NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
|
|
469037 |
1ad7   |
cing | 3-converted-DOCR | STAR | entry | full | 247 |
data_DOCR_restraints_with_modified_coordinates_PDB_code_1ad7
# This DOCR archive file contains, for PDB entry <1ad7>:
#
# - Coordinates and sequence information from the PDB mmCIF file
# - NMR restraints from the PDB MR file
#
# In this file, the coordinates and NMR restraints share the same atom names,
# and in this way can differ from the data deposited at the wwPDB. To achieve
# this aim, the NMR restraints were parsed from their original format files, and
# the coordinates and NMR restraints information were subsequently harmonized.
#
# Due to the complexity of this harmonization process, minor modifications could
# have occurred to the NMR restraints information, or data could have been lost
# because of parsing or conversion errors. The PDB file remains the
# authoritative reference for the atomic coordinates and the originally deposited
# restraints files remain the primary reference for these data.
#
# This file is generated at the BioMagResBank (BMRB) in collaboration with the
# PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and
# the CMBI/IMM group at the Radboud University of Nijmegen.
#
# Several software packages were used to produce this file:
#
# - Wattos (BMRB and CMBI/IMM).
# - FormatConverter and NMRStarExport (PDBe).
# - CCPN framework (http://www.ccpn.ac.uk/).
#
# More information about this process can be found in the references below.
# Please cite the original reference for this PDB entry.
#
# JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL
# Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED
# containing converted and filtered sets of experimental NMR restraints and
# coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12.
#
# WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL
# Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy:
# development of a software pipeline. Proteins 59, 687-696.
#
# JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister,
# G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for
# 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396.
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID rr_1ad7
_Entry.Title "wwPDB remediated NMR restraints for PDB entry 1ad7"
_Entry.Version_type original
_Entry.NMR_STAR_version 3.1.0.8
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype solution
_Entry.Details "Contains the remediated restraint lists and coordinates for PDB entry 1ad7"
_Entry.PDB_coordinate_file_version 3.20
loop_
_Related_entries.Database_name
_Related_entries.Database_accession_code
_Related_entries.Relationship
_Related_entries.Entry_ID
PDB 1ad7 "Master copy" rr_1ad7
stop_
save_
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID rr_1ad7
_Assembly.ID 1
_Assembly.Name 1ad7
_Assembly.Number_of_components 1
_Assembly.Organic_ligands 0
_Assembly.Metal_ions 0
_Assembly.Non_standard_bonds no
_Assembly.Paramagnetic no
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 2266.2218
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 "CONANTOXIN G" 1 $CONANTOXIN_G A . no . . . . . . rr_1ad7 1
stop_
save_
save_CONANTOXIN_G
_Entity.Sf_category entity
_Entity.Sf_framecode CONANTOXIN_G
_Entity.Entry_ID rr_1ad7
_Entity.ID 1
_Entity.Name CONANTOXIN_G
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_strand_ID A
_Entity.Polymer_seq_one_letter_code GEEELQENQELIREKSNX
_Entity.Ambiguous_conformational_states no
_Entity.Ambiguous_chem_comp_sites no
_Entity.Nstd_monomer yes
_Entity.Nstd_chirality yes
_Entity.Nstd_linkage yes
_Entity.Number_of_monomers 18
_Entity.Paramagnetic no
_Entity.Thiol_state "not present"
_Entity.Parent_entity_ID 1
_Entity.Formula_weight 2266.2218
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 . GLY . rr_1ad7 1
2 . GLU . rr_1ad7 1
3 . CGU . rr_1ad7 1
4 . CGU . rr_1ad7 1
5 . LEU . rr_1ad7 1
6 . GLN . rr_1ad7 1
7 . CGU . rr_1ad7 1
8 . ASN . rr_1ad7 1
9 . GLN . rr_1ad7 1
10 . CGU . rr_1ad7 1
11 . LEU . rr_1ad7 1
12 . ILE . rr_1ad7 1
13 . ARG . rr_1ad7 1
14 . CGU . rr_1ad7 1
15 . LYS . rr_1ad7 1
16 . SER . rr_1ad7 1
17 . ASN . rr_1ad7 1
18 . NH2 . rr_1ad7 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
. GLY 1 1 rr_1ad7 1
. GLU 2 2 rr_1ad7 1
. CGU 3 3 rr_1ad7 1
. CGU 4 4 rr_1ad7 1
. LEU 5 5 rr_1ad7 1
. GLN 6 6 rr_1ad7 1
. CGU 7 7 rr_1ad7 1
. ASN 8 8 rr_1ad7 1
. GLN 9 9 rr_1ad7 1
. CGU 10 10 rr_1ad7 1
. LEU 11 11 rr_1ad7 1
. ILE 12 12 rr_1ad7 1
. ARG 13 13 rr_1ad7 1
. CGU 14 14 rr_1ad7 1
. LYS 15 15 rr_1ad7 1
. SER 16 16 rr_1ad7 1
. ASN 17 17 rr_1ad7 1
. NH2 18 18 rr_1ad7 1
stop_
save_
save_chem_comp_CGU
_Chem_comp.Sf_category chem_comp
_Chem_comp.Sf_framecode chem_comp_CGU
_Chem_comp.Entry_ID rr_1ad7
_Chem_comp.ID CGU
_Chem_comp.Name "GAMMA-CARBOXY-GLUTAMIC ACID"
_Chem_comp.Type "L-peptide linking"
_Chem_comp.PDB_code CGU
_Chem_comp.Std_deriv_one_letter_code E
_Chem_comp.Std_deriv_three_letter_code Glu
_Chem_comp.Std_deriv_PDB_code GLU
_Chem_comp.Std_deriv_chem_comp_name "GLUTAMIC ACID"
_Chem_comp.Formal_charge 0
_Chem_comp.Paramagnetic no
_Chem_comp.Aromatic no
_Chem_comp.Formula "C6 H7 N O5"
_Chem_comp.Formula_weight 173.125
loop_
_Chem_comp_common_name.Name
_Chem_comp_common_name.Type
_Chem_comp_common_name.Entry_ID
_Chem_comp_common_name.Comp_ID
"(3S)-3-aminopropane-1,1,3-tricarboxylic acid" name rr_1ad7 CGU
stop_
save_
save_chem_comp_NH2
_Chem_comp.Sf_category chem_comp
_Chem_comp.Sf_framecode chem_comp_NH2
_Chem_comp.Entry_ID rr_1ad7
_Chem_comp.ID NH2
_Chem_comp.Name "AMINO GROUP"
_Chem_comp.Type non-polymer
_Chem_comp.PDB_code NH2
_Chem_comp.Formal_charge 0
_Chem_comp.Paramagnetic no
_Chem_comp.Aromatic no
_Chem_comp.Formula "H2 N"
_Chem_comp.Formula_weight 16.0225
save_
save_conformer_statistics
_Conformer_stat_list.Sf_category conformer_statistics
_Conformer_stat_list.Sf_framecode conformer_statistics
_Conformer_stat_list.Entry_ID rr_1ad7
_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_1ad7
_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_1ad7 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_1ad7 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 GLY C C -6.986 2.840 -10.023 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . rr_1ad7 1
. 1 . 2 . 1 1 1 GLY CA C -8.100 2.828 -11.044 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . rr_1ad7 1
. 1 . 3 . 1 1 1 GLY H1 H -8.158 4.875 -10.957 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . rr_1ad7 1
. 1 . 4 . 1 1 1 GLY H2 H -7.514 4.262 -12.385 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . rr_1ad7 1
. 1 . 5 . 1 1 1 GLY H3 H -9.173 4.204 -12.117 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . rr_1ad7 1
. 1 . 6 . 1 1 1 GLY HA2 H -9.043 2.533 -10.549 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . rr_1ad7 1
. 1 . 7 . 1 1 1 GLY HA3 H -7.884 2.060 -11.808 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . rr_1ad7 1
. 1 . 8 . 1 1 1 GLY N N -8.247 4.138 -11.671 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . rr_1ad7 1
. 1 . 9 . 1 1 1 GLY O O -6.369 3.873 -9.742 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . rr_1ad7 1
. 1 . 10 . 1 1 2 GLU C C -5.105 0.128 -8.391 . . . 1.0 . . . . . . . . . . . . A . 2 GLU C . . . . . . . . . rr_1ad7 1
. 1 . 11 . 1 1 2 GLU CA C -5.616 1.546 -8.487 . . . 1.0 . . . . . . . . . . . . A . 2 GLU CA . . . . . . . . . rr_1ad7 1
. 1 . 12 . 1 1 2 GLU CB C -6.157 2.038 -7.113 . . . 1.0 . . . . . . . . . . . . A . 2 GLU CB . . . . . . . . . rr_1ad7 1
. 1 . 13 . 1 1 2 GLU CD C -8.157 0.567 -6.163 . . . 1.0 . . . . . . . . . . . . A . 2 GLU CD . . . . . . . . . rr_1ad7 1
. 1 . 14 . 1 1 2 GLU CG C -7.687 1.857 -6.841 . . . 1.0 . . . . . . . . . . . . A . 2 GLU CG . . . . . . . . . rr_1ad7 1
. 1 . 15 . 1 1 2 GLU H H -7.261 0.839 -9.772 . . . 1.0 . . . . . . . . . . . . A . 2 GLU H . . . . . . . . . rr_1ad7 1
. 1 . 16 . 1 1 2 GLU HA H -4.773 2.189 -8.801 . . . 1.0 . . . . . . . . . . . . A . 2 GLU HA . . . . . . . . . rr_1ad7 1
. 1 . 17 . 1 1 2 GLU HB2 H -5.595 1.527 -6.308 . . . 1.0 . . . . . . . . . . . . A . 2 GLU HB2 . . . . . . . . . rr_1ad7 1
. 1 . 18 . 1 1 2 GLU HB3 H -5.893 3.107 -6.992 . . . 1.0 . . . . . . . . . . . . A . 2 GLU HB3 . . . . . . . . . rr_1ad7 1
. 1 . 19 . 1 1 2 GLU HG2 H -8.056 2.695 -6.220 . . . 1.0 . . . . . . . . . . . . A . 2 GLU HG2 . . . . . . . . . rr_1ad7 1
. 1 . 20 . 1 1 2 GLU HG3 H -8.256 1.947 -7.785 . . . 1.0 . . . . . . . . . . . . A . 2 GLU HG3 . . . . . . . . . rr_1ad7 1
. 1 . 21 . 1 1 2 GLU N N -6.690 1.668 -9.470 . . . 1.0 . . . . . . . . . . . . A . 2 GLU N . . . . . . . . . rr_1ad7 1
. 1 . 22 . 1 1 2 GLU O O -4.635 -0.320 -7.335 . . . 1.0 . . . . . . . . . . . . A . 2 GLU O . . . . . . . . . rr_1ad7 1
. 1 . 23 . 1 1 2 GLU OE1 O -7.692 -0.533 -6.430 . . . 1.0 . . . . . . . . . . . . A . 2 GLU OE1 . . . . . . . . . rr_1ad7 1
. 1 . 24 . 1 1 2 GLU OE2 O -9.137 0.760 -5.237 . . . 1.0 . . . . . . . . . . . . A . 2 GLU OE2 . . . . . . . . . rr_1ad7 1
. 1 . 25 . 1 1 3 CGU C C -3.411 -1.979 -10.432 . . . 1.0 . . . . . . . . . . . . A . 3 CGU C . . . . . . . . . rr_1ad7 1
. 1 . 26 . 1 1 3 CGU CA C -4.629 -1.962 -9.540 . . . 1.0 . . . . . . . . . . . . A . 3 CGU CA . . . . . . . . . rr_1ad7 1
. 1 . 27 . 1 1 3 CGU CB C -5.688 -2.979 -10.052 . . . 1.0 . . . . . . . . . . . . A . 3 CGU CB . . . . . . . . . rr_1ad7 1
. 1 . 28 . 1 1 3 CGU CD1 C -7.265 -4.156 -8.283 . . . 1.0 . . . . . . . . . . . . A . 3 CGU CD1 . . . . . . . . . rr_1ad7 1
. 1 . 29 . 1 1 3 CGU CD2 C -8.241 -3.035 -10.225 . . . 1.0 . . . . . . . . . . . . A . 3 CGU CD2 . . . . . . . . . rr_1ad7 1
. 1 . 30 . 1 1 3 CGU CG C -7.038 -3.021 -9.265 . . . 1.0 . . . . . . . . . . . . A . 3 CGU CG . . . . . . . . . rr_1ad7 1
. 1 . 31 . 1 1 3 CGU H H -5.748 -0.219 -10.290 . . . 1.0 . . . . . . . . . . . . A . 3 CGU H . . . . . . . . . rr_1ad7 1
. 1 . 32 . 1 1 3 CGU HA H -4.309 -2.254 -8.524 . . . 1.0 . . . . . . . . . . . . A . 3 CGU HA . . . . . . . . . rr_1ad7 1
. 1 . 33 . 1 1 3 CGU HB2 H -5.258 -4.000 -10.055 . . . 1.0 . . . . . . . . . . . . A . 3 CGU HB2 . . . . . . . . . rr_1ad7 1
. 1 . 34 . 1 1 3 CGU HB3 H -5.913 -2.777 -11.121 . . . 1.0 . . . . . . . . . . . . A . 3 CGU HB3 . . . . . . . . . rr_1ad7 1
. 1 . 35 . 1 1 3 CGU HG H -7.143 -2.153 -8.615 . . . 1.0 . . . . . . . . . . . . A . 3 CGU HG . . . . . . . . . rr_1ad7 1
. 1 . 36 . 1 1 3 CGU N N -5.218 -0.626 -9.480 . . . 1.0 . . . . . . . . . . . . A . 3 CGU N . . . . . . . . . rr_1ad7 1
. 1 . 37 . 1 1 3 CGU O O -3.188 -2.909 -11.215 . . . 1.0 . . . . . . . . . . . . A . 3 CGU O . . . . . . . . . rr_1ad7 1
. 1 . 38 . 1 1 3 CGU OE11 O -7.445 -5.289 -8.776 . . . 1.0 . . . . . . . . . . . . A . 3 CGU OE11 . . . . . . . . . rr_1ad7 1
. 1 . 39 . 1 1 3 CGU OE12 O -7.272 -3.950 -7.055 . . . 1.0 . . . . . . . . . . . . A . 3 CGU OE12 . . . . . . . . . rr_1ad7 1
. 1 . 40 . 1 1 3 CGU OE21 O -8.112 -3.572 -11.468 . . . 1.0 . . . . . . . . . . . . A . 3 CGU OE21 . . . . . . . . . rr_1ad7 1
. 1 . 41 . 1 1 3 CGU OE22 O -9.433 -2.511 -9.831 . . . 1.0 . . . . . . . . . . . . A . 3 CGU OE22 . . . . . . . . . rr_1ad7 1
. 1 . 42 . 1 1 4 CGU C C -0.210 -0.326 -10.168 . . . 1.0 . . . . . . . . . . . . A . 4 CGU C . . . . . . . . . rr_1ad7 1
. 1 . 43 . 1 1 4 CGU CA C -1.307 -0.915 -11.024 . . . 1.0 . . . . . . . . . . . . A . 4 CGU CA . . . . . . . . . rr_1ad7 1
. 1 . 44 . 1 1 4 CGU CB C -1.448 -0.108 -12.347 . . . 1.0 . . . . . . . . . . . . A . 4 CGU CB . . . . . . . . . rr_1ad7 1
. 1 . 45 . 1 1 4 CGU CD1 C -3.579 1.447 -12.568 . . . 1.0 . . . . . . . . . . . . A . 4 CGU CD1 . . . . . . . . . rr_1ad7 1
. 1 . 46 . 1 1 4 CGU CD2 C -1.358 2.350 -13.055 . . . 1.0 . . . . . . . . . . . . A . 4 CGU CD2 . . . . . . . . . rr_1ad7 1
. 1 . 47 . 1 1 4 CGU CG C -2.109 1.302 -12.214 . . . 1.0 . . . . . . . . . . . . A . 4 CGU CG . . . . . . . . . rr_1ad7 1
. 1 . 48 . 1 1 4 CGU H H -2.913 -0.139 -9.723 . . . 1.0 . . . . . . . . . . . . A . 4 CGU H . . . . . . . . . rr_1ad7 1
. 1 . 49 . 1 1 4 CGU HA H -1.024 -1.956 -11.263 . . . 1.0 . . . . . . . . . . . . A . 4 CGU HA . . . . . . . . . rr_1ad7 1
. 1 . 50 . 1 1 4 CGU HB2 H -0.455 0.018 -12.818 . . . 1.0 . . . . . . . . . . . . A . 4 CGU HB2 . . . . . . . . . rr_1ad7 1
. 1 . 51 . 1 1 4 CGU HB3 H -2.027 -0.700 -13.085 . . . 1.0 . . . . . . . . . . . . A . 4 CGU HB3 . . . . . . . . . rr_1ad7 1
. 1 . 52 . 1 1 4 CGU HG H -2.105 1.644 -11.179 . . . 1.0 . . . . . . . . . . . . A . 4 CGU HG . . . . . . . . . rr_1ad7 1
. 1 . 53 . 1 1 4 CGU N N -2.591 -0.935 -10.325 . . . 1.0 . . . . . . . . . . . . A . 4 CGU N . . . . . . . . . rr_1ad7 1
. 1 . 54 . 1 1 4 CGU O O 0.764 0.252 -10.666 . . . 1.0 . . . . . . . . . . . . A . 4 CGU O . . . . . . . . . rr_1ad7 1
. 1 . 55 . 1 1 4 CGU OE11 O -4.199 2.368 -11.997 . . . 1.0 . . . . . . . . . . . . A . 4 CGU OE11 . . . . . . . . . rr_1ad7 1
. 1 . 56 . 1 1 4 CGU OE12 O -4.123 0.672 -13.378 . . . 1.0 . . . . . . . . . . . . A . 4 CGU OE12 . . . . . . . . . rr_1ad7 1
. 1 . 57 . 1 1 4 CGU OE21 O -0.312 3.031 -12.516 . . . 1.0 . . . . . . . . . . . . A . 4 CGU OE21 . . . . . . . . . rr_1ad7 1
. 1 . 58 . 1 1 4 CGU OE22 O -1.742 2.595 -14.337 . . . 1.0 . . . . . . . . . . . . A . 4 CGU OE22 . . . . . . . . . rr_1ad7 1
. 1 . 59 . 1 1 5 LEU C C 0.651 -0.883 -6.640 . . . 1.0 . . . . . . . . . . . . A . 5 LEU C . . . . . . . . . rr_1ad7 1
. 1 . 60 . 1 1 5 LEU CA C 0.753 -0.126 -7.943 . . . 1.0 . . . . . . . . . . . . A . 5 LEU CA . . . . . . . . . rr_1ad7 1
. 1 . 61 . 1 1 5 LEU CB C 0.749 1.409 -7.695 . . . 1.0 . . . . . . . . . . . . A . 5 LEU CB . . . . . . . . . rr_1ad7 1
. 1 . 62 . 1 1 5 LEU CD1 C -0.330 3.697 -7.782 . . . 1.0 . . . . . . . . . . . . A . 5 LEU CD1 . . . . . . . . . rr_1ad7 1
. 1 . 63 . 1 1 5 LEU CD2 C -1.115 1.933 -9.389 . . . 1.0 . . . . . . . . . . . . A . 5 LEU CD2 . . . . . . . . . rr_1ad7 1
. 1 . 64 . 1 1 5 LEU CG C -0.561 2.192 -7.978 . . . 1.0 . . . . . . . . . . . . A . 5 LEU CG . . . . . . . . . rr_1ad7 1
. 1 . 65 . 1 1 5 LEU H H -1.229 -0.902 -8.506 . . . 1.0 . . . . . . . . . . . . A . 5 LEU H . . . . . . . . . rr_1ad7 1
. 1 . 66 . 1 1 5 LEU HA H 1.715 -0.424 -8.400 . . . 1.0 . . . . . . . . . . . . A . 5 LEU HA . . . . . . . . . rr_1ad7 1
. 1 . 67 . 1 1 5 LEU HB2 H 1.043 1.600 -6.643 . . . 1.0 . . . . . . . . . . . . A . 5 LEU HB2 . . . . . . . . . rr_1ad7 1
. 1 . 68 . 1 1 5 LEU HB3 H 1.561 1.864 -8.296 . . . 1.0 . . . . . . . . . . . . A . 5 LEU HB3 . . . . . . . . . rr_1ad7 1
. 1 . 69 . 1 1 5 LEU HD11 H 0.029 3.929 -6.761 . . . 1.0 . . . . . . . . . . . . A . 5 LEU HD11 . . . . . . . . . rr_1ad7 1
. 1 . 70 . 1 1 5 LEU HD12 H 0.417 4.103 -8.491 . . . 1.0 . . . . . . . . . . . . A . 5 LEU HD12 . . . . . . . . . rr_1ad7 1
. 1 . 71 . 1 1 5 LEU HD13 H -1.263 4.275 -7.925 . . . 1.0 . . . . . . . . . . . . A . 5 LEU HD13 . . . . . . . . . rr_1ad7 1
. 1 . 72 . 1 1 5 LEU HD21 H -0.377 2.164 -10.179 . . . 1.0 . . . . . . . . . . . . A . 5 LEU HD21 . . . . . . . . . rr_1ad7 1
. 1 . 73 . 1 1 5 LEU HD22 H -1.411 0.875 -9.515 . . . 1.0 . . . . . . . . . . . . A . 5 LEU HD22 . . . . . . . . . rr_1ad7 1
. 1 . 74 . 1 1 5 LEU HD23 H -2.023 2.530 -9.593 . . . 1.0 . . . . . . . . . . . . A . 5 LEU HD23 . . . . . . . . . rr_1ad7 1
. 1 . 75 . 1 1 5 LEU HG H -1.324 1.866 -7.240 . . . 1.0 . . . . . . . . . . . . A . 5 LEU HG . . . . . . . . . rr_1ad7 1
. 1 . 76 . 1 1 5 LEU N N -0.327 -0.497 -8.855 . . . 1.0 . . . . . . . . . . . . A . 5 LEU N . . . . . . . . . rr_1ad7 1
. 1 . 77 . 1 1 5 LEU O O 0.179 -0.368 -5.621 . . . 1.0 . . . . . . . . . . . . A . 5 LEU O . . . . . . . . . rr_1ad7 1
. 1 . 78 . 1 1 6 GLN C C 2.283 -2.931 -4.665 . . . 1.0 . . . . . . . . . . . . A . 6 GLN C . . . . . . . . . rr_1ad7 1
. 1 . 79 . 1 1 6 GLN CA C 1.007 -2.985 -5.470 . . . 1.0 . . . . . . . . . . . . A . 6 GLN CA . . . . . . . . . rr_1ad7 1
. 1 . 80 . 1 1 6 GLN CB C 0.703 -4.440 -5.902 . . . 1.0 . . . . . . . . . . . . A . 6 GLN CB . . . . . . . . . rr_1ad7 1
. 1 . 81 . 1 1 6 GLN CD C -1.638 -5.727 -6.001 . . . 1.0 . . . . . . . . . . . . A . 6 GLN CD . . . . . . . . . rr_1ad7 1
. 1 . 82 . 1 1 6 GLN CG C -0.683 -4.680 -6.586 . . . 1.0 . . . . . . . . . . . . A . 6 GLN CG . . . . . . . . . rr_1ad7 1
. 1 . 83 . 1 1 6 GLN H H 1.416 -2.517 -7.582 . . . 1.0 . . . . . . . . . . . . A . 6 GLN H . . . . . . . . . rr_1ad7 1
. 1 . 84 . 1 1 6 GLN HA H 0.191 -2.608 -4.826 . . . 1.0 . . . . . . . . . . . . A . 6 GLN HA . . . . . . . . . rr_1ad7 1
. 1 . 85 . 1 1 6 GLN HB2 H 1.509 -4.781 -6.585 . . . 1.0 . . . . . . . . . . . . A . 6 GLN HB2 . . . . . . . . . rr_1ad7 1
. 1 . 86 . 1 1 6 GLN HB3 H 0.780 -5.094 -5.010 . . . 1.0 . . . . . . . . . . . . A . 6 GLN HB3 . . . . . . . . . rr_1ad7 1
. 1 . 87 . 1 1 6 GLN HE21 H -0.141 -6.806 -5.306 . . . 1.0 . . . . . . . . . . . . A . 6 GLN HE21 . . . . . . . . . rr_1ad7 1
. 1 . 88 . 1 1 6 GLN HE22 H -1.863 -7.380 -4.948 . . . 1.0 . . . . . . . . . . . . A . 6 GLN HE22 . . . . . . . . . rr_1ad7 1
. 1 . 89 . 1 1 6 GLN HG2 H -1.274 -3.744 -6.594 . . . 1.0 . . . . . . . . . . . . A . 6 GLN HG2 . . . . . . . . . rr_1ad7 1
. 1 . 90 . 1 1 6 GLN HG3 H -0.542 -4.921 -7.656 . . . 1.0 . . . . . . . . . . . . A . 6 GLN HG3 . . . . . . . . . rr_1ad7 1
. 1 . 91 . 1 1 6 GLN N N 1.061 -2.147 -6.668 . . . 1.0 . . . . . . . . . . . . A . 6 GLN N . . . . . . . . . rr_1ad7 1
. 1 . 92 . 1 1 6 GLN NE2 N -1.160 -6.760 -5.355 . . . 1.0 . . . . . . . . . . . . A . 6 GLN NE2 . . . . . . . . . rr_1ad7 1
. 1 . 93 . 1 1 6 GLN O O 2.290 -3.248 -3.462 . . . 1.0 . . . . . . . . . . . . A . 6 GLN O . . . . . . . . . rr_1ad7 1
. 1 . 94 . 1 1 6 GLN OE1 O -2.847 -5.625 -6.137 . . . 1.0 . . . . . . . . . . . . A . 6 GLN OE1 . . . . . . . . . rr_1ad7 1
. 1 . 95 . 1 1 7 CGU C C 4.992 -1.438 -3.695 . . . 1.0 . . . . . . . . . . . . A . 7 CGU C . . . . . . . . . rr_1ad7 1
. 1 . 96 . 1 1 7 CGU CA C 4.688 -2.590 -4.623 . . . 1.0 . . . . . . . . . . . . A . 7 CGU CA . . . . . . . . . rr_1ad7 1
. 1 . 97 . 1 1 7 CGU CB C 5.806 -2.678 -5.710 . . . 1.0 . . . . . . . . . . . . A . 7 CGU CB . . . . . . . . . rr_1ad7 1
. 1 . 98 . 1 1 7 CGU CD1 C 5.429 -0.891 -7.627 . . . 1.0 . . . . . . . . . . . . A . 7 CGU CD1 . . . . . . . . . rr_1ad7 1
. 1 . 99 . 1 1 7 CGU CD2 C 7.682 -1.291 -6.763 . . . 1.0 . . . . . . . . . . . . A . 7 CGU CD2 . . . . . . . . . rr_1ad7 1
. 1 . 100 . 1 1 7 CGU CG C 6.190 -1.322 -6.386 . . . 1.0 . . . . . . . . . . . . A . 7 CGU CG . . . . . . . . . rr_1ad7 1
. 1 . 101 . 1 1 7 CGU H H 3.256 -2.110 -6.250 . . . 1.0 . . . . . . . . . . . . A . 7 CGU H . . . . . . . . . rr_1ad7 1
. 1 . 102 . 1 1 7 CGU HA H 4.702 -3.516 -4.013 . . . 1.0 . . . . . . . . . . . . A . 7 CGU HA . . . . . . . . . rr_1ad7 1
. 1 . 103 . 1 1 7 CGU HB2 H 5.521 -3.402 -6.496 . . . 1.0 . . . . . . . . . . . . A . 7 CGU HB2 . . . . . . . . . rr_1ad7 1
. 1 . 104 . 1 1 7 CGU HB3 H 6.719 -3.106 -5.246 . . . 1.0 . . . . . . . . . . . . A . 7 CGU HB3 . . . . . . . . . rr_1ad7 1
. 1 . 105 . 1 1 7 CGU HG H 6.000 -0.482 -5.718 . . . 1.0 . . . . . . . . . . . . A . 7 CGU HG . . . . . . . . . rr_1ad7 1
. 1 . 106 . 1 1 7 CGU N N 3.382 -2.497 -5.276 . . . 1.0 . . . . . . . . . . . . A . 7 CGU N . . . . . . . . . rr_1ad7 1
. 1 . 107 . 1 1 7 CGU O O 6.163 -1.063 -3.501 . . . 1.0 . . . . . . . . . . . . A . 7 CGU O . . . . . . . . . rr_1ad7 1
. 1 . 108 . 1 1 7 CGU OE11 O 4.534 -0.037 -7.462 . . . 1.0 . . . . . . . . . . . . A . 7 CGU OE11 . . . . . . . . . rr_1ad7 1
. 1 . 109 . 1 1 7 CGU OE12 O 5.703 -1.369 -8.745 . . . 1.0 . . . . . . . . . . . . A . 7 CGU OE12 . . . . . . . . . rr_1ad7 1
. 1 . 110 . 1 1 7 CGU OE21 O 8.581 -2.010 -6.039 . . . 1.0 . . . . . . . . . . . . A . 7 CGU OE21 . . . . . . . . . rr_1ad7 1
. 1 . 111 . 1 1 7 CGU OE22 O 8.101 -0.545 -7.820 . . . 1.0 . . . . . . . . . . . . A . 7 CGU OE22 . . . . . . . . . rr_1ad7 1
. 1 . 112 . 1 1 8 ASN C C 3.922 -0.463 -0.694 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . rr_1ad7 1
. 1 . 113 . 1 1 8 ASN CA C 4.169 0.152 -2.052 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . rr_1ad7 1
. 1 . 114 . 1 1 8 ASN CB C 3.220 1.367 -2.271 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . rr_1ad7 1
. 1 . 115 . 1 1 8 ASN CG C 3.143 1.969 -3.676 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . rr_1ad7 1
. 1 . 116 . 1 1 8 ASN H H 3.009 -1.065 -3.464 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . rr_1ad7 1
. 1 . 117 . 1 1 8 ASN HA H 5.223 0.487 -2.078 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . rr_1ad7 1
. 1 . 118 . 1 1 8 ASN HB2 H 2.193 1.119 -1.937 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . rr_1ad7 1
. 1 . 119 . 1 1 8 ASN HB3 H 3.538 2.176 -1.584 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . rr_1ad7 1
. 1 . 120 . 1 1 8 ASN HD21 H 4.846 2.962 -3.411 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . rr_1ad7 1
. 1 . 121 . 1 1 8 ASN HD22 H 3.956 3.109 -5.024 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . rr_1ad7 1
. 1 . 122 . 1 1 8 ASN N N 3.968 -0.827 -3.114 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . rr_1ad7 1
. 1 . 123 . 1 1 8 ASN ND2 N 4.069 2.810 -4.052 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . rr_1ad7 1
. 1 . 124 . 1 1 8 ASN O O 2.981 -0.114 0.025 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . rr_1ad7 1
. 1 . 125 . 1 1 8 ASN OD1 O 2.233 1.708 -4.451 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . rr_1ad7 1
. 1 . 126 . 1 1 9 GLN C C 5.522 -1.545 2.037 . . . 1.0 . . . . . . . . . . . . A . 9 GLN C . . . . . . . . . rr_1ad7 1
. 1 . 127 . 1 1 9 GLN CA C 4.639 -2.104 0.948 . . . 1.0 . . . . . . . . . . . . A . 9 GLN CA . . . . . . . . . rr_1ad7 1
. 1 . 128 . 1 1 9 GLN CB C 4.952 -3.598 0.697 . . . 1.0 . . . . . . . . . . . . A . 9 GLN CB . . . . . . . . . rr_1ad7 1
. 1 . 129 . 1 1 9 GLN CD C 2.549 -4.753 0.525 . . . 1.0 . . . . . . . . . . . . A . 9 GLN CD . . . . . . . . . rr_1ad7 1
. 1 . 130 . 1 1 9 GLN CG C 3.889 -4.394 -0.130 . . . 1.0 . . . . . . . . . . . . A . 9 GLN CG . . . . . . . . . rr_1ad7 1
. 1 . 131 . 1 1 9 GLN H H 5.616 -1.559 -0.945 . . . 1.0 . . . . . . . . . . . . A . 9 GLN H . . . . . . . . . rr_1ad7 1
. 1 . 132 . 1 1 9 GLN HA H 3.590 -1.991 1.276 . . . 1.0 . . . . . . . . . . . . A . 9 GLN HA . . . . . . . . . rr_1ad7 1
. 1 . 133 . 1 1 9 GLN HB2 H 5.935 -3.671 0.187 . . . 1.0 . . . . . . . . . . . . A . 9 GLN HB2 . . . . . . . . . rr_1ad7 1
. 1 . 134 . 1 1 9 GLN HB3 H 5.089 -4.102 1.673 . . . 1.0 . . . . . . . . . . . . A . 9 GLN HB3 . . . . . . . . . rr_1ad7 1
. 1 . 135 . 1 1 9 GLN HE21 H 1.530 -3.877 -0.918 . . . 1.0 . . . . . . . . . . . . A . 9 GLN HE21 . . . . . . . . . rr_1ad7 1
. 1 . 136 . 1 1 9 GLN HE22 H 0.582 -4.612 0.490 . . . 1.0 . . . . . . . . . . . . A . 9 GLN HE22 . . . . . . . . . rr_1ad7 1
. 1 . 137 . 1 1 9 GLN HG2 H 3.606 -3.836 -1.044 . . . 1.0 . . . . . . . . . . . . A . 9 GLN HG2 . . . . . . . . . rr_1ad7 1
. 1 . 138 . 1 1 9 GLN HG3 H 4.333 -5.332 -0.513 . . . 1.0 . . . . . . . . . . . . A . 9 GLN HG3 . . . . . . . . . rr_1ad7 1
. 1 . 139 . 1 1 9 GLN N N 4.803 -1.381 -0.310 . . . 1.0 . . . . . . . . . . . . A . 9 GLN N . . . . . . . . . rr_1ad7 1
. 1 . 140 . 1 1 9 GLN NE2 N 1.426 -4.406 -0.050 . . . 1.0 . . . . . . . . . . . . A . 9 GLN NE2 . . . . . . . . . rr_1ad7 1
. 1 . 141 . 1 1 9 GLN O O 5.883 -2.245 2.996 . . . 1.0 . . . . . . . . . . . . A . 9 GLN O . . . . . . . . . rr_1ad7 1
. 1 . 142 . 1 1 9 GLN OE1 O 2.506 -5.360 1.584 . . . 1.0 . . . . . . . . . . . . A . 9 GLN OE1 . . . . . . . . . rr_1ad7 1
. 1 . 143 . 1 1 10 CGU C C 5.686 1.194 3.887 . . . 1.0 . . . . . . . . . . . . A . 10 CGU C . . . . . . . . . rr_1ad7 1
. 1 . 144 . 1 1 10 CGU CA C 6.624 0.400 3.001 . . . 1.0 . . . . . . . . . . . . A . 10 CGU CA . . . . . . . . . rr_1ad7 1
. 1 . 145 . 1 1 10 CGU CB C 7.733 1.340 2.443 . . . 1.0 . . . . . . . . . . . . A . 10 CGU CB . . . . . . . . . rr_1ad7 1
. 1 . 146 . 1 1 10 CGU CD1 C 8.446 3.125 0.629 . . . 1.0 . . . . . . . . . . . . A . 10 CGU CD1 . . . . . . . . . rr_1ad7 1
. 1 . 147 . 1 1 10 CGU CD2 C 6.154 3.112 1.486 . . . 1.0 . . . . . . . . . . . . A . 10 CGU CD2 . . . . . . . . . rr_1ad7 1
. 1 . 148 . 1 1 10 CGU CG C 7.373 2.215 1.200 . . . 1.0 . . . . . . . . . . . . A . 10 CGU CG . . . . . . . . . rr_1ad7 1
. 1 . 149 . 1 1 10 CGU H H 5.749 0.173 0.979 . . . 1.0 . . . . . . . . . . . . A . 10 CGU H . . . . . . . . . rr_1ad7 1
. 1 . 150 . 1 1 10 CGU HA H 7.096 -0.374 3.633 . . . 1.0 . . . . . . . . . . . . A . 10 CGU HA . . . . . . . . . rr_1ad7 1
. 1 . 151 . 1 1 10 CGU HB2 H 8.039 2.049 3.263 . . . 1.0 . . . . . . . . . . . . A . 10 CGU HB2 . . . . . . . . . rr_1ad7 1
. 1 . 152 . 1 1 10 CGU HB3 H 8.669 0.778 2.244 . . . 1.0 . . . . . . . . . . . . A . 10 CGU HB3 . . . . . . . . . rr_1ad7 1
. 1 . 153 . 1 1 10 CGU HG H 7.131 1.604 0.330 . . . 1.0 . . . . . . . . . . . . A . 10 CGU HG . . . . . . . . . rr_1ad7 1
. 1 . 154 . 1 1 10 CGU N N 5.929 -0.282 1.906 . . . 1.0 . . . . . . . . . . . . A . 10 CGU N . . . . . . . . . rr_1ad7 1
. 1 . 155 . 1 1 10 CGU O O 6.031 1.549 5.025 . . . 1.0 . . . . . . . . . . . . A . 10 CGU O . . . . . . . . . rr_1ad7 1
. 1 . 156 . 1 1 10 CGU OE11 O 8.052 4.089 -0.057 . . . 1.0 . . . . . . . . . . . . A . 10 CGU OE11 . . . . . . . . . rr_1ad7 1
. 1 . 157 . 1 1 10 CGU OE12 O 9.654 2.894 0.832 . . . 1.0 . . . . . . . . . . . . A . 10 CGU OE12 . . . . . . . . . rr_1ad7 1
. 1 . 158 . 1 1 10 CGU OE21 O 5.208 3.296 0.527 . . . 1.0 . . . . . . . . . . . . A . 10 CGU OE21 . . . . . . . . . rr_1ad7 1
. 1 . 159 . 1 1 10 CGU OE22 O 6.025 3.719 2.696 . . . 1.0 . . . . . . . . . . . . A . 10 CGU OE22 . . . . . . . . . rr_1ad7 1
. 1 . 160 . 1 1 11 LEU C C 2.400 1.436 4.651 . . . 1.0 . . . . . . . . . . . . A . 11 LEU C . . . . . . . . . rr_1ad7 1
. 1 . 161 . 1 1 11 LEU CA C 3.534 2.303 4.157 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CA . . . . . . . . . rr_1ad7 1
. 1 . 162 . 1 1 11 LEU CB C 2.978 3.481 3.301 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CB . . . . . . . . . rr_1ad7 1
. 1 . 163 . 1 1 11 LEU CD1 C 3.910 5.454 4.583 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD1 . . . . . . . . . rr_1ad7 1
. 1 . 164 . 1 1 11 LEU CD2 C 1.898 5.814 3.122 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD2 . . . . . . . . . rr_1ad7 1
. 1 . 165 . 1 1 11 LEU CG C 2.633 4.810 4.024 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CG . . . . . . . . . rr_1ad7 1
. 1 . 166 . 1 1 11 LEU H H 4.308 1.244 2.395 . . . 1.0 . . . . . . . . . . . . A . 11 LEU H . . . . . . . . . rr_1ad7 1
. 1 . 167 . 1 1 11 LEU HA H 4.040 2.697 5.057 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HA . . . . . . . . . rr_1ad7 1
. 1 . 168 . 1 1 11 LEU HB2 H 3.691 3.696 2.480 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB2 . . . . . . . . . rr_1ad7 1
. 1 . 169 . 1 1 11 LEU HB3 H 2.064 3.118 2.783 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB3 . . . . . . . . . rr_1ad7 1
. 1 . 170 . 1 1 11 LEU HD11 H 4.808 5.131 4.022 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD11 . . . . . . . . . rr_1ad7 1
. 1 . 171 . 1 1 11 LEU HD12 H 3.878 6.558 4.517 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD12 . . . . . . . . . rr_1ad7 1
. 1 . 172 . 1 1 11 LEU HD13 H 4.080 5.194 5.646 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD13 . . . . . . . . . rr_1ad7 1
. 1 . 173 . 1 1 11 LEU HD21 H 1.237 5.309 2.394 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD21 . . . . . . . . . rr_1ad7 1
. 1 . 174 . 1 1 11 LEU HD22 H 1.278 6.523 3.703 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD22 . . . . . . . . . rr_1ad7 1
. 1 . 175 . 1 1 11 LEU HD23 H 2.610 6.413 2.525 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD23 . . . . . . . . . rr_1ad7 1
. 1 . 176 . 1 1 11 LEU HG H 1.972 4.571 4.886 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HG . . . . . . . . . rr_1ad7 1
. 1 . 177 . 1 1 11 LEU N N 4.506 1.536 3.382 . . . 1.0 . . . . . . . . . . . . A . 11 LEU N . . . . . . . . . rr_1ad7 1
. 1 . 178 . 1 1 11 LEU O O 1.840 1.644 5.731 . . . 1.0 . . . . . . . . . . . . A . 11 LEU O . . . . . . . . . rr_1ad7 1
. 1 . 179 . 1 1 12 ILE C C 1.134 -1.591 4.869 . . . 1.0 . . . . . . . . . . . . A . 12 ILE C . . . . . . . . . rr_1ad7 1
. 1 . 180 . 1 1 12 ILE CA C 0.812 -0.327 4.108 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CA . . . . . . . . . rr_1ad7 1
. 1 . 181 . 1 1 12 ILE CB C 0.012 -0.635 2.776 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CB . . . . . . . . . rr_1ad7 1
. 1 . 182 . 1 1 12 ILE CD1 C -0.883 0.342 0.504 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CD1 . . . . . . . . . rr_1ad7 1
. 1 . 183 . 1 1 12 ILE CG1 C -0.315 0.623 1.910 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG1 . . . . . . . . . rr_1ad7 1
. 1 . 184 . 1 1 12 ILE CG2 C -1.319 -1.407 3.036 . . . 1.0 . . . . . . . . . . . . A . 12 ILE CG2 . . . . . . . . . rr_1ad7 1
. 1 . 185 . 1 1 12 ILE H H 2.610 0.285 2.987 . . . 1.0 . . . . . . . . . . . . A . 12 ILE H . . . . . . . . . rr_1ad7 1
. 1 . 186 . 1 1 12 ILE HA H 0.163 0.279 4.769 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HA . . . . . . . . . rr_1ad7 1
. 1 . 187 . 1 1 12 ILE HB H 0.663 -1.290 2.158 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HB . . . . . . . . . rr_1ad7 1
. 1 . 188 . 1 1 12 ILE HD11 H -0.442 -0.570 0.058 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD11 . . . . . . . . . rr_1ad7 1
. 1 . 189 . 1 1 12 ILE HD12 H -1.980 0.210 0.509 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD12 . . . . . . . . . rr_1ad7 1
. 1 . 190 . 1 1 12 ILE HD13 H -0.670 1.177 -0.188 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HD13 . . . . . . . . . rr_1ad7 1
. 1 . 191 . 1 1 12 ILE HG12 H -0.986 1.306 2.465 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG12 . . . . . . . . . rr_1ad7 1
. 1 . 192 . 1 1 12 ILE HG13 H 0.609 1.212 1.751 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG13 . . . . . . . . . rr_1ad7 1
. 1 . 193 . 1 1 12 ILE HG21 H -1.641 -1.348 4.091 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG21 . . . . . . . . . rr_1ad7 1
. 1 . 194 . 1 1 12 ILE HG22 H -2.175 -1.003 2.466 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG22 . . . . . . . . . rr_1ad7 1
. 1 . 195 . 1 1 12 ILE HG23 H -1.234 -2.481 2.784 . . . 1.0 . . . . . . . . . . . . A . 12 ILE HG23 . . . . . . . . . rr_1ad7 1
. 1 . 196 . 1 1 12 ILE N N 2.012 0.459 3.833 . . . 1.0 . . . . . . . . . . . . A . 12 ILE N . . . . . . . . . rr_1ad7 1
. 1 . 197 . 1 1 12 ILE O O 0.651 -2.684 4.561 . . . 1.0 . . . . . . . . . . . . A . 12 ILE O . . . . . . . . . rr_1ad7 1
. 1 . 198 . 1 1 13 ARG C C 1.128 -2.705 7.787 . . . 1.0 . . . . . . . . . . . . A . 13 ARG C . . . . . . . . . rr_1ad7 1
. 1 . 199 . 1 1 13 ARG CA C 2.259 -2.556 6.800 . . . 1.0 . . . . . . . . . . . . A . 13 ARG CA . . . . . . . . . rr_1ad7 1
. 1 . 200 . 1 1 13 ARG CB C 3.624 -2.303 7.501 . . . 1.0 . . . . . . . . . . . . A . 13 ARG CB . . . . . . . . . rr_1ad7 1
. 1 . 201 . 1 1 13 ARG CD C 5.240 -0.917 6.035 . . . 1.0 . . . . . . . . . . . . A . 13 ARG CD . . . . . . . . . rr_1ad7 1
. 1 . 202 . 1 1 13 ARG CG C 4.860 -2.306 6.564 . . . 1.0 . . . . . . . . . . . . A . 13 ARG CG . . . . . . . . . rr_1ad7 1
. 1 . 203 . 1 1 13 ARG CZ C 6.078 0.608 7.834 . . . 1.0 . . . . . . . . . . . . A . 13 ARG CZ . . . . . . . . . rr_1ad7 1
. 1 . 204 . 1 1 13 ARG H H 2.501 -0.544 5.948 . . . 1.0 . . . . . . . . . . . . A . 13 ARG H . . . . . . . . . rr_1ad7 1
. 1 . 205 . 1 1 13 ARG HA H 2.313 -3.497 6.218 . . . 1.0 . . . . . . . . . . . . A . 13 ARG HA . . . . . . . . . rr_1ad7 1
. 1 . 206 . 1 1 13 ARG HB2 H 3.604 -1.336 8.040 . . . 1.0 . . . . . . . . . . . . A . 13 ARG HB2 . . . . . . . . . rr_1ad7 1
. 1 . 207 . 1 1 13 ARG HB3 H 3.766 -3.061 8.304 . . . 1.0 . . . . . . . . . . . . A . 13 ARG HB3 . . . . . . . . . rr_1ad7 1
. 1 . 208 . 1 1 13 ARG HD2 H 5.649 -1.006 4.998 . . . 1.0 . . . . . . . . . . . . A . 13 ARG HD2 . . . . . . . . . rr_1ad7 1
. 1 . 209 . 1 1 13 ARG HD3 H 4.363 -0.243 5.968 . . . 1.0 . . . . . . . . . . . . A . 13 ARG HD3 . . . . . . . . . rr_1ad7 1
. 1 . 210 . 1 1 13 ARG HE H 7.230 -0.726 6.852 . . . 1.0 . . . . . . . . . . . . A . 13 ARG HE . . . . . . . . . rr_1ad7 1
. 1 . 211 . 1 1 13 ARG HG2 H 5.751 -2.722 7.096 . . . 1.0 . . . . . . . . . . . . A . 13 ARG HG2 . . . . . . . . . rr_1ad7 1
. 1 . 212 . 1 1 13 ARG HG3 H 4.704 -2.995 5.708 . . . 1.0 . . . . . . . . . . . . A . 13 ARG HG3 . . . . . . . . . rr_1ad7 1
. 1 . 213 . 1 1 13 ARG HH11 H 4.149 0.664 7.623 . . . 1.0 . . . . . . . . . . . . A . 13 ARG HH11 . . . . . . . . . rr_1ad7 1
. 1 . 214 . 1 1 13 ARG HH12 H 4.899 1.892 8.780 . . . 1.0 . . . . . . . . . . . . A . 13 ARG HH12 . . . . . . . . . rr_1ad7 1
. 1 . 215 . 1 1 13 ARG HH21 H 7.965 0.576 8.179 . . . 1.0 . . . . . . . . . . . . A . 13 ARG HH21 . . . . . . . . . rr_1ad7 1
. 1 . 216 . 1 1 13 ARG HH22 H 6.962 1.783 9.158 . . . 1.0 . . . . . . . . . . . . A . 13 ARG HH22 . . . . . . . . . rr_1ad7 1
. 1 . 217 . 1 1 13 ARG N N 2.002 -1.462 5.869 . . . 1.0 . . . . . . . . . . . . A . 13 ARG N . . . . . . . . . rr_1ad7 1
. 1 . 218 . 1 1 13 ARG NE N 6.276 -0.345 6.934 . . . 1.0 . . . . . . . . . . . . A . 13 ARG NE . . . . . . . . . rr_1ad7 1
. 1 . 219 . 1 1 13 ARG NH1 N 4.917 1.120 8.116 . . . 1.0 . . . . . . . . . . . . A . 13 ARG NH1 . . . . . . . . . rr_1ad7 1
. 1 . 220 . 1 1 13 ARG NH2 N 7.107 1.049 8.468 . . . 1.0 . . . . . . . . . . . . A . 13 ARG NH2 . . . . . . . . . rr_1ad7 1
. 1 . 221 . 1 1 13 ARG O O 0.776 -3.827 8.197 . . . 1.0 . . . . . . . . . . . . A . 13 ARG O . . . . . . . . . rr_1ad7 1
. 1 . 222 . 1 1 14 CGU C C -1.706 -0.680 8.454 . . . 1.0 . . . . . . . . . . . . A . 14 CGU C . . . . . . . . . rr_1ad7 1
. 1 . 223 . 1 1 14 CGU CA C -0.695 -1.644 9.024 . . . 1.0 . . . . . . . . . . . . A . 14 CGU CA . . . . . . . . . rr_1ad7 1
. 1 . 224 . 1 1 14 CGU CB C -0.357 -1.287 10.499 . . . 1.0 . . . . . . . . . . . . A . 14 CGU CB . . . . . . . . . rr_1ad7 1
. 1 . 225 . 1 1 14 CGU CD1 C 2.145 -0.414 10.526 . . . 1.0 . . . . . . . . . . . . A . 14 CGU CD1 . . . . . . . . . rr_1ad7 1
. 1 . 226 . 1 1 14 CGU CD2 C 0.508 0.547 12.067 . . . 1.0 . . . . . . . . . . . . A . 14 CGU CD2 . . . . . . . . . rr_1ad7 1
. 1 . 227 . 1 1 14 CGU CG C 0.666 -0.114 10.687 . . . 1.0 . . . . . . . . . . . . A . 14 CGU CG . . . . . . . . . rr_1ad7 1
. 1 . 228 . 1 1 14 CGU H H 0.988 -0.686 7.978 . . . 1.0 . . . . . . . . . . . . A . 14 CGU H . . . . . . . . . rr_1ad7 1
. 1 . 229 . 1 1 14 CGU HA H -1.080 -2.680 8.985 . . . 1.0 . . . . . . . . . . . . A . 14 CGU HA . . . . . . . . . rr_1ad7 1
. 1 . 230 . 1 1 14 CGU HB2 H 0.057 -2.180 11.014 . . . 1.0 . . . . . . . . . . . . A . 14 CGU HB2 . . . . . . . . . rr_1ad7 1
. 1 . 231 . 1 1 14 CGU HB3 H -1.270 -1.042 11.079 . . . 1.0 . . . . . . . . . . . . A . 14 CGU HB3 . . . . . . . . . rr_1ad7 1
. 1 . 232 . 1 1 14 CGU HG H 0.521 0.657 9.931 . . . 1.0 . . . . . . . . . . . . A . 14 CGU HG . . . . . . . . . rr_1ad7 1
. 1 . 233 . 1 1 14 CGU N N 0.536 -1.600 8.222 . . . 1.0 . . . . . . . . . . . . A . 14 CGU N . . . . . . . . . rr_1ad7 1
. 1 . 234 . 1 1 14 CGU O O -1.318 0.396 7.938 . . . 1.0 . . . . . . . . . . . . A . 14 CGU O . . . . . . . . . rr_1ad7 1
. 1 . 235 . 1 1 14 CGU OE11 O 2.514 -1.572 10.813 . . . 1.0 . . . . . . . . . . . . A . 14 CGU OE11 . . . . . . . . . rr_1ad7 1
. 1 . 236 . 1 1 14 CGU OE12 O 2.934 0.458 10.112 . . . 1.0 . . . . . . . . . . . . A . 14 CGU OE12 . . . . . . . . . rr_1ad7 1
. 1 . 237 . 1 1 14 CGU OE21 O -0.550 1.365 12.313 . . . 1.0 . . . . . . . . . . . . A . 14 CGU OE21 . . . . . . . . . rr_1ad7 1
. 1 . 238 . 1 1 14 CGU OE22 O 1.428 0.316 13.042 . . . 1.0 . . . . . . . . . . . . A . 14 CGU OE22 . . . . . . . . . rr_1ad7 1
. 1 . 239 . 1 1 15 LYS C C -4.879 0.586 8.824 . . . 1.0 . . . . . . . . . . . . A . 15 LYS C . . . . . . . . . rr_1ad7 1
. 1 . 240 . 1 1 15 LYS CA C -4.004 -0.154 7.841 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CA . . . . . . . . . rr_1ad7 1
. 1 . 241 . 1 1 15 LYS CB C -4.854 -1.069 6.918 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CB . . . . . . . . . rr_1ad7 1
. 1 . 242 . 1 1 15 LYS CD C -5.204 -1.427 4.365 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CD . . . . . . . . . rr_1ad7 1
. 1 . 243 . 1 1 15 LYS CE C -6.423 -2.345 4.527 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CE . . . . . . . . . rr_1ad7 1
. 1 . 244 . 1 1 15 LYS CG C -5.148 -0.439 5.533 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CG . . . . . . . . . rr_1ad7 1
. 1 . 245 . 1 1 15 LYS H H -3.277 -1.779 9.133 . . . 1.0 . . . . . . . . . . . . A . 15 LYS H . . . . . . . . . rr_1ad7 1
. 1 . 246 . 1 1 15 LYS HA H -3.480 0.603 7.228 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HA . . . . . . . . . rr_1ad7 1
. 1 . 247 . 1 1 15 LYS HB2 H -4.342 -2.045 6.786 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB2 . . . . . . . . . rr_1ad7 1
. 1 . 248 . 1 1 15 LYS HB3 H -5.813 -1.315 7.415 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB3 . . . . . . . . . rr_1ad7 1
. 1 . 249 . 1 1 15 LYS HD2 H -5.242 -0.871 3.406 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD2 . . . . . . . . . rr_1ad7 1
. 1 . 250 . 1 1 15 LYS HD3 H -4.272 -2.029 4.338 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD3 . . . . . . . . . rr_1ad7 1
. 1 . 251 . 1 1 15 LYS HE2 H -6.861 -2.238 5.541 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE2 . . . . . . . . . rr_1ad7 1
. 1 . 252 . 1 1 15 LYS HE3 H -7.231 -2.065 3.819 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE3 . . . . . . . . . rr_1ad7 1
. 1 . 253 . 1 1 15 LYS HG2 H -6.090 0.143 5.582 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG2 . . . . . . . . . rr_1ad7 1
. 1 . 254 . 1 1 15 LYS HG3 H -4.361 0.298 5.276 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG3 . . . . . . . . . rr_1ad7 1
. 1 . 255 . 1 1 15 LYS HZ1 H -5.071 -3.895 4.657 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ1 . . . . . . . . . rr_1ad7 1
. 1 . 256 . 1 1 15 LYS HZ2 H -6.680 -4.377 4.754 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ2 . . . . . . . . . rr_1ad7 1
. 1 . 257 . 1 1 15 LYS HZ3 H -6.024 -3.930 3.271 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ3 . . . . . . . . . rr_1ad7 1
. 1 . 258 . 1 1 15 LYS N N -3.001 -0.960 8.538 . . . 1.0 . . . . . . . . . . . . A . 15 LYS N . . . . . . . . . rr_1ad7 1
. 1 . 259 . 1 1 15 LYS NZ N -6.019 -3.742 4.284 . . . 1.0 . . . . . . . . . . . . A . 15 LYS NZ . . . . . . . . . rr_1ad7 1
. 1 . 260 . 1 1 15 LYS O O -6.110 0.492 8.806 . . . 1.0 . . . . . . . . . . . . A . 15 LYS O . . . . . . . . . rr_1ad7 1
. 1 . 261 . 1 1 16 SER C C -4.306 3.603 10.658 . . . 1.0 . . . . . . . . . . . . A . 16 SER C . . . . . . . . . rr_1ad7 1
. 1 . 262 . 1 1 16 SER CA C -4.972 2.248 10.600 . . . 1.0 . . . . . . . . . . . . A . 16 SER CA . . . . . . . . . rr_1ad7 1
. 1 . 263 . 1 1 16 SER CB C -5.121 1.617 12.007 . . . 1.0 . . . . . . . . . . . . A . 16 SER CB . . . . . . . . . rr_1ad7 1
. 1 . 264 . 1 1 16 SER H H -3.194 1.280 9.729 . . . 1.0 . . . . . . . . . . . . A . 16 SER H . . . . . . . . . rr_1ad7 1
. 1 . 265 . 1 1 16 SER HA H -5.982 2.406 10.180 . . . 1.0 . . . . . . . . . . . . A . 16 SER HA . . . . . . . . . rr_1ad7 1
. 1 . 266 . 1 1 16 SER HB2 H -4.842 0.544 11.994 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB2 . . . . . . . . . rr_1ad7 1
. 1 . 267 . 1 1 16 SER HB3 H -4.404 2.088 12.707 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB3 . . . . . . . . . rr_1ad7 1
. 1 . 268 . 1 1 16 SER HG H -6.590 2.697 12.696 . . . 1.0 . . . . . . . . . . . . A . 16 SER HG . . . . . . . . . rr_1ad7 1
. 1 . 269 . 1 1 16 SER N N -4.243 1.351 9.706 . . . 1.0 . . . . . . . . . . . . A . 16 SER N . . . . . . . . . rr_1ad7 1
. 1 . 270 . 1 1 16 SER O O -4.953 4.653 10.602 . . . 1.0 . . . . . . . . . . . . A . 16 SER O . . . . . . . . . rr_1ad7 1
. 1 . 271 . 1 1 16 SER OG O -6.440 1.759 12.546 . . . 1.0 . . . . . . . . . . . . A . 16 SER OG . . . . . . . . . rr_1ad7 1
. 1 . 272 . 1 1 17 ASN C C -1.353 4.817 9.369 . . . 1.0 . . . . . . . . . . . . A . 17 ASN C . . . . . . . . . rr_1ad7 1
. 1 . 273 . 1 1 17 ASN CA C -2.199 4.826 10.622 . . . 1.0 . . . . . . . . . . . . A . 17 ASN CA . . . . . . . . . rr_1ad7 1
. 1 . 274 . 1 1 17 ASN CB C -1.308 4.992 11.888 . . . 1.0 . . . . . . . . . . . . A . 17 ASN CB . . . . . . . . . rr_1ad7 1
. 1 . 275 . 1 1 17 ASN CG C -0.699 6.376 12.133 . . . 1.0 . . . . . . . . . . . . A . 17 ASN CG . . . . . . . . . rr_1ad7 1
. 1 . 276 . 1 1 17 ASN H H -2.516 2.660 10.879 . . . 1.0 . . . . . . . . . . . . A . 17 ASN H . . . . . . . . . rr_1ad7 1
. 1 . 277 . 1 1 17 ASN HA H -2.898 5.679 10.539 . . . 1.0 . . . . . . . . . . . . A . 17 ASN HA . . . . . . . . . rr_1ad7 1
. 1 . 278 . 1 1 17 ASN HB2 H -1.899 4.740 12.790 . . . 1.0 . . . . . . . . . . . . A . 17 ASN HB2 . . . . . . . . . rr_1ad7 1
. 1 . 279 . 1 1 17 ASN HB3 H -0.489 4.249 11.882 . . . 1.0 . . . . . . . . . . . . A . 17 ASN HB3 . . . . . . . . . rr_1ad7 1
. 1 . 280 . 1 1 17 ASN HD21 H 0.899 5.582 13.015 . . . 1.0 . . . . . . . . . . . . A . 17 ASN HD21 . . . . . . . . . rr_1ad7 1
. 1 . 281 . 1 1 17 ASN HD22 H 0.786 7.417 12.832 . . . 1.0 . . . . . . . . . . . . A . 17 ASN HD22 . . . . . . . . . rr_1ad7 1
. 1 . 282 . 1 1 17 ASN N N -2.978 3.595 10.733 . . . 1.0 . . . . . . . . . . . . A . 17 ASN N . . . . . . . . . rr_1ad7 1
. 1 . 283 . 1 1 17 ASN ND2 N 0.435 6.458 12.776 . . . 1.0 . . . . . . . . . . . . A . 17 ASN ND2 . . . . . . . . . rr_1ad7 1
. 1 . 284 . 1 1 17 ASN O O -0.131 4.622 9.423 . . . 1.0 . . . . . . . . . . . . A . 17 ASN O . . . . . . . . . rr_1ad7 1
. 1 . 285 . 1 1 17 ASN OD1 O -1.235 7.404 11.747 . . . 1.0 . . . . . . . . . . . . A . 17 ASN OD1 . . . . . . . . . rr_1ad7 1
. 1 . 286 . 1 1 18 NH2 HN1 H -2.970 5.470 8.321 . . . 1.0 . . . . . . . . . . . . A . 18 NH2 HN1 . . . . . . . . . rr_1ad7 1
. 1 . 287 . 1 1 18 NH2 HN2 H -1.786 4.544 7.368 . . . 1.0 . . . . . . . . . . . . A . 18 NH2 HN2 . . . . . . . . . rr_1ad7 1
. 1 . 288 . 1 1 18 NH2 N N -2.001 5.078 8.242 . . . 1.0 . . . . . . . . . . . . A . 18 NH2 N . . . . . . . . . rr_1ad7 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_1ad7
_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 1ad7.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_1ad7 1
1 1ad7.mr . . DISCOVER 2 distance NOE simple 242 rr_1ad7 1
1 1ad7.mr . . n/a 3 comment "Not applicable" "Not applicable" 0 rr_1ad7 1
1 1ad7.mr . . DISCOVER 4 "dihedral angle" "Not applicable" "Not applicable" 13 rr_1ad7 1
1 1ad7.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_1ad7 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_1ad7
_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: '1ad7'" . . . . distance "general distance" . 234 rr_1ad7 1
2 "From CCPN project: '1ad7'" . . . . "dihedral angle" "Not applicable" . 13 rr_1ad7 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 1ad7.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_1ad7 1
1 1ad7.mr . . DISCOVER 2 distance NOE simple 242 rr_1ad7 1
1 1ad7.mr . . n/a 3 comment "Not applicable" "Not applicable" 0 rr_1ad7 1
1 1ad7.mr . . DISCOVER 4 "dihedral angle" "Not applicable" "Not applicable" 13 rr_1ad7 1
1 1ad7.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_1ad7 1
stop_
save_
save_Discover_distance_constraints_2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode Discover_distance_constraints_2
_Gen_dist_constraint_list.Entry_ID rr_1ad7
_Gen_dist_constraint_list.ID 1
_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 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_1ad7 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 2 2 GLU H H . . . 1 1 2 2 GLU HA H . . . . . 2.7 2.2 3.2 . . . . . A . 2 GLU H . . A . 2 GLU HA . 1 . 2 GLU- HN . . . 1 . 2 GLU- HA . . rr_1ad7 1
2 1 . . 1 1 2 2 GLU H H . . . 1 1 2 2 GLU HB2 H . . . . . 2.8 2.2 3.9 . . . . . A . 2 GLU H . . A . 2 GLU HB2 . 1 . 2 GLU- HN . . . 1 . 2 GLU- HB1 . . rr_1ad7 1
3 1 . . 1 1 2 2 GLU H H . . . 1 1 2 2 GLU HB3 H . . . . . 2.9 2.3 4.0 . . . . . A . 2 GLU H . . A . 2 GLU HB3 . 1 . 2 GLU- HN . . . 1 . 2 GLU- HB2 . . rr_1ad7 1
4 1 . . 1 1 2 2 GLU HA H . . . 1 1 2 2 GLU HB2 H . . . . . 2.6 2.1 3.6 . . . . . A . 2 GLU HA . . A . 2 GLU HB2 . 1 . 2 GLU- HA . . . 1 . 2 GLU- HB1 . . rr_1ad7 1
5 1 . . 1 1 2 2 GLU HA H . . . 1 1 2 2 GLU HB3 H . . . . . 2.6 2.1 3.6 . . . . . A . 2 GLU HA . . A . 2 GLU HB3 . 1 . 2 GLU- HA . . . 1 . 2 GLU- HB2 . . rr_1ad7 1
6 1 . . 1 1 2 2 GLU HA H . . . 1 1 3 3 CGU H H . . . . . 3.1 2.5 3.7 . . . . . A . 2 GLU HA . . A . 3 CGU H . 1 . 2 GLU- HA . . . 1 . 3 GLA HN . . rr_1ad7 1
7 1 . . 1 1 3 3 CGU H H . . . 1 1 3 3 CGU HA H . . . . . 2.8 2.2 3.4 . . . . . A . 3 CGU H . . A . 3 CGU HA . 1 . 3 GLA HN . . . 1 . 3 GLA HA . . rr_1ad7 1
8 1 . . 1 1 3 3 CGU H H . . . 1 1 3 3 CGU HB2 H . . . . . 2.6 2.1 3.6 . . . . . A . 3 CGU H . . A . 3 CGU HB2 . 1 . 3 GLA HN . . . 1 . 3 GLA HB1 . . rr_1ad7 1
9 1 . . 1 1 3 3 CGU H H . . . 1 1 3 3 CGU HB3 H . . . . . 2.7 2.2 3.7 . . . . . A . 3 CGU H . . A . 3 CGU HB3 . 1 . 3 GLA HN . . . 1 . 3 GLA HB2 . . rr_1ad7 1
10 1 . . 1 1 3 3 CGU H H . . . 1 1 3 3 CGU HG H . . . . . 3.1 2.5 3.7 . . . . . A . 3 CGU H . . A . 3 CGU HG . 1 . 3 GLA HN . . . 1 . 3 GLA HG . . rr_1ad7 1
11 1 . . 1 1 3 3 CGU HA H . . . 1 1 3 3 CGU HB2 H . . . . . 2.4 1.9 3.4 . . . . . A . 3 CGU HA . . A . 3 CGU HB2 . 1 . 3 GLA HA . . . 1 . 3 GLA HB1 . . rr_1ad7 1
12 1 . . 1 1 3 3 CGU HA H . . . 1 1 3 3 CGU HB3 H . . . . . 2.3 1.8 3.3 . . . . . A . 3 CGU HA . . A . 3 CGU HB3 . 1 . 3 GLA HA . . . 1 . 3 GLA HB2 . . rr_1ad7 1
13 1 . . 1 1 3 3 CGU HA H . . . 1 1 3 3 CGU HG H . . . . . 2.6 2.1 3.1 . . . . . A . 3 CGU HA . . A . 3 CGU HG . 1 . 3 GLA HA . . . 1 . 3 GLA HG . . rr_1ad7 1
14 1 . . 1 1 3 3 CGU H H . . . 1 1 4 4 CGU H H . . . . . 2.5 2.0 3.0 . . . . . A . 3 CGU H . . A . 4 CGU H . 1 . 3 GLA HN . . . 1 . 4 GLA HN . . rr_1ad7 1
15 1 . . 1 1 3 3 CGU HB2 H . . . 1 1 3 3 CGU HG H . . . . . 2.5 2.0 3.5 . . . . . A . 3 CGU HB2 . . A . 3 CGU HG . 1 . 3 GLA HB1 . . . 1 . 3 GLA HG . . rr_1ad7 1
16 1 . . 1 1 3 3 CGU HB3 H . . . 1 1 3 3 CGU HG H . . . . . 2.4 1.9 3.4 . . . . . A . 3 CGU HB3 . . A . 3 CGU HG . 1 . 3 GLA HB2 . . . 1 . 3 GLA HG . . rr_1ad7 1
17 1 . . 1 1 3 3 CGU HB2 H . . . 1 1 3 3 CGU HB3 H . . . . . 2.3 1.8 3.8 . . . . . A . 3 CGU HB2 . . A . 3 CGU HB3 . 1 . 3 GLA HB1 . . . 1 . 3 GLA HB2 . . rr_1ad7 1
18 1 . . 1 1 3 3 CGU HB3 H . . . 1 1 4 4 CGU H H . . . . . 2.9 2.3 4.0 . . . . . A . 3 CGU HB3 . . A . 4 CGU H . 1 . 3 GLA HB2 . . . 1 . 4 GLA HN . . rr_1ad7 1
19 1 . . 1 1 4 4 CGU H H . . . 1 1 4 4 CGU HA H . . . . . 2.5 2.0 3.0 . . . . . A . 4 CGU H . . A . 4 CGU HA . 1 . 4 GLA HN . . . 1 . 4 GLA HA . . rr_1ad7 1
20 1 . . 1 1 4 4 CGU H H . . . 1 1 4 4 CGU HB2 H . . . . . 2.4 1.9 3.4 . . . . . A . 4 CGU H . . A . 4 CGU HB2 . 1 . 4 GLA HN . . . 1 . 4 GLA HB1 . . rr_1ad7 1
21 1 . . 1 1 4 4 CGU H H . . . 1 1 4 4 CGU HB3 H . . . . . 2.4 1.9 3.4 . . . . . A . 4 CGU H . . A . 4 CGU HB3 . 1 . 4 GLA HN . . . 1 . 4 GLA HB2 . . rr_1ad7 1
22 1 . . 1 1 4 4 CGU H H . . . 1 1 4 4 CGU HG H . . . . . 2.8 2.2 3.4 . . . . . A . 4 CGU H . . A . 4 CGU HG . 1 . 4 GLA HN . . . 1 . 4 GLA HG . . rr_1ad7 1
23 1 . . 1 1 4 4 CGU HA H . . . 1 1 4 4 CGU HB2 H . . . . . 3.0 2.4 4.1 . . . . . A . 4 CGU HA . . A . 4 CGU HB2 . 1 . 4 GLA HA . . . 1 . 4 GLA HB1 . . rr_1ad7 1
24 1 . . 1 1 4 4 CGU HA H . . . 1 1 4 4 CGU HB3 H . . . . . 2.8 2.2 3.9 . . . . . A . 4 CGU HA . . A . 4 CGU HB3 . 1 . 4 GLA HA . . . 1 . 4 GLA HB2 . . rr_1ad7 1
25 1 . . 1 1 4 4 CGU HA H . . . 1 1 4 4 CGU HG H . . . . . 2.4 1.9 2.9 . . . . . A . 4 CGU HA . . A . 4 CGU HG . 1 . 4 GLA HA . . . 1 . 4 GLA HG . . rr_1ad7 1
26 1 . . 1 1 4 4 CGU HB2 H . . . 1 1 4 4 CGU HG H . . . . . 2.5 2.0 3.5 . . . . . A . 4 CGU HB2 . . A . 4 CGU HG . 1 . 4 GLA HB1 . . . 1 . 4 GLA HG . . rr_1ad7 1
27 1 . . 1 1 4 4 CGU HB3 H . . . 1 1 4 4 CGU HG H . . . . . 2.5 2.0 3.5 . . . . . A . 4 CGU HB3 . . A . 4 CGU HG . 1 . 4 GLA HB2 . . . 1 . 4 GLA HG . . rr_1ad7 1
28 1 . . 1 1 4 4 CGU HB2 H . . . 1 1 4 4 CGU HB3 H . . . . . 2.5 2.0 4.0 . . . . . A . 4 CGU HB2 . . A . 4 CGU HB3 . 1 . 4 GLA HB1 . . . 1 . 4 GLA HB2 . . rr_1ad7 1
29 1 . . 1 1 4 4 CGU HA H . . . 1 1 5 5 LEU H H . . . . . 2.9 2.3 3.5 . . . . . A . 4 CGU HA . . A . 5 LEU H . 1 . 4 GLA HA . . . 1 . 5 LEU HN . . rr_1ad7 1
30 1 . . 1 1 4 4 CGU HB2 H . . . 1 1 5 5 LEU H H . . . . . 2.6 2.1 3.6 . . . . . A . 4 CGU HB2 . . A . 5 LEU H . 1 . 4 GLA HB1 . . . 1 . 5 LEU HN . . rr_1ad7 1
31 1 . . 1 1 4 4 CGU HB3 H . . . 1 1 5 5 LEU H H . . . . . 2.9 2.3 4.0 . . . . . A . 4 CGU HB3 . . A . 5 LEU H . 1 . 4 GLA HB2 . . . 1 . 5 LEU HN . . rr_1ad7 1
32 1 . . 1 1 4 4 CGU HA H . . . 1 1 7 7 CGU H H . . . . . 2.9 2.3 4.0 . . . . . A . 4 CGU HA . . A . 7 CGU H . 1 . 4 GLA HA . . . 1 . 7 GLA HN . . rr_1ad7 1
33 1 . . 1 1 4 4 CGU H H . . . 1 1 5 5 LEU H H . . . . . 2.9 2.3 4.0 . . . . . A . 4 CGU H . . A . 5 LEU H . 1 . 4 GLA HN . . . 1 . 5 LEU HN . . rr_1ad7 1
34 1 . . 1 1 4 4 CGU HG H . . . 1 1 7 7 CGU HG H . . . . . 3.1 2.5 3.7 . . . . . A . 4 CGU HG . . A . 7 CGU HG . 1 . 4 GLA HG . . . 1 . 7 GLA HG . . rr_1ad7 1
35 1 . . 1 1 4 4 CGU HG H . . . 1 1 8 8 ASN H H . . . . . 4.0 3.2 5.2 . . . . . A . 4 CGU HG . . A . 8 ASN H . 1 . 4 GLA HG . . . 1 . 8 ASN HN . . rr_1ad7 1
36 1 . . 1 1 5 5 LEU H H . . . 1 1 5 5 LEU HA H . . . . . 2.8 2.2 3.4 . . . . . A . 5 LEU H . . A . 5 LEU HA . 1 . 5 LEU HN . . . 1 . 5 LEU HA . . rr_1ad7 1
37 1 . . 1 1 5 5 LEU H H . . . 1 1 5 5 LEU HB2 H . . . . . 2.8 2.2 3.9 . . . . . A . 5 LEU H . . A . 5 LEU HB2 . 1 . 5 LEU HN . . . 1 . 5 LEU HB1 . . rr_1ad7 1
38 1 . . 1 1 5 5 LEU H H . . . 1 1 5 5 LEU HB3 H . . . . . 2.7 2.2 3.7 . . . . . A . 5 LEU H . . A . 5 LEU HB3 . 1 . 5 LEU HN . . . 1 . 5 LEU HB2 . . rr_1ad7 1
39 1 . . 1 1 5 5 LEU HB2 H . . . 1 1 6 6 GLN H H . . . . . 3.1 2.5 4.2 . . . . . A . 5 LEU HB2 . . A . 6 GLN H . 1 . 5 LEU HB1 . . . 1 . 6 GLN HN . . rr_1ad7 1
40 1 . . 1 1 5 5 LEU HB3 H . . . 1 1 6 6 GLN H H . . . . . 2.9 2.3 4.0 . . . . . A . 5 LEU HB3 . . A . 6 GLN H . 1 . 5 LEU HB2 . . . 1 . 6 GLN HN . . rr_1ad7 1
41 1 . . 1 1 5 5 LEU HA H . . . 1 1 5 5 LEU HG H . . . . . 2.6 2.1 3.1 . . . . . A . 5 LEU HA . . A . 5 LEU HG . 1 . 5 LEU HA . . . 1 . 5 LEU HG . . rr_1ad7 1
42 1 . . 1 1 5 5 LEU HA H . . . 1 1 5 5 LEU CD1 C . . . . . 2.5 2.0 5.0 . . . . . A . 5 LEU HA . . A . 5 LEU CD1 . 1 . 5 LEU HA . . . 1 . 5 LEU CD1 . . rr_1ad7 1
43 1 . . 1 1 5 5 LEU HA H . . . 1 1 5 5 LEU HB2 H . . . . . 2.5 2.0 3.5 . . . . . A . 5 LEU HA . . A . 5 LEU HB2 . 1 . 5 LEU HA . . . 1 . 5 LEU HB1 . . rr_1ad7 1
44 1 . . 1 1 5 5 LEU HA H . . . 1 1 5 5 LEU HB3 H . . . . . 2.6 2.1 3.6 . . . . . A . 5 LEU HA . . A . 5 LEU HB3 . 1 . 5 LEU HA . . . 1 . 5 LEU HB2 . . rr_1ad7 1
45 1 . . 1 1 5 5 LEU HA H . . . 1 1 6 6 GLN H H . . . . . 2.8 2.2 3.4 . . . . . A . 5 LEU HA . . A . 6 GLN H . 1 . 5 LEU HA . . . 1 . 6 GLN HN . . rr_1ad7 1
46 1 . . 1 1 5 5 LEU H H . . . 1 1 6 6 GLN H H . . . . . 2.4 1.9 2.9 . . . . . A . 5 LEU H . . A . 6 GLN H . 1 . 5 LEU HN . . . 1 . 6 GLN HN . . rr_1ad7 1
47 1 . . 1 1 8 8 ASN H H . . . 1 1 5 5 LEU HB2 H . . . . . 3.1 2.5 4.2 . . . . . A . 8 ASN H . . A . 5 LEU HB2 . 1 . 8 ASN HN . . . 1 . 5 LEU HB1 . . rr_1ad7 1
48 1 . . 1 1 8 8 ASN H H . . . 1 1 5 5 LEU HB3 H . . . . . 3.0 2.4 4.1 . . . . . A . 8 ASN H . . A . 5 LEU HB3 . 1 . 8 ASN HN . . . 1 . 5 LEU HB2 . . rr_1ad7 1
49 1 . . 1 1 5 5 LEU HB2 H . . . 1 1 5 5 LEU HB3 H . . . . . 2.6 2.1 4.1 . . . . . A . 5 LEU HB2 . . A . 5 LEU HB3 . 1 . 5 LEU HB1 . . . 1 . 5 LEU HB2 . . rr_1ad7 1
50 1 . . 1 1 5 5 LEU HB2 H . . . 1 1 5 5 LEU CD2 C . . . . . 2.8 2.2 5.4 . . . . . A . 5 LEU HB2 . . A . 5 LEU CD2 . 1 . 5 LEU HB1 . . . 1 . 5 LEU CD2 . . rr_1ad7 1
51 1 . . 1 1 6 6 GLN H H . . . 1 1 6 6 GLN HA H . . . . . 2.5 2.0 3.0 . . . . . A . 6 GLN H . . A . 6 GLN HA . 1 . 6 GLN HN . . . 1 . 6 GLN HA . . rr_1ad7 1
52 1 . . 1 1 6 6 GLN H H . . . 1 1 6 6 GLN HB2 H . . . . . 2.5 2.0 3.5 . . . . . A . 6 GLN H . . A . 6 GLN HB2 . 1 . 6 GLN HN . . . 1 . 6 GLN HB1 . . rr_1ad7 1
53 1 . . 1 1 6 6 GLN H H . . . 1 1 6 6 GLN HB3 H . . . . . 2.5 2.0 3.5 . . . . . A . 6 GLN H . . A . 6 GLN HB3 . 1 . 6 GLN HN . . . 1 . 6 GLN HB2 . . rr_1ad7 1
54 1 . . 1 1 6 6 GLN H H . . . 1 1 6 6 GLN HG2 H . . . . . 3.4 2.7 4.6 . . . . . A . 6 GLN H . . A . 6 GLN HG2 . 1 . 6 GLN HN . . . 1 . 6 GLN HG1 . . rr_1ad7 1
55 1 . . 1 1 6 6 GLN H H . . . 1 1 6 6 GLN HG3 H . . . . . 3.1 2.5 4.2 . . . . . A . 6 GLN H . . A . 6 GLN HG3 . 1 . 6 GLN HN . . . 1 . 6 GLN HG2 . . rr_1ad7 1
56 1 . . 1 1 7 7 CGU H H . . . 1 1 6 6 GLN HB2 H . . . . . 2.7 2.2 3.7 . . . . . A . 7 CGU H . . A . 6 GLN HB2 . 1 . 7 GLA HN . . . 1 . 6 GLN HB1 . . rr_1ad7 1
57 1 . . 1 1 7 7 CGU H H . . . 1 1 6 6 GLN HB3 H . . . . . 2.7 2.2 3.7 . . . . . A . 7 CGU H . . A . 6 GLN HB3 . 1 . 7 GLA HN . . . 1 . 6 GLN HB2 . . rr_1ad7 1
58 1 . . 1 1 7 7 CGU H H . . . 1 1 6 6 GLN H H . . . . . 2.5 2.0 3.0 . . . . . A . 7 CGU H . . A . 6 GLN H . 1 . 7 GLA HN . . . 1 . 6 GLN HN . . rr_1ad7 1
59 1 . . 1 1 7 7 CGU H H . . . 1 1 6 6 GLN HA H . . . . . 3.2 2.6 3.8 . . . . . A . 7 CGU H . . A . 6 GLN HA . 1 . 7 GLA HN . . . 1 . 6 GLN HA . . rr_1ad7 1
60 1 . . 1 1 6 6 GLN HA H . . . 1 1 6 6 GLN HB2 H . . . . . 3.1 2.5 4.2 . . . . . A . 6 GLN HA . . A . 6 GLN HB2 . 1 . 6 GLN HA . . . 1 . 6 GLN HB1 . . rr_1ad7 1
61 1 . . 1 1 6 6 GLN HA H . . . 1 1 6 6 GLN HB3 H . . . . . 2.8 2.2 3.9 . . . . . A . 6 GLN HA . . A . 6 GLN HB3 . 1 . 6 GLN HA . . . 1 . 6 GLN HB2 . . rr_1ad7 1
62 1 . . 1 1 6 6 GLN HA H . . . 1 1 6 6 GLN HG2 H . . . . . 3.6 2.9 4.8 . . . . . A . 6 GLN HA . . A . 6 GLN HG2 . 1 . 6 GLN HA . . . 1 . 6 GLN HG1 . . rr_1ad7 1
63 1 . . 1 1 6 6 GLN HA H . . . 1 1 6 6 GLN HG3 H . . . . . 3.2 2.6 4.3 . . . . . A . 6 GLN HA . . A . 6 GLN HG3 . 1 . 6 GLN HA . . . 1 . 6 GLN HG2 . . rr_1ad7 1
64 1 . . 1 1 6 6 GLN HB2 H . . . 1 1 6 6 GLN HG3 H . . . . . 2.8 2.2 4.4 . . . . . A . 6 GLN HB2 . . A . 6 GLN HG3 . 1 . 6 GLN HB1 . . . 1 . 6 GLN HG2 . . rr_1ad7 1
65 1 . . 1 1 6 6 GLN HB3 H . . . 1 1 6 6 GLN HG3 H . . . . . 2.7 2.2 4.2 . . . . . A . 6 GLN HB3 . . A . 6 GLN HG3 . 1 . 6 GLN HB2 . . . 1 . 6 GLN HG2 . . rr_1ad7 1
66 1 . . 1 1 6 6 GLN HB2 H . . . 1 1 6 6 GLN HB3 H . . . . . 3.0 2.4 4.6 . . . . . A . 6 GLN HB2 . . A . 6 GLN HB3 . 1 . 6 GLN HB1 . . . 1 . 6 GLN HB2 . . rr_1ad7 1
67 1 . . 1 1 6 6 GLN HG2 H . . . 1 1 6 6 GLN HG3 H . . . . . 2.7 2.2 5.2 . . . . . A . 6 GLN HG2 . . A . 6 GLN HG3 . 1 . 6 GLN HG1 . . . 1 . 6 GLN HG2 . . rr_1ad7 1
68 1 . . 1 1 6 6 GLN HG2 H . . . 1 1 6 6 GLN NE2 N . . . . . 2.8 2.2 3.9 . . . . . A . 6 GLN HG2 . . A . 6 GLN NE2 . 1 . 6 GLN HG1 . . . 1 . 6 GLN NE2 . . rr_1ad7 1
69 1 . . 1 1 6 6 GLN HG3 H . . . 1 1 6 6 GLN NE2 N . . . . . 3.2 2.6 4.1 . . . . . A . 6 GLN HG3 . . A . 6 GLN NE2 . 1 . 6 GLN HG2 . . . 1 . 6 GLN NE2 . . rr_1ad7 1
70 1 . . 1 1 7 7 CGU H H . . . 1 1 7 7 CGU HA H . . . . . 3.1 2.5 3.7 . . . . . A . 7 CGU H . . A . 7 CGU HA . 1 . 7 GLA HN . . . 1 . 7 GLA HA . . rr_1ad7 1
71 1 . . 1 1 7 7 CGU H H . . . 1 1 7 7 CGU HB2 H . . . . . 2.5 2.0 3.5 . . . . . A . 7 CGU H . . A . 7 CGU HB2 . 1 . 7 GLA HN . . . 1 . 7 GLA HB1 . . rr_1ad7 1
72 1 . . 1 1 7 7 CGU H H . . . 1 1 7 7 CGU HB3 H . . . . . 2.5 2.0 3.5 . . . . . A . 7 CGU H . . A . 7 CGU HB3 . 1 . 7 GLA HN . . . 1 . 7 GLA HB2 . . rr_1ad7 1
73 1 . . 1 1 7 7 CGU H H . . . 1 1 7 7 CGU HG H . . . . . 2.5 2.0 3.0 . . . . . A . 7 CGU H . . A . 7 CGU HG . 1 . 7 GLA HN . . . 1 . 7 GLA HG . . rr_1ad7 1
74 1 . . 1 1 7 7 CGU HA H . . . 1 1 7 7 CGU HB2 H . . . . . 2.5 2.0 3.5 . . . . . A . 7 CGU HA . . A . 7 CGU HB2 . 1 . 7 GLA HA . . . 1 . 7 GLA HB1 . . rr_1ad7 1
75 1 . . 1 1 7 7 CGU HA H . . . 1 1 7 7 CGU HB3 H . . . . . 2.5 2.0 3.5 . . . . . A . 7 CGU HA . . A . 7 CGU HB3 . 1 . 7 GLA HA . . . 1 . 7 GLA HB2 . . rr_1ad7 1
76 1 . . 1 1 7 7 CGU HG H . . . 1 1 7 7 CGU HA H . . . . . 2.7 2.2 3.2 . . . . . A . 7 CGU HG . . A . 7 CGU HA . 1 . 7 GLA HG . . . 1 . 7 GLA HA . . rr_1ad7 1
77 1 . . 1 1 7 7 CGU HG H . . . 1 1 7 7 CGU HB2 H . . . . . 2.6 2.1 3.6 . . . . . A . 7 CGU HG . . A . 7 CGU HB2 . 1 . 7 GLA HG . . . 1 . 7 GLA HB1 . . rr_1ad7 1
78 1 . . 1 1 7 7 CGU HG H . . . 1 1 7 7 CGU HB3 H . . . . . 2.6 2.1 3.6 . . . . . A . 7 CGU HG . . A . 7 CGU HB3 . 1 . 7 GLA HG . . . 1 . 7 GLA HB2 . . rr_1ad7 1
79 1 . . 1 1 8 8 ASN H H . . . 1 1 7 7 CGU HA H . . . . . 3.3 2.6 4.0 . . . . . A . 8 ASN H . . A . 7 CGU HA . 1 . 8 ASN HN . . . 1 . 7 GLA HA . . rr_1ad7 1
80 1 . . 1 1 8 8 ASN H H . . . 1 1 7 7 CGU HB2 H . . . . . 2.7 2.2 3.7 . . . . . A . 8 ASN H . . A . 7 CGU HB2 . 1 . 8 ASN HN . . . 1 . 7 GLA HB1 . . rr_1ad7 1
81 1 . . 1 1 8 8 ASN H H . . . 1 1 7 7 CGU HB3 H . . . . . 2.7 2.2 3.7 . . . . . A . 8 ASN H . . A . 7 CGU HB3 . 1 . 8 ASN HN . . . 1 . 7 GLA HB2 . . rr_1ad7 1
82 1 . . 1 1 7 7 CGU HB2 H . . . 1 1 7 7 CGU HB3 H . . . . . 3.0 2.4 4.6 . . . . . A . 7 CGU HB2 . . A . 7 CGU HB3 . 1 . 7 GLA HB1 . . . 1 . 7 GLA HB2 . . rr_1ad7 1
83 1 . . 1 1 7 7 CGU H H . . . 1 1 8 8 ASN H H . . . . . 3.3 2.6 4.0 . . . . . A . 7 CGU H . . A . 8 ASN H . 1 . 7 GLA HN . . . 1 . 8 ASN HN . . rr_1ad7 1
84 1 . . 1 1 8 8 ASN H H . . . 1 1 8 8 ASN HB2 H . . . . . 2.5 2.0 3.5 . . . . . A . 8 ASN H . . A . 8 ASN HB2 . 1 . 8 ASN HN . . . 1 . 8 ASN HB1 . . rr_1ad7 1
85 1 . . 1 1 8 8 ASN H H . . . 1 1 8 8 ASN HB3 H . . . . . 2.5 2.0 3.5 . . . . . A . 8 ASN H . . A . 8 ASN HB3 . 1 . 8 ASN HN . . . 1 . 8 ASN HB2 . . rr_1ad7 1
86 1 . . 1 1 8 8 ASN HB2 H . . . 1 1 9 9 GLN H H . . . . . 2.8 2.2 3.9 . . . . . A . 8 ASN HB2 . . A . 9 GLN H . 1 . 8 ASN HB1 . . . 1 . 9 GLN HN . . rr_1ad7 1
87 1 . . 1 1 8 8 ASN HB3 H . . . 1 1 9 9 GLN H H . . . . . 3.1 2.5 4.2 . . . . . A . 8 ASN HB3 . . A . 9 GLN H . 1 . 8 ASN HB2 . . . 1 . 9 GLN HN . . rr_1ad7 1
88 1 . . 1 1 8 8 ASN HB2 H . . . 1 1 8 8 ASN HD21 H . . . . . 3.3 2.6 5.0 . . . . . A . 8 ASN HB2 . . A . 8 ASN HD21 . 1 . 8 ASN HB1 . . . 1 . 8 ASN HD21 . . rr_1ad7 1
89 1 . . 1 1 8 8 ASN HB3 H . . . 1 1 8 8 ASN HD21 H . . . . . 4.0 3.2 6.2 . . . . . A . 8 ASN HB3 . . A . 8 ASN HD21 . 1 . 8 ASN HB2 . . . 1 . 8 ASN HD21 . . rr_1ad7 1
90 1 . . 1 1 8 8 ASN HB2 H . . . 1 1 8 8 ASN HD22 H . . . . . 4.2 3.3 6.5 . . . . . A . 8 ASN HB2 . . A . 8 ASN HD22 . 1 . 8 ASN HB1 . . . 1 . 8 ASN HD22 . . rr_1ad7 1
91 1 . . 1 1 8 8 ASN HB2 H . . . 1 1 8 8 ASN HB3 H . . . . . 3.0 2.4 4.6 . . . . . A . 8 ASN HB2 . . A . 8 ASN HB3 . 1 . 8 ASN HB1 . . . 1 . 8 ASN HB2 . . rr_1ad7 1
92 1 . . 1 1 8 8 ASN HD21 H . . . 1 1 8 8 ASN HD22 H . . . . . 2.9 2.3 4.5 . . . . . A . 8 ASN HD21 . . A . 8 ASN HD22 . 1 . 8 ASN HD21 . . . 1 . 8 ASN HD22 . . rr_1ad7 1
93 1 . . 1 1 8 8 ASN HB2 H . . . 1 1 8 8 ASN HA H . . . . . 3.2 2.6 4.4 . . . . . A . 8 ASN HB2 . . A . 8 ASN HA . 1 . 8 ASN HB1 . . . 1 . 8 ASN HA . . rr_1ad7 1
94 1 . . 1 1 8 8 ASN HB3 H . . . 1 1 8 8 ASN HA H . . . . . 3.2 2.6 4.4 . . . . . A . 8 ASN HB3 . . A . 8 ASN HA . 1 . 8 ASN HB2 . . . 1 . 8 ASN HA . . rr_1ad7 1
95 1 . . 1 1 9 9 GLN H H . . . 1 1 9 9 GLN HA H . . . . . 2.5 2.0 3.0 . . . . . A . 9 GLN H . . A . 9 GLN HA . 1 . 9 GLN HN . . . 1 . 9 GLN HA . . rr_1ad7 1
96 1 . . 1 1 9 9 GLN H H . . . 1 1 9 9 GLN HB2 H . . . . . 2.7 2.2 3.7 . . . . . A . 9 GLN H . . A . 9 GLN HB2 . 1 . 9 GLN HN . . . 1 . 9 GLN HB1 . . rr_1ad7 1
97 1 . . 1 1 9 9 GLN H H . . . 1 1 9 9 GLN HB3 H . . . . . 3.0 2.4 4.1 . . . . . A . 9 GLN H . . A . 9 GLN HB3 . 1 . 9 GLN HN . . . 1 . 9 GLN HB2 . . rr_1ad7 1
98 1 . . 1 1 9 9 GLN H H . . . 1 1 9 9 GLN HG2 H . . . . . 3.1 2.5 4.2 . . . . . A . 9 GLN H . . A . 9 GLN HG2 . 1 . 9 GLN HN . . . 1 . 9 GLN HG1 . . rr_1ad7 1
99 1 . . 1 1 9 9 GLN H H . . . 1 1 9 9 GLN HG3 H . . . . . 3.1 2.5 4.2 . . . . . A . 9 GLN H . . A . 9 GLN HG3 . 1 . 9 GLN HN . . . 1 . 9 GLN HG2 . . rr_1ad7 1
100 1 . . 1 1 9 9 GLN HA H . . . 1 1 10 10 CGU H H . . . . . 3.2 2.6 3.8 . . . . . A . 9 GLN HA . . A . 10 CGU H . 1 . 9 GLN HA . . . 1 . 10 GLA HN . . rr_1ad7 1
101 1 . . 1 1 9 9 GLN HA H . . . 1 1 9 9 GLN HB2 H . . . . . 3.1 2.5 4.2 . . . . . A . 9 GLN HA . . A . 9 GLN HB2 . 1 . 9 GLN HA . . . 1 . 9 GLN HB1 . . rr_1ad7 1
102 1 . . 1 1 9 9 GLN HA H . . . 1 1 9 9 GLN HB3 H . . . . . 2.9 2.3 4.0 . . . . . A . 9 GLN HA . . A . 9 GLN HB3 . 1 . 9 GLN HA . . . 1 . 9 GLN HB2 . . rr_1ad7 1
103 1 . . 1 1 9 9 GLN HA H . . . 1 1 9 9 GLN HG2 H . . . . . 3.0 2.4 4.1 . . . . . A . 9 GLN HA . . A . 9 GLN HG2 . 1 . 9 GLN HA . . . 1 . 9 GLN HG1 . . rr_1ad7 1
104 1 . . 1 1 9 9 GLN HA H . . . 1 1 9 9 GLN HG3 H . . . . . 3.0 2.4 4.1 . . . . . A . 9 GLN HA . . A . 9 GLN HG3 . 1 . 9 GLN HA . . . 1 . 9 GLN HG2 . . rr_1ad7 1
105 1 . . 1 1 9 9 GLN HA H . . . 1 1 12 12 ILE HB H . . . . . 2.4 1.9 2.9 . . . . . A . 9 GLN HA . . A . 12 ILE HB . 1 . 9 GLN HA . . . 1 . 12 ILE HB . . rr_1ad7 1
106 1 . . 1 1 9 9 GLN HA H . . . 1 1 12 12 ILE HG12 H . . . . . 2.9 2.3 4.0 . . . . . A . 9 GLN HA . . A . 12 ILE HG12 . 1 . 9 GLN HA . . . 1 . 12 ILE HG11 . . rr_1ad7 1
107 1 . . 1 1 9 9 GLN HA H . . . 1 1 12 12 ILE CD1 C . . . . . 2.8 2.2 5.4 . . . . . A . 9 GLN HA . . A . 12 ILE CD1 . 1 . 9 GLN HA . . . 1 . 12 ILE CD1 . . rr_1ad7 1
108 1 . . 1 1 9 9 GLN HB2 H . . . 1 1 9 9 GLN HG3 H . . . . . 2.7 2.2 4.2 . . . . . A . 9 GLN HB2 . . A . 9 GLN HG3 . 1 . 9 GLN HB1 . . . 1 . 9 GLN HG2 . . rr_1ad7 1
109 1 . . 1 1 9 9 GLN HB3 H . . . 1 1 9 9 GLN HG3 H . . . . . 2.8 2.2 4.4 . . . . . A . 9 GLN HB3 . . A . 9 GLN HG3 . 1 . 9 GLN HB2 . . . 1 . 9 GLN HG2 . . rr_1ad7 1
110 1 . . 1 1 9 9 GLN HG2 H . . . 1 1 9 9 GLN HG3 H . . . . . 3.1 2.5 4.7 . . . . . A . 9 GLN HG2 . . A . 9 GLN HG3 . 1 . 9 GLN HG1 . . . 1 . 9 GLN HG2 . . rr_1ad7 1
111 1 . . 1 1 10 10 CGU H H . . . 1 1 10 10 CGU HA H . . . . . 4.8 3.8 6.2 . . . . . A . 10 CGU H . . A . 10 CGU HA . 1 . 10 GLA HN . . . 1 . 10 GLA HA . . rr_1ad7 1
112 1 . . 1 1 10 10 CGU H H . . . 1 1 10 10 CGU HB2 H . . . . . 2.6 2.1 3.6 . . . . . A . 10 CGU H . . A . 10 CGU HB2 . 1 . 10 GLA HN . . . 1 . 10 GLA HB1 . . rr_1ad7 1
113 1 . . 1 1 10 10 CGU H H . . . 1 1 10 10 CGU HB3 H . . . . . 2.6 2.1 3.6 . . . . . A . 10 CGU H . . A . 10 CGU HB3 . 1 . 10 GLA HN . . . 1 . 10 GLA HB2 . . rr_1ad7 1
114 1 . . 1 1 10 10 CGU H H . . . 1 1 10 10 CGU HG H . . . . . 4.1 3.3 5.3 . . . . . A . 10 CGU H . . A . 10 CGU HG . 1 . 10 GLA HN . . . 1 . 10 GLA HG . . rr_1ad7 1
115 1 . . 1 1 10 10 CGU HA H . . . 1 1 10 10 CGU HB2 H . . . . . 2.4 1.9 3.4 . . . . . A . 10 CGU HA . . A . 10 CGU HB2 . 1 . 10 GLA HA . . . 1 . 10 GLA HB1 . . rr_1ad7 1
116 1 . . 1 1 10 10 CGU HA H . . . 1 1 10 10 CGU HB3 H . . . . . 2.4 1.9 3.4 . . . . . A . 10 CGU HA . . A . 10 CGU HB3 . 1 . 10 GLA HA . . . 1 . 10 GLA HB2 . . rr_1ad7 1
117 1 . . 1 1 10 10 CGU HA H . . . 1 1 10 10 CGU HG H . . . . . 2.7 2.2 3.2 . . . . . A . 10 CGU HA . . A . 10 CGU HG . 1 . 10 GLA HA . . . 1 . 10 GLA HG . . rr_1ad7 1
118 1 . . 1 1 10 10 CGU HB2 H . . . 1 1 10 10 CGU HG H . . . . . 2.5 2.0 3.5 . . . . . A . 10 CGU HB2 . . A . 10 CGU HG . 1 . 10 GLA HB1 . . . 1 . 10 GLA HG . . rr_1ad7 1
119 1 . . 1 1 10 10 CGU HB3 H . . . 1 1 10 10 CGU HG H . . . . . 2.5 2.0 3.5 . . . . . A . 10 CGU HB3 . . A . 10 CGU HG . 1 . 10 GLA HB2 . . . 1 . 10 GLA HG . . rr_1ad7 1
120 1 . . 1 1 10 10 CGU HB2 H . . . 1 1 11 11 LEU H H . . . . . 2.9 2.3 4.0 . . . . . A . 10 CGU HB2 . . A . 11 LEU H . 1 . 10 GLA HB1 . . . 1 . 11 LEU HN . . rr_1ad7 1
121 1 . . 1 1 10 10 CGU HB3 H . . . 1 1 11 11 LEU H H . . . . . 2.9 2.3 4.0 . . . . . A . 10 CGU HB3 . . A . 11 LEU H . 1 . 10 GLA HB2 . . . 1 . 11 LEU HN . . rr_1ad7 1
122 1 . . 1 1 10 10 CGU H H . . . 1 1 11 11 LEU H H . . . . . 2.5 2.0 3.0 . . . . . A . 10 CGU H . . A . 11 LEU H . 1 . 10 GLA HN . . . 1 . 11 LEU HN . . rr_1ad7 1
123 1 . . 1 1 10 10 CGU HA H . . . 1 1 13 13 ARG HB2 H . . . . . 2.5 2.0 3.5 . . . . . A . 10 CGU HA . . A . 13 ARG HB2 . 1 . 10 GLA HA . . . 1 . 13 ARG+ HB1 . . rr_1ad7 1
124 1 . . 1 1 10 10 CGU HA H . . . 1 1 13 13 ARG HB3 H . . . . . 2.5 2.0 3.5 . . . . . A . 10 CGU HA . . A . 13 ARG HB3 . 1 . 10 GLA HA . . . 1 . 13 ARG+ HB2 . . rr_1ad7 1
125 1 . . 1 1 10 10 CGU HA H . . . 1 1 13 13 ARG HG2 H . . . . . 4.0 3.2 5.7 . . . . . A . 10 CGU HA . . A . 13 ARG HG2 . 1 . 10 GLA HA . . . 1 . 13 ARG+ HG1 . . rr_1ad7 1
126 1 . . 1 1 10 10 CGU HA H . . . 1 1 13 13 ARG HD2 H . . . . . 3.5 2.8 4.7 . . . . . A . 10 CGU HA . . A . 13 ARG HD2 . 1 . 10 GLA HA . . . 1 . 13 ARG+ HD1 . . rr_1ad7 1
127 1 . . 1 1 11 11 LEU H H . . . 1 1 11 11 LEU HA H . . . . . 2.6 2.1 3.1 . . . . . A . 11 LEU H . . A . 11 LEU HA . 1 . 11 LEU HN . . . 1 . 11 LEU HA . . rr_1ad7 1
128 1 . . 1 1 11 11 LEU H H . . . 1 1 11 11 LEU HB2 H . . . . . 2.5 2.0 3.5 . . . . . A . 11 LEU H . . A . 11 LEU HB2 . 1 . 11 LEU HN . . . 1 . 11 LEU HB1 . . rr_1ad7 1
129 1 . . 1 1 11 11 LEU H H . . . 1 1 11 11 LEU HB3 H . . . . . 2.6 2.1 3.6 . . . . . A . 11 LEU H . . A . 11 LEU HB3 . 1 . 11 LEU HN . . . 1 . 11 LEU HB2 . . rr_1ad7 1
130 1 . . 1 1 11 11 LEU HA H . . . 1 1 11 11 LEU HB2 H . . . . . 2.4 1.9 3.4 . . . . . A . 11 LEU HA . . A . 11 LEU HB2 . 1 . 11 LEU HA . . . 1 . 11 LEU HB1 . . rr_1ad7 1
131 1 . . 1 1 11 11 LEU HA H . . . 1 1 11 11 LEU HB3 H . . . . . 2.4 1.9 3.4 . . . . . A . 11 LEU HA . . A . 11 LEU HB3 . 1 . 11 LEU HA . . . 1 . 11 LEU HB2 . . rr_1ad7 1
132 1 . . 1 1 11 11 LEU H H . . . 1 1 11 11 LEU CD1 C . . . . . 3.3 2.6 6.0 . . . . . A . 11 LEU H . . A . 11 LEU CD1 . 1 . 11 LEU HN . . . 1 . 11 LEU CD1 . . rr_1ad7 1
133 1 . . 1 1 11 11 LEU HA H . . . 1 1 11 11 LEU CD1 C . . . . . 2.4 1.9 3.4 . . . . . A . 11 LEU HA . . A . 11 LEU CD1 . 1 . 11 LEU HA . . . 1 . 11 LEU CD1 . . rr_1ad7 1
134 1 . . 1 1 11 11 LEU HA H . . . 1 1 11 11 LEU CD2 C . . . . . 3.0 2.4 5.6 . . . . . A . 11 LEU HA . . A . 11 LEU CD2 . 1 . 11 LEU HA . . . 1 . 11 LEU CD2 . . rr_1ad7 1
135 1 . . 1 1 11 11 LEU HB2 H . . . 1 1 12 12 ILE H H . . . . . 3.5 2.8 4.7 . . . . . A . 11 LEU HB2 . . A . 12 ILE H . 1 . 11 LEU HB1 . . . 1 . 12 ILE HN . . rr_1ad7 1
136 1 . . 1 1 11 11 LEU HA H . . . 1 1 12 12 ILE H H . . . . . 2.5 2.0 3.0 . . . . . A . 11 LEU HA . . A . 12 ILE H . 1 . 11 LEU HA . . . 1 . 12 ILE HN . . rr_1ad7 1
137 1 . . 1 1 11 11 LEU HB2 H . . . 1 1 11 11 LEU HB3 H . . . . . 2.8 2.2 3.9 . . . . . A . 11 LEU HB2 . . A . 11 LEU HB3 . 1 . 11 LEU HB1 . . . 1 . 11 LEU HB2 . . rr_1ad7 1
138 1 . . 1 1 11 11 LEU HB2 H . . . 1 1 11 11 LEU CD1 C . . . . . 2.7 2.2 5.2 . . . . . A . 11 LEU HB2 . . A . 11 LEU CD1 . 1 . 11 LEU HB1 . . . 1 . 11 LEU CD1 . . rr_1ad7 1
139 1 . . 1 1 11 11 LEU HB2 H . . . 1 1 11 11 LEU CD2 C . . . . . 2.9 2.3 5.5 . . . . . A . 11 LEU HB2 . . A . 11 LEU CD2 . 1 . 11 LEU HB1 . . . 1 . 11 LEU CD2 . . rr_1ad7 1
140 1 . . 1 1 11 11 LEU HB3 H . . . 1 1 11 11 LEU CD1 C . . . . . 3.1 2.5 6.2 . . . . . A . 11 LEU HB3 . . A . 11 LEU CD1 . 1 . 11 LEU HB2 . . . 1 . 11 LEU CD1 . . rr_1ad7 1
141 1 . . 1 1 11 11 LEU HB3 H . . . 1 1 11 11 LEU CD2 C . . . . . 3.1 2.5 6.2 . . . . . A . 11 LEU HB3 . . A . 11 LEU CD2 . 1 . 11 LEU HB2 . . . 1 . 11 LEU CD2 . . rr_1ad7 1
142 1 . . 1 1 11 11 LEU H H . . . 1 1 12 12 ILE H H . . . . . 2.8 2.2 3.4 . . . . . A . 11 LEU H . . A . 12 ILE H . 1 . 11 LEU HN . . . 1 . 12 ILE HN . . rr_1ad7 1
143 1 . . 1 1 12 12 ILE H H . . . 1 1 12 12 ILE HA H . . . . . 2.8 2.2 3.4 . . . . . A . 12 ILE H . . A . 12 ILE HA . 1 . 12 ILE HN . . . 1 . 12 ILE HA . . rr_1ad7 1
144 1 . . 1 1 12 12 ILE HB H . . . 1 1 12 12 ILE H H . . . . . 2.3 1.8 2.8 . . . . . A . 12 ILE HB . . A . 12 ILE H . 1 . 12 ILE HB . . . 1 . 12 ILE HN . . rr_1ad7 1
145 1 . . 1 1 12 12 ILE HG12 H . . . 1 1 12 12 ILE H H . . . . . 2.5 2.0 3.5 . . . . . A . 12 ILE HG12 . . A . 12 ILE H . 1 . 12 ILE HG11 . . . 1 . 12 ILE HN . . rr_1ad7 1
146 1 . . 1 1 12 12 ILE H H . . . 1 1 12 12 ILE HG13 H . . . . . 2.3 1.8 3.3 . . . . . A . 12 ILE H . . A . 12 ILE HG13 . 1 . 12 ILE HN . . . 1 . 12 ILE HG12 . . rr_1ad7 1
147 1 . . 1 1 12 12 ILE H H . . . 1 1 12 12 ILE CG2 C . . . . . 2.9 2.3 5.5 . . . . . A . 12 ILE H . . A . 12 ILE CG2 . 1 . 12 ILE HN . . . 1 . 12 ILE CG2 . . rr_1ad7 1
148 1 . . 1 1 12 12 ILE CD1 C . . . 1 1 12 12 ILE H H . . . . . 3.2 2.6 5.8 . . . . . A . 12 ILE CD1 . . A . 12 ILE H . 1 . 12 ILE CD1 . . . 1 . 12 ILE HN . . rr_1ad7 1
149 1 . . 1 1 12 12 ILE HB H . . . 1 1 12 12 ILE HA H . . . . . 2.4 1.9 2.9 . . . . . A . 12 ILE HB . . A . 12 ILE HA . 1 . 12 ILE HB . . . 1 . 12 ILE HA . . rr_1ad7 1
150 1 . . 1 1 12 12 ILE HG12 H . . . 1 1 12 12 ILE HA H . . . . . 2.4 1.9 3.4 . . . . . A . 12 ILE HG12 . . A . 12 ILE HA . 1 . 12 ILE HG11 . . . 1 . 12 ILE HA . . rr_1ad7 1
151 1 . . 1 1 12 12 ILE HA H . . . 1 1 12 12 ILE HG13 H . . . . . 2.4 1.9 3.4 . . . . . A . 12 ILE HA . . A . 12 ILE HG13 . 1 . 12 ILE HA . . . 1 . 12 ILE HG12 . . rr_1ad7 1
152 1 . . 1 1 12 12 ILE HA H . . . 1 1 12 12 ILE CG2 C . . . . . 2.4 1.9 4.9 . . . . . A . 12 ILE HA . . A . 12 ILE CG2 . 1 . 12 ILE HA . . . 1 . 12 ILE CG2 . . rr_1ad7 1
153 1 . . 1 1 12 12 ILE HB H . . . 1 1 12 12 ILE HG12 H . . . . . 2.6 2.1 3.6 . . . . . A . 12 ILE HB . . A . 12 ILE HG12 . 1 . 12 ILE HB . . . 1 . 12 ILE HG11 . . rr_1ad7 1
154 1 . . 1 1 12 12 ILE HB H . . . 1 1 12 12 ILE HG13 H . . . . . 2.6 2.1 3.6 . . . . . A . 12 ILE HB . . A . 12 ILE HG13 . 1 . 12 ILE HB . . . 1 . 12 ILE HG12 . . rr_1ad7 1
155 1 . . 1 1 12 12 ILE HB H . . . 1 1 12 12 ILE CG2 C . . . . . 2.3 1.8 4.8 . . . . . A . 12 ILE HB . . A . 12 ILE CG2 . 1 . 12 ILE HB . . . 1 . 12 ILE CG2 . . rr_1ad7 1
156 1 . . 1 1 12 12 ILE HB H . . . 1 1 12 12 ILE CD1 C . . . . . 2.7 2.2 5.2 . . . . . A . 12 ILE HB . . A . 12 ILE CD1 . 1 . 12 ILE HB . . . 1 . 12 ILE CD1 . . rr_1ad7 1
157 1 . . 1 1 12 12 ILE HB H . . . 1 1 12 12 ILE CG2 C . . . . . 2.3 1.8 4.8 . . . . . A . 12 ILE HB . . A . 12 ILE CG2 . 1 . 12 ILE HB . . . 1 . 12 ILE CG2 . . rr_1ad7 1
158 1 . . 1 1 12 12 ILE HG12 H . . . 1 1 12 12 ILE HG13 H . . . . . 2.2 1.8 3.6 . . . . . A . 12 ILE HG12 . . A . 12 ILE HG13 . 1 . 12 ILE HG11 . . . 1 . 12 ILE HG12 . . rr_1ad7 1
159 1 . . 1 1 12 12 ILE HG12 H . . . 1 1 12 12 ILE CD1 C . . . . . 2.5 2.0 5.0 . . . . . A . 12 ILE HG12 . . A . 12 ILE CD1 . 1 . 12 ILE HG11 . . . 1 . 12 ILE CD1 . . rr_1ad7 1
160 1 . . 1 1 12 12 ILE CD1 C . . . 1 1 12 12 ILE HG13 H . . . . . 2.5 2.0 5.0 . . . . . A . 12 ILE CD1 . . A . 12 ILE HG13 . 1 . 12 ILE CD1 . . . 1 . 12 ILE HG12 . . rr_1ad7 1
161 1 . . 1 1 12 12 ILE CD1 C . . . 1 1 12 12 ILE CG2 C . . . . . 2.9 2.3 5.5 . . . . . A . 12 ILE CD1 . . A . 12 ILE CG2 . 1 . 12 ILE CD1 . . . 1 . 12 ILE CG2 . . rr_1ad7 1
162 1 . . 1 1 12 12 ILE HA H . . . 1 1 13 13 ARG H H . . . . . 3.2 2.6 3.8 . . . . . A . 12 ILE HA . . A . 13 ARG H . 1 . 12 ILE HA . . . 1 . 13 ARG+ HN . . rr_1ad7 1
163 1 . . 1 1 12 12 ILE HG12 H . . . 1 1 13 13 ARG H H . . . . . 2.8 2.2 3.9 . . . . . A . 12 ILE HG12 . . A . 13 ARG H . 1 . 12 ILE HG11 . . . 1 . 13 ARG+ HN . . rr_1ad7 1
164 1 . . 1 1 12 12 ILE CG2 C . . . 1 1 13 13 ARG H H . . . . . 2.7 2.2 5.2 . . . . . A . 12 ILE CG2 . . A . 13 ARG H . 1 . 12 ILE CG2 . . . 1 . 13 ARG+ HN . . rr_1ad7 1
165 1 . . 1 1 12 12 ILE H H . . . 1 1 13 13 ARG H H . . . . . 2.6 2.1 3.1 . . . . . A . 12 ILE H . . A . 13 ARG H . 1 . 12 ILE HN . . . 1 . 13 ARG+ HN . . rr_1ad7 1
166 1 . . 1 1 13 13 ARG H H . . . 1 1 13 13 ARG HA H . . . . . 2.9 2.3 3.5 . . . . . A . 13 ARG H . . A . 13 ARG HA . 1 . 13 ARG+ HN . . . 1 . 13 ARG+ HA . . rr_1ad7 1
167 1 . . 1 1 13 13 ARG HB2 H . . . 1 1 13 13 ARG H H . . . . . 2.6 2.1 3.6 . . . . . A . 13 ARG HB2 . . A . 13 ARG H . 1 . 13 ARG+ HB1 . . . 1 . 13 ARG+ HN . . rr_1ad7 1
168 1 . . 1 1 13 13 ARG HB3 H . . . 1 1 13 13 ARG H H . . . . . 2.6 2.1 3.6 . . . . . A . 13 ARG HB3 . . A . 13 ARG H . 1 . 13 ARG+ HB2 . . . 1 . 13 ARG+ HN . . rr_1ad7 1
169 1 . . 1 1 13 13 ARG HG2 H . . . 1 1 13 13 ARG H H . . . . . 4.8 3.8 6.7 . . . . . A . 13 ARG HG2 . . A . 13 ARG H . 1 . 13 ARG+ HG1 . . . 1 . 13 ARG+ HN . . rr_1ad7 1
170 1 . . 1 1 13 13 ARG H H . . . 1 1 13 13 ARG HG3 H . . . . . 2.9 2.3 4.0 . . . . . A . 13 ARG H . . A . 13 ARG HG3 . 1 . 13 ARG+ HN . . . 1 . 13 ARG+ HG2 . . rr_1ad7 1
171 1 . . 1 1 13 13 ARG HA H . . . 1 1 14 14 CGU H H . . . . . 3.4 2.7 4.1 . . . . . A . 13 ARG HA . . A . 14 CGU H . 1 . 13 ARG+ HA . . . 1 . 14 GLA HN . . rr_1ad7 1
172 1 . . 1 1 13 13 ARG HB2 H . . . 1 1 14 14 CGU H H . . . . . 2.7 2.2 3.7 . . . . . A . 13 ARG HB2 . . A . 14 CGU H . 1 . 13 ARG+ HB1 . . . 1 . 14 GLA HN . . rr_1ad7 1
173 1 . . 1 1 13 13 ARG HB3 H . . . 1 1 14 14 CGU H H . . . . . 2.7 2.2 3.7 . . . . . A . 13 ARG HB3 . . A . 14 CGU H . 1 . 13 ARG+ HB2 . . . 1 . 14 GLA HN . . rr_1ad7 1
174 1 . . 1 1 13 13 ARG HB2 H . . . 1 1 13 13 ARG HG2 H . . . . . 2.8 2.2 4.4 . . . . . A . 13 ARG HB2 . . A . 13 ARG HG2 . 1 . 13 ARG+ HB1 . . . 1 . 13 ARG+ HG1 . . rr_1ad7 1
175 1 . . 1 1 13 13 ARG HB3 H . . . 1 1 13 13 ARG HG2 H . . . . . 3.0 2.4 4.6 . . . . . A . 13 ARG HB3 . . A . 13 ARG HG2 . 1 . 13 ARG+ HB2 . . . 1 . 13 ARG+ HG1 . . rr_1ad7 1
176 1 . . 1 1 13 13 ARG HB2 H . . . 1 1 13 13 ARG HG3 H . . . . . 3.3 2.6 5.0 . . . . . A . 13 ARG HB2 . . A . 13 ARG HG3 . 1 . 13 ARG+ HB1 . . . 1 . 13 ARG+ HG2 . . rr_1ad7 1
177 1 . . 1 1 13 13 ARG HB3 H . . . 1 1 13 13 ARG HG3 H . . . . . 2.8 2.2 4.4 . . . . . A . 13 ARG HB3 . . A . 13 ARG HG3 . 1 . 13 ARG+ HB2 . . . 1 . 13 ARG+ HG2 . . rr_1ad7 1
178 1 . . 1 1 13 13 ARG HB2 H . . . 1 1 13 13 ARG HD2 H . . . . . 2.6 2.1 4.1 . . . . . A . 13 ARG HB2 . . A . 13 ARG HD2 . 1 . 13 ARG+ HB1 . . . 1 . 13 ARG+ HD1 . . rr_1ad7 1
179 1 . . 1 1 13 13 ARG HB3 H . . . 1 1 13 13 ARG HD2 H . . . . . 2.6 2.1 4.1 . . . . . A . 13 ARG HB3 . . A . 13 ARG HD2 . 1 . 13 ARG+ HB2 . . . 1 . 13 ARG+ HD1 . . rr_1ad7 1
180 1 . . 1 1 13 13 ARG HB2 H . . . 1 1 13 13 ARG HD3 H . . . . . 3.0 2.4 4.6 . . . . . A . 13 ARG HB2 . . A . 13 ARG HD3 . 1 . 13 ARG+ HB1 . . . 1 . 13 ARG+ HD2 . . rr_1ad7 1
181 1 . . 1 1 13 13 ARG HB3 H . . . 1 1 13 13 ARG HD3 H . . . . . 3.0 2.4 4.6 . . . . . A . 13 ARG HB3 . . A . 13 ARG HD3 . 1 . 13 ARG+ HB2 . . . 1 . 13 ARG+ HD2 . . rr_1ad7 1
182 1 . . 1 1 13 13 ARG HG2 H . . . 1 1 13 13 ARG HD2 H . . . . . 2.6 2.1 4.1 . . . . . A . 13 ARG HG2 . . A . 13 ARG HD2 . 1 . 13 ARG+ HG1 . . . 1 . 13 ARG+ HD1 . . rr_1ad7 1
183 1 . . 1 1 13 13 ARG HG2 H . . . 1 1 13 13 ARG HD3 H . . . . . 2.5 2.0 4.0 . . . . . A . 13 ARG HG2 . . A . 13 ARG HD3 . 1 . 13 ARG+ HG1 . . . 1 . 13 ARG+ HD2 . . rr_1ad7 1
184 1 . . 1 1 13 13 ARG HD2 H . . . 1 1 13 13 ARG HG3 H . . . . . 2.5 2.0 4.0 . . . . . A . 13 ARG HD2 . . A . 13 ARG HG3 . 1 . 13 ARG+ HD1 . . . 1 . 13 ARG+ HG2 . . rr_1ad7 1
185 1 . . 1 1 13 13 ARG HG3 H . . . 1 1 13 13 ARG HD3 H . . . . . 2.5 2.0 4.0 . . . . . A . 13 ARG HG3 . . A . 13 ARG HD3 . 1 . 13 ARG+ HG2 . . . 1 . 13 ARG+ HD2 . . rr_1ad7 1
186 1 . . 1 1 13 13 ARG HG2 H . . . 1 1 13 13 ARG HD2 H . . . . . 3.0 2.4 4.6 . . . . . A . 13 ARG HG2 . . A . 13 ARG HD2 . 1 . 13 ARG+ HG1 . . . 1 . 13 ARG+ HD1 . . rr_1ad7 1
187 1 . . 1 1 13 13 ARG HD2 H . . . 1 1 13 13 ARG HG3 H . . . . . 2.9 2.3 4.5 . . . . . A . 13 ARG HD2 . . A . 13 ARG HG3 . 1 . 13 ARG+ HD1 . . . 1 . 13 ARG+ HG2 . . rr_1ad7 1
188 1 . . 1 1 13 13 ARG HB2 H . . . 1 1 13 13 ARG HA H . . . . . 2.4 1.9 3.4 . . . . . A . 13 ARG HB2 . . A . 13 ARG HA . 1 . 13 ARG+ HB1 . . . 1 . 13 ARG+ HA . . rr_1ad7 1
189 1 . . 1 1 13 13 ARG HB3 H . . . 1 1 13 13 ARG HA H . . . . . 2.4 1.9 3.4 . . . . . A . 13 ARG HB3 . . A . 13 ARG HA . 1 . 13 ARG+ HB2 . . . 1 . 13 ARG+ HA . . rr_1ad7 1
190 1 . . 1 1 13 13 ARG HG2 H . . . 1 1 13 13 ARG HA H . . . . . 2.6 2.1 3.6 . . . . . A . 13 ARG HG2 . . A . 13 ARG HA . 1 . 13 ARG+ HG1 . . . 1 . 13 ARG+ HA . . rr_1ad7 1
191 1 . . 1 1 13 13 ARG HA H . . . 1 1 13 13 ARG HG3 H . . . . . 2.6 2.1 3.6 . . . . . A . 13 ARG HA . . A . 13 ARG HG3 . 1 . 13 ARG+ HA . . . 1 . 13 ARG+ HG2 . . rr_1ad7 1
192 1 . . 1 1 13 13 ARG HB2 H . . . 1 1 13 13 ARG HB3 H . . . . . 2.9 2.3 4.0 . . . . . A . 13 ARG HB2 . . A . 13 ARG HB3 . 1 . 13 ARG+ HB1 . . . 1 . 13 ARG+ HB2 . . rr_1ad7 1
193 1 . . 1 1 13 13 ARG HG2 H . . . 1 1 13 13 ARG HG3 H . . . . . 2.7 2.2 4.2 . . . . . A . 13 ARG HG2 . . A . 13 ARG HG3 . 1 . 13 ARG+ HG1 . . . 1 . 13 ARG+ HG2 . . rr_1ad7 1
194 1 . . 1 1 13 13 ARG HD2 H . . . 1 1 13 13 ARG HD3 H . . . . . 2.2 1.8 3.6 . . . . . A . 13 ARG HD2 . . A . 13 ARG HD3 . 1 . 13 ARG+ HD1 . . . 1 . 13 ARG+ HD2 . . rr_1ad7 1
195 1 . . 1 1 13 13 ARG H H . . . 1 1 14 14 CGU H H . . . . . 2.6 2.1 3.1 . . . . . A . 13 ARG H . . A . 14 CGU H . 1 . 13 ARG+ HN . . . 1 . 14 GLA HN . . rr_1ad7 1
196 1 . . 1 1 13 13 ARG HD2 H . . . 1 1 16 16 SER H H . . . . . 4.3 3.4 6.1 . . . . . A . 13 ARG HD2 . . A . 16 SER H . 1 . 13 ARG+ HD1 . . . 1 . 16 SER HN . . rr_1ad7 1
197 1 . . 1 1 13 13 ARG HD3 H . . . 1 1 16 16 SER H H . . . . . 3.7 3.0 4.9 . . . . . A . 13 ARG HD3 . . A . 16 SER H . 1 . 13 ARG+ HD2 . . . 1 . 16 SER HN . . rr_1ad7 1
198 1 . . 1 1 14 14 CGU H H . . . 1 1 14 14 CGU HA H . . . . . 2.6 2.1 3.1 . . . . . A . 14 CGU H . . A . 14 CGU HA . 1 . 14 GLA HN . . . 1 . 14 GLA HA . . rr_1ad7 1
199 1 . . 1 1 14 14 CGU H H . . . 1 1 14 14 CGU HB2 H . . . . . 2.7 2.2 3.7 . . . . . A . 14 CGU H . . A . 14 CGU HB2 . 1 . 14 GLA HN . . . 1 . 14 GLA HB1 . . rr_1ad7 1
200 1 . . 1 1 14 14 CGU H H . . . 1 1 14 14 CGU HB3 H . . . . . 2.6 2.1 3.6 . . . . . A . 14 CGU H . . A . 14 CGU HB3 . 1 . 14 GLA HN . . . 1 . 14 GLA HB2 . . rr_1ad7 1
201 1 . . 1 1 14 14 CGU H H . . . 1 1 14 14 CGU HG H . . . . . 2.6 2.1 3.1 . . . . . A . 14 CGU H . . A . 14 CGU HG . 1 . 14 GLA HN . . . 1 . 14 GLA HG . . rr_1ad7 1
202 1 . . 1 1 14 14 CGU HA H . . . 1 1 14 14 CGU HB2 H . . . . . 2.7 2.2 3.7 . . . . . A . 14 CGU HA . . A . 14 CGU HB2 . 1 . 14 GLA HA . . . 1 . 14 GLA HB1 . . rr_1ad7 1
203 1 . . 1 1 14 14 CGU HA H . . . 1 1 14 14 CGU HB3 H . . . . . 2.7 2.2 3.7 . . . . . A . 14 CGU HA . . A . 14 CGU HB3 . 1 . 14 GLA HA . . . 1 . 14 GLA HB2 . . rr_1ad7 1
204 1 . . 1 1 14 14 CGU HA H . . . 1 1 14 14 CGU HG H . . . . . 2.8 2.2 3.4 . . . . . A . 14 CGU HA . . A . 14 CGU HG . 1 . 14 GLA HA . . . 1 . 14 GLA HG . . rr_1ad7 1
205 1 . . 1 1 14 14 CGU HB2 H . . . 1 1 14 14 CGU HG H . . . . . 2.8 2.2 3.9 . . . . . A . 14 CGU HB2 . . A . 14 CGU HG . 1 . 14 GLA HB1 . . . 1 . 14 GLA HG . . rr_1ad7 1
206 1 . . 1 1 14 14 CGU HB2 H . . . 1 1 14 14 CGU HB3 H . . . . . 3.2 2.6 4.8 . . . . . A . 14 CGU HB2 . . A . 14 CGU HB3 . 1 . 14 GLA HB1 . . . 1 . 14 GLA HB2 . . rr_1ad7 1
207 1 . . 1 1 14 14 CGU HB3 H . . . 1 1 14 14 CGU HG H . . . . . 2.8 2.2 3.9 . . . . . A . 14 CGU HB3 . . A . 14 CGU HG . 1 . 14 GLA HB2 . . . 1 . 14 GLA HG . . rr_1ad7 1
208 1 . . 1 1 14 14 CGU HA H . . . 1 1 15 15 LYS H H . . . . . 3.5 2.8 4.2 . . . . . A . 14 CGU HA . . A . 15 LYS H . 1 . 14 GLA HA . . . 1 . 15 LYS+ HN . . rr_1ad7 1
209 1 . . 1 1 14 14 CGU H H . . . 1 1 15 15 LYS H H . . . . . 2.7 2.2 3.2 . . . . . A . 14 CGU H . . A . 15 LYS H . 1 . 14 GLA HN . . . 1 . 15 LYS+ HN . . rr_1ad7 1
210 1 . . 1 1 15 15 LYS H H . . . 1 1 15 15 LYS HA H . . . . . 2.7 2.2 3.2 . . . . . A . 15 LYS H . . A . 15 LYS HA . 1 . 15 LYS+ HN . . . 1 . 15 LYS+ HA . . rr_1ad7 1
211 1 . . 1 1 15 15 LYS H H . . . 1 1 15 15 LYS HB2 H . . . . . 2.7 2.2 3.7 . . . . . A . 15 LYS H . . A . 15 LYS HB2 . 1 . 15 LYS+ HN . . . 1 . 15 LYS+ HB1 . . rr_1ad7 1
212 1 . . 1 1 15 15 LYS H H . . . 1 1 15 15 LYS HB3 H . . . . . 2.7 2.2 3.7 . . . . . A . 15 LYS H . . A . 15 LYS HB3 . 1 . 15 LYS+ HN . . . 1 . 15 LYS+ HB2 . . rr_1ad7 1
213 1 . . 1 1 15 15 LYS H H . . . 1 1 15 15 LYS HD2 H . . . . . 3.5 2.8 4.7 . . . . . A . 15 LYS H . . A . 15 LYS HD2 . 1 . 15 LYS+ HN . . . 1 . 15 LYS+ HD1 . . rr_1ad7 1
214 1 . . 1 1 15 15 LYS H H . . . 1 1 15 15 LYS HD3 H . . . . . 3.5 2.8 4.7 . . . . . A . 15 LYS H . . A . 15 LYS HD3 . 1 . 15 LYS+ HN . . . 1 . 15 LYS+ HD2 . . rr_1ad7 1
215 1 . . 1 1 16 16 SER H H . . . 1 1 15 15 LYS HA H . . . . . 2.9 2.3 3.5 . . . . . A . 16 SER H . . A . 15 LYS HA . 1 . 16 SER HN . . . 1 . 15 LYS+ HA . . rr_1ad7 1
216 1 . . 1 1 16 16 SER H H . . . 1 1 15 15 LYS HB2 H . . . . . 2.9 2.3 3.5 . . . . . A . 16 SER H . . A . 15 LYS HB2 . 1 . 16 SER HN . . . 1 . 15 LYS+ HB1 . . rr_1ad7 1
217 1 . . 1 1 16 16 SER H H . . . 1 1 15 15 LYS HB3 H . . . . . 2.9 2.3 3.5 . . . . . A . 16 SER H . . A . 15 LYS HB3 . 1 . 16 SER HN . . . 1 . 15 LYS+ HB2 . . rr_1ad7 1
218 1 . . 1 1 15 15 LYS HB2 H . . . 1 1 15 15 LYS HD2 H . . . . . 2.9 2.3 4.5 . . . . . A . 15 LYS HB2 . . A . 15 LYS HD2 . 1 . 15 LYS+ HB1 . . . 1 . 15 LYS+ HD1 . . rr_1ad7 1
219 1 . . 1 1 15 15 LYS HB3 H . . . 1 1 15 15 LYS HD2 H . . . . . 2.9 2.3 4.5 . . . . . A . 15 LYS HB3 . . A . 15 LYS HD2 . 1 . 15 LYS+ HB2 . . . 1 . 15 LYS+ HD1 . . rr_1ad7 1
220 1 . . 1 1 15 15 LYS HB2 H . . . 1 1 15 15 LYS HD3 H . . . . . 2.9 2.3 4.5 . . . . . A . 15 LYS HB2 . . A . 15 LYS HD3 . 1 . 15 LYS+ HB1 . . . 1 . 15 LYS+ HD2 . . rr_1ad7 1
221 1 . . 1 1 15 15 LYS HB3 H . . . 1 1 15 15 LYS HD3 H . . . . . 2.9 2.3 4.5 . . . . . A . 15 LYS HB3 . . A . 15 LYS HD3 . 1 . 15 LYS+ HB2 . . . 1 . 15 LYS+ HD2 . . rr_1ad7 1
222 1 . . 1 1 15 15 LYS HA H . . . 1 1 15 15 LYS HB2 H . . . . . 2.8 2.2 3.9 . . . . . A . 15 LYS HA . . A . 15 LYS HB2 . 1 . 15 LYS+ HA . . . 1 . 15 LYS+ HB1 . . rr_1ad7 1
223 1 . . 1 1 15 15 LYS HA H . . . 1 1 15 15 LYS HB3 H . . . . . 2.8 2.2 3.9 . . . . . A . 15 LYS HA . . A . 15 LYS HB3 . 1 . 15 LYS+ HA . . . 1 . 15 LYS+ HB2 . . rr_1ad7 1
224 1 . . 1 1 15 15 LYS HA H . . . 1 1 15 15 LYS HD2 H . . . . . 4.0 3.2 5.7 . . . . . A . 15 LYS HA . . A . 15 LYS HD2 . 1 . 15 LYS+ HA . . . 1 . 15 LYS+ HD1 . . rr_1ad7 1
225 1 . . 1 1 15 15 LYS HA H . . . 1 1 15 15 LYS HD3 H . . . . . 3.8 3.0 5.1 . . . . . A . 15 LYS HA . . A . 15 LYS HD3 . 1 . 15 LYS+ HA . . . 1 . 15 LYS+ HD2 . . rr_1ad7 1
226 1 . . 1 1 15 15 LYS HA H . . . 1 1 15 15 LYS HG2 H . . . . . 2.9 2.3 4.5 . . . . . A . 15 LYS HA . . A . 15 LYS HG2 . 1 . 15 LYS+ HA . . . 1 . 15 LYS+ HG1 . . rr_1ad7 1
227 1 . . 1 1 15 15 LYS HD3 H . . . 1 1 15 15 LYS HG2 H . . . . . 2.8 2.2 4.4 . . . . . A . 15 LYS HD3 . . A . 15 LYS HG2 . 1 . 15 LYS+ HD2 . . . 1 . 15 LYS+ HG1 . . rr_1ad7 1
228 1 . . 1 1 15 15 LYS HD2 H . . . 1 1 15 15 LYS HG2 H . . . . . 2.8 2.2 4.4 . . . . . A . 15 LYS HD2 . . A . 15 LYS HG2 . 1 . 15 LYS+ HD1 . . . 1 . 15 LYS+ HG1 . . rr_1ad7 1
229 1 . . 1 1 16 16 SER H H . . . 1 1 15 15 LYS H H . . . . . 4.4 3.5 5.7 . . . . . A . 16 SER H . . A . 15 LYS H . 1 . 16 SER HN . . . 1 . 15 LYS+ HN . . rr_1ad7 1
230 1 . . 1 1 16 16 SER H H . . . 1 1 16 16 SER HA H . . . . . 2.7 2.2 3.2 . . . . . A . 16 SER H . . A . 16 SER HA . 1 . 16 SER HN . . . 1 . 16 SER HA . . rr_1ad7 1
231 1 . . 1 1 16 16 SER HA H . . . 1 1 16 16 SER HB2 H . . . . . 2.9 2.3 4.0 . . . . . A . 16 SER HA . . A . 16 SER HB2 . 1 . 16 SER HA . . . 1 . 16 SER HB1 . . rr_1ad7 1
232 1 . . 1 1 16 16 SER HA H . . . 1 1 16 16 SER HB3 H . . . . . 2.9 2.3 4.0 . . . . . A . 16 SER HA . . A . 16 SER HB3 . 1 . 16 SER HA . . . 1 . 16 SER HB2 . . rr_1ad7 1
233 1 . . 1 1 16 16 SER H H . . . 1 1 16 16 SER HB2 H . . . . . 2.9 2.3 3.5 . . . . . A . 16 SER H . . A . 16 SER HB2 . 1 . 16 SER HN . . . 1 . 16 SER HB1 . . rr_1ad7 1
234 1 . . 1 1 16 16 SER H H . . . 1 1 16 16 SER HB3 H . . . . . 2.9 2.3 3.5 . . . . . A . 16 SER H . . A . 16 SER HB3 . 1 . 16 SER HN . . . 1 . 16 SER HB2 . . rr_1ad7 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 "remote_prochiral_center NOE_distance" 1 1 3 13 rr_1ad7 1
stop_
loop_
_Gen_dist_constraint_conv_err.ID
_Gen_dist_constraint_conv_err.Gen_dist_constraint_parse_file_ID
_Gen_dist_constraint_conv_err.Parse_file_constraint_ID
_Gen_dist_constraint_conv_err.Conv_error_type
_Gen_dist_constraint_conv_err.Conv_error_note
_Gen_dist_constraint_conv_err.Entry_ID
_Gen_dist_constraint_conv_err.Gen_dist_constraint_list_ID
1 2 1 1 "Not handling restraint 1, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_1ad7 1
2 2 1 1 "Not handling restraint 1, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_1ad7 1
3 2 2 1 "Not handling restraint 2, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_1ad7 1
4 2 2 1 "Not handling restraint 2, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_1ad7 1
5 2 3 1 "Distance restraint (original ID 3) deleted - no constraint items left." rr_1ad7 1
6 2 3 1 "Not handling item from distance restraint (original ID 3) - duplicate resonances" rr_1ad7 1
7 2 7 1 "Not handling restraint 7, item 1, resonance(s) '1.2.HG' (nmrStar names) not linked" rr_1ad7 1
8 2 10 1 "Not handling restraint 10, item 1, resonance(s) '1.2.HG' (nmrStar names) not linked" rr_1ad7 1
9 2 11 1 "Not handling restraint 11, item 1, resonance(s) '1.2.HG' (nmrStar names) not linked" rr_1ad7 1
10 2 12 1 "Not handling restraint 12, item 1, resonance(s) '1.2.HG' (nmrStar names) not linked" rr_1ad7 1
11 2 13 1 "Not handling restraint 13, item 1, resonance(s) '1.2.HG' (nmrStar names) not linked" rr_1ad7 1
stop_
save_
save_Discover_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Sf_framecode Discover_distance_constraints_2_1
_Distance_constraint_list.Entry_ID rr_1ad7
_Distance_constraint_list.ID 1
_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 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_1ad7 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_1ad7 1
2 1 . . . rr_1ad7 1
3 1 . . . rr_1ad7 1
4 1 . . . rr_1ad7 1
5 1 . . . rr_1ad7 1
6 1 . . . rr_1ad7 1
7 1 . . . rr_1ad7 1
8 1 . . . rr_1ad7 1
9 1 . . . rr_1ad7 1
10 1 . . . rr_1ad7 1
11 1 . . . rr_1ad7 1
12 1 . . . rr_1ad7 1
13 1 . . . rr_1ad7 1
14 1 . . . rr_1ad7 1
15 1 . . . rr_1ad7 1
16 1 . . . rr_1ad7 1
17 1 . . . rr_1ad7 1
18 1 . . . rr_1ad7 1
19 1 . . . rr_1ad7 1
20 1 . . . rr_1ad7 1
21 1 . . . rr_1ad7 1
22 1 . . . rr_1ad7 1
23 1 . . . rr_1ad7 1
24 1 . . . rr_1ad7 1
25 1 . . . rr_1ad7 1
26 1 . . . rr_1ad7 1
27 1 . . . rr_1ad7 1
28 1 . . . rr_1ad7 1
29 1 . . . rr_1ad7 1
30 1 . . . rr_1ad7 1
31 1 . . . rr_1ad7 1
32 1 . . . rr_1ad7 1
33 1 . . . rr_1ad7 1
34 1 . . . rr_1ad7 1
35 1 . . . rr_1ad7 1
36 1 . . . rr_1ad7 1
37 1 . . . rr_1ad7 1
38 1 . . . rr_1ad7 1
39 1 . . . rr_1ad7 1
40 1 . . . rr_1ad7 1
41 1 . . . rr_1ad7 1
42 1 . . . rr_1ad7 1
43 1 . . . rr_1ad7 1
44 1 . . . rr_1ad7 1
45 1 . . . rr_1ad7 1
46 1 . . . rr_1ad7 1
47 1 . . . rr_1ad7 1
48 1 . . . rr_1ad7 1
49 1 . . . rr_1ad7 1
50 1 . . . rr_1ad7 1
51 1 . . . rr_1ad7 1
52 1 . . . rr_1ad7 1
53 1 . . . rr_1ad7 1
54 1 . . . rr_1ad7 1
55 1 . . . rr_1ad7 1
56 1 . . . rr_1ad7 1
57 1 . . . rr_1ad7 1
58 1 . . . rr_1ad7 1
59 1 . . . rr_1ad7 1
60 1 . . . rr_1ad7 1
61 1 . . . rr_1ad7 1
62 1 . . . rr_1ad7 1
63 1 . . . rr_1ad7 1
64 1 . . . rr_1ad7 1
65 1 . . . rr_1ad7 1
66 1 . . . rr_1ad7 1
67 1 . . . rr_1ad7 1
68 1 . . . rr_1ad7 1
69 1 . . . rr_1ad7 1
70 1 . . . rr_1ad7 1
71 1 . . . rr_1ad7 1
72 1 . . . rr_1ad7 1
73 1 . . . rr_1ad7 1
74 1 . . . rr_1ad7 1
75 1 . . . rr_1ad7 1
76 1 . . . rr_1ad7 1
77 1 . . . rr_1ad7 1
78 1 . . . rr_1ad7 1
79 1 . . . rr_1ad7 1
80 1 . . . rr_1ad7 1
81 1 . . . rr_1ad7 1
82 1 . . . rr_1ad7 1
83 1 . . . rr_1ad7 1
84 1 . . . rr_1ad7 1
85 1 . . . rr_1ad7 1
86 1 . . . rr_1ad7 1
87 1 . . . rr_1ad7 1
88 1 . . . rr_1ad7 1
89 1 . . . rr_1ad7 1
90 1 . . . rr_1ad7 1
91 1 . . . rr_1ad7 1
92 1 . . . rr_1ad7 1
93 1 . . . rr_1ad7 1
94 1 . . . rr_1ad7 1
95 1 . . . rr_1ad7 1
96 1 . . . rr_1ad7 1
97 1 . . . rr_1ad7 1
98 1 . . . rr_1ad7 1
99 1 . . . rr_1ad7 1
100 1 . . . rr_1ad7 1
101 1 . . . rr_1ad7 1
102 1 . . . rr_1ad7 1
103 1 . . . rr_1ad7 1
104 1 . . . rr_1ad7 1
105 1 . . . rr_1ad7 1
106 1 . . . rr_1ad7 1
107 1 . . . rr_1ad7 1
108 1 . . . rr_1ad7 1
109 1 . . . rr_1ad7 1
110 1 . . . rr_1ad7 1
111 1 . . . rr_1ad7 1
112 1 . . . rr_1ad7 1
113 1 . . . rr_1ad7 1
114 1 . . . rr_1ad7 1
115 1 . . . rr_1ad7 1
116 1 . . . rr_1ad7 1
117 1 . . . rr_1ad7 1
118 1 . . . rr_1ad7 1
119 1 . . . rr_1ad7 1
120 1 . . . rr_1ad7 1
121 1 . . . rr_1ad7 1
122 1 . . . rr_1ad7 1
123 1 . . . rr_1ad7 1
124 1 . . . rr_1ad7 1
125 1 . . . rr_1ad7 1
126 1 . . . rr_1ad7 1
127 1 . . . rr_1ad7 1
128 1 . . . rr_1ad7 1
129 1 . . . rr_1ad7 1
130 1 . . . rr_1ad7 1
131 1 . . . rr_1ad7 1
132 1 . . . rr_1ad7 1
133 1 . . . rr_1ad7 1
134 1 . . . rr_1ad7 1
135 1 . . . rr_1ad7 1
136 1 . . . rr_1ad7 1
137 1 . . . rr_1ad7 1
138 1 . . . rr_1ad7 1
139 1 . . . rr_1ad7 1
140 1 . . . rr_1ad7 1
141 1 . . . rr_1ad7 1
142 1 . . . rr_1ad7 1
143 1 . . . rr_1ad7 1
144 1 . . . rr_1ad7 1
145 1 . . . rr_1ad7 1
146 1 . . . rr_1ad7 1
147 1 . . . rr_1ad7 1
148 1 . . . rr_1ad7 1
149 1 . . . rr_1ad7 1
150 1 . . . rr_1ad7 1
151 1 . . . rr_1ad7 1
152 1 . . . rr_1ad7 1
153 1 . . . rr_1ad7 1
154 1 . . . rr_1ad7 1
155 1 . . . rr_1ad7 1
156 1 . . . rr_1ad7 1
157 1 . . . rr_1ad7 1
158 1 . . . rr_1ad7 1
159 1 . . . rr_1ad7 1
160 1 . . . rr_1ad7 1
161 1 . . . rr_1ad7 1
162 1 . . . rr_1ad7 1
163 1 . . . rr_1ad7 1
164 1 . . . rr_1ad7 1
165 1 . . . rr_1ad7 1
166 1 . . . rr_1ad7 1
167 1 . . . rr_1ad7 1
168 1 . . . rr_1ad7 1
169 1 . . . rr_1ad7 1
170 1 . . . rr_1ad7 1
171 1 . . . rr_1ad7 1
172 1 . . . rr_1ad7 1
173 1 . . . rr_1ad7 1
174 1 . . . rr_1ad7 1
175 1 . . . rr_1ad7 1
176 1 . . . rr_1ad7 1
177 1 . . . rr_1ad7 1
178 1 . . . rr_1ad7 1
179 1 . . . rr_1ad7 1
180 1 . . . rr_1ad7 1
181 1 . . . rr_1ad7 1
182 1 . . . rr_1ad7 1
183 1 . . . rr_1ad7 1
184 1 . . . rr_1ad7 1
185 1 . . . rr_1ad7 1
186 1 . . . rr_1ad7 1
187 1 . . . rr_1ad7 1
188 1 . . . rr_1ad7 1
189 1 . . . rr_1ad7 1
190 1 . . . rr_1ad7 1
191 1 . . . rr_1ad7 1
192 1 . . . rr_1ad7 1
193 1 . . . rr_1ad7 1
194 1 . . . rr_1ad7 1
195 1 . . . rr_1ad7 1
196 1 . . . rr_1ad7 1
197 1 . . . rr_1ad7 1
198 1 . . . rr_1ad7 1
199 1 . . . rr_1ad7 1
200 1 . . . rr_1ad7 1
201 1 . . . rr_1ad7 1
202 1 . . . rr_1ad7 1
203 1 . . . rr_1ad7 1
204 1 . . . rr_1ad7 1
205 1 . . . rr_1ad7 1
206 1 . . . rr_1ad7 1
207 1 . . . rr_1ad7 1
208 1 . . . rr_1ad7 1
209 1 . . . rr_1ad7 1
210 1 . . . rr_1ad7 1
211 1 . . . rr_1ad7 1
212 1 . . . rr_1ad7 1
213 1 . . . rr_1ad7 1
214 1 . . . rr_1ad7 1
215 1 . . . rr_1ad7 1
216 1 . . . rr_1ad7 1
217 1 . . . rr_1ad7 1
218 1 . . . rr_1ad7 1
219 1 . . . rr_1ad7 1
220 1 . . . rr_1ad7 1
221 1 . . . rr_1ad7 1
222 1 . . . rr_1ad7 1
223 1 . . . rr_1ad7 1
224 1 . . . rr_1ad7 1
225 1 . . . rr_1ad7 1
226 1 . . . rr_1ad7 1
227 1 . . . rr_1ad7 1
228 1 . . . rr_1ad7 1
229 1 . . . rr_1ad7 1
230 1 . . . rr_1ad7 1
231 1 . . . rr_1ad7 1
232 1 . . . rr_1ad7 1
233 1 . . . rr_1ad7 1
234 1 . . . rr_1ad7 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 2 2 GLU H H . . 1 . 2 GLU- HN rr_1ad7 1
1 1 . 2 . 1 1 2 2 GLU HA H . . 1 . 2 GLU- HA rr_1ad7 1
2 1 . 1 . 1 1 2 2 GLU H H . . 1 . 2 GLU- HN rr_1ad7 1
2 1 . 2 . 1 1 2 2 GLU HB2 H . . 1 . 2 GLU- HB1 rr_1ad7 1
3 1 . 1 . 1 1 2 2 GLU H H . . 1 . 2 GLU- HN rr_1ad7 1
3 1 . 2 . 1 1 2 2 GLU HB3 H . . 1 . 2 GLU- HB2 rr_1ad7 1
4 1 . 1 . 1 1 2 2 GLU HA H . . 1 . 2 GLU- HA rr_1ad7 1
4 1 . 2 . 1 1 2 2 GLU HB2 H . . 1 . 2 GLU- HB1 rr_1ad7 1
5 1 . 1 . 1 1 2 2 GLU HA H . . 1 . 2 GLU- HA rr_1ad7 1
5 1 . 2 . 1 1 2 2 GLU HB3 H . . 1 . 2 GLU- HB2 rr_1ad7 1
6 1 . 1 . 1 1 2 2 GLU HA H . . 1 . 2 GLU- HA rr_1ad7 1
6 1 . 2 . 1 1 3 3 CGU H H . . 1 . 3 GLA HN rr_1ad7 1
7 1 . 1 . 1 1 3 3 CGU H H . . 1 . 3 GLA HN rr_1ad7 1
7 1 . 2 . 1 1 3 3 CGU HA H . . 1 . 3 GLA HA rr_1ad7 1
8 1 . 1 . 1 1 3 3 CGU H H . . 1 . 3 GLA HN rr_1ad7 1
8 1 . 2 . 1 1 3 3 CGU HB2 H . . 1 . 3 GLA HB1 rr_1ad7 1
9 1 . 1 . 1 1 3 3 CGU H H . . 1 . 3 GLA HN rr_1ad7 1
9 1 . 2 . 1 1 3 3 CGU HB3 H . . 1 . 3 GLA HB2 rr_1ad7 1
10 1 . 1 . 1 1 3 3 CGU H H . . 1 . 3 GLA HN rr_1ad7 1
10 1 . 2 . 1 1 3 3 CGU HG H . . 1 . 3 GLA HG rr_1ad7 1
11 1 . 1 . 1 1 3 3 CGU HA H . . 1 . 3 GLA HA rr_1ad7 1
11 1 . 2 . 1 1 3 3 CGU HB2 H . . 1 . 3 GLA HB1 rr_1ad7 1
12 1 . 1 . 1 1 3 3 CGU HA H . . 1 . 3 GLA HA rr_1ad7 1
12 1 . 2 . 1 1 3 3 CGU HB3 H . . 1 . 3 GLA HB2 rr_1ad7 1
13 1 . 1 . 1 1 3 3 CGU HA H . . 1 . 3 GLA HA rr_1ad7 1
13 1 . 2 . 1 1 3 3 CGU HG H . . 1 . 3 GLA HG rr_1ad7 1
14 1 . 1 . 1 1 3 3 CGU H H . . 1 . 3 GLA HN rr_1ad7 1
14 1 . 2 . 1 1 4 4 CGU H H . . 1 . 4 GLA HN rr_1ad7 1
15 1 . 1 . 1 1 3 3 CGU HG H . . 1 . 3 GLA HG rr_1ad7 1
15 1 . 2 . 1 1 3 3 CGU HB2 H . . 1 . 3 GLA HB1 rr_1ad7 1
16 1 . 1 . 1 1 3 3 CGU HG H . . 1 . 3 GLA HG rr_1ad7 1
16 1 . 2 . 1 1 3 3 CGU HB3 H . . 1 . 3 GLA HB2 rr_1ad7 1
17 1 . 1 . 1 1 3 3 CGU HB2 H . . 1 . 3 GLA HB1 rr_1ad7 1
17 1 . 2 . 1 1 3 3 CGU HB3 H . . 1 . 3 GLA HB2 rr_1ad7 1
18 1 . 1 . 1 1 3 3 CGU HB3 H . . 1 . 3 GLA HB2 rr_1ad7 1
18 1 . 2 . 1 1 4 4 CGU H H . . 1 . 4 GLA HN rr_1ad7 1
19 1 . 1 . 1 1 4 4 CGU H H . . 1 . 4 GLA HN rr_1ad7 1
19 1 . 2 . 1 1 4 4 CGU HA H . . 1 . 4 GLA HA rr_1ad7 1
20 1 . 1 . 1 1 4 4 CGU H H . . 1 . 4 GLA HN rr_1ad7 1
20 1 . 2 . 1 1 4 4 CGU HB2 H . . 1 . 4 GLA HB1 rr_1ad7 1
21 1 . 1 . 1 1 4 4 CGU H H . . 1 . 4 GLA HN rr_1ad7 1
21 1 . 2 . 1 1 4 4 CGU HB3 H . . 1 . 4 GLA HB2 rr_1ad7 1
22 1 . 1 . 1 1 4 4 CGU H H . . 1 . 4 GLA HN rr_1ad7 1
22 1 . 2 . 1 1 4 4 CGU HG H . . 1 . 4 GLA HG rr_1ad7 1
23 1 . 1 . 1 1 4 4 CGU HA H . . 1 . 4 GLA HA rr_1ad7 1
23 1 . 2 . 1 1 4 4 CGU HB2 H . . 1 . 4 GLA HB1 rr_1ad7 1
24 1 . 1 . 1 1 4 4 CGU HA H . . 1 . 4 GLA HA rr_1ad7 1
24 1 . 2 . 1 1 4 4 CGU HB3 H . . 1 . 4 GLA HB2 rr_1ad7 1
25 1 . 1 . 1 1 4 4 CGU HA H . . 1 . 4 GLA HA rr_1ad7 1
25 1 . 2 . 1 1 4 4 CGU HG H . . 1 . 4 GLA HG rr_1ad7 1
26 1 . 1 . 1 1 4 4 CGU HB2 H . . 1 . 4 GLA HB1 rr_1ad7 1
26 1 . 2 . 1 1 4 4 CGU HG H . . 1 . 4 GLA HG rr_1ad7 1
27 1 . 1 . 1 1 4 4 CGU HB3 H . . 1 . 4 GLA HB2 rr_1ad7 1
27 1 . 2 . 1 1 4 4 CGU HG H . . 1 . 4 GLA HG rr_1ad7 1
28 1 . 1 . 1 1 4 4 CGU HB2 H . . 1 . 4 GLA HB1 rr_1ad7 1
28 1 . 2 . 1 1 4 4 CGU HB3 H . . 1 . 4 GLA HB2 rr_1ad7 1
29 1 . 1 . 1 1 4 4 CGU HA H . . 1 . 4 GLA HA rr_1ad7 1
29 1 . 2 . 1 1 5 5 LEU H H . . 1 . 5 LEU HN rr_1ad7 1
30 1 . 1 . 1 1 4 4 CGU HB2 H . . 1 . 4 GLA HB1 rr_1ad7 1
30 1 . 2 . 1 1 5 5 LEU H H . . 1 . 5 LEU HN rr_1ad7 1
31 1 . 1 . 1 1 4 4 CGU HB3 H . . 1 . 4 GLA HB2 rr_1ad7 1
31 1 . 2 . 1 1 5 5 LEU H H . . 1 . 5 LEU HN rr_1ad7 1
32 1 . 1 . 1 1 4 4 CGU HA H . . 1 . 4 GLA HA rr_1ad7 1
32 1 . 2 . 1 1 7 7 CGU H H . . 1 . 7 GLA HN rr_1ad7 1
33 1 . 1 . 1 1 4 4 CGU H H . . 1 . 4 GLA HN rr_1ad7 1
33 1 . 2 . 1 1 5 5 LEU H H . . 1 . 5 LEU HN rr_1ad7 1
34 1 . 1 . 1 1 4 4 CGU HG H . . 1 . 4 GLA HG rr_1ad7 1
34 1 . 2 . 1 1 7 7 CGU HG H . . 1 . 7 GLA HG rr_1ad7 1
35 1 . 1 . 1 1 4 4 CGU HG H . . 1 . 4 GLA HG rr_1ad7 1
35 1 . 2 . 1 1 8 8 ASN H H . . 1 . 8 ASN HN rr_1ad7 1
36 1 . 1 . 1 1 5 5 LEU H H . . 1 . 5 LEU HN rr_1ad7 1
36 1 . 2 . 1 1 5 5 LEU HA H . . 1 . 5 LEU HA rr_1ad7 1
37 1 . 1 . 1 1 5 5 LEU H H . . 1 . 5 LEU HN rr_1ad7 1
37 1 . 2 . 1 1 5 5 LEU HB2 H . . 1 . 5 LEU HB1 rr_1ad7 1
38 1 . 1 . 1 1 5 5 LEU H H . . 1 . 5 LEU HN rr_1ad7 1
38 1 . 2 . 1 1 5 5 LEU HB3 H . . 1 . 5 LEU HB2 rr_1ad7 1
39 1 . 1 . 1 1 5 5 LEU HB2 H . . 1 . 5 LEU HB1 rr_1ad7 1
39 1 . 2 . 1 1 6 6 GLN H H . . 1 . 6 GLN HN rr_1ad7 1
40 1 . 1 . 1 1 5 5 LEU HB3 H . . 1 . 5 LEU HB2 rr_1ad7 1
40 1 . 2 . 1 1 6 6 GLN H H . . 1 . 6 GLN HN rr_1ad7 1
41 1 . 1 . 1 1 5 5 LEU HA H . . 1 . 5 LEU HA rr_1ad7 1
41 1 . 2 . 1 1 5 5 LEU HG H . . 1 . 5 LEU HG rr_1ad7 1
42 1 . 1 . 1 1 5 5 LEU HA H . . 1 . 5 LEU HA rr_1ad7 1
42 1 . 2 . 1 1 5 5 LEU CD1 C . . 1 . 5 LEU CD1 rr_1ad7 1
43 1 . 1 . 1 1 5 5 LEU HA H . . 1 . 5 LEU HA rr_1ad7 1
43 1 . 2 . 1 1 5 5 LEU HB2 H . . 1 . 5 LEU HB1 rr_1ad7 1
44 1 . 1 . 1 1 5 5 LEU HA H . . 1 . 5 LEU HA rr_1ad7 1
44 1 . 2 . 1 1 5 5 LEU HB3 H . . 1 . 5 LEU HB2 rr_1ad7 1
45 1 . 1 . 1 1 5 5 LEU HA H . . 1 . 5 LEU HA rr_1ad7 1
45 1 . 2 . 1 1 6 6 GLN H H . . 1 . 6 GLN HN rr_1ad7 1
46 1 . 1 . 1 1 5 5 LEU H H . . 1 . 5 LEU HN rr_1ad7 1
46 1 . 2 . 1 1 6 6 GLN H H . . 1 . 6 GLN HN rr_1ad7 1
47 1 . 1 . 1 1 5 5 LEU HB2 H . . 1 . 5 LEU HB1 rr_1ad7 1
47 1 . 2 . 1 1 8 8 ASN H H . . 1 . 8 ASN HN rr_1ad7 1
48 1 . 1 . 1 1 5 5 LEU HB3 H . . 1 . 5 LEU HB2 rr_1ad7 1
48 1 . 2 . 1 1 8 8 ASN H H . . 1 . 8 ASN HN rr_1ad7 1
49 1 . 1 . 1 1 5 5 LEU HB2 H . . 1 . 5 LEU HB1 rr_1ad7 1
49 1 . 2 . 1 1 5 5 LEU HB3 H . . 1 . 5 LEU HB2 rr_1ad7 1
50 1 . 1 . 1 1 5 5 LEU HB2 H . . 1 . 5 LEU HB1 rr_1ad7 1
50 1 . 2 . 1 1 5 5 LEU CD2 C . . 1 . 5 LEU CD2 rr_1ad7 1
51 1 . 1 . 1 1 6 6 GLN H H . . 1 . 6 GLN HN rr_1ad7 1
51 1 . 2 . 1 1 6 6 GLN HA H . . 1 . 6 GLN HA rr_1ad7 1
52 1 . 1 . 1 1 6 6 GLN H H . . 1 . 6 GLN HN rr_1ad7 1
52 1 . 2 . 1 1 6 6 GLN HB2 H . . 1 . 6 GLN HB1 rr_1ad7 1
53 1 . 1 . 1 1 6 6 GLN H H . . 1 . 6 GLN HN rr_1ad7 1
53 1 . 2 . 1 1 6 6 GLN HB3 H . . 1 . 6 GLN HB2 rr_1ad7 1
54 1 . 1 . 1 1 6 6 GLN H H . . 1 . 6 GLN HN rr_1ad7 1
54 1 . 2 . 1 1 6 6 GLN HG2 H . . 1 . 6 GLN HG1 rr_1ad7 1
55 1 . 1 . 1 1 6 6 GLN H H . . 1 . 6 GLN HN rr_1ad7 1
55 1 . 2 . 1 1 6 6 GLN HG3 H . . 1 . 6 GLN HG2 rr_1ad7 1
56 1 . 1 . 1 1 6 6 GLN HB2 H . . 1 . 6 GLN HB1 rr_1ad7 1
56 1 . 2 . 1 1 7 7 CGU H H . . 1 . 7 GLA HN rr_1ad7 1
57 1 . 1 . 1 1 6 6 GLN HB3 H . . 1 . 6 GLN HB2 rr_1ad7 1
57 1 . 2 . 1 1 7 7 CGU H H . . 1 . 7 GLA HN rr_1ad7 1
58 1 . 1 . 1 1 6 6 GLN H H . . 1 . 6 GLN HN rr_1ad7 1
58 1 . 2 . 1 1 7 7 CGU H H . . 1 . 7 GLA HN rr_1ad7 1
59 1 . 1 . 1 1 6 6 GLN HA H . . 1 . 6 GLN HA rr_1ad7 1
59 1 . 2 . 1 1 7 7 CGU H H . . 1 . 7 GLA HN rr_1ad7 1
60 1 . 1 . 1 1 6 6 GLN HA H . . 1 . 6 GLN HA rr_1ad7 1
60 1 . 2 . 1 1 6 6 GLN HB2 H . . 1 . 6 GLN HB1 rr_1ad7 1
61 1 . 1 . 1 1 6 6 GLN HA H . . 1 . 6 GLN HA rr_1ad7 1
61 1 . 2 . 1 1 6 6 GLN HB3 H . . 1 . 6 GLN HB2 rr_1ad7 1
62 1 . 1 . 1 1 6 6 GLN HA H . . 1 . 6 GLN HA rr_1ad7 1
62 1 . 2 . 1 1 6 6 GLN HG2 H . . 1 . 6 GLN HG1 rr_1ad7 1
63 1 . 1 . 1 1 6 6 GLN HA H . . 1 . 6 GLN HA rr_1ad7 1
63 1 . 2 . 1 1 6 6 GLN HG3 H . . 1 . 6 GLN HG2 rr_1ad7 1
64 1 . 1 . 1 1 6 6 GLN HG3 H . . 1 . 6 GLN HG2 rr_1ad7 1
64 1 . 2 . 1 1 6 6 GLN HB2 H . . 1 . 6 GLN HB1 rr_1ad7 1
65 1 . 1 . 1 1 6 6 GLN HG3 H . . 1 . 6 GLN HG2 rr_1ad7 1
65 1 . 2 . 1 1 6 6 GLN HB3 H . . 1 . 6 GLN HB2 rr_1ad7 1
66 1 . 1 . 1 1 6 6 GLN HB2 H . . 1 . 6 GLN HB1 rr_1ad7 1
66 1 . 2 . 1 1 6 6 GLN HB3 H . . 1 . 6 GLN HB2 rr_1ad7 1
67 1 . 1 . 1 1 6 6 GLN HG2 H . . 1 . 6 GLN HG1 rr_1ad7 1
67 1 . 2 . 1 1 6 6 GLN HG3 H . . 1 . 6 GLN HG2 rr_1ad7 1
68 1 . 1 . 1 1 6 6 GLN NE2 N . . 1 . 6 GLN NE2 rr_1ad7 1
68 1 . 2 . 1 1 6 6 GLN HG2 H . . 1 . 6 GLN HG1 rr_1ad7 1
69 1 . 1 . 1 1 6 6 GLN NE2 N . . 1 . 6 GLN NE2 rr_1ad7 1
69 1 . 2 . 1 1 6 6 GLN HG3 H . . 1 . 6 GLN HG2 rr_1ad7 1
70 1 . 1 . 1 1 7 7 CGU H H . . 1 . 7 GLA HN rr_1ad7 1
70 1 . 2 . 1 1 7 7 CGU HA H . . 1 . 7 GLA HA rr_1ad7 1
71 1 . 1 . 1 1 7 7 CGU H H . . 1 . 7 GLA HN rr_1ad7 1
71 1 . 2 . 1 1 7 7 CGU HB2 H . . 1 . 7 GLA HB1 rr_1ad7 1
72 1 . 1 . 1 1 7 7 CGU H H . . 1 . 7 GLA HN rr_1ad7 1
72 1 . 2 . 1 1 7 7 CGU HB3 H . . 1 . 7 GLA HB2 rr_1ad7 1
73 1 . 1 . 1 1 7 7 CGU H H . . 1 . 7 GLA HN rr_1ad7 1
73 1 . 2 . 1 1 7 7 CGU HG H . . 1 . 7 GLA HG rr_1ad7 1
74 1 . 1 . 1 1 7 7 CGU HA H . . 1 . 7 GLA HA rr_1ad7 1
74 1 . 2 . 1 1 7 7 CGU HB2 H . . 1 . 7 GLA HB1 rr_1ad7 1
75 1 . 1 . 1 1 7 7 CGU HA H . . 1 . 7 GLA HA rr_1ad7 1
75 1 . 2 . 1 1 7 7 CGU HB3 H . . 1 . 7 GLA HB2 rr_1ad7 1
76 1 . 1 . 1 1 7 7 CGU HA H . . 1 . 7 GLA HA rr_1ad7 1
76 1 . 2 . 1 1 7 7 CGU HG H . . 1 . 7 GLA HG rr_1ad7 1
77 1 . 1 . 1 1 7 7 CGU HB2 H . . 1 . 7 GLA HB1 rr_1ad7 1
77 1 . 2 . 1 1 7 7 CGU HG H . . 1 . 7 GLA HG rr_1ad7 1
78 1 . 1 . 1 1 7 7 CGU HB3 H . . 1 . 7 GLA HB2 rr_1ad7 1
78 1 . 2 . 1 1 7 7 CGU HG H . . 1 . 7 GLA HG rr_1ad7 1
79 1 . 1 . 1 1 7 7 CGU HA H . . 1 . 7 GLA HA rr_1ad7 1
79 1 . 2 . 1 1 8 8 ASN H H . . 1 . 8 ASN HN rr_1ad7 1
80 1 . 1 . 1 1 7 7 CGU HB2 H . . 1 . 7 GLA HB1 rr_1ad7 1
80 1 . 2 . 1 1 8 8 ASN H H . . 1 . 8 ASN HN rr_1ad7 1
81 1 . 1 . 1 1 7 7 CGU HB3 H . . 1 . 7 GLA HB2 rr_1ad7 1
81 1 . 2 . 1 1 8 8 ASN H H . . 1 . 8 ASN HN rr_1ad7 1
82 1 . 1 . 1 1 7 7 CGU HB2 H . . 1 . 7 GLA HB1 rr_1ad7 1
82 1 . 2 . 1 1 7 7 CGU HB3 H . . 1 . 7 GLA HB2 rr_1ad7 1
83 1 . 1 . 1 1 7 7 CGU H H . . 1 . 7 GLA HN rr_1ad7 1
83 1 . 2 . 1 1 8 8 ASN H H . . 1 . 8 ASN HN rr_1ad7 1
84 1 . 1 . 1 1 8 8 ASN H H . . 1 . 8 ASN HN rr_1ad7 1
84 1 . 2 . 1 1 8 8 ASN HB2 H . . 1 . 8 ASN HB1 rr_1ad7 1
85 1 . 1 . 1 1 8 8 ASN H H . . 1 . 8 ASN HN rr_1ad7 1
85 1 . 2 . 1 1 8 8 ASN HB3 H . . 1 . 8 ASN HB2 rr_1ad7 1
86 1 . 1 . 1 1 8 8 ASN HB2 H . . 1 . 8 ASN HB1 rr_1ad7 1
86 1 . 2 . 1 1 9 9 GLN H H . . 1 . 9 GLN HN rr_1ad7 1
87 1 . 1 . 1 1 8 8 ASN HB3 H . . 1 . 8 ASN HB2 rr_1ad7 1
87 1 . 2 . 1 1 9 9 GLN H H . . 1 . 9 GLN HN rr_1ad7 1
88 1 . 1 . 1 1 8 8 ASN HB2 H . . 1 . 8 ASN HB1 rr_1ad7 1
88 1 . 2 . 1 1 8 8 ASN HD21 H . . 1 . 8 ASN HD21 rr_1ad7 1
89 1 . 1 . 1 1 8 8 ASN HB3 H . . 1 . 8 ASN HB2 rr_1ad7 1
89 1 . 2 . 1 1 8 8 ASN HD21 H . . 1 . 8 ASN HD21 rr_1ad7 1
90 1 . 1 . 1 1 8 8 ASN HB2 H . . 1 . 8 ASN HB1 rr_1ad7 1
90 1 . 2 . 1 1 8 8 ASN HD22 H . . 1 . 8 ASN HD22 rr_1ad7 1
91 1 . 1 . 1 1 8 8 ASN HB2 H . . 1 . 8 ASN HB1 rr_1ad7 1
91 1 . 2 . 1 1 8 8 ASN HB3 H . . 1 . 8 ASN HB2 rr_1ad7 1
92 1 . 1 . 1 1 8 8 ASN HD21 H . . 1 . 8 ASN HD21 rr_1ad7 1
92 1 . 2 . 1 1 8 8 ASN HD22 H . . 1 . 8 ASN HD22 rr_1ad7 1
93 1 . 1 . 1 1 8 8 ASN HA H . . 1 . 8 ASN HA rr_1ad7 1
93 1 . 2 . 1 1 8 8 ASN HB2 H . . 1 . 8 ASN HB1 rr_1ad7 1
94 1 . 1 . 1 1 8 8 ASN HA H . . 1 . 8 ASN HA rr_1ad7 1
94 1 . 2 . 1 1 8 8 ASN HB3 H . . 1 . 8 ASN HB2 rr_1ad7 1
95 1 . 1 . 1 1 9 9 GLN H H . . 1 . 9 GLN HN rr_1ad7 1
95 1 . 2 . 1 1 9 9 GLN HA H . . 1 . 9 GLN HA rr_1ad7 1
96 1 . 1 . 1 1 9 9 GLN H H . . 1 . 9 GLN HN rr_1ad7 1
96 1 . 2 . 1 1 9 9 GLN HB2 H . . 1 . 9 GLN HB1 rr_1ad7 1
97 1 . 1 . 1 1 9 9 GLN H H . . 1 . 9 GLN HN rr_1ad7 1
97 1 . 2 . 1 1 9 9 GLN HB3 H . . 1 . 9 GLN HB2 rr_1ad7 1
98 1 . 1 . 1 1 9 9 GLN H H . . 1 . 9 GLN HN rr_1ad7 1
98 1 . 2 . 1 1 9 9 GLN HG2 H . . 1 . 9 GLN HG1 rr_1ad7 1
99 1 . 1 . 1 1 9 9 GLN H H . . 1 . 9 GLN HN rr_1ad7 1
99 1 . 2 . 1 1 9 9 GLN HG3 H . . 1 . 9 GLN HG2 rr_1ad7 1
100 1 . 1 . 1 1 9 9 GLN HA H . . 1 . 9 GLN HA rr_1ad7 1
100 1 . 2 . 1 1 10 10 CGU H H . . 1 . 10 GLA HN rr_1ad7 1
101 1 . 1 . 1 1 9 9 GLN HA H . . 1 . 9 GLN HA rr_1ad7 1
101 1 . 2 . 1 1 9 9 GLN HB2 H . . 1 . 9 GLN HB1 rr_1ad7 1
102 1 . 1 . 1 1 9 9 GLN HA H . . 1 . 9 GLN HA rr_1ad7 1
102 1 . 2 . 1 1 9 9 GLN HB3 H . . 1 . 9 GLN HB2 rr_1ad7 1
103 1 . 1 . 1 1 9 9 GLN HA H . . 1 . 9 GLN HA rr_1ad7 1
103 1 . 2 . 1 1 9 9 GLN HG2 H . . 1 . 9 GLN HG1 rr_1ad7 1
104 1 . 1 . 1 1 9 9 GLN HA H . . 1 . 9 GLN HA rr_1ad7 1
104 1 . 2 . 1 1 9 9 GLN HG3 H . . 1 . 9 GLN HG2 rr_1ad7 1
105 1 . 1 . 1 1 9 9 GLN HA H . . 1 . 9 GLN HA rr_1ad7 1
105 1 . 2 . 1 1 12 12 ILE HB H . . 1 . 12 ILE HB rr_1ad7 1
106 1 . 1 . 1 1 9 9 GLN HA H . . 1 . 9 GLN HA rr_1ad7 1
106 1 . 2 . 1 1 12 12 ILE HG12 H . . 1 . 12 ILE HG11 rr_1ad7 1
107 1 . 1 . 1 1 9 9 GLN HA H . . 1 . 9 GLN HA rr_1ad7 1
107 1 . 2 . 1 1 12 12 ILE CD1 C . . 1 . 12 ILE CD1 rr_1ad7 1
108 1 . 1 . 1 1 9 9 GLN HB2 H . . 1 . 9 GLN HB1 rr_1ad7 1
108 1 . 2 . 1 1 9 9 GLN HG3 H . . 1 . 9 GLN HG2 rr_1ad7 1
109 1 . 1 . 1 1 9 9 GLN HB3 H . . 1 . 9 GLN HB2 rr_1ad7 1
109 1 . 2 . 1 1 9 9 GLN HG3 H . . 1 . 9 GLN HG2 rr_1ad7 1
110 1 . 1 . 1 1 9 9 GLN HG2 H . . 1 . 9 GLN HG1 rr_1ad7 1
110 1 . 2 . 1 1 9 9 GLN HG3 H . . 1 . 9 GLN HG2 rr_1ad7 1
111 1 . 1 . 1 1 10 10 CGU H H . . 1 . 10 GLA HN rr_1ad7 1
111 1 . 2 . 1 1 10 10 CGU HA H . . 1 . 10 GLA HA rr_1ad7 1
112 1 . 1 . 1 1 10 10 CGU H H . . 1 . 10 GLA HN rr_1ad7 1
112 1 . 2 . 1 1 10 10 CGU HB2 H . . 1 . 10 GLA HB1 rr_1ad7 1
113 1 . 1 . 1 1 10 10 CGU H H . . 1 . 10 GLA HN rr_1ad7 1
113 1 . 2 . 1 1 10 10 CGU HB3 H . . 1 . 10 GLA HB2 rr_1ad7 1
114 1 . 1 . 1 1 10 10 CGU H H . . 1 . 10 GLA HN rr_1ad7 1
114 1 . 2 . 1 1 10 10 CGU HG H . . 1 . 10 GLA HG rr_1ad7 1
115 1 . 1 . 1 1 10 10 CGU HA H . . 1 . 10 GLA HA rr_1ad7 1
115 1 . 2 . 1 1 10 10 CGU HB2 H . . 1 . 10 GLA HB1 rr_1ad7 1
116 1 . 1 . 1 1 10 10 CGU HA H . . 1 . 10 GLA HA rr_1ad7 1
116 1 . 2 . 1 1 10 10 CGU HB3 H . . 1 . 10 GLA HB2 rr_1ad7 1
117 1 . 1 . 1 1 10 10 CGU HA H . . 1 . 10 GLA HA rr_1ad7 1
117 1 . 2 . 1 1 10 10 CGU HG H . . 1 . 10 GLA HG rr_1ad7 1
118 1 . 1 . 1 1 10 10 CGU HB2 H . . 1 . 10 GLA HB1 rr_1ad7 1
118 1 . 2 . 1 1 10 10 CGU HG H . . 1 . 10 GLA HG rr_1ad7 1
119 1 . 1 . 1 1 10 10 CGU HB3 H . . 1 . 10 GLA HB2 rr_1ad7 1
119 1 . 2 . 1 1 10 10 CGU HG H . . 1 . 10 GLA HG rr_1ad7 1
120 1 . 1 . 1 1 10 10 CGU HB2 H . . 1 . 10 GLA HB1 rr_1ad7 1
120 1 . 2 . 1 1 11 11 LEU H H . . 1 . 11 LEU HN rr_1ad7 1
121 1 . 1 . 1 1 10 10 CGU HB3 H . . 1 . 10 GLA HB2 rr_1ad7 1
121 1 . 2 . 1 1 11 11 LEU H H . . 1 . 11 LEU HN rr_1ad7 1
122 1 . 1 . 1 1 10 10 CGU H H . . 1 . 10 GLA HN rr_1ad7 1
122 1 . 2 . 1 1 11 11 LEU H H . . 1 . 11 LEU HN rr_1ad7 1
123 1 . 1 . 1 1 10 10 CGU HA H . . 1 . 10 GLA HA rr_1ad7 1
123 1 . 2 . 1 1 13 13 ARG HB2 H . . 1 . 13 ARG+ HB1 rr_1ad7 1
124 1 . 1 . 1 1 10 10 CGU HA H . . 1 . 10 GLA HA rr_1ad7 1
124 1 . 2 . 1 1 13 13 ARG HB3 H . . 1 . 13 ARG+ HB2 rr_1ad7 1
125 1 . 1 . 1 1 10 10 CGU HA H . . 1 . 10 GLA HA rr_1ad7 1
125 1 . 2 . 1 1 13 13 ARG HG2 H . . 1 . 13 ARG+ HG1 rr_1ad7 1
126 1 . 1 . 1 1 10 10 CGU HA H . . 1 . 10 GLA HA rr_1ad7 1
126 1 . 2 . 1 1 13 13 ARG HD2 H . . 1 . 13 ARG+ HD1 rr_1ad7 1
127 1 . 1 . 1 1 11 11 LEU H H . . 1 . 11 LEU HN rr_1ad7 1
127 1 . 2 . 1 1 11 11 LEU HA H . . 1 . 11 LEU HA rr_1ad7 1
128 1 . 1 . 1 1 11 11 LEU H H . . 1 . 11 LEU HN rr_1ad7 1
128 1 . 2 . 1 1 11 11 LEU HB2 H . . 1 . 11 LEU HB1 rr_1ad7 1
129 1 . 1 . 1 1 11 11 LEU H H . . 1 . 11 LEU HN rr_1ad7 1
129 1 . 2 . 1 1 11 11 LEU HB3 H . . 1 . 11 LEU HB2 rr_1ad7 1
130 1 . 1 . 1 1 11 11 LEU HA H . . 1 . 11 LEU HA rr_1ad7 1
130 1 . 2 . 1 1 11 11 LEU HB2 H . . 1 . 11 LEU HB1 rr_1ad7 1
131 1 . 1 . 1 1 11 11 LEU HA H . . 1 . 11 LEU HA rr_1ad7 1
131 1 . 2 . 1 1 11 11 LEU HB3 H . . 1 . 11 LEU HB2 rr_1ad7 1
132 1 . 1 . 1 1 11 11 LEU H H . . 1 . 11 LEU HN rr_1ad7 1
132 1 . 2 . 1 1 11 11 LEU CD1 C . . 1 . 11 LEU CD1 rr_1ad7 1
133 1 . 1 . 1 1 11 11 LEU HA H . . 1 . 11 LEU HA rr_1ad7 1
133 1 . 2 . 1 1 11 11 LEU CD1 C . . 1 . 11 LEU CD1 rr_1ad7 1
134 1 . 1 . 1 1 11 11 LEU HA H . . 1 . 11 LEU HA rr_1ad7 1
134 1 . 2 . 1 1 11 11 LEU CD2 C . . 1 . 11 LEU CD2 rr_1ad7 1
135 1 . 1 . 1 1 11 11 LEU HB2 H . . 1 . 11 LEU HB1 rr_1ad7 1
135 1 . 2 . 1 1 12 12 ILE H H . . 1 . 12 ILE HN rr_1ad7 1
136 1 . 1 . 1 1 11 11 LEU HA H . . 1 . 11 LEU HA rr_1ad7 1
136 1 . 2 . 1 1 12 12 ILE H H . . 1 . 12 ILE HN rr_1ad7 1
137 1 . 1 . 1 1 11 11 LEU HB2 H . . 1 . 11 LEU HB1 rr_1ad7 1
137 1 . 2 . 1 1 11 11 LEU HB3 H . . 1 . 11 LEU HB2 rr_1ad7 1
138 1 . 1 . 1 1 11 11 LEU HB2 H . . 1 . 11 LEU HB1 rr_1ad7 1
138 1 . 2 . 1 1 11 11 LEU CD1 C . . 1 . 11 LEU CD1 rr_1ad7 1
139 1 . 1 . 1 1 11 11 LEU HB2 H . . 1 . 11 LEU HB1 rr_1ad7 1
139 1 . 2 . 1 1 11 11 LEU CD2 C . . 1 . 11 LEU CD2 rr_1ad7 1
140 1 . 1 . 1 1 11 11 LEU HB3 H . . 1 . 11 LEU HB2 rr_1ad7 1
140 1 . 2 . 1 1 11 11 LEU CD1 C . . 1 . 11 LEU CD1 rr_1ad7 1
141 1 . 1 . 1 1 11 11 LEU HB3 H . . 1 . 11 LEU HB2 rr_1ad7 1
141 1 . 2 . 1 1 11 11 LEU CD2 C . . 1 . 11 LEU CD2 rr_1ad7 1
142 1 . 1 . 1 1 11 11 LEU H H . . 1 . 11 LEU HN rr_1ad7 1
142 1 . 2 . 1 1 12 12 ILE H H . . 1 . 12 ILE HN rr_1ad7 1
143 1 . 1 . 1 1 12 12 ILE H H . . 1 . 12 ILE HN rr_1ad7 1
143 1 . 2 . 1 1 12 12 ILE HA H . . 1 . 12 ILE HA rr_1ad7 1
144 1 . 1 . 1 1 12 12 ILE H H . . 1 . 12 ILE HN rr_1ad7 1
144 1 . 2 . 1 1 12 12 ILE HB H . . 1 . 12 ILE HB rr_1ad7 1
145 1 . 1 . 1 1 12 12 ILE H H . . 1 . 12 ILE HN rr_1ad7 1
145 1 . 2 . 1 1 12 12 ILE HG12 H . . 1 . 12 ILE HG11 rr_1ad7 1
146 1 . 1 . 1 1 12 12 ILE H H . . 1 . 12 ILE HN rr_1ad7 1
146 1 . 2 . 1 1 12 12 ILE HG13 H . . 1 . 12 ILE HG12 rr_1ad7 1
147 1 . 1 . 1 1 12 12 ILE H H . . 1 . 12 ILE HN rr_1ad7 1
147 1 . 2 . 1 1 12 12 ILE CG2 C . . 1 . 12 ILE CG2 rr_1ad7 1
148 1 . 1 . 1 1 12 12 ILE H H . . 1 . 12 ILE HN rr_1ad7 1
148 1 . 2 . 1 1 12 12 ILE CD1 C . . 1 . 12 ILE CD1 rr_1ad7 1
149 1 . 1 . 1 1 12 12 ILE HA H . . 1 . 12 ILE HA rr_1ad7 1
149 1 . 2 . 1 1 12 12 ILE HB H . . 1 . 12 ILE HB rr_1ad7 1
150 1 . 1 . 1 1 12 12 ILE HA H . . 1 . 12 ILE HA rr_1ad7 1
150 1 . 2 . 1 1 12 12 ILE HG12 H . . 1 . 12 ILE HG11 rr_1ad7 1
151 1 . 1 . 1 1 12 12 ILE HA H . . 1 . 12 ILE HA rr_1ad7 1
151 1 . 2 . 1 1 12 12 ILE HG13 H . . 1 . 12 ILE HG12 rr_1ad7 1
152 1 . 1 . 1 1 12 12 ILE HA H . . 1 . 12 ILE HA rr_1ad7 1
152 1 . 2 . 1 1 12 12 ILE CG2 C . . 1 . 12 ILE CG2 rr_1ad7 1
153 1 . 1 . 1 1 12 12 ILE HB H . . 1 . 12 ILE HB rr_1ad7 1
153 1 . 2 . 1 1 12 12 ILE HG12 H . . 1 . 12 ILE HG11 rr_1ad7 1
154 1 . 1 . 1 1 12 12 ILE HB H . . 1 . 12 ILE HB rr_1ad7 1
154 1 . 2 . 1 1 12 12 ILE HG13 H . . 1 . 12 ILE HG12 rr_1ad7 1
155 1 . 1 . 1 1 12 12 ILE HB H . . 1 . 12 ILE HB rr_1ad7 1
155 1 . 2 . 1 1 12 12 ILE CG2 C . . 1 . 12 ILE CG2 rr_1ad7 1
156 1 . 1 . 1 1 12 12 ILE HB H . . 1 . 12 ILE HB rr_1ad7 1
156 1 . 2 . 1 1 12 12 ILE CD1 C . . 1 . 12 ILE CD1 rr_1ad7 1
157 1 . 1 . 1 1 12 12 ILE HB H . . 1 . 12 ILE HB rr_1ad7 1
157 1 . 2 . 1 1 12 12 ILE CG2 C . . 1 . 12 ILE CG2 rr_1ad7 1
158 1 . 1 . 1 1 12 12 ILE HG12 H . . 1 . 12 ILE HG11 rr_1ad7 1
158 1 . 2 . 1 1 12 12 ILE HG13 H . . 1 . 12 ILE HG12 rr_1ad7 1
159 1 . 1 . 1 1 12 12 ILE HG12 H . . 1 . 12 ILE HG11 rr_1ad7 1
159 1 . 2 . 1 1 12 12 ILE CD1 C . . 1 . 12 ILE CD1 rr_1ad7 1
160 1 . 1 . 1 1 12 12 ILE HG13 H . . 1 . 12 ILE HG12 rr_1ad7 1
160 1 . 2 . 1 1 12 12 ILE CD1 C . . 1 . 12 ILE CD1 rr_1ad7 1
161 1 . 1 . 1 1 12 12 ILE CG2 C . . 1 . 12 ILE CG2 rr_1ad7 1
161 1 . 2 . 1 1 12 12 ILE CD1 C . . 1 . 12 ILE CD1 rr_1ad7 1
162 1 . 1 . 1 1 12 12 ILE HA H . . 1 . 12 ILE HA rr_1ad7 1
162 1 . 2 . 1 1 13 13 ARG H H . . 1 . 13 ARG+ HN rr_1ad7 1
163 1 . 1 . 1 1 12 12 ILE HG12 H . . 1 . 12 ILE HG11 rr_1ad7 1
163 1 . 2 . 1 1 13 13 ARG H H . . 1 . 13 ARG+ HN rr_1ad7 1
164 1 . 1 . 1 1 12 12 ILE CG2 C . . 1 . 12 ILE CG2 rr_1ad7 1
164 1 . 2 . 1 1 13 13 ARG H H . . 1 . 13 ARG+ HN rr_1ad7 1
165 1 . 1 . 1 1 12 12 ILE H H . . 1 . 12 ILE HN rr_1ad7 1
165 1 . 2 . 1 1 13 13 ARG H H . . 1 . 13 ARG+ HN rr_1ad7 1
166 1 . 1 . 1 1 13 13 ARG H H . . 1 . 13 ARG+ HN rr_1ad7 1
166 1 . 2 . 1 1 13 13 ARG HA H . . 1 . 13 ARG+ HA rr_1ad7 1
167 1 . 1 . 1 1 13 13 ARG H H . . 1 . 13 ARG+ HN rr_1ad7 1
167 1 . 2 . 1 1 13 13 ARG HB2 H . . 1 . 13 ARG+ HB1 rr_1ad7 1
168 1 . 1 . 1 1 13 13 ARG H H . . 1 . 13 ARG+ HN rr_1ad7 1
168 1 . 2 . 1 1 13 13 ARG HB3 H . . 1 . 13 ARG+ HB2 rr_1ad7 1
169 1 . 1 . 1 1 13 13 ARG H H . . 1 . 13 ARG+ HN rr_1ad7 1
169 1 . 2 . 1 1 13 13 ARG HG2 H . . 1 . 13 ARG+ HG1 rr_1ad7 1
170 1 . 1 . 1 1 13 13 ARG H H . . 1 . 13 ARG+ HN rr_1ad7 1
170 1 . 2 . 1 1 13 13 ARG HG3 H . . 1 . 13 ARG+ HG2 rr_1ad7 1
171 1 . 1 . 1 1 13 13 ARG HA H . . 1 . 13 ARG+ HA rr_1ad7 1
171 1 . 2 . 1 1 14 14 CGU H H . . 1 . 14 GLA HN rr_1ad7 1
172 1 . 1 . 1 1 13 13 ARG HB2 H . . 1 . 13 ARG+ HB1 rr_1ad7 1
172 1 . 2 . 1 1 14 14 CGU H H . . 1 . 14 GLA HN rr_1ad7 1
173 1 . 1 . 1 1 13 13 ARG HB3 H . . 1 . 13 ARG+ HB2 rr_1ad7 1
173 1 . 2 . 1 1 14 14 CGU H H . . 1 . 14 GLA HN rr_1ad7 1
174 1 . 1 . 1 1 13 13 ARG HB2 H . . 1 . 13 ARG+ HB1 rr_1ad7 1
174 1 . 2 . 1 1 13 13 ARG HG2 H . . 1 . 13 ARG+ HG1 rr_1ad7 1
175 1 . 1 . 1 1 13 13 ARG HB3 H . . 1 . 13 ARG+ HB2 rr_1ad7 1
175 1 . 2 . 1 1 13 13 ARG HG2 H . . 1 . 13 ARG+ HG1 rr_1ad7 1
176 1 . 1 . 1 1 13 13 ARG HB2 H . . 1 . 13 ARG+ HB1 rr_1ad7 1
176 1 . 2 . 1 1 13 13 ARG HG3 H . . 1 . 13 ARG+ HG2 rr_1ad7 1
177 1 . 1 . 1 1 13 13 ARG HB3 H . . 1 . 13 ARG+ HB2 rr_1ad7 1
177 1 . 2 . 1 1 13 13 ARG HG3 H . . 1 . 13 ARG+ HG2 rr_1ad7 1
178 1 . 1 . 1 1 13 13 ARG HB2 H . . 1 . 13 ARG+ HB1 rr_1ad7 1
178 1 . 2 . 1 1 13 13 ARG HD2 H . . 1 . 13 ARG+ HD1 rr_1ad7 1
179 1 . 1 . 1 1 13 13 ARG HB3 H . . 1 . 13 ARG+ HB2 rr_1ad7 1
179 1 . 2 . 1 1 13 13 ARG HD2 H . . 1 . 13 ARG+ HD1 rr_1ad7 1
180 1 . 1 . 1 1 13 13 ARG HB2 H . . 1 . 13 ARG+ HB1 rr_1ad7 1
180 1 . 2 . 1 1 13 13 ARG HD3 H . . 1 . 13 ARG+ HD2 rr_1ad7 1
181 1 . 1 . 1 1 13 13 ARG HB3 H . . 1 . 13 ARG+ HB2 rr_1ad7 1
181 1 . 2 . 1 1 13 13 ARG HD3 H . . 1 . 13 ARG+ HD2 rr_1ad7 1
182 1 . 1 . 1 1 13 13 ARG HG2 H . . 1 . 13 ARG+ HG1 rr_1ad7 1
182 1 . 2 . 1 1 13 13 ARG HD2 H . . 1 . 13 ARG+ HD1 rr_1ad7 1
183 1 . 1 . 1 1 13 13 ARG HG2 H . . 1 . 13 ARG+ HG1 rr_1ad7 1
183 1 . 2 . 1 1 13 13 ARG HD3 H . . 1 . 13 ARG+ HD2 rr_1ad7 1
184 1 . 1 . 1 1 13 13 ARG HG3 H . . 1 . 13 ARG+ HG2 rr_1ad7 1
184 1 . 2 . 1 1 13 13 ARG HD2 H . . 1 . 13 ARG+ HD1 rr_1ad7 1
185 1 . 1 . 1 1 13 13 ARG HG3 H . . 1 . 13 ARG+ HG2 rr_1ad7 1
185 1 . 2 . 1 1 13 13 ARG HD3 H . . 1 . 13 ARG+ HD2 rr_1ad7 1
186 1 . 1 . 1 1 13 13 ARG HD2 H . . 1 . 13 ARG+ HD1 rr_1ad7 1
186 1 . 2 . 1 1 13 13 ARG HG2 H . . 1 . 13 ARG+ HG1 rr_1ad7 1
187 1 . 1 . 1 1 13 13 ARG HD2 H . . 1 . 13 ARG+ HD1 rr_1ad7 1
187 1 . 2 . 1 1 13 13 ARG HG3 H . . 1 . 13 ARG+ HG2 rr_1ad7 1
188 1 . 1 . 1 1 13 13 ARG HA H . . 1 . 13 ARG+ HA rr_1ad7 1
188 1 . 2 . 1 1 13 13 ARG HB2 H . . 1 . 13 ARG+ HB1 rr_1ad7 1
189 1 . 1 . 1 1 13 13 ARG HA H . . 1 . 13 ARG+ HA rr_1ad7 1
189 1 . 2 . 1 1 13 13 ARG HB3 H . . 1 . 13 ARG+ HB2 rr_1ad7 1
190 1 . 1 . 1 1 13 13 ARG HA H . . 1 . 13 ARG+ HA rr_1ad7 1
190 1 . 2 . 1 1 13 13 ARG HG2 H . . 1 . 13 ARG+ HG1 rr_1ad7 1
191 1 . 1 . 1 1 13 13 ARG HA H . . 1 . 13 ARG+ HA rr_1ad7 1
191 1 . 2 . 1 1 13 13 ARG HG3 H . . 1 . 13 ARG+ HG2 rr_1ad7 1
192 1 . 1 . 1 1 13 13 ARG HB2 H . . 1 . 13 ARG+ HB1 rr_1ad7 1
192 1 . 2 . 1 1 13 13 ARG HB3 H . . 1 . 13 ARG+ HB2 rr_1ad7 1
193 1 . 1 . 1 1 13 13 ARG HG2 H . . 1 . 13 ARG+ HG1 rr_1ad7 1
193 1 . 2 . 1 1 13 13 ARG HG3 H . . 1 . 13 ARG+ HG2 rr_1ad7 1
194 1 . 1 . 1 1 13 13 ARG HD2 H . . 1 . 13 ARG+ HD1 rr_1ad7 1
194 1 . 2 . 1 1 13 13 ARG HD3 H . . 1 . 13 ARG+ HD2 rr_1ad7 1
195 1 . 1 . 1 1 13 13 ARG H H . . 1 . 13 ARG+ HN rr_1ad7 1
195 1 . 2 . 1 1 14 14 CGU H H . . 1 . 14 GLA HN rr_1ad7 1
196 1 . 1 . 1 1 13 13 ARG HD2 H . . 1 . 13 ARG+ HD1 rr_1ad7 1
196 1 . 2 . 1 1 16 16 SER H H . . 1 . 16 SER HN rr_1ad7 1
197 1 . 1 . 1 1 13 13 ARG HD3 H . . 1 . 13 ARG+ HD2 rr_1ad7 1
197 1 . 2 . 1 1 16 16 SER H H . . 1 . 16 SER HN rr_1ad7 1
198 1 . 1 . 1 1 14 14 CGU H H . . 1 . 14 GLA HN rr_1ad7 1
198 1 . 2 . 1 1 14 14 CGU HA H . . 1 . 14 GLA HA rr_1ad7 1
199 1 . 1 . 1 1 14 14 CGU H H . . 1 . 14 GLA HN rr_1ad7 1
199 1 . 2 . 1 1 14 14 CGU HB2 H . . 1 . 14 GLA HB1 rr_1ad7 1
200 1 . 1 . 1 1 14 14 CGU H H . . 1 . 14 GLA HN rr_1ad7 1
200 1 . 2 . 1 1 14 14 CGU HB3 H . . 1 . 14 GLA HB2 rr_1ad7 1
201 1 . 1 . 1 1 14 14 CGU H H . . 1 . 14 GLA HN rr_1ad7 1
201 1 . 2 . 1 1 14 14 CGU HG H . . 1 . 14 GLA HG rr_1ad7 1
202 1 . 1 . 1 1 14 14 CGU HA H . . 1 . 14 GLA HA rr_1ad7 1
202 1 . 2 . 1 1 14 14 CGU HB2 H . . 1 . 14 GLA HB1 rr_1ad7 1
203 1 . 1 . 1 1 14 14 CGU HA H . . 1 . 14 GLA HA rr_1ad7 1
203 1 . 2 . 1 1 14 14 CGU HB3 H . . 1 . 14 GLA HB2 rr_1ad7 1
204 1 . 1 . 1 1 14 14 CGU HA H . . 1 . 14 GLA HA rr_1ad7 1
204 1 . 2 . 1 1 14 14 CGU HG H . . 1 . 14 GLA HG rr_1ad7 1
205 1 . 1 . 1 1 14 14 CGU HB2 H . . 1 . 14 GLA HB1 rr_1ad7 1
205 1 . 2 . 1 1 14 14 CGU HG H . . 1 . 14 GLA HG rr_1ad7 1
206 1 . 1 . 1 1 14 14 CGU HB2 H . . 1 . 14 GLA HB1 rr_1ad7 1
206 1 . 2 . 1 1 14 14 CGU HB3 H . . 1 . 14 GLA HB2 rr_1ad7 1
207 1 . 1 . 1 1 14 14 CGU HB3 H . . 1 . 14 GLA HB2 rr_1ad7 1
207 1 . 2 . 1 1 14 14 CGU HG H . . 1 . 14 GLA HG rr_1ad7 1
208 1 . 1 . 1 1 14 14 CGU HA H . . 1 . 14 GLA HA rr_1ad7 1
208 1 . 2 . 1 1 15 15 LYS H H . . 1 . 15 LYS+ HN rr_1ad7 1
209 1 . 1 . 1 1 14 14 CGU H H . . 1 . 14 GLA HN rr_1ad7 1
209 1 . 2 . 1 1 15 15 LYS H H . . 1 . 15 LYS+ HN rr_1ad7 1
210 1 . 1 . 1 1 15 15 LYS H H . . 1 . 15 LYS+ HN rr_1ad7 1
210 1 . 2 . 1 1 15 15 LYS HA H . . 1 . 15 LYS+ HA rr_1ad7 1
211 1 . 1 . 1 1 15 15 LYS H H . . 1 . 15 LYS+ HN rr_1ad7 1
211 1 . 2 . 1 1 15 15 LYS HB2 H . . 1 . 15 LYS+ HB1 rr_1ad7 1
212 1 . 1 . 1 1 15 15 LYS H H . . 1 . 15 LYS+ HN rr_1ad7 1
212 1 . 2 . 1 1 15 15 LYS HB3 H . . 1 . 15 LYS+ HB2 rr_1ad7 1
213 1 . 1 . 1 1 15 15 LYS H H . . 1 . 15 LYS+ HN rr_1ad7 1
213 1 . 2 . 1 1 15 15 LYS HD2 H . . 1 . 15 LYS+ HD1 rr_1ad7 1
214 1 . 1 . 1 1 15 15 LYS H H . . 1 . 15 LYS+ HN rr_1ad7 1
214 1 . 2 . 1 1 15 15 LYS HD3 H . . 1 . 15 LYS+ HD2 rr_1ad7 1
215 1 . 1 . 1 1 15 15 LYS HA H . . 1 . 15 LYS+ HA rr_1ad7 1
215 1 . 2 . 1 1 16 16 SER H H . . 1 . 16 SER HN rr_1ad7 1
216 1 . 1 . 1 1 15 15 LYS HB2 H . . 1 . 15 LYS+ HB1 rr_1ad7 1
216 1 . 2 . 1 1 16 16 SER H H . . 1 . 16 SER HN rr_1ad7 1
217 1 . 1 . 1 1 15 15 LYS HB3 H . . 1 . 15 LYS+ HB2 rr_1ad7 1
217 1 . 2 . 1 1 16 16 SER H H . . 1 . 16 SER HN rr_1ad7 1
218 1 . 1 . 1 1 15 15 LYS HD2 H . . 1 . 15 LYS+ HD1 rr_1ad7 1
218 1 . 2 . 1 1 15 15 LYS HB2 H . . 1 . 15 LYS+ HB1 rr_1ad7 1
219 1 . 1 . 1 1 15 15 LYS HD2 H . . 1 . 15 LYS+ HD1 rr_1ad7 1
219 1 . 2 . 1 1 15 15 LYS HB3 H . . 1 . 15 LYS+ HB2 rr_1ad7 1
220 1 . 1 . 1 1 15 15 LYS HD3 H . . 1 . 15 LYS+ HD2 rr_1ad7 1
220 1 . 2 . 1 1 15 15 LYS HB2 H . . 1 . 15 LYS+ HB1 rr_1ad7 1
221 1 . 1 . 1 1 15 15 LYS HD3 H . . 1 . 15 LYS+ HD2 rr_1ad7 1
221 1 . 2 . 1 1 15 15 LYS HB3 H . . 1 . 15 LYS+ HB2 rr_1ad7 1
222 1 . 1 . 1 1 15 15 LYS HA H . . 1 . 15 LYS+ HA rr_1ad7 1
222 1 . 2 . 1 1 15 15 LYS HB2 H . . 1 . 15 LYS+ HB1 rr_1ad7 1
223 1 . 1 . 1 1 15 15 LYS HA H . . 1 . 15 LYS+ HA rr_1ad7 1
223 1 . 2 . 1 1 15 15 LYS HB3 H . . 1 . 15 LYS+ HB2 rr_1ad7 1
224 1 . 1 . 1 1 15 15 LYS HA H . . 1 . 15 LYS+ HA rr_1ad7 1
224 1 . 2 . 1 1 15 15 LYS HD2 H . . 1 . 15 LYS+ HD1 rr_1ad7 1
225 1 . 1 . 1 1 15 15 LYS HA H . . 1 . 15 LYS+ HA rr_1ad7 1
225 1 . 2 . 1 1 15 15 LYS HD3 H . . 1 . 15 LYS+ HD2 rr_1ad7 1
226 1 . 1 . 1 1 15 15 LYS HA H . . 1 . 15 LYS+ HA rr_1ad7 1
226 1 . 2 . 1 1 15 15 LYS HG2 H . . 1 . 15 LYS+ HG1 rr_1ad7 1
227 1 . 1 . 1 1 15 15 LYS HD3 H . . 1 . 15 LYS+ HD2 rr_1ad7 1
227 1 . 2 . 1 1 15 15 LYS HG2 H . . 1 . 15 LYS+ HG1 rr_1ad7 1
228 1 . 1 . 1 1 15 15 LYS HD2 H . . 1 . 15 LYS+ HD1 rr_1ad7 1
228 1 . 2 . 1 1 15 15 LYS HG2 H . . 1 . 15 LYS+ HG1 rr_1ad7 1
229 1 . 1 . 1 1 15 15 LYS H H . . 1 . 15 LYS+ HN rr_1ad7 1
229 1 . 2 . 1 1 16 16 SER H H . . 1 . 16 SER HN rr_1ad7 1
230 1 . 1 . 1 1 16 16 SER H H . . 1 . 16 SER HN rr_1ad7 1
230 1 . 2 . 1 1 16 16 SER HA H . . 1 . 16 SER HA rr_1ad7 1
231 1 . 1 . 1 1 16 16 SER HA H . . 1 . 16 SER HA rr_1ad7 1
231 1 . 2 . 1 1 16 16 SER HB2 H . . 1 . 16 SER HB1 rr_1ad7 1
232 1 . 1 . 1 1 16 16 SER HA H . . 1 . 16 SER HA rr_1ad7 1
232 1 . 2 . 1 1 16 16 SER HB3 H . . 1 . 16 SER HB2 rr_1ad7 1
233 1 . 1 . 1 1 16 16 SER HB2 H . . 1 . 16 SER HB1 rr_1ad7 1
233 1 . 2 . 1 1 16 16 SER H H . . 1 . 16 SER HN rr_1ad7 1
234 1 . 1 . 1 1 16 16 SER HB3 H . . 1 . 16 SER HB2 rr_1ad7 1
234 1 . 2 . 1 1 16 16 SER H H . . 1 . 16 SER HN rr_1ad7 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 . . . . . . 2.7 2.2 3.2 rr_1ad7 1
2 1 . . . . . . 2.8 2.2 3.9 rr_1ad7 1
3 1 . . . . . . 2.9 2.3 4.0 rr_1ad7 1
4 1 . . . . . . 2.6 2.1 3.6 rr_1ad7 1
5 1 . . . . . . 2.6 2.1 3.6 rr_1ad7 1
6 1 . . . . . . 3.1 2.5 3.7 rr_1ad7 1
7 1 . . . . . . 2.8 2.2 3.4 rr_1ad7 1
8 1 . . . . . . 2.6 2.1 3.6 rr_1ad7 1
9 1 . . . . . . 2.7 2.2 3.7 rr_1ad7 1
10 1 . . . . . . 3.1 2.5 3.7 rr_1ad7 1
11 1 . . . . . . 2.4 1.9 3.4 rr_1ad7 1
12 1 . . . . . . 2.3 1.8 3.3 rr_1ad7 1
13 1 . . . . . . 2.6 2.1 3.1 rr_1ad7 1
14 1 . . . . . . 2.5 2.0 3.0 rr_1ad7 1
15 1 . . . . . . 2.5 2.0 3.5 rr_1ad7 1
16 1 . . . . . . 2.4 1.9 3.4 rr_1ad7 1
17 1 . . . . . . 2.3 1.8 3.8 rr_1ad7 1
18 1 . . . . . . 2.9 2.3 4.0 rr_1ad7 1
19 1 . . . . . . 2.5 2.0 3.0 rr_1ad7 1
20 1 . . . . . . 2.4 1.9 3.4 rr_1ad7 1
21 1 . . . . . . 2.4 1.9 3.4 rr_1ad7 1
22 1 . . . . . . 2.8 2.2 3.4 rr_1ad7 1
23 1 . . . . . . 3.0 2.4 4.1 rr_1ad7 1
24 1 . . . . . . 2.8 2.2 3.9 rr_1ad7 1
25 1 . . . . . . 2.4 1.9 2.9 rr_1ad7 1
26 1 . . . . . . 2.5 2.0 3.5 rr_1ad7 1
27 1 . . . . . . 2.5 2.0 3.5 rr_1ad7 1
28 1 . . . . . . 2.5 2.0 4.0 rr_1ad7 1
29 1 . . . . . . 2.9 2.3 3.5 rr_1ad7 1
30 1 . . . . . . 2.6 2.1 3.6 rr_1ad7 1
31 1 . . . . . . 2.9 2.3 4.0 rr_1ad7 1
32 1 . . . . . . 2.9 2.3 4.0 rr_1ad7 1
33 1 . . . . . . 2.9 2.3 4.0 rr_1ad7 1
34 1 . . . . . . 3.1 2.5 3.7 rr_1ad7 1
35 1 . . . . . . 4.0 3.2 5.2 rr_1ad7 1
36 1 . . . . . . 2.8 2.2 3.4 rr_1ad7 1
37 1 . . . . . . 2.8 2.2 3.9 rr_1ad7 1
38 1 . . . . . . 2.7 2.2 3.7 rr_1ad7 1
39 1 . . . . . . 3.1 2.5 4.2 rr_1ad7 1
40 1 . . . . . . 2.9 2.3 4.0 rr_1ad7 1
41 1 . . . . . . 2.6 2.1 3.1 rr_1ad7 1
42 1 . . . . . . 2.5 2.0 5.0 rr_1ad7 1
43 1 . . . . . . 2.5 2.0 3.5 rr_1ad7 1
44 1 . . . . . . 2.6 2.1 3.6 rr_1ad7 1
45 1 . . . . . . 2.8 2.2 3.4 rr_1ad7 1
46 1 . . . . . . 2.4 1.9 2.9 rr_1ad7 1
47 1 . . . . . . 3.1 2.5 4.2 rr_1ad7 1
48 1 . . . . . . 3.0 2.4 4.1 rr_1ad7 1
49 1 . . . . . . 2.6 2.1 4.1 rr_1ad7 1
50 1 . . . . . . 2.8 2.2 5.4 rr_1ad7 1
51 1 . . . . . . 2.5 2.0 3.0 rr_1ad7 1
52 1 . . . . . . 2.5 2.0 3.5 rr_1ad7 1
53 1 . . . . . . 2.5 2.0 3.5 rr_1ad7 1
54 1 . . . . . . 3.4 2.7 4.6 rr_1ad7 1
55 1 . . . . . . 3.1 2.5 4.2 rr_1ad7 1
56 1 . . . . . . 2.7 2.2 3.7 rr_1ad7 1
57 1 . . . . . . 2.7 2.2 3.7 rr_1ad7 1
58 1 . . . . . . 2.5 2.0 3.0 rr_1ad7 1
59 1 . . . . . . 3.2 2.6 3.8 rr_1ad7 1
60 1 . . . . . . 3.1 2.5 4.2 rr_1ad7 1
61 1 . . . . . . 2.8 2.2 3.9 rr_1ad7 1
62 1 . . . . . . 3.6 2.9 4.8 rr_1ad7 1
63 1 . . . . . . 3.2 2.6 4.3 rr_1ad7 1
64 1 . . . . . . 2.8 2.2 4.4 rr_1ad7 1
65 1 . . . . . . 2.7 2.2 4.2 rr_1ad7 1
66 1 . . . . . . 3.0 2.4 4.6 rr_1ad7 1
67 1 . . . . . . 2.7 2.2 5.2 rr_1ad7 1
68 1 . . . . . . 2.8 2.2 3.9 rr_1ad7 1
69 1 . . . . . . 3.2 2.6 4.1 rr_1ad7 1
70 1 . . . . . . 3.1 2.5 3.7 rr_1ad7 1
71 1 . . . . . . 2.5 2.0 3.5 rr_1ad7 1
72 1 . . . . . . 2.5 2.0 3.5 rr_1ad7 1
73 1 . . . . . . 2.5 2.0 3.0 rr_1ad7 1
74 1 . . . . . . 2.5 2.0 3.5 rr_1ad7 1
75 1 . . . . . . 2.5 2.0 3.5 rr_1ad7 1
76 1 . . . . . . 2.7 2.2 3.2 rr_1ad7 1
77 1 . . . . . . 2.6 2.1 3.6 rr_1ad7 1
78 1 . . . . . . 2.6 2.1 3.6 rr_1ad7 1
79 1 . . . . . . 3.3 2.6 4.0 rr_1ad7 1
80 1 . . . . . . 2.7 2.2 3.7 rr_1ad7 1
81 1 . . . . . . 2.7 2.2 3.7 rr_1ad7 1
82 1 . . . . . . 3.0 2.4 4.6 rr_1ad7 1
83 1 . . . . . . 3.3 2.6 4.0 rr_1ad7 1
84 1 . . . . . . 2.5 2.0 3.5 rr_1ad7 1
85 1 . . . . . . 2.5 2.0 3.5 rr_1ad7 1
86 1 . . . . . . 2.8 2.2 3.9 rr_1ad7 1
87 1 . . . . . . 3.1 2.5 4.2 rr_1ad7 1
88 1 . . . . . . 3.3 2.6 5.0 rr_1ad7 1
89 1 . . . . . . 4.0 3.2 6.2 rr_1ad7 1
90 1 . . . . . . 4.2 3.3 6.5 rr_1ad7 1
91 1 . . . . . . 3.0 2.4 4.6 rr_1ad7 1
92 1 . . . . . . 2.9 2.3 4.5 rr_1ad7 1
93 1 . . . . . . 3.2 2.6 4.4 rr_1ad7 1
94 1 . . . . . . 3.2 2.6 4.4 rr_1ad7 1
95 1 . . . . . . 2.5 2.0 3.0 rr_1ad7 1
96 1 . . . . . . 2.7 2.2 3.7 rr_1ad7 1
97 1 . . . . . . 3.0 2.4 4.1 rr_1ad7 1
98 1 . . . . . . 3.1 2.5 4.2 rr_1ad7 1
99 1 . . . . . . 3.1 2.5 4.2 rr_1ad7 1
100 1 . . . . . . 3.2 2.6 3.8 rr_1ad7 1
101 1 . . . . . . 3.1 2.5 4.2 rr_1ad7 1
102 1 . . . . . . 2.9 2.3 4.0 rr_1ad7 1
103 1 . . . . . . 3.0 2.4 4.1 rr_1ad7 1
104 1 . . . . . . 3.0 2.4 4.1 rr_1ad7 1
105 1 . . . . . . 2.4 1.9 2.9 rr_1ad7 1
106 1 . . . . . . 2.9 2.3 4.0 rr_1ad7 1
107 1 . . . . . . 2.8 2.2 5.4 rr_1ad7 1
108 1 . . . . . . 2.7 2.2 4.2 rr_1ad7 1
109 1 . . . . . . 2.8 2.2 4.4 rr_1ad7 1
110 1 . . . . . . 3.1 2.5 4.7 rr_1ad7 1
111 1 . . . . . . 4.8 3.8 6.2 rr_1ad7 1
112 1 . . . . . . 2.6 2.1 3.6 rr_1ad7 1
113 1 . . . . . . 2.6 2.1 3.6 rr_1ad7 1
114 1 . . . . . . 4.1 3.3 5.3 rr_1ad7 1
115 1 . . . . . . 2.4 1.9 3.4 rr_1ad7 1
116 1 . . . . . . 2.4 1.9 3.4 rr_1ad7 1
117 1 . . . . . . 2.7 2.2 3.2 rr_1ad7 1
118 1 . . . . . . 2.5 2.0 3.5 rr_1ad7 1
119 1 . . . . . . 2.5 2.0 3.5 rr_1ad7 1
120 1 . . . . . . 2.9 2.3 4.0 rr_1ad7 1
121 1 . . . . . . 2.9 2.3 4.0 rr_1ad7 1
122 1 . . . . . . 2.5 2.0 3.0 rr_1ad7 1
123 1 . . . . . . 2.5 2.0 3.5 rr_1ad7 1
124 1 . . . . . . 2.5 2.0 3.5 rr_1ad7 1
125 1 . . . . . . 4.0 3.2 5.7 rr_1ad7 1
126 1 . . . . . . 3.5 2.8 4.7 rr_1ad7 1
127 1 . . . . . . 2.6 2.1 3.1 rr_1ad7 1
128 1 . . . . . . 2.5 2.0 3.5 rr_1ad7 1
129 1 . . . . . . 2.6 2.1 3.6 rr_1ad7 1
130 1 . . . . . . 2.4 1.9 3.4 rr_1ad7 1
131 1 . . . . . . 2.4 1.9 3.4 rr_1ad7 1
132 1 . . . . . . 3.3 2.6 6.0 rr_1ad7 1
133 1 . . . . . . 2.4 1.9 3.4 rr_1ad7 1
134 1 . . . . . . 3.0 2.4 5.6 rr_1ad7 1
135 1 . . . . . . 3.5 2.8 4.7 rr_1ad7 1
136 1 . . . . . . 2.5 2.0 3.0 rr_1ad7 1
137 1 . . . . . . 2.8 2.2 3.9 rr_1ad7 1
138 1 . . . . . . 2.7 2.2 5.2 rr_1ad7 1
139 1 . . . . . . 2.9 2.3 5.5 rr_1ad7 1
140 1 . . . . . . 3.1 2.5 6.2 rr_1ad7 1
141 1 . . . . . . 3.1 2.5 6.2 rr_1ad7 1
142 1 . . . . . . 2.8 2.2 3.4 rr_1ad7 1
143 1 . . . . . . 2.8 2.2 3.4 rr_1ad7 1
144 1 . . . . . . 2.3 1.8 2.8 rr_1ad7 1
145 1 . . . . . . 2.5 2.0 3.5 rr_1ad7 1
146 1 . . . . . . 2.3 1.8 3.3 rr_1ad7 1
147 1 . . . . . . 2.9 2.3 5.5 rr_1ad7 1
148 1 . . . . . . 3.2 2.6 5.8 rr_1ad7 1
149 1 . . . . . . 2.4 1.9 2.9 rr_1ad7 1
150 1 . . . . . . 2.4 1.9 3.4 rr_1ad7 1
151 1 . . . . . . 2.4 1.9 3.4 rr_1ad7 1
152 1 . . . . . . 2.4 1.9 4.9 rr_1ad7 1
153 1 . . . . . . 2.6 2.1 3.6 rr_1ad7 1
154 1 . . . . . . 2.6 2.1 3.6 rr_1ad7 1
155 1 . . . . . . 2.3 1.8 4.8 rr_1ad7 1
156 1 . . . . . . 2.7 2.2 5.2 rr_1ad7 1
157 1 . . . . . . 2.3 1.8 4.8 rr_1ad7 1
158 1 . . . . . . 2.2 1.8 3.6 rr_1ad7 1
159 1 . . . . . . 2.5 2.0 5.0 rr_1ad7 1
160 1 . . . . . . 2.5 2.0 5.0 rr_1ad7 1
161 1 . . . . . . 2.9 2.3 5.5 rr_1ad7 1
162 1 . . . . . . 3.2 2.6 3.8 rr_1ad7 1
163 1 . . . . . . 2.8 2.2 3.9 rr_1ad7 1
164 1 . . . . . . 2.7 2.2 5.2 rr_1ad7 1
165 1 . . . . . . 2.6 2.1 3.1 rr_1ad7 1
166 1 . . . . . . 2.9 2.3 3.5 rr_1ad7 1
167 1 . . . . . . 2.6 2.1 3.6 rr_1ad7 1
168 1 . . . . . . 2.6 2.1 3.6 rr_1ad7 1
169 1 . . . . . . 4.8 3.8 6.7 rr_1ad7 1
170 1 . . . . . . 2.9 2.3 4.0 rr_1ad7 1
171 1 . . . . . . 3.4 2.7 4.1 rr_1ad7 1
172 1 . . . . . . 2.7 2.2 3.7 rr_1ad7 1
173 1 . . . . . . 2.7 2.2 3.7 rr_1ad7 1
174 1 . . . . . . 2.8 2.2 4.4 rr_1ad7 1
175 1 . . . . . . 3.0 2.4 4.6 rr_1ad7 1
176 1 . . . . . . 3.3 2.6 5.0 rr_1ad7 1
177 1 . . . . . . 2.8 2.2 4.4 rr_1ad7 1
178 1 . . . . . . 2.6 2.1 4.1 rr_1ad7 1
179 1 . . . . . . 2.6 2.1 4.1 rr_1ad7 1
180 1 . . . . . . 3.0 2.4 4.6 rr_1ad7 1
181 1 . . . . . . 3.0 2.4 4.6 rr_1ad7 1
182 1 . . . . . . 2.6 2.1 4.1 rr_1ad7 1
183 1 . . . . . . 2.5 2.0 4.0 rr_1ad7 1
184 1 . . . . . . 2.5 2.0 4.0 rr_1ad7 1
185 1 . . . . . . 2.5 2.0 4.0 rr_1ad7 1
186 1 . . . . . . 3.0 2.4 4.6 rr_1ad7 1
187 1 . . . . . . 2.9 2.3 4.5 rr_1ad7 1
188 1 . . . . . . 2.4 1.9 3.4 rr_1ad7 1
189 1 . . . . . . 2.4 1.9 3.4 rr_1ad7 1
190 1 . . . . . . 2.6 2.1 3.6 rr_1ad7 1
191 1 . . . . . . 2.6 2.1 3.6 rr_1ad7 1
192 1 . . . . . . 2.9 2.3 4.0 rr_1ad7 1
193 1 . . . . . . 2.7 2.2 4.2 rr_1ad7 1
194 1 . . . . . . 2.2 1.8 3.6 rr_1ad7 1
195 1 . . . . . . 2.6 2.1 3.1 rr_1ad7 1
196 1 . . . . . . 4.3 3.4 6.1 rr_1ad7 1
197 1 . . . . . . 3.7 3.0 4.9 rr_1ad7 1
198 1 . . . . . . 2.6 2.1 3.1 rr_1ad7 1
199 1 . . . . . . 2.7 2.2 3.7 rr_1ad7 1
200 1 . . . . . . 2.6 2.1 3.6 rr_1ad7 1
201 1 . . . . . . 2.6 2.1 3.1 rr_1ad7 1
202 1 . . . . . . 2.7 2.2 3.7 rr_1ad7 1
203 1 . . . . . . 2.7 2.2 3.7 rr_1ad7 1
204 1 . . . . . . 2.8 2.2 3.4 rr_1ad7 1
205 1 . . . . . . 2.8 2.2 3.9 rr_1ad7 1
206 1 . . . . . . 3.2 2.6 4.8 rr_1ad7 1
207 1 . . . . . . 2.8 2.2 3.9 rr_1ad7 1
208 1 . . . . . . 3.5 2.8 4.2 rr_1ad7 1
209 1 . . . . . . 2.7 2.2 3.2 rr_1ad7 1
210 1 . . . . . . 2.7 2.2 3.2 rr_1ad7 1
211 1 . . . . . . 2.7 2.2 3.7 rr_1ad7 1
212 1 . . . . . . 2.7 2.2 3.7 rr_1ad7 1
213 1 . . . . . . 3.5 2.8 4.7 rr_1ad7 1
214 1 . . . . . . 3.5 2.8 4.7 rr_1ad7 1
215 1 . . . . . . 2.9 2.3 3.5 rr_1ad7 1
216 1 . . . . . . 2.9 2.3 3.5 rr_1ad7 1
217 1 . . . . . . 2.9 2.3 3.5 rr_1ad7 1
218 1 . . . . . . 2.9 2.3 4.5 rr_1ad7 1
219 1 . . . . . . 2.9 2.3 4.5 rr_1ad7 1
220 1 . . . . . . 2.9 2.3 4.5 rr_1ad7 1
221 1 . . . . . . 2.9 2.3 4.5 rr_1ad7 1
222 1 . . . . . . 2.8 2.2 3.9 rr_1ad7 1
223 1 . . . . . . 2.8 2.2 3.9 rr_1ad7 1
224 1 . . . . . . 4.0 3.2 5.7 rr_1ad7 1
225 1 . . . . . . 3.8 3.0 5.1 rr_1ad7 1
226 1 . . . . . . 2.9 2.3 4.5 rr_1ad7 1
227 1 . . . . . . 2.8 2.2 4.4 rr_1ad7 1
228 1 . . . . . . 2.8 2.2 4.4 rr_1ad7 1
229 1 . . . . . . 4.4 3.5 5.7 rr_1ad7 1
230 1 . . . . . . 2.7 2.2 3.2 rr_1ad7 1
231 1 . . . . . . 2.9 2.3 4.0 rr_1ad7 1
232 1 . . . . . . 2.9 2.3 4.0 rr_1ad7 1
233 1 . . . . . . 2.9 2.3 3.5 rr_1ad7 1
234 1 . . . . . . 2.9 2.3 3.5 rr_1ad7 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 "remote_prochiral_center NOE_distance" 1 1 3 13 rr_1ad7 1
stop_
loop_
_Dist_constraint_conv_err.ID
_Dist_constraint_conv_err.Dist_constraint_parse_file_ID
_Dist_constraint_conv_err.Parse_file_constraint_ID
_Dist_constraint_conv_err.Conv_error_type
_Dist_constraint_conv_err.Conv_error_note
_Dist_constraint_conv_err.Entry_ID
_Dist_constraint_conv_err.Distance_constraint_list_ID
1 2 1 1 "Not handling restraint 1, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_1ad7 1
2 2 1 1 "Not handling restraint 1, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_1ad7 1
3 2 2 1 "Not handling restraint 2, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_1ad7 1
4 2 2 1 "Not handling restraint 2, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_1ad7 1
5 2 3 1 "Distance restraint (original ID 3) deleted - no constraint items left." rr_1ad7 1
6 2 3 1 "Not handling item from distance restraint (original ID 3) - duplicate resonances" rr_1ad7 1
7 2 7 1 "Not handling restraint 7, item 1, resonance(s) '1.2.HG' (nmrStar names) not linked" rr_1ad7 1
8 2 10 1 "Not handling restraint 10, item 1, resonance(s) '1.2.HG' (nmrStar names) not linked" rr_1ad7 1
9 2 11 1 "Not handling restraint 11, item 1, resonance(s) '1.2.HG' (nmrStar names) not linked" rr_1ad7 1
10 2 12 1 "Not handling restraint 12, item 1, resonance(s) '1.2.HG' (nmrStar names) not linked" rr_1ad7 1
11 2 13 1 "Not handling restraint 13, item 1, resonance(s) '1.2.HG' (nmrStar names) not linked" rr_1ad7 1
stop_
save_
save_Discover_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Sf_framecode Discover_dihedral_4
_Torsion_angle_constraint_list.Entry_ID rr_1ad7
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Details "Generated by Wattos"
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 4
loop_
_Torsion_angle_constraint_software.Software_ID
_Torsion_angle_constraint_software.Software_label
_Torsion_angle_constraint_software.Method_ID
_Torsion_angle_constraint_software.Method_label
_Torsion_angle_constraint_software.Entry_ID
_Torsion_angle_constraint_software.Torsion_angle_constraint_list_ID
. . . . rr_1ad7 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 3 3 CGU C C . . 1 1 4 4 CGU N N . . 1 1 4 4 CGU CA C . . 1 1 4 4 CGU C C . -170.0 -70.0 . . . A . 3 CGU C . . A . 4 CGU N . . A . 4 CGU CA . . A . 4 CGU C . 1 . 3 GLA C . . . 1 . 4 GLA N . . . 1 . 4 GLA CA . . . 1 . 4 GLA C . . rr_1ad7 1
2 . . 1 1 4 4 CGU C C . . 1 1 5 5 LEU N N . . 1 1 5 5 LEU CA C . . 1 1 5 5 LEU C C . -164.0 -85.0 . . . A . 4 CGU C . . A . 5 LEU N . . A . 5 LEU CA . . A . 5 LEU C . 1 . 4 GLA C . . . 1 . 5 LEU N . . . 1 . 5 LEU CA . . . 1 . 5 LEU C . . rr_1ad7 1
3 . . 1 1 5 5 LEU C C . . 1 1 6 6 GLN N N . . 1 1 6 6 GLN CA C . . 1 1 6 6 GLN C C . -162.0 -78.0 . . . A . 5 LEU C . . A . 6 GLN N . . A . 6 GLN CA . . A . 6 GLN C . 1 . 5 LEU C . . . 1 . 6 GLN N . . . 1 . 6 GLN CA . . . 1 . 6 GLN C . . rr_1ad7 1
4 . . 1 1 6 6 GLN C C . . 1 1 7 7 CGU N N . . 1 1 7 7 CGU CA C . . 1 1 7 7 CGU C C . -154.0 -80.0 . . . A . 6 GLN C . . A . 7 CGU N . . A . 7 CGU CA . . A . 7 CGU C . 1 . 6 GLN C . . . 1 . 7 GLA N . . . 1 . 7 GLA CA . . . 1 . 7 GLA C . . rr_1ad7 1
5 . . 1 1 7 7 CGU C C . . 1 1 8 8 ASN N N . . 1 1 8 8 ASN CA C . . 1 1 8 8 ASN C C . -151.0 -82.0 . . . A . 7 CGU C . . A . 8 ASN N . . A . 8 ASN CA . . A . 8 ASN C . 1 . 7 GLA C . . . 1 . 8 ASN N . . . 1 . 8 ASN CA . . . 1 . 8 ASN C . . rr_1ad7 1
6 . . 1 1 8 8 ASN C C . . 1 1 9 9 GLN N N . . 1 1 9 9 GLN CA C . . 1 1 9 9 GLN C C . -130.0 -98.0 . . . A . 8 ASN C . . A . 9 GLN N . . A . 9 GLN CA . . A . 9 GLN C . 1 . 8 ASN C . . . 1 . 9 GLN N . . . 1 . 9 GLN CA . . . 1 . 9 GLN C . . rr_1ad7 1
7 . . 1 1 9 9 GLN C C . . 1 1 10 10 CGU N N . . 1 1 10 10 CGU CA C . . 1 1 10 10 CGU C C . -170.0 -70.0 . . . A . 9 GLN C . . A . 10 CGU N . . A . 10 CGU CA . . A . 10 CGU C . 1 . 9 GLN C . . . 1 . 10 GLA N . . . 1 . 10 GLA CA . . . 1 . 10 GLA C . . rr_1ad7 1
8 . . 1 1 10 10 CGU C C . . 1 1 11 11 LEU N N . . 1 1 11 11 LEU CA C . . 1 1 11 11 LEU C C . -155.0 -72.0 . . . A . 10 CGU C . . A . 11 LEU N . . A . 11 LEU CA . . A . 11 LEU C . 1 . 10 GLA C . . . 1 . 11 LEU N . . . 1 . 11 LEU CA . . . 1 . 11 LEU C . . rr_1ad7 1
9 . . 1 1 11 11 LEU C C . . 1 1 12 12 ILE N N . . 1 1 12 12 ILE CA C . . 1 1 12 12 ILE C C . -169.0 -71.0 . . . A . 11 LEU C . . A . 12 ILE N . . A . 12 ILE CA . . A . 12 ILE C . 1 . 11 LEU C . . . 1 . 12 ILE N . . . 1 . 12 ILE CA . . . 1 . 12 ILE C . . rr_1ad7 1
10 . . 1 1 12 12 ILE C C . . 1 1 13 13 ARG N N . . 1 1 13 13 ARG CA C . . 1 1 13 13 ARG C C . -158.0 -76.0 . . . A . 12 ILE C . . A . 13 ARG N . . A . 13 ARG CA . . A . 13 ARG C . 1 . 12 ILE C . . . 1 . 13 ARG+ N . . . 1 . 13 ARG+ CA . . . 1 . 13 ARG+ C . . rr_1ad7 1
11 . . 1 1 13 13 ARG C C . . 1 1 14 14 CGU N N . . 1 1 14 14 CGU CA C . . 1 1 14 14 CGU C C . -169.0 -71.0 . . . A . 13 ARG C . . A . 14 CGU N . . A . 14 CGU CA . . A . 14 CGU C . 1 . 13 ARG+ C . . . 1 . 14 GLA N . . . 1 . 14 GLA CA . . . 1 . 14 GLA C . . rr_1ad7 1
12 . . 1 1 14 14 CGU C C . . 1 1 15 15 LYS N N . . 1 1 15 15 LYS CA C . . 1 1 15 15 LYS C C . -169.0 -71.0 . . . A . 14 CGU C . . A . 15 LYS N . . A . 15 LYS CA . . A . 15 LYS C . 1 . 14 GLA C . . . 1 . 15 LYS+ N . . . 1 . 15 LYS+ CA . . . 1 . 15 LYS+ C . . rr_1ad7 1
13 . . 1 1 15 15 LYS C C . . 1 1 16 16 SER N N . . 1 1 16 16 SER CA C . . 1 1 16 16 SER C C . -169.0 -71.0 . . . A . 15 LYS C . . A . 16 SER N . . A . 16 SER CA . . A . 16 SER C . 1 . 15 LYS+ C . . . 1 . 16 SER N . . . 1 . 16 SER CA . . . 1 . 16 SER C . . rr_1ad7 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 3J_dihedral 1 1 1 12 rr_1ad7 1
stop_
save_
save_MR_file_comment_1
_Org_constr_file_comment.Sf_framecode MR_file_comment_1
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID rr_1ad7
_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 GAMMA-CARBOXYGLUTAMIC ACID 21-FEB-97 1AD7 *TITLE NMR STRUCTURE OF METAL-FREE CONANTOKIN G, 1 STRUCTURE *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: CONANTOXIN G; *COMPND 3 CHAIN: NULL; *COMPND 4 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: CONUS GEOGRAPHUS; *SOURCE 4 ORGANISM_COMMON: GEOGRAPHY CONE; *SOURCE 5 SECRETION: VENOM; *SOURCE 6 OTHER_DETAILS: C-TERMINAL AMIDE, SYNTHETIC PEPTIDE *KEYWDS GAMMA-CARBOXYGLUTAMIC ACID, CONANTOKIN G, CONOTOXIN *EXPDTA NMR, 1 STRUCTURE *AUTHOR A.C.RIGBY,J.D.BALEJA,B.C.FURIE,B.FURIE *REVDAT 1 20-AUG-97 1AD7 0 !BIOSYM restraint 1
!
;
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_1ad7
_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
;#mixing_times
-9.990000E+02 !
;
save_
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