NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
583202 |
2mu8   |
25202 | cing | 3-converted-DOCR | STAR | entry | full | 198 |
data_DOCR_restraints_with_modified_coordinates_PDB_code_2mu8
# This DOCR archive file contains, for PDB entry <2mu8>:
#
# - 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_2mu8
_Entry.Title "wwPDB remediated NMR restraints for PDB entry 2mu8"
_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 2mu8"
_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 2mu8 "Master copy" rr_2mu8
stop_
save_
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID rr_2mu8
_Assembly.ID 1
_Assembly.Name 2mu8
_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 2396.6534
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 "MSP 2 peptide" 1 $MSP_2_peptide A . no . . . . . . rr_2mu8 1
stop_
save_
save_MSP_2_peptide
_Entity.Sf_category entity
_Entity.Sf_framecode MSP_2_peptide
_Entity.Entry_ID rr_2mu8
_Entity.ID 1
_Entity.Name MSP_2_peptide
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_strand_ID A
_Entity.Polymer_seq_one_letter_code KNESKYSNTFINNAYNMSIR
_Entity.Ambiguous_conformational_states no
_Entity.Ambiguous_chem_comp_sites no
_Entity.Nstd_monomer no
_Entity.Nstd_chirality no
_Entity.Nstd_linkage no
_Entity.Number_of_monomers 20
_Entity.Paramagnetic no
_Entity.Thiol_state "not present"
_Entity.Parent_entity_ID 1
_Entity.Formula_weight 2396.6534
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 . LYS . rr_2mu8 1
2 . ASN . rr_2mu8 1
3 . GLU . rr_2mu8 1
4 . SER . rr_2mu8 1
5 . LYS . rr_2mu8 1
6 . TYR . rr_2mu8 1
7 . SER . rr_2mu8 1
8 . ASN . rr_2mu8 1
9 . THR . rr_2mu8 1
10 . PHE . rr_2mu8 1
11 . ILE . rr_2mu8 1
12 . ASN . rr_2mu8 1
13 . ASN . rr_2mu8 1
14 . ALA . rr_2mu8 1
15 . TYR . rr_2mu8 1
16 . ASN . rr_2mu8 1
17 . MET . rr_2mu8 1
18 . SER . rr_2mu8 1
19 . ILE . rr_2mu8 1
20 . ARG . rr_2mu8 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
. LYS 1 1 rr_2mu8 1
. ASN 2 2 rr_2mu8 1
. GLU 3 3 rr_2mu8 1
. SER 4 4 rr_2mu8 1
. LYS 5 5 rr_2mu8 1
. TYR 6 6 rr_2mu8 1
. SER 7 7 rr_2mu8 1
. ASN 8 8 rr_2mu8 1
. THR 9 9 rr_2mu8 1
. PHE 10 10 rr_2mu8 1
. ILE 11 11 rr_2mu8 1
. ASN 12 12 rr_2mu8 1
. ASN 13 13 rr_2mu8 1
. ALA 14 14 rr_2mu8 1
. TYR 15 15 rr_2mu8 1
. ASN 16 16 rr_2mu8 1
. MET 17 17 rr_2mu8 1
. SER 18 18 rr_2mu8 1
. ILE 19 19 rr_2mu8 1
. ARG 20 20 rr_2mu8 1
stop_
save_
save_conformer_statistics
_Conformer_stat_list.Sf_category conformer_statistics
_Conformer_stat_list.Sf_framecode conformer_statistics
_Conformer_stat_list.Entry_ID rr_2mu8
_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_2mu8
_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_2mu8 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_2mu8 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 LYS C C -11.352 -1.218 -11.303 . . . 1.0 . . . . . . . . . . . . A . 1 LYS C . . . . . . . . . rr_2mu8 1
. 1 . 2 . 1 1 1 LYS CA C -12.897 -1.275 -11.490 . . . 1.0 . . . . . . . . . . . . A . 1 LYS CA . . . . . . . . . rr_2mu8 1
. 1 . 3 . 1 1 1 LYS CB C -13.366 -1.037 -12.955 . . . 1.0 . . . . . . . . . . . . A . 1 LYS CB . . . . . . . . . rr_2mu8 1
. 1 . 4 . 1 1 1 LYS CD C -13.682 0.471 -15.024 . . . 1.0 . . . . . . . . . . . . A . 1 LYS CD . . . . . . . . . rr_2mu8 1
. 1 . 5 . 1 1 1 LYS CE C -13.507 1.856 -15.678 . . . 1.0 . . . . . . . . . . . . A . 1 LYS CE . . . . . . . . . rr_2mu8 1
. 1 . 6 . 1 1 1 LYS CG C -13.122 0.355 -13.590 . . . 1.0 . . . . . . . . . . . . A . 1 LYS CG . . . . . . . . . rr_2mu8 1
. 1 . 7 . 1 1 1 LYS H1 H -13.840 0.613 -10.831 . . . 1.0 . . . . . . . . . . . . A . 1 LYS H1 . . . . . . . . . rr_2mu8 1
. 1 . 8 . 1 1 1 LYS HA H -13.251 -2.301 -11.256 . . . 1.0 . . . . . . . . . . . . A . 1 LYS HA . . . . . . . . . rr_2mu8 1
. 1 . 9 . 1 1 1 LYS HB2 H -12.893 -1.804 -13.599 . . . 1.0 . . . . . . . . . . . . A . 1 LYS HB2 . . . . . . . . . rr_2mu8 1
. 1 . 10 . 1 1 1 LYS HB3 H -14.449 -1.260 -13.009 . . . 1.0 . . . . . . . . . . . . A . 1 LYS HB3 . . . . . . . . . rr_2mu8 1
. 1 . 11 . 1 1 1 LYS HD2 H -13.235 -0.309 -15.671 . . . 1.0 . . . . . . . . . . . . A . 1 LYS HD2 . . . . . . . . . rr_2mu8 1
. 1 . 12 . 1 1 1 LYS HD3 H -14.764 0.239 -15.001 . . . 1.0 . . . . . . . . . . . . A . 1 LYS HD3 . . . . . . . . . rr_2mu8 1
. 1 . 13 . 1 1 1 LYS HE2 H -14.112 1.900 -16.603 . . . 1.0 . . . . . . . . . . . . A . 1 LYS HE2 . . . . . . . . . rr_2mu8 1
. 1 . 14 . 1 1 1 LYS HE3 H -13.910 2.648 -15.021 . . . 1.0 . . . . . . . . . . . . A . 1 LYS HE3 . . . . . . . . . rr_2mu8 1
. 1 . 15 . 1 1 1 LYS HG2 H -13.580 1.138 -12.956 . . . 1.0 . . . . . . . . . . . . A . 1 LYS HG2 . . . . . . . . . rr_2mu8 1
. 1 . 16 . 1 1 1 LYS HG3 H -12.039 0.575 -13.604 . . . 1.0 . . . . . . . . . . . . A . 1 LYS HG3 . . . . . . . . . rr_2mu8 1
. 1 . 17 . 1 1 1 LYS HZ2 H -11.746 1.477 -16.690 . . . 1.0 . . . . . . . . . . . . A . 1 LYS HZ2 . . . . . . . . . rr_2mu8 1
. 1 . 18 . 1 1 1 LYS HZ3 H -12.056 3.072 -16.507 . . . 1.0 . . . . . . . . . . . . A . 1 LYS HZ3 . . . . . . . . . rr_2mu8 1
. 1 . 19 . 1 1 1 LYS N N -13.567 -0.335 -10.549 . . . 1.0 . . . . . . . . . . . . A . 1 LYS N . . . . . . . . . rr_2mu8 1
. 1 . 20 . 1 1 1 LYS NZ N -12.106 2.168 -16.023 . . . 1.0 . . . . . . . . . . . . A . 1 LYS NZ . . . . . . . . . rr_2mu8 1
. 1 . 21 . 1 1 1 LYS O O -10.721 -0.190 -11.569 . . . 1.0 . . . . . . . . . . . . A . 1 LYS O . . . . . . . . . rr_2mu8 1
. 1 . 22 . 1 1 2 ASN C C -8.749 -1.398 -9.588 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . rr_2mu8 1
. 1 . 23 . 1 1 2 ASN CA C -9.302 -2.491 -10.561 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . rr_2mu8 1
. 1 . 24 . 1 1 2 ASN CB C -8.534 -2.658 -11.904 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . rr_2mu8 1
. 1 . 25 . 1 1 2 ASN CG C -7.059 -3.085 -11.769 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . rr_2mu8 1
. 1 . 26 . 1 1 2 ASN H H -11.393 -3.138 -10.737 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . rr_2mu8 1
. 1 . 27 . 1 1 2 ASN HA H -9.200 -3.464 -10.041 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . rr_2mu8 1
. 1 . 28 . 1 1 2 ASN HB2 H -9.037 -3.433 -12.516 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . rr_2mu8 1
. 1 . 29 . 1 1 2 ASN HB3 H -8.638 -1.732 -12.499 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . rr_2mu8 1
. 1 . 30 . 1 1 2 ASN HD21 H -6.446 -1.228 -12.215 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . rr_2mu8 1
. 1 . 31 . 1 1 2 ASN HD22 H -5.149 -2.481 -11.877 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . rr_2mu8 1
. 1 . 32 . 1 1 2 ASN N N -10.765 -2.335 -10.818 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . rr_2mu8 1
. 1 . 33 . 1 1 2 ASN ND2 N -6.122 -2.173 -11.981 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . rr_2mu8 1
. 1 . 34 . 1 1 2 ASN O O -8.106 -0.433 -10.015 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . rr_2mu8 1
. 1 . 35 . 1 1 2 ASN OD1 O -6.753 -4.240 -11.474 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . rr_2mu8 1
. 1 . 36 . 1 1 3 GLU C C -7.225 -1.104 -6.627 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . rr_2mu8 1
. 1 . 37 . 1 1 3 GLU CA C -8.580 -0.636 -7.224 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . rr_2mu8 1
. 1 . 38 . 1 1 3 GLU CB C -9.688 -0.559 -6.142 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . rr_2mu8 1
. 1 . 39 . 1 1 3 GLU CD C -12.051 0.196 -5.486 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . rr_2mu8 1
. 1 . 40 . 1 1 3 GLU CG C -10.993 0.141 -6.590 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . rr_2mu8 1
. 1 . 41 . 1 1 3 GLU H H -9.634 -2.353 -8.041 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . rr_2mu8 1
. 1 . 42 . 1 1 3 GLU HA H -8.479 0.388 -7.642 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . rr_2mu8 1
. 1 . 43 . 1 1 3 GLU HB2 H -9.915 -1.562 -5.728 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . rr_2mu8 1
. 1 . 44 . 1 1 3 GLU HB3 H -9.274 -0.002 -5.293 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . rr_2mu8 1
. 1 . 45 . 1 1 3 GLU HE2 H -12.633 -1.522 -6.191 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HE2 . . . . . . . . . rr_2mu8 1
. 1 . 46 . 1 1 3 GLU HG2 H -10.770 1.171 -6.926 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . rr_2mu8 1
. 1 . 47 . 1 1 3 GLU HG3 H -11.417 -0.369 -7.474 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . rr_2mu8 1
. 1 . 48 . 1 1 3 GLU N N -9.019 -1.572 -8.281 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . rr_2mu8 1
. 1 . 49 . 1 1 3 GLU O O -7.125 -2.192 -6.049 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . rr_2mu8 1
. 1 . 50 . 1 1 3 GLU OE1 O -12.151 1.129 -4.690 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . rr_2mu8 1
. 1 . 51 . 1 1 3 GLU OE2 O -12.867 -0.906 -5.494 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . rr_2mu8 1
. 1 . 52 . 1 1 4 SER C C -4.731 -0.044 -4.770 . . . 1.0 . . . . . . . . . . . . A . 4 SER C . . . . . . . . . rr_2mu8 1
. 1 . 53 . 1 1 4 SER CA C -4.832 -0.527 -6.242 . . . 1.0 . . . . . . . . . . . . A . 4 SER CA . . . . . . . . . rr_2mu8 1
. 1 . 54 . 1 1 4 SER CB C -3.771 0.163 -7.128 . . . 1.0 . . . . . . . . . . . . A . 4 SER CB . . . . . . . . . rr_2mu8 1
. 1 . 55 . 1 1 4 SER H H -6.427 0.627 -7.246 . . . 1.0 . . . . . . . . . . . . A . 4 SER H . . . . . . . . . rr_2mu8 1
. 1 . 56 . 1 1 4 SER HA H -4.629 -1.616 -6.305 . . . 1.0 . . . . . . . . . . . . A . 4 SER HA . . . . . . . . . rr_2mu8 1
. 1 . 57 . 1 1 4 SER HB2 H -3.950 1.252 -7.205 . . . 1.0 . . . . . . . . . . . . A . 4 SER HB2 . . . . . . . . . rr_2mu8 1
. 1 . 58 . 1 1 4 SER HB3 H -2.765 0.052 -6.683 . . . 1.0 . . . . . . . . . . . . A . 4 SER HB3 . . . . . . . . . rr_2mu8 1
. 1 . 59 . 1 1 4 SER HG H -3.540 -1.338 -8.309 . . . 1.0 . . . . . . . . . . . . A . 4 SER HG . . . . . . . . . rr_2mu8 1
. 1 . 60 . 1 1 4 SER N N -6.194 -0.253 -6.772 . . . 1.0 . . . . . . . . . . . . A . 4 SER N . . . . . . . . . rr_2mu8 1
. 1 . 61 . 1 1 4 SER O O -4.964 1.132 -4.469 . . . 1.0 . . . . . . . . . . . . A . 4 SER O . . . . . . . . . rr_2mu8 1
. 1 . 62 . 1 1 4 SER OG O -3.744 -0.409 -8.432 . . . 1.0 . . . . . . . . . . . . A . 4 SER OG . . . . . . . . . rr_2mu8 1
. 1 . 63 . 1 1 5 LYS C C -2.789 -1.185 -2.105 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . rr_2mu8 1
. 1 . 64 . 1 1 5 LYS CA C -4.234 -0.722 -2.430 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . rr_2mu8 1
. 1 . 65 . 1 1 5 LYS CB C -5.277 -1.527 -1.635 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . rr_2mu8 1
. 1 . 66 . 1 1 5 LYS CD C -7.065 0.376 -1.210 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . rr_2mu8 1
. 1 . 67 . 1 1 5 LYS CE C -6.782 0.623 0.285 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . rr_2mu8 1
. 1 . 68 . 1 1 5 LYS CG C -6.753 -1.056 -1.697 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . rr_2mu8 1
. 1 . 69 . 1 1 5 LYS H H -4.005 -1.857 -4.178 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . rr_2mu8 1
. 1 . 70 . 1 1 5 LYS HA H -4.362 0.353 -2.183 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . rr_2mu8 1
. 1 . 71 . 1 1 5 LYS HB2 H -5.242 -2.598 -1.919 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . rr_2mu8 1
. 1 . 72 . 1 1 5 LYS HB3 H -4.916 -1.499 -0.606 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . rr_2mu8 1
. 1 . 73 . 1 1 5 LYS HD2 H -6.513 1.107 -1.830 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . rr_2mu8 1
. 1 . 74 . 1 1 5 LYS HD3 H -8.134 0.578 -1.415 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . rr_2mu8 1
. 1 . 75 . 1 1 5 LYS HE2 H -7.349 -0.094 0.908 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . rr_2mu8 1
. 1 . 76 . 1 1 5 LYS HE3 H -5.714 0.455 0.512 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . rr_2mu8 1
. 1 . 77 . 1 1 5 LYS HG2 H -7.111 -1.156 -2.738 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . rr_2mu8 1
. 1 . 78 . 1 1 5 LYS HG3 H -7.373 -1.770 -1.121 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . rr_2mu8 1
. 1 . 79 . 1 1 5 LYS HZ2 H -6.900 2.150 1.668 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . rr_2mu8 1
. 1 . 80 . 1 1 5 LYS HZ3 H -6.583 2.673 0.152 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . rr_2mu8 1
. 1 . 81 . 1 1 5 LYS N N -4.400 -0.979 -3.862 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . rr_2mu8 1
. 1 . 82 . 1 1 5 LYS NZ N -7.142 1.996 0.683 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . rr_2mu8 1
. 1 . 83 . 1 1 5 LYS O O -2.489 -2.371 -1.917 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . rr_2mu8 1
. 1 . 84 . 1 1 6 TYR C C -0.019 0.875 -0.918 . . . 1.0 . . . . . . . . . . . . A . 6 TYR C . . . . . . . . . rr_2mu8 1
. 1 . 85 . 1 1 6 TYR CA C -0.471 -0.343 -1.770 . . . 1.0 . . . . . . . . . . . . A . 6 TYR CA . . . . . . . . . rr_2mu8 1
. 1 . 86 . 1 1 6 TYR CB C 0.414 -0.542 -3.042 . . . 1.0 . . . . . . . . . . . . A . 6 TYR CB . . . . . . . . . rr_2mu8 1
. 1 . 87 . 1 1 6 TYR CD1 C 0.730 -3.039 -3.489 . . . 1.0 . . . . . . . . . . . . A . 6 TYR CD1 . . . . . . . . . rr_2mu8 1
. 1 . 88 . 1 1 6 TYR CD2 C -0.683 -1.774 -4.985 . . . 1.0 . . . . . . . . . . . . A . 6 TYR CD2 . . . . . . . . . rr_2mu8 1
. 1 . 89 . 1 1 6 TYR CE1 C 0.469 -4.195 -4.222 . . . 1.0 . . . . . . . . . . . . A . 6 TYR CE1 . . . . . . . . . rr_2mu8 1
. 1 . 90 . 1 1 6 TYR CE2 C -0.947 -2.931 -5.714 . . . 1.0 . . . . . . . . . . . . A . 6 TYR CE2 . . . . . . . . . rr_2mu8 1
. 1 . 91 . 1 1 6 TYR CG C 0.153 -1.820 -3.863 . . . 1.0 . . . . . . . . . . . . A . 6 TYR CG . . . . . . . . . rr_2mu8 1
. 1 . 92 . 1 1 6 TYR CZ C -0.369 -4.141 -5.334 . . . 1.0 . . . . . . . . . . . . A . 6 TYR CZ . . . . . . . . . rr_2mu8 1
. 1 . 93 . 1 1 6 TYR H H -2.432 0.694 -2.048 . . . 1.0 . . . . . . . . . . . . A . 6 TYR H . . . . . . . . . rr_2mu8 1
. 1 . 94 . 1 1 6 TYR HA H -0.335 -1.239 -1.132 . . . 1.0 . . . . . . . . . . . . A . 6 TYR HA . . . . . . . . . rr_2mu8 1
. 1 . 95 . 1 1 6 TYR HB2 H 0.328 0.348 -3.695 . . . 1.0 . . . . . . . . . . . . A . 6 TYR HB2 . . . . . . . . . rr_2mu8 1
. 1 . 96 . 1 1 6 TYR HB3 H 1.478 -0.541 -2.737 . . . 1.0 . . . . . . . . . . . . A . 6 TYR HB3 . . . . . . . . . rr_2mu8 1
. 1 . 97 . 1 1 6 TYR HD1 H 1.381 -3.097 -2.629 . . . 1.0 . . . . . . . . . . . . A . 6 TYR HD1 . . . . . . . . . rr_2mu8 1
. 1 . 98 . 1 1 6 TYR HD2 H -1.144 -0.844 -5.285 . . . 1.0 . . . . . . . . . . . . A . 6 TYR HD2 . . . . . . . . . rr_2mu8 1
. 1 . 99 . 1 1 6 TYR HE1 H 0.919 -5.131 -3.926 . . . 1.0 . . . . . . . . . . . . A . 6 TYR HE1 . . . . . . . . . rr_2mu8 1
. 1 . 100 . 1 1 6 TYR HE2 H -1.599 -2.885 -6.574 . . . 1.0 . . . . . . . . . . . . A . 6 TYR HE2 . . . . . . . . . rr_2mu8 1
. 1 . 101 . 1 1 6 TYR HH H -0.140 -6.011 -5.670 . . . 1.0 . . . . . . . . . . . . A . 6 TYR HH . . . . . . . . . rr_2mu8 1
. 1 . 102 . 1 1 6 TYR N N -1.914 -0.183 -2.091 . . . 1.0 . . . . . . . . . . . . A . 6 TYR N . . . . . . . . . rr_2mu8 1
. 1 . 103 . 1 1 6 TYR O O 0.691 1.774 -1.387 . . . 1.0 . . . . . . . . . . . . A . 6 TYR O . . . . . . . . . rr_2mu8 1
. 1 . 104 . 1 1 6 TYR OH O -0.624 -5.279 -6.057 . . . 1.0 . . . . . . . . . . . . A . 6 TYR OH . . . . . . . . . rr_2mu8 1
. 1 . 105 . 1 1 7 SER C C -0.319 3.395 0.872 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . rr_2mu8 1
. 1 . 106 . 1 1 7 SER CA C -0.165 1.932 1.371 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . rr_2mu8 1
. 1 . 107 . 1 1 7 SER CB C 1.197 1.625 2.046 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . rr_2mu8 1
. 1 . 108 . 1 1 7 SER H H -1.446 0.505 0.340 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . rr_2mu8 1
. 1 . 109 . 1 1 7 SER HA H -0.919 1.809 2.172 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . rr_2mu8 1
. 1 . 110 . 1 1 7 SER HB2 H 1.356 2.303 2.904 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . rr_2mu8 1
. 1 . 111 . 1 1 7 SER HB3 H 1.203 0.606 2.475 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . rr_2mu8 1
. 1 . 112 . 1 1 7 SER HG H 3.084 1.574 1.663 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . rr_2mu8 1
. 1 . 113 . 1 1 7 SER N N -0.495 0.893 0.349 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . rr_2mu8 1
. 1 . 114 . 1 1 7 SER O O 0.637 4.172 0.861 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . rr_2mu8 1
. 1 . 115 . 1 1 7 SER OG O 2.295 1.758 1.147 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . rr_2mu8 1
. 1 . 116 . 1 1 8 ASN C C -0.968 5.687 -1.154 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . rr_2mu8 1
. 1 . 117 . 1 1 8 ASN CA C -1.929 5.064 -0.113 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . rr_2mu8 1
. 1 . 118 . 1 1 8 ASN CB C -2.366 5.908 1.104 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . rr_2mu8 1
. 1 . 119 . 1 1 8 ASN CG C -3.337 7.054 0.787 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . rr_2mu8 1
. 1 . 120 . 1 1 8 ASN H H -2.253 3.012 0.423 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . rr_2mu8 1
. 1 . 121 . 1 1 8 ASN HA H -2.825 4.883 -0.741 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . rr_2mu8 1
. 1 . 122 . 1 1 8 ASN HB2 H -2.864 5.225 1.827 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . rr_2mu8 1
. 1 . 123 . 1 1 8 ASN HB3 H -1.474 6.282 1.634 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . rr_2mu8 1
. 1 . 124 . 1 1 8 ASN HD21 H -4.694 5.672 0.385 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . rr_2mu8 1
. 1 . 125 . 1 1 8 ASN HD22 H -5.230 7.433 0.206 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . rr_2mu8 1
. 1 . 126 . 1 1 8 ASN N N -1.543 3.734 0.420 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . rr_2mu8 1
. 1 . 127 . 1 1 8 ASN ND2 N -4.571 6.692 0.470 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . rr_2mu8 1
. 1 . 128 . 1 1 8 ASN O O -0.599 6.864 -1.126 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . rr_2mu8 1
. 1 . 129 . 1 1 8 ASN OD1 O -2.994 8.235 0.823 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . rr_2mu8 1
. 1 . 130 . 1 1 9 THR C C 1.677 5.512 -2.910 . . . 1.0 . . . . . . . . . . . . A . 9 THR C . . . . . . . . . rr_2mu8 1
. 1 . 131 . 1 1 9 THR CA C 0.223 5.053 -3.274 . . . 1.0 . . . . . . . . . . . . A . 9 THR CA . . . . . . . . . rr_2mu8 1
. 1 . 132 . 1 1 9 THR CB C -0.622 5.902 -4.273 . . . 1.0 . . . . . . . . . . . . A . 9 THR CB . . . . . . . . . rr_2mu8 1
. 1 . 133 . 1 1 9 THR CG2 C 0.025 6.168 -5.627 . . . 1.0 . . . . . . . . . . . . A . 9 THR CG2 . . . . . . . . . rr_2mu8 1
. 1 . 134 . 1 1 9 THR H H -0.860 3.835 -1.781 . . . 1.0 . . . . . . . . . . . . A . 9 THR H . . . . . . . . . rr_2mu8 1
. 1 . 135 . 1 1 9 THR HA H 0.375 4.063 -3.739 . . . 1.0 . . . . . . . . . . . . A . 9 THR HA . . . . . . . . . rr_2mu8 1
. 1 . 136 . 1 1 9 THR HB H -0.852 6.862 -3.783 . . . 1.0 . . . . . . . . . . . . A . 9 THR HB . . . . . . . . . rr_2mu8 1
. 1 . 137 . 1 1 9 THR HG1 H -1.638 4.435 -5.004 . . . 1.0 . . . . . . . . . . . . A . 9 THR HG1 . . . . . . . . . rr_2mu8 1
. 1 . 138 . 1 1 9 THR HG21 H 0.288 5.217 -6.123 . . . 1.0 . . . . . . . . . . . . A . 9 THR HG21 . . . . . . . . . rr_2mu8 1
. 1 . 139 . 1 1 9 THR HG22 H 0.934 6.782 -5.527 . . . 1.0 . . . . . . . . . . . . A . 9 THR HG22 . . . . . . . . . rr_2mu8 1
. 1 . 140 . 1 1 9 THR HG23 H -0.678 6.716 -6.279 . . . 1.0 . . . . . . . . . . . . A . 9 THR HG23 . . . . . . . . . rr_2mu8 1
. 1 . 141 . 1 1 9 THR N N -0.640 4.791 -2.100 . . . 1.0 . . . . . . . . . . . . A . 9 THR N . . . . . . . . . rr_2mu8 1
. 1 . 142 . 1 1 9 THR O O 2.214 6.497 -3.421 . . . 1.0 . . . . . . . . . . . . A . 9 THR O . . . . . . . . . rr_2mu8 1
. 1 . 143 . 1 1 9 THR OG1 O -1.864 5.258 -4.564 . . . 1.0 . . . . . . . . . . . . A . 9 THR OG1 . . . . . . . . . rr_2mu8 1
. 1 . 144 . 1 1 10 PHE C C 4.596 3.604 -1.517 . . . 1.0 . . . . . . . . . . . . A . 10 PHE C . . . . . . . . . rr_2mu8 1
. 1 . 145 . 1 1 10 PHE CA C 3.689 4.888 -1.520 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CA . . . . . . . . . rr_2mu8 1
. 1 . 146 . 1 1 10 PHE CB C 3.593 5.458 -0.090 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CB . . . . . . . . . rr_2mu8 1
. 1 . 147 . 1 1 10 PHE CD1 C 3.252 7.942 -0.664 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD1 . . . . . . . . . rr_2mu8 1
. 1 . 148 . 1 1 10 PHE CD2 C 1.986 6.998 1.161 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CD2 . . . . . . . . . rr_2mu8 1
. 1 . 149 . 1 1 10 PHE CE1 C 2.599 9.159 -0.485 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE1 . . . . . . . . . rr_2mu8 1
. 1 . 150 . 1 1 10 PHE CE2 C 1.335 8.216 1.340 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CE2 . . . . . . . . . rr_2mu8 1
. 1 . 151 . 1 1 10 PHE CG C 2.932 6.841 0.142 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CG . . . . . . . . . rr_2mu8 1
. 1 . 152 . 1 1 10 PHE CZ C 1.639 9.294 0.513 . . . 1.0 . . . . . . . . . . . . A . 10 PHE CZ . . . . . . . . . rr_2mu8 1
. 1 . 153 . 1 1 10 PHE H H 1.655 4.124 -1.480 . . . 1.0 . . . . . . . . . . . . A . 10 PHE H . . . . . . . . . rr_2mu8 1
. 1 . 154 . 1 1 10 PHE HA H 4.227 5.548 -2.205 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HA . . . . . . . . . rr_2mu8 1
. 1 . 155 . 1 1 10 PHE HB2 H 3.093 4.655 0.488 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB2 . . . . . . . . . rr_2mu8 1
. 1 . 156 . 1 1 10 PHE HB3 H 4.608 5.513 0.306 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HB3 . . . . . . . . . rr_2mu8 1
. 1 . 157 . 1 1 10 PHE HD1 H 3.987 7.853 -1.450 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD1 . . . . . . . . . rr_2mu8 1
. 1 . 158 . 1 1 10 PHE HD2 H 1.743 6.181 1.821 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HD2 . . . . . . . . . rr_2mu8 1
. 1 . 159 . 1 1 10 PHE HE1 H 2.837 9.998 -1.123 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE1 . . . . . . . . . rr_2mu8 1
. 1 . 160 . 1 1 10 PHE HE2 H 0.595 8.324 2.120 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HE2 . . . . . . . . . rr_2mu8 1
. 1 . 161 . 1 1 10 PHE HZ H 1.133 10.238 0.650 . . . 1.0 . . . . . . . . . . . . A . 10 PHE HZ . . . . . . . . . rr_2mu8 1
. 1 . 162 . 1 1 10 PHE N N 2.291 4.722 -2.013 . . . 1.0 . . . . . . . . . . . . A . 10 PHE N . . . . . . . . . rr_2mu8 1
. 1 . 163 . 1 1 10 PHE O O 5.748 3.619 -1.076 . . . 1.0 . . . . . . . . . . . . A . 10 PHE O . . . . . . . . . rr_2mu8 1
. 1 . 164 . 1 1 11 ILE C C 5.278 0.494 -1.044 . . . 1.0 . . . . . . . . . . . . A . 11 ILE C . . . . . . . . . rr_2mu8 1
. 1 . 165 . 1 1 11 ILE CA C 4.581 1.177 -2.277 . . . 1.0 . . . . . . . . . . . . A . 11 ILE CA . . . . . . . . . rr_2mu8 1
. 1 . 166 . 1 1 11 ILE CB C 5.245 1.261 -3.708 . . . 1.0 . . . . . . . . . . . . A . 11 ILE CB . . . . . . . . . rr_2mu8 1
. 1 . 167 . 1 1 11 ILE CD1 C 3.180 2.440 -4.990 . . . 1.0 . . . . . . . . . . . . A . 11 ILE CD1 . . . . . . . . . rr_2mu8 1
. 1 . 168 . 1 1 11 ILE CG1 C 4.213 1.303 -4.889 . . . 1.0 . . . . . . . . . . . . A . 11 ILE CG1 . . . . . . . . . rr_2mu8 1
. 1 . 169 . 1 1 11 ILE CG2 C 6.276 0.167 -4.075 . . . 1.0 . . . . . . . . . . . . A . 11 ILE CG2 . . . . . . . . . rr_2mu8 1
. 1 . 170 . 1 1 11 ILE H H 3.466 2.977 -2.791 . . . 1.0 . . . . . . . . . . . . A . 11 ILE H . . . . . . . . . rr_2mu8 1
. 1 . 171 . 1 1 11 ILE HA H 3.686 0.540 -2.426 . . . 1.0 . . . . . . . . . . . . A . 11 ILE HA . . . . . . . . . rr_2mu8 1
. 1 . 172 . 1 1 11 ILE HB H 5.814 2.199 -3.726 . . . 1.0 . . . . . . . . . . . . A . 11 ILE HB . . . . . . . . . rr_2mu8 1
. 1 . 173 . 1 1 11 ILE HD11 H 3.654 3.435 -4.890 . . . 1.0 . . . . . . . . . . . . A . 11 ILE HD11 . . . . . . . . . rr_2mu8 1
. 1 . 174 . 1 1 11 ILE HD12 H 2.664 2.422 -5.967 . . . 1.0 . . . . . . . . . . . . A . 11 ILE HD12 . . . . . . . . . rr_2mu8 1
. 1 . 175 . 1 1 11 ILE HD13 H 2.393 2.359 -4.217 . . . 1.0 . . . . . . . . . . . . A . 11 ILE HD13 . . . . . . . . . rr_2mu8 1
. 1 . 176 . 1 1 11 ILE HG12 H 4.782 1.394 -5.820 . . . 1.0 . . . . . . . . . . . . A . 11 ILE HG12 . . . . . . . . . rr_2mu8 1
. 1 . 177 . 1 1 11 ILE HG13 H 3.676 0.337 -4.943 . . . 1.0 . . . . . . . . . . . . A . 11 ILE HG13 . . . . . . . . . rr_2mu8 1
. 1 . 178 . 1 1 11 ILE HG21 H 5.825 -0.843 -4.088 . . . 1.0 . . . . . . . . . . . . A . 11 ILE HG21 . . . . . . . . . rr_2mu8 1
. 1 . 179 . 1 1 11 ILE HG22 H 6.728 0.336 -5.070 . . . 1.0 . . . . . . . . . . . . A . 11 ILE HG22 . . . . . . . . . rr_2mu8 1
. 1 . 180 . 1 1 11 ILE HG23 H 7.117 0.148 -3.363 . . . 1.0 . . . . . . . . . . . . A . 11 ILE HG23 . . . . . . . . . rr_2mu8 1
. 1 . 181 . 1 1 11 ILE N N 4.021 2.532 -2.057 . . . 1.0 . . . . . . . . . . . . A . 11 ILE N . . . . . . . . . rr_2mu8 1
. 1 . 182 . 1 1 11 ILE O O 5.491 1.066 0.029 . . . 1.0 . . . . . . . . . . . . A . 11 ILE O . . . . . . . . . rr_2mu8 1
. 1 . 183 . 1 1 12 ASN C C 5.217 -2.157 0.872 . . . 1.0 . . . . . . . . . . . . A . 12 ASN C . . . . . . . . . rr_2mu8 1
. 1 . 184 . 1 1 12 ASN CA C 6.204 -1.739 -0.269 . . . 1.0 . . . . . . . . . . . . A . 12 ASN CA . . . . . . . . . rr_2mu8 1
. 1 . 185 . 1 1 12 ASN CB C 7.606 -1.297 0.260 . . . 1.0 . . . . . . . . . . . . A . 12 ASN CB . . . . . . . . . rr_2mu8 1
. 1 . 186 . 1 1 12 ASN CG C 8.726 -1.191 -0.792 . . . 1.0 . . . . . . . . . . . . A . 12 ASN CG . . . . . . . . . rr_2mu8 1
. 1 . 187 . 1 1 12 ASN H H 5.354 -1.072 -2.212 . . . 1.0 . . . . . . . . . . . . A . 12 ASN H . . . . . . . . . rr_2mu8 1
. 1 . 188 . 1 1 12 ASN HA H 6.355 -2.672 -0.841 . . . 1.0 . . . . . . . . . . . . A . 12 ASN HA . . . . . . . . . rr_2mu8 1
. 1 . 189 . 1 1 12 ASN HB2 H 7.521 -0.355 0.836 . . . 1.0 . . . . . . . . . . . . A . 12 ASN HB2 . . . . . . . . . rr_2mu8 1
. 1 . 190 . 1 1 12 ASN HB3 H 7.952 -2.034 1.010 . . . 1.0 . . . . . . . . . . . . A . 12 ASN HB3 . . . . . . . . . rr_2mu8 1
. 1 . 191 . 1 1 12 ASN HD21 H 8.225 0.704 -1.157 . . . 1.0 . . . . . . . . . . . . A . 12 ASN HD21 . . . . . . . . . rr_2mu8 1
. 1 . 192 . 1 1 12 ASN HD22 H 9.671 0.033 -2.066 . . . 1.0 . . . . . . . . . . . . A . 12 ASN HD22 . . . . . . . . . rr_2mu8 1
. 1 . 193 . 1 1 12 ASN N N 5.557 -0.801 -1.245 . . . 1.0 . . . . . . . . . . . . A . 12 ASN N . . . . . . . . . rr_2mu8 1
. 1 . 194 . 1 1 12 ASN ND2 N 8.936 -0.011 -1.351 . . . 1.0 . . . . . . . . . . . . A . 12 ASN ND2 . . . . . . . . . rr_2mu8 1
. 1 . 195 . 1 1 12 ASN O O 5.561 -2.201 2.057 . . . 1.0 . . . . . . . . . . . . A . 12 ASN O . . . . . . . . . rr_2mu8 1
. 1 . 196 . 1 1 12 ASN OD1 O 9.415 -2.164 -1.096 . . . 1.0 . . . . . . . . . . . . A . 12 ASN OD1 . . . . . . . . . rr_2mu8 1
. 1 . 197 . 1 1 13 ASN C C 2.915 -4.512 1.580 . . . 1.0 . . . . . . . . . . . . A . 13 ASN C . . . . . . . . . rr_2mu8 1
. 1 . 198 . 1 1 13 ASN CA C 2.901 -2.980 1.320 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CA . . . . . . . . . rr_2mu8 1
. 1 . 199 . 1 1 13 ASN CB C 1.580 -2.446 0.694 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CB . . . . . . . . . rr_2mu8 1
. 1 . 200 . 1 1 13 ASN CG C 0.331 -2.571 1.589 . . . 1.0 . . . . . . . . . . . . A . 13 ASN CG . . . . . . . . . rr_2mu8 1
. 1 . 201 . 1 1 13 ASN H H 3.812 -2.235 -0.490 . . . 1.0 . . . . . . . . . . . . A . 13 ASN H . . . . . . . . . rr_2mu8 1
. 1 . 202 . 1 1 13 ASN HA H 3.041 -2.411 2.236 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HA . . . . . . . . . rr_2mu8 1
. 1 . 203 . 1 1 13 ASN HB2 H 1.687 -1.368 0.462 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB2 . . . . . . . . . rr_2mu8 1
. 1 . 204 . 1 1 13 ASN HB3 H 1.408 -2.921 -0.292 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HB3 . . . . . . . . . rr_2mu8 1
. 1 . 205 . 1 1 13 ASN HD21 H -0.381 -4.049 0.437 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD21 . . . . . . . . . rr_2mu8 1
. 1 . 206 . 1 1 13 ASN HD22 H -1.396 -3.548 1.880 . . . 1.0 . . . . . . . . . . . . A . 13 ASN HD22 . . . . . . . . . rr_2mu8 1
. 1 . 207 . 1 1 13 ASN N N 4.000 -2.553 0.450 . . . 1.0 . . . . . . . . . . . . A . 13 ASN N . . . . . . . . . rr_2mu8 1
. 1 . 208 . 1 1 13 ASN ND2 N -0.584 -3.469 1.258 . . . 1.0 . . . . . . . . . . . . A . 13 ASN ND2 . . . . . . . . . rr_2mu8 1
. 1 . 209 . 1 1 13 ASN O O 2.345 -5.282 0.799 . . . 1.0 . . . . . . . . . . . . A . 13 ASN O . . . . . . . . . rr_2mu8 1
. 1 . 210 . 1 1 13 ASN OD1 O 0.180 -1.857 2.580 . . . 1.0 . . . . . . . . . . . . A . 13 ASN OD1 . . . . . . . . . rr_2mu8 1
. 1 . 211 . 1 1 14 ALA C C 4.493 -6.409 4.442 . . . 1.0 . . . . . . . . . . . . A . 14 ALA C . . . . . . . . . rr_2mu8 1
. 1 . 212 . 1 1 14 ALA CA C 3.682 -6.339 3.112 . . . 1.0 . . . . . . . . . . . . A . 14 ALA CA . . . . . . . . . rr_2mu8 1
. 1 . 213 . 1 1 14 ALA CB C 4.238 -7.325 2.050 . . . 1.0 . . . . . . . . . . . . A . 14 ALA CB . . . . . . . . . rr_2mu8 1
. 1 . 214 . 1 1 14 ALA H H 3.757 -4.202 3.363 . . . 1.0 . . . . . . . . . . . . A . 14 ALA H . . . . . . . . . rr_2mu8 1
. 1 . 215 . 1 1 14 ALA HA H 2.647 -6.625 3.347 . . . 1.0 . . . . . . . . . . . . A . 14 ALA HA . . . . . . . . . rr_2mu8 1
. 1 . 216 . 1 1 14 ALA HB1 H 5.244 -7.031 1.698 . . . 1.0 . . . . . . . . . . . . A . 14 ALA HB1 . . . . . . . . . rr_2mu8 1
. 1 . 217 . 1 1 14 ALA HB2 H 3.587 -7.400 1.160 . . . 1.0 . . . . . . . . . . . . A . 14 ALA HB2 . . . . . . . . . rr_2mu8 1
. 1 . 218 . 1 1 14 ALA HB3 H 4.320 -8.351 2.456 . . . 1.0 . . . . . . . . . . . . A . 14 ALA HB3 . . . . . . . . . rr_2mu8 1
. 1 . 219 . 1 1 14 ALA N N 3.593 -4.928 2.667 . . . 1.0 . . . . . . . . . . . . A . 14 ALA N . . . . . . . . . rr_2mu8 1
. 1 . 220 . 1 1 14 ALA O O 5.605 -6.947 4.485 . . . 1.0 . . . . . . . . . . . . A . 14 ALA O . . . . . . . . . rr_2mu8 1
. 1 . 221 . 1 1 15 TYR C C 5.957 -5.254 6.949 . . . 1.0 . . . . . . . . . . . . A . 15 TYR C . . . . . . . . . rr_2mu8 1
. 1 . 222 . 1 1 15 TYR CA C 4.514 -5.828 6.907 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CA . . . . . . . . . rr_2mu8 1
. 1 . 223 . 1 1 15 TYR CB C 4.211 -7.192 7.562 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CB . . . . . . . . . rr_2mu8 1
. 1 . 224 . 1 1 15 TYR CD1 C 3.331 -6.745 9.911 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD1 . . . . . . . . . rr_2mu8 1
. 1 . 225 . 1 1 15 TYR CD2 C 5.502 -7.778 9.685 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CD2 . . . . . . . . . rr_2mu8 1
. 1 . 226 . 1 1 15 TYR CE1 C 3.455 -6.788 11.298 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE1 . . . . . . . . . rr_2mu8 1
. 1 . 227 . 1 1 15 TYR CE2 C 5.625 -7.821 11.072 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CE2 . . . . . . . . . rr_2mu8 1
. 1 . 228 . 1 1 15 TYR CG C 4.355 -7.238 9.093 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CG . . . . . . . . . rr_2mu8 1
. 1 . 229 . 1 1 15 TYR CZ C 4.601 -7.327 11.879 . . . 1.0 . . . . . . . . . . . . A . 15 TYR CZ . . . . . . . . . rr_2mu8 1
. 1 . 230 . 1 1 15 TYR H H 3.046 -5.372 5.457 . . . 1.0 . . . . . . . . . . . . A . 15 TYR H . . . . . . . . . rr_2mu8 1
. 1 . 231 . 1 1 15 TYR HA H 3.892 -5.099 7.467 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HA . . . . . . . . . rr_2mu8 1
. 1 . 232 . 1 1 15 TYR HB2 H 3.154 -7.414 7.291 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB2 . . . . . . . . . rr_2mu8 1
. 1 . 233 . 1 1 15 TYR HB3 H 4.819 -7.981 7.077 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HB3 . . . . . . . . . rr_2mu8 1
. 1 . 234 . 1 1 15 TYR HD1 H 2.436 -6.322 9.475 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD1 . . . . . . . . . rr_2mu8 1
. 1 . 235 . 1 1 15 TYR HD2 H 6.305 -8.165 9.073 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HD2 . . . . . . . . . rr_2mu8 1
. 1 . 236 . 1 1 15 TYR HE1 H 2.659 -6.403 11.920 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE1 . . . . . . . . . rr_2mu8 1
. 1 . 237 . 1 1 15 TYR HE2 H 6.515 -8.239 11.520 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HE2 . . . . . . . . . rr_2mu8 1
. 1 . 238 . 1 1 15 TYR HH H 3.926 -7.004 13.640 . . . 1.0 . . . . . . . . . . . . A . 15 TYR HH . . . . . . . . . rr_2mu8 1
. 1 . 239 . 1 1 15 TYR N N 3.924 -5.864 5.547 . . . 1.0 . . . . . . . . . . . . A . 15 TYR N . . . . . . . . . rr_2mu8 1
. 1 . 240 . 1 1 15 TYR O O 6.927 -5.906 7.346 . . . 1.0 . . . . . . . . . . . . A . 15 TYR O . . . . . . . . . rr_2mu8 1
. 1 . 241 . 1 1 15 TYR OH O 4.720 -7.372 13.245 . . . 1.0 . . . . . . . . . . . . A . 15 TYR OH . . . . . . . . . rr_2mu8 1
. 1 . 242 . 1 1 16 ASN C C 7.392 -2.105 7.535 . . . 1.0 . . . . . . . . . . . . A . 16 ASN C . . . . . . . . . rr_2mu8 1
. 1 . 243 . 1 1 16 ASN CA C 7.261 -3.184 6.415 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CA . . . . . . . . . rr_2mu8 1
. 1 . 244 . 1 1 16 ASN CB C 7.321 -2.638 4.960 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CB . . . . . . . . . rr_2mu8 1
. 1 . 245 . 1 1 16 ASN CG C 8.742 -2.325 4.462 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CG . . . . . . . . . rr_2mu8 1
. 1 . 246 . 1 1 16 ASN H H 5.093 -3.659 6.206 . . . 1.0 . . . . . . . . . . . . A . 16 ASN H . . . . . . . . . rr_2mu8 1
. 1 . 247 . 1 1 16 ASN HA H 8.123 -3.855 6.577 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HA . . . . . . . . . rr_2mu8 1
. 1 . 248 . 1 1 16 ASN HB2 H 6.831 -3.346 4.261 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB2 . . . . . . . . . rr_2mu8 1
. 1 . 249 . 1 1 16 ASN HB3 H 6.705 -1.726 4.872 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB3 . . . . . . . . . rr_2mu8 1
. 1 . 250 . 1 1 16 ASN HD21 H 9.135 -4.284 4.308 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD21 . . . . . . . . . rr_2mu8 1
. 1 . 251 . 1 1 16 ASN HD22 H 10.519 -3.124 4.038 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD22 . . . . . . . . . rr_2mu8 1
. 1 . 252 . 1 1 16 ASN N N 6.014 -3.993 6.497 . . . 1.0 . . . . . . . . . . . . A . 16 ASN N . . . . . . . . . rr_2mu8 1
. 1 . 253 . 1 1 16 ASN ND2 N 9.529 -3.348 4.161 . . . 1.0 . . . . . . . . . . . . A . 16 ASN ND2 . . . . . . . . . rr_2mu8 1
. 1 . 254 . 1 1 16 ASN O O 7.814 -0.964 7.325 . . . 1.0 . . . . . . . . . . . . A . 16 ASN O . . . . . . . . . rr_2mu8 1
. 1 . 255 . 1 1 16 ASN OD1 O 9.149 -1.167 4.369 . . . 1.0 . . . . . . . . . . . . A . 16 ASN OD1 . . . . . . . . . rr_2mu8 1
. 1 . 256 . 1 1 17 MET C C 6.216 -0.553 10.032 . . . 1.0 . . . . . . . . . . . . A . 17 MET C . . . . . . . . . rr_2mu8 1
. 1 . 257 . 1 1 17 MET CA C 7.111 -1.828 10.037 . . . 1.0 . . . . . . . . . . . . A . 17 MET CA . . . . . . . . . rr_2mu8 1
. 1 . 258 . 1 1 17 MET CB C 8.598 -1.655 10.451 . . . 1.0 . . . . . . . . . . . . A . 17 MET CB . . . . . . . . . rr_2mu8 1
. 1 . 259 . 1 1 17 MET CE C 8.444 -1.012 14.577 . . . 1.0 . . . . . . . . . . . . A . 17 MET CE . . . . . . . . . rr_2mu8 1
. 1 . 260 . 1 1 17 MET CG C 8.859 -1.024 11.829 . . . 1.0 . . . . . . . . . . . . A . 17 MET CG . . . . . . . . . rr_2mu8 1
. 1 . 261 . 1 1 17 MET H H 6.456 -3.376 8.574 . . . 1.0 . . . . . . . . . . . . A . 17 MET H . . . . . . . . . rr_2mu8 1
. 1 . 262 . 1 1 17 MET HA H 6.667 -2.508 10.791 . . . 1.0 . . . . . . . . . . . . A . 17 MET HA . . . . . . . . . rr_2mu8 1
. 1 . 263 . 1 1 17 MET HB2 H 9.111 -2.638 10.435 . . . 1.0 . . . . . . . . . . . . A . 17 MET HB2 . . . . . . . . . rr_2mu8 1
. 1 . 264 . 1 1 17 MET HB3 H 9.092 -1.075 9.657 . . . 1.0 . . . . . . . . . . . . A . 17 MET HB3 . . . . . . . . . rr_2mu8 1
. 1 . 265 . 1 1 17 MET HE1 H 8.024 -1.482 15.485 . . . 1.0 . . . . . . . . . . . . A . 17 MET HE1 . . . . . . . . . rr_2mu8 1
. 1 . 266 . 1 1 17 MET HE2 H 8.014 0.002 14.486 . . . 1.0 . . . . . . . . . . . . A . 17 MET HE2 . . . . . . . . . rr_2mu8 1
. 1 . 267 . 1 1 17 MET HE3 H 9.536 -0.916 14.715 . . . 1.0 . . . . . . . . . . . . A . 17 MET HE3 . . . . . . . . . rr_2mu8 1
. 1 . 268 . 1 1 17 MET HG2 H 9.946 -0.975 12.024 . . . 1.0 . . . . . . . . . . . . A . 17 MET HG2 . . . . . . . . . rr_2mu8 1
. 1 . 269 . 1 1 17 MET HG3 H 8.488 0.016 11.869 . . . 1.0 . . . . . . . . . . . . A . 17 MET HG3 . . . . . . . . . rr_2mu8 1
. 1 . 270 . 1 1 17 MET N N 7.060 -2.571 8.749 . . . 1.0 . . . . . . . . . . . . A . 17 MET N . . . . . . . . . rr_2mu8 1
. 1 . 271 . 1 1 17 MET O O 6.703 0.582 10.067 . . . 1.0 . . . . . . . . . . . . A . 17 MET O . . . . . . . . . rr_2mu8 1
. 1 . 272 . 1 1 17 MET SD S 8.064 -2.005 13.120 . . . 1.0 . . . . . . . . . . . . A . 17 MET SD . . . . . . . . . rr_2mu8 1
. 1 . 273 . 1 1 18 SER C C 3.919 1.134 8.658 . . . 1.0 . . . . . . . . . . . . A . 18 SER C . . . . . . . . . rr_2mu8 1
. 1 . 274 . 1 1 18 SER CA C 3.839 0.280 9.958 . . . 1.0 . . . . . . . . . . . . A . 18 SER CA . . . . . . . . . rr_2mu8 1
. 1 . 275 . 1 1 18 SER CB C 3.790 1.122 11.261 . . . 1.0 . . . . . . . . . . . . A . 18 SER CB . . . . . . . . . rr_2mu8 1
. 1 . 276 . 1 1 18 SER H H 4.716 -1.741 9.611 . . . 1.0 . . . . . . . . . . . . A . 18 SER H . . . . . . . . . rr_2mu8 1
. 1 . 277 . 1 1 18 SER HA H 2.851 -0.226 9.928 . . . 1.0 . . . . . . . . . . . . A . 18 SER HA . . . . . . . . . rr_2mu8 1
. 1 . 278 . 1 1 18 SER HB2 H 4.747 1.645 11.446 . . . 1.0 . . . . . . . . . . . . A . 18 SER HB2 . . . . . . . . . rr_2mu8 1
. 1 . 279 . 1 1 18 SER HB3 H 3.025 1.916 11.178 . . . 1.0 . . . . . . . . . . . . A . 18 SER HB3 . . . . . . . . . rr_2mu8 1
. 1 . 280 . 1 1 18 SER HG H 3.467 0.893 13.143 . . . 1.0 . . . . . . . . . . . . A . 18 SER HG . . . . . . . . . rr_2mu8 1
. 1 . 281 . 1 1 18 SER N N 4.888 -0.792 9.977 . . . 1.0 . . . . . . . . . . . . A . 18 SER N . . . . . . . . . rr_2mu8 1
. 1 . 282 . 1 1 18 SER O O 4.214 2.334 8.684 . . . 1.0 . . . . . . . . . . . . A . 18 SER O . . . . . . . . . rr_2mu8 1
. 1 . 283 . 1 1 18 SER OG O 3.469 0.308 12.382 . . . 1.0 . . . . . . . . . . . . A . 18 SER OG . . . . . . . . . rr_2mu8 1
. 1 . 284 . 1 1 19 ILE C C 2.227 1.630 5.838 . . . 1.0 . . . . . . . . . . . . A . 19 ILE C . . . . . . . . . rr_2mu8 1
. 1 . 285 . 1 1 19 ILE CA C 3.657 1.100 6.171 . . . 1.0 . . . . . . . . . . . . A . 19 ILE CA . . . . . . . . . rr_2mu8 1
. 1 . 286 . 1 1 19 ILE CB C 4.316 0.122 5.130 . . . 1.0 . . . . . . . . . . . . A . 19 ILE CB . . . . . . . . . rr_2mu8 1
. 1 . 287 . 1 1 19 ILE CD1 C 5.599 1.915 3.710 . . . 1.0 . . . . . . . . . . . . A . 19 ILE CD1 . . . . . . . . . rr_2mu8 1
. 1 . 288 . 1 1 19 ILE CG1 C 4.580 0.767 3.739 . . . 1.0 . . . . . . . . . . . . A . 19 ILE CG1 . . . . . . . . . rr_2mu8 1
. 1 . 289 . 1 1 19 ILE CG2 C 3.581 -1.232 4.930 . . . 1.0 . . . . . . . . . . . . A . 19 ILE CG2 . . . . . . . . . rr_2mu8 1
. 1 . 290 . 1 1 19 ILE H H 3.538 -0.544 7.662 . . . 1.0 . . . . . . . . . . . . A . 19 ILE H . . . . . . . . . rr_2mu8 1
. 1 . 291 . 1 1 19 ILE HA H 4.349 1.966 6.215 . . . 1.0 . . . . . . . . . . . . A . 19 ILE HA . . . . . . . . . rr_2mu8 1
. 1 . 292 . 1 1 19 ILE HB H 5.310 -0.136 5.543 . . . 1.0 . . . . . . . . . . . . A . 19 ILE HB . . . . . . . . . rr_2mu8 1
. 1 . 293 . 1 1 19 ILE HD11 H 5.249 2.795 4.280 . . . 1.0 . . . . . . . . . . . . A . 19 ILE HD11 . . . . . . . . . rr_2mu8 1
. 1 . 294 . 1 1 19 ILE HD12 H 6.574 1.606 4.131 . . . 1.0 . . . . . . . . . . . . A . 19 ILE HD12 . . . . . . . . . rr_2mu8 1
. 1 . 295 . 1 1 19 ILE HD13 H 5.782 2.253 2.674 . . . 1.0 . . . . . . . . . . . . A . 19 ILE HD13 . . . . . . . . . rr_2mu8 1
. 1 . 296 . 1 1 19 ILE HG12 H 4.948 0.001 3.036 . . . 1.0 . . . . . . . . . . . . A . 19 ILE HG12 . . . . . . . . . rr_2mu8 1
. 1 . 297 . 1 1 19 ILE HG13 H 3.629 1.118 3.305 . . . 1.0 . . . . . . . . . . . . A . 19 ILE HG13 . . . . . . . . . rr_2mu8 1
. 1 . 298 . 1 1 19 ILE HG21 H 4.178 -1.933 4.320 . . . 1.0 . . . . . . . . . . . . A . 19 ILE HG21 . . . . . . . . . rr_2mu8 1
. 1 . 299 . 1 1 19 ILE HG22 H 3.392 -1.747 5.889 . . . 1.0 . . . . . . . . . . . . A . 19 ILE HG22 . . . . . . . . . rr_2mu8 1
. 1 . 300 . 1 1 19 ILE HG23 H 2.605 -1.113 4.424 . . . 1.0 . . . . . . . . . . . . A . 19 ILE HG23 . . . . . . . . . rr_2mu8 1
. 1 . 301 . 1 1 19 ILE N N 3.636 0.470 7.522 . . . 1.0 . . . . . . . . . . . . A . 19 ILE N . . . . . . . . . rr_2mu8 1
. 1 . 302 . 1 1 19 ILE O O 1.334 0.866 5.457 . . . 1.0 . . . . . . . . . . . . A . 19 ILE O . . . . . . . . . rr_2mu8 1
. 1 . 303 . 1 1 20 ARG C C 0.897 4.697 4.632 . . . 1.0 . . . . . . . . . . . . A . 20 ARG C . . . . . . . . . rr_2mu8 1
. 1 . 304 . 1 1 20 ARG CA C 0.739 3.641 5.759 . . . 1.0 . . . . . . . . . . . . A . 20 ARG CA . . . . . . . . . rr_2mu8 1
. 1 . 305 . 1 1 20 ARG CB C 0.215 4.351 7.039 . . . 1.0 . . . . . . . . . . . . A . 20 ARG CB . . . . . . . . . rr_2mu8 1
. 1 . 306 . 1 1 20 ARG CD C 0.618 2.686 9.031 . . . 1.0 . . . . . . . . . . . . A . 20 ARG CD . . . . . . . . . rr_2mu8 1
. 1 . 307 . 1 1 20 ARG CG C -0.390 3.480 8.169 . . . 1.0 . . . . . . . . . . . . A . 20 ARG CG . . . . . . . . . rr_2mu8 1
. 1 . 308 . 1 1 20 ARG CZ C -0.037 2.687 11.460 . . . 1.0 . . . . . . . . . . . . A . 20 ARG CZ . . . . . . . . . rr_2mu8 1
. 1 . 309 . 1 1 20 ARG H H 2.860 3.464 6.343 . . . 1.0 . . . . . . . . . . . . A . 20 ARG H . . . . . . . . . rr_2mu8 1
. 1 . 310 . 1 1 20 ARG HA H -0.033 2.911 5.439 . . . 1.0 . . . . . . . . . . . . A . 20 ARG HA . . . . . . . . . rr_2mu8 1
. 1 . 311 . 1 1 20 ARG HB2 H 0.993 5.018 7.458 . . . 1.0 . . . . . . . . . . . . A . 20 ARG HB2 . . . . . . . . . rr_2mu8 1
. 1 . 312 . 1 1 20 ARG HB3 H -0.593 5.043 6.731 . . . 1.0 . . . . . . . . . . . . A . 20 ARG HB3 . . . . . . . . . rr_2mu8 1
. 1 . 313 . 1 1 20 ARG HD2 H 1.029 1.854 8.434 . . . 1.0 . . . . . . . . . . . . A . 20 ARG HD2 . . . . . . . . . rr_2mu8 1
. 1 . 314 . 1 1 20 ARG HD3 H 1.492 3.313 9.291 . . . 1.0 . . . . . . . . . . . . A . 20 ARG HD3 . . . . . . . . . rr_2mu8 1
. 1 . 315 . 1 1 20 ARG HG2 H -0.957 4.162 8.833 . . . 1.0 . . . . . . . . . . . . A . 20 ARG HG2 . . . . . . . . . rr_2mu8 1
. 1 . 316 . 1 1 20 ARG HG3 H -1.150 2.795 7.749 . . . 1.0 . . . . . . . . . . . . A . 20 ARG HG3 . . . . . . . . . rr_2mu8 1
. 1 . 317 . 1 1 20 ARG HH11 H 0.908 4.383 10.934 . . . 1.0 . . . . . . . . . . . . A . 20 ARG HH11 . . . . . . . . . rr_2mu8 1
. 1 . 318 . 1 1 20 ARG HH12 H 0.374 4.232 12.683 . . . 1.0 . . . . . . . . . . . . A . 20 ARG HH12 . . . . . . . . . rr_2mu8 1
. 1 . 319 . 1 1 20 ARG HH21 H -0.997 1.106 12.229 . . . 1.0 . . . . . . . . . . . . A . 20 ARG HH21 . . . . . . . . . rr_2mu8 1
. 1 . 320 . 1 1 20 ARG HH22 H -0.631 2.502 13.362 . . . 1.0 . . . . . . . . . . . . A . 20 ARG HH22 . . . . . . . . . rr_2mu8 1
. 1 . 321 . 1 1 20 ARG N N 2.033 2.950 6.020 . . . 1.0 . . . . . . . . . . . . A . 20 ARG N . . . . . . . . . rr_2mu8 1
. 1 . 322 . 1 1 20 ARG NE N 0.000 2.098 10.246 . . . 1.0 . . . . . . . . . . . . A . 20 ARG NE . . . . . . . . . rr_2mu8 1
. 1 . 323 . 1 1 20 ARG NH1 N 0.469 3.891 11.719 . . . 1.0 . . . . . . . . . . . . A . 20 ARG NH1 . . . . . . . . . rr_2mu8 1
. 1 . 324 . 1 1 20 ARG NH2 N -0.613 2.031 12.451 . . . 1.0 . . . . . . . . . . . . A . 20 ARG NH2 . . . . . . . . . rr_2mu8 1
. 1 . 325 . 1 1 20 ARG O O 1.978 5.189 4.300 . . . 1.0 . . . . . . . . . . . . A . 20 ARG O . . . . . . . . . rr_2mu8 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_2mu8
_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 2mu8.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_2mu8 1
1 2mu8.mr . . DISCOVER 2 stereochemistry prochirality "Not applicable" 0 rr_2mu8 1
1 2mu8.mr . . DISCOVER 3 distance "hydrogen bond" simple 2 rr_2mu8 1
1 2mu8.mr . . DISCOVER 4 distance NOE simple 184 rr_2mu8 1
1 2mu8.mr . . "MR format" 5 comment "Not applicable" "Not applicable" 0 rr_2mu8 1
1 2mu8.mr . . DISCOVER 6 "dihedral angle" "Not applicable" "Not applicable" 19 rr_2mu8 1
1 2mu8.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_2mu8 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_2mu8
_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: '2mu8'" . . . . distance "general distance" . 177 rr_2mu8 1
2 "From CCPN project: '2mu8'" . . . . distance "hydrogen bond" . 2 rr_2mu8 1
3 "From CCPN project: '2mu8'" . . . . "dihedral angle" "Not applicable" . 19 rr_2mu8 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 2mu8.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_2mu8 1
1 2mu8.mr . . DISCOVER 2 stereochemistry prochirality "Not applicable" 0 rr_2mu8 1
1 2mu8.mr . . DISCOVER 3 distance "hydrogen bond" simple 2 rr_2mu8 1
1 2mu8.mr . . DISCOVER 4 distance NOE simple 184 rr_2mu8 1
1 2mu8.mr . . "MR format" 5 comment "Not applicable" "Not applicable" 0 rr_2mu8 1
1 2mu8.mr . . DISCOVER 6 "dihedral angle" "Not applicable" "Not applicable" 19 rr_2mu8 1
1 2mu8.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_2mu8 1
stop_
save_
save_Discover_distance_constraints_4
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode Discover_distance_constraints_4
_Gen_dist_constraint_list.Entry_ID rr_2mu8
_Gen_dist_constraint_list.ID 2
_Gen_dist_constraint_list.Constraint_type NOE
_Gen_dist_constraint_list.Details "Generated by Wattos"
_Gen_dist_constraint_list.Constraint_file_ID 1
_Gen_dist_constraint_list.Block_ID 4
loop_
_Gen_dist_constraint_software.Software_ID
_Gen_dist_constraint_software.Software_label
_Gen_dist_constraint_software.Method_ID
_Gen_dist_constraint_software.Method_label
_Gen_dist_constraint_software.Entry_ID
_Gen_dist_constraint_software.Gen_dist_constraint_list_ID
. . . . rr_2mu8 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 ASN H H . . . 1 1 2 2 ASN HA H . . . . . 3.5 1.8 2.8 . . . . . A . 2 ASN H . . A . 2 ASN HA . 1 . 2 ASN HN . . . 1 . 2 ASN HA . . rr_2mu8 1
2 1 . . 1 1 3 3 GLU H H . . . 1 1 3 3 GLU HA H . . . . . 3.5 2.8 3.5 . . . . . A . 3 GLU H . . A . 3 GLU HA . 1 . 3 GLU HN . . . 1 . 3 GLU HA . . rr_2mu8 1
3 1 . . 1 1 4 4 SER H H . . . 1 1 4 4 SER HA H . . . . . 3.5 2.8 3.5 . . . . . A . 4 SER H . . A . 4 SER HA . 1 . 4 SER HN . . . 1 . 4 SER HA . . rr_2mu8 1
4 1 . . 1 1 5 5 LYS H H . . . 1 1 5 5 LYS HA H . . . . . 3.5 2.8 3.5 . . . . . A . 5 LYS H . . A . 5 LYS HA . 1 . 5 LYS HN . . . 1 . 5 LYS HA . . rr_2mu8 1
5 1 . . 1 1 18 18 SER H H . . . 1 1 17 17 MET HB2 H . . . . . 5.0 3.5 5.0 . . . . . A . 18 SER H . . A . 17 MET HB2 . 1 . 18 SER HN . . . 1 . 17 MET HBS . . rr_2mu8 1
6 1 . . 1 1 18 18 SER H H . . . 1 1 17 17 MET HB3 H . . . . . 5.0 3.5 5.0 . . . . . A . 18 SER H . . A . 17 MET HB3 . 1 . 18 SER HN . . . 1 . 17 MET HBR . . rr_2mu8 1
7 1 . . 1 1 2 2 ASN H H . . . 1 1 2 2 ASN HB3 H . . . . . 3.5 2.8 3.5 . . . . . A . 2 ASN H . . A . 2 ASN HB3 . 1 . 2 ASN HN . . . 1 . 2 ASN HBR . . rr_2mu8 1
8 1 . . 1 1 2 2 ASN H H . . . 1 1 2 2 ASN HB2 H . . . . . 3.5 2.8 3.5 . . . . . A . 2 ASN H . . A . 2 ASN HB2 . 1 . 2 ASN HN . . . 1 . 2 ASN HBS . . rr_2mu8 1
9 1 OR . 1 1 4 4 SER H H . . . 1 1 4 4 SER HB2 H . . . . . 2.5 1.8 3.5 . . . . . A . 4 SER H . . A . 4 SER HB2 . 1 . 4 SER HN . . . 1 . 4 SER HB* . . rr_2mu8 1
9 2 OR . 1 1 4 4 SER H H . . . 1 1 4 4 SER HB3 H . . . . . 2.5 1.8 3.5 . . . . . A . 4 SER H . . A . 4 SER HB3 . 1 . 4 SER HN . . . 1 . 4 SER HB* . . rr_2mu8 1
10 1 . . 1 1 5 5 LYS H H . . . 1 1 5 5 LYS HB3 H . . . . . 3.5 2.8 3.5 . . . . . A . 5 LYS H . . A . 5 LYS HB3 . 1 . 5 LYS HN . . . 1 . 5 LYS HBS . . rr_2mu8 1
11 1 . . 1 1 5 5 LYS H H . . . 1 1 5 5 LYS HB2 H . . . . . 3.5 2.8 3.5 . . . . . A . 5 LYS H . . A . 5 LYS HB2 . 1 . 5 LYS HN . . . 1 . 5 LYS HBR . . rr_2mu8 1
12 1 . . 1 1 6 6 TYR H H . . . 1 1 6 6 TYR HA H . . . . . 3.5 2.8 3.5 . . . . . A . 6 TYR H . . A . 6 TYR HA . 1 . 6 TYR HN . . . 1 . 6 TYR HA . . rr_2mu8 1
13 1 OR . 1 1 6 6 TYR H H . . . 1 1 6 6 TYR HB2 H . . . . . 3.5 2.5 4.5 . . . . . A . 6 TYR H . . A . 6 TYR HB2 . 1 . 6 TYR HN . . . 1 . 6 TYR HB* . . rr_2mu8 1
13 2 OR . 1 1 6 6 TYR H H . . . 1 1 6 6 TYR HB3 H . . . . . 3.5 2.5 4.5 . . . . . A . 6 TYR H . . A . 6 TYR HB3 . 1 . 6 TYR HN . . . 1 . 6 TYR HB* . . rr_2mu8 1
14 1 OR . 1 1 6 6 TYR H H . . . 1 1 4 4 SER HB2 H . . . . . 3.5 2.5 4.5 . . . . . A . 6 TYR H . . A . 4 SER HB2 . 1 . 6 TYR HN . . . 1 . 4 SER HB* . . rr_2mu8 1
14 2 OR . 1 1 4 4 SER HB3 H . . . 1 1 6 6 TYR H H . . . . . 3.5 2.5 4.5 . . . . . A . 4 SER HB3 . . A . 6 TYR H . 1 . 4 SER HB* . . . 1 . 6 TYR HN . . rr_2mu8 1
15 1 . . 1 1 7 7 SER H H . . . 1 1 7 7 SER HA H . . . . . 2.5 1.8 2.8 . . . . . A . 7 SER H . . A . 7 SER HA . 1 . 7 SER HN . . . 1 . 7 SER HA . . rr_2mu8 1
16 1 . . 1 1 6 6 TYR HA H . . . 1 1 7 7 SER H H . . . . . 2.5 1.8 2.8 . . . . . A . 6 TYR HA . . A . 7 SER H . 1 . 6 TYR HA . . . 1 . 7 SER HN . . rr_2mu8 1
17 1 . . 1 1 8 8 ASN H H . . . 1 1 8 8 ASN HA H . . . . . 2.5 1.8 2.8 . . . . . A . 8 ASN H . . A . 8 ASN HA . 1 . 8 ASN HN . . . 1 . 8 ASN HA . . rr_2mu8 1
18 1 . . 1 1 9 9 THR H H . . . 1 1 9 9 THR HB H . . . . . 3.5 2.8 3.5 . . . . . A . 9 THR H . . A . 9 THR HB . 1 . 9 THR HN . . . 1 . 9 THR HB . . rr_2mu8 1
19 1 . . 1 1 9 9 THR H H . . . 1 1 9 9 THR HA H . . . . . 3.5 2.8 3.5 . . . . . A . 9 THR H . . A . 9 THR HA . 1 . 9 THR HN . . . 1 . 9 THR HA . . rr_2mu8 1
20 1 . . 1 1 10 10 PHE H H . . . 1 1 10 10 PHE HA H . . . . . 2.5 1.8 2.8 . . . . . A . 10 PHE H . . A . 10 PHE HA . 1 . 10 PHE HN . . . 1 . 10 PHE HA . . rr_2mu8 1
21 1 . . 1 1 11 11 ILE H H . . . 1 1 10 10 PHE HB3 H . . . . . 3.5 2.8 3.5 . . . . . A . 11 ILE H . . A . 10 PHE HB3 . 1 . 11 ILE HN . . . 1 . 10 PHE HBS . . rr_2mu8 1
22 1 . . 1 1 11 11 ILE H H . . . 1 1 10 10 PHE HB2 H . . . . . 3.5 2.8 3.5 . . . . . A . 11 ILE H . . A . 10 PHE HB2 . 1 . 11 ILE HN . . . 1 . 10 PHE HBR . . rr_2mu8 1
23 1 . . 1 1 11 11 ILE H H . . . 1 1 11 11 ILE HA H . . . . . 3.5 2.8 3.5 . . . . . A . 11 ILE H . . A . 11 ILE HA . 1 . 11 ILE HN . . . 1 . 11 ILE HA . . rr_2mu8 1
24 1 . . 1 1 12 12 ASN H H . . . 1 1 12 12 ASN HA H . . . . . 2.5 1.8 2.8 . . . . . A . 12 ASN H . . A . 12 ASN HA . 1 . 12 ASN HN . . . 1 . 12 ASN HA . . rr_2mu8 1
25 1 . . 1 1 13 13 ASN H H . . . 1 1 13 13 ASN HA H . . . . . 2.5 1.8 2.8 . . . . . A . 13 ASN H . . A . 13 ASN HA . 1 . 13 ASN HN . . . 1 . 13 ASN HA . . rr_2mu8 1
26 1 . . 1 1 15 15 TYR H H . . . 1 1 15 15 TYR HA H . . . . . 2.5 1.8 2.8 . . . . . A . 15 TYR H . . A . 15 TYR HA . 1 . 15 TYR HN . . . 1 . 15 TYR HA . . rr_2mu8 1
27 1 . . 1 1 14 14 ALA H H . . . 1 1 14 14 ALA HA H . . . . . 2.5 1.8 2.8 . . . . . A . 14 ALA H . . A . 14 ALA HA . 1 . 14 ALA HN . . . 1 . 14 ALA HA . . rr_2mu8 1
28 1 . . 1 1 15 15 TYR H H . . . 1 1 15 15 TYR HB2 H . . . . . 2.5 1.8 2.8 . . . . . A . 15 TYR H . . A . 15 TYR HB2 . 1 . 15 TYR HN . . . 1 . 15 TYR HBR . . rr_2mu8 1
29 1 . . 1 1 15 15 TYR H H . . . 1 1 15 15 TYR HB3 H . . . . . 3.5 2.8 3.5 . . . . . A . 15 TYR H . . A . 15 TYR HB3 . 1 . 15 TYR HN . . . 1 . 15 TYR HBS . . rr_2mu8 1
30 1 . . 1 1 17 17 MET H H . . . 1 1 17 17 MET HA H . . . . . 3.5 2.8 3.5 . . . . . A . 17 MET H . . A . 17 MET HA . 1 . 17 MET HN . . . 1 . 17 MET HA . . rr_2mu8 1
31 1 . . 1 1 18 18 SER H H . . . 1 1 18 18 SER HA H . . . . . 3.5 2.8 3.5 . . . . . A . 18 SER H . . A . 18 SER HA . 1 . 18 SER HN . . . 1 . 18 SER HA . . rr_2mu8 1
32 1 OR . 1 1 18 18 SER H H . . . 1 1 18 18 SER HB2 H . . . . . 2.5 1.8 3.5 . . . . . A . 18 SER H . . A . 18 SER HB2 . 1 . 18 SER HN . . . 1 . 18 SER HB* . . rr_2mu8 1
32 2 OR . 1 1 18 18 SER H H . . . 1 1 18 18 SER HB3 H . . . . . 2.5 1.8 3.5 . . . . . A . 18 SER H . . A . 18 SER HB3 . 1 . 18 SER HN . . . 1 . 18 SER HB* . . rr_2mu8 1
33 1 . . 1 1 19 19 ILE H H . . . 1 1 19 19 ILE HA H . . . . . 3.5 2.8 3.5 . . . . . A . 19 ILE H . . A . 19 ILE HA . 1 . 19 ILE HN . . . 1 . 19 ILE HA . . rr_2mu8 1
34 1 OR . 1 1 19 19 ILE H H . . . 1 1 18 18 SER HB2 H . . . . . 3.5 2.5 4.5 . . . . . A . 19 ILE H . . A . 18 SER HB2 . 1 . 19 ILE HN . . . 1 . 18 SER HB* . . rr_2mu8 1
34 2 OR . 1 1 18 18 SER HB3 H . . . 1 1 19 19 ILE H H . . . . . 3.5 2.5 4.5 . . . . . A . 18 SER HB3 . . A . 19 ILE H . 1 . 18 SER HB* . . . 1 . 19 ILE HN . . rr_2mu8 1
35 1 . . 1 1 1 1 LYS HA H . . . 1 1 2 2 ASN H H . . . . . 2.5 1.8 2.8 . . . . . A . 1 LYS HA . . A . 2 ASN H . 1 . 1 LYS HA . . . 1 . 2 ASN HN . . rr_2mu8 1
36 1 . . 1 1 2 2 ASN HA H . . . 1 1 3 3 GLU H H . . . . . 2.5 1.8 2.8 . . . . . A . 2 ASN HA . . A . 3 GLU H . 1 . 2 ASN HA . . . 1 . 3 GLU HN . . rr_2mu8 1
37 1 . . 1 1 4 4 SER HA H . . . 1 1 5 5 LYS H H . . . . . 2.5 1.8 2.8 . . . . . A . 4 SER HA . . A . 5 LYS H . 1 . 4 SER HA . . . 1 . 5 LYS HN . . rr_2mu8 1
38 1 . . 1 1 5 5 LYS HA H . . . 1 1 6 6 TYR H H . . . . . 2.5 1.8 2.8 . . . . . A . 5 LYS HA . . A . 6 TYR H . 1 . 5 LYS HA . . . 1 . 6 TYR HN . . rr_2mu8 1
39 1 . . 1 1 7 7 SER HA H . . . 1 1 8 8 ASN H H . . . . . 2.5 1.8 2.8 . . . . . A . 7 SER HA . . A . 8 ASN H . 1 . 7 SER HA . . . 1 . 8 ASN HN . . rr_2mu8 1
40 1 . . 1 1 8 8 ASN HA H . . . 1 1 9 9 THR H H . . . . . 2.5 1.8 2.8 . . . . . A . 8 ASN HA . . A . 9 THR H . 1 . 8 ASN HA . . . 1 . 9 THR HN . . rr_2mu8 1
41 1 . . 1 1 9 9 THR HB H . . . 1 1 10 10 PHE H H . . . . . 3.5 2.8 3.5 . . . . . A . 9 THR HB . . A . 10 PHE H . 1 . 9 THR HB . . . 1 . 10 PHE HN . . rr_2mu8 1
42 1 . . 1 1 9 9 THR HA H . . . 1 1 10 10 PHE H H . . . . . 2.5 1.8 2.8 . . . . . A . 9 THR HA . . A . 10 PHE H . 1 . 9 THR HA . . . 1 . 10 PHE HN . . rr_2mu8 1
43 1 . . 1 1 10 10 PHE HA H . . . 1 1 11 11 ILE H H . . . . . 2.5 1.8 2.8 . . . . . A . 10 PHE HA . . A . 11 ILE H . 1 . 10 PHE HA . . . 1 . 11 ILE HN . . rr_2mu8 1
44 1 . . 1 1 11 11 ILE HA H . . . 1 1 12 12 ASN H H . . . . . 2.5 1.8 2.8 . . . . . A . 11 ILE HA . . A . 12 ASN H . 1 . 11 ILE HA . . . 1 . 12 ASN HN . . rr_2mu8 1
45 1 . . 1 1 15 15 TYR H H . . . 1 1 14 14 ALA HA H . . . . . 2.5 1.8 2.8 . . . . . A . 15 TYR H . . A . 14 ALA HA . 1 . 15 TYR HN . . . 1 . 14 ALA HA . . rr_2mu8 1
46 1 . . 1 1 18 18 SER HA H . . . 1 1 19 19 ILE H H . . . . . 2.5 1.8 2.8 . . . . . A . 18 SER HA . . A . 19 ILE H . 1 . 18 SER HA . . . 1 . 19 ILE HN . . rr_2mu8 1
47 1 . . 1 1 7 7 SER HA H . . . 1 1 9 9 THR H H . . . . . 5.0 3.5 5.0 . . . . . A . 7 SER HA . . A . 9 THR H . 1 . 7 SER HA . . . 1 . 9 THR HN . . rr_2mu8 1
48 1 . . 1 1 13 13 ASN HA H . . . 1 1 13 13 ASN HD21 H . . . . . 5.0 3.5 5.0 . . . . . A . 13 ASN HA . . A . 13 ASN HD21 . 1 . 13 ASN HA . . . 1 . 13 ASN HD21 . . rr_2mu8 1
49 1 . . 1 1 8 8 ASN HA H . . . 1 1 8 8 ASN HD21 H . . . . . 5.0 3.5 5.0 . . . . . A . 8 ASN HA . . A . 8 ASN HD21 . 1 . 8 ASN HA . . . 1 . 8 ASN HD21 . . rr_2mu8 1
50 1 . . 1 1 10 10 PHE HA H . . . 1 1 10 10 PHE QD H . . . . . 2.5 1.8 4.5 . . . . . A . 10 PHE HA . . A . 10 PHE QD . 1 . 10 PHE HA . . . 1 . 10 PHE HD* . . rr_2mu8 1
51 1 . . 1 1 6 6 TYR HA H . . . 1 1 6 6 TYR QD H . . . . . 2.5 1.8 4.5 . . . . . A . 6 TYR HA . . A . 6 TYR QD . 1 . 6 TYR HA . . . 1 . 6 TYR HD* . . rr_2mu8 1
52 1 . . 1 1 16 16 ASN HD22 H . . . 1 1 16 16 ASN HA H . . . . . 3.5 2.8 3.5 . . . . . A . 16 ASN HD22 . . A . 16 ASN HA . 1 . 16 ASN HD22 . . . 1 . 16 ASN HA . . rr_2mu8 1
53 1 . . 1 1 8 8 ASN HA H . . . 1 1 8 8 ASN HD22 H . . . . . 5.0 3.5 5.0 . . . . . A . 8 ASN HA . . A . 8 ASN HD22 . 1 . 8 ASN HA . . . 1 . 8 ASN HD22 . . rr_2mu8 1
54 1 . . 1 1 15 15 TYR HA H . . . 1 1 15 15 TYR QD H . . . . . 2.5 1.8 4.5 . . . . . A . 15 TYR HA . . A . 15 TYR QD . 1 . 15 TYR HA . . . 1 . 15 TYR HD* . . rr_2mu8 1
55 1 . . 1 1 9 9 THR HA H . . . 1 1 10 10 PHE QD H . . . . . 2.5 1.8 4.5 . . . . . A . 9 THR HA . . A . 10 PHE QD . 1 . 9 THR HA . . . 1 . 10 PHE HD* . . rr_2mu8 1
56 1 . . 1 1 5 5 LYS HA H . . . 1 1 6 6 TYR QD H . . . . . 5.0 3.5 7.0 . . . . . A . 5 LYS HA . . A . 6 TYR QD . 1 . 5 LYS HA . . . 1 . 6 TYR HD* . . rr_2mu8 1
57 1 . . 1 1 14 14 ALA HA H . . . 1 1 15 15 TYR QD H . . . . . 5.0 3.5 7.0 . . . . . A . 14 ALA HA . . A . 15 TYR QD . 1 . 14 ALA HA . . . 1 . 15 TYR HD* . . rr_2mu8 1
58 1 . . 1 1 9 9 THR HB H . . . 1 1 10 10 PHE QD H . . . . . 5.0 3.5 7.0 . . . . . A . 9 THR HB . . A . 10 PHE QD . 1 . 9 THR HB . . . 1 . 10 PHE HD* . . rr_2mu8 1
59 1 . . 1 1 15 15 TYR HA H . . . 1 1 15 15 TYR QE H . . . . . 5.0 3.5 7.0 . . . . . A . 15 TYR HA . . A . 15 TYR QE . 1 . 15 TYR HA . . . 1 . 15 TYR HE* . . rr_2mu8 1
60 1 . . 1 1 6 6 TYR HA H . . . 1 1 6 6 TYR QE H . . . . . 5.0 3.5 7.0 . . . . . A . 6 TYR HA . . A . 6 TYR QE . 1 . 6 TYR HA . . . 1 . 6 TYR HE* . . rr_2mu8 1
61 1 . . 1 1 16 16 ASN HA H . . . 1 1 16 16 ASN HD21 H . . . . . 3.5 2.8 3.5 . . . . . A . 16 ASN HA . . A . 16 ASN HD21 . 1 . 16 ASN HA . . . 1 . 16 ASN HD21 . . rr_2mu8 1
62 1 OR . 1 1 8 8 ASN H H . . . 1 1 7 7 SER HB2 H . . . . . 3.5 2.5 4.5 . . . . . A . 8 ASN H . . A . 7 SER HB2 . 1 . 8 ASN HN . . . 1 . 7 SER HB* . . rr_2mu8 1
62 2 OR . 1 1 8 8 ASN H H . . . 1 1 7 7 SER HB3 H . . . . . 3.5 2.5 4.5 . . . . . A . 8 ASN H . . A . 7 SER HB3 . 1 . 8 ASN HN . . . 1 . 7 SER HB* . . rr_2mu8 1
63 1 OR . 1 1 7 7 SER H H . . . 1 1 7 7 SER HB2 H . . . . . 3.5 2.5 4.5 . . . . . A . 7 SER H . . A . 7 SER HB2 . 1 . 7 SER HN . . . 1 . 7 SER HB* . . rr_2mu8 1
63 2 OR . 1 1 7 7 SER H H . . . 1 1 7 7 SER HB3 H . . . . . 3.5 2.5 4.5 . . . . . A . 7 SER H . . A . 7 SER HB3 . 1 . 7 SER HN . . . 1 . 7 SER HB* . . rr_2mu8 1
64 1 OR . 1 1 5 5 LYS H H . . . 1 1 4 4 SER HB2 H . . . . . 2.5 1.8 3.5 . . . . . A . 5 LYS H . . A . 4 SER HB2 . 1 . 5 LYS HN . . . 1 . 4 SER HB* . . rr_2mu8 1
64 2 OR . 1 1 5 5 LYS H H . . . 1 1 4 4 SER HB3 H . . . . . 2.5 1.8 3.5 . . . . . A . 5 LYS H . . A . 4 SER HB3 . 1 . 5 LYS HN . . . 1 . 4 SER HB* . . rr_2mu8 1
65 1 OR . 1 1 6 6 TYR QD H . . . 1 1 4 4 SER HB2 H . . . . . 5.0 3.5 8.0 . . . . . A . 6 TYR QD . . A . 4 SER HB2 . 1 . 6 TYR HD* . . . 1 . 4 SER HB* . . rr_2mu8 1
65 2 OR . 1 1 4 4 SER HB3 H . . . 1 1 6 6 TYR QD H . . . . . 5.0 3.5 8.0 . . . . . A . 4 SER HB3 . . A . 6 TYR QD . 1 . 4 SER HB* . . . 1 . 6 TYR HD* . . rr_2mu8 1
66 1 . . 1 1 8 8 ASN H H . . . 1 1 8 8 ASN HB3 H . . . . . 2.5 1.8 2.8 . . . . . A . 8 ASN H . . A . 8 ASN HB3 . 1 . 8 ASN HN . . . 1 . 8 ASN HBR . . rr_2mu8 1
67 1 . . 1 1 8 8 ASN H H . . . 1 1 8 8 ASN HB2 H . . . . . 2.5 1.8 2.8 . . . . . A . 8 ASN H . . A . 8 ASN HB2 . 1 . 8 ASN HN . . . 1 . 8 ASN HBS . . rr_2mu8 1
68 1 . . 1 1 13 13 ASN H H . . . 1 1 13 13 ASN HB3 H . . . . . 2.5 1.8 2.8 . . . . . A . 13 ASN H . . A . 13 ASN HB3 . 1 . 13 ASN HN . . . 1 . 13 ASN HBR . . rr_2mu8 1
69 1 . . 1 1 13 13 ASN H H . . . 1 1 13 13 ASN HB2 H . . . . . 2.5 1.8 2.8 . . . . . A . 13 ASN H . . A . 13 ASN HB2 . 1 . 13 ASN HN . . . 1 . 13 ASN HBS . . rr_2mu8 1
70 1 OR . 1 1 7 7 SER H H . . . 1 1 6 6 TYR HB2 H . . . . . 3.5 2.5 4.5 . . . . . A . 7 SER H . . A . 6 TYR HB2 . 1 . 7 SER HN . . . 1 . 6 TYR HB* . . rr_2mu8 1
70 2 OR . 1 1 6 6 TYR HB3 H . . . 1 1 7 7 SER H H . . . . . 3.5 2.5 4.5 . . . . . A . 6 TYR HB3 . . A . 7 SER H . 1 . 6 TYR HB* . . . 1 . 7 SER HN . . rr_2mu8 1
71 1 OR . 1 1 18 18 SER H H . . . 1 1 17 17 MET HG2 H . . . . . 5.0 3.5 6.0 . . . . . A . 18 SER H . . A . 17 MET HG2 . 1 . 18 SER HN . . . 1 . 17 MET HG* . . rr_2mu8 1
71 2 OR . 1 1 18 18 SER H H . . . 1 1 17 17 MET HG3 H . . . . . 5.0 3.5 6.0 . . . . . A . 18 SER H . . A . 17 MET HG3 . 1 . 18 SER HN . . . 1 . 17 MET HG* . . rr_2mu8 1
72 1 . . 1 1 16 16 ASN H H . . . 1 1 16 16 ASN HB3 H . . . . . 3.5 2.8 3.5 . . . . . A . 16 ASN H . . A . 16 ASN HB3 . 1 . 16 ASN HN . . . 1 . 16 ASN HBR . . rr_2mu8 1
73 1 OR . 1 1 17 17 MET H H . . . 1 1 17 17 MET HG2 H . . . . . 3.5 2.5 4.5 . . . . . A . 17 MET H . . A . 17 MET HG2 . 1 . 17 MET HN . . . 1 . 17 MET HG* . . rr_2mu8 1
73 2 OR . 1 1 17 17 MET H H . . . 1 1 17 17 MET HG3 H . . . . . 3.5 2.5 4.5 . . . . . A . 17 MET H . . A . 17 MET HG3 . 1 . 17 MET HN . . . 1 . 17 MET HG* . . rr_2mu8 1
74 1 . . 1 1 3 3 GLU H H . . . 1 1 2 2 ASN HB3 H . . . . . 5.0 3.5 5.0 . . . . . A . 3 GLU H . . A . 2 ASN HB3 . 1 . 3 GLU HN . . . 1 . 2 ASN HBR . . rr_2mu8 1
75 1 . . 1 1 16 16 ASN H H . . . 1 1 16 16 ASN HB2 H . . . . . 3.5 2.8 3.5 . . . . . A . 16 ASN H . . A . 16 ASN HB2 . 1 . 16 ASN HN . . . 1 . 16 ASN HBS . . rr_2mu8 1
76 1 . . 1 1 10 10 PHE H H . . . 1 1 10 10 PHE HB3 H . . . . . 3.5 2.8 3.5 . . . . . A . 10 PHE H . . A . 10 PHE HB3 . 1 . 10 PHE HN . . . 1 . 10 PHE HBS . . rr_2mu8 1
77 1 . . 1 1 10 10 PHE H H . . . 1 1 10 10 PHE HB2 H . . . . . 3.5 2.8 3.5 . . . . . A . 10 PHE H . . A . 10 PHE HB2 . 1 . 10 PHE HN . . . 1 . 10 PHE HBR . . rr_2mu8 1
78 1 . . 1 1 10 10 PHE HB2 H . . . 1 1 10 10 PHE QD H . . . . . 2.5 1.8 4.5 . . . . . A . 10 PHE HB2 . . A . 10 PHE QD . 1 . 10 PHE HBR . . . 1 . 10 PHE HD* . . rr_2mu8 1
79 1 . . 1 1 15 15 TYR HB2 H . . . 1 1 15 15 TYR QD H . . . . . 2.5 1.8 4.5 . . . . . A . 15 TYR HB2 . . A . 15 TYR QD . 1 . 15 TYR HBR . . . 1 . 15 TYR HD* . . rr_2mu8 1
80 1 . . 1 1 10 10 PHE QD H . . . 1 1 8 8 ASN HB3 H . . . . . 5.0 3.5 7.0 . . . . . A . 10 PHE QD . . A . 8 ASN HB3 . 1 . 10 PHE HD* . . . 1 . 8 ASN HBR . . rr_2mu8 1
81 1 . . 1 1 10 10 PHE QD H . . . 1 1 8 8 ASN HB2 H . . . . . 5.0 3.5 7.0 . . . . . A . 10 PHE QD . . A . 8 ASN HB2 . 1 . 10 PHE HD* . . . 1 . 8 ASN HBS . . rr_2mu8 1
82 1 . . 1 1 9 9 THR H H . . . 1 1 8 8 ASN HB3 H . . . . . 3.5 2.8 3.5 . . . . . A . 9 THR H . . A . 8 ASN HB3 . 1 . 9 THR HN . . . 1 . 8 ASN HBR . . rr_2mu8 1
83 1 . . 1 1 9 9 THR H H . . . 1 1 8 8 ASN HB2 H . . . . . 3.5 2.8 3.5 . . . . . A . 9 THR H . . A . 8 ASN HB2 . 1 . 9 THR HN . . . 1 . 8 ASN HBS . . rr_2mu8 1
84 1 . . 1 1 3 3 GLU H H . . . 1 1 2 2 ASN HB2 H . . . . . 5.0 3.5 5.0 . . . . . A . 3 GLU H . . A . 2 ASN HB2 . 1 . 3 GLU HN . . . 1 . 2 ASN HBS . . rr_2mu8 1
85 1 . . 1 1 17 17 MET H H . . . 1 1 16 16 ASN HB2 H . . . . . 3.5 2.8 3.5 . . . . . A . 17 MET H . . A . 16 ASN HB2 . 1 . 17 MET HN . . . 1 . 16 ASN HBS . . rr_2mu8 1
86 1 . . 1 1 10 10 PHE HB3 H . . . 1 1 10 10 PHE QD H . . . . . 2.5 1.8 4.5 . . . . . A . 10 PHE HB3 . . A . 10 PHE QD . 1 . 10 PHE HBS . . . 1 . 10 PHE HD* . . rr_2mu8 1
87 1 . . 1 1 15 15 TYR HB3 H . . . 1 1 15 15 TYR QD H . . . . . 2.5 1.8 4.5 . . . . . A . 15 TYR HB3 . . A . 15 TYR QD . 1 . 15 TYR HBS . . . 1 . 15 TYR HD* . . rr_2mu8 1
88 1 . . 1 1 16 16 ASN HD22 H . . . 1 1 16 16 ASN HB2 H . . . . . 3.5 2.8 3.5 . . . . . A . 16 ASN HD22 . . A . 16 ASN HB2 . 1 . 16 ASN HD22 . . . 1 . 16 ASN HBS . . rr_2mu8 1
89 1 OR . 1 1 4 4 SER H H . . . 1 1 3 3 GLU HG2 H . . . . . 5.0 3.5 6.0 . . . . . A . 4 SER H . . A . 3 GLU HG2 . 1 . 4 SER HN . . . 1 . 3 GLU HG* . . rr_2mu8 1
89 2 OR . 1 1 4 4 SER H H . . . 1 1 3 3 GLU HG3 H . . . . . 5.0 3.5 6.0 . . . . . A . 4 SER H . . A . 3 GLU HG3 . 1 . 4 SER HN . . . 1 . 3 GLU HG* . . rr_2mu8 1
90 1 OR . 1 1 3 3 GLU H H . . . 1 1 3 3 GLU HG2 H . . . . . 5.0 3.5 6.0 . . . . . A . 3 GLU H . . A . 3 GLU HG2 . 1 . 3 GLU HN . . . 1 . 3 GLU HG* . . rr_2mu8 1
90 2 OR . 1 1 3 3 GLU H H . . . 1 1 3 3 GLU HG3 H . . . . . 5.0 3.5 6.0 . . . . . A . 3 GLU H . . A . 3 GLU HG3 . 1 . 3 GLU HN . . . 1 . 3 GLU HG* . . rr_2mu8 1
91 1 . . 1 1 4 4 SER H H . . . 1 1 3 3 GLU HB2 H . . . . . 5.0 3.5 5.0 . . . . . A . 4 SER H . . A . 3 GLU HB2 . 1 . 4 SER HN . . . 1 . 3 GLU HBR . . rr_2mu8 1
92 1 . . 1 1 17 17 MET HB2 H . . . 1 1 17 17 MET H H . . . . . 3.5 2.8 3.5 . . . . . A . 17 MET HB2 . . A . 17 MET H . 1 . 17 MET HBS . . . 1 . 17 MET HN . . rr_2mu8 1
93 1 . . 1 1 3 3 GLU H H . . . 1 1 3 3 GLU HB2 H . . . . . 5.0 3.5 5.0 . . . . . A . 3 GLU H . . A . 3 GLU HB2 . 1 . 3 GLU HN . . . 1 . 3 GLU HBR . . rr_2mu8 1
94 1 . . 1 1 19 19 ILE H H . . . 1 1 19 19 ILE HB H . . . . . 3.5 2.8 3.5 . . . . . A . 19 ILE H . . A . 19 ILE HB . 1 . 19 ILE HN . . . 1 . 19 ILE HB . . rr_2mu8 1
95 1 . . 1 1 12 12 ASN H H . . . 1 1 11 11 ILE HB H . . . . . 3.5 2.8 3.5 . . . . . A . 12 ASN H . . A . 11 ILE HB . 1 . 12 ASN HN . . . 1 . 11 ILE HB . . rr_2mu8 1
96 1 . . 1 1 2 2 ASN H H . . . 1 1 1 1 LYS HB2 H . . . . . 5.0 3.5 5.0 . . . . . A . 2 ASN H . . A . 1 LYS HB2 . 1 . 2 ASN HN . . . 1 . 1 LYS HBR . . rr_2mu8 1
97 1 . . 1 1 2 2 ASN H H . . . 1 1 1 1 LYS HB3 H . . . . . 5.0 3.5 5.0 . . . . . A . 2 ASN H . . A . 1 LYS HB3 . 1 . 2 ASN HN . . . 1 . 1 LYS HBS . . rr_2mu8 1
98 1 OR . 1 1 2 2 ASN H H . . . 1 1 1 1 LYS HG2 H . . . . . 5.0 3.5 6.0 . . . . . A . 2 ASN H . . A . 1 LYS HG2 . 1 . 2 ASN HN . . . 1 . 1 LYS HG* . . rr_2mu8 1
98 2 OR . 1 1 2 2 ASN H H . . . 1 1 1 1 LYS HG3 H . . . . . 5.0 3.5 6.0 . . . . . A . 2 ASN H . . A . 1 LYS HG3 . 1 . 2 ASN HN . . . 1 . 1 LYS HG* . . rr_2mu8 1
99 1 . . 1 1 12 12 ASN H H . . . 1 1 11 11 ILE HG12 H . . . . . 5.0 3.5 5.0 . . . . . A . 12 ASN H . . A . 11 ILE HG12 . 1 . 12 ASN HN . . . 1 . 11 ILE HG1R . . rr_2mu8 1
100 1 . . 1 1 19 19 ILE H H . . . 1 1 19 19 ILE HG12 H . . . . . 5.0 3.5 5.0 . . . . . A . 19 ILE H . . A . 19 ILE HG12 . 1 . 19 ILE HN . . . 1 . 19 ILE HG1R . . rr_2mu8 1
101 1 . . 1 1 11 11 ILE H H . . . 1 1 11 11 ILE HG12 H . . . . . 3.5 2.8 3.5 . . . . . A . 11 ILE H . . A . 11 ILE HG12 . 1 . 11 ILE HN . . . 1 . 11 ILE HG1R . . rr_2mu8 1
102 1 . . 1 1 5 5 LYS HB3 H . . . 1 1 6 6 TYR H H . . . . . 3.5 2.8 3.5 . . . . . A . 5 LYS HB3 . . A . 6 TYR H . 1 . 5 LYS HBS . . . 1 . 6 TYR HN . . rr_2mu8 1
103 1 . . 1 1 5 5 LYS HB2 H . . . 1 1 6 6 TYR H H . . . . . 5.0 3.5 5.0 . . . . . A . 5 LYS HB2 . . A . 6 TYR H . 1 . 5 LYS HBR . . . 1 . 6 TYR HN . . rr_2mu8 1
104 1 . . 1 1 11 11 ILE H H . . . 1 1 11 11 ILE HB H . . . . . 2.5 1.8 2.8 . . . . . A . 11 ILE H . . A . 11 ILE HB . 1 . 11 ILE HN . . . 1 . 11 ILE HB . . rr_2mu8 1
105 1 . . 1 1 4 4 SER H H . . . 1 1 3 3 GLU HB3 H . . . . . 3.5 2.8 3.5 . . . . . A . 4 SER H . . A . 3 GLU HB3 . 1 . 4 SER HN . . . 1 . 3 GLU HBS . . rr_2mu8 1
106 1 . . 1 1 3 3 GLU H H . . . 1 1 3 3 GLU HB3 H . . . . . 3.5 2.8 3.5 . . . . . A . 3 GLU H . . A . 3 GLU HB3 . 1 . 3 GLU HN . . . 1 . 3 GLU HBS . . rr_2mu8 1
107 1 . . 1 1 17 17 MET HB3 H . . . 1 1 17 17 MET H H . . . . . 3.5 2.8 3.5 . . . . . A . 17 MET HB3 . . A . 17 MET H . 1 . 17 MET HBR . . . 1 . 17 MET HN . . rr_2mu8 1
108 1 OR . 1 1 5 5 LYS H H . . . 1 1 5 5 LYS HG2 H . . . . . 3.5 2.5 4.5 . . . . . A . 5 LYS H . . A . 5 LYS HG2 . 1 . 5 LYS HN . . . 1 . 5 LYS HG* . . rr_2mu8 1
108 2 OR . 1 1 5 5 LYS H H . . . 1 1 5 5 LYS HG3 H . . . . . 3.5 2.5 4.5 . . . . . A . 5 LYS H . . A . 5 LYS HG3 . 1 . 5 LYS HN . . . 1 . 5 LYS HG* . . rr_2mu8 1
109 1 . . 1 1 12 12 ASN H H . . . 1 1 11 11 ILE MD H . . . . . 3.5 2.5 4.5 . . . . . A . 12 ASN H . . A . 11 ILE MD . 1 . 12 ASN HN . . . 1 . 11 ILE HD1* . . rr_2mu8 1
110 1 . . 1 1 11 11 ILE H H . . . 1 1 11 11 ILE MD H . . . . . 3.5 2.5 4.5 . . . . . A . 11 ILE H . . A . 11 ILE MD . 1 . 11 ILE HN . . . 1 . 11 ILE HD1* . . rr_2mu8 1
111 1 . . 1 1 19 19 ILE H H . . . 1 1 19 19 ILE MD H . . . . . 5.0 3.5 6.0 . . . . . A . 19 ILE H . . A . 19 ILE MD . 1 . 19 ILE HN . . . 1 . 19 ILE HD1* . . rr_2mu8 1
112 1 . . 1 1 9 9 THR H H . . . 1 1 9 9 THR MG H . . . . . 2.5 1.8 3.5 . . . . . A . 9 THR H . . A . 9 THR MG . 1 . 9 THR HN . . . 1 . 9 THR HG2* . . rr_2mu8 1
113 1 . . 1 1 14 14 ALA H H . . . 1 1 14 14 ALA MB H . . . . . 2.5 1.8 3.5 . . . . . A . 14 ALA H . . A . 14 ALA MB . 1 . 14 ALA HN . . . 1 . 14 ALA HB* . . rr_2mu8 1
114 1 . . 1 1 16 16 ASN H H . . . 1 1 14 14 ALA MB H . . . . . 5.0 3.5 6.0 . . . . . A . 16 ASN H . . A . 14 ALA MB . 1 . 16 ASN HN . . . 1 . 14 ALA HB* . . rr_2mu8 1
115 1 . . 1 1 15 15 TYR H H . . . 1 1 14 14 ALA MB H . . . . . 2.5 1.8 3.5 . . . . . A . 15 TYR H . . A . 14 ALA MB . 1 . 15 TYR HN . . . 1 . 14 ALA HB* . . rr_2mu8 1
116 1 . . 1 1 11 11 ILE H H . . . 1 1 11 11 ILE HG13 H . . . . . 3.5 2.8 3.5 . . . . . A . 11 ILE H . . A . 11 ILE HG13 . 1 . 11 ILE HN . . . 1 . 11 ILE HG1S . . rr_2mu8 1
117 1 . . 1 1 12 12 ASN H H . . . 1 1 11 11 ILE HG13 H . . . . . 3.5 2.8 3.5 . . . . . A . 12 ASN H . . A . 11 ILE HG13 . 1 . 12 ASN HN . . . 1 . 11 ILE HG1S . . rr_2mu8 1
118 1 . . 1 1 19 19 ILE H H . . . 1 1 19 19 ILE HG13 H . . . . . 5.0 3.5 5.0 . . . . . A . 19 ILE H . . A . 19 ILE HG13 . 1 . 19 ILE HN . . . 1 . 19 ILE HG1S . . rr_2mu8 1
119 1 . . 1 1 10 10 PHE H H . . . 1 1 9 9 THR MG H . . . . . 3.5 2.5 4.5 . . . . . A . 10 PHE H . . A . 9 THR MG . 1 . 10 PHE HN . . . 1 . 9 THR HG2* . . rr_2mu8 1
120 1 . . 1 1 10 10 PHE HA H . . . 1 1 11 11 ILE MD H . . . . . 3.5 2.5 4.5 . . . . . A . 10 PHE HA . . A . 11 ILE MD . 1 . 10 PHE HA . . . 1 . 11 ILE HD1* . . rr_2mu8 1
121 1 . . 1 1 13 13 ASN HA H . . . 1 1 14 14 ALA MB H . . . . . 3.5 2.5 4.5 . . . . . A . 13 ASN HA . . A . 14 ALA MB . 1 . 13 ASN HA . . . 1 . 14 ALA HB* . . rr_2mu8 1
122 1 . . 1 1 8 8 ASN HA H . . . 1 1 9 9 THR MG H . . . . . 5.0 3.5 6.0 . . . . . A . 8 ASN HA . . A . 9 THR MG . 1 . 8 ASN HA . . . 1 . 9 THR HG2* . . rr_2mu8 1
123 1 . . 1 1 11 11 ILE HA H . . . 1 1 11 11 ILE MD H . . . . . 2.5 1.8 3.5 . . . . . A . 11 ILE HA . . A . 11 ILE MD . 1 . 11 ILE HA . . . 1 . 11 ILE HD1* . . rr_2mu8 1
124 1 . . 1 1 9 9 THR HA H . . . 1 1 9 9 THR MG H . . . . . 2.5 1.8 3.5 . . . . . A . 9 THR HA . . A . 9 THR MG . 1 . 9 THR HA . . . 1 . 9 THR HG2* . . rr_2mu8 1
125 1 . . 1 1 14 14 ALA HA H . . . 1 1 14 14 ALA MB H . . . . . 2.5 1.8 3.5 . . . . . A . 14 ALA HA . . A . 14 ALA MB . 1 . 14 ALA HA . . . 1 . 14 ALA HB* . . rr_2mu8 1
126 1 . . 1 1 11 11 ILE HA H . . . 1 1 11 11 ILE HG13 H . . . . . 3.5 2.8 3.5 . . . . . A . 11 ILE HA . . A . 11 ILE HG13 . 1 . 11 ILE HA . . . 1 . 11 ILE HG1S . . rr_2mu8 1
127 1 OR . 1 1 1 1 LYS HA H . . . 1 1 1 1 LYS HG2 H . . . . . 5.0 3.5 6.0 . . . . . A . 1 LYS HA . . A . 1 LYS HG2 . 1 . 1 LYS HA . . . 1 . 1 LYS HG* . . rr_2mu8 1
127 2 OR . 1 1 1 1 LYS HA H . . . 1 1 1 1 LYS HG3 H . . . . . 5.0 3.5 6.0 . . . . . A . 1 LYS HA . . A . 1 LYS HG3 . 1 . 1 LYS HA . . . 1 . 1 LYS HG* . . rr_2mu8 1
128 1 . . 1 1 3 3 GLU HA H . . . 1 1 3 3 GLU HB3 H . . . . . 3.5 2.8 3.5 . . . . . A . 3 GLU HA . . A . 3 GLU HB3 . 1 . 3 GLU HA . . . 1 . 3 GLU HBS . . rr_2mu8 1
129 1 . . 1 1 17 17 MET HB3 H . . . 1 1 17 17 MET HA H . . . . . 3.5 2.8 3.5 . . . . . A . 17 MET HB3 . . A . 17 MET HA . 1 . 17 MET HBR . . . 1 . 17 MET HA . . rr_2mu8 1
130 1 . . 1 1 3 3 GLU HA H . . . 1 1 3 3 GLU HB2 H . . . . . 3.5 2.8 3.5 . . . . . A . 3 GLU HA . . A . 3 GLU HB2 . 1 . 3 GLU HA . . . 1 . 3 GLU HBR . . rr_2mu8 1
131 1 . . 1 1 17 17 MET HB2 H . . . 1 1 17 17 MET HA H . . . . . 3.5 2.8 3.5 . . . . . A . 17 MET HB2 . . A . 17 MET HA . 1 . 17 MET HBS . . . 1 . 17 MET HA . . rr_2mu8 1
132 1 OR . 1 1 3 3 GLU HA H . . . 1 1 3 3 GLU HG2 H . . . . . 5.0 3.5 6.0 . . . . . A . 3 GLU HA . . A . 3 GLU HG2 . 1 . 3 GLU HA . . . 1 . 3 GLU HG* . . rr_2mu8 1
132 2 OR . 1 1 3 3 GLU HA H . . . 1 1 3 3 GLU HG3 H . . . . . 5.0 3.5 6.0 . . . . . A . 3 GLU HA . . A . 3 GLU HG3 . 1 . 3 GLU HA . . . 1 . 3 GLU HG* . . rr_2mu8 1
133 1 . . 1 1 15 15 TYR HA H . . . 1 1 15 15 TYR HB3 H . . . . . 5.0 3.5 5.0 . . . . . A . 15 TYR HA . . A . 15 TYR HB3 . 1 . 15 TYR HA . . . 1 . 15 TYR HBS . . rr_2mu8 1
134 1 . . 1 1 10 10 PHE HA H . . . 1 1 10 10 PHE HB3 H . . . . . 5.0 3.5 5.0 . . . . . A . 10 PHE HA . . A . 10 PHE HB3 . 1 . 10 PHE HA . . . 1 . 10 PHE HBS . . rr_2mu8 1
135 1 . . 1 1 8 8 ASN HA H . . . 1 1 8 8 ASN HB2 H . . . . . 5.0 3.5 5.0 . . . . . A . 8 ASN HA . . A . 8 ASN HB2 . 1 . 8 ASN HA . . . 1 . 8 ASN HBS . . rr_2mu8 1
136 1 . . 1 1 8 8 ASN HA H . . . 1 1 8 8 ASN HB3 H . . . . . 5.0 3.5 5.0 . . . . . A . 8 ASN HA . . A . 8 ASN HB3 . 1 . 8 ASN HA . . . 1 . 8 ASN HBR . . rr_2mu8 1
137 1 . . 1 1 10 10 PHE HA H . . . 1 1 11 11 ILE HB H . . . . . 5.0 3.5 5.0 . . . . . A . 10 PHE HA . . A . 11 ILE HB . 1 . 10 PHE HA . . . 1 . 11 ILE HB . . rr_2mu8 1
138 1 . . 1 1 2 2 ASN H H . . . 1 1 3 3 GLU H H . . . . . 3.5 2.8 3.5 . . . . . A . 2 ASN H . . A . 3 GLU H . 1 . 2 ASN HN . . . 1 . 3 GLU HN . . rr_2mu8 1
139 1 . . 1 1 11 11 ILE H H . . . 1 1 12 12 ASN H H . . . . . 3.5 2.8 3.5 . . . . . A . 11 ILE H . . A . 12 ASN H . 1 . 11 ILE HN . . . 1 . 12 ASN HN . . rr_2mu8 1
140 1 . . 1 1 8 8 ASN H H . . . 1 1 9 9 THR H H . . . . . 2.5 1.8 2.8 . . . . . A . 8 ASN H . . A . 9 THR H . 1 . 8 ASN HN . . . 1 . 9 THR HN . . rr_2mu8 1
141 1 . . 1 1 18 18 SER H H . . . 1 1 19 19 ILE H H . . . . . 2.5 1.8 2.8 . . . . . A . 18 SER H . . A . 19 ILE H . 1 . 18 SER HN . . . 1 . 19 ILE HN . . rr_2mu8 1
142 1 . . 1 1 9 9 THR H H . . . 1 1 10 10 PHE H H . . . . . 2.5 1.8 2.8 . . . . . A . 9 THR H . . A . 10 PHE H . 1 . 9 THR HN . . . 1 . 10 PHE HN . . rr_2mu8 1
143 1 . . 1 1 7 7 SER H H . . . 1 1 8 8 ASN H H . . . . . 2.5 1.8 2.8 . . . . . A . 7 SER H . . A . 8 ASN H . 1 . 7 SER HN . . . 1 . 8 ASN HN . . rr_2mu8 1
144 1 . . 1 1 15 15 TYR H H . . . 1 1 14 14 ALA H H . . . . . 2.5 1.8 2.8 . . . . . A . 15 TYR H . . A . 14 ALA H . 1 . 15 TYR HN . . . 1 . 14 ALA HN . . rr_2mu8 1
145 1 . . 1 1 18 18 SER H H . . . 1 1 17 17 MET H H . . . . . 2.5 1.8 2.8 . . . . . A . 18 SER H . . A . 17 MET H . 1 . 18 SER HN . . . 1 . 17 MET HN . . rr_2mu8 1
146 1 . . 1 1 5 5 LYS H H . . . 1 1 6 6 TYR H H . . . . . 3.5 2.8 3.5 . . . . . A . 5 LYS H . . A . 6 TYR H . 1 . 5 LYS HN . . . 1 . 6 TYR HN . . rr_2mu8 1
147 1 . . 1 1 6 6 TYR H H . . . 1 1 7 7 SER H H . . . . . 2.5 1.8 2.8 . . . . . A . 6 TYR H . . A . 7 SER H . 1 . 6 TYR HN . . . 1 . 7 SER HN . . rr_2mu8 1
148 1 . . 1 1 15 15 TYR H H . . . 1 1 16 16 ASN H H . . . . . 2.5 1.8 2.8 . . . . . A . 15 TYR H . . A . 16 ASN H . 1 . 15 TYR HN . . . 1 . 16 ASN HN . . rr_2mu8 1
149 1 . . 1 1 10 10 PHE H H . . . 1 1 10 10 PHE QD H . . . . . 3.5 2.5 5.5 . . . . . A . 10 PHE H . . A . 10 PHE QD . 1 . 10 PHE HN . . . 1 . 10 PHE HD* . . rr_2mu8 1
150 1 . . 1 1 15 15 TYR H H . . . 1 1 15 15 TYR QD H . . . . . 2.5 1.8 4.5 . . . . . A . 15 TYR H . . A . 15 TYR QD . 1 . 15 TYR HN . . . 1 . 15 TYR HD* . . rr_2mu8 1
151 1 . . 1 1 7 7 SER H H . . . 1 1 6 6 TYR QD H . . . . . 3.5 2.5 5.5 . . . . . A . 7 SER H . . A . 6 TYR QD . 1 . 7 SER HN . . . 1 . 6 TYR HD* . . rr_2mu8 1
152 1 . . 1 1 6 6 TYR QD H . . . 1 1 6 6 TYR QE H . . . . . 2.5 1.8 6.5 . . . . . A . 6 TYR QD . . A . 6 TYR QE . 1 . 6 TYR HD* . . . 1 . 6 TYR HE* . . rr_2mu8 1
153 1 . . 1 1 15 15 TYR QD H . . . 1 1 15 15 TYR QE H . . . . . 2.5 1.8 6.5 . . . . . A . 15 TYR QD . . A . 15 TYR QE . 1 . 15 TYR HD* . . . 1 . 15 TYR HE* . . rr_2mu8 1
154 1 . . 1 1 15 15 TYR H H . . . 1 1 15 15 TYR QE H . . . . . 3.5 2.5 5.5 . . . . . A . 15 TYR H . . A . 15 TYR QE . 1 . 15 TYR HN . . . 1 . 15 TYR HE* . . rr_2mu8 1
155 1 . . 1 1 6 6 TYR H H . . . 1 1 6 6 TYR QE H . . . . . 3.5 2.5 5.5 . . . . . A . 6 TYR H . . A . 6 TYR QE . 1 . 6 TYR HN . . . 1 . 6 TYR HE* . . rr_2mu8 1
156 1 . . 1 1 8 8 ASN HD21 H . . . 1 1 8 8 ASN HD22 H . . . . . 2.5 1.8 2.8 . . . . . A . 8 ASN HD21 . . A . 8 ASN HD22 . 1 . 8 ASN HD21 . . . 1 . 8 ASN HD22 . . rr_2mu8 1
157 1 . . 1 1 13 13 ASN HD21 H . . . 1 1 13 13 ASN HD22 H . . . . . 2.5 1.8 2.8 . . . . . A . 13 ASN HD21 . . A . 13 ASN HD22 . 1 . 13 ASN HD21 . . . 1 . 13 ASN HD22 . . rr_2mu8 1
158 1 . . 1 1 8 8 ASN H H . . . 1 1 8 8 ASN HD22 H . . . . . 3.5 2.8 3.5 . . . . . A . 8 ASN H . . A . 8 ASN HD22 . 1 . 8 ASN HN . . . 1 . 8 ASN HD22 . . rr_2mu8 1
159 1 . . 1 1 12 12 ASN H H . . . 1 1 12 12 ASN HD22 H . . . . . 3.5 2.8 3.5 . . . . . A . 12 ASN H . . A . 12 ASN HD22 . 1 . 12 ASN HN . . . 1 . 12 ASN HD22 . . rr_2mu8 1
160 1 . . 1 1 13 13 ASN H H . . . 1 1 13 13 ASN HD21 H . . . . . 5.0 3.5 5.0 . . . . . A . 13 ASN H . . A . 13 ASN HD21 . 1 . 13 ASN HN . . . 1 . 13 ASN HD21 . . rr_2mu8 1
161 1 . . 1 1 10 10 PHE HB3 H . . . 1 1 10 10 PHE HB2 H . . . . . 2.5 1.8 2.8 . . . . . A . 10 PHE HB3 . . A . 10 PHE HB2 . 1 . 10 PHE HBS . . . 1 . 10 PHE HBR . . rr_2mu8 1
162 1 . . 1 1 15 15 TYR HB2 H . . . 1 1 15 15 TYR HB3 H . . . . . 2.5 1.8 2.8 . . . . . A . 15 TYR HB2 . . A . 15 TYR HB3 . 1 . 15 TYR HBR . . . 1 . 15 TYR HBS . . rr_2mu8 1
163 1 . . 1 1 14 14 ALA HA H . . . 1 1 16 16 ASN H H . . . . . 5.0 3.5 5.0 . . . . . A . 14 ALA HA . . A . 16 ASN H . 1 . 14 ALA HA . . . 1 . 16 ASN HN . . rr_2mu8 1
164 1 . . 1 1 16 16 ASN HA H . . . 1 1 16 16 ASN H H . . . . . 3.5 2.8 3.5 . . . . . A . 16 ASN HA . . A . 16 ASN H . 1 . 16 ASN HA . . . 1 . 16 ASN HN . . rr_2mu8 1
165 1 . . 1 1 20 20 ARG H H . . . 1 1 20 20 ARG HA H . . . . . 3.5 2.8 3.5 . . . . . A . 20 ARG H . . A . 20 ARG HA . 1 . 20 ARG HN . . . 1 . 20 ARG HA . . rr_2mu8 1
166 1 . . 1 1 3 3 GLU HA H . . . 1 1 4 4 SER H H . . . . . 2.5 1.8 2.8 . . . . . A . 3 GLU HA . . A . 4 SER H . 1 . 3 GLU HA . . . 1 . 4 SER HN . . rr_2mu8 1
167 1 . . 1 1 12 12 ASN HA H . . . 1 1 13 13 ASN H H . . . . . 2.5 1.8 2.8 . . . . . A . 12 ASN HA . . A . 13 ASN H . 1 . 12 ASN HA . . . 1 . 13 ASN HN . . rr_2mu8 1
168 1 . . 1 1 13 13 ASN HA H . . . 1 1 14 14 ALA H H . . . . . 2.5 1.8 2.8 . . . . . A . 13 ASN HA . . A . 14 ALA H . 1 . 13 ASN HA . . . 1 . 14 ALA HN . . rr_2mu8 1
169 1 . . 1 1 15 15 TYR HA H . . . 1 1 16 16 ASN H H . . . . . 2.5 1.8 2.8 . . . . . A . 15 TYR HA . . A . 16 ASN H . 1 . 15 TYR HA . . . 1 . 16 ASN HN . . rr_2mu8 1
170 1 . . 1 1 17 17 MET H H . . . 1 1 16 16 ASN HA H . . . . . 2.5 1.8 2.8 . . . . . A . 17 MET H . . A . 16 ASN HA . 1 . 17 MET HN . . . 1 . 16 ASN HA . . rr_2mu8 1
171 1 . . 1 1 18 18 SER H H . . . 1 1 17 17 MET HA H . . . . . 2.5 1.8 2.8 . . . . . A . 18 SER H . . A . 17 MET HA . 1 . 18 SER HN . . . 1 . 17 MET HA . . rr_2mu8 1
172 1 . . 1 1 19 19 ILE HA H . . . 1 1 20 20 ARG H H . . . . . 2.5 1.8 2.8 . . . . . A . 19 ILE HA . . A . 20 ARG H . 1 . 19 ILE HA . . . 1 . 20 ARG HN . . rr_2mu8 1
173 1 . . 1 1 12 12 ASN H H . . . 1 1 13 13 ASN H H . . . . . 2.5 1.8 2.8 . . . . . A . 12 ASN H . . A . 13 ASN H . 1 . 12 ASN HN . . . 1 . 13 ASN HN . . rr_2mu8 1
174 1 . . 1 1 4 4 SER H H . . . 1 1 5 5 LYS H H . . . . . 5.0 3.5 5.0 . . . . . A . 4 SER H . . A . 5 LYS H . 1 . 4 SER HN . . . 1 . 5 LYS HN . . rr_2mu8 1
175 1 . . 1 1 17 17 MET H H . . . 1 1 16 16 ASN H H . . . . . 2.5 1.8 2.8 . . . . . A . 17 MET H . . A . 16 ASN H . 1 . 17 MET HN . . . 1 . 16 ASN HN . . rr_2mu8 1
176 1 . . 1 1 10 10 PHE H H . . . 1 1 11 11 ILE H H . . . . . 2.5 1.8 2.8 . . . . . A . 10 PHE H . . A . 11 ILE H . 1 . 10 PHE HN . . . 1 . 11 ILE HN . . rr_2mu8 1
177 1 . . 1 1 3 3 GLU H H . . . 1 1 4 4 SER H H . . . . . 5.0 3.5 5.0 . . . . . A . 3 GLU H . . A . 4 SER H . 1 . 3 GLU HN . . . 1 . 4 SER HN . . rr_2mu8 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 NOE_distance 1 1 1 13 rr_2mu8 1
2 medium: 2 87 2 102 rr_2mu8 1
3 medium: 3 87 3 101 rr_2mu8 1
4 medium: 4 87 4 101 rr_2mu8 1
5 medium: 5 87 5 101 rr_2mu8 1
6 medium: 6 87 6 102 rr_2mu8 1
7 weak: 7 87 7 103 rr_2mu8 1
8 weak: 8 87 8 101 rr_2mu8 1
9 strong: 9 87 9 102 rr_2mu8 1
10 medium: 10 87 10 103 rr_2mu8 1
11 medium: 11 87 11 102 rr_2mu8 1
12 strong: 12 87 12 102 rr_2mu8 1
13 weak: 13 87 13 102 rr_2mu8 1
14 medium: 14 87 14 102 rr_2mu8 1
15 medium: 15 87 15 102 rr_2mu8 1
16 medium: 16 87 16 102 rr_2mu8 1
17 medium: 17 87 17 102 rr_2mu8 1
18 medium: 18 87 18 102 rr_2mu8 1
19 strong: 19 87 19 102 rr_2mu8 1
20 strong: 20 87 20 102 rr_2mu8 1
21 strong: 21 87 21 102 rr_2mu8 1
22 medium: 22 87 22 102 rr_2mu8 1
23 medium: 23 87 23 101 rr_2mu8 1
24 strong: 24 87 24 102 rr_2mu8 1
25 medium: 25 87 25 102 rr_2mu8 1
26 medium: 26 87 26 103 rr_2mu8 1
27 medium: 27 87 27 103 rr_2mu8 1
28 strong: 28 87 28 103 rr_2mu8 1
29 strong: 29 87 29 103 rr_2mu8 1
30 strong: 30 87 30 104 rr_2mu8 1
31 strong: 31 87 31 102 rr_2mu8 1
32 strong: 32 87 32 102 rr_2mu8 1
33 medium: 33 87 33 103 rr_2mu8 1
34 medium: 34 87 34 101 rr_2mu8 1
35 medium: 35 87 35 104 rr_2mu8 1
36 strong: 36 87 36 102 rr_2mu8 1
37 medium: 37 87 37 102 rr_2mu8 1
38 medium: 38 87 38 101 rr_2mu8 1
39 strong: 39 87 39 102 rr_2mu8 1
40 strong: 40 87 40 102 rr_2mu8 1
41 strong: 41 87 41 102 rr_2mu8 1
42 strong: 42 87 42 102 rr_2mu8 1
43 strong: 43 87 43 102 rr_2mu8 1
44 strong: 44 87 44 102 rr_2mu8 1
45 medium: 45 87 45 100 rr_2mu8 1
46 strong: 46 87 46 102 rr_2mu8 1
47 strong: 47 87 47 102 rr_2mu8 1
48 strong: 48 87 48 102 rr_2mu8 1
49 strong: 49 87 49 102 rr_2mu8 1
50 strong: 50 87 50 102 rr_2mu8 1
51 medium: 51 87 51 102 rr_2mu8 1
52 weak: 52 87 52 102 rr_2mu8 1
53 weak: 53 87 53 101 rr_2mu8 1
54 weak: 54 87 54 102 rr_2mu8 1
55 strong: 55 87 55 102 rr_2mu8 1
56 strong: 56 87 56 102 rr_2mu8 1
57 medium: 57 87 57 100 rr_2mu8 1
58 weak: 58 87 58 102 rr_2mu8 1
59 strong: 59 87 59 102 rr_2mu8 1
60 strong: 60 87 60 102 rr_2mu8 1
61 weak: 61 87 61 99 rr_2mu8 1
62 weak: 62 87 62 102 rr_2mu8 1
63 weak: 63 87 63 104 rr_2mu8 1
64 weak: 64 87 64 99 rr_2mu8 1
65 weak: 65 87 65 99 rr_2mu8 1
66 medium: 66 87 66 104 rr_2mu8 1
67 medium: 67 87 67 102 rr_2mu8 1
68 medium: 68 87 68 103 rr_2mu8 1
69 strong: 69 87 69 104 rr_2mu8 1
70 weak: 70 87 70 101 rr_2mu8 1
71 strong: 71 87 71 102 rr_2mu8 1
72 strong: 72 87 72 103 rr_2mu8 1
73 strong: 73 87 73 103 rr_2mu8 1
74 strong: 74 87 74 102 rr_2mu8 1
75 medium: 75 87 75 101 rr_2mu8 1
76 weak: 76 87 76 101 rr_2mu8 1
77 medium: 77 87 77 101 rr_2mu8 1
78 medium: 78 87 78 102 rr_2mu8 1
79 weak: 79 87 79 100 rr_2mu8 1
80 medium: 80 87 80 101 rr_2mu8 1
81 medium: 81 87 81 103 rr_2mu8 1
82 medium: 82 87 82 101 rr_2mu8 1
83 strong: 83 87 83 102 rr_2mu8 1
84 strong: 84 87 84 102 rr_2mu8 1
85 weak: 85 87 85 101 rr_2mu8 1
86 weak: 86 87 86 101 rr_2mu8 1
87 medium: 87 87 87 103 rr_2mu8 1
88 medium: 88 87 88 102 rr_2mu8 1
89 weak: 89 87 89 99 rr_2mu8 1
90 medium: 90 87 90 104 rr_2mu8 1
91 strong: 91 87 91 102 rr_2mu8 1
92 strong: 92 87 92 102 rr_2mu8 1
93 medium: 93 87 93 104 rr_2mu8 1
94 weak: 94 87 94 99 rr_2mu8 1
95 weak: 95 87 95 100 rr_2mu8 1
96 weak: 96 87 96 100 rr_2mu8 1
97 medium: 97 87 97 102 rr_2mu8 1
98 weak: 98 87 98 99 rr_2mu8 1
99 medium: 99 87 99 103 rr_2mu8 1
100 weak: 100 87 100 100 rr_2mu8 1
101 medium: 101 87 101 102 rr_2mu8 1
102 weak: 102 87 102 101 rr_2mu8 1
103 weak: 103 87 103 101 rr_2mu8 1
104 weak: 104 87 104 98 rr_2mu8 1
105 weak: 105 87 105 101 rr_2mu8 1
106 medium: 106 87 106 100 rr_2mu8 1
107 weak: 107 87 107 98 rr_2mu8 1
108 medium: 108 87 108 102 rr_2mu8 1
109 medium: 109 87 109 104 rr_2mu8 1
110 weak: 110 87 110 100 rr_2mu8 1
111 strong: 111 87 111 102 rr_2mu8 1
112 medium: 112 87 112 102 rr_2mu8 1
113 medium: 113 87 113 101 rr_2mu8 1
114 medium: 114 87 114 102 rr_2mu8 1
115 medium: 115 87 115 105 rr_2mu8 1
116 medium: 116 87 116 104 rr_2mu8 1
117 medium: 117 87 117 103 rr_2mu8 1
118 weak: 118 87 118 100 rr_2mu8 1
119 strong: 119 87 119 102 rr_2mu8 1
120 strong: 120 87 120 102 rr_2mu8 1
121 weak: 121 87 121 100 rr_2mu8 1
122 strong: 122 87 122 102 rr_2mu8 1
123 medium: 123 87 123 102 rr_2mu8 1
124 medium: 124 87 124 102 rr_2mu8 1
125 weak: 125 87 125 101 rr_2mu8 1
126 medium: 126 87 126 102 rr_2mu8 1
127 medium: 127 87 127 101 rr_2mu8 1
128 medium: 128 87 128 101 rr_2mu8 1
129 weak: 129 87 129 101 rr_2mu8 1
130 strong: 130 87 130 102 rr_2mu8 1
131 strong: 131 87 131 102 rr_2mu8 1
132 strong: 132 87 132 102 rr_2mu8 1
133 medium: 133 87 133 101 rr_2mu8 1
134 weak: 134 87 134 100 rr_2mu8 1
135 medium: 135 87 135 102 rr_2mu8 1
136 medium: 136 87 136 103 rr_2mu8 1
137 medium: 137 87 137 101 rr_2mu8 1
138 medium: 138 87 138 102 rr_2mu8 1
139 weak: 139 87 139 97 rr_2mu8 1
140 weak: 140 87 140 101 rr_2mu8 1
141 weak: 141 87 141 99 rr_2mu8 1
142 weak: 142 87 142 98 rr_2mu8 1
143 weak: 143 87 143 100 rr_2mu8 1
144 weak: 144 87 144 100 rr_2mu8 1
145 medium: 145 87 145 102 rr_2mu8 1
146 medium: 146 87 146 101 rr_2mu8 1
147 strong: 147 87 147 102 rr_2mu8 1
148 strong: 148 87 148 102 rr_2mu8 1
149 strong: 149 87 149 102 rr_2mu8 1
150 strong: 150 87 150 100 rr_2mu8 1
151 strong: 151 87 151 102 rr_2mu8 1
152 strong: 152 87 152 102 rr_2mu8 1
153 medium: 153 87 153 103 rr_2mu8 1
154 strong: 154 87 154 102 rr_2mu8 1
155 strong: 155 87 155 102 rr_2mu8 1
156 medium: 156 87 156 102 rr_2mu8 1
157 strong: 157 87 157 102 rr_2mu8 1
158 medium: 158 87 158 105 rr_2mu8 1
159 strong: 159 87 159 102 rr_2mu8 1
160 strong: 160 87 160 102 rr_2mu8 1
161 medium: 161 87 161 102 rr_2mu8 1
162 medium: 162 87 162 102 rr_2mu8 1
163 strong: 163 87 163 102 rr_2mu8 1
164 strong: 164 87 164 102 rr_2mu8 1
165 medium: 165 87 165 102 rr_2mu8 1
166 medium: 166 87 166 101 rr_2mu8 1
167 weak: 167 87 167 98 rr_2mu8 1
168 strong: 168 87 168 102 rr_2mu8 1
169 strong: 169 87 169 102 rr_2mu8 1
170 weak: 170 87 170 92 rr_2mu8 1
171 medium: 171 87 171 94 rr_2mu8 1
172 medium: 172 87 172 95 rr_2mu8 1
173 strong: 173 87 173 95 rr_2mu8 1
174 strong: 174 87 174 94 rr_2mu8 1
175 strong: 175 87 175 94 rr_2mu8 1
176 strong: 176 87 176 94 rr_2mu8 1
177 strong: 177 87 177 94 rr_2mu8 1
178 strong: 178 87 178 94 rr_2mu8 1
179 strong: 179 87 179 94 rr_2mu8 1
180 strong: 180 87 180 94 rr_2mu8 1
181 weak: 181 87 181 93 rr_2mu8 1
182 weak: 182 87 182 93 rr_2mu8 1
183 strong: 183 87 183 94 rr_2mu8 1
184 strong: 184 87 184 94 rr_2mu8 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 4 1 1 "Not handling restraint 1, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_2mu8 1
2 4 8 1 "Not handling restraint 8, item 1, resonance(s) '1.1.HN' (nmrStar names),'B.1.HA*' (nmrStar names) not linked" rr_2mu8 1
3 4 12 1 "Not handling restraint 12, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_2mu8 1
4 4 50 1 "Not handling restraint 50, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_2mu8 1
5 4 99 1 "Not handling restraint 99, item 1, resonance(s) 'B.1.HA*' (nmrStar names) not linked" rr_2mu8 1
6 4 105 1 "Not handling restraint 105, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_2mu8 1
7 4 105 1 "Not handling restraint 105, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_2mu8 1
8 4 180 1 "Not handling restraint 180, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_2mu8 1
stop_
save_
save_Discover_distance_constraints_3
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode Discover_distance_constraints_3
_Gen_dist_constraint_list.Entry_ID rr_2mu8
_Gen_dist_constraint_list.ID 1
_Gen_dist_constraint_list.Constraint_type "hydrogen bond"
_Gen_dist_constraint_list.Details "Generated by Wattos"
_Gen_dist_constraint_list.Constraint_file_ID 1
_Gen_dist_constraint_list.Block_ID 3
loop_
_Gen_dist_constraint_software.Software_ID
_Gen_dist_constraint_software.Software_label
_Gen_dist_constraint_software.Method_ID
_Gen_dist_constraint_software.Method_label
_Gen_dist_constraint_software.Entry_ID
_Gen_dist_constraint_software.Gen_dist_constraint_list_ID
. . . . rr_2mu8 2
stop_
loop_
_Gen_dist_constraint.ID
_Gen_dist_constraint.Member_ID
_Gen_dist_constraint.Member_logic_code
_Gen_dist_constraint.Assembly_atom_ID_1
_Gen_dist_constraint.Entity_assembly_ID_1
_Gen_dist_constraint.Entity_ID_1
_Gen_dist_constraint.Comp_index_ID_1
_Gen_dist_constraint.Seq_ID_1
_Gen_dist_constraint.Comp_ID_1
_Gen_dist_constraint.Atom_ID_1
_Gen_dist_constraint.Atom_type_1
_Gen_dist_constraint.Atom_isotope_number_1
_Gen_dist_constraint.Resonance_ID_1
_Gen_dist_constraint.Assembly_atom_ID_2
_Gen_dist_constraint.Entity_assembly_ID_2
_Gen_dist_constraint.Entity_ID_2
_Gen_dist_constraint.Comp_index_ID_2
_Gen_dist_constraint.Seq_ID_2
_Gen_dist_constraint.Comp_ID_2
_Gen_dist_constraint.Atom_ID_2
_Gen_dist_constraint.Atom_type_2
_Gen_dist_constraint.Atom_isotope_number_2
_Gen_dist_constraint.Resonance_ID_2
_Gen_dist_constraint.Intensity_val
_Gen_dist_constraint.Intensity_lower_val_err
_Gen_dist_constraint.Intensity_upper_val_err
_Gen_dist_constraint.Distance_val
_Gen_dist_constraint.Distance_lower_bound_val
_Gen_dist_constraint.Distance_upper_bound_val
_Gen_dist_constraint.Contribution_fractional_val
_Gen_dist_constraint.Spectral_peak_ID
_Gen_dist_constraint.Spectral_peak_list_ID
_Gen_dist_constraint.PDB_record_ID_1
_Gen_dist_constraint.PDB_model_num_1
_Gen_dist_constraint.PDB_strand_ID_1
_Gen_dist_constraint.PDB_ins_code_1
_Gen_dist_constraint.PDB_residue_no_1
_Gen_dist_constraint.PDB_residue_name_1
_Gen_dist_constraint.PDB_atom_name_1
_Gen_dist_constraint.PDB_record_ID_2
_Gen_dist_constraint.PDB_model_num_2
_Gen_dist_constraint.PDB_strand_ID_2
_Gen_dist_constraint.PDB_ins_code_2
_Gen_dist_constraint.PDB_residue_no_2
_Gen_dist_constraint.PDB_residue_name_2
_Gen_dist_constraint.PDB_atom_name_2
_Gen_dist_constraint.Auth_entity_assembly_ID_1
_Gen_dist_constraint.Auth_asym_ID_1
_Gen_dist_constraint.Auth_chain_ID_1
_Gen_dist_constraint.Auth_seq_ID_1
_Gen_dist_constraint.Auth_comp_ID_1
_Gen_dist_constraint.Auth_atom_ID_1
_Gen_dist_constraint.Auth_alt_ID_1
_Gen_dist_constraint.Auth_atom_name_1
_Gen_dist_constraint.Auth_entity_assembly_ID_2
_Gen_dist_constraint.Auth_asym_ID_2
_Gen_dist_constraint.Auth_chain_ID_2
_Gen_dist_constraint.Auth_seq_ID_2
_Gen_dist_constraint.Auth_comp_ID_2
_Gen_dist_constraint.Auth_atom_ID_2
_Gen_dist_constraint.Auth_alt_ID_2
_Gen_dist_constraint.Auth_atom_name_2
_Gen_dist_constraint.Entry_ID
_Gen_dist_constraint.Gen_dist_constraint_list_ID
1 1 . . 1 1 10 10 PHE H H . . . 1 1 7 7 SER O O . . . . . . 1.8 2.5 . . . . . A . 10 PHE H . . A . 7 SER O . 1 . 10 PHE HN . . . 1 . 7 SER O . . rr_2mu8 2
2 1 . . 1 1 9 9 THR H H . . . 1 1 6 6 TYR O O . . . . . . 1.8 2.5 . . . . . A . 9 THR H . . A . 6 TYR O . 1 . 9 THR HN . . . 1 . 6 TYR O . . rr_2mu8 2
stop_
loop_
_Gen_dist_constraint_comment_org.ID
_Gen_dist_constraint_comment_org.Comment_text
_Gen_dist_constraint_comment_org.Comment_begin_line
_Gen_dist_constraint_comment_org.Comment_begin_column
_Gen_dist_constraint_comment_org.Comment_end_line
_Gen_dist_constraint_comment_org.Comment_end_column
_Gen_dist_constraint_comment_org.Entry_ID
_Gen_dist_constraint_comment_org.Gen_dist_constraint_list_ID
1 distance 1 1 1 9 rr_2mu8 2
stop_
save_
save_Discover_distance_constraints_4_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Sf_framecode Discover_distance_constraints_4_1
_Distance_constraint_list.Entry_ID rr_2mu8
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Details "Generated by Wattos"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 4
loop_
_Distance_constraint_software.Software_ID
_Distance_constraint_software.Software_label
_Distance_constraint_software.Method_ID
_Distance_constraint_software.Method_label
_Distance_constraint_software.Entry_ID
_Distance_constraint_software.Distance_constraint_list_ID
. . . . rr_2mu8 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_2mu8 1
2 1 . . . rr_2mu8 1
3 1 . . . rr_2mu8 1
4 1 . . . rr_2mu8 1
5 1 . . . rr_2mu8 1
6 1 . . . rr_2mu8 1
7 1 . . . rr_2mu8 1
8 1 . . . rr_2mu8 1
9 1 2 . OR rr_2mu8 1
9 2 . 3 . rr_2mu8 1
9 3 . . . rr_2mu8 1
10 1 . . . rr_2mu8 1
11 1 . . . rr_2mu8 1
12 1 . . . rr_2mu8 1
13 1 2 . OR rr_2mu8 1
13 2 . 3 . rr_2mu8 1
13 3 . . . rr_2mu8 1
14 1 2 . OR rr_2mu8 1
14 2 . 3 . rr_2mu8 1
14 3 . . . rr_2mu8 1
15 1 . . . rr_2mu8 1
16 1 . . . rr_2mu8 1
17 1 . . . rr_2mu8 1
18 1 . . . rr_2mu8 1
19 1 . . . rr_2mu8 1
20 1 . . . rr_2mu8 1
21 1 . . . rr_2mu8 1
22 1 . . . rr_2mu8 1
23 1 . . . rr_2mu8 1
24 1 . . . rr_2mu8 1
25 1 . . . rr_2mu8 1
26 1 . . . rr_2mu8 1
27 1 . . . rr_2mu8 1
28 1 . . . rr_2mu8 1
29 1 . . . rr_2mu8 1
30 1 . . . rr_2mu8 1
31 1 . . . rr_2mu8 1
32 1 2 . OR rr_2mu8 1
32 2 . 3 . rr_2mu8 1
32 3 . . . rr_2mu8 1
33 1 . . . rr_2mu8 1
34 1 2 . OR rr_2mu8 1
34 2 . 3 . rr_2mu8 1
34 3 . . . rr_2mu8 1
35 1 . . . rr_2mu8 1
36 1 . . . rr_2mu8 1
37 1 . . . rr_2mu8 1
38 1 . . . rr_2mu8 1
39 1 . . . rr_2mu8 1
40 1 . . . rr_2mu8 1
41 1 . . . rr_2mu8 1
42 1 . . . rr_2mu8 1
43 1 . . . rr_2mu8 1
44 1 . . . rr_2mu8 1
45 1 . . . rr_2mu8 1
46 1 . . . rr_2mu8 1
47 1 . . . rr_2mu8 1
48 1 . . . rr_2mu8 1
49 1 . . . rr_2mu8 1
50 1 . . . rr_2mu8 1
51 1 . . . rr_2mu8 1
52 1 . . . rr_2mu8 1
53 1 . . . rr_2mu8 1
54 1 . . . rr_2mu8 1
55 1 . . . rr_2mu8 1
56 1 . . . rr_2mu8 1
57 1 . . . rr_2mu8 1
58 1 . . . rr_2mu8 1
59 1 . . . rr_2mu8 1
60 1 . . . rr_2mu8 1
61 1 . . . rr_2mu8 1
62 1 2 . OR rr_2mu8 1
62 2 . 3 . rr_2mu8 1
62 3 . . . rr_2mu8 1
63 1 2 . OR rr_2mu8 1
63 2 . 3 . rr_2mu8 1
63 3 . . . rr_2mu8 1
64 1 2 . OR rr_2mu8 1
64 2 . 3 . rr_2mu8 1
64 3 . . . rr_2mu8 1
65 1 2 . OR rr_2mu8 1
65 2 . 3 . rr_2mu8 1
65 3 . . . rr_2mu8 1
66 1 . . . rr_2mu8 1
67 1 . . . rr_2mu8 1
68 1 . . . rr_2mu8 1
69 1 . . . rr_2mu8 1
70 1 2 . OR rr_2mu8 1
70 2 . 3 . rr_2mu8 1
70 3 . . . rr_2mu8 1
71 1 2 . OR rr_2mu8 1
71 2 . 3 . rr_2mu8 1
71 3 . . . rr_2mu8 1
72 1 . . . rr_2mu8 1
73 1 2 . OR rr_2mu8 1
73 2 . 3 . rr_2mu8 1
73 3 . . . rr_2mu8 1
74 1 . . . rr_2mu8 1
75 1 . . . rr_2mu8 1
76 1 . . . rr_2mu8 1
77 1 . . . rr_2mu8 1
78 1 . . . rr_2mu8 1
79 1 . . . rr_2mu8 1
80 1 . . . rr_2mu8 1
81 1 . . . rr_2mu8 1
82 1 . . . rr_2mu8 1
83 1 . . . rr_2mu8 1
84 1 . . . rr_2mu8 1
85 1 . . . rr_2mu8 1
86 1 . . . rr_2mu8 1
87 1 . . . rr_2mu8 1
88 1 . . . rr_2mu8 1
89 1 2 . OR rr_2mu8 1
89 2 . 3 . rr_2mu8 1
89 3 . . . rr_2mu8 1
90 1 2 . OR rr_2mu8 1
90 2 . 3 . rr_2mu8 1
90 3 . . . rr_2mu8 1
91 1 . . . rr_2mu8 1
92 1 . . . rr_2mu8 1
93 1 . . . rr_2mu8 1
94 1 . . . rr_2mu8 1
95 1 . . . rr_2mu8 1
96 1 . . . rr_2mu8 1
97 1 . . . rr_2mu8 1
98 1 2 . OR rr_2mu8 1
98 2 . 3 . rr_2mu8 1
98 3 . . . rr_2mu8 1
99 1 . . . rr_2mu8 1
100 1 . . . rr_2mu8 1
101 1 . . . rr_2mu8 1
102 1 . . . rr_2mu8 1
103 1 . . . rr_2mu8 1
104 1 . . . rr_2mu8 1
105 1 . . . rr_2mu8 1
106 1 . . . rr_2mu8 1
107 1 . . . rr_2mu8 1
108 1 2 . OR rr_2mu8 1
108 2 . 3 . rr_2mu8 1
108 3 . . . rr_2mu8 1
109 1 . . . rr_2mu8 1
110 1 . . . rr_2mu8 1
111 1 . . . rr_2mu8 1
112 1 . . . rr_2mu8 1
113 1 . . . rr_2mu8 1
114 1 . . . rr_2mu8 1
115 1 . . . rr_2mu8 1
116 1 . . . rr_2mu8 1
117 1 . . . rr_2mu8 1
118 1 . . . rr_2mu8 1
119 1 . . . rr_2mu8 1
120 1 . . . rr_2mu8 1
121 1 . . . rr_2mu8 1
122 1 . . . rr_2mu8 1
123 1 . . . rr_2mu8 1
124 1 . . . rr_2mu8 1
125 1 . . . rr_2mu8 1
126 1 . . . rr_2mu8 1
127 1 2 . OR rr_2mu8 1
127 2 . 3 . rr_2mu8 1
127 3 . . . rr_2mu8 1
128 1 . . . rr_2mu8 1
129 1 . . . rr_2mu8 1
130 1 . . . rr_2mu8 1
131 1 . . . rr_2mu8 1
132 1 2 . OR rr_2mu8 1
132 2 . 3 . rr_2mu8 1
132 3 . . . rr_2mu8 1
133 1 . . . rr_2mu8 1
134 1 . . . rr_2mu8 1
135 1 . . . rr_2mu8 1
136 1 . . . rr_2mu8 1
137 1 . . . rr_2mu8 1
138 1 . . . rr_2mu8 1
139 1 . . . rr_2mu8 1
140 1 . . . rr_2mu8 1
141 1 . . . rr_2mu8 1
142 1 . . . rr_2mu8 1
143 1 . . . rr_2mu8 1
144 1 . . . rr_2mu8 1
145 1 . . . rr_2mu8 1
146 1 . . . rr_2mu8 1
147 1 . . . rr_2mu8 1
148 1 . . . rr_2mu8 1
149 1 . . . rr_2mu8 1
150 1 . . . rr_2mu8 1
151 1 . . . rr_2mu8 1
152 1 . . . rr_2mu8 1
153 1 . . . rr_2mu8 1
154 1 . . . rr_2mu8 1
155 1 . . . rr_2mu8 1
156 1 . . . rr_2mu8 1
157 1 . . . rr_2mu8 1
158 1 . . . rr_2mu8 1
159 1 . . . rr_2mu8 1
160 1 . . . rr_2mu8 1
161 1 . . . rr_2mu8 1
162 1 . . . rr_2mu8 1
163 1 . . . rr_2mu8 1
164 1 . . . rr_2mu8 1
165 1 . . . rr_2mu8 1
166 1 . . . rr_2mu8 1
167 1 . . . rr_2mu8 1
168 1 . . . rr_2mu8 1
169 1 . . . rr_2mu8 1
170 1 . . . rr_2mu8 1
171 1 . . . rr_2mu8 1
172 1 . . . rr_2mu8 1
173 1 . . . rr_2mu8 1
174 1 . . . rr_2mu8 1
175 1 . . . rr_2mu8 1
176 1 . . . rr_2mu8 1
177 1 . . . rr_2mu8 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 ASN H H . . 1 . 2 ASN HN rr_2mu8 1
1 1 . 2 . 1 1 2 2 ASN HA H . . 1 . 2 ASN HA rr_2mu8 1
2 1 . 1 . 1 1 3 3 GLU H H . . 1 . 3 GLU HN rr_2mu8 1
2 1 . 2 . 1 1 3 3 GLU HA H . . 1 . 3 GLU HA rr_2mu8 1
3 1 . 1 . 1 1 4 4 SER H H . . 1 . 4 SER HN rr_2mu8 1
3 1 . 2 . 1 1 4 4 SER HA H . . 1 . 4 SER HA rr_2mu8 1
4 1 . 1 . 1 1 5 5 LYS H H . . 1 . 5 LYS HN rr_2mu8 1
4 1 . 2 . 1 1 5 5 LYS HA H . . 1 . 5 LYS HA rr_2mu8 1
5 1 . 1 . 1 1 18 18 SER H H . . 1 . 18 SER HN rr_2mu8 1
5 1 . 2 . 1 1 17 17 MET HB2 H . . 1 . 17 MET HBS rr_2mu8 1
6 1 . 1 . 1 1 18 18 SER H H . . 1 . 18 SER HN rr_2mu8 1
6 1 . 2 . 1 1 17 17 MET HB3 H . . 1 . 17 MET HBR rr_2mu8 1
7 1 . 1 . 1 1 2 2 ASN H H . . 1 . 2 ASN HN rr_2mu8 1
7 1 . 2 . 1 1 2 2 ASN HB3 H . . 1 . 2 ASN HBR rr_2mu8 1
8 1 . 1 . 1 1 2 2 ASN H H . . 1 . 2 ASN HN rr_2mu8 1
8 1 . 2 . 1 1 2 2 ASN HB2 H . . 1 . 2 ASN HBS rr_2mu8 1
9 2 . 1 . 1 1 4 4 SER H H . . 1 . 4 SER HN rr_2mu8 1
9 2 . 2 . 1 1 4 4 SER HB2 H . . 1 . 4 SER HB* rr_2mu8 1
9 3 . 1 . 1 1 4 4 SER H H . . 1 . 4 SER HN rr_2mu8 1
9 3 . 2 . 1 1 4 4 SER HB3 H . . 1 . 4 SER HB* rr_2mu8 1
10 1 . 1 . 1 1 5 5 LYS H H . . 1 . 5 LYS HN rr_2mu8 1
10 1 . 2 . 1 1 5 5 LYS HB3 H . . 1 . 5 LYS HBS rr_2mu8 1
11 1 . 1 . 1 1 5 5 LYS H H . . 1 . 5 LYS HN rr_2mu8 1
11 1 . 2 . 1 1 5 5 LYS HB2 H . . 1 . 5 LYS HBR rr_2mu8 1
12 1 . 1 . 1 1 6 6 TYR H H . . 1 . 6 TYR HN rr_2mu8 1
12 1 . 2 . 1 1 6 6 TYR HA H . . 1 . 6 TYR HA rr_2mu8 1
13 2 . 1 . 1 1 6 6 TYR H H . . 1 . 6 TYR HN rr_2mu8 1
13 2 . 2 . 1 1 6 6 TYR HB2 H . . 1 . 6 TYR HB* rr_2mu8 1
13 3 . 1 . 1 1 6 6 TYR H H . . 1 . 6 TYR HN rr_2mu8 1
13 3 . 2 . 1 1 6 6 TYR HB3 H . . 1 . 6 TYR HB* rr_2mu8 1
14 2 . 1 . 1 1 6 6 TYR H H . . 1 . 6 TYR HN rr_2mu8 1
14 2 . 2 . 1 1 4 4 SER HB2 H . . 1 . 4 SER HB* rr_2mu8 1
14 3 . 1 . 1 1 6 6 TYR H H . . 1 . 6 TYR HN rr_2mu8 1
14 3 . 2 . 1 1 4 4 SER HB3 H . . 1 . 4 SER HB* rr_2mu8 1
15 1 . 1 . 1 1 7 7 SER H H . . 1 . 7 SER HN rr_2mu8 1
15 1 . 2 . 1 1 7 7 SER HA H . . 1 . 7 SER HA rr_2mu8 1
16 1 . 1 . 1 1 7 7 SER H H . . 1 . 7 SER HN rr_2mu8 1
16 1 . 2 . 1 1 6 6 TYR HA H . . 1 . 6 TYR HA rr_2mu8 1
17 1 . 1 . 1 1 8 8 ASN H H . . 1 . 8 ASN HN rr_2mu8 1
17 1 . 2 . 1 1 8 8 ASN HA H . . 1 . 8 ASN HA rr_2mu8 1
18 1 . 1 . 1 1 9 9 THR H H . . 1 . 9 THR HN rr_2mu8 1
18 1 . 2 . 1 1 9 9 THR HB H . . 1 . 9 THR HB rr_2mu8 1
19 1 . 1 . 1 1 9 9 THR H H . . 1 . 9 THR HN rr_2mu8 1
19 1 . 2 . 1 1 9 9 THR HA H . . 1 . 9 THR HA rr_2mu8 1
20 1 . 1 . 1 1 10 10 PHE H H . . 1 . 10 PHE HN rr_2mu8 1
20 1 . 2 . 1 1 10 10 PHE HA H . . 1 . 10 PHE HA rr_2mu8 1
21 1 . 1 . 1 1 11 11 ILE H H . . 1 . 11 ILE HN rr_2mu8 1
21 1 . 2 . 1 1 10 10 PHE HB3 H . . 1 . 10 PHE HBS rr_2mu8 1
22 1 . 1 . 1 1 11 11 ILE H H . . 1 . 11 ILE HN rr_2mu8 1
22 1 . 2 . 1 1 10 10 PHE HB2 H . . 1 . 10 PHE HBR rr_2mu8 1
23 1 . 1 . 1 1 11 11 ILE H H . . 1 . 11 ILE HN rr_2mu8 1
23 1 . 2 . 1 1 11 11 ILE HA H . . 1 . 11 ILE HA rr_2mu8 1
24 1 . 1 . 1 1 12 12 ASN H H . . 1 . 12 ASN HN rr_2mu8 1
24 1 . 2 . 1 1 12 12 ASN HA H . . 1 . 12 ASN HA rr_2mu8 1
25 1 . 1 . 1 1 13 13 ASN H H . . 1 . 13 ASN HN rr_2mu8 1
25 1 . 2 . 1 1 13 13 ASN HA H . . 1 . 13 ASN HA rr_2mu8 1
26 1 . 1 . 1 1 15 15 TYR H H . . 1 . 15 TYR HN rr_2mu8 1
26 1 . 2 . 1 1 15 15 TYR HA H . . 1 . 15 TYR HA rr_2mu8 1
27 1 . 1 . 1 1 14 14 ALA H H . . 1 . 14 ALA HN rr_2mu8 1
27 1 . 2 . 1 1 14 14 ALA HA H . . 1 . 14 ALA HA rr_2mu8 1
28 1 . 1 . 1 1 15 15 TYR H H . . 1 . 15 TYR HN rr_2mu8 1
28 1 . 2 . 1 1 15 15 TYR HB2 H . . 1 . 15 TYR HBR rr_2mu8 1
29 1 . 1 . 1 1 15 15 TYR H H . . 1 . 15 TYR HN rr_2mu8 1
29 1 . 2 . 1 1 15 15 TYR HB3 H . . 1 . 15 TYR HBS rr_2mu8 1
30 1 . 1 . 1 1 17 17 MET H H . . 1 . 17 MET HN rr_2mu8 1
30 1 . 2 . 1 1 17 17 MET HA H . . 1 . 17 MET HA rr_2mu8 1
31 1 . 1 . 1 1 18 18 SER H H . . 1 . 18 SER HN rr_2mu8 1
31 1 . 2 . 1 1 18 18 SER HA H . . 1 . 18 SER HA rr_2mu8 1
32 2 . 1 . 1 1 18 18 SER H H . . 1 . 18 SER HN rr_2mu8 1
32 2 . 2 . 1 1 18 18 SER HB2 H . . 1 . 18 SER HB* rr_2mu8 1
32 3 . 1 . 1 1 18 18 SER H H . . 1 . 18 SER HN rr_2mu8 1
32 3 . 2 . 1 1 18 18 SER HB3 H . . 1 . 18 SER HB* rr_2mu8 1
33 1 . 1 . 1 1 19 19 ILE H H . . 1 . 19 ILE HN rr_2mu8 1
33 1 . 2 . 1 1 19 19 ILE HA H . . 1 . 19 ILE HA rr_2mu8 1
34 2 . 1 . 1 1 19 19 ILE H H . . 1 . 19 ILE HN rr_2mu8 1
34 2 . 2 . 1 1 18 18 SER HB2 H . . 1 . 18 SER HB* rr_2mu8 1
34 3 . 1 . 1 1 19 19 ILE H H . . 1 . 19 ILE HN rr_2mu8 1
34 3 . 2 . 1 1 18 18 SER HB3 H . . 1 . 18 SER HB* rr_2mu8 1
35 1 . 1 . 1 1 2 2 ASN H H . . 1 . 2 ASN HN rr_2mu8 1
35 1 . 2 . 1 1 1 1 LYS HA H . . 1 . 1 LYS HA rr_2mu8 1
36 1 . 1 . 1 1 3 3 GLU H H . . 1 . 3 GLU HN rr_2mu8 1
36 1 . 2 . 1 1 2 2 ASN HA H . . 1 . 2 ASN HA rr_2mu8 1
37 1 . 1 . 1 1 5 5 LYS H H . . 1 . 5 LYS HN rr_2mu8 1
37 1 . 2 . 1 1 4 4 SER HA H . . 1 . 4 SER HA rr_2mu8 1
38 1 . 1 . 1 1 6 6 TYR H H . . 1 . 6 TYR HN rr_2mu8 1
38 1 . 2 . 1 1 5 5 LYS HA H . . 1 . 5 LYS HA rr_2mu8 1
39 1 . 1 . 1 1 8 8 ASN H H . . 1 . 8 ASN HN rr_2mu8 1
39 1 . 2 . 1 1 7 7 SER HA H . . 1 . 7 SER HA rr_2mu8 1
40 1 . 1 . 1 1 9 9 THR H H . . 1 . 9 THR HN rr_2mu8 1
40 1 . 2 . 1 1 8 8 ASN HA H . . 1 . 8 ASN HA rr_2mu8 1
41 1 . 1 . 1 1 10 10 PHE H H . . 1 . 10 PHE HN rr_2mu8 1
41 1 . 2 . 1 1 9 9 THR HB H . . 1 . 9 THR HB rr_2mu8 1
42 1 . 1 . 1 1 10 10 PHE H H . . 1 . 10 PHE HN rr_2mu8 1
42 1 . 2 . 1 1 9 9 THR HA H . . 1 . 9 THR HA rr_2mu8 1
43 1 . 1 . 1 1 11 11 ILE H H . . 1 . 11 ILE HN rr_2mu8 1
43 1 . 2 . 1 1 10 10 PHE HA H . . 1 . 10 PHE HA rr_2mu8 1
44 1 . 1 . 1 1 12 12 ASN H H . . 1 . 12 ASN HN rr_2mu8 1
44 1 . 2 . 1 1 11 11 ILE HA H . . 1 . 11 ILE HA rr_2mu8 1
45 1 . 1 . 1 1 15 15 TYR H H . . 1 . 15 TYR HN rr_2mu8 1
45 1 . 2 . 1 1 14 14 ALA HA H . . 1 . 14 ALA HA rr_2mu8 1
46 1 . 1 . 1 1 19 19 ILE H H . . 1 . 19 ILE HN rr_2mu8 1
46 1 . 2 . 1 1 18 18 SER HA H . . 1 . 18 SER HA rr_2mu8 1
47 1 . 1 . 1 1 9 9 THR H H . . 1 . 9 THR HN rr_2mu8 1
47 1 . 2 . 1 1 7 7 SER HA H . . 1 . 7 SER HA rr_2mu8 1
48 1 . 1 . 1 1 13 13 ASN HD21 H . . 1 . 13 ASN HD21 rr_2mu8 1
48 1 . 2 . 1 1 13 13 ASN HA H . . 1 . 13 ASN HA rr_2mu8 1
49 1 . 1 . 1 1 8 8 ASN HD21 H . . 1 . 8 ASN HD21 rr_2mu8 1
49 1 . 2 . 1 1 8 8 ASN HA H . . 1 . 8 ASN HA rr_2mu8 1
50 1 . 1 . 1 1 10 10 PHE QD H . . 1 . 10 PHE HD* rr_2mu8 1
50 1 . 2 . 1 1 10 10 PHE HA H . . 1 . 10 PHE HA rr_2mu8 1
51 1 . 1 . 1 1 6 6 TYR QD H . . 1 . 6 TYR HD* rr_2mu8 1
51 1 . 2 . 1 1 6 6 TYR HA H . . 1 . 6 TYR HA rr_2mu8 1
52 1 . 1 . 1 1 16 16 ASN HD22 H . . 1 . 16 ASN HD22 rr_2mu8 1
52 1 . 2 . 1 1 16 16 ASN HA H . . 1 . 16 ASN HA rr_2mu8 1
53 1 . 1 . 1 1 8 8 ASN HD22 H . . 1 . 8 ASN HD22 rr_2mu8 1
53 1 . 2 . 1 1 8 8 ASN HA H . . 1 . 8 ASN HA rr_2mu8 1
54 1 . 1 . 1 1 15 15 TYR QD H . . 1 . 15 TYR HD* rr_2mu8 1
54 1 . 2 . 1 1 15 15 TYR HA H . . 1 . 15 TYR HA rr_2mu8 1
55 1 . 1 . 1 1 10 10 PHE QD H . . 1 . 10 PHE HD* rr_2mu8 1
55 1 . 2 . 1 1 9 9 THR HA H . . 1 . 9 THR HA rr_2mu8 1
56 1 . 1 . 1 1 6 6 TYR QD H . . 1 . 6 TYR HD* rr_2mu8 1
56 1 . 2 . 1 1 5 5 LYS HA H . . 1 . 5 LYS HA rr_2mu8 1
57 1 . 1 . 1 1 15 15 TYR QD H . . 1 . 15 TYR HD* rr_2mu8 1
57 1 . 2 . 1 1 14 14 ALA HA H . . 1 . 14 ALA HA rr_2mu8 1
58 1 . 1 . 1 1 10 10 PHE QD H . . 1 . 10 PHE HD* rr_2mu8 1
58 1 . 2 . 1 1 9 9 THR HB H . . 1 . 9 THR HB rr_2mu8 1
59 1 . 1 . 1 1 15 15 TYR QE H . . 1 . 15 TYR HE* rr_2mu8 1
59 1 . 2 . 1 1 15 15 TYR HA H . . 1 . 15 TYR HA rr_2mu8 1
60 1 . 1 . 1 1 6 6 TYR QE H . . 1 . 6 TYR HE* rr_2mu8 1
60 1 . 2 . 1 1 6 6 TYR HA H . . 1 . 6 TYR HA rr_2mu8 1
61 1 . 1 . 1 1 16 16 ASN HD21 H . . 1 . 16 ASN HD21 rr_2mu8 1
61 1 . 2 . 1 1 16 16 ASN HA H . . 1 . 16 ASN HA rr_2mu8 1
62 2 . 1 . 1 1 8 8 ASN H H . . 1 . 8 ASN HN rr_2mu8 1
62 2 . 2 . 1 1 7 7 SER HB2 H . . 1 . 7 SER HB* rr_2mu8 1
62 3 . 1 . 1 1 8 8 ASN H H . . 1 . 8 ASN HN rr_2mu8 1
62 3 . 2 . 1 1 7 7 SER HB3 H . . 1 . 7 SER HB* rr_2mu8 1
63 2 . 1 . 1 1 7 7 SER H H . . 1 . 7 SER HN rr_2mu8 1
63 2 . 2 . 1 1 7 7 SER HB2 H . . 1 . 7 SER HB* rr_2mu8 1
63 3 . 1 . 1 1 7 7 SER H H . . 1 . 7 SER HN rr_2mu8 1
63 3 . 2 . 1 1 7 7 SER HB3 H . . 1 . 7 SER HB* rr_2mu8 1
64 2 . 1 . 1 1 5 5 LYS H H . . 1 . 5 LYS HN rr_2mu8 1
64 2 . 2 . 1 1 4 4 SER HB2 H . . 1 . 4 SER HB* rr_2mu8 1
64 3 . 1 . 1 1 5 5 LYS H H . . 1 . 5 LYS HN rr_2mu8 1
64 3 . 2 . 1 1 4 4 SER HB3 H . . 1 . 4 SER HB* rr_2mu8 1
65 2 . 1 . 1 1 6 6 TYR QD H . . 1 . 6 TYR HD* rr_2mu8 1
65 2 . 2 . 1 1 4 4 SER HB2 H . . 1 . 4 SER HB* rr_2mu8 1
65 3 . 1 . 1 1 6 6 TYR QD H . . 1 . 6 TYR HD* rr_2mu8 1
65 3 . 2 . 1 1 4 4 SER HB3 H . . 1 . 4 SER HB* rr_2mu8 1
66 1 . 1 . 1 1 8 8 ASN H H . . 1 . 8 ASN HN rr_2mu8 1
66 1 . 2 . 1 1 8 8 ASN HB3 H . . 1 . 8 ASN HBR rr_2mu8 1
67 1 . 1 . 1 1 8 8 ASN H H . . 1 . 8 ASN HN rr_2mu8 1
67 1 . 2 . 1 1 8 8 ASN HB2 H . . 1 . 8 ASN HBS rr_2mu8 1
68 1 . 1 . 1 1 13 13 ASN H H . . 1 . 13 ASN HN rr_2mu8 1
68 1 . 2 . 1 1 13 13 ASN HB3 H . . 1 . 13 ASN HBR rr_2mu8 1
69 1 . 1 . 1 1 13 13 ASN H H . . 1 . 13 ASN HN rr_2mu8 1
69 1 . 2 . 1 1 13 13 ASN HB2 H . . 1 . 13 ASN HBS rr_2mu8 1
70 2 . 1 . 1 1 7 7 SER H H . . 1 . 7 SER HN rr_2mu8 1
70 2 . 2 . 1 1 6 6 TYR HB2 H . . 1 . 6 TYR HB* rr_2mu8 1
70 3 . 1 . 1 1 7 7 SER H H . . 1 . 7 SER HN rr_2mu8 1
70 3 . 2 . 1 1 6 6 TYR HB3 H . . 1 . 6 TYR HB* rr_2mu8 1
71 2 . 1 . 1 1 18 18 SER H H . . 1 . 18 SER HN rr_2mu8 1
71 2 . 2 . 1 1 17 17 MET HG2 H . . 1 . 17 MET HG* rr_2mu8 1
71 3 . 1 . 1 1 18 18 SER H H . . 1 . 18 SER HN rr_2mu8 1
71 3 . 2 . 1 1 17 17 MET HG3 H . . 1 . 17 MET HG* rr_2mu8 1
72 1 . 1 . 1 1 16 16 ASN H H . . 1 . 16 ASN HN rr_2mu8 1
72 1 . 2 . 1 1 16 16 ASN HB3 H . . 1 . 16 ASN HBR rr_2mu8 1
73 2 . 1 . 1 1 17 17 MET H H . . 1 . 17 MET HN rr_2mu8 1
73 2 . 2 . 1 1 17 17 MET HG2 H . . 1 . 17 MET HG* rr_2mu8 1
73 3 . 1 . 1 1 17 17 MET H H . . 1 . 17 MET HN rr_2mu8 1
73 3 . 2 . 1 1 17 17 MET HG3 H . . 1 . 17 MET HG* rr_2mu8 1
74 1 . 1 . 1 1 3 3 GLU H H . . 1 . 3 GLU HN rr_2mu8 1
74 1 . 2 . 1 1 2 2 ASN HB3 H . . 1 . 2 ASN HBR rr_2mu8 1
75 1 . 1 . 1 1 16 16 ASN H H . . 1 . 16 ASN HN rr_2mu8 1
75 1 . 2 . 1 1 16 16 ASN HB2 H . . 1 . 16 ASN HBS rr_2mu8 1
76 1 . 1 . 1 1 10 10 PHE H H . . 1 . 10 PHE HN rr_2mu8 1
76 1 . 2 . 1 1 10 10 PHE HB3 H . . 1 . 10 PHE HBS rr_2mu8 1
77 1 . 1 . 1 1 10 10 PHE H H . . 1 . 10 PHE HN rr_2mu8 1
77 1 . 2 . 1 1 10 10 PHE HB2 H . . 1 . 10 PHE HBR rr_2mu8 1
78 1 . 1 . 1 1 10 10 PHE QD H . . 1 . 10 PHE HD* rr_2mu8 1
78 1 . 2 . 1 1 10 10 PHE HB2 H . . 1 . 10 PHE HBR rr_2mu8 1
79 1 . 1 . 1 1 15 15 TYR QD H . . 1 . 15 TYR HD* rr_2mu8 1
79 1 . 2 . 1 1 15 15 TYR HB2 H . . 1 . 15 TYR HBR rr_2mu8 1
80 1 . 1 . 1 1 10 10 PHE QD H . . 1 . 10 PHE HD* rr_2mu8 1
80 1 . 2 . 1 1 8 8 ASN HB3 H . . 1 . 8 ASN HBR rr_2mu8 1
81 1 . 1 . 1 1 10 10 PHE QD H . . 1 . 10 PHE HD* rr_2mu8 1
81 1 . 2 . 1 1 8 8 ASN HB2 H . . 1 . 8 ASN HBS rr_2mu8 1
82 1 . 1 . 1 1 9 9 THR H H . . 1 . 9 THR HN rr_2mu8 1
82 1 . 2 . 1 1 8 8 ASN HB3 H . . 1 . 8 ASN HBR rr_2mu8 1
83 1 . 1 . 1 1 9 9 THR H H . . 1 . 9 THR HN rr_2mu8 1
83 1 . 2 . 1 1 8 8 ASN HB2 H . . 1 . 8 ASN HBS rr_2mu8 1
84 1 . 1 . 1 1 3 3 GLU H H . . 1 . 3 GLU HN rr_2mu8 1
84 1 . 2 . 1 1 2 2 ASN HB2 H . . 1 . 2 ASN HBS rr_2mu8 1
85 1 . 1 . 1 1 17 17 MET H H . . 1 . 17 MET HN rr_2mu8 1
85 1 . 2 . 1 1 16 16 ASN HB2 H . . 1 . 16 ASN HBS rr_2mu8 1
86 1 . 1 . 1 1 10 10 PHE QD H . . 1 . 10 PHE HD* rr_2mu8 1
86 1 . 2 . 1 1 10 10 PHE HB3 H . . 1 . 10 PHE HBS rr_2mu8 1
87 1 . 1 . 1 1 15 15 TYR QD H . . 1 . 15 TYR HD* rr_2mu8 1
87 1 . 2 . 1 1 15 15 TYR HB3 H . . 1 . 15 TYR HBS rr_2mu8 1
88 1 . 1 . 1 1 16 16 ASN HD22 H . . 1 . 16 ASN HD22 rr_2mu8 1
88 1 . 2 . 1 1 16 16 ASN HB2 H . . 1 . 16 ASN HBS rr_2mu8 1
89 2 . 1 . 1 1 4 4 SER H H . . 1 . 4 SER HN rr_2mu8 1
89 2 . 2 . 1 1 3 3 GLU HG2 H . . 1 . 3 GLU HG* rr_2mu8 1
89 3 . 1 . 1 1 4 4 SER H H . . 1 . 4 SER HN rr_2mu8 1
89 3 . 2 . 1 1 3 3 GLU HG3 H . . 1 . 3 GLU HG* rr_2mu8 1
90 2 . 1 . 1 1 3 3 GLU H H . . 1 . 3 GLU HN rr_2mu8 1
90 2 . 2 . 1 1 3 3 GLU HG2 H . . 1 . 3 GLU HG* rr_2mu8 1
90 3 . 1 . 1 1 3 3 GLU H H . . 1 . 3 GLU HN rr_2mu8 1
90 3 . 2 . 1 1 3 3 GLU HG3 H . . 1 . 3 GLU HG* rr_2mu8 1
91 1 . 1 . 1 1 4 4 SER H H . . 1 . 4 SER HN rr_2mu8 1
91 1 . 2 . 1 1 3 3 GLU HB2 H . . 1 . 3 GLU HBR rr_2mu8 1
92 1 . 1 . 1 1 17 17 MET H H . . 1 . 17 MET HN rr_2mu8 1
92 1 . 2 . 1 1 17 17 MET HB2 H . . 1 . 17 MET HBS rr_2mu8 1
93 1 . 1 . 1 1 3 3 GLU H H . . 1 . 3 GLU HN rr_2mu8 1
93 1 . 2 . 1 1 3 3 GLU HB2 H . . 1 . 3 GLU HBR rr_2mu8 1
94 1 . 1 . 1 1 19 19 ILE H H . . 1 . 19 ILE HN rr_2mu8 1
94 1 . 2 . 1 1 19 19 ILE HB H . . 1 . 19 ILE HB rr_2mu8 1
95 1 . 1 . 1 1 12 12 ASN H H . . 1 . 12 ASN HN rr_2mu8 1
95 1 . 2 . 1 1 11 11 ILE HB H . . 1 . 11 ILE HB rr_2mu8 1
96 1 . 1 . 1 1 2 2 ASN H H . . 1 . 2 ASN HN rr_2mu8 1
96 1 . 2 . 1 1 1 1 LYS HB2 H . . 1 . 1 LYS HBR rr_2mu8 1
97 1 . 1 . 1 1 2 2 ASN H H . . 1 . 2 ASN HN rr_2mu8 1
97 1 . 2 . 1 1 1 1 LYS HB3 H . . 1 . 1 LYS HBS rr_2mu8 1
98 2 . 1 . 1 1 2 2 ASN H H . . 1 . 2 ASN HN rr_2mu8 1
98 2 . 2 . 1 1 1 1 LYS HG2 H . . 1 . 1 LYS HG* rr_2mu8 1
98 3 . 1 . 1 1 2 2 ASN H H . . 1 . 2 ASN HN rr_2mu8 1
98 3 . 2 . 1 1 1 1 LYS HG3 H . . 1 . 1 LYS HG* rr_2mu8 1
99 1 . 1 . 1 1 12 12 ASN H H . . 1 . 12 ASN HN rr_2mu8 1
99 1 . 2 . 1 1 11 11 ILE HG12 H . . 1 . 11 ILE HG1R rr_2mu8 1
100 1 . 1 . 1 1 19 19 ILE H H . . 1 . 19 ILE HN rr_2mu8 1
100 1 . 2 . 1 1 19 19 ILE HG12 H . . 1 . 19 ILE HG1R rr_2mu8 1
101 1 . 1 . 1 1 11 11 ILE H H . . 1 . 11 ILE HN rr_2mu8 1
101 1 . 2 . 1 1 11 11 ILE HG12 H . . 1 . 11 ILE HG1R rr_2mu8 1
102 1 . 1 . 1 1 6 6 TYR H H . . 1 . 6 TYR HN rr_2mu8 1
102 1 . 2 . 1 1 5 5 LYS HB3 H . . 1 . 5 LYS HBS rr_2mu8 1
103 1 . 1 . 1 1 6 6 TYR H H . . 1 . 6 TYR HN rr_2mu8 1
103 1 . 2 . 1 1 5 5 LYS HB2 H . . 1 . 5 LYS HBR rr_2mu8 1
104 1 . 1 . 1 1 11 11 ILE H H . . 1 . 11 ILE HN rr_2mu8 1
104 1 . 2 . 1 1 11 11 ILE HB H . . 1 . 11 ILE HB rr_2mu8 1
105 1 . 1 . 1 1 4 4 SER H H . . 1 . 4 SER HN rr_2mu8 1
105 1 . 2 . 1 1 3 3 GLU HB3 H . . 1 . 3 GLU HBS rr_2mu8 1
106 1 . 1 . 1 1 3 3 GLU H H . . 1 . 3 GLU HN rr_2mu8 1
106 1 . 2 . 1 1 3 3 GLU HB3 H . . 1 . 3 GLU HBS rr_2mu8 1
107 1 . 1 . 1 1 17 17 MET H H . . 1 . 17 MET HN rr_2mu8 1
107 1 . 2 . 1 1 17 17 MET HB3 H . . 1 . 17 MET HBR rr_2mu8 1
108 2 . 1 . 1 1 5 5 LYS H H . . 1 . 5 LYS HN rr_2mu8 1
108 2 . 2 . 1 1 5 5 LYS HG2 H . . 1 . 5 LYS HG* rr_2mu8 1
108 3 . 1 . 1 1 5 5 LYS H H . . 1 . 5 LYS HN rr_2mu8 1
108 3 . 2 . 1 1 5 5 LYS HG3 H . . 1 . 5 LYS HG* rr_2mu8 1
109 1 . 1 . 1 1 12 12 ASN H H . . 1 . 12 ASN HN rr_2mu8 1
109 1 . 2 . 1 1 11 11 ILE MD H . . 1 . 11 ILE HD1* rr_2mu8 1
110 1 . 1 . 1 1 11 11 ILE H H . . 1 . 11 ILE HN rr_2mu8 1
110 1 . 2 . 1 1 11 11 ILE MD H . . 1 . 11 ILE HD1* rr_2mu8 1
111 1 . 1 . 1 1 19 19 ILE H H . . 1 . 19 ILE HN rr_2mu8 1
111 1 . 2 . 1 1 19 19 ILE MD H . . 1 . 19 ILE HD1* rr_2mu8 1
112 1 . 1 . 1 1 9 9 THR H H . . 1 . 9 THR HN rr_2mu8 1
112 1 . 2 . 1 1 9 9 THR MG H . . 1 . 9 THR HG2* rr_2mu8 1
113 1 . 1 . 1 1 14 14 ALA H H . . 1 . 14 ALA HN rr_2mu8 1
113 1 . 2 . 1 1 14 14 ALA MB H . . 1 . 14 ALA HB* rr_2mu8 1
114 1 . 1 . 1 1 16 16 ASN H H . . 1 . 16 ASN HN rr_2mu8 1
114 1 . 2 . 1 1 14 14 ALA MB H . . 1 . 14 ALA HB* rr_2mu8 1
115 1 . 1 . 1 1 15 15 TYR H H . . 1 . 15 TYR HN rr_2mu8 1
115 1 . 2 . 1 1 14 14 ALA MB H . . 1 . 14 ALA HB* rr_2mu8 1
116 1 . 1 . 1 1 11 11 ILE H H . . 1 . 11 ILE HN rr_2mu8 1
116 1 . 2 . 1 1 11 11 ILE HG13 H . . 1 . 11 ILE HG1S rr_2mu8 1
117 1 . 1 . 1 1 12 12 ASN H H . . 1 . 12 ASN HN rr_2mu8 1
117 1 . 2 . 1 1 11 11 ILE HG13 H . . 1 . 11 ILE HG1S rr_2mu8 1
118 1 . 1 . 1 1 19 19 ILE H H . . 1 . 19 ILE HN rr_2mu8 1
118 1 . 2 . 1 1 19 19 ILE HG13 H . . 1 . 19 ILE HG1S rr_2mu8 1
119 1 . 1 . 1 1 10 10 PHE H H . . 1 . 10 PHE HN rr_2mu8 1
119 1 . 2 . 1 1 9 9 THR MG H . . 1 . 9 THR HG2* rr_2mu8 1
120 1 . 1 . 1 1 11 11 ILE MD H . . 1 . 11 ILE HD1* rr_2mu8 1
120 1 . 2 . 1 1 10 10 PHE HA H . . 1 . 10 PHE HA rr_2mu8 1
121 1 . 1 . 1 1 14 14 ALA MB H . . 1 . 14 ALA HB* rr_2mu8 1
121 1 . 2 . 1 1 13 13 ASN HA H . . 1 . 13 ASN HA rr_2mu8 1
122 1 . 1 . 1 1 9 9 THR MG H . . 1 . 9 THR HG2* rr_2mu8 1
122 1 . 2 . 1 1 8 8 ASN HA H . . 1 . 8 ASN HA rr_2mu8 1
123 1 . 1 . 1 1 11 11 ILE MD H . . 1 . 11 ILE HD1* rr_2mu8 1
123 1 . 2 . 1 1 11 11 ILE HA H . . 1 . 11 ILE HA rr_2mu8 1
124 1 . 1 . 1 1 9 9 THR MG H . . 1 . 9 THR HG2* rr_2mu8 1
124 1 . 2 . 1 1 9 9 THR HA H . . 1 . 9 THR HA rr_2mu8 1
125 1 . 1 . 1 1 14 14 ALA MB H . . 1 . 14 ALA HB* rr_2mu8 1
125 1 . 2 . 1 1 14 14 ALA HA H . . 1 . 14 ALA HA rr_2mu8 1
126 1 . 1 . 1 1 11 11 ILE HG13 H . . 1 . 11 ILE HG1S rr_2mu8 1
126 1 . 2 . 1 1 11 11 ILE HA H . . 1 . 11 ILE HA rr_2mu8 1
127 2 . 1 . 1 1 1 1 LYS HG2 H . . 1 . 1 LYS HG* rr_2mu8 1
127 2 . 2 . 1 1 1 1 LYS HA H . . 1 . 1 LYS HA rr_2mu8 1
127 3 . 1 . 1 1 1 1 LYS HG3 H . . 1 . 1 LYS HG* rr_2mu8 1
127 3 . 2 . 1 1 1 1 LYS HA H . . 1 . 1 LYS HA rr_2mu8 1
128 1 . 1 . 1 1 3 3 GLU HB3 H . . 1 . 3 GLU HBS rr_2mu8 1
128 1 . 2 . 1 1 3 3 GLU HA H . . 1 . 3 GLU HA rr_2mu8 1
129 1 . 1 . 1 1 17 17 MET HB3 H . . 1 . 17 MET HBR rr_2mu8 1
129 1 . 2 . 1 1 17 17 MET HA H . . 1 . 17 MET HA rr_2mu8 1
130 1 . 1 . 1 1 3 3 GLU HB2 H . . 1 . 3 GLU HBR rr_2mu8 1
130 1 . 2 . 1 1 3 3 GLU HA H . . 1 . 3 GLU HA rr_2mu8 1
131 1 . 1 . 1 1 17 17 MET HB2 H . . 1 . 17 MET HBS rr_2mu8 1
131 1 . 2 . 1 1 17 17 MET HA H . . 1 . 17 MET HA rr_2mu8 1
132 2 . 1 . 1 1 3 3 GLU HG2 H . . 1 . 3 GLU HG* rr_2mu8 1
132 2 . 2 . 1 1 3 3 GLU HA H . . 1 . 3 GLU HA rr_2mu8 1
132 3 . 1 . 1 1 3 3 GLU HG3 H . . 1 . 3 GLU HG* rr_2mu8 1
132 3 . 2 . 1 1 3 3 GLU HA H . . 1 . 3 GLU HA rr_2mu8 1
133 1 . 1 . 1 1 15 15 TYR HB3 H . . 1 . 15 TYR HBS rr_2mu8 1
133 1 . 2 . 1 1 15 15 TYR HA H . . 1 . 15 TYR HA rr_2mu8 1
134 1 . 1 . 1 1 10 10 PHE HB3 H . . 1 . 10 PHE HBS rr_2mu8 1
134 1 . 2 . 1 1 10 10 PHE HA H . . 1 . 10 PHE HA rr_2mu8 1
135 1 . 1 . 1 1 8 8 ASN HB2 H . . 1 . 8 ASN HBS rr_2mu8 1
135 1 . 2 . 1 1 8 8 ASN HA H . . 1 . 8 ASN HA rr_2mu8 1
136 1 . 1 . 1 1 8 8 ASN HB3 H . . 1 . 8 ASN HBR rr_2mu8 1
136 1 . 2 . 1 1 8 8 ASN HA H . . 1 . 8 ASN HA rr_2mu8 1
137 1 . 1 . 1 1 11 11 ILE HB H . . 1 . 11 ILE HB rr_2mu8 1
137 1 . 2 . 1 1 10 10 PHE HA H . . 1 . 10 PHE HA rr_2mu8 1
138 1 . 1 . 1 1 2 2 ASN H H . . 1 . 2 ASN HN rr_2mu8 1
138 1 . 2 . 1 1 3 3 GLU H H . . 1 . 3 GLU HN rr_2mu8 1
139 1 . 1 . 1 1 12 12 ASN H H . . 1 . 12 ASN HN rr_2mu8 1
139 1 . 2 . 1 1 11 11 ILE H H . . 1 . 11 ILE HN rr_2mu8 1
140 1 . 1 . 1 1 8 8 ASN H H . . 1 . 8 ASN HN rr_2mu8 1
140 1 . 2 . 1 1 9 9 THR H H . . 1 . 9 THR HN rr_2mu8 1
141 1 . 1 . 1 1 18 18 SER H H . . 1 . 18 SER HN rr_2mu8 1
141 1 . 2 . 1 1 19 19 ILE H H . . 1 . 19 ILE HN rr_2mu8 1
142 1 . 1 . 1 1 10 10 PHE H H . . 1 . 10 PHE HN rr_2mu8 1
142 1 . 2 . 1 1 9 9 THR H H . . 1 . 9 THR HN rr_2mu8 1
143 1 . 1 . 1 1 7 7 SER H H . . 1 . 7 SER HN rr_2mu8 1
143 1 . 2 . 1 1 8 8 ASN H H . . 1 . 8 ASN HN rr_2mu8 1
144 1 . 1 . 1 1 14 14 ALA H H . . 1 . 14 ALA HN rr_2mu8 1
144 1 . 2 . 1 1 15 15 TYR H H . . 1 . 15 TYR HN rr_2mu8 1
145 1 . 1 . 1 1 18 18 SER H H . . 1 . 18 SER HN rr_2mu8 1
145 1 . 2 . 1 1 17 17 MET H H . . 1 . 17 MET HN rr_2mu8 1
146 1 . 1 . 1 1 5 5 LYS H H . . 1 . 5 LYS HN rr_2mu8 1
146 1 . 2 . 1 1 6 6 TYR H H . . 1 . 6 TYR HN rr_2mu8 1
147 1 . 1 . 1 1 7 7 SER H H . . 1 . 7 SER HN rr_2mu8 1
147 1 . 2 . 1 1 6 6 TYR H H . . 1 . 6 TYR HN rr_2mu8 1
148 1 . 1 . 1 1 16 16 ASN H H . . 1 . 16 ASN HN rr_2mu8 1
148 1 . 2 . 1 1 15 15 TYR H H . . 1 . 15 TYR HN rr_2mu8 1
149 1 . 1 . 1 1 10 10 PHE H H . . 1 . 10 PHE HN rr_2mu8 1
149 1 . 2 . 1 1 10 10 PHE QD H . . 1 . 10 PHE HD* rr_2mu8 1
150 1 . 1 . 1 1 15 15 TYR H H . . 1 . 15 TYR HN rr_2mu8 1
150 1 . 2 . 1 1 15 15 TYR QD H . . 1 . 15 TYR HD* rr_2mu8 1
151 1 . 1 . 1 1 7 7 SER H H . . 1 . 7 SER HN rr_2mu8 1
151 1 . 2 . 1 1 6 6 TYR QD H . . 1 . 6 TYR HD* rr_2mu8 1
152 1 . 1 . 1 1 6 6 TYR QD H . . 1 . 6 TYR HD* rr_2mu8 1
152 1 . 2 . 1 1 6 6 TYR QE H . . 1 . 6 TYR HE* rr_2mu8 1
153 1 . 1 . 1 1 15 15 TYR QD H . . 1 . 15 TYR HD* rr_2mu8 1
153 1 . 2 . 1 1 15 15 TYR QE H . . 1 . 15 TYR HE* rr_2mu8 1
154 1 . 1 . 1 1 15 15 TYR H H . . 1 . 15 TYR HN rr_2mu8 1
154 1 . 2 . 1 1 15 15 TYR QE H . . 1 . 15 TYR HE* rr_2mu8 1
155 1 . 1 . 1 1 6 6 TYR H H . . 1 . 6 TYR HN rr_2mu8 1
155 1 . 2 . 1 1 6 6 TYR QE H . . 1 . 6 TYR HE* rr_2mu8 1
156 1 . 1 . 1 1 8 8 ASN HD21 H . . 1 . 8 ASN HD21 rr_2mu8 1
156 1 . 2 . 1 1 8 8 ASN HD22 H . . 1 . 8 ASN HD22 rr_2mu8 1
157 1 . 1 . 1 1 13 13 ASN HD21 H . . 1 . 13 ASN HD21 rr_2mu8 1
157 1 . 2 . 1 1 13 13 ASN HD22 H . . 1 . 13 ASN HD22 rr_2mu8 1
158 1 . 1 . 1 1 8 8 ASN H H . . 1 . 8 ASN HN rr_2mu8 1
158 1 . 2 . 1 1 8 8 ASN HD22 H . . 1 . 8 ASN HD22 rr_2mu8 1
159 1 . 1 . 1 1 12 12 ASN H H . . 1 . 12 ASN HN rr_2mu8 1
159 1 . 2 . 1 1 12 12 ASN HD22 H . . 1 . 12 ASN HD22 rr_2mu8 1
160 1 . 1 . 1 1 13 13 ASN H H . . 1 . 13 ASN HN rr_2mu8 1
160 1 . 2 . 1 1 13 13 ASN HD21 H . . 1 . 13 ASN HD21 rr_2mu8 1
161 1 . 1 . 1 1 10 10 PHE HB3 H . . 1 . 10 PHE HBS rr_2mu8 1
161 1 . 2 . 1 1 10 10 PHE HB2 H . . 1 . 10 PHE HBR rr_2mu8 1
162 1 . 1 . 1 1 15 15 TYR HB3 H . . 1 . 15 TYR HBS rr_2mu8 1
162 1 . 2 . 1 1 15 15 TYR HB2 H . . 1 . 15 TYR HBR rr_2mu8 1
163 1 . 1 . 1 1 16 16 ASN H H . . 1 . 16 ASN HN rr_2mu8 1
163 1 . 2 . 1 1 14 14 ALA HA H . . 1 . 14 ALA HA rr_2mu8 1
164 1 . 1 . 1 1 16 16 ASN H H . . 1 . 16 ASN HN rr_2mu8 1
164 1 . 2 . 1 1 16 16 ASN HA H . . 1 . 16 ASN HA rr_2mu8 1
165 1 . 1 . 1 1 20 20 ARG H H . . 1 . 20 ARG HN rr_2mu8 1
165 1 . 2 . 1 1 20 20 ARG HA H . . 1 . 20 ARG HA rr_2mu8 1
166 1 . 1 . 1 1 4 4 SER H H . . 1 . 4 SER HN rr_2mu8 1
166 1 . 2 . 1 1 3 3 GLU HA H . . 1 . 3 GLU HA rr_2mu8 1
167 1 . 1 . 1 1 13 13 ASN H H . . 1 . 13 ASN HN rr_2mu8 1
167 1 . 2 . 1 1 12 12 ASN HA H . . 1 . 12 ASN HA rr_2mu8 1
168 1 . 1 . 1 1 14 14 ALA H H . . 1 . 14 ALA HN rr_2mu8 1
168 1 . 2 . 1 1 13 13 ASN HA H . . 1 . 13 ASN HA rr_2mu8 1
169 1 . 1 . 1 1 16 16 ASN H H . . 1 . 16 ASN HN rr_2mu8 1
169 1 . 2 . 1 1 15 15 TYR HA H . . 1 . 15 TYR HA rr_2mu8 1
170 1 . 1 . 1 1 17 17 MET H H . . 1 . 17 MET HN rr_2mu8 1
170 1 . 2 . 1 1 16 16 ASN HA H . . 1 . 16 ASN HA rr_2mu8 1
171 1 . 1 . 1 1 18 18 SER H H . . 1 . 18 SER HN rr_2mu8 1
171 1 . 2 . 1 1 17 17 MET HA H . . 1 . 17 MET HA rr_2mu8 1
172 1 . 1 . 1 1 20 20 ARG H H . . 1 . 20 ARG HN rr_2mu8 1
172 1 . 2 . 1 1 19 19 ILE HA H . . 1 . 19 ILE HA rr_2mu8 1
173 1 . 1 . 1 1 12 12 ASN H H . . 1 . 12 ASN HN rr_2mu8 1
173 1 . 2 . 1 1 13 13 ASN H H . . 1 . 13 ASN HN rr_2mu8 1
174 1 . 1 . 1 1 5 5 LYS H H . . 1 . 5 LYS HN rr_2mu8 1
174 1 . 2 . 1 1 4 4 SER H H . . 1 . 4 SER HN rr_2mu8 1
175 1 . 1 . 1 1 16 16 ASN H H . . 1 . 16 ASN HN rr_2mu8 1
175 1 . 2 . 1 1 17 17 MET H H . . 1 . 17 MET HN rr_2mu8 1
176 1 . 1 . 1 1 11 11 ILE H H . . 1 . 11 ILE HN rr_2mu8 1
176 1 . 2 . 1 1 10 10 PHE H H . . 1 . 10 PHE HN rr_2mu8 1
177 1 . 1 . 1 1 3 3 GLU H H . . 1 . 3 GLU HN rr_2mu8 1
177 1 . 2 . 1 1 4 4 SER H H . . 1 . 4 SER HN rr_2mu8 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Spectral_peak_list_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . 3.5 1.8 2.8 rr_2mu8 1
2 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
3 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
4 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
5 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
6 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
7 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
8 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
9 2 . . . . . . 2.5 1.8 3.5 rr_2mu8 1
9 3 . . . . . . 2.5 1.8 3.5 rr_2mu8 1
10 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
11 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
12 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
13 2 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
13 3 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
14 2 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
14 3 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
15 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
16 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
17 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
18 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
19 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
20 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
21 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
22 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
23 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
24 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
25 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
26 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
27 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
28 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
29 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
30 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
31 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
32 2 . . . . . . 2.5 1.8 3.5 rr_2mu8 1
32 3 . . . . . . 2.5 1.8 3.5 rr_2mu8 1
33 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
34 2 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
34 3 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
35 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
36 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
37 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
38 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
39 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
40 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
41 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
42 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
43 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
44 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
45 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
46 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
47 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
48 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
49 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
50 1 . . . . . . 2.5 1.8 4.5 rr_2mu8 1
51 1 . . . . . . 2.5 1.8 4.5 rr_2mu8 1
52 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
53 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
54 1 . . . . . . 2.5 1.8 4.5 rr_2mu8 1
55 1 . . . . . . 2.5 1.8 4.5 rr_2mu8 1
56 1 . . . . . . 5.0 3.5 7.0 rr_2mu8 1
57 1 . . . . . . 5.0 3.5 7.0 rr_2mu8 1
58 1 . . . . . . 5.0 3.5 7.0 rr_2mu8 1
59 1 . . . . . . 5.0 3.5 7.0 rr_2mu8 1
60 1 . . . . . . 5.0 3.5 7.0 rr_2mu8 1
61 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
62 2 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
62 3 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
63 2 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
63 3 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
64 2 . . . . . . 2.5 1.8 3.5 rr_2mu8 1
64 3 . . . . . . 2.5 1.8 3.5 rr_2mu8 1
65 2 . . . . . . 5.0 3.5 8.0 rr_2mu8 1
65 3 . . . . . . 5.0 3.5 8.0 rr_2mu8 1
66 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
67 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
68 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
69 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
70 2 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
70 3 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
71 2 . . . . . . 5.0 3.5 6.0 rr_2mu8 1
71 3 . . . . . . 5.0 3.5 6.0 rr_2mu8 1
72 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
73 2 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
73 3 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
74 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
75 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
76 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
77 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
78 1 . . . . . . 2.5 1.8 4.5 rr_2mu8 1
79 1 . . . . . . 2.5 1.8 4.5 rr_2mu8 1
80 1 . . . . . . 5.0 3.5 7.0 rr_2mu8 1
81 1 . . . . . . 5.0 3.5 7.0 rr_2mu8 1
82 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
83 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
84 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
85 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
86 1 . . . . . . 2.5 1.8 4.5 rr_2mu8 1
87 1 . . . . . . 2.5 1.8 4.5 rr_2mu8 1
88 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
89 2 . . . . . . 5.0 3.5 6.0 rr_2mu8 1
89 3 . . . . . . 5.0 3.5 6.0 rr_2mu8 1
90 2 . . . . . . 5.0 3.5 6.0 rr_2mu8 1
90 3 . . . . . . 5.0 3.5 6.0 rr_2mu8 1
91 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
92 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
93 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
94 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
95 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
96 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
97 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
98 2 . . . . . . 5.0 3.5 6.0 rr_2mu8 1
98 3 . . . . . . 5.0 3.5 6.0 rr_2mu8 1
99 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
100 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
101 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
102 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
103 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
104 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
105 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
106 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
107 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
108 2 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
108 3 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
109 1 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
110 1 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
111 1 . . . . . . 5.0 3.5 6.0 rr_2mu8 1
112 1 . . . . . . 2.5 1.8 3.5 rr_2mu8 1
113 1 . . . . . . 2.5 1.8 3.5 rr_2mu8 1
114 1 . . . . . . 5.0 3.5 6.0 rr_2mu8 1
115 1 . . . . . . 2.5 1.8 3.5 rr_2mu8 1
116 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
117 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
118 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
119 1 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
120 1 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
121 1 . . . . . . 3.5 2.5 4.5 rr_2mu8 1
122 1 . . . . . . 5.0 3.5 6.0 rr_2mu8 1
123 1 . . . . . . 2.5 1.8 3.5 rr_2mu8 1
124 1 . . . . . . 2.5 1.8 3.5 rr_2mu8 1
125 1 . . . . . . 2.5 1.8 3.5 rr_2mu8 1
126 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
127 2 . . . . . . 5.0 3.5 6.0 rr_2mu8 1
127 3 . . . . . . 5.0 3.5 6.0 rr_2mu8 1
128 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
129 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
130 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
131 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
132 2 . . . . . . 5.0 3.5 6.0 rr_2mu8 1
132 3 . . . . . . 5.0 3.5 6.0 rr_2mu8 1
133 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
134 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
135 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
136 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
137 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
138 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
139 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
140 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
141 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
142 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
143 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
144 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
145 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
146 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
147 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
148 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
149 1 . . . . . . 3.5 2.5 5.5 rr_2mu8 1
150 1 . . . . . . 2.5 1.8 4.5 rr_2mu8 1
151 1 . . . . . . 3.5 2.5 5.5 rr_2mu8 1
152 1 . . . . . . 2.5 1.8 6.5 rr_2mu8 1
153 1 . . . . . . 2.5 1.8 6.5 rr_2mu8 1
154 1 . . . . . . 3.5 2.5 5.5 rr_2mu8 1
155 1 . . . . . . 3.5 2.5 5.5 rr_2mu8 1
156 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
157 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
158 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
159 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
160 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
161 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
162 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
163 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
164 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
165 1 . . . . . . 3.5 2.8 3.5 rr_2mu8 1
166 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
167 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
168 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
169 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
170 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
171 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
172 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
173 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
174 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 1
175 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
176 1 . . . . . . 2.5 1.8 2.8 rr_2mu8 1
177 1 . . . . . . 5.0 3.5 5.0 rr_2mu8 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 NOE_distance 1 1 1 13 rr_2mu8 1
2 medium: 2 87 2 102 rr_2mu8 1
3 medium: 3 87 3 101 rr_2mu8 1
4 medium: 4 87 4 101 rr_2mu8 1
5 medium: 5 87 5 101 rr_2mu8 1
6 medium: 6 87 6 102 rr_2mu8 1
7 weak: 7 87 7 103 rr_2mu8 1
8 weak: 8 87 8 101 rr_2mu8 1
9 strong: 9 87 9 102 rr_2mu8 1
10 medium: 10 87 10 103 rr_2mu8 1
11 medium: 11 87 11 102 rr_2mu8 1
12 strong: 12 87 12 102 rr_2mu8 1
13 weak: 13 87 13 102 rr_2mu8 1
14 medium: 14 87 14 102 rr_2mu8 1
15 medium: 15 87 15 102 rr_2mu8 1
16 medium: 16 87 16 102 rr_2mu8 1
17 medium: 17 87 17 102 rr_2mu8 1
18 medium: 18 87 18 102 rr_2mu8 1
19 strong: 19 87 19 102 rr_2mu8 1
20 strong: 20 87 20 102 rr_2mu8 1
21 strong: 21 87 21 102 rr_2mu8 1
22 medium: 22 87 22 102 rr_2mu8 1
23 medium: 23 87 23 101 rr_2mu8 1
24 strong: 24 87 24 102 rr_2mu8 1
25 medium: 25 87 25 102 rr_2mu8 1
26 medium: 26 87 26 103 rr_2mu8 1
27 medium: 27 87 27 103 rr_2mu8 1
28 strong: 28 87 28 103 rr_2mu8 1
29 strong: 29 87 29 103 rr_2mu8 1
30 strong: 30 87 30 104 rr_2mu8 1
31 strong: 31 87 31 102 rr_2mu8 1
32 strong: 32 87 32 102 rr_2mu8 1
33 medium: 33 87 33 103 rr_2mu8 1
34 medium: 34 87 34 101 rr_2mu8 1
35 medium: 35 87 35 104 rr_2mu8 1
36 strong: 36 87 36 102 rr_2mu8 1
37 medium: 37 87 37 102 rr_2mu8 1
38 medium: 38 87 38 101 rr_2mu8 1
39 strong: 39 87 39 102 rr_2mu8 1
40 strong: 40 87 40 102 rr_2mu8 1
41 strong: 41 87 41 102 rr_2mu8 1
42 strong: 42 87 42 102 rr_2mu8 1
43 strong: 43 87 43 102 rr_2mu8 1
44 strong: 44 87 44 102 rr_2mu8 1
45 medium: 45 87 45 100 rr_2mu8 1
46 strong: 46 87 46 102 rr_2mu8 1
47 strong: 47 87 47 102 rr_2mu8 1
48 strong: 48 87 48 102 rr_2mu8 1
49 strong: 49 87 49 102 rr_2mu8 1
50 strong: 50 87 50 102 rr_2mu8 1
51 medium: 51 87 51 102 rr_2mu8 1
52 weak: 52 87 52 102 rr_2mu8 1
53 weak: 53 87 53 101 rr_2mu8 1
54 weak: 54 87 54 102 rr_2mu8 1
55 strong: 55 87 55 102 rr_2mu8 1
56 strong: 56 87 56 102 rr_2mu8 1
57 medium: 57 87 57 100 rr_2mu8 1
58 weak: 58 87 58 102 rr_2mu8 1
59 strong: 59 87 59 102 rr_2mu8 1
60 strong: 60 87 60 102 rr_2mu8 1
61 weak: 61 87 61 99 rr_2mu8 1
62 weak: 62 87 62 102 rr_2mu8 1
63 weak: 63 87 63 104 rr_2mu8 1
64 weak: 64 87 64 99 rr_2mu8 1
65 weak: 65 87 65 99 rr_2mu8 1
66 medium: 66 87 66 104 rr_2mu8 1
67 medium: 67 87 67 102 rr_2mu8 1
68 medium: 68 87 68 103 rr_2mu8 1
69 strong: 69 87 69 104 rr_2mu8 1
70 weak: 70 87 70 101 rr_2mu8 1
71 strong: 71 87 71 102 rr_2mu8 1
72 strong: 72 87 72 103 rr_2mu8 1
73 strong: 73 87 73 103 rr_2mu8 1
74 strong: 74 87 74 102 rr_2mu8 1
75 medium: 75 87 75 101 rr_2mu8 1
76 weak: 76 87 76 101 rr_2mu8 1
77 medium: 77 87 77 101 rr_2mu8 1
78 medium: 78 87 78 102 rr_2mu8 1
79 weak: 79 87 79 100 rr_2mu8 1
80 medium: 80 87 80 101 rr_2mu8 1
81 medium: 81 87 81 103 rr_2mu8 1
82 medium: 82 87 82 101 rr_2mu8 1
83 strong: 83 87 83 102 rr_2mu8 1
84 strong: 84 87 84 102 rr_2mu8 1
85 weak: 85 87 85 101 rr_2mu8 1
86 weak: 86 87 86 101 rr_2mu8 1
87 medium: 87 87 87 103 rr_2mu8 1
88 medium: 88 87 88 102 rr_2mu8 1
89 weak: 89 87 89 99 rr_2mu8 1
90 medium: 90 87 90 104 rr_2mu8 1
91 strong: 91 87 91 102 rr_2mu8 1
92 strong: 92 87 92 102 rr_2mu8 1
93 medium: 93 87 93 104 rr_2mu8 1
94 weak: 94 87 94 99 rr_2mu8 1
95 weak: 95 87 95 100 rr_2mu8 1
96 weak: 96 87 96 100 rr_2mu8 1
97 medium: 97 87 97 102 rr_2mu8 1
98 weak: 98 87 98 99 rr_2mu8 1
99 medium: 99 87 99 103 rr_2mu8 1
100 weak: 100 87 100 100 rr_2mu8 1
101 medium: 101 87 101 102 rr_2mu8 1
102 weak: 102 87 102 101 rr_2mu8 1
103 weak: 103 87 103 101 rr_2mu8 1
104 weak: 104 87 104 98 rr_2mu8 1
105 weak: 105 87 105 101 rr_2mu8 1
106 medium: 106 87 106 100 rr_2mu8 1
107 weak: 107 87 107 98 rr_2mu8 1
108 medium: 108 87 108 102 rr_2mu8 1
109 medium: 109 87 109 104 rr_2mu8 1
110 weak: 110 87 110 100 rr_2mu8 1
111 strong: 111 87 111 102 rr_2mu8 1
112 medium: 112 87 112 102 rr_2mu8 1
113 medium: 113 87 113 101 rr_2mu8 1
114 medium: 114 87 114 102 rr_2mu8 1
115 medium: 115 87 115 105 rr_2mu8 1
116 medium: 116 87 116 104 rr_2mu8 1
117 medium: 117 87 117 103 rr_2mu8 1
118 weak: 118 87 118 100 rr_2mu8 1
119 strong: 119 87 119 102 rr_2mu8 1
120 strong: 120 87 120 102 rr_2mu8 1
121 weak: 121 87 121 100 rr_2mu8 1
122 strong: 122 87 122 102 rr_2mu8 1
123 medium: 123 87 123 102 rr_2mu8 1
124 medium: 124 87 124 102 rr_2mu8 1
125 weak: 125 87 125 101 rr_2mu8 1
126 medium: 126 87 126 102 rr_2mu8 1
127 medium: 127 87 127 101 rr_2mu8 1
128 medium: 128 87 128 101 rr_2mu8 1
129 weak: 129 87 129 101 rr_2mu8 1
130 strong: 130 87 130 102 rr_2mu8 1
131 strong: 131 87 131 102 rr_2mu8 1
132 strong: 132 87 132 102 rr_2mu8 1
133 medium: 133 87 133 101 rr_2mu8 1
134 weak: 134 87 134 100 rr_2mu8 1
135 medium: 135 87 135 102 rr_2mu8 1
136 medium: 136 87 136 103 rr_2mu8 1
137 medium: 137 87 137 101 rr_2mu8 1
138 medium: 138 87 138 102 rr_2mu8 1
139 weak: 139 87 139 97 rr_2mu8 1
140 weak: 140 87 140 101 rr_2mu8 1
141 weak: 141 87 141 99 rr_2mu8 1
142 weak: 142 87 142 98 rr_2mu8 1
143 weak: 143 87 143 100 rr_2mu8 1
144 weak: 144 87 144 100 rr_2mu8 1
145 medium: 145 87 145 102 rr_2mu8 1
146 medium: 146 87 146 101 rr_2mu8 1
147 strong: 147 87 147 102 rr_2mu8 1
148 strong: 148 87 148 102 rr_2mu8 1
149 strong: 149 87 149 102 rr_2mu8 1
150 strong: 150 87 150 100 rr_2mu8 1
151 strong: 151 87 151 102 rr_2mu8 1
152 strong: 152 87 152 102 rr_2mu8 1
153 medium: 153 87 153 103 rr_2mu8 1
154 strong: 154 87 154 102 rr_2mu8 1
155 strong: 155 87 155 102 rr_2mu8 1
156 medium: 156 87 156 102 rr_2mu8 1
157 strong: 157 87 157 102 rr_2mu8 1
158 medium: 158 87 158 105 rr_2mu8 1
159 strong: 159 87 159 102 rr_2mu8 1
160 strong: 160 87 160 102 rr_2mu8 1
161 medium: 161 87 161 102 rr_2mu8 1
162 medium: 162 87 162 102 rr_2mu8 1
163 strong: 163 87 163 102 rr_2mu8 1
164 strong: 164 87 164 102 rr_2mu8 1
165 medium: 165 87 165 102 rr_2mu8 1
166 medium: 166 87 166 101 rr_2mu8 1
167 weak: 167 87 167 98 rr_2mu8 1
168 strong: 168 87 168 102 rr_2mu8 1
169 strong: 169 87 169 102 rr_2mu8 1
170 weak: 170 87 170 92 rr_2mu8 1
171 medium: 171 87 171 94 rr_2mu8 1
172 medium: 172 87 172 95 rr_2mu8 1
173 strong: 173 87 173 95 rr_2mu8 1
174 strong: 174 87 174 94 rr_2mu8 1
175 strong: 175 87 175 94 rr_2mu8 1
176 strong: 176 87 176 94 rr_2mu8 1
177 strong: 177 87 177 94 rr_2mu8 1
178 strong: 178 87 178 94 rr_2mu8 1
179 strong: 179 87 179 94 rr_2mu8 1
180 strong: 180 87 180 94 rr_2mu8 1
181 weak: 181 87 181 93 rr_2mu8 1
182 weak: 182 87 182 93 rr_2mu8 1
183 strong: 183 87 183 94 rr_2mu8 1
184 strong: 184 87 184 94 rr_2mu8 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 4 1 1 "Not handling restraint 1, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_2mu8 1
2 4 8 1 "Not handling restraint 8, item 1, resonance(s) '1.1.HN' (nmrStar names),'B.1.HA*' (nmrStar names) not linked" rr_2mu8 1
3 4 12 1 "Not handling restraint 12, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_2mu8 1
4 4 50 1 "Not handling restraint 50, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_2mu8 1
5 4 99 1 "Not handling restraint 99, item 1, resonance(s) 'B.1.HA*' (nmrStar names) not linked" rr_2mu8 1
6 4 105 1 "Not handling restraint 105, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_2mu8 1
7 4 105 1 "Not handling restraint 105, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_2mu8 1
8 4 180 1 "Not handling restraint 180, item 1, resonance(s) '1.1.HN' (nmrStar names) not linked" rr_2mu8 1
stop_
save_
save_Discover_distance_constraints_3_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Sf_framecode Discover_distance_constraints_3_1
_Distance_constraint_list.Entry_ID rr_2mu8
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Details "Generated by Wattos"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 3
loop_
_Distance_constraint_software.Software_ID
_Distance_constraint_software.Software_label
_Distance_constraint_software.Method_ID
_Distance_constraint_software.Method_label
_Distance_constraint_software.Entry_ID
_Distance_constraint_software.Distance_constraint_list_ID
. . . . rr_2mu8 2
stop_
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . rr_2mu8 2
2 1 . . . rr_2mu8 2
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Contribution_fractional_val
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Assembly_atom_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Seq_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Atom_type
_Dist_constraint.Atom_isotope_number
_Dist_constraint.Resonance_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_entity_assembly_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 . 1 . 1 1 7 7 SER O O . . 1 . 7 SER O rr_2mu8 2
1 1 . 2 . 1 1 10 10 PHE H H . . 1 . 10 PHE HN rr_2mu8 2
2 1 . 1 . 1 1 6 6 TYR O O . . 1 . 6 TYR O rr_2mu8 2
2 1 . 2 . 1 1 9 9 THR H H . . 1 . 9 THR HN rr_2mu8 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Spectral_peak_list_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . . 1.8 2.5 rr_2mu8 2
2 1 . . . . . . . 1.8 2.5 rr_2mu8 2
stop_
loop_
_Dist_constraint_comment_org.ID
_Dist_constraint_comment_org.Comment_text
_Dist_constraint_comment_org.Comment_begin_line
_Dist_constraint_comment_org.Comment_begin_column
_Dist_constraint_comment_org.Comment_end_line
_Dist_constraint_comment_org.Comment_end_column
_Dist_constraint_comment_org.Entry_ID
_Dist_constraint_comment_org.Distance_constraint_list_ID
1 distance 1 1 1 9 rr_2mu8 2
stop_
save_
save_Discover_dihedral_6
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Sf_framecode Discover_dihedral_6
_Torsion_angle_constraint_list.Entry_ID rr_2mu8
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Details "Generated by Wattos"
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 6
loop_
_Torsion_angle_constraint_software.Software_ID
_Torsion_angle_constraint_software.Software_label
_Torsion_angle_constraint_software.Method_ID
_Torsion_angle_constraint_software.Method_label
_Torsion_angle_constraint_software.Entry_ID
_Torsion_angle_constraint_software.Torsion_angle_constraint_list_ID
. . . . rr_2mu8 1
stop_
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Atom_type_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Atom_type_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Atom_type_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Atom_type_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.PDB_record_ID_1
_Torsion_angle_constraint.PDB_model_num_1
_Torsion_angle_constraint.PDB_strand_ID_1
_Torsion_angle_constraint.PDB_ins_code_1
_Torsion_angle_constraint.PDB_residue_no_1
_Torsion_angle_constraint.PDB_residue_name_1
_Torsion_angle_constraint.PDB_atom_name_1
_Torsion_angle_constraint.PDB_record_ID_2
_Torsion_angle_constraint.PDB_model_num_2
_Torsion_angle_constraint.PDB_strand_ID_2
_Torsion_angle_constraint.PDB_ins_code_2
_Torsion_angle_constraint.PDB_residue_no_2
_Torsion_angle_constraint.PDB_residue_name_2
_Torsion_angle_constraint.PDB_atom_name_2
_Torsion_angle_constraint.PDB_record_ID_3
_Torsion_angle_constraint.PDB_model_num_3
_Torsion_angle_constraint.PDB_strand_ID_3
_Torsion_angle_constraint.PDB_ins_code_3
_Torsion_angle_constraint.PDB_residue_no_3
_Torsion_angle_constraint.PDB_residue_name_3
_Torsion_angle_constraint.PDB_atom_name_3
_Torsion_angle_constraint.PDB_record_ID_4
_Torsion_angle_constraint.PDB_model_num_4
_Torsion_angle_constraint.PDB_strand_ID_4
_Torsion_angle_constraint.PDB_ins_code_4
_Torsion_angle_constraint.PDB_residue_no_4
_Torsion_angle_constraint.PDB_residue_name_4
_Torsion_angle_constraint.PDB_atom_name_4
_Torsion_angle_constraint.Auth_entity_assembly_ID_1
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_chain_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_alt_ID_1
_Torsion_angle_constraint.Auth_atom_name_1
_Torsion_angle_constraint.Auth_entity_assembly_ID_2
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_chain_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_alt_ID_2
_Torsion_angle_constraint.Auth_atom_name_2
_Torsion_angle_constraint.Auth_entity_assembly_ID_3
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_chain_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_alt_ID_3
_Torsion_angle_constraint.Auth_atom_name_3
_Torsion_angle_constraint.Auth_entity_assembly_ID_4
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_chain_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Auth_alt_ID_4
_Torsion_angle_constraint.Auth_atom_name_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . 1 1 1 1 LYS CA C . . 1 1 1 1 LYS C C . . 1 1 2 2 ASN N N . . 1 1 2 2 ASN CA C . 178.0 180.0 . . . A . 1 LYS CA . . A . 1 LYS C . . A . 2 ASN N . . A . 2 ASN CA . 1 . 1 LYS CA . . . 1 . 1 LYS C . . . 1 . 2 ASN N . . . 1 . 2 ASN CA . . rr_2mu8 1
2 . . 1 1 2 2 ASN CA C . . 1 1 2 2 ASN C C . . 1 1 3 3 GLU N N . . 1 1 3 3 GLU CA C . 178.0 180.0 . . . A . 2 ASN CA . . A . 2 ASN C . . A . 3 GLU N . . A . 3 GLU CA . 1 . 2 ASN CA . . . 1 . 2 ASN C . . . 1 . 3 GLU N . . . 1 . 3 GLU CA . . rr_2mu8 1
3 . . 1 1 3 3 GLU CA C . . 1 1 3 3 GLU C C . . 1 1 4 4 SER N N . . 1 1 4 4 SER CA C . 178.0 180.0 . . . A . 3 GLU CA . . A . 3 GLU C . . A . 4 SER N . . A . 4 SER CA . 1 . 3 GLU CA . . . 1 . 3 GLU C . . . 1 . 4 SER N . . . 1 . 4 SER CA . . rr_2mu8 1
4 . . 1 1 4 4 SER CA C . . 1 1 4 4 SER C C . . 1 1 5 5 LYS N N . . 1 1 5 5 LYS CA C . 178.0 180.0 . . . A . 4 SER CA . . A . 4 SER C . . A . 5 LYS N . . A . 5 LYS CA . 1 . 4 SER CA . . . 1 . 4 SER C . . . 1 . 5 LYS N . . . 1 . 5 LYS CA . . rr_2mu8 1
5 . . 1 1 5 5 LYS CA C . . 1 1 5 5 LYS C C . . 1 1 6 6 TYR N N . . 1 1 6 6 TYR CA C . 178.0 180.0 . . . A . 5 LYS CA . . A . 5 LYS C . . A . 6 TYR N . . A . 6 TYR CA . 1 . 5 LYS CA . . . 1 . 5 LYS C . . . 1 . 6 TYR N . . . 1 . 6 TYR CA . . rr_2mu8 1
6 . . 1 1 6 6 TYR CA C . . 1 1 6 6 TYR C C . . 1 1 7 7 SER N N . . 1 1 7 7 SER CA C . 178.0 180.0 . . . A . 6 TYR CA . . A . 6 TYR C . . A . 7 SER N . . A . 7 SER CA . 1 . 6 TYR CA . . . 1 . 6 TYR C . . . 1 . 7 SER N . . . 1 . 7 SER CA . . rr_2mu8 1
7 . . 1 1 7 7 SER CA C . . 1 1 7 7 SER C C . . 1 1 8 8 ASN N N . . 1 1 8 8 ASN CA C . 178.0 180.0 . . . A . 7 SER CA . . A . 7 SER C . . A . 8 ASN N . . A . 8 ASN CA . 1 . 7 SER CA . . . 1 . 7 SER C . . . 1 . 8 ASN N . . . 1 . 8 ASN CA . . rr_2mu8 1
8 . . 1 1 8 8 ASN CA C . . 1 1 8 8 ASN C C . . 1 1 9 9 THR N N . . 1 1 9 9 THR CA C . 178.0 180.0 . . . A . 8 ASN CA . . A . 8 ASN C . . A . 9 THR N . . A . 9 THR CA . 1 . 8 ASN CA . . . 1 . 8 ASN C . . . 1 . 9 THR N . . . 1 . 9 THR CA . . rr_2mu8 1
9 . . 1 1 9 9 THR CA C . . 1 1 9 9 THR C C . . 1 1 10 10 PHE N N . . 1 1 10 10 PHE CA C . 178.0 180.0 . . . A . 9 THR CA . . A . 9 THR C . . A . 10 PHE N . . A . 10 PHE CA . 1 . 9 THR CA . . . 1 . 9 THR C . . . 1 . 10 PHE N . . . 1 . 10 PHE CA . . rr_2mu8 1
10 . . 1 1 10 10 PHE CA C . . 1 1 10 10 PHE C C . . 1 1 11 11 ILE N N . . 1 1 11 11 ILE CA C . 178.0 180.0 . . . A . 10 PHE CA . . A . 10 PHE C . . A . 11 ILE N . . A . 11 ILE CA . 1 . 10 PHE CA . . . 1 . 10 PHE C . . . 1 . 11 ILE N . . . 1 . 11 ILE CA . . rr_2mu8 1
11 . . 1 1 11 11 ILE CA C . . 1 1 11 11 ILE C C . . 1 1 12 12 ASN N N . . 1 1 12 12 ASN CA C . 178.0 180.0 . . . A . 11 ILE CA . . A . 11 ILE C . . A . 12 ASN N . . A . 12 ASN CA . 1 . 11 ILE CA . . . 1 . 11 ILE C . . . 1 . 12 ASN N . . . 1 . 12 ASN CA . . rr_2mu8 1
12 . . 1 1 12 12 ASN CA C . . 1 1 12 12 ASN C C . . 1 1 13 13 ASN N N . . 1 1 13 13 ASN CA C . 178.0 180.0 . . . A . 12 ASN CA . . A . 12 ASN C . . A . 13 ASN N . . A . 13 ASN CA . 1 . 12 ASN CA . . . 1 . 12 ASN C . . . 1 . 13 ASN N . . . 1 . 13 ASN CA . . rr_2mu8 1
13 . . 1 1 13 13 ASN CA C . . 1 1 13 13 ASN C C . . 1 1 14 14 ALA N N . . 1 1 14 14 ALA CA C . 178.0 180.0 . . . A . 13 ASN CA . . A . 13 ASN C . . A . 14 ALA N . . A . 14 ALA CA . 1 . 13 ASN CA . . . 1 . 13 ASN C . . . 1 . 14 ALA N . . . 1 . 14 ALA CA . . rr_2mu8 1
14 . . 1 1 14 14 ALA CA C . . 1 1 14 14 ALA C C . . 1 1 15 15 TYR N N . . 1 1 15 15 TYR CA C . 178.0 180.0 . . . A . 14 ALA CA . . A . 14 ALA C . . A . 15 TYR N . . A . 15 TYR CA . 1 . 14 ALA CA . . . 1 . 14 ALA C . . . 1 . 15 TYR N . . . 1 . 15 TYR CA . . rr_2mu8 1
15 . . 1 1 15 15 TYR CA C . . 1 1 15 15 TYR C C . . 1 1 16 16 ASN N N . . 1 1 16 16 ASN CA C . 178.0 180.0 . . . A . 15 TYR CA . . A . 15 TYR C . . A . 16 ASN N . . A . 16 ASN CA . 1 . 15 TYR CA . . . 1 . 15 TYR C . . . 1 . 16 ASN N . . . 1 . 16 ASN CA . . rr_2mu8 1
16 . . 1 1 16 16 ASN CA C . . 1 1 16 16 ASN C C . . 1 1 17 17 MET N N . . 1 1 17 17 MET CA C . 178.0 180.0 . . . A . 16 ASN CA . . A . 16 ASN C . . A . 17 MET N . . A . 17 MET CA . 1 . 16 ASN CA . . . 1 . 16 ASN C . . . 1 . 17 MET N . . . 1 . 17 MET CA . . rr_2mu8 1
17 . . 1 1 17 17 MET CA C . . 1 1 17 17 MET C C . . 1 1 18 18 SER N N . . 1 1 18 18 SER CA C . 178.0 180.0 . . . A . 17 MET CA . . A . 17 MET C . . A . 18 SER N . . A . 18 SER CA . 1 . 17 MET CA . . . 1 . 17 MET C . . . 1 . 18 SER N . . . 1 . 18 SER CA . . rr_2mu8 1
18 . . 1 1 18 18 SER CA C . . 1 1 18 18 SER C C . . 1 1 19 19 ILE N N . . 1 1 19 19 ILE CA C . 178.0 180.0 . . . A . 18 SER CA . . A . 18 SER C . . A . 19 ILE N . . A . 19 ILE CA . 1 . 18 SER CA . . . 1 . 18 SER C . . . 1 . 19 ILE N . . . 1 . 19 ILE CA . . rr_2mu8 1
19 . . 1 1 19 19 ILE CA C . . 1 1 19 19 ILE C C . . 1 1 20 20 ARG N N . . 1 1 20 20 ARG CA C . 178.0 180.0 . . . A . 19 ILE CA . . A . 19 ILE C . . A . 20 ARG N . . A . 20 ARG CA . 1 . 19 ILE CA . . . 1 . 19 ILE C . . . 1 . 20 ARG N . . . 1 . 20 ARG CA . . rr_2mu8 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 NMR_dihedral 1 1 1 13 rr_2mu8 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_2mu8
_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 CELL INVASION 04-SEP-14 2MU8 *TITLE DISTORTING MALARIA PEPTIDE BACKBONE STRUCTURE TO ENABLE FITTING INTO *TITLE 2 MHC CLASS II MOLECULES RENDERS MODIFIED PEPTIDES IMMUNOGENIC AND *TITLE 3 PROTECTIVE. *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: MSP-2 PEPTIDE; *COMPND 3 CHAIN: A; *COMPND 4 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: PLASMODIUM FALCIPARUM; *SOURCE 4 ORGANISM_TAXID: 5833; *SOURCE 5 OTHER_DETAILS: SYNTHETIC PEPTIDE OF 20 RESIDUES LENGTH FROM MSP-2 *SOURCE 6 PROTEIN OF PLASMODIUM FALCIPARUM *KEYWDS MEROZOITE SURFACE PROTEIN 2, CLASSIC BETA-TURN, CELL INVASION *EXPDTA SOLUTION NMR *NUMMDL 1 *AUTHOR G.CIFUENTES, M.E.PATARROYO, M.URQUIZA, L.E.RAMIREZ, C.REYES, *AUTHOR 2 R.RODRIGUEZ *REVDAT 1 12-NOV-14 2MU8 0"
save_
save_MR_file_comment_5
_Org_constr_file_comment.Sf_framecode MR_file_comment_5
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID rr_2mu8
_Org_constr_file_comment.ID 2
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 5
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;#mixing_times
3.000000E+02 !
;
save_
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