . . . . . . . . . . . A . 19 C O4' . . . . . . . . . rr_1f79 1
. 1 . 606 . 1 1 19 C O5' O 12.606 10.498 8.690 . . . 1.0 . . . . . . . . . . . . A . 19 C O5' . . . . . . . . . rr_1f79 1
. 1 . 607 . 1 1 19 C OP1 O 14.136 12.469 8.457 . . . 1.0 . . . . . . . . . . . . A . 19 C OP1 . . . . . . . . . rr_1f79 1
. 1 . 608 . 1 1 19 C OP2 O 12.298 12.440 10.243 . . . 1.0 . . . . . . . . . . . . A . 19 C OP2 . . . . . . . . . rr_1f79 1
. 1 . 609 . 1 1 19 C P P 13.321 11.727 9.446 . . . 1.0 . . . . . . . . . . . . A . 19 C P . . . . . . . . . rr_1f79 1
. 1 . 610 . 1 1 20 C C1' C 6.418 7.993 3.576 . . . 1.0 . . . . . . . . . . . . A . 20 C C1' . . . . . . . . . rr_1f79 1
. 1 . 611 . 1 1 20 C C2 C 5.048 8.256 5.589 . . . 1.0 . . . . . . . . . . . . A . 20 C C2 . . . . . . . . . rr_1f79 1
. 1 . 612 . 1 1 20 C C2' C 5.765 8.982 2.613 . . . 1.0 . . . . . . . . . . . . A . 20 C C2' . . . . . . . . . rr_1f79 1
. 1 . 613 . 1 1 20 C C3' C 6.927 9.901 2.281 . . . 1.0 . . . . . . . . . . . . A . 20 C C3' . . . . . . . . . rr_1f79 1
. 1 . 614 . 1 1 20 C C4 C 5.923 9.170 7.566 . . . 1.0 . . . . . . . . . . . . A . 20 C C4 . . . . . . . . . rr_1f79 1
. 1 . 615 . 1 1 20 C C4' C 8.109 8.948 2.226 . . . 1.0 . . . . . . . . . . . . A . 20 C C4' . . . . . . . . . rr_1f79 1
. 1 . 616 . 1 1 20 C C5 C 7.202 9.341 6.951 . . . 1.0 . . . . . . . . . . . . A . 20 C C5 . . . . . . . . . rr_1f79 1
. 1 . 617 . 1 1 20 C C5' C 9.457 9.586 2.536 . . . 1.0 . . . . . . . . . . . . A . 20 C C5' . . . . . . . . . rr_1f79 1
. 1 . 618 . 1 1 20 C C6 C 7.341 8.954 5.669 . . . 1.0 . . . . . . . . . . . . A . 20 C C6 . . . . . . . . . rr_1f79 1
. 1 . 619 . 1 1 20 C H1' H 5.995 6.995 3.457 . . . 1.0 . . . . . . . . . . . . A . 20 C H1' . . . . . . . . . rr_1f79 1
. 1 . 620 . 1 1 20 C H2' H 4.959 9.530 3.100 . . . 1.0 . . . . . . . . . . . . A . 20 C H2' . . . . . . . . . rr_1f79 1
. 1 . 621 . 1 1 20 C H3' H 7.058 10.711 2.997 . . . 1.0 . . . . . . . . . . . . A . 20 C H3' . . . . . . . . . rr_1f79 1
. 1 . 622 . 1 1 20 C H4' H 8.163 8.460 1.252 . . . 1.0 . . . . . . . . . . . . A . 20 C H4' . . . . . . . . . rr_1f79 1
. 1 . 623 . 1 1 20 C H41 H 4.825 9.330 9.273 . . . 1.0 . . . . . . . . . . . . A . 20 C H41 . . . . . . . . . rr_1f79 1
. 1 . 624 . 1 1 20 C H42 H 6.442 9.993 9.354 . . . 1.0 . . . . . . . . . . . . A . 20 C H42 . . . . . . . . . rr_1f79 1
. 1 . 625 . 1 1 20 C H5 H 8.044 9.769 7.495 . . . 1.0 . . . . . . . . . . . . A . 20 C H5 . . . . . . . . . rr_1f79 1
. 1 . 626 . 1 1 20 C H5' H 10.236 8.828 2.458 . . . 1.0 . . . . . . . . . . . . A . 20 C H5' . . . . . . . . . rr_1f79 1
. 1 . 627 . 1 1 20 C H5'' H 9.653 10.375 1.810 . . . 1.0 . . . . . . . . . . . . A . 20 C H5'' . . . . . . . . . rr_1f79 1
. 1 . 628 . 1 1 20 C H6 H 8.311 9.059 5.177 . . . 1.0 . . . . . . . . . . . . A . 20 C H6 . . . . . . . . . rr_1f79 1
. 1 . 629 . 1 1 20 C HO2' H 5.600 7.400 1.494 . . . 1.0 . . . . . . . . . . . . A . 20 C HO2' . . . . . . . . . rr_1f79 1
. 1 . 630 . 1 1 20 C N1 N 6.286 8.418 4.985 . . . 1.0 . . . . . . . . . . . . A . 20 C N1 . . . . . . . . . rr_1f79 1
. 1 . 631 . 1 1 20 C N3 N 4.896 8.643 6.886 . . . 1.0 . . . . . . . . . . . . A . 20 C N3 . . . . . . . . . rr_1f79 1
. 1 . 632 . 1 1 20 C N4 N 5.713 9.527 8.833 . . . 1.0 . . . . . . . . . . . . A . 20 C N4 . . . . . . . . . rr_1f79 1
. 1 . 633 . 1 1 20 C O2 O 4.111 7.772 4.957 . . . 1.0 . . . . . . . . . . . . A . 20 C O2 . . . . . . . . . rr_1f79 1
. 1 . 634 . 1 1 20 C O2' O 5.302 8.311 1.439 . . . 1.0 . . . . . . . . . . . . A . 20 C O2' . . . . . . . . . rr_1f79 1
. 1 . 635 . 1 1 20 C O3' O 6.715 10.390 0.955 . . . 1.0 . . . . . . . . . . . . A . 20 C O3' . . . . . . . . . rr_1f79 1
. 1 . 636 . 1 1 20 C O4' O 7.813 7.965 3.224 . . . 1.0 . . . . . . . . . . . . A . 20 C O4' . . . . . . . . . rr_1f79 1
. 1 . 637 . 1 1 20 C O5' O 9.480 10.146 3.851 . . . 1.0 . . . . . . . . . . . . A . 20 C O5' . . . . . . . . . rr_1f79 1
. 1 . 638 . 1 1 20 C OP1 O 11.834 10.915 3.478 . . . 1.0 . . . . . . . . . . . . A . 20 C OP1 . . . . . . . . . rr_1f79 1
. 1 . 639 . 1 1 20 C OP2 O 10.595 11.492 5.645 . . . 1.0 . . . . . . . . . . . . A . 20 C OP2 . . . . . . . . . rr_1f79 1
. 1 . 640 . 1 1 20 C P P 10.877 10.544 4.544 . . . 1.0 . . . . . . . . . . . . A . 20 C P . . . . . . . . . rr_1f79 1
. 1 . 641 . 1 1 21 G C1' C 1.508 10.567 3.301 . . . 1.0 . . . . . . . . . . . . A . 21 G C1' . . . . . . . . . rr_1f79 1
. 1 . 642 . 1 1 21 G C2 C 0.379 9.394 7.329 . . . 1.0 . . . . . . . . . . . . A . 21 G C2 . . . . . . . . . rr_1f79 1
. 1 . 643 . 1 1 21 G C2' C 0.971 11.940 2.896 . . . 1.0 . . . . . . . . . . . . A . 21 G C2' . . . . . . . . . rr_1f79 1
. 1 . 644 . 1 1 21 G C3' C 2.007 12.405 1.885 . . . 1.0 . . . . . . . . . . . . A . 21 G C3' . . . . . . . . . rr_1f79 1
. 1 . 645 . 1 1 21 G C4 C 1.771 10.226 5.797 . . . 1.0 . . . . . . . . . . . . A . 21 G C4 . . . . . . . . . rr_1f79 1
. 1 . 646 . 1 1 21 G C4' C 2.381 11.116 1.188 . . . 1.0 . . . . . . . . . . . . A . 21 G C4' . . . . . . . . . rr_1f79 1
. 1 . 647 . 1 1 21 G C5 C 2.770 10.497 6.701 . . . 1.0 . . . . . . . . . . . . A . 21 G C5 . . . . . . . . . rr_1f79 1
. 1 . 648 . 1 1 21 G C5' C 3.730 11.128 0.478 . . . 1.0 . . . . . . . . . . . . A . 21 G C5' . . . . . . . . . rr_1f79 1
. 1 . 649 . 1 1 21 G C6 C 2.573 10.191 8.075 . . . 1.0 . . . . . . . . . . . . A . 21 G C6 . . . . . . . . . rr_1f79 1
. 1 . 650 . 1 1 21 G C8 C 3.509 11.117 4.808 . . . 1.0 . . . . . . . . . . . . A . 21 G C8 . . . . . . . . . rr_1f79 1
. 1 . 651 . 1 1 21 G H1 H 1.096 9.388 9.254 . . . 1.0 . . . . . . . . . . . . A . 21 G H1 . . . . . . . . . rr_1f79 1
. 1 . 652 . 1 1 21 G H1' H 0.700 9.841 3.387 . . . 1.0 . . . . . . . . . . . . A . 21 G H1' . . . . . . . . . rr_1f79 1
. 1 . 653 . 1 1 21 G H2' H 0.936 12.605 3.754 . . . 1.0 . . . . . . . . . . . . A . 21 G H2' . . . . . . . . . rr_1f79 1
. 1 . 654 . 1 1 21 G H21 H -0.890 8.565 8.688 . . . 1.0 . . . . . . . . . . . . A . 21 G H21 . . . . . . . . . rr_1f79 1
. 1 . 655 . 1 1 21 G H22 H -1.520 8.713 7.063 . . . 1.0 . . . . . . . . . . . . A . 21 G H22 . . . . . . . . . rr_1f79 1
. 1 . 656 . 1 1 21 G H3' H 2.857 12.917 2.337 . . . 1.0 . . . . . . . . . . . . A . 21 G H3' . . . . . . . . . rr_1f79 1
. 1 . 657 . 1 1 21 G H4' H 1.607 10.832 0.475 . . . 1.0 . . . . . . . . . . . . A . 21 G H4' . . . . . . . . . rr_1f79 1
. 1 . 658 . 1 1 21 G H5' H 4.082 10.102 0.366 . . . 1.0 . . . . . . . . . . . . A . 21 G H5' . . . . . . . . . rr_1f79 1
. 1 . 659 . 1 1 21 G H5'' H 3.607 11.571 -0.510 . . . 1.0 . . . . . . . . . . . . A . 21 G H5'' . . . . . . . . . rr_1f79 1
. 1 . 660 . 1 1 21 G H8 H 4.146 11.523 4.023 . . . 1.0 . . . . . . . . . . . . A . 21 G H8 . . . . . . . . . rr_1f79 1
. 1 . 661 . 1 1 21 G HO2' H -0.254 11.112 1.632 . . . 1.0 . . . . . . . . . . . . A . 21 G HO2' . . . . . . . . . rr_1f79 1
. 1 . 662 . 1 1 21 G N1 N 1.325 9.632 8.301 . . . 1.0 . . . . . . . . . . . . A . 21 G N1 . . . . . . . . . rr_1f79 1
. 1 . 663 . 1 1 21 G N2 N -0.770 8.846 7.725 . . . 1.0 . . . . . . . . . . . . A . 21 G N2 . . . . . . . . . rr_1f79 1
. 1 . 664 . 1 1 21 G N3 N 0.554 9.677 6.036 . . . 1.0 . . . . . . . . . . . . A . 21 G N3 . . . . . . . . . rr_1f79 1
. 1 . 665 . 1 1 21 G N7 N 3.868 11.061 6.061 . . . 1.0 . . . . . . . . . . . . A . 21 G N7 . . . . . . . . . rr_1f79 1
. 1 . 666 . 1 1 21 G N9 N 2.250 10.628 4.574 . . . 1.0 . . . . . . . . . . . . A . 21 G N9 . . . . . . . . . rr_1f79 1
. 1 . 667 . 1 1 21 G O2' O -0.314 11.817 2.281 . . . 1.0 . . . . . . . . . . . . A . 21 G O2' . . . . . . . . . rr_1f79 1
. 1 . 668 . 1 1 21 G O3' O 1.331 13.225 0.928 . . . 1.0 . . . . . . . . . . . . A . 21 G O3' . . . . . . . . . rr_1f79 1
. 1 . 669 . 1 1 21 G O4' O 2.406 10.163 2.252 . . . 1.0 . . . . . . . . . . . . A . 21 G O4' . . . . . . . . . rr_1f79 1
. 1 . 670 . 1 1 21 G O5' O 4.706 11.877 1.206 . . . 1.0 . . . . . . . . . . . . A . 21 G O5' . . . . . . . . . rr_1f79 1
. 1 . 671 . 1 1 21 G O6 O 3.348 10.364 9.014 . . . 1.0 . . . . . . . . . . . . A . 21 G O6 . . . . . . . . . rr_1f79 1
. 1 . 672 . 1 1 21 G OP1 O 6.252 12.174 -0.742 . . . 1.0 . . . . . . . . . . . . A . 21 G OP1 . . . . . . . . . rr_1f79 1
. 1 . 673 . 1 1 21 G OP2 O 7.001 12.785 1.631 . . . 1.0 . . . . . . . . . . . . A . 21 G OP2 . . . . . . . . . rr_1f79 1
. 1 . 674 . 1 1 21 G P P 6.238 11.909 0.714 . . . 1.0 . . . . . . . . . . . . A . 21 G P . . . . . . . . . rr_1f79 1
. 1 . 675 . 1 1 22 G C1' C -2.302 15.674 3.634 . . . 1.0 . . . . . . . . . . . . A . 22 G C1' . . . . . . . . . rr_1f79 1
. 1 . 676 . 1 1 22 G C2 C -2.214 15.712 7.983 . . . 1.0 . . . . . . . . . . . . A . 22 G C2 . . . . . . . . . rr_1f79 1
. 1 . 677 . 1 1 22 G C2' C -2.408 17.167 3.335 . . . 1.0 . . . . . . . . . . . . A . 22 G C2' . . . . . . . . . rr_1f79 1
. 1 . 678 . 1 1 22 G C3' C -1.501 17.299 2.124 . . . 1.0 . . . . . . . . . . . . A . 22 G C3' . . . . . . . . . rr_1f79 1
. 1 . 679 . 1 1 22 G C4 C -1.320 15.426 5.959 . . . 1.0 . . . . . . . . . . . . A . 22 G C4 . . . . . . . . . rr_1f79 1
. 1 . 680 . 1 1 22 G C4' C -1.780 16.020 1.355 . . . 1.0 . . . . . . . . . . . . A . 22 G C4' . . . . . . . . . rr_1f79 1
. 1 . 681 . 1 1 22 G C5 C -0.079 15.083 6.442 . . . 1.0 . . . . . . . . . . . . A . 22 G C5 . . . . . . . . . rr_1f79 1
. 1 . 682 . 1 1 22 G C5' C -0.645 15.558 0.448 . . . 1.0 . . . . . . . . . . . . A . 22 G C5' . . . . . . . . . rr_1f79 1
. 1 . 683 . 1 1 22 G C6 C 0.140 15.044 7.846 . . . 1.0 . . . . . . . . . . . . A . 22 G C6 . . . . . . . . . rr_1f79 1
. 1 . 684 . 1 1 22 G C8 C 0.076 15.003 4.325 . . . 1.0 . . . . . . . . . . . . A . 22 G C8 . . . . . . . . . rr_1f79 1
. 1 . 685 . 1 1 22 G H1 H -0.940 15.379 9.559 . . . 1.0 . . . . . . . . . . . . A . 22 G H1 . . . . . . . . . rr_1f79 1
. 1 . 686 . 1 1 22 G H1' H -3.243 15.284 4.020 . . . 1.0 . . . . . . . . . . . . A . 22 G H1' . . . . . . . . . rr_1f79 1
. 1 . 687 . 1 1 22 G H2' H -2.040 17.761 4.169 . . . 1.0 . . . . . . . . . . . . A . 22 G H2' . . . . . . . . . rr_1f79 1
. 1 . 688 . 1 1 22 G H21 H -3.068 15.963 9.813 . . . 1.0 . . . . . . . . . . . . A . 22 G H21 . . . . . . . . . rr_1f79 1
. 1 . 689 . 1 1 22 G H22 H -4.115 16.270 8.446 . . . 1.0 . . . . . . . . . . . . A . 22 G H22 . . . . . . . . . rr_1f79 1
. 1 . 690 . 1 1 22 G H3' H -0.450 17.429 2.382 . . . 1.0 . . . . . . . . . . . . A . 22 G H3' . . . . . . . . . rr_1f79 1
. 1 . 691 . 1 1 22 G H4' H -2.689 16.120 0.761 . . . 1.0 . . . . . . . . . . . . A . 22 G H4' . . . . . . . . . rr_1f79 1
. 1 . 692 . 1 1 22 G H5' H -0.830 14.527 0.144 . . . 1.0 . . . . . . . . . . . . A . 22 G H5' . . . . . . . . . rr_1f79 1
. 1 . 693 . 1 1 22 G H5'' H -0.618 16.191 -0.439 . . . 1.0 . . . . . . . . . . . . A . 22 G H5'' . . . . . . . . . rr_1f79 1
. 1 . 694 . 1 1 22 G H8 H 0.462 14.856 3.314 . . . 1.0 . . . . . . . . . . . . A . 22 G H8 . . . . . . . . . rr_1f79 1
. 1 . 695 . 1 1 22 G HO2' H -3.759 17.766 2.071 . . . 1.0 . . . . . . . . . . . . A . 22 G HO2' . . . . . . . . . rr_1f79 1
. 1 . 696 . 1 1 22 G N1 N -1.005 15.380 8.551 . . . 1.0 . . . . . . . . . . . . A . 22 G N1 . . . . . . . . . rr_1f79 1
. 1 . 697 . 1 1 22 G N2 N -3.213 16.006 8.814 . . . 1.0 . . . . . . . . . . . . A . 22 G N2 . . . . . . . . . rr_1f79 1
. 1 . 698 . 1 1 22 G N3 N -2.431 15.751 6.665 . . . 1.0 . . . . . . . . . . . . A . 22 G N3 . . . . . . . . . rr_1f79 1
. 1 . 699 . 1 1 22 G N7 N 0.797 14.818 5.395 . . . 1.0 . . . . . . . . . . . . A . 22 G N7 . . . . . . . . . rr_1f79 1
. 1 . 700 . 1 1 22 G N9 N -1.218 15.374 4.588 . . . 1.0 . . . . . . . . . . . . A . 22 G N9 . . . . . . . . . rr_1f79 1
. 1 . 701 . 1 1 22 G O2' O -3.753 17.519 2.998 . . . 1.0 . . . . . . . . . . . . A . 22 G O2' . . . . . . . . . rr_1f79 1
. 1 . 702 . 1 1 22 G O3' O -1.996 18.385 1.338 . . . 1.0 . . . . . . . . . . . . A . 22 G O3' . . . . . . . . . rr_1f79 1
. 1 . 703 . 1 1 22 G O4' O -1.998 15.041 2.379 . . . 1.0 . . . . . . . . . . . . A . 22 G O4' . . . . . . . . . rr_1f79 1
. 1 . 704 . 1 1 22 G O5' O 0.619 15.628 1.110 . . . 1.0 . . . . . . . . . . . . A . 22 G O5' . . . . . . . . . rr_1f79 1
. 1 . 705 . 1 1 22 G O6 O 1.174 14.761 8.449 . . . 1.0 . . . . . . . . . . . . A . 22 G O6 . . . . . . . . . rr_1f79 1
. 1 . 706 . 1 1 22 G OP1 O 1.979 14.866 -0.850 . . . 1.0 . . . . . . . . . . . . A . 22 G OP1 . . . . . . . . . rr_1f79 1
. 1 . 707 . 1 1 22 G OP2 O 3.012 14.995 1.491 . . . 1.0 . . . . . . . . . . . . A . 22 G OP2 . . . . . . . . . rr_1f79 1
. 1 . 708 . 1 1 22 G P P 1.851 14.717 0.616 . . . 1.0 . . . . . . . . . . . . A . 22 G P . . . . . . . . . rr_1f79 1
. 1 . 709 . 1 1 23 C C1' C -2.263 20.029 6.528 . . . 1.0 . . . . . . . . . . . . A . 23 C C1' . . . . . . . . . rr_1f79 1
. 1 . 710 . 1 1 23 C C2 C -0.578 19.000 7.991 . . . 1.0 . . . . . . . . . . . . A . 23 C C2 . . . . . . . . . rr_1f79 1
. 1 . 711 . 1 1 23 C C2' C -2.189 21.533 6.797 . . . 1.0 . . . . . . . . . . . . A . 23 C C2' . . . . . . . . . rr_1f79 1
. 1 . 712 . 1 1 23 C C3' C -2.053 22.099 5.392 . . . 1.0 . . . . . . . . . . . . A . 23 C C3' . . . . . . . . . rr_1f79 1
. 1 . 713 . 1 1 23 C C4 C 1.422 18.119 7.134 . . . 1.0 . . . . . . . . . . . . A . 23 C C4 . . . . . . . . . rr_1f79 1
. 1 . 714 . 1 1 23 C C4' C -2.932 21.172 4.580 . . . 1.0 . . . . . . . . . . . . A . 23 C C4' . . . . . . . . . rr_1f79 1
. 1 . 715 . 1 1 23 C C5 C 1.046 18.491 5.805 . . . 1.0 . . . . . . . . . . . . A . 23 C C5 . . . . . . . . . rr_1f79 1
. 1 . 716 . 1 1 23 C C5' C -2.628 21.137 3.085 . . . 1.0 . . . . . . . . . . . . A . 23 C C5' . . . . . . . . . rr_1f79 1
. 1 . 717 . 1 1 23 C C6 C -0.141 19.105 5.635 . . . 1.0 . . . . . . . . . . . . A . 23 C C6 . . . . . . . . . rr_1f79 1
. 1 . 718 . 1 1 23 C H1' H -3.001 19.559 7.174 . . . 1.0 . . . . . . . . . . . . A . 23 C H1' . . . . . . . . . rr_1f79 1
. 1 . 719 . 1 1 23 C H2' H -1.322 21.776 7.407 . . . 1.0 . . . . . . . . . . . . A . 23 C H2' . . . . . . . . . rr_1f79 1
. 1 . 720 . 1 1 23 C H3' H -1.023 22.142 5.039 . . . 1.0 . . . . . . . . . . . . A . 23 C H3' . . . . . . . . . rr_1f79 1
. 1 . 721 . 1 1 23 C H4' H -3.985 21.420 4.723 . . . 1.0 . . . . . . . . . . . . A . 23 C H4' . . . . . . . . . rr_1f79 1
. 1 . 722 . 1 1 23 C H41 H 2.793 17.182 8.313 . . . 1.0 . . . . . . . . . . . . A . 23 C H41 . . . . . . . . . rr_1f79 1
. 1 . 723 . 1 1 23 C H42 H 3.245 17.364 6.632 . . . 1.0 . . . . . . . . . . . . A . 23 C H42 . . . . . . . . . rr_1f79 1
. 1 . 724 . 1 1 23 C H5 H 1.691 18.287 4.951 . . . 1.0 . . . . . . . . . . . . A . 23 C H5 . . . . . . . . . rr_1f79 1
. 1 . 725 . 1 1 23 C H5' H -3.480 20.706 2.557 . . . 1.0 . . . . . . . . . . . . A . 23 C H5' . . . . . . . . . rr_1f79 1
. 1 . 726 . 1 1 23 C H5'' H -2.470 22.155 2.731 . . . 1.0 . . . . . . . . . . . . A . 23 C H5'' . . . . . . . . . rr_1f79 1
. 1 . 727 . 1 1 23 C H6 H -0.454 19.405 4.636 . . . 1.0 . . . . . . . . . . . . A . 23 C H6 . . . . . . . . . rr_1f79 1
. 1 . 728 . 1 1 23 C HO2' H -3.548 22.890 7.102 . . . 1.0 . . . . . . . . . . . . A . 23 C HO2' . . . . . . . . . rr_1f79 1
. 1 . 729 . 1 1 23 C N1 N -0.952 19.362 6.703 . . . 1.0 . . . . . . . . . . . . A . 23 C N1 . . . . . . . . . rr_1f79 1
. 1 . 730 . 1 1 23 C N3 N 0.620 18.377 8.174 . . . 1.0 . . . . . . . . . . . . A . 23 C N3 . . . . . . . . . rr_1f79 1
. 1 . 731 . 1 1 23 C N4 N 2.581 17.506 7.379 . . . 1.0 . . . . . . . . . . . . A . 23 C N4 . . . . . . . . . rr_1f79 1
. 1 . 732 . 1 1 23 C O2 O -1.317 19.246 8.942 . . . 1.0 . . . . . . . . . . . . A . 23 C O2 . . . . . . . . . rr_1f79 1
. 1 . 733 . 1 1 23 C O2' O -3.397 21.993 7.409 . . . 1.0 . . . . . . . . . . . . A . 23 C O2' . . . . . . . . . rr_1f79 1
. 1 . 734 . 1 1 23 C O3' O -2.677 23.386 5.388 . . . 1.0 . . . . . . . . . . . . A . 23 C O3' . . . . . . . . . rr_1f79 1
. 1 . 735 . 1 1 23 C O4' O -2.676 19.889 5.155 . . . 1.0 . . . . . . . . . . . . A . 23 C O4' . . . . . . . . . rr_1f79 1
. 1 . 736 . 1 1 23 C O5' O -1.465 20.359 2.798 . . . 1.0 . . . . . . . . . . . . A . 23 C O5' . . . . . . . . . rr_1f79 1
. 1 . 737 . 1 1 23 C OP1 O -1.900 20.685 0.353 . . . 1.0 . . . . . . . . . . . . A . 23 C OP1 . . . . . . . . . rr_1f79 1
. 1 . 738 . 1 1 23 C OP2 O 0.232 19.515 1.160 . . . 1.0 . . . . . . . . . . . . A . 23 C OP2 . . . . . . . . . rr_1f79 1
. 1 . 739 . 1 1 23 C P P -1.214 19.791 1.313 . . . 1.0 . . . . . . . . . . . . A . 23 C P . . . . . . . . . rr_1f79 1
. 1 . 740 . 1 1 24 U C1' C -0.110 24.008 9.795 . . . 1.0 . . . . . . . . . . . . A . 24 U C1' . . . . . . . . . rr_1f79 1
. 1 . 741 . 1 1 24 U C2 C 1.891 22.611 9.986 . . . 1.0 . . . . . . . . . . . . A . 24 U C2 . . . . . . . . . rr_1f79 1
. 1 . 742 . 1 1 24 U C2' C 0.395 25.406 10.165 . . . 1.0 . . . . . . . . . . . . A . 24 U C2' . . . . . . . . . rr_1f79 1
. 1 . 743 . 1 1 24 U C3' C -0.156 26.266 9.038 . . . 1.0 . . . . . . . . . . . . A . 24 U C3' . . . . . . . . . rr_1f79 1
. 1 . 744 . 1 1 24 U C4 C 2.975 21.636 8.000 . . . 1.0 . . . . . . . . . . . . A . 24 U C4 . . . . . . . . . rr_1f79 1
. 1 . 745 . 1 1 24 U C4' C -1.471 25.592 8.704 . . . 1.0 . . . . . . . . . . . . A . 24 U C4' . . . . . . . . . rr_1f79 1
. 1 . 746 . 1 1 24 U C5 C 1.950 22.271 7.202 . . . 1.0 . . . . . . . . . . . . A . 24 U C5 . . . . . . . . . rr_1f79 1
. 1 . 747 . 1 1 24 U C5' C -1.989 25.853 7.294 . . . 1.0 . . . . . . . . . . . . A . 24 U C5' . . . . . . . . . rr_1f79 1
. 1 . 748 . 1 1 24 U C6 C 0.984 23.014 7.798 . . . 1.0 . . . . . . . . . . . . A . 24 U C6 . . . . . . . . . rr_1f79 1
. 1 . 749 . 1 1 24 U H1' H -0.492 23.490 10.674 . . . 1.0 . . . . . . . . . . . . A . 24 U H1' . . . . . . . . . rr_1f79 1
. 1 . 750 . 1 1 24 U H2' H 1.483 25.434 10.180 . . . 1.0 . . . . . . . . . . . . A . 24 U H2' . . . . . . . . . rr_1f79 1
. 1 . 751 . 1 1 24 U H3 H 3.564 21.431 9.951 . . . 1.0 . . . . . . . . . . . . A . 24 U H3 . . . . . . . . . rr_1f79 1
. 1 . 752 . 1 1 24 U H3' H 0.518 26.348 8.185 . . . 1.0 . . . . . . . . . . . . A . 24 U H3' . . . . . . . . . rr_1f79 1
. 1 . 753 . 1 1 24 U H4' H -2.241 25.876 9.422 . . . 1.0 . . . . . . . . . . . . A . 24 U H4' . . . . . . . . . rr_1f79 1
. 1 . 754 . 1 1 24 U H5 H 1.954 22.152 6.118 . . . 1.0 . . . . . . . . . . . . A . 24 U H5 . . . . . . . . . rr_1f79 1
. 1 . 755 . 1 1 24 U H5' H -3.016 25.495 7.221 . . . 1.0 . . . . . . . . . . . . A . 24 U H5' . . . . . . . . . rr_1f79 1
. 1 . 756 . 1 1 24 U H5'' H -1.971 26.925 7.102 . . . 1.0 . . . . . . . . . . . . A . 24 U H5'' . . . . . . . . . rr_1f79 1
. 1 . 757 . 1 1 24 U H6 H 0.219 23.483 7.179 . . . 1.0 . . . . . . . . . . . . A . 24 U H6 . . . . . . . . . rr_1f79 1
. 1 . 758 . 1 1 24 U HO2' H -1.103 25.854 11.321 . . . 1.0 . . . . . . . . . . . . A . 24 U HO2' . . . . . . . . . rr_1f79 1
. 1 . 759 . 1 1 24 U N1 N 0.944 23.188 9.158 . . . 1.0 . . . . . . . . . . . . A . 24 U N1 . . . . . . . . . rr_1f79 1
. 1 . 760 . 1 1 24 U N3 N 2.866 21.859 9.360 . . . 1.0 . . . . . . . . . . . . A . 24 U N3 . . . . . . . . . rr_1f79 1
. 1 . 761 . 1 1 24 U O2 O 1.874 22.754 11.207 . . . 1.0 . . . . . . . . . . . . A . 24 U O2 . . . . . . . . . rr_1f79 1
. 1 . 762 . 1 1 24 U O2' O -0.149 25.818 11.421 . . . 1.0 . . . . . . . . . . . . A . 24 U O2' . . . . . . . . . rr_1f79 1
. 1 . 763 . 1 1 24 U O3' O -0.468 27.545 9.596 . . . 1.0 . . . . . . . . . . . . A . 24 U O3' . . . . . . . . . rr_1f79 1
. 1 . 764 . 1 1 24 U O4 O 3.891 20.944 7.561 . . . 1.0 . . . . . . . . . . . . A . 24 U O4 . . . . . . . . . rr_1f79 1
. 1 . 765 . 1 1 24 U O4' O -1.184 24.202 8.856 . . . 1.0 . . . . . . . . . . . . A . 24 U O4' . . . . . . . . . rr_1f79 1
. 1 . 766 . 1 1 24 U O5' O -1.193 25.190 6.309 . . . 1.0 . . . . . . . . . . . . A . 24 U O5' . . . . . . . . . rr_1f79 1
. 1 . 767 . 1 1 24 U OP1 O -2.823 25.718 4.482 . . . 1.0 . . . . . . . . . . . . A . 24 U OP1 . . . . . . . . . rr_1f79 1
. 1 . 768 . 1 1 24 U OP2 O -0.766 24.260 4.023 . . . 1.0 . . . . . . . . . . . . A . 24 U OP2 . . . . . . . . . rr_1f79 1
. 1 . 769 . 1 1 24 U P P -1.854 24.692 4.929 . . . 1.0 . . . . . . . . . . . . A . 24 U P . . . . . . . . . rr_1f79 1
. 1 . 770 . 1 1 25 U C1' C 3.505 26.358 13.327 . . . 1.0 . . . . . . . . . . . . A . 25 U C1' . . . . . . . . . rr_1f79 1
. 1 . 771 . 1 1 25 U C2 C 5.315 25.133 12.210 . . . 1.0 . . . . . . . . . . . . A . 25 U C2 . . . . . . . . . rr_1f79 1
. 1 . 772 . 1 1 25 U C2' C 4.145 27.556 14.024 . . . 1.0 . . . . . . . . . . . . A . 25 U C2' . . . . . . . . . rr_1f79 1
. 1 . 773 . 1 1 25 U C3' C 3.384 28.713 13.402 . . . 1.0 . . . . . . . . . . . . A . 25 U C3' . . . . . . . . . rr_1f79 1
. 1 . 774 . 1 1 25 U C4 C 5.620 25.247 9.768 . . . 1.0 . . . . . . . . . . . . A . 25 U C4 . . . . . . . . . rr_1f79 1
. 1 . 775 . 1 1 25 U C4' C 1.976 28.160 13.280 . . . 1.0 . . . . . . . . . . . . A . 25 U C4' . . . . . . . . . rr_1f79 1
. 1 . 776 . 1 1 25 U C5 C 4.475 26.127 9.724 . . . 1.0 . . . . . . . . . . . . A . 25 U C5 . . . . . . . . . rr_1f79 1
. 1 . 777 . 1 1 25 U C5' C 1.127 28.803 12.188 . . . 1.0 . . . . . . . . . . . . A . 25 U C5' . . . . . . . . . rr_1f79 1
. 1 . 778 . 1 1 25 U C6 C 3.826 26.459 10.869 . . . 1.0 . . . . . . . . . . . . A . 25 U C6 . . . . . . . . . rr_1f79 1
. 1 . 779 . 1 1 25 U H1' H 3.448 25.500 13.998 . . . 1.0 . . . . . . . . . . . . A . 25 U H1' . . . . . . . . . rr_1f79 1
. 1 . 780 . 1 1 25 U H2' H 5.208 27.616 13.799 . . . 1.0 . . . . . . . . . . . . A . 25 U H2' . . . . . . . . . rr_1f79 1
. 1 . 781 . 1 1 25 U H3 H 6.756 24.189 11.104 . . . 1.0 . . . . . . . . . . . . A . 25 U H3 . . . . . . . . . rr_1f79 1
. 1 . 782 . 1 1 25 U H3' H 3.802 29.046 12.452 . . . 1.0 . . . . . . . . . . . . A . 25 U H3' . . . . . . . . . rr_1f79 1
. 1 . 783 . 1 1 25 U H4' H 1.449 28.242 14.231 . . . 1.0 . . . . . . . . . . . . A . 25 U H4' . . . . . . . . . rr_1f79 1
. 1 . 784 . 1 1 25 U H5 H 4.131 26.525 8.770 . . . 1.0 . . . . . . . . . . . . A . 25 U H5 . . . . . . . . . rr_1f79 1
. 1 . 785 . 1 1 25 U H5' H 0.082 28.537 12.347 . . . 1.0 . . . . . . . . . . . . A . 25 U H5' . . . . . . . . . rr_1f79 1
. 1 . 786 . 1 1 25 U H5'' H 1.233 29.886 12.247 . . . 1.0 . . . . . . . . . . . . A . 25 U H5'' . . . . . . . . . rr_1f79 1
. 1 . 787 . 1 1 25 U H6 H 2.965 27.125 10.816 . . . 1.0 . . . . . . . . . . . . A . 25 U H6 . . . . . . . . . rr_1f79 1
. 1 . 788 . 1 1 25 U HO2' H 2.968 27.410 15.565 . . . 1.0 . . . . . . . . . . . . A . 25 U HO2' . . . . . . . . . rr_1f79 1
. 1 . 789 . 1 1 25 U N1 N 4.226 25.980 12.090 . . . 1.0 . . . . . . . . . . . . A . 25 U N1 . . . . . . . . . rr_1f79 1
. 1 . 790 . 1 1 25 U N3 N 5.961 24.807 11.033 . . . 1.0 . . . . . . . . . . . . A . 25 U N3 . . . . . . . . . rr_1f79 1
. 1 . 791 . 1 1 25 U O2 O 5.692 24.693 13.294 . . . 1.0 . . . . . . . . . . . . A . 25 U O2 . . . . . . . . . rr_1f79 1
. 1 . 792 . 1 1 25 U O2' O 3.914 27.500 15.434 . . . 1.0 . . . . . . . . . . . . A . 25 U O2' . . . . . . . . . rr_1f79 1
. 1 . 793 . 1 1 25 U O3' O 3.345 29.766 14.368 . . . 1.0 . . . . . . . . . . . . A . 25 U O3' . . . . . . . . . rr_1f79 1
. 1 . 794 . 1 1 25 U O4 O 6.275 24.884 8.793 . . . 1.0 . . . . . . . . . . . . A . 25 U O4 . . . . . . . . . rr_1f79 1
. 1 . 795 . 1 1 25 U O4' O 2.173 26.774 12.975 . . . 1.0 . . . . . . . . . . . . A . 25 U O4' . . . . . . . . . rr_1f79 1
. 1 . 796 . 1 1 25 U O5' O 1.525 28.367 10.886 . . . 1.0 . . . . . . . . . . . . A . 25 U O5' . . . . . . . . . rr_1f79 1
. 1 . 797 . 1 1 25 U OP1 O -0.068 30.004 9.859 . . . 1.0 . . . . . . . . . . . . A . 25 U OP1 . . . . . . . . . rr_1f79 1
. 1 . 798 . 1 1 25 U OP2 O 1.471 28.576 8.390 . . . 1.0 . . . . . . . . . . . . A . 25 U OP2 . . . . . . . . . rr_1f79 1
. 1 . 799 . 1 1 25 U P P 0.628 28.724 9.597 . . . 1.0 . . . . . . . . . . . . A . 25 U P . . . . . . . . . rr_1f79 1
. 1 . 800 . 1 1 26 C C1' C 8.579 28.211 14.673 . . . 1.0 . . . . . . . . . . . . A . 26 C C1' . . . . . . . . . rr_1f79 1
. 1 . 801 . 1 1 26 C C2 C 9.550 27.356 12.583 . . . 1.0 . . . . . . . . . . . . A . 26 C C2 . . . . . . . . . rr_1f79 1
. 1 . 802 . 1 1 26 C C2' C 9.480 29.369 15.122 . . . 1.0 . . . . . . . . . . . . A . 26 C C2' . . . . . . . . . rr_1f79 1
. 1 . 803 . 1 1 26 C C3' C 8.474 30.460 15.466 . . . 1.0 . . . . . . . . . . . . A . 26 C C3' . . . . . . . . . rr_1f79 1
. 1 . 804 . 1 1 26 C C4 C 8.529 27.741 10.504 . . . 1.0 . . . . . . . . . . . . A . 26 C C4 . . . . . . . . . rr_1f79 1
. 1 . 805 . 1 1 26 C C4' C 7.281 29.680 15.980 . . . 1.0 . . . . . . . . . . . . A . 26 C C4' . . . . . . . . . rr_1f79 1
. 1 . 806 . 1 1 26 C C5 C 7.475 28.479 11.130 . . . 1.0 . . . . . . . . . . . . A . 26 C C5 . . . . . . . . . rr_1f79 1
. 1 . 807 . 1 1 26 C C5' C 5.943 30.404 15.874 . . . 1.0 . . . . . . . . . . . . A . 26 C C5' . . . . . . . . . rr_1f79 1
. 1 . 808 . 1 1 26 C C6 C 7.514 28.619 12.470 . . . 1.0 . . . . . . . . . . . . A . 26 C C6 . . . . . . . . . rr_1f79 1
. 1 . 809 . 1 1 26 C H1' H 8.911 27.271 15.116 . . . 1.0 . . . . . . . . . . . . A . 26 C H1' . . . . . . . . . rr_1f79 1
. 1 . 810 . 1 1 26 C H2' H 10.138 29.686 14.313 . . . 1.0 . . . . . . . . . . . . A . 26 C H2' . . . . . . . . . rr_1f79 1
. 1 . 811 . 1 1 26 C H3' H 8.237 31.111 14.625 . . . 1.0 . . . . . . . . . . . . A . 26 C H3' . . . . . . . . . rr_1f79 1
. 1 . 812 . 1 1 26 C H4' H 7.439 29.378 17.015 . . . 1.0 . . . . . . . . . . . . A . 26 C H4' . . . . . . . . . rr_1f79 1
. 1 . 813 . 1 1 26 C H41 H 9.264 26.965 8.769 . . . 1.0 . . . . . . . . . . . . A . 26 C H41 . . . . . . . . . rr_1f79 1
. 1 . 814 . 1 1 26 C H42 H 7.860 27.996 8.598 . . . 1.0 . . . . . . . . . . . . A . 26 C H42 . . . . . . . . . rr_1f79 1
. 1 . 815 . 1 1 26 C H5 H 6.662 28.916 10.550 . . . 1.0 . . . . . . . . . . . . A . 26 C H5 . . . . . . . . . rr_1f79 1
. 1 . 816 . 1 1 26 C H5' H 5.155 29.752 16.250 . . . 1.0 . . . . . . . . . . . . A . 26 C H5' . . . . . . . . . rr_1f79 1
. 1 . 817 . 1 1 26 C H5'' H 5.979 31.306 16.485 . . . 1.0 . . . . . . . . . . . . A . 26 C H5'' . . . . . . . . . rr_1f79 1
. 1 . 818 . 1 1 26 C H6 H 6.726 29.176 12.976 . . . 1.0 . . . . . . . . . . . . A . 26 C H6 . . . . . . . . . rr_1f79 1
. 1 . 819 . 1 1 26 C HO2' H 10.261 28.038 16.307 . . . 1.0 . . . . . . . . . . . . A . 26 C HO2' . . . . . . . . . rr_1f79 1
. 1 . 820 . 1 1 26 C N1 N 8.530 28.070 13.199 . . . 1.0 . . . . . . . . . . . . A . 26 C N1 . . . . . . . . . rr_1f79 1
. 1 . 821 . 1 1 26 C N3 N 9.522 27.209 11.230 . . . 1.0 . . . . . . . . . . . . A . 26 C N3 . . . . . . . . . rr_1f79 1
. 1 . 822 . 1 1 26 C N4 N 8.553 27.553 9.184 . . . 1.0 . . . . . . . . . . . . A . 26 C N4 . . . . . . . . . rr_1f79 1
. 1 . 823 . 1 1 26 C O2 O 10.454 26.866 13.256 . . . 1.0 . . . . . . . . . . . . A . 26 C O2 . . . . . . . . . rr_1f79 1
. 1 . 824 . 1 1 26 C O2' O 10.230 28.998 16.281 . . . 1.0 . . . . . . . . . . . . A . 26 C O2' . . . . . . . . . rr_1f79 1
. 1 . 825 . 1 1 26 C O3' O 9.007 31.192 16.573 . . . 1.0 . . . . . . . . . . . . A . 26 C O3' . . . . . . . . . rr_1f79 1
. 1 . 826 . 1 1 26 C O4' O 7.259 28.515 15.155 . . . 1.0 . . . . . . . . . . . . A . 26 C O4' . . . . . . . . . rr_1f79 1
. 1 . 827 . 1 1 26 C O5' O 5.642 30.768 14.525 . . . 1.0 . . . . . . . . . . . . A . 26 C O5' . . . . . . . . . rr_1f79 1
. 1 . 828 . 1 1 26 C OP1 O 3.627 32.160 15.052 . . . 1.0 . . . . . . . . . . . . A . 26 C OP1 . . . . . . . . . rr_1f79 1
. 1 . 829 . 1 1 26 C OP2 O 4.115 31.418 12.649 . . . 1.0 . . . . . . . . . . . . A . 26 C OP2 . . . . . . . . . rr_1f79 1
. 1 . 830 . 1 1 26 C P P 4.135 31.144 14.103 . . . 1.0 . . . . . . . . . . . . A . 26 C P . . . . . . . . . rr_1f79 1
. 1 . 831 . 1 1 27 C C1' C 13.311 30.857 12.020 . . . 1.0 . . . . . . . . . . . . A . 27 C C1' . . . . . . . . . rr_1f79 1
. 1 . 832 . 1 1 27 C C2 C 12.856 30.520 9.631 . . . 1.0 . . . . . . . . . . . . A . 27 C C2 . . . . . . . . . rr_1f79 1
. 1 . 833 . 1 1 27 C C2' C 14.215 32.080 11.864 . . . 1.0 . . . . . . . . . . . . A . 27 C C2' . . . . . . . . . rr_1f79 1
. 1 . 834 . 1 1 27 C C3' C 13.426 33.150 12.602 . . . 1.0 . . . . . . . . . . . . A . 27 C C3' . . . . . . . . . rr_1f79 1
. 1 . 835 . 1 1 27 C C4 C 10.665 30.457 8.789 . . . 1.0 . . . . . . . . . . . . A . 27 C C4 . . . . . . . . . rr_1f79 1
. 1 . 836 . 1 1 27 C C4' C 12.880 32.364 13.783 . . . 1.0 . . . . . . . . . . . . A . 27 C C4' . . . . . . . . . rr_1f79 1
. 1 . 837 . 1 1 27 C C5 C 10.128 30.659 10.100 . . . 1.0 . . . . . . . . . . . . A . 27 C C5 . . . . . . . . . rr_1f79 1
. 1 . 838 . 1 1 27 C C5' C 11.614 32.947 14.400 . . . 1.0 . . . . . . . . . . . . A . 27 C C5' . . . . . . . . . rr_1f79 1
. 1 . 839 . 1 1 27 C C6 C 10.996 30.783 11.122 . . . 1.0 . . . . . . . . . . . . A . 27 C C6 . . . . . . . . . rr_1f79 1
. 1 . 840 . 1 1 27 C H1' H 13.901 29.944 12.102 . . . 1.0 . . . . . . . . . . . . A . 27 C H1' . . . . . . . . . rr_1f79 1
. 1 . 841 . 1 1 27 C H2' H 14.346 32.343 10.815 . . . 1.0 . . . . . . . . . . . . A . 27 C H2' . . . . . . . . . rr_1f79 1
. 1 . 842 . 1 1 27 C H3' H 12.619 33.540 11.983 . . . 1.0 . . . . . . . . . . . . A . 27 C H3' . . . . . . . . . rr_1f79 1
. 1 . 843 . 1 1 27 C H4' H 13.638 32.262 14.560 . . . 1.0 . . . . . . . . . . . . A . 27 C H4' . . . . . . . . . rr_1f79 1
. 1 . 844 . 1 1 27 C H41 H 10.264 30.189 6.813 . . . 1.0 . . . . . . . . . . . . A . 27 C H41 . . . . . . . . . rr_1f79 1
. 1 . 845 . 1 1 27 C H42 H 8.864 30.371 7.844 . . . 1.0 . . . . . . . . . . . . A . 27 C H42 . . . . . . . . . rr_1f79 1
. 1 . 846 . 1 1 27 C H5 H 9.054 30.713 10.274 . . . 1.0 . . . . . . . . . . . . A . 27 C H5 . . . . . . . . . rr_1f79 1
. 1 . 847 . 1 1 27 C H5' H 11.868 33.865 14.931 . . . 1.0 . . . . . . . . . . . . A . 27 C H5' . . . . . . . . . rr_1f79 1
. 1 . 848 . 1 1 27 C H5'' H 10.906 33.181 13.605 . . . 1.0 . . . . . . . . . . . . A . 27 C H5'' . . . . . . . . . rr_1f79 1
. 1 . 849 . 1 1 27 C H6 H 10.618 30.931 12.135 . . . 1.0 . . . . . . . . . . . . A . 27 C H6 . . . . . . . . . rr_1f79 1
. 1 . 850 . 1 1 27 C HO2' H 15.469 32.344 13.328 . . . 1.0 . . . . . . . . . . . . A . 27 C HO2' . . . . . . . . . rr_1f79 1
. 1 . 851 . 1 1 27 C HO3' H 13.861 35.030 12.839 . . . 1.0 . . . . . . . . . . . . A . 27 C HO3' . . . . . . . . . rr_1f79 1
. 1 . 852 . 1 1 27 C N1 N 12.343 30.718 10.906 . . . 1.0 . . . . . . . . . . . . A . 27 C N1 . . . . . . . . . rr_1f79 1
. 1 . 853 . 1 1 27 C N3 N 11.987 30.392 8.589 . . . 1.0 . . . . . . . . . . . . A . 27 C N3 . . . . . . . . . rr_1f79 1
. 1 . 854 . 1 1 27 C N4 N 9.867 30.328 7.730 . . . 1.0 . . . . . . . . . . . . A . 27 C N4 . . . . . . . . . rr_1f79 1
. 1 . 855 . 1 1 27 C O2 O 14.071 30.462 9.456 . . . 1.0 . . . . . . . . . . . . A . 27 C O2 . . . . . . . . . rr_1f79 1
. 1 . 856 . 1 1 27 C O2' O 15.476 31.855 12.502 . . . 1.0 . . . . . . . . . . . . A . 27 C O2' . . . . . . . . . rr_1f79 1
. 1 . 857 . 1 1 27 C O3' O 14.290 34.197 13.050 . . . 1.0 . . . . . . . . . . . . A . 27 C O3' . . . . . . . . . rr_1f79 1
. 1 . 858 . 1 1 27 C O4' O 12.589 31.069 13.244 . . . 1.0 . . . . . . . . . . . . A . 27 C O4' . . . . . . . . . rr_1f79 1
. 1 . 859 . 1 1 27 C O5' O 11.005 32.033 15.314 . . . 1.0 . . . . . . . . . . . . A . 27 C O5' . . . . . . . . . rr_1f79 1
. 1 . 860 . 1 1 27 C OP1 O 10.506 32.915 17.603 . . . 1.0 . . . . . . . . . . . . A . 27 C OP1 . . . . . . . . . rr_1f79 1
. 1 . 861 . 1 1 27 C OP2 O 9.001 33.505 15.614 . . . 1.0 . . . . . . . . . . . . A . 27 C OP2 . . . . . . . . . rr_1f79 1
. 1 . 862 . 1 1 27 C P P 9.860 32.533 16.327 . . . 1.0 . . . . . . . . . . . . A . 27 C P . . . . . . . . . rr_1f79 1
. 1 . 863 . 2 2 1 NCO CO Co 6.441 14.368 8.059 . . . 1.0 . . . . . . . . . . . . A . 28 NCO CO . . . . . . . . . rr_1f79 1
. 1 . 864 . 2 2 1 NCO HN11 H 6.402 16.334 6.446 . . . 1.0 . . . . . . . . . . . . A . 28 NCO HN11 . . . . . . . . . rr_1f79 1
. 1 . 865 . 2 2 1 NCO HN12 H 7.879 16.246 7.123 . . . 1.0 . . . . . . . . . . . . A . 28 NCO HN12 . . . . . . . . . rr_1f79 1
. 1 . 866 . 2 2 1 NCO HN13 H 7.480 15.243 5.905 . . . 1.0 . . . . . . . . . . . . A . 28 NCO HN13 . . . . . . . . . rr_1f79 1
. 1 . 867 . 2 2 1 NCO HN21 H 6.468 12.381 9.647 . . . 1.0 . . . . . . . . . . . . A . 28 NCO HN21 . . . . . . . . . rr_1f79 1
. 1 . 868 . 2 2 1 NCO HN22 H 5.421 13.490 10.218 . . . 1.0 . . . . . . . . . . . . A . 28 NCO HN22 . . . . . . . . . rr_1f79 1
. 1 . 869 . 2 2 1 NCO HN23 H 4.982 12.511 8.997 . . . 1.0 . . . . . . . . . . . . A . 28 NCO HN23 . . . . . . . . . rr_1f79 1
. 1 . 870 . 2 2 1 NCO HN31 H 4.405 13.733 6.671 . . . 1.0 . . . . . . . . . . . . A . 28 NCO HN31 . . . . . . . . . rr_1f79 1
. 1 . 871 . 2 2 1 NCO HN32 H 5.715 13.728 5.706 . . . 1.0 . . . . . . . . . . . . A . 28 NCO HN32 . . . . . . . . . rr_1f79 1
. 1 . 872 . 2 2 1 NCO HN33 H 5.429 12.471 6.698 . . . 1.0 . . . . . . . . . . . . A . 28 NCO HN33 . . . . . . . . . rr_1f79 1
. 1 . 873 . 2 2 1 NCO HN41 H 8.677 13.634 7.093 . . . 1.0 . . . . . . . . . . . . A . 28 NCO HN41 . . . . . . . . . rr_1f79 1
. 1 . 874 . 2 2 1 NCO HN42 H 8.450 12.876 8.514 . . . 1.0 . . . . . . . . . . . . A . 28 NCO HN42 . . . . . . . . . rr_1f79 1
. 1 . 875 . 2 2 1 NCO HN43 H 7.697 12.339 7.177 . . . 1.0 . . . . . . . . . . . . A . 28 NCO HN43 . . . . . . . . . rr_1f79 1
. 1 . 876 . 2 2 1 NCO HN51 H 8.484 15.018 9.429 . . . 1.0 . . . . . . . . . . . . A . 28 NCO HN51 . . . . . . . . . rr_1f79 1
. 1 . 877 . 2 2 1 NCO HN52 H 7.440 16.264 9.433 . . . 1.0 . . . . . . . . . . . . A . 28 NCO HN52 . . . . . . . . . rr_1f79 1
. 1 . 878 . 2 2 1 NCO HN53 H 7.188 14.988 10.412 . . . 1.0 . . . . . . . . . . . . A . 28 NCO HN53 . . . . . . . . . rr_1f79 1
. 1 . 879 . 2 2 1 NCO HN61 H 5.181 16.395 8.947 . . . 1.0 . . . . . . . . . . . . A . 28 NCO HN61 . . . . . . . . . rr_1f79 1
. 1 . 880 . 2 2 1 NCO HN62 H 4.426 15.860 7.610 . . . 1.0 . . . . . . . . . . . . A . 28 NCO HN62 . . . . . . . . . rr_1f79 1
. 1 . 881 . 2 2 1 NCO HN63 H 4.204 15.098 9.031 . . . 1.0 . . . . . . . . . . . . A . 28 NCO HN63 . . . . . . . . . rr_1f79 1
. 1 . 882 . 2 2 1 NCO N1 N 7.126 15.694 6.737 . . . 1.0 . . . . . . . . . . . . A . 28 NCO N1 . . . . . . . . . rr_1f79 1
. 1 . 883 . 2 2 1 NCO N2 N 5.752 13.041 9.377 . . . 1.0 . . . . . . . . . . . . A . 28 NCO N2 . . . . . . . . . rr_1f79 1
. 1 . 884 . 2 2 1 NCO N3 N 5.380 13.477 6.625 . . . 1.0 . . . . . . . . . . . . A . 28 NCO N3 . . . . . . . . . rr_1f79 1
. 1 . 885 . 2 2 1 NCO N4 N 7.987 13.172 7.667 . . . 1.0 . . . . . . . . . . . . A . 28 NCO N4 . . . . . . . . . rr_1f79 1
. 1 . 886 . 2 2 1 NCO N5 N 7.505 15.258 9.492 . . . 1.0 . . . . . . . . . . . . A . 28 NCO N5 . . . . . . . . . rr_1f79 1
. 1 . 887 . 2 2 1 NCO N6 N 4.892 15.563 8.456 . . . 1.0 . . . . . . . . . . . . A . 28 NCO N6 . . . . . . . . . rr_1f79 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_1f79
_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 1f79.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 2 distance "hydrogen bond" simple 49 rr_1f79 1
1 1f79.mr . . n/a 3 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 4 distance NOE simple 280 rr_1f79 1
1 1f79.mr . . n/a 5 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 6 "dihedral angle" "Not applicable" "Not applicable" 20 rr_1f79 1
1 1f79.mr . . n/a 7 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 8 "dihedral angle" "Not applicable" "Not applicable" 108 rr_1f79 1
1 1f79.mr . . n/a 9 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 10 "dihedral angle" "Not applicable" "Not applicable" 24 rr_1f79 1
1 1f79.mr . . n/a 11 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 12 "dihedral angle" "Not applicable" "Not applicable" 20 rr_1f79 1
1 1f79.mr . . n/a 13 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 14 "dihedral angle" "Not applicable" "Not applicable" 18 rr_1f79 1
1 1f79.mr . . n/a 15 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 16 "dihedral angle" "Not applicable" "Not applicable" 18 rr_1f79 1
1 1f79.mr . . n/a 17 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 18 "dihedral angle" "Not applicable" "Not applicable" 18 rr_1f79 1
1 1f79.mr . . n/a 19 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 20 "dihedral angle" "Not applicable" "Not applicable" 20 rr_1f79 1
1 1f79.mr . . "MR format" 21 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_1f79 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_1f79
_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: '1f79'" . . . . distance "general distance" . 280 rr_1f79 1
2 "From CCPN project: '1f79'" . . . . distance "hydrogen bond" . 49 rr_1f79 1
4 "From CCPN project: '1f79'" . . . . "dihedral angle" "Not applicable" . 108 rr_1f79 1
5 "From CCPN project: '1f79'" . . . . "dihedral angle" "Not applicable" . 24 rr_1f79 1
7 "From CCPN project: '1f79'" . . . . "dihedral angle" "Not applicable" . 18 rr_1f79 1
9 "From CCPN project: '1f79'" . . . . "dihedral angle" "Not applicable" . 18 rr_1f79 1
3 "From CCPN project: '1f79'" . . . . "dihedral angle" "Not applicable" . 20 rr_1f79 1
10 "From CCPN project: '1f79'" . . . . "dihedral angle" "Not applicable" . 20 rr_1f79 1
8 "From CCPN project: '1f79'" . . . . "dihedral angle" "Not applicable" . 18 rr_1f79 1
6 "From CCPN project: '1f79'" . . . . "dihedral angle" "Not applicable" . 20 rr_1f79 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 1f79.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 2 distance "hydrogen bond" simple 49 rr_1f79 1
1 1f79.mr . . n/a 3 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 4 distance NOE simple 280 rr_1f79 1
1 1f79.mr . . n/a 5 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 6 "dihedral angle" "Not applicable" "Not applicable" 20 rr_1f79 1
1 1f79.mr . . n/a 7 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 8 "dihedral angle" "Not applicable" "Not applicable" 108 rr_1f79 1
1 1f79.mr . . n/a 9 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 10 "dihedral angle" "Not applicable" "Not applicable" 24 rr_1f79 1
1 1f79.mr . . n/a 11 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 12 "dihedral angle" "Not applicable" "Not applicable" 20 rr_1f79 1
1 1f79.mr . . n/a 13 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 14 "dihedral angle" "Not applicable" "Not applicable" 18 rr_1f79 1
1 1f79.mr . . n/a 15 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 16 "dihedral angle" "Not applicable" "Not applicable" 18 rr_1f79 1
1 1f79.mr . . n/a 17 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 18 "dihedral angle" "Not applicable" "Not applicable" 18 rr_1f79 1
1 1f79.mr . . n/a 19 comment "Not applicable" "Not applicable" 0 rr_1f79 1
1 1f79.mr . . XPLOR/CNS 20 "dihedral angle" "Not applicable" "Not applicable" 20 rr_1f79 1
1 1f79.mr . . "MR format" 21 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_1f79 1
stop_
save_
save_CNS/XPLOR_distance_constraints_4
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_4
_Gen_dist_constraint_list.Entry_ID rr_1f79
_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 4
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_1f79 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 G H8 H . . . 1 1 1 1 G H1' H . . . . . 2.0 2.0 5.0 . . . . . A . 1 G H8 . . A . 1 G H1' . . . 1 . H8 . . . . . 1 . H1' . . rr_1f79 1
2 1 . . 1 1 1 1 G H8 H . . . 1 1 1 1 G H2' H . . . . . 2.0 2.0 4.0 . . . . . A . 1 G H8 . . A . 1 G H2' . . . 1 . H8 . . . . . 1 . H2'' . . rr_1f79 1
3 1 . . 1 1 1 1 G H1' H . . . 1 1 2 2 G H8 H . . . . . 2.0 2.0 4.0 . . . . . A . 1 G H1' . . A . 2 G H8 . . . 1 . H1' . . . . . 2 . H8 . . rr_1f79 1
4 1 . . 1 1 1 1 G H2' H . . . 1 1 2 2 G H8 H . . . . . 1.8 1.8 3.2 . . . . . A . 1 G H2' . . A . 2 G H8 . . . 1 . H2'' . . . . . 2 . H8 . . rr_1f79 1
5 1 . . 1 1 1 1 G H2' H . . . 1 1 2 2 G H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 1 G H2' . . A . 2 G H1' . . . 1 . H2'' . . . . . 2 . H1' . . rr_1f79 1
6 1 . . 1 1 2 2 G H8 H . . . 1 1 1 1 G H3' H . . . . . 2.0 2.0 4.0 . . . . . A . 1 G H3' . . A . 2 G H8 . . . 1 . H3' . . . . . 2 . H8 . . rr_1f79 1
7 1 . . 1 1 2 2 G H8 H . . . 1 1 1 1 G H4' H . . . . . 3.0 3.0 7.0 . . . . . A . 1 G H4' . . A . 2 G H8 . . . 1 . H4' . . . . . 2 . H8 . . rr_1f79 1
8 1 . . 1 1 1 1 G H8 H . . . 1 1 2 2 G H8 H . . . . . 2.5 2.5 4.5 . . . . . A . 1 G H8 . . A . 2 G H8 . . . 1 . H8 . . . . . 2 . H8 . . rr_1f79 1
9 1 . . 1 1 2 2 G H8 H . . . 1 1 2 2 G H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 2 G H8 . . A . 2 G H1' . . . 2 . H8 . . . . . 2 . H1' . . rr_1f79 1
10 1 . . 1 1 2 2 G H8 H . . . 1 1 2 2 G H2' H . . . . . 2.0 2.0 5.0 . . . . . A . 2 G H8 . . A . 2 G H2' . . . 2 . H8 . . . . . 2 . H2'' . . rr_1f79 1
11 1 . . 1 1 2 2 G H1' H . . . 1 1 3 3 A H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 2 G H1' . . A . 3 A H8 . . . 2 . H1' . . . . . 3 . H8 . . rr_1f79 1
12 1 . . 1 1 2 2 G H2' H . . . 1 1 3 3 A H8 H . . . . . 1.8 1.8 3.2 . . . . . A . 2 G H2' . . A . 3 A H8 . . . 2 . H2'' . . . . . 3 . H8 . . rr_1f79 1
13 1 . . 1 1 2 2 G H2' H . . . 1 1 3 3 A H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 2 G H2' . . A . 3 A H1' . . . 2 . H2'' . . . . . 3 . H1' . . rr_1f79 1
14 1 . . 1 1 3 3 A H8 H . . . 1 1 2 2 G H3' H . . . . . 1.8 1.8 3.2 . . . . . A . 2 G H3' . . A . 3 A H8 . . . 2 . H3' . . . . . 3 . H8 . . rr_1f79 1
15 1 . . 1 1 3 3 A H8 H . . . 1 1 2 2 G H4' H . . . . . 3.0 3.0 7.0 . . . . . A . 2 G H4' . . A . 3 A H8 . . . 2 . H4' . . . . . 3 . H8 . . rr_1f79 1
16 1 . . 1 1 2 2 G H8 H . . . 1 1 3 3 A H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 2 G H8 . . A . 3 A H8 . . . 2 . H8 . . . . . 3 . H8 . . rr_1f79 1
17 1 . . 1 1 3 3 A H8 H . . . 1 1 3 3 A H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 3 A H8 . . A . 3 A H1' . . . 3 . H8 . . . . . 3 . H1' . . rr_1f79 1
18 1 . . 1 1 3 3 A H8 H . . . 1 1 3 3 A H2' H . . . . . 2.0 2.0 5.0 . . . . . A . 3 A H8 . . A . 3 A H2' . . . 3 . H8 . . . . . 3 . H2'' . . rr_1f79 1
19 1 . . 1 1 3 3 A H1' H . . . 1 1 3 3 A H2 H . . . . . 3.0 3.0 7.0 . . . . . A . 3 A H2 . . A . 3 A H1' . . . 3 . H2 . . . . . 3 . H1' . . rr_1f79 1
20 1 . . 1 1 3 3 A H1' H . . . 1 1 4 4 A H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 3 A H1' . . A . 4 A H8 . . . 3 . H1' . . . . . 4 . H8 . . rr_1f79 1
21 1 . . 1 1 3 3 A H2' H . . . 1 1 4 4 A H8 H . . . . . 1.8 1.8 3.2 . . . . . A . 3 A H2' . . A . 4 A H8 . . . 3 . H2'' . . . . . 4 . H8 . . rr_1f79 1
22 1 . . 1 1 3 3 A H2' H . . . 1 1 4 4 A H1' H . . . . . 3.0 3.0 7.0 . . . . . A . 3 A H2' . . A . 4 A H1' . . . 3 . H2'' . . . . . 4 . H1' . . rr_1f79 1
23 1 . . 1 1 4 4 A H8 H . . . 1 1 3 3 A H3' H . . . . . 2.0 2.0 4.0 . . . . . A . 3 A H3' . . A . 4 A H8 . . . 3 . H3' . . . . . 4 . H8 . . rr_1f79 1
24 1 . . 1 1 4 4 A H8 H . . . 1 1 3 3 A H4' H . . . . . 3.0 3.0 7.0 . . . . . A . 3 A H4' . . A . 4 A H8 . . . 3 . H4' . . . . . 4 . H8 . . rr_1f79 1
25 1 . . 1 1 3 3 A H8 H . . . 1 1 4 4 A H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 3 A H8 . . A . 4 A H8 . . . 3 . H8 . . . . . 4 . H8 . . rr_1f79 1
26 1 . . 1 1 3 3 A H2 H . . . 1 1 4 4 A H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 3 A H2 . . A . 4 A H1' . . . 3 . H2 . . . . . 4 . H1' . . rr_1f79 1
27 1 . . 1 1 3 3 A H2 H . . . 1 1 4 4 A H2 H . . . . . 2.0 2.0 5.0 . . . . . A . 3 A H2 . . A . 4 A H2 . . . 3 . H2 . . . . . 4 . H2 . . rr_1f79 1
28 1 . . 1 1 3 3 A H2 H . . . 1 1 26 26 C H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 3 A H2 . . A . 26 C H1' . . . 3 . H2 . . . . . 26 . H1' . . rr_1f79 1
29 1 . . 1 1 4 4 A H8 H . . . 1 1 4 4 A H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 4 A H8 . . A . 4 A H1' . . . 4 . H8 . . . . . 4 . H1' . . rr_1f79 1
30 1 . . 1 1 4 4 A H8 H . . . 1 1 4 4 A H2' H . . . . . 2.0 2.0 5.0 . . . . . A . 4 A H8 . . A . 4 A H2' . . . 4 . H8 . . . . . 4 . H2'' . . rr_1f79 1
31 1 . . 1 1 4 4 A H1' H . . . 1 1 4 4 A H2 H . . . . . 3.0 3.0 7.0 . . . . . A . 4 A H2 . . A . 4 A H1' . . . 4 . H2 . . . . . 4 . H1' . . rr_1f79 1
32 1 . . 1 1 4 4 A H1' H . . . 1 1 5 5 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 4 A H1' . . A . 5 G H8 . . . 4 . H1' . . . . . 5 . H8 . . rr_1f79 1
33 1 . . 1 1 4 4 A H1' H . . . 1 1 5 5 G H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 4 A H1' . . A . 5 G H1' . . . 4 . H1' . . . . . 5 . H1' . . rr_1f79 1
34 1 . . 1 1 4 4 A H2' H . . . 1 1 5 5 G H8 H . . . . . 1.8 1.8 3.2 . . . . . A . 4 A H2' . . A . 5 G H8 . . . 4 . H2'' . . . . . 5 . H8 . . rr_1f79 1
35 1 . . 1 1 4 4 A H2' H . . . 1 1 5 5 G H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 4 A H2' . . A . 5 G H1' . . . 4 . H2'' . . . . . 5 . H1' . . rr_1f79 1
36 1 . . 1 1 5 5 G H8 H . . . 1 1 4 4 A H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 4 A H3' . . A . 5 G H8 . . . 4 . H3' . . . . . 5 . H8 . . rr_1f79 1
37 1 . . 1 1 5 5 G H8 H . . . 1 1 4 4 A H4' H . . . . . 3.0 3.0 7.0 . . . . . A . 4 A H4' . . A . 5 G H8 . . . 4 . H4' . . . . . 5 . H8 . . rr_1f79 1
38 1 . . 1 1 4 4 A H8 H . . . 1 1 5 5 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 4 A H8 . . A . 5 G H8 . . . 4 . H8 . . . . . 5 . H8 . . rr_1f79 1
39 1 . . 1 1 4 4 A H2 H . . . 1 1 5 5 G H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 4 A H2 . . A . 5 G H1' . . . 4 . H2 . . . . . 5 . H1' . . rr_1f79 1
40 1 . . 1 1 4 4 A H2 H . . . 1 1 5 5 G H8 H . . . . . 3.0 3.0 7.0 . . . . . A . 4 A H2 . . A . 5 G H8 . . . 4 . H2 . . . . . 5 . H8 . . rr_1f79 1
41 1 . . 1 1 4 4 A H2 H . . . 1 1 25 25 U H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 4 A H2 . . A . 25 U H1' . . . 4 . H2 . . . . . 25 . H1' . . rr_1f79 1
42 1 . . 1 1 5 5 G H8 H . . . 1 1 5 5 G H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 5 G H8 . . A . 5 G H1' . . . 5 . H8 . . . . . 5 . H1' . . rr_1f79 1
43 1 . . 1 1 5 5 G H8 H . . . 1 1 5 5 G H2' H . . . . . 2.0 2.0 5.0 . . . . . A . 5 G H8 . . A . 5 G H2' . . . 5 . H8 . . . . . 5 . H2'' . . rr_1f79 1
44 1 . . 1 1 5 5 G H1' H . . . 1 1 6 6 U H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 5 G H1' . . A . 6 U H6 . . . 5 . H1' . . . . . 6 . H6 . . rr_1f79 1
45 1 . . 1 1 5 5 G H1' H . . . 1 1 6 6 U H5 H . . . . . 3.0 3.0 6.0 . . . . . A . 5 G H1' . . A . 6 U H5 . . . 5 . H1' . . . . . 6 . H5 . . rr_1f79 1
46 1 . . 1 1 5 5 G H2' H . . . 1 1 6 6 U H6 H . . . . . 1.8 1.8 3.8 . . . . . A . 5 G H2' . . A . 6 U H6 . . . 5 . H2'' . . . . . 6 . H6 . . rr_1f79 1
47 1 . . 1 1 5 5 G H2' H . . . 1 1 6 6 U H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 5 G H2' . . A . 6 U H5 . . . 5 . H2'' . . . . . 6 . H5 . . rr_1f79 1
48 1 . . 1 1 6 6 U H6 H . . . 1 1 5 5 G H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 5 G H3' . . A . 6 U H6 . . . 5 . H3' . . . . . 6 . H6 . . rr_1f79 1
49 1 . . 1 1 6 6 U H5 H . . . 1 1 5 5 G H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 5 G H3' . . A . 6 U H5 . . . 5 . H3' . . . . . 6 . H5 . . rr_1f79 1
50 1 . . 1 1 6 6 U H6 H . . . 1 1 5 5 G H4' H . . . . . 3.0 3.0 7.0 . . . . . A . 5 G H4' . . A . 6 U H6 . . . 5 . H4' . . . . . 6 . H6 . . rr_1f79 1
51 1 . . 1 1 5 5 G H8 H . . . 1 1 6 6 U H6 H . . . . . 2.0 2.0 4.0 . . . . . A . 5 G H8 . . A . 6 U H6 . . . 5 . H8 . . . . . 6 . H6 . . rr_1f79 1
52 1 . . 1 1 5 5 G H8 H . . . 1 1 6 6 U H5 H . . . . . 2.0 2.0 4.0 . . . . . A . 5 G H8 . . A . 6 U H5 . . . 5 . H8 . . . . . 6 . H5 . . rr_1f79 1
53 1 . . 1 1 6 6 U H6 H . . . 1 1 6 6 U H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 6 U H1' . . A . 6 U H6 . . . 6 . H1' . . . . . 6 . H6 . . rr_1f79 1
54 1 . . 1 1 6 6 U H6 H . . . 1 1 6 6 U H2' H . . . . . 1.8 1.8 3.8 . . . . . A . 6 U H2' . . A . 6 U H6 . . . 6 . H2'' . . . . . 6 . H6 . . rr_1f79 1
55 1 . . 1 1 6 6 U H1' H . . . 1 1 7 7 U H6 H . . . . . 3.0 3.0 7.0 . . . . . A . 6 U H1' . . A . 7 U H6 . . . 6 . H1' . . . . . 7 . H6 . . rr_1f79 1
56 1 . . 1 1 6 6 U H2' H . . . 1 1 7 7 U H6 H . . . . . 3.0 3.0 7.0 . . . . . A . 6 U H2' . . A . 7 U H6 . . . 6 . H2'' . . . . . 7 . H6 . . rr_1f79 1
57 1 . . 1 1 6 6 U H1' H . . . 1 1 8 8 C H6 H . . . . . 3.0 3.0 7.0 . . . . . A . 6 U H1' . . A . 8 C H6 . . . 6 . H1' . . . . . 8 . H6 . . rr_1f79 1
58 1 . . 1 1 6 6 U H2' H . . . 1 1 8 8 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 6 U H2' . . A . 8 C H6 . . . 6 . H2'' . . . . . 8 . H6 . . rr_1f79 1
59 1 . . 1 1 6 6 U H2' H . . . 1 1 8 8 C H5 H . . . . . 2.0 2.0 4.0 . . . . . A . 6 U H2' . . A . 8 C H5 . . . 6 . H2'' . . . . . 8 . H5 . . rr_1f79 1
60 1 . . 1 1 8 8 C H6 H . . . 1 1 6 6 U H4' H . . . . . 3.0 3.0 7.0 . . . . . A . 6 U H4' . . A . 8 C H6 . . . 6 . H4' . . . . . 8 . H6 . . rr_1f79 1
61 1 . . 1 1 6 6 U H6 H . . . 1 1 8 8 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 6 U H6 . . A . 8 C H6 . . . 6 . H6 . . . . . 8 . H6 . . rr_1f79 1
62 1 . . 1 1 6 6 U H6 H . . . 1 1 8 8 C H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 6 U H6 . . A . 8 C H5 . . . 6 . H6 . . . . . 8 . H5 . . rr_1f79 1
63 1 . . 1 1 6 6 U H5 H . . . 1 1 8 8 C H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 6 U H5 . . A . 8 C H5 . . . 6 . H5 . . . . . 8 . H5 . . rr_1f79 1
64 1 . . 1 1 7 7 U H6 H . . . 1 1 7 7 U H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 7 U H1' . . A . 7 U H6 . . . 7 . H1' . . . . . 7 . H6 . . rr_1f79 1
65 1 . . 1 1 7 7 U H2' H . . . 1 1 7 7 U H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 7 U H2' . . A . 7 U H5 . . . 7 . H2'' . . . . . 7 . H5 . . rr_1f79 1
66 1 . . 1 1 7 7 U H6 H . . . 1 1 8 8 C H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 7 U H6 . . A . 8 C H5 . . . 7 . H6 . . . . . 8 . H5 . . rr_1f79 1
67 1 . . 1 1 8 8 C H6 H . . . 1 1 7 7 U H2' H . . . . . 2.0 2.0 4.0 . . . . . A . 7 U H2' . . A . 8 C H6 . . . 7 . H2'' . . . . . 8 . H6 . . rr_1f79 1
68 1 . . 1 1 8 8 C H6 H . . . 1 1 7 7 U H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 7 U H3' . . A . 8 C H6 . . . 7 . H3' . . . . . 8 . H6 . . rr_1f79 1
69 1 . . 1 1 8 8 C H6 H . . . 1 1 7 7 U H4' H . . . . . 2.5 2.5 5.0 . . . . . A . 7 U H4' . . A . 8 C H6 . . . 7 . H4' . . . . . 8 . H6 . . rr_1f79 1
70 1 . . 1 1 8 8 C H6 H . . . 1 1 8 8 C H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 8 C H6 . . A . 8 C H1' . . . 8 . H6 . . . . . 8 . H1' . . rr_1f79 1
71 1 . . 1 1 8 8 C H6 H . . . 1 1 8 8 C H2' H . . . . . 1.8 1.8 3.8 . . . . . A . 8 C H6 . . A . 8 C H2' . . . 8 . H6 . . . . . 8 . H2'' . . rr_1f79 1
72 1 . . 1 1 8 8 C H5 H . . . 1 1 8 8 C H1' H . . . . . 3.0 3.0 7.0 . . . . . A . 8 C H5 . . A . 8 C H1' . . . 8 . H5 . . . . . 8 . H1' . . rr_1f79 1
73 1 . . 1 1 8 8 C H1' H . . . 1 1 9 9 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 8 C H1' . . A . 9 G H8 . . . 8 . H1' . . . . . 9 . H8 . . rr_1f79 1
74 1 . . 1 1 8 8 C H1' H . . . 1 1 9 9 G H1' H . . . . . 3.0 3.0 7.0 . . . . . A . 8 C H1' . . A . 9 G H1' . . . 8 . H1' . . . . . 9 . H1' . . rr_1f79 1
75 1 . . 1 1 8 8 C H2' H . . . 1 1 9 9 G H8 H . . . . . 1.8 1.8 3.2 . . . . . A . 8 C H2' . . A . 9 G H8 . . . 8 . H2'' . . . . . 9 . H8 . . rr_1f79 1
76 1 . . 1 1 8 8 C H2' H . . . 1 1 9 9 G H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 8 C H2' . . A . 9 G H1' . . . 8 . H2'' . . . . . 9 . H1' . . rr_1f79 1
77 1 . . 1 1 9 9 G H8 H . . . 1 1 8 8 C H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 8 C H3' . . A . 9 G H8 . . . 8 . H3' . . . . . 9 . H8 . . rr_1f79 1
78 1 . . 1 1 9 9 G H8 H . . . 1 1 8 8 C H4' H . . . . . 3.0 3.0 7.0 . . . . . A . 8 C H4' . . A . 9 G H8 . . . 8 . H4' . . . . . 9 . H8 . . rr_1f79 1
79 1 . . 1 1 8 8 C H6 H . . . 1 1 9 9 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 8 C H6 . . A . 9 G H8 . . . 8 . H6 . . . . . 9 . H8 . . rr_1f79 1
80 1 . . 1 1 9 9 G H8 H . . . 1 1 9 9 G H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 9 G H8 . . A . 9 G H1' . . . 9 . H8 . . . . . 9 . H1' . . rr_1f79 1
81 1 . . 1 1 9 9 G H8 H . . . 1 1 9 9 G H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 9 G H8 . . A . 9 G H2' . . . 9 . H8 . . . . . 9 . H2'' . . rr_1f79 1
82 1 . . 1 1 9 9 G H1' H . . . 1 1 10 10 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 9 G H1' . . A . 10 G H8 . . . 9 . H1' . . . . . 10 . H8 . . rr_1f79 1
83 1 . . 1 1 9 9 G H2' H . . . 1 1 10 10 G H8 H . . . . . 1.8 1.8 3.2 . . . . . A . 9 G H2' . . A . 10 G H8 . . . 9 . H2'' . . . . . 10 . H8 . . rr_1f79 1
84 1 . . 1 1 9 9 G H2' H . . . 1 1 10 10 G H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 9 G H2' . . A . 10 G H1' . . . 9 . H2'' . . . . . 10 . H1' . . rr_1f79 1
85 1 . . 1 1 10 10 G H8 H . . . 1 1 9 9 G H3' H . . . . . 2.0 2.0 4.0 . . . . . A . 9 G H3' . . A . 10 G H8 . . . 9 . H3' . . . . . 10 . H8 . . rr_1f79 1
86 1 . . 1 1 10 10 G H8 H . . . 1 1 9 9 G H4' H . . . . . 3.0 3.0 7.0 . . . . . A . 9 G H4' . . A . 10 G H8 . . . 9 . H4' . . . . . 10 . H8 . . rr_1f79 1
87 1 . . 1 1 9 9 G H8 H . . . 1 1 10 10 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 9 G H8 . . A . 10 G H8 . . . 9 . H8 . . . . . 10 . H8 . . rr_1f79 1
88 1 . . 1 1 9 9 G H8 H . . . 1 1 9 9 G H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 9 G H8 . . A . 9 G H1' . . . 9 . H8 . . . . . 9 . H1' . . rr_1f79 1
89 1 . . 1 1 9 9 G H8 H . . . 1 1 9 9 G H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 9 G H8 . . A . 9 G H2' . . . 9 . H8 . . . . . 9 . H2'' . . rr_1f79 1
90 1 . . 1 1 10 10 G H1' H . . . 1 1 11 11 U H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 10 G H1' . . A . 11 U H6 . . . 10 . H1' . . . . . 11 . H6 . . rr_1f79 1
91 1 . . 1 1 10 10 G H1' H . . . 1 1 11 11 U H5 H . . . . . 3.0 3.0 6.0 . . . . . A . 10 G H1' . . A . 11 U H5 . . . 10 . H1' . . . . . 11 . H5 . . rr_1f79 1
92 1 . . 1 1 11 11 U H6 H . . . 1 1 10 10 G H2' H . . . . . 1.8 1.8 3.2 . . . . . A . 10 G H2' . . A . 11 U H6 . . . 10 . H2'' . . . . . 11 . H6 . . rr_1f79 1
93 1 . . 1 1 11 11 U H5 H . . . 1 1 10 10 G H2' H . . . . . 2.0 2.0 4.0 . . . . . A . 10 G H2' . . A . 11 U H5 . . . 10 . H2'' . . . . . 11 . H5 . . rr_1f79 1
94 1 . . 1 1 10 10 G H2' H . . . 1 1 11 11 U H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 10 G H2' . . A . 11 U H1' . . . 10 . H2'' . . . . . 11 . H1' . . rr_1f79 1
95 1 . . 1 1 11 11 U H6 H . . . 1 1 10 10 G H3' H . . . . . 2.0 2.0 4.0 . . . . . A . 10 G H3' . . A . 11 U H6 . . . 10 . H3' . . . . . 11 . H6 . . rr_1f79 1
96 1 . . 1 1 10 10 G H8 H . . . 1 1 11 11 U H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 10 G H8 . . A . 11 U H6 . . . 10 . H8 . . . . . 11 . H6 . . rr_1f79 1
97 1 . . 1 1 10 10 G H8 H . . . 1 1 11 11 U H5 H . . . . . 2.0 2.0 4.0 . . . . . A . 10 G H8 . . A . 11 U H5 . . . 10 . H8 . . . . . 11 . H5 . . rr_1f79 1
98 1 . . 1 1 11 11 U H6 H . . . 1 1 11 11 U H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 11 U H6 . . A . 11 U H1' . . . 11 . H6 . . . . . 11 . H1' . . rr_1f79 1
99 1 . . 1 1 11 11 U H6 H . . . 1 1 11 11 U H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 11 U H6 . . A . 11 U H2' . . . 11 . H6 . . . . . 11 . H2'' . . rr_1f79 1
100 1 . . 1 1 11 11 U H5 H . . . 1 1 11 11 U H1' H . . . . . 3.0 3.0 7.0 . . . . . A . 11 U H5 . . A . 11 U H1' . . . 11 . H5 . . . . . 11 . H1' . . rr_1f79 1
101 1 . . 1 1 11 11 U H1' H . . . 1 1 12 12 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 11 U H1' . . A . 12 C H6 . . . 11 . H1' . . . . . 12 . H6 . . rr_1f79 1
102 1 . . 1 1 11 11 U H2' H . . . 1 1 12 12 C H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 11 U H2' . . A . 12 C H1' . . . 11 . H2'' . . . . . 12 . H1' . . rr_1f79 1
103 1 . . 1 1 11 11 U H2' H . . . 1 1 12 12 C H6 H . . . . . 1.8 1.8 3.2 . . . . . A . 11 U H2' . . A . 12 C H6 . . . 11 . H2'' . . . . . 12 . H6 . . rr_1f79 1
104 1 . . 1 1 11 11 U H2' H . . . 1 1 12 12 C H5 H . . . . . 2.0 2.0 4.0 . . . . . A . 11 U H2' . . A . 12 C H5 . . . 11 . H2'' . . . . . 12 . H5 . . rr_1f79 1
105 1 . . 1 1 12 12 C H6 H . . . 1 1 11 11 U H3' H . . . . . 2.0 2.0 4.0 . . . . . A . 11 U H3' . . A . 12 C H6 . . . 11 . H3' . . . . . 12 . H6 . . rr_1f79 1
106 1 . . 1 1 12 12 C H6 H . . . 1 1 11 11 U H4' H . . . . . 2.5 2.5 5.0 . . . . . A . 11 U H4' . . A . 12 C H6 . . . 11 . H4' . . . . . 12 . H6 . . rr_1f79 1
107 1 . . 1 1 11 11 U H6 H . . . 1 1 12 12 C H6 H . . . . . 3.0 3.0 7.0 . . . . . A . 11 U H6 . . A . 12 C H6 . . . 11 . H6 . . . . . 12 . H6 . . rr_1f79 1
108 1 . . 1 1 11 11 U H6 H . . . 1 1 12 12 C H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 11 U H6 . . A . 12 C H5 . . . 11 . H6 . . . . . 12 . H5 . . rr_1f79 1
109 1 . . 1 1 11 11 U H5 H . . . 1 1 12 12 C H5 H . . . . . 2.0 2.0 4.0 . . . . . A . 11 U H5 . . A . 12 C H5 . . . 11 . H5 . . . . . 12 . H5 . . rr_1f79 1
110 1 . . 1 1 12 12 C H6 H . . . 1 1 12 12 C H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 12 C H6 . . A . 12 C H1' . . . 12 . H6 . . . . . 12 . H1' . . rr_1f79 1
111 1 . . 1 1 12 12 C H6 H . . . 1 1 12 12 C H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 12 C H6 . . A . 12 C H2' . . . 12 . H6 . . . . . 12 . H2'' . . rr_1f79 1
112 1 . . 1 1 12 12 C H1' H . . . 1 1 13 13 U H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 12 C H1' . . A . 13 U H6 . . . 12 . H1' . . . . . 13 . H6 . . rr_1f79 1
113 1 . . 1 1 12 12 C H2' H . . . 1 1 13 13 U H1' H . . . . . 3.0 3.0 7.0 . . . . . A . 12 C H2' . . A . 13 U H1' . . . 12 . H2'' . . . . . 13 . H1' . . rr_1f79 1
114 1 . . 1 1 12 12 C H2' H . . . 1 1 13 13 U H6 H . . . . . 1.8 1.8 3.2 . . . . . A . 12 C H2' . . A . 13 U H6 . . . 12 . H2'' . . . . . 13 . H6 . . rr_1f79 1
115 1 . . 1 1 13 13 U H6 H . . . 1 1 12 12 C H3' H . . . . . 2.0 2.0 5.0 . . . . . A . 12 C H3' . . A . 13 U H6 . . . 12 . H3' . . . . . 13 . H6 . . rr_1f79 1
116 1 . . 1 1 13 13 U H6 H . . . 1 1 12 12 C H4' H . . . . . 3.0 3.0 7.0 . . . . . A . 12 C H4' . . A . 13 U H6 . . . 12 . H4' . . . . . 13 . H6 . . rr_1f79 1
117 1 . . 1 1 12 12 C H6 H . . . 1 1 13 13 U H6 H . . . . . 3.0 3.0 7.0 . . . . . A . 12 C H6 . . A . 13 U H6 . . . 12 . H6 . . . . . 13 . H6 . . rr_1f79 1
118 1 . . 1 1 12 12 C H6 H . . . 1 1 13 13 U H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 12 C H6 . . A . 13 U H5 . . . 12 . H6 . . . . . 13 . H5 . . rr_1f79 1
119 1 . . 1 1 12 12 C H5 H . . . 1 1 13 13 U H5 H . . . . . 2.0 2.0 4.0 . . . . . A . 12 C H5 . . A . 13 U H5 . . . 12 . H5 . . . . . 13 . H5 . . rr_1f79 1
120 1 . . 1 1 13 13 U H6 H . . . 1 1 13 13 U H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 13 U H6 . . A . 13 U H1' . . . 13 . H6 . . . . . 13 . H1' . . rr_1f79 1
121 1 . . 1 1 13 13 U H6 H . . . 1 1 13 13 U H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 13 U H6 . . A . 13 U H2' . . . 13 . H6 . . . . . 13 . H2'' . . rr_1f79 1
122 1 . . 1 1 13 13 U H1' H . . . 1 1 14 14 U H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 13 U H1' . . A . 14 U H5 . . . 13 . H1' . . . . . 14 . H5 . . rr_1f79 1
123 1 . . 1 1 14 14 U H5 H . . . 1 1 13 13 U H3' H . . . . . 3.0 3.0 7.0 . . . . . A . 13 U H3' . . A . 14 U H5 . . . 13 . H3' . . . . . 14 . H5 . . rr_1f79 1
124 1 . . 1 1 14 14 U H5 H . . . 1 1 13 13 U H4' H . . . . . 2.0 2.0 4.0 . . . . . A . 13 U H4' . . A . 14 U H5 . . . 13 . H4' . . . . . 14 . H5 . . rr_1f79 1
125 1 . . 1 1 13 13 U H2' H . . . 1 1 14 14 U H6 H . . . . . 3.0 3.0 7.0 . . . . . A . 13 U H2' . . A . 14 U H6 . . . 13 . H2'' . . . . . 14 . H6 . . rr_1f79 1
126 1 . . 1 1 13 13 U H1' H . . . 1 1 14 14 U H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 13 U H1' . . A . 14 U H5 . . . 13 . H1' . . . . . 14 . H5 . . rr_1f79 1
127 1 . . 1 1 13 13 U H2' H . . . 1 1 14 14 U H5 H . . . . . 2.0 2.0 4.0 . . . . . A . 13 U H2' . . A . 14 U H5 . . . 13 . H2'' . . . . . 14 . H5 . . rr_1f79 1
128 1 . . 1 1 13 13 U H2' H . . . 1 1 14 14 U H6 H . . . . . 3.0 3.0 7.0 . . . . . A . 13 U H2' . . A . 14 U H6 . . . 13 . H2'' . . . . . 14 . H6 . . rr_1f79 1
129 1 . . 1 1 13 13 U H6 H . . . 1 1 14 14 U H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 13 U H6 . . A . 14 U H5 . . . 13 . H6 . . . . . 14 . H5 . . rr_1f79 1
130 1 . . 1 1 13 13 U H3' H . . . 1 1 15 15 C H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 13 U H3' . . A . 15 C H5 . . . 13 . H3' . . . . . 15 . H5 . . rr_1f79 1
131 1 . . 1 1 14 14 U H6 H . . . 1 1 14 14 U H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 14 U H6 . . A . 14 U H1' . . . 14 . H6 . . . . . 14 . H1' . . rr_1f79 1
132 1 . . 1 1 14 14 U H6 H . . . 1 1 14 14 U H2' H . . . . . 1.8 1.8 3.2 . . . . . A . 14 U H6 . . A . 14 U H2' . . . 14 . H6 . . . . . 14 . H2'' . . rr_1f79 1
133 1 . . 1 1 14 14 U H2' H . . . 1 1 15 15 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 14 U H2' . . A . 15 C H6 . . . 14 . H2'' . . . . . 15 . H6 . . rr_1f79 1
134 1 . . 1 1 15 15 C H5 H . . . 1 1 14 14 U H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 14 U H2' . . A . 15 C H5 . . . 14 . H2'' . . . . . 15 . H5 . . rr_1f79 1
135 1 . . 1 1 14 14 U H6 H . . . 1 1 15 15 C H6 H . . . . . 2.0 2.0 4.0 . . . . . A . 14 U H6 . . A . 15 C H6 . . . 14 . H6 . . . . . 15 . H6 . . rr_1f79 1
136 1 . . 1 1 15 15 C H5 H . . . 1 1 14 14 U H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 14 U H2' . . A . 15 C H5 . . . 14 . H2'' . . . . . 15 . H5 . . rr_1f79 1
137 1 . . 1 1 15 15 C H5 H . . . 1 1 14 14 U H3' H . . . . . 2.0 2.0 4.0 . . . . . A . 14 U H3' . . A . 15 C H5 . . . 14 . H3' . . . . . 15 . H5 . . rr_1f79 1
138 1 . . 1 1 15 15 C H5 H . . . 1 1 14 14 U H4' H . . . . . 2.5 2.5 5.0 . . . . . A . 14 U H4' . . A . 15 C H5 . . . 14 . H4' . . . . . 15 . H5 . . rr_1f79 1
139 1 . . 1 1 15 15 C H5 H . . . 1 1 14 14 U H5' H . . . . . 2.0 2.0 4.0 . . . . . A . 14 U H5' . . A . 15 C H5 . . . 14 . H5' . . . . . 15 . H5 . . rr_1f79 1
140 1 . . 1 1 15 15 C H5 H . . . 1 1 14 14 U H5'' H . . . . . 2.0 2.0 4.0 . . . . . A . 14 U H5'' . . A . 15 C H5 . . . 14 . H5'' . . . . . 15 . H5 . . rr_1f79 1
141 1 . . 1 1 15 15 C H6 H . . . 1 1 15 15 C H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 15 C H6 . . A . 15 C H1' . . . 15 . H6 . . . . . 15 . H1' . . rr_1f79 1
142 1 . . 1 1 15 15 C H6 H . . . 1 1 15 15 C H2' H . . . . . 2.0 2.0 4.0 . . . . . A . 15 C H6 . . A . 15 C H2' . . . 15 . H6 . . . . . 15 . H2'' . . rr_1f79 1
143 1 . . 1 1 15 15 C H5 H . . . 1 1 15 15 C H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 15 C H5 . . A . 15 C H2' . . . 15 . H5 . . . . . 15 . H2'' . . rr_1f79 1
144 1 . . 1 1 15 15 C H3' H . . . 1 1 16 16 G H1' H . . . . . 3.0 3.0 7.0 . . . . . A . 15 C H3' . . A . 16 G H1' . . . 15 . H3' . . . . . 16 . H1' . . rr_1f79 1
145 1 . . 1 1 16 16 G H1' H . . . 1 1 15 15 C H4' H . . . . . 3.0 3.0 7.0 . . . . . A . 15 C H4' . . A . 16 G H1' . . . 15 . H4' . . . . . 16 . H1' . . rr_1f79 1
146 1 . . 1 1 15 15 C H4' H . . . 1 1 16 16 G H3' H . . . . . 3.0 3.0 7.0 . . . . . A . 15 C H4' . . A . 16 G H3' . . . 15 . H4' . . . . . 16 . H3' . . rr_1f79 1
147 1 . . 1 1 16 16 G H1' H . . . 1 1 16 16 G H8 H . . . . . 1.8 1.8 3.2 . . . . . A . 16 G H8 . . A . 16 G H1' . . . 16 . H8 . . . . . 16 . H1' . . rr_1f79 1
148 1 . . 1 1 16 16 G H8 H . . . 1 1 16 16 G H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 16 G H8 . . A . 16 G H2' . . . 16 . H8 . . . . . 16 . H2'' . . rr_1f79 1
149 1 . . 1 1 16 16 G H2' H . . . 1 1 17 17 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 16 G H2' . . A . 17 G H8 . . . 16 . H2'' . . . . . 17 . H8 . . rr_1f79 1
150 1 . . 1 1 16 16 G H3' H . . . 1 1 17 17 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 16 G H3' . . A . 17 G H8 . . . 16 . H3' . . . . . 17 . H8 . . rr_1f79 1
151 1 . . 1 1 16 16 G H8 H . . . 1 1 17 17 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 16 G H8 . . A . 17 G H8 . . . 16 . H8 . . . . . 17 . H8 . . rr_1f79 1
152 1 . . 1 1 17 17 G H8 H . . . 1 1 17 17 G H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 17 G H8 . . A . 17 G H1' . . . 17 . H8 . . . . . 17 . H1' . . rr_1f79 1
153 1 . . 1 1 17 17 G H8 H . . . 1 1 17 17 G H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 17 G H8 . . A . 17 G H2' . . . 17 . H8 . . . . . 17 . H2'' . . rr_1f79 1
154 1 . . 1 1 17 17 G H1' H . . . 1 1 18 18 A H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 17 G H1' . . A . 18 A H8 . . . 17 . H1' . . . . . 18 . H8 . . rr_1f79 1
155 1 . . 1 1 17 17 G H2' H . . . 1 1 18 18 A H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 17 G H2' . . A . 18 A H1' . . . 17 . H2'' . . . . . 18 . H1' . . rr_1f79 1
156 1 . . 1 1 17 17 G H2' H . . . 1 1 18 18 A H8 H . . . . . 1.8 1.8 3.2 . . . . . A . 17 G H2' . . A . 18 A H8 . . . 17 . H2'' . . . . . 18 . H8 . . rr_1f79 1
157 1 . . 1 1 17 17 G H8 H . . . 1 1 18 18 A H8 H . . . . . 2.0 2.0 4.0 . . . . . A . 17 G H8 . . A . 18 A H8 . . . 17 . H8 . . . . . 18 . H8 . . rr_1f79 1
158 1 . . 1 1 18 18 A H8 H . . . 1 1 18 18 A H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 18 A H8 . . A . 18 A H1' . . . 18 . H8 . . . . . 18 . H1' . . rr_1f79 1
159 1 . . 1 1 18 18 A H8 H . . . 1 1 18 18 A H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 18 A H8 . . A . 18 A H2' . . . 18 . H8 . . . . . 18 . H2'' . . rr_1f79 1
160 1 . . 1 1 18 18 A H1' H . . . 1 1 18 18 A H2 H . . . . . 3.0 3.0 7.0 . . . . . A . 18 A H2 . . A . 18 A H1' . . . 18 . H2 . . . . . 18 . H1' . . rr_1f79 1
161 1 . . 1 1 18 18 A H1' H . . . 1 1 19 19 C H1' H . . . . . 3.0 3.0 7.0 . . . . . A . 18 A H1' . . A . 19 C H1' . . . 18 . H1' . . . . . 19 . H1' . . rr_1f79 1
162 1 . . 1 1 18 18 A H1' H . . . 1 1 19 19 C H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 18 A H1' . . A . 19 C H5 . . . 18 . H1' . . . . . 19 . H5 . . rr_1f79 1
163 1 . . 1 1 18 18 A H1' H . . . 1 1 19 19 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 18 A H1' . . A . 19 C H6 . . . 18 . H1' . . . . . 19 . H6 . . rr_1f79 1
164 1 . . 1 1 18 18 A H2' H . . . 1 1 19 19 C H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 18 A H2' . . A . 19 C H1' . . . 18 . H2'' . . . . . 19 . H1' . . rr_1f79 1
165 1 . . 1 1 18 18 A H2' H . . . 1 1 19 19 C H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 18 A H2' . . A . 19 C H5 . . . 18 . H2'' . . . . . 19 . H5 . . rr_1f79 1
166 1 . . 1 1 18 18 A H2' H . . . 1 1 19 19 C H6 H . . . . . 2.0 2.0 4.0 . . . . . A . 18 A H2' . . A . 19 C H6 . . . 18 . H2'' . . . . . 19 . H6 . . rr_1f79 1
167 1 . . 1 1 19 19 C H6 H . . . 1 1 18 18 A H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 18 A H3' . . A . 19 C H6 . . . 18 . H3' . . . . . 19 . H6 . . rr_1f79 1
168 1 . . 1 1 18 18 A H8 H . . . 1 1 19 19 C H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 18 A H8 . . A . 19 C H5 . . . 18 . H8 . . . . . 19 . H5 . . rr_1f79 1
169 1 . . 1 1 18 18 A H8 H . . . 1 1 19 19 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 18 A H8 . . A . 19 C H6 . . . 18 . H8 . . . . . 19 . H6 . . rr_1f79 1
170 1 . . 1 1 18 18 A H2 H . . . 1 1 19 19 C H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 18 A H2 . . A . 19 C H1' . . . 18 . H2 . . . . . 19 . H1' . . rr_1f79 1
171 1 . . 1 1 18 18 A H2 H . . . 1 1 19 19 C H6 H . . . . . 3.0 3.0 7.0 . . . . . A . 18 A H2 . . A . 19 C H6 . . . 18 . H2 . . . . . 19 . H6 . . rr_1f79 1
172 1 . . 1 1 12 12 C H1' H . . . 1 1 18 18 A H2 H . . . . . 2.0 2.0 4.0 . . . . . A . 18 A H2 . . A . 12 C H1' . . . 18 . H2 . . . . . 12 . H1' . . rr_1f79 1
173 1 . . 1 1 19 19 C H1' H . . . 1 1 19 19 C H6 H . . . . . 2.0 2.0 4.0 . . . . . A . 19 C H6 . . A . 19 C H1' . . . 19 . H6 . . . . . 19 . H1' . . rr_1f79 1
174 1 . . 1 1 19 19 C H6 H . . . 1 1 19 19 C H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 19 C H6 . . A . 19 C H2' . . . 19 . H6 . . . . . 19 . H2'' . . rr_1f79 1
175 1 . . 1 1 19 19 C H1' H . . . 1 1 19 19 C H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 19 C H5 . . A . 19 C H1' . . . 19 . H5 . . . . . 19 . H1' . . rr_1f79 1
176 1 . . 1 1 19 19 C H1' H . . . 1 1 20 20 C H1' H . . . . . 3.0 3.0 7.0 . . . . . A . 19 C H1' . . A . 20 C H1' . . . 19 . H1' . . . . . 20 . H1' . . rr_1f79 1
177 1 . . 1 1 19 19 C H1' H . . . 1 1 20 20 C H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 19 C H1' . . A . 20 C H5 . . . 19 . H1' . . . . . 20 . H5 . . rr_1f79 1
178 1 . . 1 1 19 19 C H1' H . . . 1 1 20 20 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 19 C H1' . . A . 20 C H6 . . . 19 . H1' . . . . . 20 . H6 . . rr_1f79 1
179 1 . . 1 1 19 19 C H2' H . . . 1 1 20 20 C H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 19 C H2' . . A . 20 C H1' . . . 19 . H2'' . . . . . 20 . H1' . . rr_1f79 1
180 1 . . 1 1 19 19 C H2' H . . . 1 1 20 20 C H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 19 C H2' . . A . 20 C H5 . . . 19 . H2'' . . . . . 20 . H5 . . rr_1f79 1
181 1 . . 1 1 19 19 C H2' H . . . 1 1 20 20 C H6 H . . . . . 2.0 2.0 4.0 . . . . . A . 19 C H2' . . A . 20 C H6 . . . 19 . H2'' . . . . . 20 . H6 . . rr_1f79 1
182 1 . . 1 1 20 20 C H6 H . . . 1 1 19 19 C H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 19 C H3' . . A . 20 C H6 . . . 19 . H3' . . . . . 20 . H6 . . rr_1f79 1
183 1 . . 1 1 20 20 C H6 H . . . 1 1 19 19 C H4' H . . . . . 2.5 2.5 5.0 . . . . . A . 19 C H4' . . A . 20 C H6 . . . 19 . H4' . . . . . 20 . H6 . . rr_1f79 1
184 1 . . 1 1 19 19 C H5 H . . . 1 1 20 20 C H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 19 C H5 . . A . 20 C H5 . . . 19 . H5 . . . . . 20 . H5 . . rr_1f79 1
185 1 . . 1 1 19 19 C H5 H . . . 1 1 20 20 C H6 H . . . . . 3.0 3.0 7.0 . . . . . A . 19 C H5 . . A . 20 C H6 . . . 19 . H5 . . . . . 20 . H6 . . rr_1f79 1
186 1 . . 1 1 19 19 C H6 H . . . 1 1 20 20 C H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 19 C H6 . . A . 20 C H5 . . . 19 . H6 . . . . . 20 . H5 . . rr_1f79 1
187 1 . . 1 1 19 19 C H6 H . . . 1 1 20 20 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 19 C H6 . . A . 20 C H6 . . . 19 . H6 . . . . . 20 . H6 . . rr_1f79 1
188 1 . . 1 1 20 20 C H1' H . . . 1 1 20 20 C H6 H . . . . . 2.0 2.0 4.0 . . . . . A . 20 C H6 . . A . 20 C H1' . . . 20 . H6 . . . . . 20 . H1' . . rr_1f79 1
189 1 . . 1 1 20 20 C H6 H . . . 1 1 20 20 C H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 20 C H6 . . A . 20 C H2' . . . 20 . H6 . . . . . 20 . H2'' . . rr_1f79 1
190 1 . . 1 1 20 20 C H1' H . . . 1 1 20 20 C H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 20 C H5 . . A . 20 C H1' . . . 20 . H5 . . . . . 20 . H1' . . rr_1f79 1
191 1 . . 1 1 20 20 C H1' H . . . 1 1 21 21 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 20 C H1' . . A . 21 G H8 . . . 20 . H1' . . . . . 21 . H8 . . rr_1f79 1
192 1 . . 1 1 20 20 C H2' H . . . 1 1 21 21 G H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 20 C H2' . . A . 21 G H1' . . . 20 . H2'' . . . . . 21 . H1' . . rr_1f79 1
193 1 . . 1 1 20 20 C H2' H . . . 1 1 21 21 G H8 H . . . . . 1.8 1.8 3.2 . . . . . A . 20 C H2' . . A . 21 G H8 . . . 20 . H2'' . . . . . 21 . H8 . . rr_1f79 1
194 1 . . 1 1 21 21 G H8 H . . . 1 1 20 20 C H3' H . . . . . 2.0 2.0 4.0 . . . . . A . 20 C H3' . . A . 21 G H8 . . . 20 . H3' . . . . . 21 . H8 . . rr_1f79 1
195 1 . . 1 1 20 20 C H5 H . . . 1 1 21 21 G H8 H . . . . . 3.0 3.0 7.0 . . . . . A . 20 C H5 . . A . 21 G H8 . . . 20 . H5 . . . . . 21 . H8 . . rr_1f79 1
196 1 . . 1 1 20 20 C H6 H . . . 1 1 21 21 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 20 C H6 . . A . 21 G H8 . . . 20 . H6 . . . . . 21 . H8 . . rr_1f79 1
197 1 . . 1 1 21 21 G H8 H . . . 1 1 21 21 G H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 21 G H8 . . A . 21 G H1' . . . 21 . H8 . . . . . 21 . H1' . . rr_1f79 1
198 1 . . 1 1 21 21 G H8 H . . . 1 1 21 21 G H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 21 G H8 . . A . 21 G H2' . . . 21 . H8 . . . . . 21 . H2'' . . rr_1f79 1
199 1 . . 1 1 21 21 G H1' H . . . 1 1 22 22 G H8 H . . . . . 2.0 2.0 5.0 . . . . . A . 21 G H1' . . A . 22 G H8 . . . 21 . H1' . . . . . 22 . H8 . . rr_1f79 1
200 1 . . 1 1 21 21 G H2' H . . . 1 1 22 22 G H1' H . . . . . 3.0 3.0 7.0 . . . . . A . 21 G H2' . . A . 22 G H1' . . . 21 . H2'' . . . . . 22 . H1' . . rr_1f79 1
201 1 . . 1 1 21 21 G H2' H . . . 1 1 22 22 G H8 H . . . . . 1.8 1.8 3.2 . . . . . A . 21 G H2' . . A . 22 G H8 . . . 21 . H2'' . . . . . 22 . H8 . . rr_1f79 1
202 1 . . 1 1 22 22 G H8 H . . . 1 1 21 21 G H3' H . . . . . 2.0 2.0 4.0 . . . . . A . 21 G H3' . . A . 22 G H8 . . . 21 . H3' . . . . . 22 . H8 . . rr_1f79 1
203 1 . . 1 1 22 22 G H8 H . . . 1 1 21 21 G H4' H . . . . . 2.5 2.5 5.0 . . . . . A . 21 G H4' . . A . 22 G H8 . . . 21 . H4' . . . . . 22 . H8 . . rr_1f79 1
204 1 . . 1 1 21 21 G H8 H . . . 1 1 22 22 G H8 H . . . . . 2.5 2.5 5.0 . . . . . A . 21 G H8 . . A . 22 G H8 . . . 21 . H8 . . . . . 22 . H8 . . rr_1f79 1
205 1 . . 1 1 22 22 G H8 H . . . 1 1 22 22 G H1' H . . . . . 2.0 2.0 4.0 . . . . . A . 22 G H8 . . A . 22 G H1' . . . 22 . H8 . . . . . 22 . H1' . . rr_1f79 1
206 1 . . 1 1 22 22 G H8 H . . . 1 1 22 22 G H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 22 G H8 . . A . 22 G H2' . . . 22 . H8 . . . . . 22 . H2'' . . rr_1f79 1
207 1 . . 1 1 22 22 G H8 H . . . 1 1 22 22 G H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 22 G H8 . . A . 22 G H3' . . . 22 . H8 . . . . . 22 . H3' . . rr_1f79 1
208 1 . . 1 1 22 22 G H1' H . . . 1 1 23 23 C H1' H . . . . . 3.0 3.0 7.0 . . . . . A . 22 G H1' . . A . 23 C H1' . . . 22 . H1' . . . . . 23 . H1' . . rr_1f79 1
209 1 . . 1 1 22 22 G H1' H . . . 1 1 23 23 C H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 22 G H1' . . A . 23 C H5 . . . 22 . H1' . . . . . 23 . H5 . . rr_1f79 1
210 1 . . 1 1 22 22 G H1' H . . . 1 1 23 23 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 22 G H1' . . A . 23 C H6 . . . 22 . H1' . . . . . 23 . H6 . . rr_1f79 1
211 1 . . 1 1 22 22 G H2' H . . . 1 1 23 23 C H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 22 G H2' . . A . 23 C H1' . . . 22 . H2'' . . . . . 23 . H1' . . rr_1f79 1
212 1 . . 1 1 22 22 G H2' H . . . 1 1 23 23 C H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 22 G H2' . . A . 23 C H5 . . . 22 . H2'' . . . . . 23 . H5 . . rr_1f79 1
213 1 . . 1 1 22 22 G H2' H . . . 1 1 23 23 C H6 H . . . . . 2.0 2.0 4.0 . . . . . A . 22 G H2' . . A . 23 C H6 . . . 22 . H2'' . . . . . 23 . H6 . . rr_1f79 1
214 1 . . 1 1 22 22 G H3' H . . . 1 1 23 23 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 22 G H3' . . A . 23 C H6 . . . 22 . H3' . . . . . 23 . H6 . . rr_1f79 1
215 1 . . 1 1 22 22 G H8 H . . . 1 1 23 23 C H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 22 G H8 . . A . 23 C H5 . . . 22 . H8 . . . . . 23 . H5 . . rr_1f79 1
216 1 . . 1 1 22 22 G H8 H . . . 1 1 23 23 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 22 G H8 . . A . 23 C H6 . . . 22 . H8 . . . . . 23 . H6 . . rr_1f79 1
217 1 . . 1 1 23 23 C H1' H . . . 1 1 23 23 C H6 H . . . . . 2.0 2.0 4.0 . . . . . A . 23 C H6 . . A . 23 C H1' . . . 23 . H6 . . . . . 23 . H1' . . rr_1f79 1
218 1 . . 1 1 23 23 C H6 H . . . 1 1 23 23 C H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 23 C H6 . . A . 23 C H2' . . . 23 . H6 . . . . . 23 . H2'' . . rr_1f79 1
219 1 . . 1 1 23 23 C H1' H . . . 1 1 23 23 C H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 23 C H5 . . A . 23 C H1' . . . 23 . H5 . . . . . 23 . H1' . . rr_1f79 1
220 1 . . 1 1 23 23 C H1' H . . . 1 1 24 24 U H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 23 C H1' . . A . 24 U H5 . . . 23 . H1' . . . . . 24 . H5 . . rr_1f79 1
221 1 . . 1 1 23 23 C H1' H . . . 1 1 24 24 U H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 23 C H1' . . A . 24 U H6 . . . 23 . H1' . . . . . 24 . H6 . . rr_1f79 1
222 1 . . 1 1 23 23 C H2' H . . . 1 1 24 24 U H1' H . . . . . 3.0 3.0 7.0 . . . . . A . 23 C H2' . . A . 24 U H1' . . . 23 . H2'' . . . . . 24 . H1' . . rr_1f79 1
223 1 . . 1 1 23 23 C H2' H . . . 1 1 24 24 U H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 23 C H2' . . A . 24 U H5 . . . 23 . H2'' . . . . . 24 . H5 . . rr_1f79 1
224 1 . . 1 1 23 23 C H2' H . . . 1 1 24 24 U H6 H . . . . . 1.8 1.8 3.2 . . . . . A . 23 C H2' . . A . 24 U H6 . . . 23 . H2'' . . . . . 24 . H6 . . rr_1f79 1
225 1 . . 1 1 24 24 U H6 H . . . 1 1 23 23 C H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 23 C H3' . . A . 24 U H6 . . . 23 . H3' . . . . . 24 . H6 . . rr_1f79 1
226 1 . . 1 1 23 23 C H5 H . . . 1 1 24 24 U H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 23 C H5 . . A . 24 U H5 . . . 23 . H5 . . . . . 24 . H5 . . rr_1f79 1
227 1 . . 1 1 23 23 C H5 H . . . 1 1 24 24 U H6 H . . . . . 3.0 3.0 7.0 . . . . . A . 23 C H5 . . A . 24 U H6 . . . 23 . H5 . . . . . 24 . H6 . . rr_1f79 1
228 1 . . 1 1 23 23 C H6 H . . . 1 1 24 24 U H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 23 C H6 . . A . 24 U H5 . . . 23 . H6 . . . . . 24 . H5 . . rr_1f79 1
229 1 . . 1 1 23 23 C H6 H . . . 1 1 24 24 U H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 23 C H6 . . A . 24 U H6 . . . 23 . H6 . . . . . 24 . H6 . . rr_1f79 1
230 1 . . 1 1 24 24 U H6 H . . . 1 1 24 24 U H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 24 U H6 . . A . 24 U H1' . . . 24 . H6 . . . . . 24 . H1' . . rr_1f79 1
231 1 . . 1 1 24 24 U H6 H . . . 1 1 24 24 U H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 24 U H6 . . A . 24 U H2' . . . 24 . H6 . . . . . 24 . H2'' . . rr_1f79 1
232 1 . . 1 1 24 24 U H5 H . . . 1 1 24 24 U H1' H . . . . . 3.0 3.0 7.0 . . . . . A . 24 U H5 . . A . 24 U H1' . . . 24 . H5 . . . . . 24 . H1' . . rr_1f79 1
233 1 . . 1 1 24 24 U H1' H . . . 1 1 25 25 U H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 24 U H1' . . A . 25 U H5 . . . 24 . H1' . . . . . 25 . H5 . . rr_1f79 1
234 1 . . 1 1 24 24 U H1' H . . . 1 1 25 25 U H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 24 U H1' . . A . 25 U H6 . . . 24 . H1' . . . . . 25 . H6 . . rr_1f79 1
235 1 . . 1 1 25 25 U H1' H . . . 1 1 24 24 U H2' H . . . . . 3.0 3.0 7.0 . . . . . A . 24 U H2' . . A . 25 U H1' . . . 24 . H2'' . . . . . 25 . H1' . . rr_1f79 1
236 1 . . 1 1 24 24 U H2' H . . . 1 1 25 25 U H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 24 U H2' . . A . 25 U H5 . . . 24 . H2'' . . . . . 25 . H5 . . rr_1f79 1
237 1 . . 1 1 24 24 U H2' H . . . 1 1 25 25 U H6 H . . . . . 1.8 1.8 3.2 . . . . . A . 24 U H2' . . A . 25 U H6 . . . 24 . H2'' . . . . . 25 . H6 . . rr_1f79 1
238 1 . . 1 1 25 25 U H6 H . . . 1 1 24 24 U H3' H . . . . . 2.0 2.0 4.0 . . . . . A . 24 U H3' . . A . 25 U H6 . . . 24 . H3' . . . . . 25 . H6 . . rr_1f79 1
239 1 . . 1 1 24 24 U H5 H . . . 1 1 25 25 U H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 24 U H5 . . A . 25 U H5 . . . 24 . H5 . . . . . 25 . H5 . . rr_1f79 1
240 1 . . 1 1 24 24 U H5 H . . . 1 1 25 25 U H6 H . . . . . 3.0 3.0 7.0 . . . . . A . 24 U H5 . . A . 25 U H6 . . . 24 . H5 . . . . . 25 . H6 . . rr_1f79 1
241 1 . . 1 1 24 24 U H6 H . . . 1 1 25 25 U H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 24 U H6 . . A . 25 U H5 . . . 24 . H6 . . . . . 25 . H5 . . rr_1f79 1
242 1 . . 1 1 24 24 U H6 H . . . 1 1 25 25 U H6 H . . . . . 3.0 3.0 7.0 . . . . . A . 24 U H6 . . A . 25 U H6 . . . 24 . H6 . . . . . 25 . H6 . . rr_1f79 1
243 1 . . 1 1 25 25 U H1' H . . . 1 1 25 25 U H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 25 U H6 . . A . 25 U H1' . . . 25 . H6 . . . . . 25 . H1' . . rr_1f79 1
244 1 . . 1 1 25 25 U H6 H . . . 1 1 25 25 U H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 25 U H6 . . A . 25 U H2' . . . 25 . H6 . . . . . 25 . H2'' . . rr_1f79 1
245 1 . . 1 1 25 25 U H1' H . . . 1 1 25 25 U H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 25 U H5 . . A . 25 U H1' . . . 25 . H5 . . . . . 25 . H1' . . rr_1f79 1
246 1 . . 1 1 25 25 U H1' H . . . 1 1 26 26 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 25 U H1' . . A . 26 C H6 . . . 25 . H1' . . . . . 26 . H6 . . rr_1f79 1
247 1 . . 1 1 26 26 C H1' H . . . 1 1 25 25 U H2' H . . . . . 3.0 3.0 7.0 . . . . . A . 25 U H2' . . A . 26 C H1' . . . 25 . H2'' . . . . . 26 . H1' . . rr_1f79 1
248 1 . . 1 1 25 25 U H2' H . . . 1 1 26 26 C H5 H . . . . . 3.0 3.0 7.0 . . . . . A . 25 U H2' . . A . 26 C H5 . . . 25 . H2'' . . . . . 26 . H5 . . rr_1f79 1
249 1 . . 1 1 25 25 U H2' H . . . 1 1 26 26 C H6 H . . . . . 2.0 2.0 4.0 . . . . . A . 25 U H2' . . A . 26 C H6 . . . 25 . H2'' . . . . . 26 . H6 . . rr_1f79 1
250 1 . . 1 1 26 26 C H6 H . . . 1 1 25 25 U H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 25 U H3' . . A . 26 C H6 . . . 25 . H3' . . . . . 26 . H6 . . rr_1f79 1
251 1 . . 1 1 25 25 U H5 H . . . 1 1 26 26 C H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 25 U H5 . . A . 26 C H5 . . . 25 . H5 . . . . . 26 . H5 . . rr_1f79 1
252 1 . . 1 1 25 25 U H5 H . . . 1 1 26 26 C H6 H . . . . . 3.0 3.0 7.0 . . . . . A . 25 U H5 . . A . 26 C H6 . . . 25 . H5 . . . . . 26 . H6 . . rr_1f79 1
253 1 . . 1 1 25 25 U H6 H . . . 1 1 26 26 C H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 25 U H6 . . A . 26 C H5 . . . 25 . H6 . . . . . 26 . H5 . . rr_1f79 1
254 1 . . 1 1 25 25 U H6 H . . . 1 1 26 26 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 25 U H6 . . A . 26 C H6 . . . 25 . H6 . . . . . 26 . H6 . . rr_1f79 1
255 1 . . 1 1 26 26 C H1' H . . . 1 1 26 26 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 26 C H6 . . A . 26 C H1' . . . 26 . H6 . . . . . 26 . H1' . . rr_1f79 1
256 1 . . 1 1 26 26 C H6 H . . . 1 1 26 26 C H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 26 C H6 . . A . 26 C H2' . . . 26 . H6 . . . . . 26 . H2'' . . rr_1f79 1
257 1 . . 1 1 26 26 C H1' H . . . 1 1 27 27 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 26 C H1' . . A . 27 C H6 . . . 26 . H1' . . . . . 27 . H6 . . rr_1f79 1
258 1 . . 1 1 26 26 C H2' H . . . 1 1 27 27 C H1' H . . . . . 3.0 3.0 7.0 . . . . . A . 26 C H2' . . A . 27 C H1' . . . 26 . H2'' . . . . . 27 . H1' . . rr_1f79 1
259 1 . . 1 1 26 26 C H2' H . . . 1 1 27 27 C H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 26 C H2' . . A . 27 C H5 . . . 26 . H2'' . . . . . 27 . H5 . . rr_1f79 1
260 1 . . 1 1 26 26 C H2' H . . . 1 1 27 27 C H6 H . . . . . 2.0 2.0 4.0 . . . . . A . 26 C H2' . . A . 27 C H6 . . . 26 . H2'' . . . . . 27 . H6 . . rr_1f79 1
261 1 . . 1 1 27 27 C H6 H . . . 1 1 26 26 C H3' H . . . . . 2.5 2.5 5.0 . . . . . A . 26 C H3' . . A . 27 C H6 . . . 26 . H3' . . . . . 27 . H6 . . rr_1f79 1
262 1 . . 1 1 27 27 C H6 H . . . 1 1 26 26 C H4' H . . . . . 3.0 3.0 7.0 . . . . . A . 26 C H4' . . A . 27 C H6 . . . 26 . H4' . . . . . 27 . H6 . . rr_1f79 1
263 1 . . 1 1 26 26 C H5 H . . . 1 1 27 27 C H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 26 C H5 . . A . 27 C H5 . . . 26 . H5 . . . . . 27 . H5 . . rr_1f79 1
264 1 . . 1 1 26 26 C H6 H . . . 1 1 27 27 C H5 H . . . . . 2.5 2.5 5.0 . . . . . A . 26 C H6 . . A . 27 C H5 . . . 26 . H6 . . . . . 27 . H5 . . rr_1f79 1
265 1 . . 1 1 26 26 C H6 H . . . 1 1 27 27 C H6 H . . . . . 2.5 2.5 5.0 . . . . . A . 26 C H6 . . A . 27 C H6 . . . 26 . H6 . . . . . 27 . H6 . . rr_1f79 1
266 1 . . 1 1 27 27 C H6 H . . . 1 1 27 27 C H1' H . . . . . 2.5 2.5 5.0 . . . . . A . 27 C H6 . . A . 27 C H1' . . . 27 . H6 . . . . . 27 . H1' . . rr_1f79 1
267 1 . . 1 1 27 27 C H6 H . . . 1 1 27 27 C H2' H . . . . . 2.5 2.5 5.0 . . . . . A . 27 C H6 . . A . 27 C H2' . . . 27 . H6 . . . . . 27 . H2'' . . rr_1f79 1
268 1 . . 1 1 27 27 C H6 H . . . 1 1 27 27 C H1' H . . . . . 3.0 3.0 7.0 . . . . . A . 27 C H6 . . A . 27 C H1' . . . 27 . H6 . . . . . 27 . H1' . . rr_1f79 1
269 1 . . 2 2 1 1 NCO CO Co . . . 1 1 5 5 G H1 H . . . . . 4.3 4.3 9.3 . . . . . A . 28 NCO CO . . A . 5 G H1 . . . 28 . CO . . . . . 5 . H1 . . rr_1f79 1
270 1 . . 2 2 1 1 NCO CO Co . . . 1 1 9 9 G H1 H . . . . . 4.3 4.3 9.3 . . . . . A . 28 NCO CO . . A . 9 G H1 . . . 28 . CO . . . . . 9 . H1 . . rr_1f79 1
271 1 . . 2 2 1 1 NCO CO Co . . . 1 1 10 10 G H1 H . . . . . 4.3 4.3 9.3 . . . . . A . 28 NCO CO . . A . 10 G H1 . . . 28 . CO . . . . . 10 . H1 . . rr_1f79 1
272 1 . . 2 2 1 1 NCO CO Co . . . 1 1 21 21 G H1 H . . . . . 4.3 4.3 9.3 . . . . . A . 28 NCO CO . . A . 21 G H1 . . . 28 . CO . . . . . 21 . H1 . . rr_1f79 1
273 1 . . 2 2 1 1 NCO CO Co . . . 1 1 11 11 U H3 H . . . . . 4.3 4.3 11.3 . . . . . A . 28 NCO CO . . A . 11 U H3 . . . 28 . CO . . . . . 11 . H3 . . rr_1f79 1
274 1 . . 2 2 1 1 NCO CO Co . . . 1 1 24 24 U H3 H . . . . . 4.3 4.3 11.3 . . . . . A . 28 NCO CO . . A . 24 U H3 . . . 28 . CO . . . . . 24 . H3 . . rr_1f79 1
275 1 . . 1 1 21 21 G H8 H . . . 2 2 1 1 NCO CO Co . . . . . 4.3 4.3 9.3 . . . . . A . 28 NCO CO . . A . 21 G H8 . . . 28 . CO . . . . . 21 . H8 . . rr_1f79 1
276 1 . . 1 1 20 20 C H6 H . . . 2 2 1 1 NCO CO Co . . . . . 4.3 4.3 9.3 . . . . . A . 28 NCO CO . . A . 20 C H6 . . . 28 . CO . . . . . 20 . H6 . . rr_1f79 1
277 1 . . 1 1 23 23 C H6 H . . . 2 2 1 1 NCO CO Co . . . . . 4.3 4.3 9.3 . . . . . A . 28 NCO CO . . A . 23 C H6 . . . 28 . CO . . . . . 23 . H6 . . rr_1f79 1
278 1 . . 1 1 5 5 G H8 H . . . 2 2 1 1 NCO CO Co . . . . . 4.3 4.3 11.3 . . . . . A . 28 NCO CO . . A . 5 G H8 . . . 28 . CO . . . . . 5 . H8 . . rr_1f79 1
279 1 . . 1 1 19 19 C H6 H . . . 2 2 1 1 NCO CO Co . . . . . 4.3 4.3 11.3 . . . . . A . 28 NCO CO . . A . 19 C H6 . . . 28 . CO . . . . . 19 . H6 . . rr_1f79 1
280 1 . . 1 1 22 22 G H8 H . . . 2 2 1 1 NCO CO Co . . . . . 4.3 4.3 11.3 . . . . . A . 28 NCO CO . . A . 22 G H8 . . . 28 . CO . . . . . 22 . H8 . . rr_1f79 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 "constraints for residue 1 from expt" 1 2 1 2 rr_1f79 1
2 "constraints for residue 1 to 2 from expt" 5 2 5 2 rr_1f79 1
3 "constraints for residue 2 from expt" 13 2 13 2 rr_1f79 1
4 "constraints for residue 2 to 3 from expt" 17 2 17 2 rr_1f79 1
5 overl. 22 68 22 68 rr_1f79 1
6 "constraints for residue 3 from expt" 25 2 25 2 rr_1f79 1
7 "constraints for residue 3 to 4 from expt" 30 2 30 2 rr_1f79 1
8 "constraints for residue 3 to 26 from expt" 40 2 40 2 rr_1f79 1
9 "constraints for residue 4 from expt" 43 2 43 2 rr_1f79 1
10 "constraints for residue 4 to 5 from expt" 48 2 48 2 rr_1f79 1
11 "constraints for residue 4 to 25 from expt" 59 2 59 2 rr_1f79 1
12 "constraints for residue 5 from expt" 62 2 62 2 rr_1f79 1
13 "constraints for residue 5 to 6 from expt" 66 2 66 2 rr_1f79 1
14 overl. 71 68 71 68 rr_1f79 1
15 "constraints for residue 6 from expt" 77 2 77 2 rr_1f79 1
16 "constraints for residue 6 to 7 from expt" 81 2 81 2 rr_1f79 1
17 overl. 83 69 83 69 rr_1f79 1
18 "constraints for residue 6 to 8 from expt" 85 2 85 2 rr_1f79 1
19 overl. 89 68 89 68 rr_1f79 1
20 "constraints for residue 7 from expt" 94 2 94 2 rr_1f79 1
21 "constraints for residue 7 to 8 from expt" 98 2 98 2 rr_1f79 1
22 "constraints for residue 8 from expt" 104 2 104 2 rr_1f79 1
23 "constraints for residue 8 to 9 from expt" 109 2 109 2 rr_1f79 1
24 overl. 114 68 114 68 rr_1f79 1
25 overl. 115 68 115 68 rr_1f79 1
26 "constraints for residue 9 from expt" 118 2 118 2 rr_1f79 1
27 "constraints for residue 9 to 10 from expt" 122 2 122 2 rr_1f79 1
28 "constraints for residue 10 from expt" 130 2 130 2 rr_1f79 1
29 "constraints for residue 10 to 11 from expt" 134 2 134 2 rr_1f79 1
30 "~= H2'" 140 70 140 70 rr_1f79 1
31 "constraints for residue 11 from expt" 144 2 144 2 rr_1f79 1
32 "constraints for residue 11 to 12 from expt" 149 2 149 2 rr_1f79 1
33 "constraints for residue 12 from expt" 160 2 160 2 rr_1f79 1
34 "constraints for residue 12 to 13 from expt" 164 2 164 2 rr_1f79 1
35 "constraints for residue 13 from expt" 174 2 174 2 rr_1f79 1
36 "constraints for residue 13 to 14 from expt" 178 2 178 2 rr_1f79 1
37 "constraints for residue 13 to 15 from expt" 184 2 184 2 rr_1f79 1
38 "constraints for residue 14 from expt" 191 2 191 2 rr_1f79 1
39 "constraints for residue 14 to 15 from expt" 195 2 195 2 rr_1f79 1
40 "constraints for residue 15 from expt" 206 2 206 2 rr_1f79 1
41 "constraints for residue 15 to 16 from expt" 212 2 212 2 rr_1f79 1
42 "constraints for residue 16 from expt - syn" 217 2 217 2 rr_1f79 1
43 "constraints for residue 16 to 17 from expt" 221 2 221 2 rr_1f79 1
44 "constraints for residue 17 from expt" 226 2 226 2 rr_1f79 1
45 "constraints for residue 17 to 18 from expt" 230 2 230 2 rr_1f79 1
46 "constraints for residue 18 from expt" 236 2 236 2 rr_1f79 1
47 "constraints for residue 18 to 19 from expt" 241 2 241 2 rr_1f79 1
48 "constraints for residue 18 to 12 from expt" 254 2 254 2 rr_1f79 1
49 "constraints for residue 19 from expt" 257 2 257 2 rr_1f79 1
50 "constraints for residue 19 to 20 from expt" 262 2 262 2 rr_1f79 1
51 "constraints for residue 20 from expt" 276 2 276 2 rr_1f79 1
52 "constraints for residue 20 to 21 from expt" 281 2 281 2 rr_1f79 1
53 "constraints for residue 21 from expt" 289 2 289 2 rr_1f79 1
54 "constraints for residue 21 to 22 from expt" 293 2 293 2 rr_1f79 1
55 "constraints for residue 22 from expt" 301 2 301 2 rr_1f79 1
56 "constraints for residue 22 to 23 from expt" 306 2 306 2 rr_1f79 1
57 "constraints for residue 23 from expt" 317 2 317 2 rr_1f79 1
58 "constraints for residue 23 to 24 from expt" 322 2 322 2 rr_1f79 1
59 overl. 328 70 328 70 rr_1f79 1
60 "constraints for residue 24 from expt" 334 2 334 2 rr_1f79 1
61 "constraints for residue 24 to 25 from expt" 339 2 339 2 rr_1f79 1
62 "~= 2'" 345 70 345 70 rr_1f79 1
63 "constraints for residue 25 from expt" 351 2 351 2 rr_1f79 1
64 "constraints for residue 25 to 26 from expt" 356 2 356 2 rr_1f79 1
65 "constraints for residue 26 from expt" 367 2 367 2 rr_1f79 1
66 "constraints for residue 26 to 27 from expt" 371 2 371 2 rr_1f79 1
67 "constraints for residue 27 from expt" 382 2 382 2 rr_1f79 1
68 "end of experimental constraints; 65 intra, 172 inter, 237 total" 387 2 387 2 rr_1f79 1
69 "constraints for Cohex from H2O-NOESY 300 ms" 389 2 389 2 rr_1f79 1
70 imino 390 2 390 2 rr_1f79 1
71 aromatic 398 2 398 2 rr_1f79 1
stop_
save_
save_CNS/XPLOR_distance_constraints_2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_2
_Gen_dist_constraint_list.Entry_ID rr_1f79
_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_1f79 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 27 27 C H41 H . . . 1 1 1 1 G O6 O . . . . . 1.7 1.6 1.8 . . . . . A . 27 C H41 . . A . 1 G O6 . . . 27 . H41 . . . . . 1 . O6 . . rr_1f79 2
2 1 . . 1 1 27 27 C N3 N . . . 1 1 1 1 G H21 H . . . . . 3.0 2.9 3.1 . . . . . A . 27 C N3 . . A . 1 G H21 . . . 27 . N3 . . . . . 1 . H21 . . rr_1f79 2
3 1 . . 1 1 1 1 G H21 H . . . 1 1 27 27 C O2 O . . . . . 2.0 1.9 2.1 . . . . . A . 27 C O2 . . A . 1 G H21 . . . 27 . O2 . . . . . 1 . H21 . . rr_1f79 2
4 1 . . 1 1 27 27 C N3 N . . . 1 1 1 1 G H1 H . . . . . 1.9 1.8 2.0 . . . . . A . 27 C N3 . . A . 1 G H1 . . . 27 . N3 . . . . . 1 . H1 . . rr_1f79 2
5 1 . . 1 1 26 26 C H41 H . . . 1 1 2 2 G O6 O . . . . . 1.7 1.6 1.8 . . . . . A . 26 C H41 . . A . 2 G O6 . . . 26 . H41 . . . . . 2 . O6 . . rr_1f79 2
6 1 . . 1 1 26 26 C N3 N . . . 1 1 2 2 G H21 H . . . . . 3.0 2.9 3.1 . . . . . A . 26 C N3 . . A . 2 G H21 . . . 26 . N3 . . . . . 2 . H21 . . rr_1f79 2
7 1 . . 1 1 2 2 G H21 H . . . 1 1 26 26 C O2 O . . . . . 2.0 1.9 2.1 . . . . . A . 26 C O2 . . A . 2 G H21 . . . 26 . O2 . . . . . 2 . H21 . . rr_1f79 2
8 1 . . 1 1 26 26 C N3 N . . . 1 1 2 2 G H1 H . . . . . 1.9 1.8 2.0 . . . . . A . 26 C N3 . . A . 2 G H1 . . . 26 . N3 . . . . . 2 . H1 . . rr_1f79 2
9 1 . . 1 1 3 3 A H2 H . . . 1 1 25 25 U O2 O . . . . . 3.2 3.1 3.3 . . . . . A . 3 A H2 . . A . 25 U O2 . . . 3 . H2 . . . . . 25 . O2 . . rr_1f79 2
10 1 . . 1 1 3 3 A N1 N . . . 1 1 25 25 U H3 H . . . . . 1.9 1.8 2.0 . . . . . A . 3 A N1 . . A . 25 U H3 . . . 3 . N1 . . . . . 25 . H3 . . rr_1f79 2
11 1 . . 1 1 3 3 A H61 H . . . 1 1 25 25 U O4 O . . . . . 1.8 1.7 1.9 . . . . . A . 3 A H61 . . A . 25 U O4 . . . 3 . H61 . . . . . 25 . O4 . . rr_1f79 2
12 1 . . 1 1 3 3 A H2 H . . . 1 1 25 25 U H3 H . . . . . 2.9 2.8 3.0 . . . . . A . 3 A H2 . . A . 25 U H3 . . . 3 . H2 . . . . . 25 . H3 . . rr_1f79 2
13 1 . . 1 1 4 4 A H2 H . . . 1 1 24 24 U O2 O . . . . . 3.2 3.1 3.3 . . . . . A . 4 A H2 . . A . 24 U O2 . . . 4 . H2 . . . . . 24 . O2 . . rr_1f79 2
14 1 . . 1 1 24 24 U H3 H . . . 1 1 4 4 A N1 N . . . . . 1.9 1.8 2.0 . . . . . A . 4 A N1 . . A . 24 U H3 . . . 4 . N1 . . . . . 24 . H3 . . rr_1f79 2
15 1 . . 1 1 4 4 A H61 H . . . 1 1 24 24 U O4 O . . . . . 1.8 1.7 1.9 . . . . . A . 4 A H61 . . A . 24 U O4 . . . 4 . H61 . . . . . 24 . O4 . . rr_1f79 2
16 1 . . 1 1 4 4 A H2 H . . . 1 1 24 24 U H3 H . . . . . 2.9 2.8 3.0 . . . . . A . 4 A H2 . . A . 24 U H3 . . . 4 . H2 . . . . . 24 . H3 . . rr_1f79 2
17 1 . . 1 1 23 23 C H41 H . . . 1 1 5 5 G O6 O . . . . . 1.7 1.6 1.8 . . . . . A . 23 C H41 . . A . 5 G O6 . . . 23 . H41 . . . . . 5 . O6 . . rr_1f79 2
18 1 . . 1 1 23 23 C N3 N . . . 1 1 5 5 G H21 H . . . . . 3.0 2.9 3.1 . . . . . A . 23 C N3 . . A . 5 G H21 . . . 23 . N3 . . . . . 5 . H21 . . rr_1f79 2
19 1 . . 1 1 5 5 G H21 H . . . 1 1 23 23 C O2 O . . . . . 2.0 1.9 2.1 . . . . . A . 23 C O2 . . A . 5 G H21 . . . 23 . O2 . . . . . 5 . H21 . . rr_1f79 2
20 1 . . 1 1 5 5 G H1 H . . . 1 1 23 23 C N3 N . . . . . 1.9 1.8 2.0 . . . . . A . 23 C N3 . . A . 5 G H1 . . . 23 . N3 . . . . . 5 . H1 . . rr_1f79 2
21 1 . . 1 1 22 22 G H1 H . . . 1 1 6 6 U O2 O . . . . . 1.8 1.7 1.9 . . . . . A . 22 G H1 . . A . 6 U O2 . . . 22 . H1 . . . . . 6 . O2 . . rr_1f79 2
22 1 . . 1 1 22 22 G H1 H . . . 1 1 6 6 U H3 H . . . . . 2.6 2.5 2.7 . . . . . A . 22 G H1 . . A . 6 U H3 . . . 22 . H1 . . . . . 6 . H3 . . rr_1f79 2
23 1 . . 1 1 6 6 U H3 H . . . 1 1 22 22 G O6 O . . . . . 1.9 1.8 2.0 . . . . . A . 22 G O6 . . A . 6 U H3 . . . 22 . O6 . . . . . 6 . H3 . . rr_1f79 2
24 1 . . 1 1 6 6 U O2 O . . . 1 1 22 22 G O6 O . . . . . 3.7 3.6 3.8 . . . . . A . 22 G O6 . . A . 6 U O2 . . . 22 . O6 . . . . . 6 . O2 . . rr_1f79 2
25 1 . . 1 1 22 22 G N1 N . . . 1 1 6 6 U N3 N . . . . . 3.7 3.6 3.8 . . . . . A . 22 G N1 . . A . 6 U N3 . . . 22 . N1 . . . . . 6 . N3 . . rr_1f79 2
26 1 . . 1 1 8 8 C H41 H . . . 1 1 21 21 G O6 O . . . . . 1.7 1.6 1.8 . . . . . A . 8 C H41 . . A . 21 G O6 . . . 8 . H41 . . . . . 21 . O6 . . rr_1f79 2
27 1 . . 1 1 8 8 C N3 N . . . 1 1 21 21 G H21 H . . . . . 3.0 2.9 3.1 . . . . . A . 8 C N3 . . A . 21 G H21 . . . 8 . N3 . . . . . 21 . H21 . . rr_1f79 2
28 1 . . 1 1 21 21 G H21 H . . . 1 1 8 8 C O2 O . . . . . 2.0 1.9 2.1 . . . . . A . 8 C O2 . . A . 21 G H21 . . . 8 . O2 . . . . . 21 . H21 . . rr_1f79 2
29 1 . . 1 1 21 21 G H1 H . . . 1 1 8 8 C N3 N . . . . . 1.9 1.8 2.0 . . . . . A . 8 C N3 . . A . 21 G H1 . . . 8 . N3 . . . . . 21 . H1 . . rr_1f79 2
30 1 . . 1 1 20 20 C H41 H . . . 1 1 9 9 G O6 O . . . . . 1.7 1.6 1.8 . . . . . A . 20 C H41 . . A . 9 G O6 . . . 20 . H41 . . . . . 9 . O6 . . rr_1f79 2
31 1 . . 1 1 20 20 C N3 N . . . 1 1 9 9 G H21 H . . . . . 3.0 2.9 3.1 . . . . . A . 20 C N3 . . A . 9 G H21 . . . 20 . N3 . . . . . 9 . H21 . . rr_1f79 2
32 1 . . 1 1 9 9 G H21 H . . . 1 1 20 20 C O2 O . . . . . 2.0 1.9 2.1 . . . . . A . 20 C O2 . . A . 9 G H21 . . . 20 . O2 . . . . . 9 . H21 . . rr_1f79 2
33 1 . . 1 1 9 9 G H1 H . . . 1 1 20 20 C N3 N . . . . . 1.9 1.8 2.0 . . . . . A . 20 C N3 . . A . 9 G H1 . . . 20 . N3 . . . . . 9 . H1 . . rr_1f79 2
34 1 . . 1 1 19 19 C H41 H . . . 1 1 10 10 G O6 O . . . . . 1.7 1.6 1.8 . . . . . A . 19 C H41 . . A . 10 G O6 . . . 19 . H41 . . . . . 10 . O6 . . rr_1f79 2
35 1 . . 1 1 19 19 C N3 N . . . 1 1 10 10 G H21 H . . . . . 3.0 2.9 3.1 . . . . . A . 19 C N3 . . A . 10 G H21 . . . 19 . N3 . . . . . 10 . H21 . . rr_1f79 2
36 1 . . 1 1 10 10 G H21 H . . . 1 1 19 19 C O2 O . . . . . 2.0 1.9 2.1 . . . . . A . 19 C O2 . . A . 10 G H21 . . . 19 . O2 . . . . . 10 . H21 . . rr_1f79 2
37 1 . . 1 1 10 10 G H1 H . . . 1 1 19 19 C N3 N . . . . . 1.9 1.8 2.0 . . . . . A . 19 C N3 . . A . 10 G H1 . . . 19 . N3 . . . . . 10 . H1 . . rr_1f79 2
38 1 . . 1 1 18 18 A H2 H . . . 1 1 11 11 U O2 O . . . . . 3.2 3.1 3.3 . . . . . A . 18 A H2 . . A . 11 U O2 . . . 18 . H2 . . . . . 11 . O2 . . rr_1f79 2
39 1 . . 1 1 11 11 U H3 H . . . 1 1 18 18 A N1 N . . . . . 1.9 1.8 2.0 . . . . . A . 18 A N1 . . A . 11 U H3 . . . 18 . N1 . . . . . 11 . H3 . . rr_1f79 2
40 1 . . 1 1 18 18 A H61 H . . . 1 1 11 11 U O4 O . . . . . 1.8 1.7 1.9 . . . . . A . 18 A H61 . . A . 11 U O4 . . . 18 . H61 . . . . . 11 . O4 . . rr_1f79 2
41 1 . . 1 1 18 18 A H2 H . . . 1 1 11 11 U H3 H . . . . . 2.9 2.8 3.0 . . . . . A . 18 A H2 . . A . 11 U H3 . . . 18 . H2 . . . . . 11 . H3 . . rr_1f79 2
42 1 . . 1 1 12 12 C H41 H . . . 1 1 17 17 G O6 O . . . . . 1.7 1.6 1.8 . . . . . A . 12 C H41 . . A . 17 G O6 . . . 12 . H41 . . . . . 17 . O6 . . rr_1f79 2
43 1 . . 1 1 12 12 C N3 N . . . 1 1 17 17 G H21 H . . . . . 3.0 2.9 3.1 . . . . . A . 12 C N3 . . A . 17 G H21 . . . 12 . N3 . . . . . 17 . H21 . . rr_1f79 2
44 1 . . 1 1 17 17 G H21 H . . . 1 1 12 12 C O2 O . . . . . 2.0 1.9 2.1 . . . . . A . 12 C O2 . . A . 17 G H21 . . . 12 . O2 . . . . . 17 . H21 . . rr_1f79 2
45 1 . . 1 1 12 12 C N3 N . . . 1 1 17 17 G H1 H . . . . . 1.9 1.8 2.0 . . . . . A . 12 C N3 . . A . 17 G H1 . . . 12 . N3 . . . . . 17 . H1 . . rr_1f79 2
46 1 . . 1 1 13 13 U O2 O . . . 1 1 16 16 G H1 H . . . . . 1.9 1.7 2.1 . . . . . A . 13 U O2 . . A . 16 G H1 . . . 13 . O2 . . . . . 16 . H1 . . rr_1f79 2
47 1 . . 1 1 13 13 U O2 O . . . 1 1 16 16 G H21 H . . . . . 2.4 2.2 2.6 . . . . . A . 13 U O2 . . A . 16 G H21 . . . 13 . O2 . . . . . 16 . H21 . . rr_1f79 2
48 1 . . 1 1 16 16 G H21 H . . . 1 1 13 13 U H3 H . . . . . 3.8 3.6 4.0 . . . . . A . 13 U H3 . . A . 16 G H21 . . . 13 . H3 . . . . . 16 . H21 . . rr_1f79 2
49 1 . . 1 1 16 16 G H1 H . . . 1 1 13 13 U H3 H . . . . . 4.4 4.2 4.6 . . . . . A . 13 U H3 . . A . 16 G H1 . . . 13 . H3 . . . . . 16 . H1 . . rr_1f79 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 "base pairing between 1 and 27 GC pair" 1 2 1 2 rr_1f79 2
2 "base pairing between 2 and 26 GC pair" 7 2 7 2 rr_1f79 2
3 "base pairing between 3 and 25 AU pair" 13 2 13 2 rr_1f79 2
4 "base pairing between 4 and 24 AU pair" 19 2 19 2 rr_1f79 2
5 "base pairing between 5 and 24 GC pair" 25 2 25 2 rr_1f79 2
6 "base pairing between 6 and 22 UG pair - standard wobble" 31 2 31 2 rr_1f79 2
7 "base 7: unpaired" 38 2 38 2 rr_1f79 2
8 "base pairing between 8 and 21 CG pair" 40 2 40 2 rr_1f79 2
9 "base pairing between 9 and 20 GC pair" 46 2 46 2 rr_1f79 2
10 "base pairing between 10 and 19 GC pair" 52 2 52 2 rr_1f79 2
11 "base pairing between 11 and 18 AU pair" 58 2 58 2 rr_1f79 2
12 "base pairing between 12 and 17 CG pair" 64 2 64 2 rr_1f79 2
13 "base 13-16: UUCG tetraloop, fill in from literature ..." 70 2 70 2 rr_1f79 2
stop_
save_
save_CNS/XPLOR_distance_constraints_4_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_4_1
_Distance_constraint_list.Entry_ID rr_1f79
_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 4
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_1f79 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_1f79 1
2 1 . . . rr_1f79 1
3 1 . . . rr_1f79 1
4 1 . . . rr_1f79 1
5 1 . . . rr_1f79 1
6 1 . . . rr_1f79 1
7 1 . . . rr_1f79 1
8 1 . . . rr_1f79 1
9 1 . . . rr_1f79 1
10 1 . . . rr_1f79 1
11 1 . . . rr_1f79 1
12 1 . . . rr_1f79 1
13 1 . . . rr_1f79 1
14 1 . . . rr_1f79 1
15 1 . . . rr_1f79 1
16 1 . . . rr_1f79 1
17 1 . . . rr_1f79 1
18 1 . . . rr_1f79 1
19 1 . . . rr_1f79 1
20 1 . . . rr_1f79 1
21 1 . . . rr_1f79 1
22 1 . . . rr_1f79 1
23 1 . . . rr_1f79 1
24 1 . . . rr_1f79 1
25 1 . . . rr_1f79 1
26 1 . . . rr_1f79 1
27 1 . . . rr_1f79 1
28 1 . . . rr_1f79 1
29 1 . . . rr_1f79 1
30 1 . . . rr_1f79 1
31 1 . . . rr_1f79 1
32 1 . . . rr_1f79 1
33 1 . . . rr_1f79 1
34 1 . . . rr_1f79 1
35 1 . . . rr_1f79 1
36 1 . . . rr_1f79 1
37 1 . . . rr_1f79 1
38 1 . . . rr_1f79 1
39 1 . . . rr_1f79 1
40 1 . . . rr_1f79 1
41 1 . . . rr_1f79 1
42 1 . . . rr_1f79 1
43 1 . . . rr_1f79 1
44 1 . . . rr_1f79 1
45 1 . . . rr_1f79 1
46 1 . . . rr_1f79 1
47 1 . . . rr_1f79 1
48 1 . . . rr_1f79 1
49 1 . . . rr_1f79 1
50 1 . . . rr_1f79 1
51 1 . . . rr_1f79 1
52 1 . . . rr_1f79 1
53 1 . . . rr_1f79 1
54 1 . . . rr_1f79 1
55 1 . . . rr_1f79 1
56 1 . . . rr_1f79 1
57 1 . . . rr_1f79 1
58 1 . . . rr_1f79 1
59 1 . . . rr_1f79 1
60 1 . . . rr_1f79 1
61 1 . . . rr_1f79 1
62 1 . . . rr_1f79 1
63 1 . . . rr_1f79 1
64 1 . . . rr_1f79 1
65 1 . . . rr_1f79 1
66 1 . . . rr_1f79 1
67 1 . . . rr_1f79 1
68 1 . . . rr_1f79 1
69 1 . . . rr_1f79 1
70 1 . . . rr_1f79 1
71 1 . . . rr_1f79 1
72 1 . . . rr_1f79 1
73 1 . . . rr_1f79 1
74 1 . . . rr_1f79 1
75 1 . . . rr_1f79 1
76 1 . . . rr_1f79 1
77 1 . . . rr_1f79 1
78 1 . . . rr_1f79 1
79 1 . . . rr_1f79 1
80 1 . . . rr_1f79 1
81 1 . . . rr_1f79 1
82 1 . . . rr_1f79 1
83 1 . . . rr_1f79 1
84 1 . . . rr_1f79 1
85 1 . . . rr_1f79 1
86 1 . . . rr_1f79 1
87 1 . . . rr_1f79 1
88 1 . . . rr_1f79 1
89 1 . . . rr_1f79 1
90 1 . . . rr_1f79 1
91 1 . . . rr_1f79 1
92 1 . . . rr_1f79 1
93 1 . . . rr_1f79 1
94 1 . . . rr_1f79 1
95 1 . . . rr_1f79 1
96 1 . . . rr_1f79 1
97 1 . . . rr_1f79 1
98 1 . . . rr_1f79 1
99 1 . . . rr_1f79 1
100 1 . . . rr_1f79 1
101 1 . . . rr_1f79 1
102 1 . . . rr_1f79 1
103 1 . . . rr_1f79 1
104 1 . . . rr_1f79 1
105 1 . . . rr_1f79 1
106 1 . . . rr_1f79 1
107 1 . . . rr_1f79 1
108 1 . . . rr_1f79 1
109 1 . . . rr_1f79 1
110 1 . . . rr_1f79 1
111 1 . . . rr_1f79 1
112 1 . . . rr_1f79 1
113 1 . . . rr_1f79 1
114 1 . . . rr_1f79 1
115 1 . . . rr_1f79 1
116 1 . . . rr_1f79 1
117 1 . . . rr_1f79 1
118 1 . . . rr_1f79 1
119 1 . . . rr_1f79 1
120 1 . . . rr_1f79 1
121 1 . . . rr_1f79 1
122 1 . . . rr_1f79 1
123 1 . . . rr_1f79 1
124 1 . . . rr_1f79 1
125 1 . . . rr_1f79 1
126 1 . . . rr_1f79 1
127 1 . . . rr_1f79 1
128 1 . . . rr_1f79 1
129 1 . . . rr_1f79 1
130 1 . . . rr_1f79 1
131 1 . . . rr_1f79 1
132 1 . . . rr_1f79 1
133 1 . . . rr_1f79 1
134 1 . . . rr_1f79 1
135 1 . . . rr_1f79 1
136 1 . . . rr_1f79 1
137 1 . . . rr_1f79 1
138 1 . . . rr_1f79 1
139 1 . . . rr_1f79 1
140 1 . . . rr_1f79 1
141 1 . . . rr_1f79 1
142 1 . . . rr_1f79 1
143 1 . . . rr_1f79 1
144 1 . . . rr_1f79 1
145 1 . . . rr_1f79 1
146 1 . . . rr_1f79 1
147 1 . . . rr_1f79 1
148 1 . . . rr_1f79 1
149 1 . . . rr_1f79 1
150 1 . . . rr_1f79 1
151 1 . . . rr_1f79 1
152 1 . . . rr_1f79 1
153 1 . . . rr_1f79 1
154 1 . . . rr_1f79 1
155 1 . . . rr_1f79 1
156 1 . . . rr_1f79 1
157 1 . . . rr_1f79 1
158 1 . . . rr_1f79 1
159 1 . . . rr_1f79 1
160 1 . . . rr_1f79 1
161 1 . . . rr_1f79 1
162 1 . . . rr_1f79 1
163 1 . . . rr_1f79 1
164 1 . . . rr_1f79 1
165 1 . . . rr_1f79 1
166 1 . . . rr_1f79 1
167 1 . . . rr_1f79 1
168 1 . . . rr_1f79 1
169 1 . . . rr_1f79 1
170 1 . . . rr_1f79 1
171 1 . . . rr_1f79 1
172 1 . . . rr_1f79 1
173 1 . . . rr_1f79 1
174 1 . . . rr_1f79 1
175 1 . . . rr_1f79 1
176 1 . . . rr_1f79 1
177 1 . . . rr_1f79 1
178 1 . . . rr_1f79 1
179 1 . . . rr_1f79 1
180 1 . . . rr_1f79 1
181 1 . . . rr_1f79 1
182 1 . . . rr_1f79 1
183 1 . . . rr_1f79 1
184 1 . . . rr_1f79 1
185 1 . . . rr_1f79 1
186 1 . . . rr_1f79 1
187 1 . . . rr_1f79 1
188 1 . . . rr_1f79 1
189 1 . . . rr_1f79 1
190 1 . . . rr_1f79 1
191 1 . . . rr_1f79 1
192 1 . . . rr_1f79 1
193 1 . . . rr_1f79 1
194 1 . . . rr_1f79 1
195 1 . . . rr_1f79 1
196 1 . . . rr_1f79 1
197 1 . . . rr_1f79 1
198 1 . . . rr_1f79 1
199 1 . . . rr_1f79 1
200 1 . . . rr_1f79 1
201 1 . . . rr_1f79 1
202 1 . . . rr_1f79 1
203 1 . . . rr_1f79 1
204 1 . . . rr_1f79 1
205 1 . . . rr_1f79 1
206 1 . . . rr_1f79 1
207 1 . . . rr_1f79 1
208 1 . . . rr_1f79 1
209 1 . . . rr_1f79 1
210 1 . . . rr_1f79 1
211 1 . . . rr_1f79 1
212 1 . . . rr_1f79 1
213 1 . . . rr_1f79 1
214 1 . . . rr_1f79 1
215 1 . . . rr_1f79 1
216 1 . . . rr_1f79 1
217 1 . . . rr_1f79 1
218 1 . . . rr_1f79 1
219 1 . . . rr_1f79 1
220 1 . . . rr_1f79 1
221 1 . . . rr_1f79 1
222 1 . . . rr_1f79 1
223 1 . . . rr_1f79 1
224 1 . . . rr_1f79 1
225 1 . . . rr_1f79 1
226 1 . . . rr_1f79 1
227 1 . . . rr_1f79 1
228 1 . . . rr_1f79 1
229 1 . . . rr_1f79 1
230 1 . . . rr_1f79 1
231 1 . . . rr_1f79 1
232 1 . . . rr_1f79 1
233 1 . . . rr_1f79 1
234 1 . . . rr_1f79 1
235 1 . . . rr_1f79 1
236 1 . . . rr_1f79 1
237 1 . . . rr_1f79 1
238 1 . . . rr_1f79 1
239 1 . . . rr_1f79 1
240 1 . . . rr_1f79 1
241 1 . . . rr_1f79 1
242 1 . . . rr_1f79 1
243 1 . . . rr_1f79 1
244 1 . . . rr_1f79 1
245 1 . . . rr_1f79 1
246 1 . . . rr_1f79 1
247 1 . . . rr_1f79 1
248 1 . . . rr_1f79 1
249 1 . . . rr_1f79 1
250 1 . . . rr_1f79 1
251 1 . . . rr_1f79 1
252 1 . . . rr_1f79 1
253 1 . . . rr_1f79 1
254 1 . . . rr_1f79 1
255 1 . . . rr_1f79 1
256 1 . . . rr_1f79 1
257 1 . . . rr_1f79 1
258 1 . . . rr_1f79 1
259 1 . . . rr_1f79 1
260 1 . . . rr_1f79 1
261 1 . . . rr_1f79 1
262 1 . . . rr_1f79 1
263 1 . . . rr_1f79 1
264 1 . . . rr_1f79 1
265 1 . . . rr_1f79 1
266 1 . . . rr_1f79 1
267 1 . . . rr_1f79 1
268 1 . . . rr_1f79 1
269 1 . . . rr_1f79 1
270 1 . . . rr_1f79 1
271 1 . . . rr_1f79 1
272 1 . . . rr_1f79 1
273 1 . . . rr_1f79 1
274 1 . . . rr_1f79 1
275 1 . . . rr_1f79 1
276 1 . . . rr_1f79 1
277 1 . . . rr_1f79 1
278 1 . . . rr_1f79 1
279 1 . . . rr_1f79 1
280 1 . . . rr_1f79 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 G H8 H . . . . 1 . H8 rr_1f79 1
1 1 . 2 . 1 1 1 1 G H1' H . . . . 1 . H1' rr_1f79 1
2 1 . 1 . 1 1 1 1 G H8 H . . . . 1 . H8 rr_1f79 1
2 1 . 2 . 1 1 1 1 G H2' H . . . . 1 . H2'' rr_1f79 1
3 1 . 1 . 1 1 1 1 G H1' H . . . . 1 . H1' rr_1f79 1
3 1 . 2 . 1 1 2 2 G H8 H . . . . 2 . H8 rr_1f79 1
4 1 . 1 . 1 1 1 1 G H2' H . . . . 1 . H2'' rr_1f79 1
4 1 . 2 . 1 1 2 2 G H8 H . . . . 2 . H8 rr_1f79 1
5 1 . 1 . 1 1 1 1 G H2' H . . . . 1 . H2'' rr_1f79 1
5 1 . 2 . 1 1 2 2 G H1' H . . . . 2 . H1' rr_1f79 1
6 1 . 1 . 1 1 1 1 G H3' H . . . . 1 . H3' rr_1f79 1
6 1 . 2 . 1 1 2 2 G H8 H . . . . 2 . H8 rr_1f79 1
7 1 . 1 . 1 1 1 1 G H4' H . . . . 1 . H4' rr_1f79 1
7 1 . 2 . 1 1 2 2 G H8 H . . . . 2 . H8 rr_1f79 1
8 1 . 1 . 1 1 1 1 G H8 H . . . . 1 . H8 rr_1f79 1
8 1 . 2 . 1 1 2 2 G H8 H . . . . 2 . H8 rr_1f79 1
9 1 . 1 . 1 1 2 2 G H8 H . . . . 2 . H8 rr_1f79 1
9 1 . 2 . 1 1 2 2 G H1' H . . . . 2 . H1' rr_1f79 1
10 1 . 1 . 1 1 2 2 G H8 H . . . . 2 . H8 rr_1f79 1
10 1 . 2 . 1 1 2 2 G H2' H . . . . 2 . H2'' rr_1f79 1
11 1 . 1 . 1 1 2 2 G H1' H . . . . 2 . H1' rr_1f79 1
11 1 . 2 . 1 1 3 3 A H8 H . . . . 3 . H8 rr_1f79 1
12 1 . 1 . 1 1 2 2 G H2' H . . . . 2 . H2'' rr_1f79 1
12 1 . 2 . 1 1 3 3 A H8 H . . . . 3 . H8 rr_1f79 1
13 1 . 1 . 1 1 2 2 G H2' H . . . . 2 . H2'' rr_1f79 1
13 1 . 2 . 1 1 3 3 A H1' H . . . . 3 . H1' rr_1f79 1
14 1 . 1 . 1 1 2 2 G H3' H . . . . 2 . H3' rr_1f79 1
14 1 . 2 . 1 1 3 3 A H8 H . . . . 3 . H8 rr_1f79 1
15 1 . 1 . 1 1 2 2 G H4' H . . . . 2 . H4' rr_1f79 1
15 1 . 2 . 1 1 3 3 A H8 H . . . . 3 . H8 rr_1f79 1
16 1 . 1 . 1 1 2 2 G H8 H . . . . 2 . H8 rr_1f79 1
16 1 . 2 . 1 1 3 3 A H8 H . . . . 3 . H8 rr_1f79 1
17 1 . 1 . 1 1 3 3 A H8 H . . . . 3 . H8 rr_1f79 1
17 1 . 2 . 1 1 3 3 A H1' H . . . . 3 . H1' rr_1f79 1
18 1 . 1 . 1 1 3 3 A H8 H . . . . 3 . H8 rr_1f79 1
18 1 . 2 . 1 1 3 3 A H2' H . . . . 3 . H2'' rr_1f79 1
19 1 . 1 . 1 1 3 3 A H2 H . . . . 3 . H2 rr_1f79 1
19 1 . 2 . 1 1 3 3 A H1' H . . . . 3 . H1' rr_1f79 1
20 1 . 1 . 1 1 3 3 A H1' H . . . . 3 . H1' rr_1f79 1
20 1 . 2 . 1 1 4 4 A H8 H . . . . 4 . H8 rr_1f79 1
21 1 . 1 . 1 1 3 3 A H2' H . . . . 3 . H2'' rr_1f79 1
21 1 . 2 . 1 1 4 4 A H8 H . . . . 4 . H8 rr_1f79 1
22 1 . 1 . 1 1 3 3 A H2' H . . . . 3 . H2'' rr_1f79 1
22 1 . 2 . 1 1 4 4 A H1' H . . . . 4 . H1' rr_1f79 1
23 1 . 1 . 1 1 3 3 A H3' H . . . . 3 . H3' rr_1f79 1
23 1 . 2 . 1 1 4 4 A H8 H . . . . 4 . H8 rr_1f79 1
24 1 . 1 . 1 1 3 3 A H4' H . . . . 3 . H4' rr_1f79 1
24 1 . 2 . 1 1 4 4 A H8 H . . . . 4 . H8 rr_1f79 1
25 1 . 1 . 1 1 3 3 A H8 H . . . . 3 . H8 rr_1f79 1
25 1 . 2 . 1 1 4 4 A H8 H . . . . 4 . H8 rr_1f79 1
26 1 . 1 . 1 1 3 3 A H2 H . . . . 3 . H2 rr_1f79 1
26 1 . 2 . 1 1 4 4 A H1' H . . . . 4 . H1' rr_1f79 1
27 1 . 1 . 1 1 3 3 A H2 H . . . . 3 . H2 rr_1f79 1
27 1 . 2 . 1 1 4 4 A H2 H . . . . 4 . H2 rr_1f79 1
28 1 . 1 . 1 1 3 3 A H2 H . . . . 3 . H2 rr_1f79 1
28 1 . 2 . 1 1 26 26 C H1' H . . . . 26 . H1' rr_1f79 1
29 1 . 1 . 1 1 4 4 A H8 H . . . . 4 . H8 rr_1f79 1
29 1 . 2 . 1 1 4 4 A H1' H . . . . 4 . H1' rr_1f79 1
30 1 . 1 . 1 1 4 4 A H8 H . . . . 4 . H8 rr_1f79 1
30 1 . 2 . 1 1 4 4 A H2' H . . . . 4 . H2'' rr_1f79 1
31 1 . 1 . 1 1 4 4 A H2 H . . . . 4 . H2 rr_1f79 1
31 1 . 2 . 1 1 4 4 A H1' H . . . . 4 . H1' rr_1f79 1
32 1 . 1 . 1 1 4 4 A H1' H . . . . 4 . H1' rr_1f79 1
32 1 . 2 . 1 1 5 5 G H8 H . . . . 5 . H8 rr_1f79 1
33 1 . 1 . 1 1 4 4 A H1' H . . . . 4 . H1' rr_1f79 1
33 1 . 2 . 1 1 5 5 G H1' H . . . . 5 . H1' rr_1f79 1
34 1 . 1 . 1 1 4 4 A H2' H . . . . 4 . H2'' rr_1f79 1
34 1 . 2 . 1 1 5 5 G H8 H . . . . 5 . H8 rr_1f79 1
35 1 . 1 . 1 1 4 4 A H2' H . . . . 4 . H2'' rr_1f79 1
35 1 . 2 . 1 1 5 5 G H1' H . . . . 5 . H1' rr_1f79 1
36 1 . 1 . 1 1 4 4 A H3' H . . . . 4 . H3' rr_1f79 1
36 1 . 2 . 1 1 5 5 G H8 H . . . . 5 . H8 rr_1f79 1
37 1 . 1 . 1 1 4 4 A H4' H . . . . 4 . H4' rr_1f79 1
37 1 . 2 . 1 1 5 5 G H8 H . . . . 5 . H8 rr_1f79 1
38 1 . 1 . 1 1 4 4 A H8 H . . . . 4 . H8 rr_1f79 1
38 1 . 2 . 1 1 5 5 G H8 H . . . . 5 . H8 rr_1f79 1
39 1 . 1 . 1 1 4 4 A H2 H . . . . 4 . H2 rr_1f79 1
39 1 . 2 . 1 1 5 5 G H1' H . . . . 5 . H1' rr_1f79 1
40 1 . 1 . 1 1 4 4 A H2 H . . . . 4 . H2 rr_1f79 1
40 1 . 2 . 1 1 5 5 G H8 H . . . . 5 . H8 rr_1f79 1
41 1 . 1 . 1 1 4 4 A H2 H . . . . 4 . H2 rr_1f79 1
41 1 . 2 . 1 1 25 25 U H1' H . . . . 25 . H1' rr_1f79 1
42 1 . 1 . 1 1 5 5 G H8 H . . . . 5 . H8 rr_1f79 1
42 1 . 2 . 1 1 5 5 G H1' H . . . . 5 . H1' rr_1f79 1
43 1 . 1 . 1 1 5 5 G H8 H . . . . 5 . H8 rr_1f79 1
43 1 . 2 . 1 1 5 5 G H2' H . . . . 5 . H2'' rr_1f79 1
44 1 . 1 . 1 1 5 5 G H1' H . . . . 5 . H1' rr_1f79 1
44 1 . 2 . 1 1 6 6 U H6 H . . . . 6 . H6 rr_1f79 1
45 1 . 1 . 1 1 5 5 G H1' H . . . . 5 . H1' rr_1f79 1
45 1 . 2 . 1 1 6 6 U H5 H . . . . 6 . H5 rr_1f79 1
46 1 . 1 . 1 1 5 5 G H2' H . . . . 5 . H2'' rr_1f79 1
46 1 . 2 . 1 1 6 6 U H6 H . . . . 6 . H6 rr_1f79 1
47 1 . 1 . 1 1 5 5 G H2' H . . . . 5 . H2'' rr_1f79 1
47 1 . 2 . 1 1 6 6 U H5 H . . . . 6 . H5 rr_1f79 1
48 1 . 1 . 1 1 5 5 G H3' H . . . . 5 . H3' rr_1f79 1
48 1 . 2 . 1 1 6 6 U H6 H . . . . 6 . H6 rr_1f79 1
49 1 . 1 . 1 1 5 5 G H3' H . . . . 5 . H3' rr_1f79 1
49 1 . 2 . 1 1 6 6 U H5 H . . . . 6 . H5 rr_1f79 1
50 1 . 1 . 1 1 5 5 G H4' H . . . . 5 . H4' rr_1f79 1
50 1 . 2 . 1 1 6 6 U H6 H . . . . 6 . H6 rr_1f79 1
51 1 . 1 . 1 1 5 5 G H8 H . . . . 5 . H8 rr_1f79 1
51 1 . 2 . 1 1 6 6 U H6 H . . . . 6 . H6 rr_1f79 1
52 1 . 1 . 1 1 5 5 G H8 H . . . . 5 . H8 rr_1f79 1
52 1 . 2 . 1 1 6 6 U H5 H . . . . 6 . H5 rr_1f79 1
53 1 . 1 . 1 1 6 6 U H1' H . . . . 6 . H1' rr_1f79 1
53 1 . 2 . 1 1 6 6 U H6 H . . . . 6 . H6 rr_1f79 1
54 1 . 1 . 1 1 6 6 U H2' H . . . . 6 . H2'' rr_1f79 1
54 1 . 2 . 1 1 6 6 U H6 H . . . . 6 . H6 rr_1f79 1
55 1 . 1 . 1 1 6 6 U H1' H . . . . 6 . H1' rr_1f79 1
55 1 . 2 . 1 1 7 7 U H6 H . . . . 7 . H6 rr_1f79 1
56 1 . 1 . 1 1 6 6 U H2' H . . . . 6 . H2'' rr_1f79 1
56 1 . 2 . 1 1 7 7 U H6 H . . . . 7 . H6 rr_1f79 1
57 1 . 1 . 1 1 6 6 U H1' H . . . . 6 . H1' rr_1f79 1
57 1 . 2 . 1 1 8 8 C H6 H . . . . 8 . H6 rr_1f79 1
58 1 . 1 . 1 1 6 6 U H2' H . . . . 6 . H2'' rr_1f79 1
58 1 . 2 . 1 1 8 8 C H6 H . . . . 8 . H6 rr_1f79 1
59 1 . 1 . 1 1 6 6 U H2' H . . . . 6 . H2'' rr_1f79 1
59 1 . 2 . 1 1 8 8 C H5 H . . . . 8 . H5 rr_1f79 1
60 1 . 1 . 1 1 6 6 U H4' H . . . . 6 . H4' rr_1f79 1
60 1 . 2 . 1 1 8 8 C H6 H . . . . 8 . H6 rr_1f79 1
61 1 . 1 . 1 1 6 6 U H6 H . . . . 6 . H6 rr_1f79 1
61 1 . 2 . 1 1 8 8 C H6 H . . . . 8 . H6 rr_1f79 1
62 1 . 1 . 1 1 6 6 U H6 H . . . . 6 . H6 rr_1f79 1
62 1 . 2 . 1 1 8 8 C H5 H . . . . 8 . H5 rr_1f79 1
63 1 . 1 . 1 1 6 6 U H5 H . . . . 6 . H5 rr_1f79 1
63 1 . 2 . 1 1 8 8 C H5 H . . . . 8 . H5 rr_1f79 1
64 1 . 1 . 1 1 7 7 U H1' H . . . . 7 . H1' rr_1f79 1
64 1 . 2 . 1 1 7 7 U H6 H . . . . 7 . H6 rr_1f79 1
65 1 . 1 . 1 1 7 7 U H2' H . . . . 7 . H2'' rr_1f79 1
65 1 . 2 . 1 1 7 7 U H5 H . . . . 7 . H5 rr_1f79 1
66 1 . 1 . 1 1 7 7 U H6 H . . . . 7 . H6 rr_1f79 1
66 1 . 2 . 1 1 8 8 C H5 H . . . . 8 . H5 rr_1f79 1
67 1 . 1 . 1 1 7 7 U H2' H . . . . 7 . H2'' rr_1f79 1
67 1 . 2 . 1 1 8 8 C H6 H . . . . 8 . H6 rr_1f79 1
68 1 . 1 . 1 1 7 7 U H3' H . . . . 7 . H3' rr_1f79 1
68 1 . 2 . 1 1 8 8 C H6 H . . . . 8 . H6 rr_1f79 1
69 1 . 1 . 1 1 7 7 U H4' H . . . . 7 . H4' rr_1f79 1
69 1 . 2 . 1 1 8 8 C H6 H . . . . 8 . H6 rr_1f79 1
70 1 . 1 . 1 1 8 8 C H6 H . . . . 8 . H6 rr_1f79 1
70 1 . 2 . 1 1 8 8 C H1' H . . . . 8 . H1' rr_1f79 1
71 1 . 1 . 1 1 8 8 C H6 H . . . . 8 . H6 rr_1f79 1
71 1 . 2 . 1 1 8 8 C H2' H . . . . 8 . H2'' rr_1f79 1
72 1 . 1 . 1 1 8 8 C H5 H . . . . 8 . H5 rr_1f79 1
72 1 . 2 . 1 1 8 8 C H1' H . . . . 8 . H1' rr_1f79 1
73 1 . 1 . 1 1 8 8 C H1' H . . . . 8 . H1' rr_1f79 1
73 1 . 2 . 1 1 9 9 G H8 H . . . . 9 . H8 rr_1f79 1
74 1 . 1 . 1 1 8 8 C H1' H . . . . 8 . H1' rr_1f79 1
74 1 . 2 . 1 1 9 9 G H1' H . . . . 9 . H1' rr_1f79 1
75 1 . 1 . 1 1 8 8 C H2' H . . . . 8 . H2'' rr_1f79 1
75 1 . 2 . 1 1 9 9 G H8 H . . . . 9 . H8 rr_1f79 1
76 1 . 1 . 1 1 8 8 C H2' H . . . . 8 . H2'' rr_1f79 1
76 1 . 2 . 1 1 9 9 G H1' H . . . . 9 . H1' rr_1f79 1
77 1 . 1 . 1 1 8 8 C H3' H . . . . 8 . H3' rr_1f79 1
77 1 . 2 . 1 1 9 9 G H8 H . . . . 9 . H8 rr_1f79 1
78 1 . 1 . 1 1 8 8 C H4' H . . . . 8 . H4' rr_1f79 1
78 1 . 2 . 1 1 9 9 G H8 H . . . . 9 . H8 rr_1f79 1
79 1 . 1 . 1 1 8 8 C H6 H . . . . 8 . H6 rr_1f79 1
79 1 . 2 . 1 1 9 9 G H8 H . . . . 9 . H8 rr_1f79 1
80 1 . 1 . 1 1 9 9 G H8 H . . . . 9 . H8 rr_1f79 1
80 1 . 2 . 1 1 9 9 G H1' H . . . . 9 . H1' rr_1f79 1
81 1 . 1 . 1 1 9 9 G H8 H . . . . 9 . H8 rr_1f79 1
81 1 . 2 . 1 1 9 9 G H2' H . . . . 9 . H2'' rr_1f79 1
82 1 . 1 . 1 1 9 9 G H1' H . . . . 9 . H1' rr_1f79 1
82 1 . 2 . 1 1 10 10 G H8 H . . . . 10 . H8 rr_1f79 1
83 1 . 1 . 1 1 9 9 G H2' H . . . . 9 . H2'' rr_1f79 1
83 1 . 2 . 1 1 10 10 G H8 H . . . . 10 . H8 rr_1f79 1
84 1 . 1 . 1 1 9 9 G H2' H . . . . 9 . H2'' rr_1f79 1
84 1 . 2 . 1 1 10 10 G H1' H . . . . 10 . H1' rr_1f79 1
85 1 . 1 . 1 1 9 9 G H3' H . . . . 9 . H3' rr_1f79 1
85 1 . 2 . 1 1 10 10 G H8 H . . . . 10 . H8 rr_1f79 1
86 1 . 1 . 1 1 9 9 G H4' H . . . . 9 . H4' rr_1f79 1
86 1 . 2 . 1 1 10 10 G H8 H . . . . 10 . H8 rr_1f79 1
87 1 . 1 . 1 1 9 9 G H8 H . . . . 9 . H8 rr_1f79 1
87 1 . 2 . 1 1 10 10 G H8 H . . . . 10 . H8 rr_1f79 1
88 1 . 1 . 1 1 9 9 G H8 H . . . . 9 . H8 rr_1f79 1
88 1 . 2 . 1 1 9 9 G H1' H . . . . 9 . H1' rr_1f79 1
89 1 . 1 . 1 1 9 9 G H8 H . . . . 9 . H8 rr_1f79 1
89 1 . 2 . 1 1 9 9 G H2' H . . . . 9 . H2'' rr_1f79 1
90 1 . 1 . 1 1 10 10 G H1' H . . . . 10 . H1' rr_1f79 1
90 1 . 2 . 1 1 11 11 U H6 H . . . . 11 . H6 rr_1f79 1
91 1 . 1 . 1 1 10 10 G H1' H . . . . 10 . H1' rr_1f79 1
91 1 . 2 . 1 1 11 11 U H5 H . . . . 11 . H5 rr_1f79 1
92 1 . 1 . 1 1 10 10 G H2' H . . . . 10 . H2'' rr_1f79 1
92 1 . 2 . 1 1 11 11 U H6 H . . . . 11 . H6 rr_1f79 1
93 1 . 1 . 1 1 10 10 G H2' H . . . . 10 . H2'' rr_1f79 1
93 1 . 2 . 1 1 11 11 U H5 H . . . . 11 . H5 rr_1f79 1
94 1 . 1 . 1 1 10 10 G H2' H . . . . 10 . H2'' rr_1f79 1
94 1 . 2 . 1 1 11 11 U H1' H . . . . 11 . H1' rr_1f79 1
95 1 . 1 . 1 1 10 10 G H3' H . . . . 10 . H3' rr_1f79 1
95 1 . 2 . 1 1 11 11 U H6 H . . . . 11 . H6 rr_1f79 1
96 1 . 1 . 1 1 10 10 G H8 H . . . . 10 . H8 rr_1f79 1
96 1 . 2 . 1 1 11 11 U H6 H . . . . 11 . H6 rr_1f79 1
97 1 . 1 . 1 1 10 10 G H8 H . . . . 10 . H8 rr_1f79 1
97 1 . 2 . 1 1 11 11 U H5 H . . . . 11 . H5 rr_1f79 1
98 1 . 1 . 1 1 11 11 U H6 H . . . . 11 . H6 rr_1f79 1
98 1 . 2 . 1 1 11 11 U H1' H . . . . 11 . H1' rr_1f79 1
99 1 . 1 . 1 1 11 11 U H6 H . . . . 11 . H6 rr_1f79 1
99 1 . 2 . 1 1 11 11 U H2' H . . . . 11 . H2'' rr_1f79 1
100 1 . 1 . 1 1 11 11 U H5 H . . . . 11 . H5 rr_1f79 1
100 1 . 2 . 1 1 11 11 U H1' H . . . . 11 . H1' rr_1f79 1
101 1 . 1 . 1 1 11 11 U H1' H . . . . 11 . H1' rr_1f79 1
101 1 . 2 . 1 1 12 12 C H6 H . . . . 12 . H6 rr_1f79 1
102 1 . 1 . 1 1 11 11 U H2' H . . . . 11 . H2'' rr_1f79 1
102 1 . 2 . 1 1 12 12 C H1' H . . . . 12 . H1' rr_1f79 1
103 1 . 1 . 1 1 11 11 U H2' H . . . . 11 . H2'' rr_1f79 1
103 1 . 2 . 1 1 12 12 C H6 H . . . . 12 . H6 rr_1f79 1
104 1 . 1 . 1 1 11 11 U H2' H . . . . 11 . H2'' rr_1f79 1
104 1 . 2 . 1 1 12 12 C H5 H . . . . 12 . H5 rr_1f79 1
105 1 . 1 . 1 1 11 11 U H3' H . . . . 11 . H3' rr_1f79 1
105 1 . 2 . 1 1 12 12 C H6 H . . . . 12 . H6 rr_1f79 1
106 1 . 1 . 1 1 11 11 U H4' H . . . . 11 . H4' rr_1f79 1
106 1 . 2 . 1 1 12 12 C H6 H . . . . 12 . H6 rr_1f79 1
107 1 . 1 . 1 1 11 11 U H6 H . . . . 11 . H6 rr_1f79 1
107 1 . 2 . 1 1 12 12 C H6 H . . . . 12 . H6 rr_1f79 1
108 1 . 1 . 1 1 11 11 U H6 H . . . . 11 . H6 rr_1f79 1
108 1 . 2 . 1 1 12 12 C H5 H . . . . 12 . H5 rr_1f79 1
109 1 . 1 . 1 1 11 11 U H5 H . . . . 11 . H5 rr_1f79 1
109 1 . 2 . 1 1 12 12 C H5 H . . . . 12 . H5 rr_1f79 1
110 1 . 1 . 1 1 12 12 C H6 H . . . . 12 . H6 rr_1f79 1
110 1 . 2 . 1 1 12 12 C H1' H . . . . 12 . H1' rr_1f79 1
111 1 . 1 . 1 1 12 12 C H6 H . . . . 12 . H6 rr_1f79 1
111 1 . 2 . 1 1 12 12 C H2' H . . . . 12 . H2'' rr_1f79 1
112 1 . 1 . 1 1 12 12 C H1' H . . . . 12 . H1' rr_1f79 1
112 1 . 2 . 1 1 13 13 U H6 H . . . . 13 . H6 rr_1f79 1
113 1 . 1 . 1 1 12 12 C H2' H . . . . 12 . H2'' rr_1f79 1
113 1 . 2 . 1 1 13 13 U H1' H . . . . 13 . H1' rr_1f79 1
114 1 . 1 . 1 1 12 12 C H2' H . . . . 12 . H2'' rr_1f79 1
114 1 . 2 . 1 1 13 13 U H6 H . . . . 13 . H6 rr_1f79 1
115 1 . 1 . 1 1 12 12 C H3' H . . . . 12 . H3' rr_1f79 1
115 1 . 2 . 1 1 13 13 U H6 H . . . . 13 . H6 rr_1f79 1
116 1 . 1 . 1 1 12 12 C H4' H . . . . 12 . H4' rr_1f79 1
116 1 . 2 . 1 1 13 13 U H6 H . . . . 13 . H6 rr_1f79 1
117 1 . 1 . 1 1 12 12 C H6 H . . . . 12 . H6 rr_1f79 1
117 1 . 2 . 1 1 13 13 U H6 H . . . . 13 . H6 rr_1f79 1
118 1 . 1 . 1 1 12 12 C H6 H . . . . 12 . H6 rr_1f79 1
118 1 . 2 . 1 1 13 13 U H5 H . . . . 13 . H5 rr_1f79 1
119 1 . 1 . 1 1 12 12 C H5 H . . . . 12 . H5 rr_1f79 1
119 1 . 2 . 1 1 13 13 U H5 H . . . . 13 . H5 rr_1f79 1
120 1 . 1 . 1 1 13 13 U H6 H . . . . 13 . H6 rr_1f79 1
120 1 . 2 . 1 1 13 13 U H1' H . . . . 13 . H1' rr_1f79 1
121 1 . 1 . 1 1 13 13 U H6 H . . . . 13 . H6 rr_1f79 1
121 1 . 2 . 1 1 13 13 U H2' H . . . . 13 . H2'' rr_1f79 1
122 1 . 1 . 1 1 13 13 U H1' H . . . . 13 . H1' rr_1f79 1
122 1 . 2 . 1 1 14 14 U H5 H . . . . 14 . H5 rr_1f79 1
123 1 . 1 . 1 1 13 13 U H3' H . . . . 13 . H3' rr_1f79 1
123 1 . 2 . 1 1 14 14 U H5 H . . . . 14 . H5 rr_1f79 1
124 1 . 1 . 1 1 13 13 U H4' H . . . . 13 . H4' rr_1f79 1
124 1 . 2 . 1 1 14 14 U H5 H . . . . 14 . H5 rr_1f79 1
125 1 . 1 . 1 1 13 13 U H2' H . . . . 13 . H2'' rr_1f79 1
125 1 . 2 . 1 1 14 14 U H6 H . . . . 14 . H6 rr_1f79 1
126 1 . 1 . 1 1 13 13 U H1' H . . . . 13 . H1' rr_1f79 1
126 1 . 2 . 1 1 14 14 U H5 H . . . . 14 . H5 rr_1f79 1
127 1 . 1 . 1 1 13 13 U H2' H . . . . 13 . H2'' rr_1f79 1
127 1 . 2 . 1 1 14 14 U H5 H . . . . 14 . H5 rr_1f79 1
128 1 . 1 . 1 1 13 13 U H2' H . . . . 13 . H2'' rr_1f79 1
128 1 . 2 . 1 1 14 14 U H6 H . . . . 14 . H6 rr_1f79 1
129 1 . 1 . 1 1 13 13 U H6 H . . . . 13 . H6 rr_1f79 1
129 1 . 2 . 1 1 14 14 U H5 H . . . . 14 . H5 rr_1f79 1
130 1 . 1 . 1 1 13 13 U H3' H . . . . 13 . H3' rr_1f79 1
130 1 . 2 . 1 1 15 15 C H5 H . . . . 15 . H5 rr_1f79 1
131 1 . 1 . 1 1 14 14 U H6 H . . . . 14 . H6 rr_1f79 1
131 1 . 2 . 1 1 14 14 U H1' H . . . . 14 . H1' rr_1f79 1
132 1 . 1 . 1 1 14 14 U H6 H . . . . 14 . H6 rr_1f79 1
132 1 . 2 . 1 1 14 14 U H2' H . . . . 14 . H2'' rr_1f79 1
133 1 . 1 . 1 1 14 14 U H2' H . . . . 14 . H2'' rr_1f79 1
133 1 . 2 . 1 1 15 15 C H6 H . . . . 15 . H6 rr_1f79 1
134 1 . 1 . 1 1 14 14 U H2' H . . . . 14 . H2'' rr_1f79 1
134 1 . 2 . 1 1 15 15 C H5 H . . . . 15 . H5 rr_1f79 1
135 1 . 1 . 1 1 14 14 U H6 H . . . . 14 . H6 rr_1f79 1
135 1 . 2 . 1 1 15 15 C H6 H . . . . 15 . H6 rr_1f79 1
136 1 . 1 . 1 1 14 14 U H2' H . . . . 14 . H2'' rr_1f79 1
136 1 . 2 . 1 1 15 15 C H5 H . . . . 15 . H5 rr_1f79 1
137 1 . 1 . 1 1 14 14 U H3' H . . . . 14 . H3' rr_1f79 1
137 1 . 2 . 1 1 15 15 C H5 H . . . . 15 . H5 rr_1f79 1
138 1 . 1 . 1 1 14 14 U H4' H . . . . 14 . H4' rr_1f79 1
138 1 . 2 . 1 1 15 15 C H5 H . . . . 15 . H5 rr_1f79 1
139 1 . 1 . 1 1 14 14 U H5' H . . . . 14 . H5' rr_1f79 1
139 1 . 2 . 1 1 15 15 C H5 H . . . . 15 . H5 rr_1f79 1
140 1 . 1 . 1 1 14 14 U H5'' H . . . . 14 . H5'' rr_1f79 1
140 1 . 2 . 1 1 15 15 C H5 H . . . . 15 . H5 rr_1f79 1
141 1 . 1 . 1 1 15 15 C H6 H . . . . 15 . H6 rr_1f79 1
141 1 . 2 . 1 1 15 15 C H1' H . . . . 15 . H1' rr_1f79 1
142 1 . 1 . 1 1 15 15 C H6 H . . . . 15 . H6 rr_1f79 1
142 1 . 2 . 1 1 15 15 C H2' H . . . . 15 . H2'' rr_1f79 1
143 1 . 1 . 1 1 15 15 C H5 H . . . . 15 . H5 rr_1f79 1
143 1 . 2 . 1 1 15 15 C H2' H . . . . 15 . H2'' rr_1f79 1
144 1 . 1 . 1 1 15 15 C H3' H . . . . 15 . H3' rr_1f79 1
144 1 . 2 . 1 1 16 16 G H1' H . . . . 16 . H1' rr_1f79 1
145 1 . 1 . 1 1 15 15 C H4' H . . . . 15 . H4' rr_1f79 1
145 1 . 2 . 1 1 16 16 G H1' H . . . . 16 . H1' rr_1f79 1
146 1 . 1 . 1 1 15 15 C H4' H . . . . 15 . H4' rr_1f79 1
146 1 . 2 . 1 1 16 16 G H3' H . . . . 16 . H3' rr_1f79 1
147 1 . 1 . 1 1 16 16 G H8 H . . . . 16 . H8 rr_1f79 1
147 1 . 2 . 1 1 16 16 G H1' H . . . . 16 . H1' rr_1f79 1
148 1 . 1 . 1 1 16 16 G H8 H . . . . 16 . H8 rr_1f79 1
148 1 . 2 . 1 1 16 16 G H2' H . . . . 16 . H2'' rr_1f79 1
149 1 . 1 . 1 1 16 16 G H2' H . . . . 16 . H2'' rr_1f79 1
149 1 . 2 . 1 1 17 17 G H8 H . . . . 17 . H8 rr_1f79 1
150 1 . 1 . 1 1 16 16 G H3' H . . . . 16 . H3' rr_1f79 1
150 1 . 2 . 1 1 17 17 G H8 H . . . . 17 . H8 rr_1f79 1
151 1 . 1 . 1 1 16 16 G H8 H . . . . 16 . H8 rr_1f79 1
151 1 . 2 . 1 1 17 17 G H8 H . . . . 17 . H8 rr_1f79 1
152 1 . 1 . 1 1 17 17 G H8 H . . . . 17 . H8 rr_1f79 1
152 1 . 2 . 1 1 17 17 G H1' H . . . . 17 . H1' rr_1f79 1
153 1 . 1 . 1 1 17 17 G H8 H . . . . 17 . H8 rr_1f79 1
153 1 . 2 . 1 1 17 17 G H2' H . . . . 17 . H2'' rr_1f79 1
154 1 . 1 . 1 1 17 17 G H1' H . . . . 17 . H1' rr_1f79 1
154 1 . 2 . 1 1 18 18 A H8 H . . . . 18 . H8 rr_1f79 1
155 1 . 1 . 1 1 17 17 G H2' H . . . . 17 . H2'' rr_1f79 1
155 1 . 2 . 1 1 18 18 A H1' H . . . . 18 . H1' rr_1f79 1
156 1 . 1 . 1 1 17 17 G H2' H . . . . 17 . H2'' rr_1f79 1
156 1 . 2 . 1 1 18 18 A H8 H . . . . 18 . H8 rr_1f79 1
157 1 . 1 . 1 1 17 17 G H8 H . . . . 17 . H8 rr_1f79 1
157 1 . 2 . 1 1 18 18 A H8 H . . . . 18 . H8 rr_1f79 1
158 1 . 1 . 1 1 18 18 A H8 H . . . . 18 . H8 rr_1f79 1
158 1 . 2 . 1 1 18 18 A H1' H . . . . 18 . H1' rr_1f79 1
159 1 . 1 . 1 1 18 18 A H8 H . . . . 18 . H8 rr_1f79 1
159 1 . 2 . 1 1 18 18 A H2' H . . . . 18 . H2'' rr_1f79 1
160 1 . 1 . 1 1 18 18 A H2 H . . . . 18 . H2 rr_1f79 1
160 1 . 2 . 1 1 18 18 A H1' H . . . . 18 . H1' rr_1f79 1
161 1 . 1 . 1 1 18 18 A H1' H . . . . 18 . H1' rr_1f79 1
161 1 . 2 . 1 1 19 19 C H1' H . . . . 19 . H1' rr_1f79 1
162 1 . 1 . 1 1 18 18 A H1' H . . . . 18 . H1' rr_1f79 1
162 1 . 2 . 1 1 19 19 C H5 H . . . . 19 . H5 rr_1f79 1
163 1 . 1 . 1 1 18 18 A H1' H . . . . 18 . H1' rr_1f79 1
163 1 . 2 . 1 1 19 19 C H6 H . . . . 19 . H6 rr_1f79 1
164 1 . 1 . 1 1 18 18 A H2' H . . . . 18 . H2'' rr_1f79 1
164 1 . 2 . 1 1 19 19 C H1' H . . . . 19 . H1' rr_1f79 1
165 1 . 1 . 1 1 18 18 A H2' H . . . . 18 . H2'' rr_1f79 1
165 1 . 2 . 1 1 19 19 C H5 H . . . . 19 . H5 rr_1f79 1
166 1 . 1 . 1 1 18 18 A H2' H . . . . 18 . H2'' rr_1f79 1
166 1 . 2 . 1 1 19 19 C H6 H . . . . 19 . H6 rr_1f79 1
167 1 . 1 . 1 1 18 18 A H3' H . . . . 18 . H3' rr_1f79 1
167 1 . 2 . 1 1 19 19 C H6 H . . . . 19 . H6 rr_1f79 1
168 1 . 1 . 1 1 18 18 A H8 H . . . . 18 . H8 rr_1f79 1
168 1 . 2 . 1 1 19 19 C H5 H . . . . 19 . H5 rr_1f79 1
169 1 . 1 . 1 1 18 18 A H8 H . . . . 18 . H8 rr_1f79 1
169 1 . 2 . 1 1 19 19 C H6 H . . . . 19 . H6 rr_1f79 1
170 1 . 1 . 1 1 18 18 A H2 H . . . . 18 . H2 rr_1f79 1
170 1 . 2 . 1 1 19 19 C H1' H . . . . 19 . H1' rr_1f79 1
171 1 . 1 . 1 1 18 18 A H2 H . . . . 18 . H2 rr_1f79 1
171 1 . 2 . 1 1 19 19 C H6 H . . . . 19 . H6 rr_1f79 1
172 1 . 1 . 1 1 18 18 A H2 H . . . . 18 . H2 rr_1f79 1
172 1 . 2 . 1 1 12 12 C H1' H . . . . 12 . H1' rr_1f79 1
173 1 . 1 . 1 1 19 19 C H6 H . . . . 19 . H6 rr_1f79 1
173 1 . 2 . 1 1 19 19 C H1' H . . . . 19 . H1' rr_1f79 1
174 1 . 1 . 1 1 19 19 C H6 H . . . . 19 . H6 rr_1f79 1
174 1 . 2 . 1 1 19 19 C H2' H . . . . 19 . H2'' rr_1f79 1
175 1 . 1 . 1 1 19 19 C H5 H . . . . 19 . H5 rr_1f79 1
175 1 . 2 . 1 1 19 19 C H1' H . . . . 19 . H1' rr_1f79 1
176 1 . 1 . 1 1 19 19 C H1' H . . . . 19 . H1' rr_1f79 1
176 1 . 2 . 1 1 20 20 C H1' H . . . . 20 . H1' rr_1f79 1
177 1 . 1 . 1 1 19 19 C H1' H . . . . 19 . H1' rr_1f79 1
177 1 . 2 . 1 1 20 20 C H5 H . . . . 20 . H5 rr_1f79 1
178 1 . 1 . 1 1 19 19 C H1' H . . . . 19 . H1' rr_1f79 1
178 1 . 2 . 1 1 20 20 C H6 H . . . . 20 . H6 rr_1f79 1
179 1 . 1 . 1 1 19 19 C H2' H . . . . 19 . H2'' rr_1f79 1
179 1 . 2 . 1 1 20 20 C H1' H . . . . 20 . H1' rr_1f79 1
180 1 . 1 . 1 1 19 19 C H2' H . . . . 19 . H2'' rr_1f79 1
180 1 . 2 . 1 1 20 20 C H5 H . . . . 20 . H5 rr_1f79 1
181 1 . 1 . 1 1 19 19 C H2' H . . . . 19 . H2'' rr_1f79 1
181 1 . 2 . 1 1 20 20 C H6 H . . . . 20 . H6 rr_1f79 1
182 1 . 1 . 1 1 19 19 C H3' H . . . . 19 . H3' rr_1f79 1
182 1 . 2 . 1 1 20 20 C H6 H . . . . 20 . H6 rr_1f79 1
183 1 . 1 . 1 1 19 19 C H4' H . . . . 19 . H4' rr_1f79 1
183 1 . 2 . 1 1 20 20 C H6 H . . . . 20 . H6 rr_1f79 1
184 1 . 1 . 1 1 19 19 C H5 H . . . . 19 . H5 rr_1f79 1
184 1 . 2 . 1 1 20 20 C H5 H . . . . 20 . H5 rr_1f79 1
185 1 . 1 . 1 1 19 19 C H5 H . . . . 19 . H5 rr_1f79 1
185 1 . 2 . 1 1 20 20 C H6 H . . . . 20 . H6 rr_1f79 1
186 1 . 1 . 1 1 19 19 C H6 H . . . . 19 . H6 rr_1f79 1
186 1 . 2 . 1 1 20 20 C H5 H . . . . 20 . H5 rr_1f79 1
187 1 . 1 . 1 1 19 19 C H6 H . . . . 19 . H6 rr_1f79 1
187 1 . 2 . 1 1 20 20 C H6 H . . . . 20 . H6 rr_1f79 1
188 1 . 1 . 1 1 20 20 C H6 H . . . . 20 . H6 rr_1f79 1
188 1 . 2 . 1 1 20 20 C H1' H . . . . 20 . H1' rr_1f79 1
189 1 . 1 . 1 1 20 20 C H6 H . . . . 20 . H6 rr_1f79 1
189 1 . 2 . 1 1 20 20 C H2' H . . . . 20 . H2'' rr_1f79 1
190 1 . 1 . 1 1 20 20 C H5 H . . . . 20 . H5 rr_1f79 1
190 1 . 2 . 1 1 20 20 C H1' H . . . . 20 . H1' rr_1f79 1
191 1 . 1 . 1 1 20 20 C H1' H . . . . 20 . H1' rr_1f79 1
191 1 . 2 . 1 1 21 21 G H8 H . . . . 21 . H8 rr_1f79 1
192 1 . 1 . 1 1 20 20 C H2' H . . . . 20 . H2'' rr_1f79 1
192 1 . 2 . 1 1 21 21 G H1' H . . . . 21 . H1' rr_1f79 1
193 1 . 1 . 1 1 20 20 C H2' H . . . . 20 . H2'' rr_1f79 1
193 1 . 2 . 1 1 21 21 G H8 H . . . . 21 . H8 rr_1f79 1
194 1 . 1 . 1 1 20 20 C H3' H . . . . 20 . H3' rr_1f79 1
194 1 . 2 . 1 1 21 21 G H8 H . . . . 21 . H8 rr_1f79 1
195 1 . 1 . 1 1 20 20 C H5 H . . . . 20 . H5 rr_1f79 1
195 1 . 2 . 1 1 21 21 G H8 H . . . . 21 . H8 rr_1f79 1
196 1 . 1 . 1 1 20 20 C H6 H . . . . 20 . H6 rr_1f79 1
196 1 . 2 . 1 1 21 21 G H8 H . . . . 21 . H8 rr_1f79 1
197 1 . 1 . 1 1 21 21 G H8 H . . . . 21 . H8 rr_1f79 1
197 1 . 2 . 1 1 21 21 G H1' H . . . . 21 . H1' rr_1f79 1
198 1 . 1 . 1 1 21 21 G H8 H . . . . 21 . H8 rr_1f79 1
198 1 . 2 . 1 1 21 21 G H2' H . . . . 21 . H2'' rr_1f79 1
199 1 . 1 . 1 1 21 21 G H1' H . . . . 21 . H1' rr_1f79 1
199 1 . 2 . 1 1 22 22 G H8 H . . . . 22 . H8 rr_1f79 1
200 1 . 1 . 1 1 21 21 G H2' H . . . . 21 . H2'' rr_1f79 1
200 1 . 2 . 1 1 22 22 G H1' H . . . . 22 . H1' rr_1f79 1
201 1 . 1 . 1 1 21 21 G H2' H . . . . 21 . H2'' rr_1f79 1
201 1 . 2 . 1 1 22 22 G H8 H . . . . 22 . H8 rr_1f79 1
202 1 . 1 . 1 1 21 21 G H3' H . . . . 21 . H3' rr_1f79 1
202 1 . 2 . 1 1 22 22 G H8 H . . . . 22 . H8 rr_1f79 1
203 1 . 1 . 1 1 21 21 G H4' H . . . . 21 . H4' rr_1f79 1
203 1 . 2 . 1 1 22 22 G H8 H . . . . 22 . H8 rr_1f79 1
204 1 . 1 . 1 1 21 21 G H8 H . . . . 21 . H8 rr_1f79 1
204 1 . 2 . 1 1 22 22 G H8 H . . . . 22 . H8 rr_1f79 1
205 1 . 1 . 1 1 22 22 G H8 H . . . . 22 . H8 rr_1f79 1
205 1 . 2 . 1 1 22 22 G H1' H . . . . 22 . H1' rr_1f79 1
206 1 . 1 . 1 1 22 22 G H8 H . . . . 22 . H8 rr_1f79 1
206 1 . 2 . 1 1 22 22 G H2' H . . . . 22 . H2'' rr_1f79 1
207 1 . 1 . 1 1 22 22 G H8 H . . . . 22 . H8 rr_1f79 1
207 1 . 2 . 1 1 22 22 G H3' H . . . . 22 . H3' rr_1f79 1
208 1 . 1 . 1 1 22 22 G H1' H . . . . 22 . H1' rr_1f79 1
208 1 . 2 . 1 1 23 23 C H1' H . . . . 23 . H1' rr_1f79 1
209 1 . 1 . 1 1 22 22 G H1' H . . . . 22 . H1' rr_1f79 1
209 1 . 2 . 1 1 23 23 C H5 H . . . . 23 . H5 rr_1f79 1
210 1 . 1 . 1 1 22 22 G H1' H . . . . 22 . H1' rr_1f79 1
210 1 . 2 . 1 1 23 23 C H6 H . . . . 23 . H6 rr_1f79 1
211 1 . 1 . 1 1 22 22 G H2' H . . . . 22 . H2'' rr_1f79 1
211 1 . 2 . 1 1 23 23 C H1' H . . . . 23 . H1' rr_1f79 1
212 1 . 1 . 1 1 22 22 G H2' H . . . . 22 . H2'' rr_1f79 1
212 1 . 2 . 1 1 23 23 C H5 H . . . . 23 . H5 rr_1f79 1
213 1 . 1 . 1 1 22 22 G H2' H . . . . 22 . H2'' rr_1f79 1
213 1 . 2 . 1 1 23 23 C H6 H . . . . 23 . H6 rr_1f79 1
214 1 . 1 . 1 1 22 22 G H3' H . . . . 22 . H3' rr_1f79 1
214 1 . 2 . 1 1 23 23 C H6 H . . . . 23 . H6 rr_1f79 1
215 1 . 1 . 1 1 22 22 G H8 H . . . . 22 . H8 rr_1f79 1
215 1 . 2 . 1 1 23 23 C H5 H . . . . 23 . H5 rr_1f79 1
216 1 . 1 . 1 1 22 22 G H8 H . . . . 22 . H8 rr_1f79 1
216 1 . 2 . 1 1 23 23 C H6 H . . . . 23 . H6 rr_1f79 1
217 1 . 1 . 1 1 23 23 C H6 H . . . . 23 . H6 rr_1f79 1
217 1 . 2 . 1 1 23 23 C H1' H . . . . 23 . H1' rr_1f79 1
218 1 . 1 . 1 1 23 23 C H6 H . . . . 23 . H6 rr_1f79 1
218 1 . 2 . 1 1 23 23 C H2' H . . . . 23 . H2'' rr_1f79 1
219 1 . 1 . 1 1 23 23 C H5 H . . . . 23 . H5 rr_1f79 1
219 1 . 2 . 1 1 23 23 C H1' H . . . . 23 . H1' rr_1f79 1
220 1 . 1 . 1 1 23 23 C H1' H . . . . 23 . H1' rr_1f79 1
220 1 . 2 . 1 1 24 24 U H5 H . . . . 24 . H5 rr_1f79 1
221 1 . 1 . 1 1 23 23 C H1' H . . . . 23 . H1' rr_1f79 1
221 1 . 2 . 1 1 24 24 U H6 H . . . . 24 . H6 rr_1f79 1
222 1 . 1 . 1 1 23 23 C H2' H . . . . 23 . H2'' rr_1f79 1
222 1 . 2 . 1 1 24 24 U H1' H . . . . 24 . H1' rr_1f79 1
223 1 . 1 . 1 1 23 23 C H2' H . . . . 23 . H2'' rr_1f79 1
223 1 . 2 . 1 1 24 24 U H5 H . . . . 24 . H5 rr_1f79 1
224 1 . 1 . 1 1 23 23 C H2' H . . . . 23 . H2'' rr_1f79 1
224 1 . 2 . 1 1 24 24 U H6 H . . . . 24 . H6 rr_1f79 1
225 1 . 1 . 1 1 23 23 C H3' H . . . . 23 . H3' rr_1f79 1
225 1 . 2 . 1 1 24 24 U H6 H . . . . 24 . H6 rr_1f79 1
226 1 . 1 . 1 1 23 23 C H5 H . . . . 23 . H5 rr_1f79 1
226 1 . 2 . 1 1 24 24 U H5 H . . . . 24 . H5 rr_1f79 1
227 1 . 1 . 1 1 23 23 C H5 H . . . . 23 . H5 rr_1f79 1
227 1 . 2 . 1 1 24 24 U H6 H . . . . 24 . H6 rr_1f79 1
228 1 . 1 . 1 1 23 23 C H6 H . . . . 23 . H6 rr_1f79 1
228 1 . 2 . 1 1 24 24 U H5 H . . . . 24 . H5 rr_1f79 1
229 1 . 1 . 1 1 23 23 C H6 H . . . . 23 . H6 rr_1f79 1
229 1 . 2 . 1 1 24 24 U H6 H . . . . 24 . H6 rr_1f79 1
230 1 . 1 . 1 1 24 24 U H6 H . . . . 24 . H6 rr_1f79 1
230 1 . 2 . 1 1 24 24 U H1' H . . . . 24 . H1' rr_1f79 1
231 1 . 1 . 1 1 24 24 U H6 H . . . . 24 . H6 rr_1f79 1
231 1 . 2 . 1 1 24 24 U H2' H . . . . 24 . H2'' rr_1f79 1
232 1 . 1 . 1 1 24 24 U H5 H . . . . 24 . H5 rr_1f79 1
232 1 . 2 . 1 1 24 24 U H1' H . . . . 24 . H1' rr_1f79 1
233 1 . 1 . 1 1 24 24 U H1' H . . . . 24 . H1' rr_1f79 1
233 1 . 2 . 1 1 25 25 U H5 H . . . . 25 . H5 rr_1f79 1
234 1 . 1 . 1 1 24 24 U H1' H . . . . 24 . H1' rr_1f79 1
234 1 . 2 . 1 1 25 25 U H6 H . . . . 25 . H6 rr_1f79 1
235 1 . 1 . 1 1 24 24 U H2' H . . . . 24 . H2'' rr_1f79 1
235 1 . 2 . 1 1 25 25 U H1' H . . . . 25 . H1' rr_1f79 1
236 1 . 1 . 1 1 24 24 U H2' H . . . . 24 . H2'' rr_1f79 1
236 1 . 2 . 1 1 25 25 U H5 H . . . . 25 . H5 rr_1f79 1
237 1 . 1 . 1 1 24 24 U H2' H . . . . 24 . H2'' rr_1f79 1
237 1 . 2 . 1 1 25 25 U H6 H . . . . 25 . H6 rr_1f79 1
238 1 . 1 . 1 1 24 24 U H3' H . . . . 24 . H3' rr_1f79 1
238 1 . 2 . 1 1 25 25 U H6 H . . . . 25 . H6 rr_1f79 1
239 1 . 1 . 1 1 24 24 U H5 H . . . . 24 . H5 rr_1f79 1
239 1 . 2 . 1 1 25 25 U H5 H . . . . 25 . H5 rr_1f79 1
240 1 . 1 . 1 1 24 24 U H5 H . . . . 24 . H5 rr_1f79 1
240 1 . 2 . 1 1 25 25 U H6 H . . . . 25 . H6 rr_1f79 1
241 1 . 1 . 1 1 24 24 U H6 H . . . . 24 . H6 rr_1f79 1
241 1 . 2 . 1 1 25 25 U H5 H . . . . 25 . H5 rr_1f79 1
242 1 . 1 . 1 1 24 24 U H6 H . . . . 24 . H6 rr_1f79 1
242 1 . 2 . 1 1 25 25 U H6 H . . . . 25 . H6 rr_1f79 1
243 1 . 1 . 1 1 25 25 U H6 H . . . . 25 . H6 rr_1f79 1
243 1 . 2 . 1 1 25 25 U H1' H . . . . 25 . H1' rr_1f79 1
244 1 . 1 . 1 1 25 25 U H6 H . . . . 25 . H6 rr_1f79 1
244 1 . 2 . 1 1 25 25 U H2' H . . . . 25 . H2'' rr_1f79 1
245 1 . 1 . 1 1 25 25 U H5 H . . . . 25 . H5 rr_1f79 1
245 1 . 2 . 1 1 25 25 U H1' H . . . . 25 . H1' rr_1f79 1
246 1 . 1 . 1 1 25 25 U H1' H . . . . 25 . H1' rr_1f79 1
246 1 . 2 . 1 1 26 26 C H6 H . . . . 26 . H6 rr_1f79 1
247 1 . 1 . 1 1 25 25 U H2' H . . . . 25 . H2'' rr_1f79 1
247 1 . 2 . 1 1 26 26 C H1' H . . . . 26 . H1' rr_1f79 1
248 1 . 1 . 1 1 25 25 U H2' H . . . . 25 . H2'' rr_1f79 1
248 1 . 2 . 1 1 26 26 C H5 H . . . . 26 . H5 rr_1f79 1
249 1 . 1 . 1 1 25 25 U H2' H . . . . 25 . H2'' rr_1f79 1
249 1 . 2 . 1 1 26 26 C H6 H . . . . 26 . H6 rr_1f79 1
250 1 . 1 . 1 1 25 25 U H3' H . . . . 25 . H3' rr_1f79 1
250 1 . 2 . 1 1 26 26 C H6 H . . . . 26 . H6 rr_1f79 1
251 1 . 1 . 1 1 25 25 U H5 H . . . . 25 . H5 rr_1f79 1
251 1 . 2 . 1 1 26 26 C H5 H . . . . 26 . H5 rr_1f79 1
252 1 . 1 . 1 1 25 25 U H5 H . . . . 25 . H5 rr_1f79 1
252 1 . 2 . 1 1 26 26 C H6 H . . . . 26 . H6 rr_1f79 1
253 1 . 1 . 1 1 25 25 U H6 H . . . . 25 . H6 rr_1f79 1
253 1 . 2 . 1 1 26 26 C H5 H . . . . 26 . H5 rr_1f79 1
254 1 . 1 . 1 1 25 25 U H6 H . . . . 25 . H6 rr_1f79 1
254 1 . 2 . 1 1 26 26 C H6 H . . . . 26 . H6 rr_1f79 1
255 1 . 1 . 1 1 26 26 C H6 H . . . . 26 . H6 rr_1f79 1
255 1 . 2 . 1 1 26 26 C H1' H . . . . 26 . H1' rr_1f79 1
256 1 . 1 . 1 1 26 26 C H6 H . . . . 26 . H6 rr_1f79 1
256 1 . 2 . 1 1 26 26 C H2' H . . . . 26 . H2'' rr_1f79 1
257 1 . 1 . 1 1 26 26 C H1' H . . . . 26 . H1' rr_1f79 1
257 1 . 2 . 1 1 27 27 C H6 H . . . . 27 . H6 rr_1f79 1
258 1 . 1 . 1 1 26 26 C H2' H . . . . 26 . H2'' rr_1f79 1
258 1 . 2 . 1 1 27 27 C H1' H . . . . 27 . H1' rr_1f79 1
259 1 . 1 . 1 1 26 26 C H2' H . . . . 26 . H2'' rr_1f79 1
259 1 . 2 . 1 1 27 27 C H5 H . . . . 27 . H5 rr_1f79 1
260 1 . 1 . 1 1 26 26 C H2' H . . . . 26 . H2'' rr_1f79 1
260 1 . 2 . 1 1 27 27 C H6 H . . . . 27 . H6 rr_1f79 1
261 1 . 1 . 1 1 26 26 C H3' H . . . . 26 . H3' rr_1f79 1
261 1 . 2 . 1 1 27 27 C H6 H . . . . 27 . H6 rr_1f79 1
262 1 . 1 . 1 1 26 26 C H4' H . . . . 26 . H4' rr_1f79 1
262 1 . 2 . 1 1 27 27 C H6 H . . . . 27 . H6 rr_1f79 1
263 1 . 1 . 1 1 26 26 C H5 H . . . . 26 . H5 rr_1f79 1
263 1 . 2 . 1 1 27 27 C H5 H . . . . 27 . H5 rr_1f79 1
264 1 . 1 . 1 1 26 26 C H6 H . . . . 26 . H6 rr_1f79 1
264 1 . 2 . 1 1 27 27 C H5 H . . . . 27 . H5 rr_1f79 1
265 1 . 1 . 1 1 26 26 C H6 H . . . . 26 . H6 rr_1f79 1
265 1 . 2 . 1 1 27 27 C H6 H . . . . 27 . H6 rr_1f79 1
266 1 . 1 . 1 1 27 27 C H6 H . . . . 27 . H6 rr_1f79 1
266 1 . 2 . 1 1 27 27 C H1' H . . . . 27 . H1' rr_1f79 1
267 1 . 1 . 1 1 27 27 C H6 H . . . . 27 . H6 rr_1f79 1
267 1 . 2 . 1 1 27 27 C H2' H . . . . 27 . H2'' rr_1f79 1
268 1 . 1 . 1 1 27 27 C H6 H . . . . 27 . H6 rr_1f79 1
268 1 . 2 . 1 1 27 27 C H1' H . . . . 27 . H1' rr_1f79 1
269 1 . 1 . 2 2 1 1 NCO CO Co . . . . 28 . CO rr_1f79 1
269 1 . 2 . 1 1 5 5 G H1 H . . . . 5 . H1 rr_1f79 1
270 1 . 1 . 2 2 1 1 NCO CO Co . . . . 28 . CO rr_1f79 1
270 1 . 2 . 1 1 9 9 G H1 H . . . . 9 . H1 rr_1f79 1
271 1 . 1 . 2 2 1 1 NCO CO Co . . . . 28 . CO rr_1f79 1
271 1 . 2 . 1 1 10 10 G H1 H . . . . 10 . H1 rr_1f79 1
272 1 . 1 . 2 2 1 1 NCO CO Co . . . . 28 . CO rr_1f79 1
272 1 . 2 . 1 1 21 21 G H1 H . . . . 21 . H1 rr_1f79 1
273 1 . 1 . 2 2 1 1 NCO CO Co . . . . 28 . CO rr_1f79 1
273 1 . 2 . 1 1 11 11 U H3 H . . . . 11 . H3 rr_1f79 1
274 1 . 1 . 2 2 1 1 NCO CO Co . . . . 28 . CO rr_1f79 1
274 1 . 2 . 1 1 24 24 U H3 H . . . . 24 . H3 rr_1f79 1
275 1 . 1 . 2 2 1 1 NCO CO Co . . . . 28 . CO rr_1f79 1
275 1 . 2 . 1 1 21 21 G H8 H . . . . 21 . H8 rr_1f79 1
276 1 . 1 . 2 2 1 1 NCO CO Co . . . . 28 . CO rr_1f79 1
276 1 . 2 . 1 1 20 20 C H6 H . . . . 20 . H6 rr_1f79 1
277 1 . 1 . 2 2 1 1 NCO CO Co . . . . 28 . CO rr_1f79 1
277 1 . 2 . 1 1 23 23 C H6 H . . . . 23 . H6 rr_1f79 1
278 1 . 1 . 2 2 1 1 NCO CO Co . . . . 28 . CO rr_1f79 1
278 1 . 2 . 1 1 5 5 G H8 H . . . . 5 . H8 rr_1f79 1
279 1 . 1 . 2 2 1 1 NCO CO Co . . . . 28 . CO rr_1f79 1
279 1 . 2 . 1 1 19 19 C H6 H . . . . 19 . H6 rr_1f79 1
280 1 . 1 . 2 2 1 1 NCO CO Co . . . . 28 . CO rr_1f79 1
280 1 . 2 . 1 1 22 22 G H8 H . . . . 22 . H8 rr_1f79 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 . . . . . . 2.0 2.0 5.0 rr_1f79 1
2 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
3 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
4 1 . . . . . . 1.8 1.8 3.2 rr_1f79 1
5 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
6 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
7 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
8 1 . . . . . . 2.5 2.5 4.5 rr_1f79 1
9 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
10 1 . . . . . . 2.0 2.0 5.0 rr_1f79 1
11 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
12 1 . . . . . . 1.8 1.8 3.2 rr_1f79 1
13 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
14 1 . . . . . . 1.8 1.8 3.2 rr_1f79 1
15 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
16 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
17 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
18 1 . . . . . . 2.0 2.0 5.0 rr_1f79 1
19 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
20 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
21 1 . . . . . . 1.8 1.8 3.2 rr_1f79 1
22 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
23 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
24 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
25 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
26 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
27 1 . . . . . . 2.0 2.0 5.0 rr_1f79 1
28 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
29 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
30 1 . . . . . . 2.0 2.0 5.0 rr_1f79 1
31 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
32 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
33 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
34 1 . . . . . . 1.8 1.8 3.2 rr_1f79 1
35 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
36 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
37 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
38 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
39 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
40 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
41 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
42 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
43 1 . . . . . . 2.0 2.0 5.0 rr_1f79 1
44 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
45 1 . . . . . . 3.0 3.0 6.0 rr_1f79 1
46 1 . . . . . . 1.8 1.8 3.8 rr_1f79 1
47 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
48 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
49 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
50 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
51 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
52 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
53 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
54 1 . . . . . . 1.8 1.8 3.8 rr_1f79 1
55 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
56 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
57 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
58 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
59 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
60 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
61 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
62 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
63 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
64 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
65 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
66 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
67 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
68 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
69 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
70 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
71 1 . . . . . . 1.8 1.8 3.8 rr_1f79 1
72 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
73 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
74 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
75 1 . . . . . . 1.8 1.8 3.2 rr_1f79 1
76 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
77 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
78 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
79 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
80 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
81 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
82 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
83 1 . . . . . . 1.8 1.8 3.2 rr_1f79 1
84 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
85 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
86 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
87 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
88 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
89 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
90 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
91 1 . . . . . . 3.0 3.0 6.0 rr_1f79 1
92 1 . . . . . . 1.8 1.8 3.2 rr_1f79 1
93 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
94 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
95 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
96 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
97 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
98 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
99 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
100 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
101 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
102 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
103 1 . . . . . . 1.8 1.8 3.2 rr_1f79 1
104 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
105 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
106 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
107 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
108 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
109 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
110 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
111 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
112 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
113 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
114 1 . . . . . . 1.8 1.8 3.2 rr_1f79 1
115 1 . . . . . . 2.0 2.0 5.0 rr_1f79 1
116 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
117 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
118 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
119 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
120 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
121 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
122 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
123 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
124 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
125 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
126 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
127 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
128 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
129 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
130 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
131 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
132 1 . . . . . . 1.8 1.8 3.2 rr_1f79 1
133 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
134 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
135 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
136 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
137 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
138 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
139 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
140 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
141 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
142 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
143 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
144 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
145 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
146 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
147 1 . . . . . . 1.8 1.8 3.2 rr_1f79 1
148 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
149 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
150 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
151 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
152 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
153 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
154 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
155 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
156 1 . . . . . . 1.8 1.8 3.2 rr_1f79 1
157 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
158 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
159 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
160 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
161 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
162 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
163 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
164 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
165 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
166 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
167 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
168 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
169 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
170 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
171 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
172 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
173 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
174 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
175 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
176 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
177 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
178 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
179 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
180 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
181 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
182 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
183 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
184 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
185 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
186 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
187 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
188 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
189 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
190 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
191 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
192 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
193 1 . . . . . . 1.8 1.8 3.2 rr_1f79 1
194 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
195 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
196 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
197 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
198 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
199 1 . . . . . . 2.0 2.0 5.0 rr_1f79 1
200 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
201 1 . . . . . . 1.8 1.8 3.2 rr_1f79 1
202 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
203 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
204 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
205 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
206 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
207 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
208 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
209 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
210 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
211 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
212 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
213 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
214 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
215 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
216 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
217 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
218 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
219 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
220 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
221 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
222 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
223 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
224 1 . . . . . . 1.8 1.8 3.2 rr_1f79 1
225 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
226 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
227 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
228 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
229 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
230 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
231 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
232 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
233 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
234 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
235 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
236 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
237 1 . . . . . . 1.8 1.8 3.2 rr_1f79 1
238 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
239 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
240 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
241 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
242 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
243 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
244 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
245 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
246 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
247 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
248 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
249 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
250 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
251 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
252 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
253 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
254 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
255 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
256 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
257 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
258 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
259 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
260 1 . . . . . . 2.0 2.0 4.0 rr_1f79 1
261 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
262 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
263 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
264 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
265 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
266 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
267 1 . . . . . . 2.5 2.5 5.0 rr_1f79 1
268 1 . . . . . . 3.0 3.0 7.0 rr_1f79 1
269 1 . . . . . . 4.3 4.3 9.3 rr_1f79 1
270 1 . . . . . . 4.3 4.3 9.3 rr_1f79 1
271 1 . . . . . . 4.3 4.3 9.3 rr_1f79 1
272 1 . . . . . . 4.3 4.3 9.3 rr_1f79 1
273 1 . . . . . . 4.3 4.3 11.3 rr_1f79 1
274 1 . . . . . . 4.3 4.3 11.3 rr_1f79 1
275 1 . . . . . . 4.3 4.3 9.3 rr_1f79 1
276 1 . . . . . . 4.3 4.3 9.3 rr_1f79 1
277 1 . . . . . . 4.3 4.3 9.3 rr_1f79 1
278 1 . . . . . . 4.3 4.3 11.3 rr_1f79 1
279 1 . . . . . . 4.3 4.3 11.3 rr_1f79 1
280 1 . . . . . . 4.3 4.3 11.3 rr_1f79 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 "constraints for residue 1 from expt" 1 2 1 2 rr_1f79 1
2 "constraints for residue 1 to 2 from expt" 5 2 5 2 rr_1f79 1
3 "constraints for residue 2 from expt" 13 2 13 2 rr_1f79 1
4 "constraints for residue 2 to 3 from expt" 17 2 17 2 rr_1f79 1
5 overl. 22 68 22 68 rr_1f79 1
6 "constraints for residue 3 from expt" 25 2 25 2 rr_1f79 1
7 "constraints for residue 3 to 4 from expt" 30 2 30 2 rr_1f79 1
8 "constraints for residue 3 to 26 from expt" 40 2 40 2 rr_1f79 1
9 "constraints for residue 4 from expt" 43 2 43 2 rr_1f79 1
10 "constraints for residue 4 to 5 from expt" 48 2 48 2 rr_1f79 1
11 "constraints for residue 4 to 25 from expt" 59 2 59 2 rr_1f79 1
12 "constraints for residue 5 from expt" 62 2 62 2 rr_1f79 1
13 "constraints for residue 5 to 6 from expt" 66 2 66 2 rr_1f79 1
14 overl. 71 68 71 68 rr_1f79 1
15 "constraints for residue 6 from expt" 77 2 77 2 rr_1f79 1
16 "constraints for residue 6 to 7 from expt" 81 2 81 2 rr_1f79 1
17 overl. 83 69 83 69 rr_1f79 1
18 "constraints for residue 6 to 8 from expt" 85 2 85 2 rr_1f79 1
19 overl. 89 68 89 68 rr_1f79 1
20 "constraints for residue 7 from expt" 94 2 94 2 rr_1f79 1
21 "constraints for residue 7 to 8 from expt" 98 2 98 2 rr_1f79 1
22 "constraints for residue 8 from expt" 104 2 104 2 rr_1f79 1
23 "constraints for residue 8 to 9 from expt" 109 2 109 2 rr_1f79 1
24 overl. 114 68 114 68 rr_1f79 1
25 overl. 115 68 115 68 rr_1f79 1
26 "constraints for residue 9 from expt" 118 2 118 2 rr_1f79 1
27 "constraints for residue 9 to 10 from expt" 122 2 122 2 rr_1f79 1
28 "constraints for residue 10 from expt" 130 2 130 2 rr_1f79 1
29 "constraints for residue 10 to 11 from expt" 134 2 134 2 rr_1f79 1
30 "~= H2'" 140 70 140 70 rr_1f79 1
31 "constraints for residue 11 from expt" 144 2 144 2 rr_1f79 1
32 "constraints for residue 11 to 12 from expt" 149 2 149 2 rr_1f79 1
33 "constraints for residue 12 from expt" 160 2 160 2 rr_1f79 1
34 "constraints for residue 12 to 13 from expt" 164 2 164 2 rr_1f79 1
35 "constraints for residue 13 from expt" 174 2 174 2 rr_1f79 1
36 "constraints for residue 13 to 14 from expt" 178 2 178 2 rr_1f79 1
37 "constraints for residue 13 to 15 from expt" 184 2 184 2 rr_1f79 1
38 "constraints for residue 14 from expt" 191 2 191 2 rr_1f79 1
39 "constraints for residue 14 to 15 from expt" 195 2 195 2 rr_1f79 1
40 "constraints for residue 15 from expt" 206 2 206 2 rr_1f79 1
41 "constraints for residue 15 to 16 from expt" 212 2 212 2 rr_1f79 1
42 "constraints for residue 16 from expt - syn" 217 2 217 2 rr_1f79 1
43 "constraints for residue 16 to 17 from expt" 221 2 221 2 rr_1f79 1
44 "constraints for residue 17 from expt" 226 2 226 2 rr_1f79 1
45 "constraints for residue 17 to 18 from expt" 230 2 230 2 rr_1f79 1
46 "constraints for residue 18 from expt" 236 2 236 2 rr_1f79 1
47 "constraints for residue 18 to 19 from expt" 241 2 241 2 rr_1f79 1
48 "constraints for residue 18 to 12 from expt" 254 2 254 2 rr_1f79 1
49 "constraints for residue 19 from expt" 257 2 257 2 rr_1f79 1
50 "constraints for residue 19 to 20 from expt" 262 2 262 2 rr_1f79 1
51 "constraints for residue 20 from expt" 276 2 276 2 rr_1f79 1
52 "constraints for residue 20 to 21 from expt" 281 2 281 2 rr_1f79 1
53 "constraints for residue 21 from expt" 289 2 289 2 rr_1f79 1
54 "constraints for residue 21 to 22 from expt" 293 2 293 2 rr_1f79 1
55 "constraints for residue 22 from expt" 301 2 301 2 rr_1f79 1
56 "constraints for residue 22 to 23 from expt" 306 2 306 2 rr_1f79 1
57 "constraints for residue 23 from expt" 317 2 317 2 rr_1f79 1
58 "constraints for residue 23 to 24 from expt" 322 2 322 2 rr_1f79 1
59 overl. 328 70 328 70 rr_1f79 1
60 "constraints for residue 24 from expt" 334 2 334 2 rr_1f79 1
61 "constraints for residue 24 to 25 from expt" 339 2 339 2 rr_1f79 1
62 "~= 2'" 345 70 345 70 rr_1f79 1
63 "constraints for residue 25 from expt" 351 2 351 2 rr_1f79 1
64 "constraints for residue 25 to 26 from expt" 356 2 356 2 rr_1f79 1
65 "constraints for residue 26 from expt" 367 2 367 2 rr_1f79 1
66 "constraints for residue 26 to 27 from expt" 371 2 371 2 rr_1f79 1
67 "constraints for residue 27 from expt" 382 2 382 2 rr_1f79 1
68 "end of experimental constraints; 65 intra, 172 inter, 237 total" 387 2 387 2 rr_1f79 1
69 "constraints for Cohex from H2O-NOESY 300 ms" 389 2 389 2 rr_1f79 1
70 imino 390 2 390 2 rr_1f79 1
71 aromatic 398 2 398 2 rr_1f79 1
stop_
save_
save_CNS/XPLOR_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_2_1
_Distance_constraint_list.Entry_ID rr_1f79
_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_1f79 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_1f79 2
2 1 . . . rr_1f79 2
3 1 . . . rr_1f79 2
4 1 . . . rr_1f79 2
5 1 . . . rr_1f79 2
6 1 . . . rr_1f79 2
7 1 . . . rr_1f79 2
8 1 . . . rr_1f79 2
9 1 . . . rr_1f79 2
10 1 . . . rr_1f79 2
11 1 . . . rr_1f79 2
12 1 . . . rr_1f79 2
13 1 . . . rr_1f79 2
14 1 . . . rr_1f79 2
15 1 . . . rr_1f79 2
16 1 . . . rr_1f79 2
17 1 . . . rr_1f79 2
18 1 . . . rr_1f79 2
19 1 . . . rr_1f79 2
20 1 . . . rr_1f79 2
21 1 . . . rr_1f79 2
22 1 . . . rr_1f79 2
23 1 . . . rr_1f79 2
24 1 . . . rr_1f79 2
25 1 . . . rr_1f79 2
26 1 . . . rr_1f79 2
27 1 . . . rr_1f79 2
28 1 . . . rr_1f79 2
29 1 . . . rr_1f79 2
30 1 . . . rr_1f79 2
31 1 . . . rr_1f79 2
32 1 . . . rr_1f79 2
33 1 . . . rr_1f79 2
34 1 . . . rr_1f79 2
35 1 . . . rr_1f79 2
36 1 . . . rr_1f79 2
37 1 . . . rr_1f79 2
38 1 . . . rr_1f79 2
39 1 . . . rr_1f79 2
40 1 . . . rr_1f79 2
41 1 . . . rr_1f79 2
42 1 . . . rr_1f79 2
43 1 . . . rr_1f79 2
44 1 . . . rr_1f79 2
45 1 . . . rr_1f79 2
46 1 . . . rr_1f79 2
47 1 . . . rr_1f79 2
48 1 . . . rr_1f79 2
49 1 . . . rr_1f79 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 27 27 C H41 H . . . . 27 . H41 rr_1f79 2
1 1 . 2 . 1 1 1 1 G O6 O . . . . 1 . O6 rr_1f79 2
2 1 . 1 . 1 1 27 27 C N3 N . . . . 27 . N3 rr_1f79 2
2 1 . 2 . 1 1 1 1 G H21 H . . . . 1 . H21 rr_1f79 2
3 1 . 1 . 1 1 27 27 C O2 O . . . . 27 . O2 rr_1f79 2
3 1 . 2 . 1 1 1 1 G H21 H . . . . 1 . H21 rr_1f79 2
4 1 . 1 . 1 1 27 27 C N3 N . . . . 27 . N3 rr_1f79 2
4 1 . 2 . 1 1 1 1 G H1 H . . . . 1 . H1 rr_1f79 2
5 1 . 1 . 1 1 26 26 C H41 H . . . . 26 . H41 rr_1f79 2
5 1 . 2 . 1 1 2 2 G O6 O . . . . 2 . O6 rr_1f79 2
6 1 . 1 . 1 1 26 26 C N3 N . . . . 26 . N3 rr_1f79 2
6 1 . 2 . 1 1 2 2 G H21 H . . . . 2 . H21 rr_1f79 2
7 1 . 1 . 1 1 26 26 C O2 O . . . . 26 . O2 rr_1f79 2
7 1 . 2 . 1 1 2 2 G H21 H . . . . 2 . H21 rr_1f79 2
8 1 . 1 . 1 1 26 26 C N3 N . . . . 26 . N3 rr_1f79 2
8 1 . 2 . 1 1 2 2 G H1 H . . . . 2 . H1 rr_1f79 2
9 1 . 1 . 1 1 3 3 A H2 H . . . . 3 . H2 rr_1f79 2
9 1 . 2 . 1 1 25 25 U O2 O . . . . 25 . O2 rr_1f79 2
10 1 . 1 . 1 1 3 3 A N1 N . . . . 3 . N1 rr_1f79 2
10 1 . 2 . 1 1 25 25 U H3 H . . . . 25 . H3 rr_1f79 2
11 1 . 1 . 1 1 3 3 A H61 H . . . . 3 . H61 rr_1f79 2
11 1 . 2 . 1 1 25 25 U O4 O . . . . 25 . O4 rr_1f79 2
12 1 . 1 . 1 1 3 3 A H2 H . . . . 3 . H2 rr_1f79 2
12 1 . 2 . 1 1 25 25 U H3 H . . . . 25 . H3 rr_1f79 2
13 1 . 1 . 1 1 4 4 A H2 H . . . . 4 . H2 rr_1f79 2
13 1 . 2 . 1 1 24 24 U O2 O . . . . 24 . O2 rr_1f79 2
14 1 . 1 . 1 1 4 4 A N1 N . . . . 4 . N1 rr_1f79 2
14 1 . 2 . 1 1 24 24 U H3 H . . . . 24 . H3 rr_1f79 2
15 1 . 1 . 1 1 4 4 A H61 H . . . . 4 . H61 rr_1f79 2
15 1 . 2 . 1 1 24 24 U O4 O . . . . 24 . O4 rr_1f79 2
16 1 . 1 . 1 1 4 4 A H2 H . . . . 4 . H2 rr_1f79 2
16 1 . 2 . 1 1 24 24 U H3 H . . . . 24 . H3 rr_1f79 2
17 1 . 1 . 1 1 23 23 C H41 H . . . . 23 . H41 rr_1f79 2
17 1 . 2 . 1 1 5 5 G O6 O . . . . 5 . O6 rr_1f79 2
18 1 . 1 . 1 1 23 23 C N3 N . . . . 23 . N3 rr_1f79 2
18 1 . 2 . 1 1 5 5 G H21 H . . . . 5 . H21 rr_1f79 2
19 1 . 1 . 1 1 23 23 C O2 O . . . . 23 . O2 rr_1f79 2
19 1 . 2 . 1 1 5 5 G H21 H . . . . 5 . H21 rr_1f79 2
20 1 . 1 . 1 1 23 23 C N3 N . . . . 23 . N3 rr_1f79 2
20 1 . 2 . 1 1 5 5 G H1 H . . . . 5 . H1 rr_1f79 2
21 1 . 1 . 1 1 22 22 G H1 H . . . . 22 . H1 rr_1f79 2
21 1 . 2 . 1 1 6 6 U O2 O . . . . 6 . O2 rr_1f79 2
22 1 . 1 . 1 1 22 22 G H1 H . . . . 22 . H1 rr_1f79 2
22 1 . 2 . 1 1 6 6 U H3 H . . . . 6 . H3 rr_1f79 2
23 1 . 1 . 1 1 22 22 G O6 O . . . . 22 . O6 rr_1f79 2
23 1 . 2 . 1 1 6 6 U H3 H . . . . 6 . H3 rr_1f79 2
24 1 . 1 . 1 1 22 22 G O6 O . . . . 22 . O6 rr_1f79 2
24 1 . 2 . 1 1 6 6 U O2 O . . . . 6 . O2 rr_1f79 2
25 1 . 1 . 1 1 22 22 G N1 N . . . . 22 . N1 rr_1f79 2
25 1 . 2 . 1 1 6 6 U N3 N . . . . 6 . N3 rr_1f79 2
26 1 . 1 . 1 1 8 8 C H41 H . . . . 8 . H41 rr_1f79 2
26 1 . 2 . 1 1 21 21 G O6 O . . . . 21 . O6 rr_1f79 2
27 1 . 1 . 1 1 8 8 C N3 N . . . . 8 . N3 rr_1f79 2
27 1 . 2 . 1 1 21 21 G H21 H . . . . 21 . H21 rr_1f79 2
28 1 . 1 . 1 1 8 8 C O2 O . . . . 8 . O2 rr_1f79 2
28 1 . 2 . 1 1 21 21 G H21 H . . . . 21 . H21 rr_1f79 2
29 1 . 1 . 1 1 8 8 C N3 N . . . . 8 . N3 rr_1f79 2
29 1 . 2 . 1 1 21 21 G H1 H . . . . 21 . H1 rr_1f79 2
30 1 . 1 . 1 1 20 20 C H41 H . . . . 20 . H41 rr_1f79 2
30 1 . 2 . 1 1 9 9 G O6 O . . . . 9 . O6 rr_1f79 2
31 1 . 1 . 1 1 20 20 C N3 N . . . . 20 . N3 rr_1f79 2
31 1 . 2 . 1 1 9 9 G H21 H . . . . 9 . H21 rr_1f79 2
32 1 . 1 . 1 1 20 20 C O2 O . . . . 20 . O2 rr_1f79 2
32 1 . 2 . 1 1 9 9 G H21 H . . . . 9 . H21 rr_1f79 2
33 1 . 1 . 1 1 20 20 C N3 N . . . . 20 . N3 rr_1f79 2
33 1 . 2 . 1 1 9 9 G H1 H . . . . 9 . H1 rr_1f79 2
34 1 . 1 . 1 1 19 19 C H41 H . . . . 19 . H41 rr_1f79 2
34 1 . 2 . 1 1 10 10 G O6 O . . . . 10 . O6 rr_1f79 2
35 1 . 1 . 1 1 19 19 C N3 N . . . . 19 . N3 rr_1f79 2
35 1 . 2 . 1 1 10 10 G H21 H . . . . 10 . H21 rr_1f79 2
36 1 . 1 . 1 1 19 19 C O2 O . . . . 19 . O2 rr_1f79 2
36 1 . 2 . 1 1 10 10 G H21 H . . . . 10 . H21 rr_1f79 2
37 1 . 1 . 1 1 19 19 C N3 N . . . . 19 . N3 rr_1f79 2
37 1 . 2 . 1 1 10 10 G H1 H . . . . 10 . H1 rr_1f79 2
38 1 . 1 . 1 1 18 18 A H2 H . . . . 18 . H2 rr_1f79 2
38 1 . 2 . 1 1 11 11 U O2 O . . . . 11 . O2 rr_1f79 2
39 1 . 1 . 1 1 18 18 A N1 N . . . . 18 . N1 rr_1f79 2
39 1 . 2 . 1 1 11 11 U H3 H . . . . 11 . H3 rr_1f79 2
40 1 . 1 . 1 1 18 18 A H61 H . . . . 18 . H61 rr_1f79 2
40 1 . 2 . 1 1 11 11 U O4 O . . . . 11 . O4 rr_1f79 2
41 1 . 1 . 1 1 18 18 A H2 H . . . . 18 . H2 rr_1f79 2
41 1 . 2 . 1 1 11 11 U H3 H . . . . 11 . H3 rr_1f79 2
42 1 . 1 . 1 1 12 12 C H41 H . . . . 12 . H41 rr_1f79 2
42 1 . 2 . 1 1 17 17 G O6 O . . . . 17 . O6 rr_1f79 2
43 1 . 1 . 1 1 12 12 C N3 N . . . . 12 . N3 rr_1f79 2
43 1 . 2 . 1 1 17 17 G H21 H . . . . 17 . H21 rr_1f79 2
44 1 . 1 . 1 1 12 12 C O2 O . . . . 12 . O2 rr_1f79 2
44 1 . 2 . 1 1 17 17 G H21 H . . . . 17 . H21 rr_1f79 2
45 1 . 1 . 1 1 12 12 C N3 N . . . . 12 . N3 rr_1f79 2
45 1 . 2 . 1 1 17 17 G H1 H . . . . 17 . H1 rr_1f79 2
46 1 . 1 . 1 1 13 13 U O2 O . . . . 13 . O2 rr_1f79 2
46 1 . 2 . 1 1 16 16 G H1 H . . . . 16 . H1 rr_1f79 2
47 1 . 1 . 1 1 13 13 U O2 O . . . . 13 . O2 rr_1f79 2
47 1 . 2 . 1 1 16 16 G H21 H . . . . 16 . H21 rr_1f79 2
48 1 . 1 . 1 1 13 13 U H3 H . . . . 13 . H3 rr_1f79 2
48 1 . 2 . 1 1 16 16 G H21 H . . . . 16 . H21 rr_1f79 2
49 1 . 1 . 1 1 13 13 U H3 H . . . . 13 . H3 rr_1f79 2
49 1 . 2 . 1 1 16 16 G H1 H . . . . 16 . H1 rr_1f79 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Spectral_peak_list_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . 1.7 1.6 1.8 rr_1f79 2
2 1 . . . . . . 3.0 2.9 3.1 rr_1f79 2
3 1 . . . . . . 2.0 1.9 2.1 rr_1f79 2
4 1 . . . . . . 1.9 1.8 2.0 rr_1f79 2
5 1 . . . . . . 1.7 1.6 1.8 rr_1f79 2
6 1 . . . . . . 3.0 2.9 3.1 rr_1f79 2
7 1 . . . . . . 2.0 1.9 2.1 rr_1f79 2
8 1 . . . . . . 1.9 1.8 2.0 rr_1f79 2
9 1 . . . . . . 3.2 3.1 3.3 rr_1f79 2
10 1 . . . . . . 1.9 1.8 2.0 rr_1f79 2
11 1 . . . . . . 1.8 1.7 1.9 rr_1f79 2
12 1 . . . . . . 2.9 2.8 3.0 rr_1f79 2
13 1 . . . . . . 3.2 3.1 3.3 rr_1f79 2
14 1 . . . . . . 1.9 1.8 2.0 rr_1f79 2
15 1 . . . . . . 1.8 1.7 1.9 rr_1f79 2
16 1 . . . . . . 2.9 2.8 3.0 rr_1f79 2
17 1 . . . . . . 1.7 1.6 1.8 rr_1f79 2
18 1 . . . . . . 3.0 2.9 3.1 rr_1f79 2
19 1 . . . . . . 2.0 1.9 2.1 rr_1f79 2
20 1 . . . . . . 1.9 1.8 2.0 rr_1f79 2
21 1 . . . . . . 1.8 1.7 1.9 rr_1f79 2
22 1 . . . . . . 2.6 2.5 2.7 rr_1f79 2
23 1 . . . . . . 1.9 1.8 2.0 rr_1f79 2
24 1 . . . . . . 3.7 3.6 3.8 rr_1f79 2
25 1 . . . . . . 3.7 3.6 3.8 rr_1f79 2
26 1 . . . . . . 1.7 1.6 1.8 rr_1f79 2
27 1 . . . . . . 3.0 2.9 3.1 rr_1f79 2
28 1 . . . . . . 2.0 1.9 2.1 rr_1f79 2
29 1 . . . . . . 1.9 1.8 2.0 rr_1f79 2
30 1 . . . . . . 1.7 1.6 1.8 rr_1f79 2
31 1 . . . . . . 3.0 2.9 3.1 rr_1f79 2
32 1 . . . . . . 2.0 1.9 2.1 rr_1f79 2
33 1 . . . . . . 1.9 1.8 2.0 rr_1f79 2
34 1 . . . . . . 1.7 1.6 1.8 rr_1f79 2
35 1 . . . . . . 3.0 2.9 3.1 rr_1f79 2
36 1 . . . . . . 2.0 1.9 2.1 rr_1f79 2
37 1 . . . . . . 1.9 1.8 2.0 rr_1f79 2
38 1 . . . . . . 3.2 3.1 3.3 rr_1f79 2
39 1 . . . . . . 1.9 1.8 2.0 rr_1f79 2
40 1 . . . . . . 1.8 1.7 1.9 rr_1f79 2
41 1 . . . . . . 2.9 2.8 3.0 rr_1f79 2
42 1 . . . . . . 1.7 1.6 1.8 rr_1f79 2
43 1 . . . . . . 3.0 2.9 3.1 rr_1f79 2
44 1 . . . . . . 2.0 1.9 2.1 rr_1f79 2
45 1 . . . . . . 1.9 1.8 2.0 rr_1f79 2
46 1 . . . . . . 1.9 1.7 2.1 rr_1f79 2
47 1 . . . . . . 2.4 2.2 2.6 rr_1f79 2
48 1 . . . . . . 3.8 3.6 4.0 rr_1f79 2
49 1 . . . . . . 4.4 4.2 4.6 rr_1f79 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 "base pairing between 1 and 27 GC pair" 1 2 1 2 rr_1f79 2
2 "base pairing between 2 and 26 GC pair" 7 2 7 2 rr_1f79 2
3 "base pairing between 3 and 25 AU pair" 13 2 13 2 rr_1f79 2
4 "base pairing between 4 and 24 AU pair" 19 2 19 2 rr_1f79 2
5 "base pairing between 5 and 24 GC pair" 25 2 25 2 rr_1f79 2
6 "base pairing between 6 and 22 UG pair - standard wobble" 31 2 31 2 rr_1f79 2
7 "base 7: unpaired" 38 2 38 2 rr_1f79 2
8 "base pairing between 8 and 21 CG pair" 40 2 40 2 rr_1f79 2
9 "base pairing between 9 and 20 GC pair" 46 2 46 2 rr_1f79 2
10 "base pairing between 10 and 19 GC pair" 52 2 52 2 rr_1f79 2
11 "base pairing between 11 and 18 AU pair" 58 2 58 2 rr_1f79 2
12 "base pairing between 12 and 17 CG pair" 64 2 64 2 rr_1f79 2
13 "base 13-16: UUCG tetraloop, fill in from literature ..." 70 2 70 2 rr_1f79 2
stop_
save_
save_CNS/XPLOR_dihedral_8
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_8
_Torsion_angle_constraint_list.Entry_ID rr_1f79
_Torsion_angle_constraint_list.ID 2
_Torsion_angle_constraint_list.Details "Generated by Wattos"
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 8
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_1f79 1
stop_
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Atom_type_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Atom_type_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Atom_type_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Atom_type_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.PDB_record_ID_1
_Torsion_angle_constraint.PDB_model_num_1
_Torsion_angle_constraint.PDB_strand_ID_1
_Torsion_angle_constraint.PDB_ins_code_1
_Torsion_angle_constraint.PDB_residue_no_1
_Torsion_angle_constraint.PDB_residue_name_1
_Torsion_angle_constraint.PDB_atom_name_1
_Torsion_angle_constraint.PDB_record_ID_2
_Torsion_angle_constraint.PDB_model_num_2
_Torsion_angle_constraint.PDB_strand_ID_2
_Torsion_angle_constraint.PDB_ins_code_2
_Torsion_angle_constraint.PDB_residue_no_2
_Torsion_angle_constraint.PDB_residue_name_2
_Torsion_angle_constraint.PDB_atom_name_2
_Torsion_angle_constraint.PDB_record_ID_3
_Torsion_angle_constraint.PDB_model_num_3
_Torsion_angle_constraint.PDB_strand_ID_3
_Torsion_angle_constraint.PDB_ins_code_3
_Torsion_angle_constraint.PDB_residue_no_3
_Torsion_angle_constraint.PDB_residue_name_3
_Torsion_angle_constraint.PDB_atom_name_3
_Torsion_angle_constraint.PDB_record_ID_4
_Torsion_angle_constraint.PDB_model_num_4
_Torsion_angle_constraint.PDB_strand_ID_4
_Torsion_angle_constraint.PDB_ins_code_4
_Torsion_angle_constraint.PDB_residue_no_4
_Torsion_angle_constraint.PDB_residue_name_4
_Torsion_angle_constraint.PDB_atom_name_4
_Torsion_angle_constraint.Auth_entity_assembly_ID_1
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_chain_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_alt_ID_1
_Torsion_angle_constraint.Auth_atom_name_1
_Torsion_angle_constraint.Auth_entity_assembly_ID_2
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_chain_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_alt_ID_2
_Torsion_angle_constraint.Auth_atom_name_2
_Torsion_angle_constraint.Auth_entity_assembly_ID_3
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_chain_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_alt_ID_3
_Torsion_angle_constraint.Auth_atom_name_3
_Torsion_angle_constraint.Auth_entity_assembly_ID_4
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_chain_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Auth_alt_ID_4
_Torsion_angle_constraint.Auth_atom_name_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . 1 1 1 1 G C4' C . . 1 1 1 1 G O4' O . . 1 1 1 1 G C1' C . . 1 1 1 1 G C2' C . -5.0 5.0 . . . A . 1 G C4' . . A . 1 G O4' . . A . 1 G C1' . . A . 1 G C2' . . . 1 . C4' . . . . . 1 . O4' . . . . . 1 . C1' . . . . . 1 . C2' . . rr_1f79 1
2 . . 1 1 1 1 G O4' O . . 1 1 1 1 G C1' C . . 1 1 1 1 G C2' C . . 1 1 1 1 G C3' C . -27.0 -17.0 . . . A . 1 G O4' . . A . 1 G C1' . . A . 1 G C2' . . A . 1 G C3' . . . 1 . O4' . . . . . 1 . C1' . . . . . 1 . C2' . . . . . 1 . C3' . . rr_1f79 1
3 . . 1 1 1 1 G C1' C . . 1 1 1 1 G C2' C . . 1 1 1 1 G C3' C . . 1 1 1 1 G C4' C . 31.0 41.0 . . . A . 1 G C1' . . A . 1 G C2' . . A . 1 G C3' . . A . 1 G C4' . . . 1 . C1' . . . . . 1 . C2' . . . . . 1 . C3' . . . . . 1 . C4' . . rr_1f79 1
4 . . 1 1 1 1 G C2' C . . 1 1 1 1 G C3' C . . 1 1 1 1 G C4' C . . 1 1 1 1 G O4' O . -41.0 -31.0 . . . A . 1 G C2' . . A . 1 G C3' . . A . 1 G C4' . . A . 1 G O4' . . . 1 . C2' . . . . . 1 . C3' . . . . . 1 . C4' . . . . . 1 . O4' . . rr_1f79 1
5 . . 1 1 2 2 G C4' C . . 1 1 2 2 G O4' O . . 1 1 2 2 G C1' C . . 1 1 2 2 G C2' C . -5.0 5.0 . . . A . 2 G C4' . . A . 2 G O4' . . A . 2 G C1' . . A . 2 G C2' . . . 2 . C4' . . . . . 2 . O4' . . . . . 2 . C1' . . . . . 2 . C2' . . rr_1f79 1
6 . . 1 1 2 2 G O4' O . . 1 1 2 2 G C1' C . . 1 1 2 2 G C2' C . . 1 1 2 2 G C3' C . -27.0 -17.0 . . . A . 2 G O4' . . A . 2 G C1' . . A . 2 G C2' . . A . 2 G C3' . . . 2 . O4' . . . . . 2 . C1' . . . . . 2 . C2' . . . . . 2 . C3' . . rr_1f79 1
7 . . 1 1 2 2 G C1' C . . 1 1 2 2 G C2' C . . 1 1 2 2 G C3' C . . 1 1 2 2 G C4' C . 31.0 41.0 . . . A . 2 G C1' . . A . 2 G C2' . . A . 2 G C3' . . A . 2 G C4' . . . 2 . C1' . . . . . 2 . C2' . . . . . 2 . C3' . . . . . 2 . C4' . . rr_1f79 1
8 . . 1 1 2 2 G C2' C . . 1 1 2 2 G C3' C . . 1 1 2 2 G C4' C . . 1 1 2 2 G O4' O . -41.0 -31.0 . . . A . 2 G C2' . . A . 2 G C3' . . A . 2 G C4' . . A . 2 G O4' . . . 2 . C2' . . . . . 2 . C3' . . . . . 2 . C4' . . . . . 2 . O4' . . rr_1f79 1
9 . . 1 1 3 3 A C4' C . . 1 1 3 3 A O4' O . . 1 1 3 3 A C1' C . . 1 1 3 3 A C2' C . -5.0 5.0 . . . A . 3 A C4' . . A . 3 A O4' . . A . 3 A C1' . . A . 3 A C2' . . . 3 . C4' . . . . . 3 . O4' . . . . . 3 . C1' . . . . . 3 . C2' . . rr_1f79 1
10 . . 1 1 3 3 A O4' O . . 1 1 3 3 A C1' C . . 1 1 3 3 A C2' C . . 1 1 3 3 A C3' C . -27.0 -17.0 . . . A . 3 A O4' . . A . 3 A C1' . . A . 3 A C2' . . A . 3 A C3' . . . 3 . O4' . . . . . 3 . C1' . . . . . 3 . C2' . . . . . 3 . C3' . . rr_1f79 1
11 . . 1 1 3 3 A C1' C . . 1 1 3 3 A C2' C . . 1 1 3 3 A C3' C . . 1 1 3 3 A C4' C . 31.0 41.0 . . . A . 3 A C1' . . A . 3 A C2' . . A . 3 A C3' . . A . 3 A C4' . . . 3 . C1' . . . . . 3 . C2' . . . . . 3 . C3' . . . . . 3 . C4' . . rr_1f79 1
12 . . 1 1 3 3 A C2' C . . 1 1 3 3 A C3' C . . 1 1 3 3 A C4' C . . 1 1 3 3 A O4' O . -41.0 -31.0 . . . A . 3 A C2' . . A . 3 A C3' . . A . 3 A C4' . . A . 3 A O4' . . . 3 . C2' . . . . . 3 . C3' . . . . . 3 . C4' . . . . . 3 . O4' . . rr_1f79 1
13 . . 1 1 4 4 A C4' C . . 1 1 4 4 A O4' O . . 1 1 4 4 A C1' C . . 1 1 4 4 A C2' C . -5.0 5.0 . . . A . 4 A C4' . . A . 4 A O4' . . A . 4 A C1' . . A . 4 A C2' . . . 4 . C4' . . . . . 4 . O4' . . . . . 4 . C1' . . . . . 4 . C2' . . rr_1f79 1
14 . . 1 1 4 4 A O4' O . . 1 1 4 4 A C1' C . . 1 1 4 4 A C2' C . . 1 1 4 4 A C3' C . -27.0 -17.0 . . . A . 4 A O4' . . A . 4 A C1' . . A . 4 A C2' . . A . 4 A C3' . . . 4 . O4' . . . . . 4 . C1' . . . . . 4 . C2' . . . . . 4 . C3' . . rr_1f79 1
15 . . 1 1 4 4 A C1' C . . 1 1 4 4 A C2' C . . 1 1 4 4 A C3' C . . 1 1 4 4 A C4' C . 31.0 41.0 . . . A . 4 A C1' . . A . 4 A C2' . . A . 4 A C3' . . A . 4 A C4' . . . 4 . C1' . . . . . 4 . C2' . . . . . 4 . C3' . . . . . 4 . C4' . . rr_1f79 1
16 . . 1 1 4 4 A C2' C . . 1 1 4 4 A C3' C . . 1 1 4 4 A C4' C . . 1 1 4 4 A O4' O . -41.0 -31.0 . . . A . 4 A C2' . . A . 4 A C3' . . A . 4 A C4' . . A . 4 A O4' . . . 4 . C2' . . . . . 4 . C3' . . . . . 4 . C4' . . . . . 4 . O4' . . rr_1f79 1
17 . . 1 1 5 5 G C4' C . . 1 1 5 5 G O4' O . . 1 1 5 5 G C1' C . . 1 1 5 5 G C2' C . -5.0 5.0 . . . A . 5 G C4' . . A . 5 G O4' . . A . 5 G C1' . . A . 5 G C2' . . . 5 . C4' . . . . . 5 . O4' . . . . . 5 . C1' . . . . . 5 . C2' . . rr_1f79 1
18 . . 1 1 5 5 G O4' O . . 1 1 5 5 G C1' C . . 1 1 5 5 G C2' C . . 1 1 5 5 G C3' C . -27.0 -17.0 . . . A . 5 G O4' . . A . 5 G C1' . . A . 5 G C2' . . A . 5 G C3' . . . 5 . O4' . . . . . 5 . C1' . . . . . 5 . C2' . . . . . 5 . C3' . . rr_1f79 1
19 . . 1 1 5 5 G C1' C . . 1 1 5 5 G C2' C . . 1 1 5 5 G C3' C . . 1 1 5 5 G C4' C . 31.0 41.0 . . . A . 5 G C1' . . A . 5 G C2' . . A . 5 G C3' . . A . 5 G C4' . . . 5 . C1' . . . . . 5 . C2' . . . . . 5 . C3' . . . . . 5 . C4' . . rr_1f79 1
20 . . 1 1 5 5 G C2' C . . 1 1 5 5 G C3' C . . 1 1 5 5 G C4' C . . 1 1 5 5 G O4' O . -41.0 -31.0 . . . A . 5 G C2' . . A . 5 G C3' . . A . 5 G C4' . . A . 5 G O4' . . . 5 . C2' . . . . . 5 . C3' . . . . . 5 . C4' . . . . . 5 . O4' . . rr_1f79 1
21 . . 1 1 8 8 C C4' C . . 1 1 8 8 C O4' O . . 1 1 8 8 C C1' C . . 1 1 8 8 C C2' C . -5.0 5.0 . . . A . 8 C C4' . . A . 8 C O4' . . A . 8 C C1' . . A . 8 C C2' . . . 8 . C4' . . . . . 8 . O4' . . . . . 8 . C1' . . . . . 8 . C2' . . rr_1f79 1
22 . . 1 1 8 8 C O4' O . . 1 1 8 8 C C1' C . . 1 1 8 8 C C2' C . . 1 1 8 8 C C3' C . -27.0 -17.0 . . . A . 8 C O4' . . A . 8 C C1' . . A . 8 C C2' . . A . 8 C C3' . . . 8 . O4' . . . . . 8 . C1' . . . . . 8 . C2' . . . . . 8 . C3' . . rr_1f79 1
23 . . 1 1 8 8 C C1' C . . 1 1 8 8 C C2' C . . 1 1 8 8 C C3' C . . 1 1 8 8 C C4' C . 31.0 41.0 . . . A . 8 C C1' . . A . 8 C C2' . . A . 8 C C3' . . A . 8 C C4' . . . 8 . C1' . . . . . 8 . C2' . . . . . 8 . C3' . . . . . 8 . C4' . . rr_1f79 1
24 . . 1 1 8 8 C C2' C . . 1 1 8 8 C C3' C . . 1 1 8 8 C C4' C . . 1 1 8 8 C O4' O . -41.0 -31.0 . . . A . 8 C C2' . . A . 8 C C3' . . A . 8 C C4' . . A . 8 C O4' . . . 8 . C2' . . . . . 8 . C3' . . . . . 8 . C4' . . . . . 8 . O4' . . rr_1f79 1
25 . . 1 1 9 9 G C4' C . . 1 1 9 9 G O4' O . . 1 1 9 9 G C1' C . . 1 1 9 9 G C2' C . -5.0 5.0 . . . A . 9 G C4' . . A . 9 G O4' . . A . 9 G C1' . . A . 9 G C2' . . . 9 . C4' . . . . . 9 . O4' . . . . . 9 . C1' . . . . . 9 . C2' . . rr_1f79 1
26 . . 1 1 9 9 G O4' O . . 1 1 9 9 G C1' C . . 1 1 9 9 G C2' C . . 1 1 9 9 G C3' C . -27.0 -17.0 . . . A . 9 G O4' . . A . 9 G C1' . . A . 9 G C2' . . A . 9 G C3' . . . 9 . O4' . . . . . 9 . C1' . . . . . 9 . C2' . . . . . 9 . C3' . . rr_1f79 1
27 . . 1 1 9 9 G C1' C . . 1 1 9 9 G C2' C . . 1 1 9 9 G C3' C . . 1 1 9 9 G C4' C . 31.0 41.0 . . . A . 9 G C1' . . A . 9 G C2' . . A . 9 G C3' . . A . 9 G C4' . . . 9 . C1' . . . . . 9 . C2' . . . . . 9 . C3' . . . . . 9 . C4' . . rr_1f79 1
28 . . 1 1 9 9 G C2' C . . 1 1 9 9 G C3' C . . 1 1 9 9 G C4' C . . 1 1 9 9 G O4' O . -41.0 -31.0 . . . A . 9 G C2' . . A . 9 G C3' . . A . 9 G C4' . . A . 9 G O4' . . . 9 . C2' . . . . . 9 . C3' . . . . . 9 . C4' . . . . . 9 . O4' . . rr_1f79 1
29 . . 1 1 10 10 G C4' C . . 1 1 10 10 G O4' O . . 1 1 10 10 G C1' C . . 1 1 10 10 G C2' C . -5.0 5.0 . . . A . 10 G C4' . . A . 10 G O4' . . A . 10 G C1' . . A . 10 G C2' . . . 10 . C4' . . . . . 10 . O4' . . . . . 10 . C1' . . . . . 10 . C2' . . rr_1f79 1
30 . . 1 1 10 10 G O4' O . . 1 1 10 10 G C1' C . . 1 1 10 10 G C2' C . . 1 1 10 10 G C3' C . -27.0 -17.0 . . . A . 10 G O4' . . A . 10 G C1' . . A . 10 G C2' . . A . 10 G C3' . . . 10 . O4' . . . . . 10 . C1' . . . . . 10 . C2' . . . . . 10 . C3' . . rr_1f79 1
31 . . 1 1 10 10 G C1' C . . 1 1 10 10 G C2' C . . 1 1 10 10 G C3' C . . 1 1 10 10 G C4' C . 31.0 41.0 . . . A . 10 G C1' . . A . 10 G C2' . . A . 10 G C3' . . A . 10 G C4' . . . 10 . C1' . . . . . 10 . C2' . . . . . 10 . C3' . . . . . 10 . C4' . . rr_1f79 1
32 . . 1 1 10 10 G C2' C . . 1 1 10 10 G C3' C . . 1 1 10 10 G C4' C . . 1 1 10 10 G O4' O . -41.0 -31.0 . . . A . 10 G C2' . . A . 10 G C3' . . A . 10 G C4' . . A . 10 G O4' . . . 10 . C2' . . . . . 10 . C3' . . . . . 10 . C4' . . . . . 10 . O4' . . rr_1f79 1
33 . . 1 1 11 11 U C4' C . . 1 1 11 11 U O4' O . . 1 1 11 11 U C1' C . . 1 1 11 11 U C2' C . -5.0 5.0 . . . A . 11 U C4' . . A . 11 U O4' . . A . 11 U C1' . . A . 11 U C2' . . . 11 . C4' . . . . . 11 . O4' . . . . . 11 . C1' . . . . . 11 . C2' . . rr_1f79 1
34 . . 1 1 11 11 U O4' O . . 1 1 11 11 U C1' C . . 1 1 11 11 U C2' C . . 1 1 11 11 U C3' C . -27.0 -17.0 . . . A . 11 U O4' . . A . 11 U C1' . . A . 11 U C2' . . A . 11 U C3' . . . 11 . O4' . . . . . 11 . C1' . . . . . 11 . C2' . . . . . 11 . C3' . . rr_1f79 1
35 . . 1 1 11 11 U C1' C . . 1 1 11 11 U C2' C . . 1 1 11 11 U C3' C . . 1 1 11 11 U C4' C . 31.0 41.0 . . . A . 11 U C1' . . A . 11 U C2' . . A . 11 U C3' . . A . 11 U C4' . . . 11 . C1' . . . . . 11 . C2' . . . . . 11 . C3' . . . . . 11 . C4' . . rr_1f79 1
36 . . 1 1 11 11 U C2' C . . 1 1 11 11 U C3' C . . 1 1 11 11 U C4' C . . 1 1 11 11 U O4' O . -41.0 -31.0 . . . A . 11 U C2' . . A . 11 U C3' . . A . 11 U C4' . . A . 11 U O4' . . . 11 . C2' . . . . . 11 . C3' . . . . . 11 . C4' . . . . . 11 . O4' . . rr_1f79 1
37 . . 1 1 12 12 C C4' C . . 1 1 12 12 C O4' O . . 1 1 12 12 C C1' C . . 1 1 12 12 C C2' C . -5.0 5.0 . . . A . 12 C C4' . . A . 12 C O4' . . A . 12 C C1' . . A . 12 C C2' . . . 12 . C4' . . . . . 12 . O4' . . . . . 12 . C1' . . . . . 12 . C2' . . rr_1f79 1
38 . . 1 1 12 12 C O4' O . . 1 1 12 12 C C1' C . . 1 1 12 12 C C2' C . . 1 1 12 12 C C3' C . -27.0 -17.0 . . . A . 12 C O4' . . A . 12 C C1' . . A . 12 C C2' . . A . 12 C C3' . . . 12 . O4' . . . . . 12 . C1' . . . . . 12 . C2' . . . . . 12 . C3' . . rr_1f79 1
39 . . 1 1 12 12 C C1' C . . 1 1 12 12 C C2' C . . 1 1 12 12 C C3' C . . 1 1 12 12 C C4' C . 31.0 41.0 . . . A . 12 C C1' . . A . 12 C C2' . . A . 12 C C3' . . A . 12 C C4' . . . 12 . C1' . . . . . 12 . C2' . . . . . 12 . C3' . . . . . 12 . C4' . . rr_1f79 1
40 . . 1 1 12 12 C C2' C . . 1 1 12 12 C C3' C . . 1 1 12 12 C C4' C . . 1 1 12 12 C O4' O . -41.0 -31.0 . . . A . 12 C C2' . . A . 12 C C3' . . A . 12 C C4' . . A . 12 C O4' . . . 12 . C2' . . . . . 12 . C3' . . . . . 12 . C4' . . . . . 12 . O4' . . rr_1f79 1
41 . . 1 1 13 13 U C4' C . . 1 1 13 13 U O4' O . . 1 1 13 13 U C1' C . . 1 1 13 13 U C2' C . -5.0 5.0 . . . A . 13 U C4' . . A . 13 U O4' . . A . 13 U C1' . . A . 13 U C2' . . . 13 . C4' . . . . . 13 . O4' . . . . . 13 . C1' . . . . . 13 . C2' . . rr_1f79 1
42 . . 1 1 13 13 U O4' O . . 1 1 13 13 U C1' C . . 1 1 13 13 U C2' C . . 1 1 13 13 U C3' C . -27.0 -17.0 . . . A . 13 U O4' . . A . 13 U C1' . . A . 13 U C2' . . A . 13 U C3' . . . 13 . O4' . . . . . 13 . C1' . . . . . 13 . C2' . . . . . 13 . C3' . . rr_1f79 1
43 . . 1 1 13 13 U C1' C . . 1 1 13 13 U C2' C . . 1 1 13 13 U C3' C . . 1 1 13 13 U C4' C . 31.0 41.0 . . . A . 13 U C1' . . A . 13 U C2' . . A . 13 U C3' . . A . 13 U C4' . . . 13 . C1' . . . . . 13 . C2' . . . . . 13 . C3' . . . . . 13 . C4' . . rr_1f79 1
44 . . 1 1 13 13 U C2' C . . 1 1 13 13 U C3' C . . 1 1 13 13 U C4' C . . 1 1 13 13 U O4' O . -41.0 -31.0 . . . A . 13 U C2' . . A . 13 U C3' . . A . 13 U C4' . . A . 13 U O4' . . . 13 . C2' . . . . . 13 . C3' . . . . . 13 . C4' . . . . . 13 . O4' . . rr_1f79 1
45 . . 1 1 16 16 G C4' C . . 1 1 16 16 G O4' O . . 1 1 16 16 G C1' C . . 1 1 16 16 G C2' C . -5.0 5.0 . . . A . 16 G C4' . . A . 16 G O4' . . A . 16 G C1' . . A . 16 G C2' . . . 16 . C4' . . . . . 16 . O4' . . . . . 16 . C1' . . . . . 16 . C2' . . rr_1f79 1
46 . . 1 1 16 16 G O4' O . . 1 1 16 16 G C1' C . . 1 1 16 16 G C2' C . . 1 1 16 16 G C3' C . -27.0 -17.0 . . . A . 16 G O4' . . A . 16 G C1' . . A . 16 G C2' . . A . 16 G C3' . . . 16 . O4' . . . . . 16 . C1' . . . . . 16 . C2' . . . . . 16 . C3' . . rr_1f79 1
47 . . 1 1 16 16 G C1' C . . 1 1 16 16 G C2' C . . 1 1 16 16 G C3' C . . 1 1 16 16 G C4' C . 31.0 41.0 . . . A . 16 G C1' . . A . 16 G C2' . . A . 16 G C3' . . A . 16 G C4' . . . 16 . C1' . . . . . 16 . C2' . . . . . 16 . C3' . . . . . 16 . C4' . . rr_1f79 1
48 . . 1 1 16 16 G C2' C . . 1 1 16 16 G C3' C . . 1 1 16 16 G C4' C . . 1 1 16 16 G O4' O . -41.0 -31.0 . . . A . 16 G C2' . . A . 16 G C3' . . A . 16 G C4' . . A . 16 G O4' . . . 16 . C2' . . . . . 16 . C3' . . . . . 16 . C4' . . . . . 16 . O4' . . rr_1f79 1
49 . . 1 1 17 17 G C4' C . . 1 1 17 17 G O4' O . . 1 1 17 17 G C1' C . . 1 1 17 17 G C2' C . -5.0 5.0 . . . A . 17 G C4' . . A . 17 G O4' . . A . 17 G C1' . . A . 17 G C2' . . . 17 . C4' . . . . . 17 . O4' . . . . . 17 . C1' . . . . . 17 . C2' . . rr_1f79 1
50 . . 1 1 17 17 G O4' O . . 1 1 17 17 G C1' C . . 1 1 17 17 G C2' C . . 1 1 17 17 G C3' C . -27.0 -17.0 . . . A . 17 G O4' . . A . 17 G C1' . . A . 17 G C2' . . A . 17 G C3' . . . 17 . O4' . . . . . 17 . C1' . . . . . 17 . C2' . . . . . 17 . C3' . . rr_1f79 1
51 . . 1 1 17 17 G C1' C . . 1 1 17 17 G C2' C . . 1 1 17 17 G C3' C . . 1 1 17 17 G C4' C . 31.0 41.0 . . . A . 17 G C1' . . A . 17 G C2' . . A . 17 G C3' . . A . 17 G C4' . . . 17 . C1' . . . . . 17 . C2' . . . . . 17 . C3' . . . . . 17 . C4' . . rr_1f79 1
52 . . 1 1 17 17 G C2' C . . 1 1 17 17 G C3' C . . 1 1 17 17 G C4' C . . 1 1 17 17 G O4' O . -41.0 -31.0 . . . A . 17 G C2' . . A . 17 G C3' . . A . 17 G C4' . . A . 17 G O4' . . . 17 . C2' . . . . . 17 . C3' . . . . . 17 . C4' . . . . . 17 . O4' . . rr_1f79 1
53 . . 1 1 18 18 A C4' C . . 1 1 18 18 A O4' O . . 1 1 18 18 A C1' C . . 1 1 18 18 A C2' C . -5.0 5.0 . . . A . 18 A C4' . . A . 18 A O4' . . A . 18 A C1' . . A . 18 A C2' . . . 18 . C4' . . . . . 18 . O4' . . . . . 18 . C1' . . . . . 18 . C2' . . rr_1f79 1
54 . . 1 1 18 18 A O4' O . . 1 1 18 18 A C1' C . . 1 1 18 18 A C2' C . . 1 1 18 18 A C3' C . -27.0 -17.0 . . . A . 18 A O4' . . A . 18 A C1' . . A . 18 A C2' . . A . 18 A C3' . . . 18 . O4' . . . . . 18 . C1' . . . . . 18 . C2' . . . . . 18 . C3' . . rr_1f79 1
55 . . 1 1 18 18 A C1' C . . 1 1 18 18 A C2' C . . 1 1 18 18 A C3' C . . 1 1 18 18 A C4' C . 31.0 41.0 . . . A . 18 A C1' . . A . 18 A C2' . . A . 18 A C3' . . A . 18 A C4' . . . 18 . C1' . . . . . 18 . C2' . . . . . 18 . C3' . . . . . 18 . C4' . . rr_1f79 1
56 . . 1 1 18 18 A C2' C . . 1 1 18 18 A C3' C . . 1 1 18 18 A C4' C . . 1 1 18 18 A O4' O . -41.0 -31.0 . . . A . 18 A C2' . . A . 18 A C3' . . A . 18 A C4' . . A . 18 A O4' . . . 18 . C2' . . . . . 18 . C3' . . . . . 18 . C4' . . . . . 18 . O4' . . rr_1f79 1
57 . . 1 1 19 19 C C4' C . . 1 1 19 19 C O4' O . . 1 1 19 19 C C1' C . . 1 1 19 19 C C2' C . -5.0 5.0 . . . A . 19 C C4' . . A . 19 C O4' . . A . 19 C C1' . . A . 19 C C2' . . . 19 . C4' . . . . . 19 . O4' . . . . . 19 . C1' . . . . . 19 . C2' . . rr_1f79 1
58 . . 1 1 19 19 C O4' O . . 1 1 19 19 C C1' C . . 1 1 19 19 C C2' C . . 1 1 19 19 C C3' C . -27.0 -17.0 . . . A . 19 C O4' . . A . 19 C C1' . . A . 19 C C2' . . A . 19 C C3' . . . 19 . O4' . . . . . 19 . C1' . . . . . 19 . C2' . . . . . 19 . C3' . . rr_1f79 1
59 . . 1 1 19 19 C C1' C . . 1 1 19 19 C C2' C . . 1 1 19 19 C C3' C . . 1 1 19 19 C C4' C . 31.0 41.0 . . . A . 19 C C1' . . A . 19 C C2' . . A . 19 C C3' . . A . 19 C C4' . . . 19 . C1' . . . . . 19 . C2' . . . . . 19 . C3' . . . . . 19 . C4' . . rr_1f79 1
60 . . 1 1 19 19 C C2' C . . 1 1 19 19 C C3' C . . 1 1 19 19 C C4' C . . 1 1 19 19 C O4' O . -41.0 -31.0 . . . A . 19 C C2' . . A . 19 C C3' . . A . 19 C C4' . . A . 19 C O4' . . . 19 . C2' . . . . . 19 . C3' . . . . . 19 . C4' . . . . . 19 . O4' . . rr_1f79 1
61 . . 1 1 20 20 C C4' C . . 1 1 20 20 C O4' O . . 1 1 20 20 C C1' C . . 1 1 20 20 C C2' C . -5.0 5.0 . . . A . 20 C C4' . . A . 20 C O4' . . A . 20 C C1' . . A . 20 C C2' . . . 20 . C4' . . . . . 20 . O4' . . . . . 20 . C1' . . . . . 20 . C2' . . rr_1f79 1
62 . . 1 1 20 20 C O4' O . . 1 1 20 20 C C1' C . . 1 1 20 20 C C2' C . . 1 1 20 20 C C3' C . -27.0 -17.0 . . . A . 20 C O4' . . A . 20 C C1' . . A . 20 C C2' . . A . 20 C C3' . . . 20 . O4' . . . . . 20 . C1' . . . . . 20 . C2' . . . . . 20 . C3' . . rr_1f79 1
63 . . 1 1 20 20 C C1' C . . 1 1 20 20 C C2' C . . 1 1 20 20 C C3' C . . 1 1 20 20 C C4' C . 31.0 41.0 . . . A . 20 C C1' . . A . 20 C C2' . . A . 20 C C3' . . A . 20 C C4' . . . 20 . C1' . . . . . 20 . C2' . . . . . 20 . C3' . . . . . 20 . C4' . . rr_1f79 1
64 . . 1 1 20 20 C C2' C . . 1 1 20 20 C C3' C . . 1 1 20 20 C C4' C . . 1 1 20 20 C O4' O . -41.0 -31.0 . . . A . 20 C C2' . . A . 20 C C3' . . A . 20 C C4' . . A . 20 C O4' . . . 20 . C2' . . . . . 20 . C3' . . . . . 20 . C4' . . . . . 20 . O4' . . rr_1f79 1
65 . . 1 1 21 21 G C4' C . . 1 1 21 21 G O4' O . . 1 1 21 21 G C1' C . . 1 1 21 21 G C2' C . -5.0 5.0 . . . A . 21 G C4' . . A . 21 G O4' . . A . 21 G C1' . . A . 21 G C2' . . . 21 . C4' . . . . . 21 . O4' . . . . . 21 . C1' . . . . . 21 . C2' . . rr_1f79 1
66 . . 1 1 21 21 G O4' O . . 1 1 21 21 G C1' C . . 1 1 21 21 G C2' C . . 1 1 21 21 G C3' C . -27.0 -17.0 . . . A . 21 G O4' . . A . 21 G C1' . . A . 21 G C2' . . A . 21 G C3' . . . 21 . O4' . . . . . 21 . C1' . . . . . 21 . C2' . . . . . 21 . C3' . . rr_1f79 1
67 . . 1 1 21 21 G C1' C . . 1 1 21 21 G C2' C . . 1 1 21 21 G C3' C . . 1 1 21 21 G C4' C . 31.0 41.0 . . . A . 21 G C1' . . A . 21 G C2' . . A . 21 G C3' . . A . 21 G C4' . . . 21 . C1' . . . . . 21 . C2' . . . . . 21 . C3' . . . . . 21 . C4' . . rr_1f79 1
68 . . 1 1 21 21 G C2' C . . 1 1 21 21 G C3' C . . 1 1 21 21 G C4' C . . 1 1 21 21 G O4' O . -41.0 -31.0 . . . A . 21 G C2' . . A . 21 G C3' . . A . 21 G C4' . . A . 21 G O4' . . . 21 . C2' . . . . . 21 . C3' . . . . . 21 . C4' . . . . . 21 . O4' . . rr_1f79 1
69 . . 1 1 22 22 G C4' C . . 1 1 22 22 G O4' O . . 1 1 22 22 G C1' C . . 1 1 22 22 G C2' C . -5.0 5.0 . . . A . 22 G C4' . . A . 22 G O4' . . A . 22 G C1' . . A . 22 G C2' . . . 22 . C4' . . . . . 22 . O4' . . . . . 22 . C1' . . . . . 22 . C2' . . rr_1f79 1
70 . . 1 1 22 22 G O4' O . . 1 1 22 22 G C1' C . . 1 1 22 22 G C2' C . . 1 1 22 22 G C3' C . -27.0 -17.0 . . . A . 22 G O4' . . A . 22 G C1' . . A . 22 G C2' . . A . 22 G C3' . . . 22 . O4' . . . . . 22 . C1' . . . . . 22 . C2' . . . . . 22 . C3' . . rr_1f79 1
71 . . 1 1 22 22 G C1' C . . 1 1 22 22 G C2' C . . 1 1 22 22 G C3' C . . 1 1 22 22 G C4' C . 31.0 41.0 . . . A . 22 G C1' . . A . 22 G C2' . . A . 22 G C3' . . A . 22 G C4' . . . 22 . C1' . . . . . 22 . C2' . . . . . 22 . C3' . . . . . 22 . C4' . . rr_1f79 1
72 . . 1 1 22 22 G C2' C . . 1 1 22 22 G C3' C . . 1 1 22 22 G C4' C . . 1 1 22 22 G O4' O . -41.0 -31.0 . . . A . 22 G C2' . . A . 22 G C3' . . A . 22 G C4' . . A . 22 G O4' . . . 22 . C2' . . . . . 22 . C3' . . . . . 22 . C4' . . . . . 22 . O4' . . rr_1f79 1
73 . . 1 1 23 23 C C4' C . . 1 1 23 23 C O4' O . . 1 1 23 23 C C1' C . . 1 1 23 23 C C2' C . -5.0 5.0 . . . A . 23 C C4' . . A . 23 C O4' . . A . 23 C C1' . . A . 23 C C2' . . . 23 . C4' . . . . . 23 . O4' . . . . . 23 . C1' . . . . . 23 . C2' . . rr_1f79 1
74 . . 1 1 23 23 C O4' O . . 1 1 23 23 C C1' C . . 1 1 23 23 C C2' C . . 1 1 23 23 C C3' C . -27.0 -17.0 . . . A . 23 C O4' . . A . 23 C C1' . . A . 23 C C2' . . A . 23 C C3' . . . 23 . O4' . . . . . 23 . C1' . . . . . 23 . C2' . . . . . 23 . C3' . . rr_1f79 1
75 . . 1 1 23 23 C C1' C . . 1 1 23 23 C C2' C . . 1 1 23 23 C C3' C . . 1 1 23 23 C C4' C . 31.0 41.0 . . . A . 23 C C1' . . A . 23 C C2' . . A . 23 C C3' . . A . 23 C C4' . . . 23 . C1' . . . . . 23 . C2' . . . . . 23 . C3' . . . . . 23 . C4' . . rr_1f79 1
76 . . 1 1 23 23 C C2' C . . 1 1 23 23 C C3' C . . 1 1 23 23 C C4' C . . 1 1 23 23 C O4' O . -41.0 -31.0 . . . A . 23 C C2' . . A . 23 C C3' . . A . 23 C C4' . . A . 23 C O4' . . . 23 . C2' . . . . . 23 . C3' . . . . . 23 . C4' . . . . . 23 . O4' . . rr_1f79 1
77 . . 1 1 24 24 U C4' C . . 1 1 24 24 U O4' O . . 1 1 24 24 U C1' C . . 1 1 24 24 U C2' C . -5.0 5.0 . . . A . 24 U C4' . . A . 24 U O4' . . A . 24 U C1' . . A . 24 U C2' . . . 24 . C4' . . . . . 24 . O4' . . . . . 24 . C1' . . . . . 24 . C2' . . rr_1f79 1
78 . . 1 1 24 24 U O4' O . . 1 1 24 24 U C1' C . . 1 1 24 24 U C2' C . . 1 1 24 24 U C3' C . -27.0 -17.0 . . . A . 24 U O4' . . A . 24 U C1' . . A . 24 U C2' . . A . 24 U C3' . . . 24 . O4' . . . . . 24 . C1' . . . . . 24 . C2' . . . . . 24 . C3' . . rr_1f79 1
79 . . 1 1 24 24 U C1' C . . 1 1 24 24 U C2' C . . 1 1 24 24 U C3' C . . 1 1 24 24 U C4' C . 31.0 41.0 . . . A . 24 U C1' . . A . 24 U C2' . . A . 24 U C3' . . A . 24 U C4' . . . 24 . C1' . . . . . 24 . C2' . . . . . 24 . C3' . . . . . 24 . C4' . . rr_1f79 1
80 . . 1 1 24 24 U C2' C . . 1 1 24 24 U C3' C . . 1 1 24 24 U C4' C . . 1 1 24 24 U O4' O . -41.0 -31.0 . . . A . 24 U C2' . . A . 24 U C3' . . A . 24 U C4' . . A . 24 U O4' . . . 24 . C2' . . . . . 24 . C3' . . . . . 24 . C4' . . . . . 24 . O4' . . rr_1f79 1
81 . . 1 1 25 25 U C4' C . . 1 1 25 25 U O4' O . . 1 1 25 25 U C1' C . . 1 1 25 25 U C2' C . -5.0 5.0 . . . A . 25 U C4' . . A . 25 U O4' . . A . 25 U C1' . . A . 25 U C2' . . . 25 . C4' . . . . . 25 . O4' . . . . . 25 . C1' . . . . . 25 . C2' . . rr_1f79 1
82 . . 1 1 25 25 U O4' O . . 1 1 25 25 U C1' C . . 1 1 25 25 U C2' C . . 1 1 25 25 U C3' C . -27.0 -17.0 . . . A . 25 U O4' . . A . 25 U C1' . . A . 25 U C2' . . A . 25 U C3' . . . 25 . O4' . . . . . 25 . C1' . . . . . 25 . C2' . . . . . 25 . C3' . . rr_1f79 1
83 . . 1 1 25 25 U C1' C . . 1 1 25 25 U C2' C . . 1 1 25 25 U C3' C . . 1 1 25 25 U C4' C . 31.0 41.0 . . . A . 25 U C1' . . A . 25 U C2' . . A . 25 U C3' . . A . 25 U C4' . . . 25 . C1' . . . . . 25 . C2' . . . . . 25 . C3' . . . . . 25 . C4' . . rr_1f79 1
84 . . 1 1 25 25 U C2' C . . 1 1 25 25 U C3' C . . 1 1 25 25 U C4' C . . 1 1 25 25 U O4' O . -41.0 -31.0 . . . A . 25 U C2' . . A . 25 U C3' . . A . 25 U C4' . . A . 25 U O4' . . . 25 . C2' . . . . . 25 . C3' . . . . . 25 . C4' . . . . . 25 . O4' . . rr_1f79 1
85 . . 1 1 26 26 C C4' C . . 1 1 26 26 C O4' O . . 1 1 26 26 C C1' C . . 1 1 26 26 C C2' C . -5.0 5.0 . . . A . 26 C C4' . . A . 26 C O4' . . A . 26 C C1' . . A . 26 C C2' . . . 26 . C4' . . . . . 26 . O4' . . . . . 26 . C1' . . . . . 26 . C2' . . rr_1f79 1
86 . . 1 1 26 26 C O4' O . . 1 1 26 26 C C1' C . . 1 1 26 26 C C2' C . . 1 1 26 26 C C3' C . -27.0 -17.0 . . . A . 26 C O4' . . A . 26 C C1' . . A . 26 C C2' . . A . 26 C C3' . . . 26 . O4' . . . . . 26 . C1' . . . . . 26 . C2' . . . . . 26 . C3' . . rr_1f79 1
87 . . 1 1 26 26 C C1' C . . 1 1 26 26 C C2' C . . 1 1 26 26 C C3' C . . 1 1 26 26 C C4' C . 31.0 41.0 . . . A . 26 C C1' . . A . 26 C C2' . . A . 26 C C3' . . A . 26 C C4' . . . 26 . C1' . . . . . 26 . C2' . . . . . 26 . C3' . . . . . 26 . C4' . . rr_1f79 1
88 . . 1 1 26 26 C C2' C . . 1 1 26 26 C C3' C . . 1 1 26 26 C C4' C . . 1 1 26 26 C O4' O . -41.0 -31.0 . . . A . 26 C C2' . . A . 26 C C3' . . A . 26 C C4' . . A . 26 C O4' . . . 26 . C2' . . . . . 26 . C3' . . . . . 26 . C4' . . . . . 26 . O4' . . rr_1f79 1
89 . . 1 1 27 27 C C4' C . . 1 1 27 27 C O4' O . . 1 1 27 27 C C1' C . . 1 1 27 27 C C2' C . -5.0 5.0 . . . A . 27 C C4' . . A . 27 C O4' . . A . 27 C C1' . . A . 27 C C2' . . . 27 . C4' . . . . . 27 . O4' . . . . . 27 . C1' . . . . . 27 . C2' . . rr_1f79 1
90 . . 1 1 27 27 C O4' O . . 1 1 27 27 C C1' C . . 1 1 27 27 C C2' C . . 1 1 27 27 C C3' C . -27.0 -17.0 . . . A . 27 C O4' . . A . 27 C C1' . . A . 27 C C2' . . A . 27 C C3' . . . 27 . O4' . . . . . 27 . C1' . . . . . 27 . C2' . . . . . 27 . C3' . . rr_1f79 1
91 . . 1 1 27 27 C C1' C . . 1 1 27 27 C C2' C . . 1 1 27 27 C C3' C . . 1 1 27 27 C C4' C . 31.0 41.0 . . . A . 27 C C1' . . A . 27 C C2' . . A . 27 C C3' . . A . 27 C C4' . . . 27 . C1' . . . . . 27 . C2' . . . . . 27 . C3' . . . . . 27 . C4' . . rr_1f79 1
92 . . 1 1 27 27 C C2' C . . 1 1 27 27 C C3' C . . 1 1 27 27 C C4' C . . 1 1 27 27 C O4' O . -41.0 -31.0 . . . A . 27 C C2' . . A . 27 C C3' . . A . 27 C C4' . . A . 27 C O4' . . . 27 . C2' . . . . . 27 . C3' . . . . . 27 . C4' . . . . . 27 . O4' . . rr_1f79 1
93 . . 1 1 6 6 U C4' C . . 1 1 6 6 U O4' O . . 1 1 6 6 U C1' C . . 1 1 6 6 U C2' C . -40.0 0.0 . . . A . 6 U C4' . . A . 6 U O4' . . A . 6 U C1' . . A . 6 U C2' . . . 6 . C4' . . . . . 6 . O4' . . . . . 6 . C1' . . . . . 6 . C2' . . rr_1f79 1
94 . . 1 1 6 6 U O4' O . . 1 1 6 6 U C1' C . . 1 1 6 6 U C2' C . . 1 1 6 6 U C3' C . -10.0 40.0 . . . A . 6 U O4' . . A . 6 U C1' . . A . 6 U C2' . . A . 6 U C3' . . . 6 . O4' . . . . . 6 . C1' . . . . . 6 . C2' . . . . . 6 . C3' . . rr_1f79 1
95 . . 1 1 6 6 U C1' C . . 1 1 6 6 U C2' C . . 1 1 6 6 U C3' C . . 1 1 6 6 U C4' C . -35.0 35.0 . . . A . 6 U C1' . . A . 6 U C2' . . A . 6 U C3' . . A . 6 U C4' . . . 6 . C1' . . . . . 6 . C2' . . . . . 6 . C3' . . . . . 6 . C4' . . rr_1f79 1
96 . . 1 1 6 6 U C2' C . . 1 1 6 6 U C3' C . . 1 1 6 6 U C4' C . . 1 1 6 6 U O4' O . -40.0 40.0 . . . A . 6 U C2' . . A . 6 U C3' . . A . 6 U C4' . . A . 6 U O4' . . . 6 . C2' . . . . . 6 . C3' . . . . . 6 . C4' . . . . . 6 . O4' . . rr_1f79 1
97 . . 1 1 7 7 U C4' C . . 1 1 7 7 U O4' O . . 1 1 7 7 U C1' C . . 1 1 7 7 U C2' C . -40.0 0.0 . . . A . 7 U C4' . . A . 7 U O4' . . A . 7 U C1' . . A . 7 U C2' . . . 7 . C4' . . . . . 7 . O4' . . . . . 7 . C1' . . . . . 7 . C2' . . rr_1f79 1
98 . . 1 1 7 7 U O4' O . . 1 1 7 7 U C1' C . . 1 1 7 7 U C2' C . . 1 1 6 6 U C3' C . -10.0 40.0 . . . A . 7 U O4' . . A . 7 U C1' . . A . 7 U C2' . . A . 6 U C3' . . . 7 . O4' . . . . . 7 . C1' . . . . . 7 . C2' . . . . . 6 . C3' . . rr_1f79 1
99 . . 1 1 7 7 U C1' C . . 1 1 7 7 U C2' C . . 1 1 7 7 U C3' C . . 1 1 7 7 U C4' C . -35.0 35.0 . . . A . 7 U C1' . . A . 7 U C2' . . A . 7 U C3' . . A . 7 U C4' . . . 7 . C1' . . . . . 7 . C2' . . . . . 7 . C3' . . . . . 7 . C4' . . rr_1f79 1
100 . . 1 1 7 7 U C2' C . . 1 1 7 7 U C3' C . . 1 1 7 7 U C4' C . . 1 1 7 7 U O4' O . -40.0 40.0 . . . A . 7 U C2' . . A . 7 U C3' . . A . 7 U C4' . . A . 7 U O4' . . . 7 . C2' . . . . . 7 . C3' . . . . . 7 . C4' . . . . . 7 . O4' . . rr_1f79 1
101 . . 1 1 14 14 U C4' C . . 1 1 14 14 U O4' O . . 1 1 14 14 U C1' C . . 1 1 14 14 U C2' C . -23.0 -13.0 . . . A . 14 U C4' . . A . 14 U O4' . . A . 14 U C1' . . A . 14 U C2' . . . 14 . C4' . . . . . 14 . O4' . . . . . 14 . C1' . . . . . 14 . C2' . . rr_1f79 1
102 . . 1 1 14 14 U O4' O . . 1 1 14 14 U C1' C . . 1 1 14 14 U C2' C . . 1 1 14 14 U C3' C . 29.0 39.0 . . . A . 14 U O4' . . A . 14 U C1' . . A . 14 U C2' . . A . 14 U C3' . . . 14 . O4' . . . . . 14 . C1' . . . . . 14 . C2' . . . . . 14 . C3' . . rr_1f79 1
103 . . 1 1 14 14 U C1' C . . 1 1 14 14 U C2' C . . 1 1 14 14 U C3' C . . 1 1 14 14 U C4' C . -42.0 -32.0 . . . A . 14 U C1' . . A . 14 U C2' . . A . 14 U C3' . . A . 14 U C4' . . . 14 . C1' . . . . . 14 . C2' . . . . . 14 . C3' . . . . . 14 . C4' . . rr_1f79 1
104 . . 1 1 14 14 U C2' C . . 1 1 14 14 U C3' C . . 1 1 14 14 U C4' C . . 1 1 14 14 U O4' O . 21.0 31.0 . . . A . 14 U C2' . . A . 14 U C3' . . A . 14 U C4' . . A . 14 U O4' . . . 14 . C2' . . . . . 14 . C3' . . . . . 14 . C4' . . . . . 14 . O4' . . rr_1f79 1
105 . . 1 1 15 15 C C4' C . . 1 1 15 15 C O4' O . . 1 1 15 15 C C1' C . . 1 1 15 15 C C2' C . -23.0 -13.0 . . . A . 15 C C4' . . A . 15 C O4' . . A . 15 C C1' . . A . 15 C C2' . . . 15 . C4' . . . . . 15 . O4' . . . . . 15 . C1' . . . . . 15 . C2' . . rr_1f79 1
106 . . 1 1 15 15 C O4' O . . 1 1 15 15 C C1' C . . 1 1 15 15 C C2' C . . 1 1 15 15 C C3' C . 29.0 39.0 . . . A . 15 C O4' . . A . 15 C C1' . . A . 15 C C2' . . A . 15 C C3' . . . 15 . O4' . . . . . 15 . C1' . . . . . 15 . C2' . . . . . 15 . C3' . . rr_1f79 1
107 . . 1 1 15 15 C C1' C . . 1 1 15 15 C C2' C . . 1 1 15 15 C C3' C . . 1 1 15 15 C C4' C . -42.0 -32.0 . . . A . 15 C C1' . . A . 15 C C2' . . A . 15 C C3' . . A . 15 C C4' . . . 15 . C1' . . . . . 15 . C2' . . . . . 15 . C3' . . . . . 15 . C4' . . rr_1f79 1
108 . . 1 1 15 15 C C2' C . . 1 1 15 15 C C3' C . . 1 1 15 15 C C4' C . . 1 1 15 15 C O4' O . 21.0 31.0 . . . A . 15 C C2' . . A . 15 C C3' . . A . 15 C C4' . . A . 15 C O4' . . . 15 . C2' . . . . . 15 . C3' . . . . . 15 . C4' . . . . . 15 . O4' . . rr_1f79 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 "restrain some nucleotides to be c2'-endo or in between, based on 2JH1'H2''" 210 1 210 1 rr_1f79 1
2 "in between" 212 2 212 2 rr_1f79 1
3 c2'-endo 231 2 231 2 rr_1f79 1
stop_
save_
save_CNS/XPLOR_dihedral_10
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_10
_Torsion_angle_constraint_list.Entry_ID rr_1f79
_Torsion_angle_constraint_list.ID 3
_Torsion_angle_constraint_list.Details "Generated by Wattos"
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 10
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_1f79 2
stop_
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Atom_type_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Atom_type_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Atom_type_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Atom_type_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.PDB_record_ID_1
_Torsion_angle_constraint.PDB_model_num_1
_Torsion_angle_constraint.PDB_strand_ID_1
_Torsion_angle_constraint.PDB_ins_code_1
_Torsion_angle_constraint.PDB_residue_no_1
_Torsion_angle_constraint.PDB_residue_name_1
_Torsion_angle_constraint.PDB_atom_name_1
_Torsion_angle_constraint.PDB_record_ID_2
_Torsion_angle_constraint.PDB_model_num_2
_Torsion_angle_constraint.PDB_strand_ID_2
_Torsion_angle_constraint.PDB_ins_code_2
_Torsion_angle_constraint.PDB_residue_no_2
_Torsion_angle_constraint.PDB_residue_name_2
_Torsion_angle_constraint.PDB_atom_name_2
_Torsion_angle_constraint.PDB_record_ID_3
_Torsion_angle_constraint.PDB_model_num_3
_Torsion_angle_constraint.PDB_strand_ID_3
_Torsion_angle_constraint.PDB_ins_code_3
_Torsion_angle_constraint.PDB_residue_no_3
_Torsion_angle_constraint.PDB_residue_name_3
_Torsion_angle_constraint.PDB_atom_name_3
_Torsion_angle_constraint.PDB_record_ID_4
_Torsion_angle_constraint.PDB_model_num_4
_Torsion_angle_constraint.PDB_strand_ID_4
_Torsion_angle_constraint.PDB_ins_code_4
_Torsion_angle_constraint.PDB_residue_no_4
_Torsion_angle_constraint.PDB_residue_name_4
_Torsion_angle_constraint.PDB_atom_name_4
_Torsion_angle_constraint.Auth_entity_assembly_ID_1
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_chain_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_alt_ID_1
_Torsion_angle_constraint.Auth_atom_name_1
_Torsion_angle_constraint.Auth_entity_assembly_ID_2
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_chain_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_alt_ID_2
_Torsion_angle_constraint.Auth_atom_name_2
_Torsion_angle_constraint.Auth_entity_assembly_ID_3
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_chain_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_alt_ID_3
_Torsion_angle_constraint.Auth_atom_name_3
_Torsion_angle_constraint.Auth_entity_assembly_ID_4
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_chain_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Auth_alt_ID_4
_Torsion_angle_constraint.Auth_atom_name_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . 1 1 1 1 G O4' O . . 1 1 1 1 G C1' C . . 1 1 1 1 G N9 N . . 1 1 1 1 G C4 C . -180.0 -40.0 . . . A . 1 G O4' . . A . 1 G C1' . . A . 1 G N9 . . A . 1 G C4 . . . 1 . O4' . . . . . 1 . C1' . . . . . 1 . N9 . . . . . 1 . C4 . . rr_1f79 2
2 . . 1 1 2 2 G O4' O . . 1 1 2 2 G C1' C . . 1 1 2 2 G N9 N . . 1 1 2 2 G C4 C . -180.0 -40.0 . . . A . 2 G O4' . . A . 2 G C1' . . A . 2 G N9 . . A . 2 G C4 . . . 2 . O4' . . . . . 2 . C1' . . . . . 2 . N9 . . . . . 2 . C4 . . rr_1f79 2
3 . . 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 . -180.0 -40.0 . . . A . 3 A O4' . . A . 3 A C1' . . A . 3 A N9 . . A . 3 A C4 . . . 3 . O4' . . . . . 3 . C1' . . . . . 3 . N9 . . . . . 3 . C4 . . rr_1f79 2
4 . . 1 1 4 4 A O4' O . . 1 1 4 4 A C1' C . . 1 1 4 4 A N9 N . . 1 1 4 4 A C4 C . -180.0 -40.0 . . . A . 4 A O4' . . A . 4 A C1' . . A . 4 A N9 . . A . 4 A C4 . . . 4 . O4' . . . . . 4 . C1' . . . . . 4 . N9 . . . . . 4 . C4 . . rr_1f79 2
5 . . 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 . -180.0 -40.0 . . . A . 5 G O4' . . A . 5 G C1' . . A . 5 G N9 . . A . 5 G C4 . . . 5 . O4' . . . . . 5 . C1' . . . . . 5 . N9 . . . . . 5 . C4 . . rr_1f79 2
6 . . 1 1 9 9 G O4' O . . 1 1 9 9 G C1' C . . 1 1 9 9 G N9 N . . 1 1 9 9 G C4 C . -180.0 -40.0 . . . A . 9 G O4' . . A . 9 G C1' . . A . 9 G N9 . . A . 9 G C4 . . . 9 . O4' . . . . . 9 . C1' . . . . . 9 . N9 . . . . . 9 . C4 . . rr_1f79 2
7 . . 1 1 10 10 G O4' O . . 1 1 10 10 G C1' C . . 1 1 10 10 G N9 N . . 1 1 10 10 G C4 C . -180.0 -40.0 . . . A . 10 G O4' . . A . 10 G C1' . . A . 10 G N9 . . A . 10 G C4 . . . 10 . O4' . . . . . 10 . C1' . . . . . 10 . N9 . . . . . 10 . C4 . . rr_1f79 2
8 . . 1 1 17 17 G O4' O . . 1 1 17 17 G C1' C . . 1 1 17 17 G N9 N . . 1 1 17 17 G C4 C . -180.0 -40.0 . . . A . 17 G O4' . . A . 17 G C1' . . A . 17 G N9 . . A . 17 G C4 . . . 17 . O4' . . . . . 17 . C1' . . . . . 17 . N9 . . . . . 17 . C4 . . rr_1f79 2
9 . . 1 1 18 18 A O4' O . . 1 1 18 18 A C1' C . . 1 1 18 18 A N9 N . . 1 1 18 18 A C4 C . -180.0 -40.0 . . . A . 18 A O4' . . A . 18 A C1' . . A . 18 A N9 . . A . 18 A C4 . . . 18 . O4' . . . . . 18 . C1' . . . . . 18 . N9 . . . . . 18 . C4 . . rr_1f79 2
10 . . 1 1 21 21 G O4' O . . 1 1 21 21 G C1' C . . 1 1 21 21 G N9 N . . 1 1 21 21 G C4 C . -180.0 -40.0 . . . A . 21 G O4' . . A . 21 G C1' . . A . 21 G N9 . . A . 21 G C4 . . . 21 . O4' . . . . . 21 . C1' . . . . . 21 . N9 . . . . . 21 . C4 . . rr_1f79 2
11 . . 1 1 22 22 G O4' O . . 1 1 22 22 G C1' C . . 1 1 22 22 G N9 N . . 1 1 22 22 G C4 C . -180.0 -40.0 . . . A . 22 G O4' . . A . 22 G C1' . . A . 22 G N9 . . A . 22 G C4 . . . 22 . O4' . . . . . 22 . C1' . . . . . 22 . N9 . . . . . 22 . C4 . . rr_1f79 2
12 . . 1 1 6 6 U O4' O . . 1 1 6 6 U C1' C . . 1 1 6 6 U N1 N . . 1 1 6 6 U C2 C . -180.0 -40.0 . . . A . 6 U O4' . . A . 6 U C1' . . A . 6 U N1 . . A . 6 U C2 . . . 6 . O4' . . . . . 6 . C1' . . . . . 6 . N1 . . . . . 6 . C2 . . rr_1f79 2
13 . . 1 1 8 8 C O4' O . . 1 1 8 8 C C1' C . . 1 1 8 8 C N1 N . . 1 1 8 8 C C2 C . -180.0 -40.0 . . . A . 8 C O4' . . A . 8 C C1' . . A . 8 C N1 . . A . 8 C C2 . . . 8 . O4' . . . . . 8 . C1' . . . . . 8 . N1 . . . . . 8 . C2 . . rr_1f79 2
14 . . 1 1 11 11 U O4' O . . 1 1 11 11 U C1' C . . 1 1 11 11 U N1 N . . 1 1 11 11 U C2 C . -180.0 -40.0 . . . A . 11 U O4' . . A . 11 U C1' . . A . 11 U N1 . . A . 11 U C2 . . . 11 . O4' . . . . . 11 . C1' . . . . . 11 . N1 . . . . . 11 . C2 . . rr_1f79 2
15 . . 1 1 12 12 C O4' O . . 1 1 12 12 C C1' C . . 1 1 12 12 C N1 N . . 1 1 12 12 C C2 C . -180.0 -40.0 . . . A . 12 C O4' . . A . 12 C C1' . . A . 12 C N1 . . A . 12 C C2 . . . 12 . O4' . . . . . 12 . C1' . . . . . 12 . N1 . . . . . 12 . C2 . . rr_1f79 2
16 . . 1 1 13 13 U O4' O . . 1 1 13 13 U C1' C . . 1 1 13 13 U N1 N . . 1 1 13 13 U C2 C . -180.0 -40.0 . . . A . 13 U O4' . . A . 13 U C1' . . A . 13 U N1 . . A . 13 U C2 . . . 13 . O4' . . . . . 13 . C1' . . . . . 13 . N1 . . . . . 13 . C2 . . rr_1f79 2
17 . . 1 1 19 19 C O4' O . . 1 1 19 19 C C1' C . . 1 1 19 19 C N1 N . . 1 1 19 19 C C2 C . -180.0 -40.0 . . . A . 19 C O4' . . A . 19 C C1' . . A . 19 C N1 . . A . 19 C C2 . . . 19 . O4' . . . . . 19 . C1' . . . . . 19 . N1 . . . . . 19 . C2 . . rr_1f79 2
18 . . 1 1 20 20 C O4' O . . 1 1 20 20 C C1' C . . 1 1 20 20 C N1 N . . 1 1 20 20 C C2 C . -180.0 -40.0 . . . A . 20 C O4' . . A . 20 C C1' . . A . 20 C N1 . . A . 20 C C2 . . . 20 . O4' . . . . . 20 . C1' . . . . . 20 . N1 . . . . . 20 . C2 . . rr_1f79 2
19 . . 1 1 23 23 C O4' O . . 1 1 23 23 C C1' C . . 1 1 23 23 C N1 N . . 1 1 23 23 C C2 C . -180.0 -40.0 . . . A . 23 C O4' . . A . 23 C C1' . . A . 23 C N1 . . A . 23 C C2 . . . 23 . O4' . . . . . 23 . C1' . . . . . 23 . N1 . . . . . 23 . C2 . . rr_1f79 2
20 . . 1 1 24 24 U O4' O . . 1 1 24 24 U C1' C . . 1 1 24 24 U N1 N . . 1 1 24 24 U C2 C . -180.0 -40.0 . . . A . 24 U O4' . . A . 24 U C1' . . A . 24 U N1 . . A . 24 U C2 . . . 24 . O4' . . . . . 24 . C1' . . . . . 24 . N1 . . . . . 24 . C2 . . rr_1f79 2
21 . . 1 1 25 25 U O4' O . . 1 1 25 25 U C1' C . . 1 1 25 25 U N1 N . . 1 1 25 25 U C2 C . -180.0 -40.0 . . . A . 25 U O4' . . A . 25 U C1' . . A . 25 U N1 . . A . 25 U C2 . . . 25 . O4' . . . . . 25 . C1' . . . . . 25 . N1 . . . . . 25 . C2 . . rr_1f79 2
22 . . 1 1 26 26 C O4' O . . 1 1 26 26 C C1' C . . 1 1 26 26 C N1 N . . 1 1 26 26 C C2 C . -180.0 -40.0 . . . A . 26 C O4' . . A . 26 C C1' . . A . 26 C N1 . . A . 26 C C2 . . . 26 . O4' . . . . . 26 . C1' . . . . . 26 . N1 . . . . . 26 . C2 . . rr_1f79 2
23 . . 1 1 27 27 C O4' O . . 1 1 27 27 C C1' C . . 1 1 27 27 C N1 N . . 1 1 27 27 C C2 C . -180.0 -40.0 . . . A . 27 C O4' . . A . 27 C C1' . . A . 27 C N1 . . A . 27 C C2 . . . 27 . O4' . . . . . 27 . C1' . . . . . 27 . N1 . . . . . 27 . C2 . . rr_1f79 2
24 . . 1 1 16 16 G O4' O . . 1 1 16 16 G C1' C . . 1 1 16 16 G N9 N . . 1 1 16 16 G C4 C . 0.0 140.0 . . . A . 16 G O4' . . A . 16 G C1' . . A . 16 G N9 . . A . 16 G C4 . . . 16 . O4' . . . . . 16 . C1' . . . . . 16 . N9 . . . . . 16 . C4 . . rr_1f79 2
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 "G5: not sure about this one" 13 2 13 2 rr_1f79 2
2 "G16: syn!" 23 2 23 2 rr_1f79 2
3 "restrain some nucleotides to keep pyrimidine bases anti" 38 1 38 1 rr_1f79 2
4 "loop nucleotides UC in U(UC)G not constrained" 55 9 55 9 rr_1f79 2
5 "constrain G16 to syn based on strong H8H1' cross peak" 78 2 78 2 rr_1f79 2
stop_
save_
save_CNS/XPLOR_dihedral_14
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_14
_Torsion_angle_constraint_list.Entry_ID rr_1f79
_Torsion_angle_constraint_list.ID 5
_Torsion_angle_constraint_list.Details "Generated by Wattos"
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 14
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_1f79 3
stop_
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Atom_type_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Atom_type_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Atom_type_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Atom_type_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.PDB_record_ID_1
_Torsion_angle_constraint.PDB_model_num_1
_Torsion_angle_constraint.PDB_strand_ID_1
_Torsion_angle_constraint.PDB_ins_code_1
_Torsion_angle_constraint.PDB_residue_no_1
_Torsion_angle_constraint.PDB_residue_name_1
_Torsion_angle_constraint.PDB_atom_name_1
_Torsion_angle_constraint.PDB_record_ID_2
_Torsion_angle_constraint.PDB_model_num_2
_Torsion_angle_constraint.PDB_strand_ID_2
_Torsion_angle_constraint.PDB_ins_code_2
_Torsion_angle_constraint.PDB_residue_no_2
_Torsion_angle_constraint.PDB_residue_name_2
_Torsion_angle_constraint.PDB_atom_name_2
_Torsion_angle_constraint.PDB_record_ID_3
_Torsion_angle_constraint.PDB_model_num_3
_Torsion_angle_constraint.PDB_strand_ID_3
_Torsion_angle_constraint.PDB_ins_code_3
_Torsion_angle_constraint.PDB_residue_no_3
_Torsion_angle_constraint.PDB_residue_name_3
_Torsion_angle_constraint.PDB_atom_name_3
_Torsion_angle_constraint.PDB_record_ID_4
_Torsion_angle_constraint.PDB_model_num_4
_Torsion_angle_constraint.PDB_strand_ID_4
_Torsion_angle_constraint.PDB_ins_code_4
_Torsion_angle_constraint.PDB_residue_no_4
_Torsion_angle_constraint.PDB_residue_name_4
_Torsion_angle_constraint.PDB_atom_name_4
_Torsion_angle_constraint.Auth_entity_assembly_ID_1
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_chain_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_alt_ID_1
_Torsion_angle_constraint.Auth_atom_name_1
_Torsion_angle_constraint.Auth_entity_assembly_ID_2
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_chain_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_alt_ID_2
_Torsion_angle_constraint.Auth_atom_name_2
_Torsion_angle_constraint.Auth_entity_assembly_ID_3
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_chain_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_alt_ID_3
_Torsion_angle_constraint.Auth_atom_name_3
_Torsion_angle_constraint.Auth_entity_assembly_ID_4
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_chain_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Auth_alt_ID_4
_Torsion_angle_constraint.Auth_atom_name_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . 1 1 1 1 G O5' O . . 1 1 1 1 G C5' C . . 1 1 1 1 G C4' C . . 1 1 1 1 G C3' C . 25.0 85.0 . . . A . 1 G O5' . . A . 1 G C5' . . A . 1 G C4' . . A . 1 G C3' . . . 1 . O5' . . . . . 1 . C5' . . . . . 1 . C4' . . . . . 1 . C3' . . rr_1f79 3
2 . . 1 1 2 2 G O5' O . . 1 1 2 2 G C5' C . . 1 1 2 2 G C4' C . . 1 1 2 2 G C3' C . 25.0 85.0 . . . A . 2 G O5' . . A . 2 G C5' . . A . 2 G C4' . . A . 2 G C3' . . . 2 . O5' . . . . . 2 . C5' . . . . . 2 . C4' . . . . . 2 . C3' . . rr_1f79 3
3 . . 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 . 25.0 85.0 . . . A . 3 A O5' . . A . 3 A C5' . . A . 3 A C4' . . A . 3 A C3' . . . 3 . O5' . . . . . 3 . C5' . . . . . 3 . C4' . . . . . 3 . C3' . . rr_1f79 3
4 . . 1 1 4 4 A O5' O . . 1 1 4 4 A C5' C . . 1 1 4 4 A C4' C . . 1 1 4 4 A C3' C . 25.0 85.0 . . . A . 4 A O5' . . A . 4 A C5' . . A . 4 A C4' . . A . 4 A C3' . . . 4 . O5' . . . . . 4 . C5' . . . . . 4 . C4' . . . . . 4 . C3' . . rr_1f79 3
5 . . 1 1 5 5 G O5' O . . 1 1 5 5 G C5' C . . 1 1 5 5 G C4' C . . 1 1 5 5 G C3' C . 25.0 85.0 . . . A . 5 G O5' . . A . 5 G C5' . . A . 5 G C4' . . A . 5 G C3' . . . 5 . O5' . . . . . 5 . C5' . . . . . 5 . C4' . . . . . 5 . C3' . . rr_1f79 3
6 . . 1 1 9 9 G O5' O . . 1 1 9 9 G C5' C . . 1 1 9 9 G C4' C . . 1 1 9 9 G C3' C . 25.0 85.0 . . . A . 9 G O5' . . A . 9 G C5' . . A . 9 G C4' . . A . 9 G C3' . . . 9 . O5' . . . . . 9 . C5' . . . . . 9 . C4' . . . . . 9 . C3' . . rr_1f79 3
7 . . 1 1 10 10 G O5' O . . 1 1 10 10 G C5' C . . 1 1 10 10 G C4' C . . 1 1 10 10 G C3' C . 25.0 85.0 . . . A . 10 G O5' . . A . 10 G C5' . . A . 10 G C4' . . A . 10 G C3' . . . 10 . O5' . . . . . 10 . C5' . . . . . 10 . C4' . . . . . 10 . C3' . . rr_1f79 3
8 . . 1 1 11 11 U O5' O . . 1 1 11 11 U C5' C . . 1 1 11 11 U C4' C . . 1 1 11 11 U C3' C . 25.0 85.0 . . . A . 11 U O5' . . A . 11 U C5' . . A . 11 U C4' . . A . 11 U C3' . . . 11 . O5' . . . . . 11 . C5' . . . . . 11 . C4' . . . . . 11 . C3' . . rr_1f79 3
9 . . 1 1 17 17 G O5' O . . 1 1 17 17 G C5' C . . 1 1 17 17 G C4' C . . 1 1 17 17 G C3' C . 25.0 85.0 . . . A . 17 G O5' . . A . 17 G C5' . . A . 17 G C4' . . A . 17 G C3' . . . 17 . O5' . . . . . 17 . C5' . . . . . 17 . C4' . . . . . 17 . C3' . . rr_1f79 3
10 . . 1 1 18 18 A O5' O . . 1 1 18 18 A C5' C . . 1 1 18 18 A C4' C . . 1 1 18 18 A C3' C . 25.0 85.0 . . . A . 18 A O5' . . A . 18 A C5' . . A . 18 A C4' . . A . 18 A C3' . . . 18 . O5' . . . . . 18 . C5' . . . . . 18 . C4' . . . . . 18 . C3' . . rr_1f79 3
11 . . 1 1 19 19 C O5' O . . 1 1 19 19 C C5' C . . 1 1 19 19 C C4' C . . 1 1 19 19 C C3' C . 25.0 85.0 . . . A . 19 C O5' . . A . 19 C C5' . . A . 19 C C4' . . A . 19 C C3' . . . 19 . O5' . . . . . 19 . C5' . . . . . 19 . C4' . . . . . 19 . C3' . . rr_1f79 3
12 . . 1 1 20 20 C O5' O . . 1 1 20 20 C C5' C . . 1 1 20 20 C C4' C . . 1 1 20 20 C C3' C . 25.0 85.0 . . . A . 20 C O5' . . A . 20 C C5' . . A . 20 C C4' . . A . 20 C C3' . . . 20 . O5' . . . . . 20 . C5' . . . . . 20 . C4' . . . . . 20 . C3' . . rr_1f79 3
13 . . 1 1 21 21 G O5' O . . 1 1 21 21 G C5' C . . 1 1 21 21 G C4' C . . 1 1 21 21 G C3' C . 25.0 85.0 . . . A . 21 G O5' . . A . 21 G C5' . . A . 21 G C4' . . A . 21 G C3' . . . 21 . O5' . . . . . 21 . C5' . . . . . 21 . C4' . . . . . 21 . C3' . . rr_1f79 3
14 . . 1 1 22 22 G O5' O . . 1 1 22 22 G C5' C . . 1 1 22 22 G C4' C . . 1 1 22 22 G C3' C . 25.0 85.0 . . . A . 22 G O5' . . A . 22 G C5' . . A . 22 G C4' . . A . 22 G C3' . . . 22 . O5' . . . . . 22 . C5' . . . . . 22 . C4' . . . . . 22 . C3' . . rr_1f79 3
15 . . 1 1 23 23 C O5' O . . 1 1 23 23 C C5' C . . 1 1 23 23 C C4' C . . 1 1 23 23 C C3' C . 25.0 85.0 . . . A . 23 C O5' . . A . 23 C C5' . . A . 23 C C4' . . A . 23 C C3' . . . 23 . O5' . . . . . 23 . C5' . . . . . 23 . C4' . . . . . 23 . C3' . . rr_1f79 3
16 . . 1 1 24 24 U O5' O . . 1 1 24 24 U C5' C . . 1 1 24 24 U C4' C . . 1 1 24 24 U C3' C . 25.0 85.0 . . . A . 24 U O5' . . A . 24 U C5' . . A . 24 U C4' . . A . 24 U C3' . . . 24 . O5' . . . . . 24 . C5' . . . . . 24 . C4' . . . . . 24 . C3' . . rr_1f79 3
17 . . 1 1 25 25 U O5' O . . 1 1 25 25 U C5' C . . 1 1 25 25 U C4' C . . 1 1 25 25 U C3' C . 25.0 85.0 . . . A . 25 U O5' . . A . 25 U C5' . . A . 25 U C4' . . A . 25 U C3' . . . 25 . O5' . . . . . 25 . C5' . . . . . 25 . C4' . . . . . 25 . C3' . . rr_1f79 3
18 . . 1 1 26 26 C O5' O . . 1 1 26 26 C C5' C . . 1 1 26 26 C C4' C . . 1 1 26 26 C C3' C . 25.0 85.0 . . . A . 26 C O5' . . A . 26 C C5' . . A . 26 C C4' . . A . 26 C C3' . . . 26 . O5' . . . . . 26 . C5' . . . . . 26 . C4' . . . . . 26 . C3' . . rr_1f79 3
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 "U6-C8: around bulge loop, not constrained" 12 2 12 2 rr_1f79 3
2 "C12-G16: C(UUCG) tetraloop, not constrained" 21 2 21 2 rr_1f79 3
stop_
save_
save_CNS/XPLOR_dihedral_18
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_18
_Torsion_angle_constraint_list.Entry_ID rr_1f79
_Torsion_angle_constraint_list.ID 7
_Torsion_angle_constraint_list.Details "Generated by Wattos"
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 18
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_1f79 4
stop_
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Atom_type_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Atom_type_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Atom_type_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Atom_type_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.PDB_record_ID_1
_Torsion_angle_constraint.PDB_model_num_1
_Torsion_angle_constraint.PDB_strand_ID_1
_Torsion_angle_constraint.PDB_ins_code_1
_Torsion_angle_constraint.PDB_residue_no_1
_Torsion_angle_constraint.PDB_residue_name_1
_Torsion_angle_constraint.PDB_atom_name_1
_Torsion_angle_constraint.PDB_record_ID_2
_Torsion_angle_constraint.PDB_model_num_2
_Torsion_angle_constraint.PDB_strand_ID_2
_Torsion_angle_constraint.PDB_ins_code_2
_Torsion_angle_constraint.PDB_residue_no_2
_Torsion_angle_constraint.PDB_residue_name_2
_Torsion_angle_constraint.PDB_atom_name_2
_Torsion_angle_constraint.PDB_record_ID_3
_Torsion_angle_constraint.PDB_model_num_3
_Torsion_angle_constraint.PDB_strand_ID_3
_Torsion_angle_constraint.PDB_ins_code_3
_Torsion_angle_constraint.PDB_residue_no_3
_Torsion_angle_constraint.PDB_residue_name_3
_Torsion_angle_constraint.PDB_atom_name_3
_Torsion_angle_constraint.PDB_record_ID_4
_Torsion_angle_constraint.PDB_model_num_4
_Torsion_angle_constraint.PDB_strand_ID_4
_Torsion_angle_constraint.PDB_ins_code_4
_Torsion_angle_constraint.PDB_residue_no_4
_Torsion_angle_constraint.PDB_residue_name_4
_Torsion_angle_constraint.PDB_atom_name_4
_Torsion_angle_constraint.Auth_entity_assembly_ID_1
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_chain_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_alt_ID_1
_Torsion_angle_constraint.Auth_atom_name_1
_Torsion_angle_constraint.Auth_entity_assembly_ID_2
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_chain_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_alt_ID_2
_Torsion_angle_constraint.Auth_atom_name_2
_Torsion_angle_constraint.Auth_entity_assembly_ID_3
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_chain_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_alt_ID_3
_Torsion_angle_constraint.Auth_atom_name_3
_Torsion_angle_constraint.Auth_entity_assembly_ID_4
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_chain_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Auth_alt_ID_4
_Torsion_angle_constraint.Auth_atom_name_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . 1 1 1 1 G O3' O . . 1 1 2 2 G P P . . 1 1 2 2 G O5' O . . 1 1 2 2 G C5' C . -100.0 -40.0 . . . A . 1 G O3' . . A . 2 G P . . A . 2 G O5' . . A . 2 G C5' . . . 1 . O3' . . . . . 2 . P . . . . . 2 . O5' . . . . . 2 . C5' . . rr_1f79 4
2 . . 1 1 2 2 G O3' O . . 1 1 3 3 A P P . . 1 1 3 3 A O5' O . . 1 1 3 3 A C5' C . -100.0 -40.0 . . . A . 2 G O3' . . A . 3 A P . . A . 3 A O5' . . A . 3 A C5' . . . 2 . O3' . . . . . 3 . P . . . . . 3 . O5' . . . . . 3 . C5' . . rr_1f79 4
3 . . 1 1 3 3 A O3' O . . 1 1 4 4 A P P . . 1 1 4 4 A O5' O . . 1 1 4 4 A C5' C . -100.0 -40.0 . . . A . 3 A O3' . . A . 4 A P . . A . 4 A O5' . . A . 4 A C5' . . . 3 . O3' . . . . . 4 . P . . . . . 4 . O5' . . . . . 4 . C5' . . rr_1f79 4
4 . . 1 1 4 4 A O3' O . . 1 1 5 5 G P P . . 1 1 5 5 G O5' O . . 1 1 5 5 G C5' C . -100.0 -40.0 . . . A . 4 A O3' . . A . 5 G P . . A . 5 G O5' . . A . 5 G C5' . . . 4 . O3' . . . . . 5 . P . . . . . 5 . O5' . . . . . 5 . C5' . . rr_1f79 4
5 . . 1 1 8 8 C O3' O . . 1 1 9 9 G P P . . 1 1 9 9 G O5' O . . 1 1 9 9 G C5' C . -100.0 -40.0 . . . A . 8 C O3' . . A . 9 G P . . A . 9 G O5' . . A . 9 G C5' . . . 8 . O3' . . . . . 9 . P . . . . . 9 . O5' . . . . . 9 . C5' . . rr_1f79 4
6 . . 1 1 9 9 G O3' O . . 1 1 10 10 G P P . . 1 1 10 10 G O5' O . . 1 1 10 10 G C5' C . -100.0 -40.0 . . . A . 9 G O3' . . A . 10 G P . . A . 10 G O5' . . A . 10 G C5' . . . 9 . O3' . . . . . 10 . P . . . . . 10 . O5' . . . . . 10 . C5' . . rr_1f79 4
7 . . 1 1 10 10 G O3' O . . 1 1 11 11 U P P . . 1 1 11 11 U O5' O . . 1 1 11 11 U C5' C . -100.0 -40.0 . . . A . 10 G O3' . . A . 11 U P . . A . 11 U O5' . . A . 11 U C5' . . . 10 . O3' . . . . . 11 . P . . . . . 11 . O5' . . . . . 11 . C5' . . rr_1f79 4
8 . . 1 1 11 11 U O3' O . . 1 1 12 12 C P P . . 1 1 12 12 C O5' O . . 1 1 12 12 C C5' C . -100.0 -40.0 . . . A . 11 U O3' . . A . 12 C P . . A . 12 C O5' . . A . 12 C C5' . . . 11 . O3' . . . . . 12 . P . . . . . 12 . O5' . . . . . 12 . C5' . . rr_1f79 4
9 . . 1 1 12 12 C O3' O . . 1 1 13 13 U P P . . 1 1 13 13 U O5' O . . 1 1 13 13 U C5' C . -100.0 -40.0 . . . A . 12 C O3' . . A . 13 U P . . A . 13 U O5' . . A . 13 U C5' . . . 12 . O3' . . . . . 13 . P . . . . . 13 . O5' . . . . . 13 . C5' . . rr_1f79 4
10 . . 1 1 13 13 U O3' O . . 1 1 14 14 U P P . . 1 1 14 14 U O5' O . . 1 1 14 14 U C5' C . -100.0 -40.0 . . . A . 13 U O3' . . A . 14 U P . . A . 14 U O5' . . A . 14 U C5' . . . 13 . O3' . . . . . 14 . P . . . . . 14 . O5' . . . . . 14 . C5' . . rr_1f79 4
11 . . 1 1 17 17 G O3' O . . 1 1 18 18 A P P . . 1 1 18 18 A O5' O . . 1 1 18 18 A C5' C . -100.0 -40.0 . . . A . 17 G O3' . . A . 18 A P . . A . 18 A O5' . . A . 18 A C5' . . . 17 . O3' . . . . . 18 . P . . . . . 18 . O5' . . . . . 18 . C5' . . rr_1f79 4
12 . . 1 1 18 18 A O3' O . . 1 1 19 19 C P P . . 1 1 19 19 C O5' O . . 1 1 19 19 C C5' C . -100.0 -40.0 . . . A . 18 A O3' . . A . 19 C P . . A . 19 C O5' . . A . 19 C C5' . . . 18 . O3' . . . . . 19 . P . . . . . 19 . O5' . . . . . 19 . C5' . . rr_1f79 4
13 . . 1 1 19 19 C O3' O . . 1 1 20 20 C P P . . 1 1 20 20 C O5' O . . 1 1 20 20 C C5' C . -100.0 -40.0 . . . A . 19 C O3' . . A . 20 C P . . A . 20 C O5' . . A . 20 C C5' . . . 19 . O3' . . . . . 20 . P . . . . . 20 . O5' . . . . . 20 . C5' . . rr_1f79 4
14 . . 1 1 20 20 C O3' O . . 1 1 21 21 G P P . . 1 1 21 21 G O5' O . . 1 1 21 21 G C5' C . -100.0 -40.0 . . . A . 20 C O3' . . A . 21 G P . . A . 21 G O5' . . A . 21 G C5' . . . 20 . O3' . . . . . 21 . P . . . . . 21 . O5' . . . . . 21 . C5' . . rr_1f79 4
15 . . 1 1 22 22 G O3' O . . 1 1 23 23 C P P . . 1 1 23 23 C O5' O . . 1 1 23 23 C C5' C . -100.0 -40.0 . . . A . 22 G O3' . . A . 23 C P . . A . 23 C O5' . . A . 23 C C5' . . . 22 . O3' . . . . . 23 . P . . . . . 23 . O5' . . . . . 23 . C5' . . rr_1f79 4
16 . . 1 1 23 23 C O3' O . . 1 1 24 24 U P P . . 1 1 24 24 U O5' O . . 1 1 24 24 U C5' C . -100.0 -40.0 . . . A . 23 C O3' . . A . 24 U P . . A . 24 U O5' . . A . 24 U C5' . . . 23 . O3' . . . . . 24 . P . . . . . 24 . O5' . . . . . 24 . C5' . . rr_1f79 4
17 . . 1 1 24 24 U O3' O . . 1 1 25 25 U P P . . 1 1 25 25 U O5' O . . 1 1 25 25 U C5' C . -100.0 -40.0 . . . A . 24 U O3' . . A . 25 U P . . A . 25 U O5' . . A . 25 U C5' . . . 24 . O3' . . . . . 25 . P . . . . . 25 . O5' . . . . . 25 . C5' . . rr_1f79 4
18 . . 1 1 25 25 U O3' O . . 1 1 26 26 C P P . . 1 1 26 26 C O5' O . . 1 1 26 26 C C5' C . -100.0 -40.0 . . . A . 25 U O3' . . A . 26 C P . . A . 26 C O5' . . A . 26 C C5' . . . 25 . O3' . . . . . 26 . P . . . . . 26 . O5' . . . . . 26 . C5' . . rr_1f79 4
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 "U6-C8: round bulge loop, not constrained" 10 2 10 2 rr_1f79 4
2 "UUCG: taken from literature" 21 2 21 2 rr_1f79 4
3 "don't constrain U14, C15, G16: strong 3JPH4'/H5'/H5'', irregular CS" 26 9 26 9 rr_1f79 4
4 "UUCG: end" 27 2 27 2 rr_1f79 4
5 "G21-p-G22: continuous strand of bulge, not constrained" 38 2 38 2 rr_1f79 4
stop_
save_
save_CNS/XPLOR_dihedral_6
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_6
_Torsion_angle_constraint_list.Entry_ID rr_1f79
_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 6
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_1f79 5
stop_
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Atom_type_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Atom_type_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Atom_type_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Atom_type_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.PDB_record_ID_1
_Torsion_angle_constraint.PDB_model_num_1
_Torsion_angle_constraint.PDB_strand_ID_1
_Torsion_angle_constraint.PDB_ins_code_1
_Torsion_angle_constraint.PDB_residue_no_1
_Torsion_angle_constraint.PDB_residue_name_1
_Torsion_angle_constraint.PDB_atom_name_1
_Torsion_angle_constraint.PDB_record_ID_2
_Torsion_angle_constraint.PDB_model_num_2
_Torsion_angle_constraint.PDB_strand_ID_2
_Torsion_angle_constraint.PDB_ins_code_2
_Torsion_angle_constraint.PDB_residue_no_2
_Torsion_angle_constraint.PDB_residue_name_2
_Torsion_angle_constraint.PDB_atom_name_2
_Torsion_angle_constraint.PDB_record_ID_3
_Torsion_angle_constraint.PDB_model_num_3
_Torsion_angle_constraint.PDB_strand_ID_3
_Torsion_angle_constraint.PDB_ins_code_3
_Torsion_angle_constraint.PDB_residue_no_3
_Torsion_angle_constraint.PDB_residue_name_3
_Torsion_angle_constraint.PDB_atom_name_3
_Torsion_angle_constraint.PDB_record_ID_4
_Torsion_angle_constraint.PDB_model_num_4
_Torsion_angle_constraint.PDB_strand_ID_4
_Torsion_angle_constraint.PDB_ins_code_4
_Torsion_angle_constraint.PDB_residue_no_4
_Torsion_angle_constraint.PDB_residue_name_4
_Torsion_angle_constraint.PDB_atom_name_4
_Torsion_angle_constraint.Auth_entity_assembly_ID_1
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_chain_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_alt_ID_1
_Torsion_angle_constraint.Auth_atom_name_1
_Torsion_angle_constraint.Auth_entity_assembly_ID_2
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_chain_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_alt_ID_2
_Torsion_angle_constraint.Auth_atom_name_2
_Torsion_angle_constraint.Auth_entity_assembly_ID_3
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_chain_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_alt_ID_3
_Torsion_angle_constraint.Auth_atom_name_3
_Torsion_angle_constraint.Auth_entity_assembly_ID_4
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_chain_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Auth_alt_ID_4
_Torsion_angle_constraint.Auth_atom_name_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . 1 1 1 1 G H22 H . . 1 1 1 1 G N2 N . . 1 1 1 1 G C2 C . . 1 1 1 1 G N3 N . -5.0 5.0 . . . A . 1 G H22 . . A . 1 G N2 . . A . 1 G C2 . . A . 1 G N3 . . . 1 . H22 . . . . . 1 . N2 . . . . . 1 . C2 . . . . . 1 . N3 . . rr_1f79 5
2 . . 1 1 2 2 G H22 H . . 1 1 2 2 G N2 N . . 1 1 2 2 G C2 C . . 1 1 2 2 G N3 N . -5.0 5.0 . . . A . 2 G H22 . . A . 2 G N2 . . A . 2 G C2 . . A . 2 G N3 . . . 2 . H22 . . . . . 2 . N2 . . . . . 2 . C2 . . . . . 2 . N3 . . rr_1f79 5
3 . . 1 1 5 5 G H22 H . . 1 1 5 5 G N2 N . . 1 1 5 5 G C2 C . . 1 1 5 5 G N3 N . -5.0 5.0 . . . A . 5 G H22 . . A . 5 G N2 . . A . 5 G C2 . . A . 5 G N3 . . . 5 . H22 . . . . . 5 . N2 . . . . . 5 . C2 . . . . . 5 . N3 . . rr_1f79 5
4 . . 1 1 9 9 G H22 H . . 1 1 9 9 G N2 N . . 1 1 9 9 G C2 C . . 1 1 9 9 G N3 N . -5.0 5.0 . . . A . 9 G H22 . . A . 9 G N2 . . A . 9 G C2 . . A . 9 G N3 . . . 9 . H22 . . . . . 9 . N2 . . . . . 9 . C2 . . . . . 9 . N3 . . rr_1f79 5
5 . . 1 1 10 10 G H22 H . . 1 1 10 10 G N2 N . . 1 1 10 10 G C2 C . . 1 1 10 10 G N3 N . -5.0 5.0 . . . A . 10 G H22 . . A . 10 G N2 . . A . 10 G C2 . . A . 10 G N3 . . . 10 . H22 . . . . . 10 . N2 . . . . . 10 . C2 . . . . . 10 . N3 . . rr_1f79 5
6 . . 1 1 16 16 G H22 H . . 1 1 16 16 G N2 N . . 1 1 16 16 G C2 C . . 1 1 16 16 G N3 N . -5.0 5.0 . . . A . 16 G H22 . . A . 16 G N2 . . A . 16 G C2 . . A . 16 G N3 . . . 16 . H22 . . . . . 16 . N2 . . . . . 16 . C2 . . . . . 16 . N3 . . rr_1f79 5
7 . . 1 1 17 17 G H22 H . . 1 1 17 17 G N2 N . . 1 1 17 17 G C2 C . . 1 1 17 17 G N3 N . -5.0 5.0 . . . A . 17 G H22 . . A . 17 G N2 . . A . 17 G C2 . . A . 17 G N3 . . . 17 . H22 . . . . . 17 . N2 . . . . . 17 . C2 . . . . . 17 . N3 . . rr_1f79 5
8 . . 1 1 21 21 G H22 H . . 1 1 21 21 G N2 N . . 1 1 21 21 G C2 C . . 1 1 21 21 G N3 N . -5.0 5.0 . . . A . 21 G H22 . . A . 21 G N2 . . A . 21 G C2 . . A . 21 G N3 . . . 21 . H22 . . . . . 21 . N2 . . . . . 21 . C2 . . . . . 21 . N3 . . rr_1f79 5
9 . . 1 1 22 22 G H22 H . . 1 1 22 22 G N2 N . . 1 1 22 22 G C2 C . . 1 1 22 22 G N3 N . -5.0 5.0 . . . A . 22 G H22 . . A . 22 G N2 . . A . 22 G C2 . . A . 22 G N3 . . . 22 . H22 . . . . . 22 . N2 . . . . . 22 . C2 . . . . . 22 . N3 . . rr_1f79 5
10 . . 1 1 8 8 C H42 H . . 1 1 8 8 C N4 N . . 1 1 8 8 C C4 C . . 1 1 8 8 C C5 C . -5.0 5.0 . . . A . 8 C H42 . . A . 8 C N4 . . A . 8 C C4 . . A . 8 C C5 . . . 8 . H42 . . . . . 8 . N4 . . . . . 8 . C4 . . . . . 8 . C5 . . rr_1f79 5
11 . . 1 1 12 12 C H42 H . . 1 1 12 12 C N4 N . . 1 1 12 12 C C4 C . . 1 1 12 12 C C5 C . -5.0 5.0 . . . A . 12 C H42 . . A . 12 C N4 . . A . 12 C C4 . . A . 12 C C5 . . . 12 . H42 . . . . . 12 . N4 . . . . . 12 . C4 . . . . . 12 . C5 . . rr_1f79 5
12 . . 1 1 15 15 C H42 H . . 1 1 15 15 C N4 N . . 1 1 15 15 C C4 C . . 1 1 15 15 C C5 C . -5.0 5.0 . . . A . 15 C H42 . . A . 15 C N4 . . A . 15 C C4 . . A . 15 C C5 . . . 15 . H42 . . . . . 15 . N4 . . . . . 15 . C4 . . . . . 15 . C5 . . rr_1f79 5
13 . . 1 1 19 19 C H42 H . . 1 1 19 19 C N4 N . . 1 1 19 19 C C4 C . . 1 1 19 19 C C5 C . -5.0 5.0 . . . A . 19 C H42 . . A . 19 C N4 . . A . 19 C C4 . . A . 19 C C5 . . . 19 . H42 . . . . . 19 . N4 . . . . . 19 . C4 . . . . . 19 . C5 . . rr_1f79 5
14 . . 1 1 20 20 C H42 H . . 1 1 20 20 C N4 N . . 1 1 20 20 C C4 C . . 1 1 20 20 C C5 C . -5.0 5.0 . . . A . 20 C H42 . . A . 20 C N4 . . A . 20 C C4 . . A . 20 C C5 . . . 20 . H42 . . . . . 20 . N4 . . . . . 20 . C4 . . . . . 20 . C5 . . rr_1f79 5
15 . . 1 1 23 23 C H42 H . . 1 1 23 23 C N4 N . . 1 1 23 23 C C4 C . . 1 1 23 23 C C5 C . -5.0 5.0 . . . A . 23 C H42 . . A . 23 C N4 . . A . 23 C C4 . . A . 23 C C5 . . . 23 . H42 . . . . . 23 . N4 . . . . . 23 . C4 . . . . . 23 . C5 . . rr_1f79 5
16 . . 1 1 26 26 C H42 H . . 1 1 26 26 C N4 N . . 1 1 26 26 C C4 C . . 1 1 26 26 C C5 C . -5.0 5.0 . . . A . 26 C H42 . . A . 26 C N4 . . A . 26 C C4 . . A . 26 C C5 . . . 26 . H42 . . . . . 26 . N4 . . . . . 26 . C4 . . . . . 26 . C5 . . rr_1f79 5
17 . . 1 1 27 27 C H42 H . . 1 1 27 27 C N4 N . . 1 1 27 27 C C4 C . . 1 1 27 27 C C5 C . -5.0 5.0 . . . A . 27 C H42 . . A . 27 C N4 . . A . 27 C C4 . . A . 27 C C5 . . . 27 . H42 . . . . . 27 . N4 . . . . . 27 . C4 . . . . . 27 . C5 . . rr_1f79 5
18 . . 1 1 3 3 A H62 H . . 1 1 3 3 A N6 N . . 1 1 3 3 A C6 C . . 1 1 3 3 A C5 C . -5.0 5.0 . . . A . 3 A H62 . . A . 3 A N6 . . A . 3 A C6 . . A . 3 A C5 . . . 3 . H62 . . . . . 3 . N6 . . . . . 3 . C6 . . . . . 3 . C5 . . rr_1f79 5
19 . . 1 1 4 4 A H62 H . . 1 1 4 4 A N6 N . . 1 1 4 4 A C6 C . . 1 1 4 4 A C5 C . -5.0 5.0 . . . A . 4 A H62 . . A . 4 A N6 . . A . 4 A C6 . . A . 4 A C5 . . . 4 . H62 . . . . . 4 . N6 . . . . . 4 . C6 . . . . . 4 . C5 . . rr_1f79 5
20 . . 1 1 18 18 A H62 H . . 1 1 18 18 A N6 N . . 1 1 18 18 A C6 C . . 1 1 18 18 A C5 C . -5.0 5.0 . . . A . 18 A H62 . . A . 18 A N6 . . A . 18 A C6 . . A . 18 A C5 . . . 18 . H62 . . . . . 18 . N6 . . . . . 18 . C6 . . . . . 18 . C5 . . rr_1f79 5
stop_
loop_
_TA_constraint_comment_org.ID
_TA_constraint_comment_org.Comment_text
_TA_constraint_comment_org.Comment_begin_line
_TA_constraint_comment_org.Comment_begin_column
_TA_constraint_comment_org.Comment_end_line
_TA_constraint_comment_org.Comment_end_column
_TA_constraint_comment_org.Entry_ID
_TA_constraint_comment_org.Torsion_angle_constraint_list_ID
1 "Keep G amino groups in the plane of the base" 1 1 1 1 rr_1f79 5
2 "Keep C amino groups in the plane of the base" 21 1 21 1 rr_1f79 5
3 "Keep A amino groups in the plane of the base" 39 1 39 1 rr_1f79 5
stop_
save_
save_CNS/XPLOR_dihedral_20
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_20
_Torsion_angle_constraint_list.Entry_ID rr_1f79
_Torsion_angle_constraint_list.ID 8
_Torsion_angle_constraint_list.Details "Generated by Wattos"
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 20
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_1f79 6
stop_
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Atom_type_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Atom_type_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Atom_type_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Atom_type_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.PDB_record_ID_1
_Torsion_angle_constraint.PDB_model_num_1
_Torsion_angle_constraint.PDB_strand_ID_1
_Torsion_angle_constraint.PDB_ins_code_1
_Torsion_angle_constraint.PDB_residue_no_1
_Torsion_angle_constraint.PDB_residue_name_1
_Torsion_angle_constraint.PDB_atom_name_1
_Torsion_angle_constraint.PDB_record_ID_2
_Torsion_angle_constraint.PDB_model_num_2
_Torsion_angle_constraint.PDB_strand_ID_2
_Torsion_angle_constraint.PDB_ins_code_2
_Torsion_angle_constraint.PDB_residue_no_2
_Torsion_angle_constraint.PDB_residue_name_2
_Torsion_angle_constraint.PDB_atom_name_2
_Torsion_angle_constraint.PDB_record_ID_3
_Torsion_angle_constraint.PDB_model_num_3
_Torsion_angle_constraint.PDB_strand_ID_3
_Torsion_angle_constraint.PDB_ins_code_3
_Torsion_angle_constraint.PDB_residue_no_3
_Torsion_angle_constraint.PDB_residue_name_3
_Torsion_angle_constraint.PDB_atom_name_3
_Torsion_angle_constraint.PDB_record_ID_4
_Torsion_angle_constraint.PDB_model_num_4
_Torsion_angle_constraint.PDB_strand_ID_4
_Torsion_angle_constraint.PDB_ins_code_4
_Torsion_angle_constraint.PDB_residue_no_4
_Torsion_angle_constraint.PDB_residue_name_4
_Torsion_angle_constraint.PDB_atom_name_4
_Torsion_angle_constraint.Auth_entity_assembly_ID_1
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_chain_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_alt_ID_1
_Torsion_angle_constraint.Auth_atom_name_1
_Torsion_angle_constraint.Auth_entity_assembly_ID_2
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_chain_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_alt_ID_2
_Torsion_angle_constraint.Auth_atom_name_2
_Torsion_angle_constraint.Auth_entity_assembly_ID_3
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_chain_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_alt_ID_3
_Torsion_angle_constraint.Auth_atom_name_3
_Torsion_angle_constraint.Auth_entity_assembly_ID_4
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_chain_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Auth_alt_ID_4
_Torsion_angle_constraint.Auth_atom_name_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . 1 1 1 1 G C3' C . . 1 1 1 1 G O3' O . . 1 1 2 2 G P P . . 1 1 2 2 G O5' O . -100.0 -40.0 . . . A . 1 G C3' . . A . 1 G O3' . . A . 2 G P . . A . 2 G O5' . . . 1 . C3' . . . . . 1 . O3' . . . . . 2 . P . . . . . 2 . O5' . . rr_1f79 6
2 . . 1 1 2 2 G C3' C . . 1 1 2 2 G O3' O . . 1 1 3 3 A P P . . 1 1 3 3 A O5' O . -100.0 -40.0 . . . A . 2 G C3' . . A . 2 G O3' . . A . 3 A P . . A . 3 A O5' . . . 2 . C3' . . . . . 2 . O3' . . . . . 3 . P . . . . . 3 . O5' . . rr_1f79 6
3 . . 1 1 3 3 A C3' C . . 1 1 3 3 A O3' O . . 1 1 4 4 A P P . . 1 1 4 4 A O5' O . -100.0 -40.0 . . . A . 3 A C3' . . A . 3 A O3' . . A . 4 A P . . A . 4 A O5' . . . 3 . C3' . . . . . 3 . O3' . . . . . 4 . P . . . . . 4 . O5' . . rr_1f79 6
4 . . 1 1 4 4 A C3' C . . 1 1 4 4 A O3' O . . 1 1 5 5 G P P . . 1 1 5 5 G O5' O . -100.0 -40.0 . . . A . 4 A C3' . . A . 4 A O3' . . A . 5 G P . . A . 5 G O5' . . . 4 . C3' . . . . . 4 . O3' . . . . . 5 . P . . . . . 5 . O5' . . rr_1f79 6
5 . . 1 1 5 5 G C3' C . . 1 1 5 5 G O3' O . . 1 1 6 6 U P P . . 1 1 6 6 U O5' O . -100.0 -40.0 . . . A . 5 G C3' . . A . 5 G O3' . . A . 6 U P . . A . 6 U O5' . . . 5 . C3' . . . . . 5 . O3' . . . . . 6 . P . . . . . 6 . O5' . . rr_1f79 6
6 . . 1 1 8 8 C C3' C . . 1 1 8 8 C O3' O . . 1 1 9 9 G P P . . 1 1 9 9 G O5' O . -100.0 -40.0 . . . A . 8 C C3' . . A . 8 C O3' . . A . 9 G P . . A . 9 G O5' . . . 8 . C3' . . . . . 8 . O3' . . . . . 9 . P . . . . . 9 . O5' . . rr_1f79 6
7 . . 1 1 9 9 G C3' C . . 1 1 9 9 G O3' O . . 1 1 10 10 G P P . . 1 1 10 10 G O5' O . -100.0 -40.0 . . . A . 9 G C3' . . A . 9 G O3' . . A . 10 G P . . A . 10 G O5' . . . 9 . C3' . . . . . 9 . O3' . . . . . 10 . P . . . . . 10 . O5' . . rr_1f79 6
8 . . 1 1 10 10 G C3' C . . 1 1 10 10 G O3' O . . 1 1 11 11 U P P . . 1 1 11 11 U O5' O . -100.0 -40.0 . . . A . 10 G C3' . . A . 10 G O3' . . A . 11 U P . . A . 11 U O5' . . . 10 . C3' . . . . . 10 . O3' . . . . . 11 . P . . . . . 11 . O5' . . rr_1f79 6
9 . . 1 1 11 11 U C3' C . . 1 1 11 11 U O3' O . . 1 1 12 12 C P P . . 1 1 12 12 C O5' O . -100.0 -40.0 . . . A . 11 U C3' . . A . 11 U O3' . . A . 12 C P . . A . 12 C O5' . . . 11 . C3' . . . . . 11 . O3' . . . . . 12 . P . . . . . 12 . O5' . . rr_1f79 6
10 . . 1 1 12 12 C C3' C . . 1 1 12 12 C O3' O . . 1 1 13 13 U P P . . 1 1 13 13 U O5' O . -100.0 -40.0 . . . A . 12 C C3' . . A . 12 C O3' . . A . 13 U P . . A . 13 U O5' . . . 12 . C3' . . . . . 12 . O3' . . . . . 13 . P . . . . . 13 . O5' . . rr_1f79 6
11 . . 1 1 13 13 U C3' C . . 1 1 13 13 U O3' O . . 1 1 14 14 U P P . . 1 1 14 14 U O5' O . -100.0 -40.0 . . . A . 13 U C3' . . A . 13 U O3' . . A . 14 U P . . A . 14 U O5' . . . 13 . C3' . . . . . 13 . O3' . . . . . 14 . P . . . . . 14 . O5' . . rr_1f79 6
12 . . 1 1 17 17 G C3' C . . 1 1 17 17 G O3' O . . 1 1 18 18 A P P . . 1 1 18 18 A O5' O . -100.0 -40.0 . . . A . 17 G C3' . . A . 17 G O3' . . A . 18 A P . . A . 18 A O5' . . . 17 . C3' . . . . . 17 . O3' . . . . . 18 . P . . . . . 18 . O5' . . rr_1f79 6
13 . . 1 1 18 18 A C3' C . . 1 1 18 18 A O3' O . . 1 1 19 19 C P P . . 1 1 19 19 C O5' O . -100.0 -40.0 . . . A . 18 A C3' . . A . 18 A O3' . . A . 19 C P . . A . 19 C O5' . . . 18 . C3' . . . . . 18 . O3' . . . . . 19 . P . . . . . 19 . O5' . . rr_1f79 6
14 . . 1 1 19 19 C C3' C . . 1 1 19 19 C O3' O . . 1 1 20 20 C P P . . 1 1 20 20 C O5' O . -100.0 -40.0 . . . A . 19 C C3' . . A . 19 C O3' . . A . 20 C P . . A . 20 C O5' . . . 19 . C3' . . . . . 19 . O3' . . . . . 20 . P . . . . . 20 . O5' . . rr_1f79 6
15 . . 1 1 20 20 C C3' C . . 1 1 20 20 C O3' O . . 1 1 21 21 G P P . . 1 1 21 21 G O5' O . -100.0 -40.0 . . . A . 20 C C3' . . A . 20 C O3' . . A . 21 G P . . A . 21 G O5' . . . 20 . C3' . . . . . 20 . O3' . . . . . 21 . P . . . . . 21 . O5' . . rr_1f79 6
16 . . 1 1 22 22 G C3' C . . 1 1 22 22 G O3' O . . 1 1 23 23 C P P . . 1 1 23 23 C O5' O . -100.0 -40.0 . . . A . 22 G C3' . . A . 22 G O3' . . A . 23 C P . . A . 23 C O5' . . . 22 . C3' . . . . . 22 . O3' . . . . . 23 . P . . . . . 23 . O5' . . rr_1f79 6
17 . . 1 1 23 23 C C3' C . . 1 1 23 23 C O3' O . . 1 1 24 24 U P P . . 1 1 24 24 U O5' O . -100.0 -40.0 . . . A . 23 C C3' . . A . 23 C O3' . . A . 24 U P . . A . 24 U O5' . . . 23 . C3' . . . . . 23 . O3' . . . . . 24 . P . . . . . 24 . O5' . . rr_1f79 6
18 . . 1 1 24 24 U C3' C . . 1 1 24 24 U O3' O . . 1 1 25 25 U P P . . 1 1 25 25 U O5' O . -100.0 -40.0 . . . A . 24 U C3' . . A . 24 U O3' . . A . 25 U P . . A . 25 U O5' . . . 24 . C3' . . . . . 24 . O3' . . . . . 25 . P . . . . . 25 . O5' . . rr_1f79 6
19 . . 1 1 25 25 U C3' C . . 1 1 25 25 U O3' O . . 1 1 26 26 C P P . . 1 1 26 26 C O5' O . -100.0 -40.0 . . . A . 25 U C3' . . A . 25 U O3' . . A . 26 C P . . A . 26 C O5' . . . 25 . C3' . . . . . 25 . O3' . . . . . 26 . P . . . . . 26 . O5' . . rr_1f79 6
20 . . 1 1 26 26 C C3' C . . 1 1 26 26 C O3' O . . 1 1 27 27 C P P . . 1 1 27 27 C O5' O . -100.0 -40.0 . . . A . 26 C C3' . . A . 26 C O3' . . A . 27 C P . . A . 27 C O5' . . . 26 . C3' . . . . . 26 . O3' . . . . . 27 . P . . . . . 27 . O5' . . rr_1f79 6
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 "U6-C8: around bulge, not constrained" 12 2 12 2 rr_1f79 6
2 "UUCG: taken from literature" 23 2 23 2 rr_1f79 6
3 "don't constrain U14, C15: strong 3JPH4'/H5'/H5'', irregular CS" 28 9 28 9 rr_1f79 6
4 "UUCG: end" 29 2 29 2 rr_1f79 6
5 "don't constrain U16 either; funny shift and strong 3JP/H5'/H5''" 31 2 31 2 rr_1f79 6
6 "G21-p-G22: continuous strand of bulge, not constrained" 42 2 42 2 rr_1f79 6
7 "end of zeta restraints, 19 total" 55 1 55 1 rr_1f79 6
8 "end of backbone constraints" 57 2 57 2 rr_1f79 6
9 "20 beta 18 gamma 18 epsilon 18 alpha 19 zeta, 93 total" 58 2 58 2 rr_1f79 6
10 "end of dihedal restraints" 60 2 60 2 rr_1f79 6
11 "20 amino 27 pucker 23 glycosidic 93 backbone, 163 total" 61 2 61 2 rr_1f79 6
12 "end of combined NOE distance/dihedral constraints P4 C7>U mutant" 63 2 63 2 rr_1f79 6
stop_
save_
save_CNS/XPLOR_dihedral_16
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_16
_Torsion_angle_constraint_list.Entry_ID rr_1f79
_Torsion_angle_constraint_list.ID 6
_Torsion_angle_constraint_list.Details "Generated by Wattos"
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 16
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_1f79 7
stop_
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Atom_type_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Atom_type_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Atom_type_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Atom_type_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.PDB_record_ID_1
_Torsion_angle_constraint.PDB_model_num_1
_Torsion_angle_constraint.PDB_strand_ID_1
_Torsion_angle_constraint.PDB_ins_code_1
_Torsion_angle_constraint.PDB_residue_no_1
_Torsion_angle_constraint.PDB_residue_name_1
_Torsion_angle_constraint.PDB_atom_name_1
_Torsion_angle_constraint.PDB_record_ID_2
_Torsion_angle_constraint.PDB_model_num_2
_Torsion_angle_constraint.PDB_strand_ID_2
_Torsion_angle_constraint.PDB_ins_code_2
_Torsion_angle_constraint.PDB_residue_no_2
_Torsion_angle_constraint.PDB_residue_name_2
_Torsion_angle_constraint.PDB_atom_name_2
_Torsion_angle_constraint.PDB_record_ID_3
_Torsion_angle_constraint.PDB_model_num_3
_Torsion_angle_constraint.PDB_strand_ID_3
_Torsion_angle_constraint.PDB_ins_code_3
_Torsion_angle_constraint.PDB_residue_no_3
_Torsion_angle_constraint.PDB_residue_name_3
_Torsion_angle_constraint.PDB_atom_name_3
_Torsion_angle_constraint.PDB_record_ID_4
_Torsion_angle_constraint.PDB_model_num_4
_Torsion_angle_constraint.PDB_strand_ID_4
_Torsion_angle_constraint.PDB_ins_code_4
_Torsion_angle_constraint.PDB_residue_no_4
_Torsion_angle_constraint.PDB_residue_name_4
_Torsion_angle_constraint.PDB_atom_name_4
_Torsion_angle_constraint.Auth_entity_assembly_ID_1
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_chain_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_alt_ID_1
_Torsion_angle_constraint.Auth_atom_name_1
_Torsion_angle_constraint.Auth_entity_assembly_ID_2
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_chain_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_alt_ID_2
_Torsion_angle_constraint.Auth_atom_name_2
_Torsion_angle_constraint.Auth_entity_assembly_ID_3
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_chain_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_alt_ID_3
_Torsion_angle_constraint.Auth_atom_name_3
_Torsion_angle_constraint.Auth_entity_assembly_ID_4
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_chain_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Auth_alt_ID_4
_Torsion_angle_constraint.Auth_atom_name_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . 1 1 1 1 G C4' C . . 1 1 1 1 G C3' C . . 1 1 1 1 G O3' O . . 1 1 2 2 G P P . -185.0 -125.0 . . . A . 1 G C4' . . A . 1 G C3' . . A . 1 G O3' . . A . 2 G P . . . 1 . C4' . . . . . 1 . C3' . . . . . 1 . O3' . . . . . 2 . P . . rr_1f79 7
2 . . 1 1 2 2 G C4' C . . 1 1 2 2 G C3' C . . 1 1 2 2 G O3' O . . 1 1 3 3 A P P . -185.0 -125.0 . . . A . 2 G C4' . . A . 2 G C3' . . A . 2 G O3' . . A . 3 A P . . . 2 . C4' . . . . . 2 . C3' . . . . . 2 . O3' . . . . . 3 . P . . rr_1f79 7
3 . . 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 A P P . -185.0 -125.0 . . . A . 3 A C4' . . A . 3 A C3' . . A . 3 A O3' . . A . 4 A P . . . 3 . C4' . . . . . 3 . C3' . . . . . 3 . O3' . . . . . 4 . P . . rr_1f79 7
4 . . 1 1 4 4 A C4' C . . 1 1 4 4 A C3' C . . 1 1 4 4 A O3' O . . 1 1 5 5 G P P . -185.0 -125.0 . . . A . 4 A C4' . . A . 4 A C3' . . A . 4 A O3' . . A . 5 G P . . . 4 . C4' . . . . . 4 . C3' . . . . . 4 . O3' . . . . . 5 . P . . rr_1f79 7
5 . . 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 U P P . -185.0 -125.0 . . . A . 5 G C4' . . A . 5 G C3' . . A . 5 G O3' . . A . 6 U P . . . 5 . C4' . . . . . 5 . C3' . . . . . 5 . O3' . . . . . 6 . P . . rr_1f79 7
6 . . 1 1 9 9 G C4' C . . 1 1 9 9 G C3' C . . 1 1 9 9 G O3' O . . 1 1 10 10 G P P . -185.0 -125.0 . . . A . 9 G C4' . . A . 9 G C3' . . A . 9 G O3' . . A . 10 G P . . . 9 . C4' . . . . . 9 . C3' . . . . . 9 . O3' . . . . . 10 . P . . rr_1f79 7
7 . . 1 1 10 10 G C4' C . . 1 1 10 10 G C3' C . . 1 1 10 10 G O3' O . . 1 1 11 11 U P P . -185.0 -125.0 . . . A . 10 G C4' . . A . 10 G C3' . . A . 10 G O3' . . A . 11 U P . . . 10 . C4' . . . . . 10 . C3' . . . . . 10 . O3' . . . . . 11 . P . . rr_1f79 7
8 . . 1 1 11 11 U C4' C . . 1 1 11 11 U C3' C . . 1 1 11 11 U O3' O . . 1 1 12 12 C P P . -185.0 -125.0 . . . A . 11 U C4' . . A . 11 U C3' . . A . 11 U O3' . . A . 12 C P . . . 11 . C4' . . . . . 11 . C3' . . . . . 11 . O3' . . . . . 12 . P . . rr_1f79 7
9 . . 1 1 17 17 G C4' C . . 1 1 17 17 G C3' C . . 1 1 17 17 G O3' O . . 1 1 18 18 A P P . -185.0 -125.0 . . . A . 17 G C4' . . A . 17 G C3' . . A . 17 G O3' . . A . 18 A P . . . 17 . C4' . . . . . 17 . C3' . . . . . 17 . O3' . . . . . 18 . P . . rr_1f79 7
10 . . 1 1 18 18 A C4' C . . 1 1 18 18 A C3' C . . 1 1 18 18 A O3' O . . 1 1 19 19 C P P . -185.0 -125.0 . . . A . 18 A C4' . . A . 18 A C3' . . A . 18 A O3' . . A . 19 C P . . . 18 . C4' . . . . . 18 . C3' . . . . . 18 . O3' . . . . . 19 . P . . rr_1f79 7
11 . . 1 1 19 19 C C4' C . . 1 1 19 19 C C3' C . . 1 1 19 19 C O3' O . . 1 1 20 20 C P P . -185.0 -125.0 . . . A . 19 C C4' . . A . 19 C C3' . . A . 19 C O3' . . A . 20 C P . . . 19 . C4' . . . . . 19 . C3' . . . . . 19 . O3' . . . . . 20 . P . . rr_1f79 7
12 . . 1 1 20 20 C C4' C . . 1 1 20 20 C C3' C . . 1 1 20 20 C O3' O . . 1 1 21 21 G P P . -185.0 -125.0 . . . A . 20 C C4' . . A . 20 C C3' . . A . 20 C O3' . . A . 21 G P . . . 20 . C4' . . . . . 20 . C3' . . . . . 20 . O3' . . . . . 21 . P . . rr_1f79 7
13 . . 1 1 21 21 G C4' C . . 1 1 21 21 G C3' C . . 1 1 21 21 G O3' O . . 1 1 22 22 G P P . -185.0 -125.0 . . . A . 21 G C4' . . A . 21 G C3' . . A . 21 G O3' . . A . 22 G P . . . 21 . C4' . . . . . 21 . C3' . . . . . 21 . O3' . . . . . 22 . P . . rr_1f79 7
14 . . 1 1 22 22 G C4' C . . 1 1 22 22 G C3' C . . 1 1 22 22 G O3' O . . 1 1 23 23 C P P . -185.0 -125.0 . . . A . 22 G C4' . . A . 22 G C3' . . A . 22 G O3' . . A . 23 C P . . . 22 . C4' . . . . . 22 . C3' . . . . . 22 . O3' . . . . . 23 . P . . rr_1f79 7
15 . . 1 1 23 23 C C4' C . . 1 1 23 23 C C3' C . . 1 1 23 23 C O3' O . . 1 1 24 24 U P P . -185.0 -125.0 . . . A . 23 C C4' . . A . 23 C C3' . . A . 23 C O3' . . A . 24 U P . . . 23 . C4' . . . . . 23 . C3' . . . . . 23 . O3' . . . . . 24 . P . . rr_1f79 7
16 . . 1 1 24 24 U C4' C . . 1 1 24 24 U C3' C . . 1 1 24 24 U O3' O . . 1 1 25 25 U P P . -185.0 -125.0 . . . A . 24 U C4' . . A . 24 U C3' . . A . 24 U O3' . . A . 25 U P . . . 24 . C4' . . . . . 24 . C3' . . . . . 24 . O3' . . . . . 25 . P . . rr_1f79 7
17 . . 1 1 25 25 U C4' C . . 1 1 25 25 U C3' C . . 1 1 25 25 U O3' O . . 1 1 26 26 C P P . -185.0 -125.0 . . . A . 25 U C4' . . A . 25 U C3' . . A . 25 U O3' . . A . 26 C P . . . 25 . C4' . . . . . 25 . C3' . . . . . 25 . O3' . . . . . 26 . P . . rr_1f79 7
18 . . 1 1 26 26 C C4' C . . 1 1 26 26 C C3' C . . 1 1 26 26 C O3' O . . 1 1 27 27 C P P . -185.0 -125.0 . . . A . 26 C C4' . . A . 26 C C3' . . A . 26 C O3' . . A . 27 C P . . . 26 . C4' . . . . . 26 . C3' . . . . . 26 . O3' . . . . . 27 . P . . rr_1f79 7
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 "U6-C8: around bulge loop, not constrained" 12 2 12 2 rr_1f79 7
2 "C12-G16: C(UUCG) tetraloop, not constrained" 21 2 21 2 rr_1f79 7
stop_
save_
save_CNS/XPLOR_dihedral_12
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_12
_Torsion_angle_constraint_list.Entry_ID rr_1f79
_Torsion_angle_constraint_list.ID 4
_Torsion_angle_constraint_list.Details "Generated by Wattos"
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 12
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_1f79 8
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 2 2 G P P . . 1 1 2 2 G O5' O . . 1 1 2 2 G C5' C . . 1 1 2 2 G C4' C . 150.0 210.0 . . . A . 2 G P . . A . 2 G O5' . . A . 2 G C5' . . A . 2 G C4' . . . 2 . P . . . . . 2 . O5' . . . . . 2 . C5' . . . . . 2 . C4' . . rr_1f79 8
2 . . 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 . 3 A P . . A . 3 A O5' . . A . 3 A C5' . . A . 3 A C4' . . . 3 . P . . . . . 3 . O5' . . . . . 3 . C5' . . . . . 3 . C4' . . rr_1f79 8
3 . . 1 1 4 4 A P P . . 1 1 4 4 A O5' O . . 1 1 4 4 A C5' C . . 1 1 4 4 A C4' C . 150.0 210.0 . . . A . 4 A P . . A . 4 A O5' . . A . 4 A C5' . . A . 4 A C4' . . . 4 . P . . . . . 4 . O5' . . . . . 4 . C5' . . . . . 4 . C4' . . rr_1f79 8
4 . . 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 . 5 G P . . A . 5 G O5' . . A . 5 G C5' . . A . 5 G C4' . . . 5 . P . . . . . 5 . O5' . . . . . 5 . C5' . . . . . 5 . C4' . . rr_1f79 8
5 . . 1 1 6 6 U P P . . 1 1 6 6 U O5' O . . 1 1 6 6 U C5' C . . 1 1 6 6 U C4' C . 150.0 210.0 . . . A . 6 U P . . A . 6 U O5' . . A . 6 U C5' . . A . 6 U C4' . . . 6 . P . . . . . 6 . O5' . . . . . 6 . C5' . . . . . 6 . C4' . . rr_1f79 8
6 . . 1 1 7 7 U P P . . 1 1 7 7 U O5' O . . 1 1 7 7 U C5' C . . 1 1 7 7 U C4' C . -110.0 110.0 . . . A . 7 U P . . A . 7 U O5' . . A . 7 U C5' . . A . 7 U C4' . . . 7 . P . . . . . 7 . O5' . . . . . 7 . C5' . . . . . 7 . C4' . . rr_1f79 8
7 . . 1 1 8 8 C P P . . 1 1 8 8 C O5' O . . 1 1 8 8 C C5' C . . 1 1 8 8 C C4' C . -110.0 110.0 . . . A . 8 C P . . A . 8 C O5' . . A . 8 C C5' . . A . 8 C C4' . . . 8 . P . . . . . 8 . O5' . . . . . 8 . C5' . . . . . 8 . C4' . . rr_1f79 8
8 . . 1 1 9 9 G P P . . 1 1 9 9 G O5' O . . 1 1 9 9 G C5' C . . 1 1 9 9 G C4' C . 150.0 210.0 . . . A . 9 G P . . A . 9 G O5' . . A . 9 G C5' . . A . 9 G C4' . . . 9 . P . . . . . 9 . O5' . . . . . 9 . C5' . . . . . 9 . C4' . . rr_1f79 8
9 . . 1 1 10 10 G P P . . 1 1 10 10 G O5' O . . 1 1 10 10 G C5' C . . 1 1 10 10 G C4' C . 150.0 210.0 . . . A . 10 G P . . A . 10 G O5' . . A . 10 G C5' . . A . 10 G C4' . . . 10 . P . . . . . 10 . O5' . . . . . 10 . C5' . . . . . 10 . C4' . . rr_1f79 8
10 . . 1 1 11 11 U P P . . 1 1 11 11 U O5' O . . 1 1 11 11 U C5' C . . 1 1 11 11 U C4' C . 150.0 210.0 . . . A . 11 U P . . A . 11 U O5' . . A . 11 U C5' . . A . 11 U C4' . . . 11 . P . . . . . 11 . O5' . . . . . 11 . C5' . . . . . 11 . C4' . . rr_1f79 8
11 . . 1 1 17 17 G P P . . 1 1 17 17 G O5' O . . 1 1 17 17 G C5' C . . 1 1 17 17 G C4' C . -110.0 110.0 . . . A . 17 G P . . A . 17 G O5' . . A . 17 G C5' . . A . 17 G C4' . . . 17 . P . . . . . 17 . O5' . . . . . 17 . C5' . . . . . 17 . C4' . . rr_1f79 8
12 . . 1 1 18 18 A P P . . 1 1 18 18 A O5' O . . 1 1 18 18 A C5' C . . 1 1 18 18 A C4' C . 150.0 210.0 . . . A . 18 A P . . A . 18 A O5' . . A . 18 A C5' . . A . 18 A C4' . . . 18 . P . . . . . 18 . O5' . . . . . 18 . C5' . . . . . 18 . C4' . . rr_1f79 8
13 . . 1 1 19 19 C P P . . 1 1 19 19 C O5' O . . 1 1 19 19 C C5' C . . 1 1 19 19 C C4' C . 150.0 210.0 . . . A . 19 C P . . A . 19 C O5' . . A . 19 C C5' . . A . 19 C C4' . . . 19 . P . . . . . 19 . O5' . . . . . 19 . C5' . . . . . 19 . C4' . . rr_1f79 8
14 . . 1 1 20 20 C P P . . 1 1 20 20 C O5' O . . 1 1 20 20 C C5' C . . 1 1 20 20 C C4' C . 150.0 210.0 . . . A . 20 C P . . A . 20 C O5' . . A . 20 C C5' . . A . 20 C C4' . . . 20 . P . . . . . 20 . O5' . . . . . 20 . C5' . . . . . 20 . C4' . . rr_1f79 8
15 . . 1 1 21 21 G P P . . 1 1 21 21 G O5' O . . 1 1 21 21 G C5' C . . 1 1 21 21 G C4' C . 150.0 210.0 . . . A . 21 G P . . A . 21 G O5' . . A . 21 G C5' . . A . 21 G C4' . . . 21 . P . . . . . 21 . O5' . . . . . 21 . C5' . . . . . 21 . C4' . . rr_1f79 8
16 . . 1 1 22 22 G P P . . 1 1 22 22 G O5' O . . 1 1 22 22 G C5' C . . 1 1 22 22 G C4' C . 150.0 210.0 . . . A . 22 G P . . A . 22 G O5' . . A . 22 G C5' . . A . 22 G C4' . . . 22 . P . . . . . 22 . O5' . . . . . 22 . C5' . . . . . 22 . C4' . . rr_1f79 8
17 . . 1 1 23 23 C P P . . 1 1 23 23 C O5' O . . 1 1 23 23 C C5' C . . 1 1 23 23 C C4' C . 150.0 210.0 . . . A . 23 C P . . A . 23 C O5' . . A . 23 C C5' . . A . 23 C C4' . . . 23 . P . . . . . 23 . O5' . . . . . 23 . C5' . . . . . 23 . C4' . . rr_1f79 8
18 . . 1 1 24 24 U P P . . 1 1 24 24 U O5' O . . 1 1 24 24 U C5' C . . 1 1 24 24 U C4' C . 150.0 210.0 . . . A . 24 U P . . A . 24 U O5' . . A . 24 U C5' . . A . 24 U C4' . . . 24 . P . . . . . 24 . O5' . . . . . 24 . C5' . . . . . 24 . C4' . . rr_1f79 8
19 . . 1 1 25 25 U P P . . 1 1 25 25 U O5' O . . 1 1 25 25 U C5' C . . 1 1 25 25 U C4' C . 150.0 210.0 . . . A . 25 U P . . A . 25 U O5' . . A . 25 U C5' . . A . 25 U C4' . . . 25 . P . . . . . 25 . O5' . . . . . 25 . C5' . . . . . 25 . C4' . . rr_1f79 8
20 . . 1 1 26 26 C P P . . 1 1 26 26 C O5' O . . 1 1 26 26 C C5' C . . 1 1 26 26 C C4' C . 150.0 210.0 . . . A . 26 C P . . A . 26 C O5' . . A . 26 C C5' . . A . 26 C C4' . . . 26 . P . . . . . 26 . O5' . . . . . 26 . C5' . . . . . 26 . C4' . . rr_1f79 8
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 "bulge loop: U6 normal, U7,C8: 3JPH5'/H5'' observed, non trans" 10 2 10 2 rr_1f79 8
2 "end bulge" 19 2 19 2 rr_1f79 8
3 "C12-G16: C(UUCG) tetraloop, not constrained" 28 9 28 9 rr_1f79 8
4 "weak 3JPH5'/H5'' for G16, 3JPH4' for C15; C13,U13 probably trans" 29 9 29 9 rr_1f79 8
5 "G17: strong 3JPH5'/H5'', non-trans" 31 9 31 9 rr_1f79 8
6 "end of beta restraints, 20 total" 54 1 54 1 rr_1f79 8
stop_
save_
save_MR_file_comment_19
_Org_constr_file_comment.Sf_framecode MR_file_comment_19
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID rr_1f79
_Org_constr_file_comment.ID 10
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 19
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;{ end of alpha restraints, 18 total } {backbone torsion angle zeta}
{used in final stage of refinement only}
;
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_1f79
_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 23-JUN-00 1F79 *TITLE SOLUTION STRUCTURE OF RNASE P RNA (M1 RNA) P4 STEM C70U *TITLE 2 MUTANT OLIGORIBONUCLEOTIDE COMPLEXED WITH COBALT(III) *TITLE 3 HEXAMMINE, NMR, MINIMIZED AVERAGE STRUCTURE *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: RNASE P RNA RIBOZYME, P4 DOMAIN MUTANT; *COMPND 3 CHAIN: A; *COMPND 4 FRAGMENT: P4 STEM; *COMPND 5 ENGINEERED: YES; *COMPND 6 MUTATION: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 OTHER_DETAILS: SYNTHESIZED FROM DNA OLOGONUCLEOTIDE *SOURCE 4 TEMPLATE BY T7 RNA POLYMERASE *KEYWDS RIBONUCLEASE P, RIBOZYME, TRANSFER RNA PROCESSING, P4 STEM, *KEYWDS 2 C70U MUTANT, METAL BINDING SITE, METAL COMPLEX, COBALT (III) *KEYWDS 3 HEXAMMINE COMPLEX *EXPDTA NMR, MINIMIZED AVERAGE STRUCTURE *AUTHOR M.SCHMITZ, I.TINOCO JR. *REVDAT 1 09-OCT-00 1F79 0 { Combined x-plor distance and dihedral constraint file } { for P4 C7>U mutant - cobalt hexammine complex structure } {DISTANCE CONSTRAINTS FOR P4M-COHEX COMPLEX} {Last modified Oct 3 1998: NOEs up to 2'}
{Last modified May 3 1999: NOEs up to some 3'}
{Last modified May 7 1999: UUCG basepair constraint, added forgotten G10-C19}
{Last modified Jul 19 1999: fixed U6-U7 constraints, added 3' and 4'}
{Last modified Jul 20 1999: fixed U11/C12 seq. constraints}
{Last modified Jul 21 1999: fixed C19 H1'-H5 constraint}
{Last modified Jun 24 2000: prepared for PDB submission} {base pair constraints; standard WC base pair distances}
;
save_
save_MR_file_comment_5
_Org_constr_file_comment.Sf_framecode MR_file_comment_5
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID rr_1f79
_Org_constr_file_comment.ID 3
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 5
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;{end of CoHex constraints; 12 total} {end of distance restraints; 298 total} {===================================== 8< ====================================} {TORSION ANGLE CONSTRAINTS FOR P4M} {Last modified Oct 9 1998: all angles}
{Last modified Jul 24 2000: prepared for PDB submission} { enforce planarity of base amino groups }
;
save_
save_MR_file_comment_3
_Org_constr_file_comment.Sf_framecode MR_file_comment_3
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID rr_1f79
_Org_constr_file_comment.ID 2
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 3
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment "{end of base pairing constrains; 49 total} {experimental constraints}"
save_
save_MR_file_comment_9
_Org_constr_file_comment.Sf_framecode MR_file_comment_9
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID rr_1f79
_Org_constr_file_comment.ID 5
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 9
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment "{ end of ribose pucker restraints, 27 puckers total } { base chi angle constraints } {restrain some nucleotides to keep purine bases anti}"
save_
save_MR_file_comment_7
_Org_constr_file_comment.Sf_framecode MR_file_comment_7
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID rr_1f79
_Org_constr_file_comment.ID 4
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 7
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;{ end of amino planarity restraints, 20 total } { ribose pucker constraints } {Make some nucleotides c3'-endo based on 2JH1'H2''}
{modified to restrain v0, v1,v2, and v3 instead of delta}
;
save_
save_MR_file_comment_13
_Org_constr_file_comment.Sf_framecode MR_file_comment_13
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID rr_1f79
_Org_constr_file_comment.ID 7
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 13
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;{backbone torsion angle gamma}
{used in refinement only}
;
save_
save_MR_file_comment_11
_Org_constr_file_comment.Sf_framecode MR_file_comment_11
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID rr_1f79
_Org_constr_file_comment.ID 6
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 11
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;{ end of glycosidic angle restraints, 23 total } { phosphate backbone torsion angle constraints } { these constraints were used only during the refinement stage } { torsions beta through epsilon are used in a first high temperature } { dynamics stage, torsions alpha and zeta are added in for a second } { high temperature dynamics stage and final cooling } {backbone torsion angle beta}
{used in refinement only}
;
save_
save_MR_file_comment_17
_Org_constr_file_comment.Sf_framecode MR_file_comment_17
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID rr_1f79
_Org_constr_file_comment.ID 9
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 17
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;{ end of epsilon restraints, 18 total } {backbone torsion angle alpha}
{used in final stage of refinement only}
;
save_
save_MR_file_comment_15
_Org_constr_file_comment.Sf_framecode MR_file_comment_15
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID rr_1f79
_Org_constr_file_comment.ID 8
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 15
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;{ end of gamma restraints, 18 total } {backbone torsion angle epsilon}
{used in refinement only}
;
save_
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