NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
393952 |
1r02   |
5994 | cing | 3-converted-DOCR | STAR | entry | full | 233 |
data_DOCR_restraints_with_modified_coordinates_PDB_code_1r02
# This DOCR archive file contains, for PDB entry <1r02>:
#
# - Coordinates and sequence information from the PDB mmCIF file
# - NMR restraints from the PDB MR file
#
# In this file, the coordinates and NMR restraints share the same atom names,
# and in this way can differ from the data deposited at the wwPDB. To achieve
# this aim, the NMR restraints were parsed from their original format files, and
# the coordinates and NMR restraints information were subsequently harmonized.
#
# Due to the complexity of this harmonization process, minor modifications could
# have occurred to the NMR restraints information, or data could have been lost
# because of parsing or conversion errors. The PDB file remains the
# authoritative reference for the atomic coordinates and the originally deposited
# restraints files remain the primary reference for these data.
#
# This file is generated at the BioMagResBank (BMRB) in collaboration with the
# PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and
# the CMBI/IMM group at the Radboud University of Nijmegen.
#
# Several software packages were used to produce this file:
#
# - Wattos (BMRB and CMBI/IMM).
# - FormatConverter and NMRStarExport (PDBe).
# - CCPN framework (http://www.ccpn.ac.uk/).
#
# More information about this process can be found in the references below.
# Please cite the original reference for this PDB entry.
#
# JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL
# Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED
# containing converted and filtered sets of experimental NMR restraints and
# coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12.
#
# WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL
# Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy:
# development of a software pipeline. Proteins 59, 687-696.
#
# JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend,
# JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with
# curated sets of experimental NMR restraints for over 4,000 protein and nucleic
# acid PDB entries. (in preparation)
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID rr_1r02
_Entry.Title "wwPDB remediated NMR restraints for PDB entry 1r02"
_Entry.NMR_STAR_version 3.1
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype solution
_Entry.Details "Contains the remediated restraint lists and coordinates for PDB entry 1r02"
save_
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID rr_1r02
_Assembly.ID 1
_Assembly.Name 1r02
_Assembly.Number_of_components 1
_Assembly.Organic_ligands 0
_Assembly.Metal_ions 0
_Assembly.Non_standard_bonds no
_Assembly.Paramagnetic no
_Assembly.Thiol_state "all free"
_Assembly.Molecular_mass 3582.1591
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 "Orexin A" 1 $Orexin_A A . no . . . . . . rr_1r02 1
stop_
save_
save_Orexin_A
_Entity.Sf_category entity
_Entity.Sf_framecode Orexin_A
_Entity.Entry_ID rr_1r02
_Entity.ID 1
_Entity.Name Orexin_A
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_strand_ID A
_Entity.Polymer_seq_one_letter_code
;QPLPDCCRQKTCSCRLYELL
HGAGNHAAGILTL
;
_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 33
_Entity.Paramagnetic no
_Entity.Thiol_state "all free"
_Entity.Parent_entity_ID 1
_Entity.Formula_weight 3582.1591
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 . GLN . rr_1r02 1
2 . PRO . rr_1r02 1
3 . LEU . rr_1r02 1
4 . PRO . rr_1r02 1
5 . ASP . rr_1r02 1
6 . CYS . rr_1r02 1
7 . CYS . rr_1r02 1
8 . ARG . rr_1r02 1
9 . GLN . rr_1r02 1
10 . LYS . rr_1r02 1
11 . THR . rr_1r02 1
12 . CYS . rr_1r02 1
13 . SER . rr_1r02 1
14 . CYS . rr_1r02 1
15 . ARG . rr_1r02 1
16 . LEU . rr_1r02 1
17 . TYR . rr_1r02 1
18 . GLU . rr_1r02 1
19 . LEU . rr_1r02 1
20 . LEU . rr_1r02 1
21 . HIS . rr_1r02 1
22 . GLY . rr_1r02 1
23 . ALA . rr_1r02 1
24 . GLY . rr_1r02 1
25 . ASN . rr_1r02 1
26 . HIS . rr_1r02 1
27 . ALA . rr_1r02 1
28 . ALA . rr_1r02 1
29 . GLY . rr_1r02 1
30 . ILE . rr_1r02 1
31 . LEU . rr_1r02 1
32 . THR . rr_1r02 1
33 . LEU . rr_1r02 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
. GLN 1 1 rr_1r02 1
. PRO 2 2 rr_1r02 1
. LEU 3 3 rr_1r02 1
. PRO 4 4 rr_1r02 1
. ASP 5 5 rr_1r02 1
. CYS 6 6 rr_1r02 1
. CYS 7 7 rr_1r02 1
. ARG 8 8 rr_1r02 1
. GLN 9 9 rr_1r02 1
. LYS 10 10 rr_1r02 1
. THR 11 11 rr_1r02 1
. CYS 12 12 rr_1r02 1
. SER 13 13 rr_1r02 1
. CYS 14 14 rr_1r02 1
. ARG 15 15 rr_1r02 1
. LEU 16 16 rr_1r02 1
. TYR 17 17 rr_1r02 1
. GLU 18 18 rr_1r02 1
. LEU 19 19 rr_1r02 1
. LEU 20 20 rr_1r02 1
. HIS 21 21 rr_1r02 1
. GLY 22 22 rr_1r02 1
. ALA 23 23 rr_1r02 1
. GLY 24 24 rr_1r02 1
. ASN 25 25 rr_1r02 1
. HIS 26 26 rr_1r02 1
. ALA 27 27 rr_1r02 1
. ALA 28 28 rr_1r02 1
. GLY 29 29 rr_1r02 1
. ILE 30 30 rr_1r02 1
. LEU 31 31 rr_1r02 1
. THR 32 32 rr_1r02 1
. LEU 33 33 rr_1r02 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_1r02
_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_1r02
_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_1r02 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_1r02 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 GLN C C 5.275 19.686 1.047 . . . 1.0 . . . . . . . . . . . . A . 1 GLN C . . . . . . . . . rr_1r02 1
. 1 . 2 . 1 1 1 GLN CA C 5.949 20.973 1.534 . . . 1.0 . . . . . . . . . . . . A . 1 GLN CA . . . . . . . . . rr_1r02 1
. 1 . 3 . 1 1 1 GLN CB C 4.928 22.115 1.616 . . . 1.0 . . . . . . . . . . . . A . 1 GLN CB . . . . . . . . . rr_1r02 1
. 1 . 4 . 1 1 1 GLN CD C 3.987 21.223 3.784 . . . 1.0 . . . . . . . . . . . . A . 1 GLN CD . . . . . . . . . rr_1r02 1
. 1 . 5 . 1 1 1 GLN CG C 3.676 21.765 2.403 . . . 1.0 . . . . . . . . . . . . A . 1 GLN CG . . . . . . . . . rr_1r02 1
. 1 . 6 . 1 1 1 GLN H1 H 7.823 21.771 1.239 . . . 1.0 . . . . . . . . . . . . A . 1 GLN H1 . . . . . . . . . rr_1r02 1
. 1 . 7 . 1 1 1 GLN H2 H 6.702 22.105 -0.016 . . . 1.0 . . . . . . . . . . . . A . 1 GLN H2 . . . . . . . . . rr_1r02 1
. 1 . 8 . 1 1 1 GLN H3 H 7.392 20.540 0.130 . . . 1.0 . . . . . . . . . . . . A . 1 GLN H3 . . . . . . . . . rr_1r02 1
. 1 . 9 . 1 1 1 GLN HA H 6.354 20.797 2.521 . . . 1.0 . . . . . . . . . . . . A . 1 GLN HA . . . . . . . . . rr_1r02 1
. 1 . 10 . 1 1 1 GLN HB2 H 5.397 22.965 2.088 . . . 1.0 . . . . . . . . . . . . A . 1 GLN HB2 . . . . . . . . . rr_1r02 1
. 1 . 11 . 1 1 1 GLN HB3 H 4.631 22.391 0.615 . . . 1.0 . . . . . . . . . . . . A . 1 GLN HB3 . . . . . . . . . rr_1r02 1
. 1 . 12 . 1 1 1 GLN HG2 H 3.073 22.656 2.510 . . . 1.0 . . . . . . . . . . . . A . 1 GLN HG2 . . . . . . . . . rr_1r02 1
. 1 . 13 . 1 1 1 GLN HG3 H 3.119 21.019 1.857 . . . 1.0 . . . . . . . . . . . . A . 1 GLN HG3 . . . . . . . . . rr_1r02 1
. 1 . 14 . 1 1 1 GLN N N 7.066 21.384 0.641 . . . 1.0 . . . . . . . . . . . . A . 1 GLN N . . . . . . . . . rr_1r02 1
. 1 . 15 . 1 1 1 GLN NE2 N 4.475 22.002 4.632 . . . 1.0 . . . . . . . . . . . . A . 1 GLN NE2 . . . . . . . . . rr_1r02 1
. 1 . 16 . 1 1 1 GLN O O 5.014 18.782 1.840 . . . 1.0 . . . . . . . . . . . . A . 1 GLN O . . . . . . . . . rr_1r02 1
. 1 . 17 . 1 1 1 GLN OE1 O 3.745 20.021 4.019 . . . 1.0 . . . . . . . . . . . . A . 1 GLN OE1 . . . . . . . . . rr_1r02 1
. 1 . 18 . 1 1 2 PRO C C 5.069 17.099 -0.447 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . rr_1r02 1
. 1 . 19 . 1 1 2 PRO CA C 4.342 18.385 -0.827 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . rr_1r02 1
. 1 . 20 . 1 1 2 PRO CB C 4.420 18.613 -2.338 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . rr_1r02 1
. 1 . 21 . 1 1 2 PRO CD C 5.254 20.596 -1.300 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . rr_1r02 1
. 1 . 22 . 1 1 2 PRO CG C 4.493 20.092 -2.493 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . rr_1r02 1
. 1 . 23 . 1 1 2 PRO HA H 3.307 18.314 -0.523 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . rr_1r02 1
. 1 . 24 . 1 1 2 PRO HB2 H 5.300 18.128 -2.734 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . rr_1r02 1
. 1 . 25 . 1 1 2 PRO HB3 H 3.536 18.211 -2.811 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . rr_1r02 1
. 1 . 26 . 1 1 2 PRO HD2 H 6.311 20.649 -1.521 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . rr_1r02 1
. 1 . 27 . 1 1 2 PRO HD3 H 4.883 21.562 -0.997 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . rr_1r02 1
. 1 . 28 . 1 1 2 PRO HG2 H 5.017 20.340 -3.405 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . rr_1r02 1
. 1 . 29 . 1 1 2 PRO HG3 H 3.497 20.510 -2.506 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . rr_1r02 1
. 1 . 30 . 1 1 2 PRO N N 4.985 19.578 -0.265 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . rr_1r02 1
. 1 . 31 . 1 1 2 PRO O O 4.476 16.021 -0.438 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . rr_1r02 1
. 1 . 32 . 1 1 3 LEU C C 7.187 15.037 -0.890 . . . 1.0 . . . . . . . . . . . . A . 3 LEU C . . . . . . . . . rr_1r02 1
. 1 . 33 . 1 1 3 LEU CA C 7.159 16.061 0.243 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CA . . . . . . . . . rr_1r02 1
. 1 . 34 . 1 1 3 LEU CB C 6.595 15.420 1.515 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CB . . . . . . . . . rr_1r02 1
. 1 . 35 . 1 1 3 LEU CD1 C 6.447 15.364 4.017 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD1 . . . . . . . . . rr_1r02 1
. 1 . 36 . 1 1 3 LEU CD2 C 8.375 16.511 2.912 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD2 . . . . . . . . . rr_1r02 1
. 1 . 37 . 1 1 3 LEU CG C 6.892 16.177 2.811 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CG . . . . . . . . . rr_1r02 1
. 1 . 38 . 1 1 3 LEU H H 6.778 18.104 -0.161 . . . 1.0 . . . . . . . . . . . . A . 3 LEU H . . . . . . . . . rr_1r02 1
. 1 . 39 . 1 1 3 LEU HA H 8.166 16.399 0.435 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HA . . . . . . . . . rr_1r02 1
. 1 . 40 . 1 1 3 LEU HB2 H 5.522 15.345 1.407 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB2 . . . . . . . . . rr_1r02 1
. 1 . 41 . 1 1 3 LEU HB3 H 6.999 14.424 1.605 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB3 . . . . . . . . . rr_1r02 1
. 1 . 42 . 1 1 3 LEU HD11 H 6.310 16.019 4.865 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD11 . . . . . . . . . rr_1r02 1
. 1 . 43 . 1 1 3 LEU HD12 H 7.200 14.624 4.251 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD12 . . . . . . . . . rr_1r02 1
. 1 . 44 . 1 1 3 LEU HD13 H 5.514 14.868 3.793 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD13 . . . . . . . . . rr_1r02 1
. 1 . 45 . 1 1 3 LEU HD21 H 8.940 15.836 2.288 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD21 . . . . . . . . . rr_1r02 1
. 1 . 46 . 1 1 3 LEU HD22 H 8.699 16.411 3.936 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD22 . . . . . . . . . rr_1r02 1
. 1 . 47 . 1 1 3 LEU HD23 H 8.537 17.526 2.582 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD23 . . . . . . . . . rr_1r02 1
. 1 . 48 . 1 1 3 LEU HG H 6.339 17.105 2.815 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HG . . . . . . . . . rr_1r02 1
. 1 . 49 . 1 1 3 LEU N N 6.357 17.218 -0.135 . . . 1.0 . . . . . . . . . . . . A . 3 LEU N . . . . . . . . . rr_1r02 1
. 1 . 50 . 1 1 3 LEU O O 6.360 15.090 -1.798 . . . 1.0 . . . . . . . . . . . . A . 3 LEU O . . . . . . . . . rr_1r02 1
. 1 . 51 . 1 1 4 PRO C C 6.918 12.489 -2.304 . . . 1.0 . . . . . . . . . . . . A . 4 PRO C . . . . . . . . . rr_1r02 1
. 1 . 52 . 1 1 4 PRO CA C 8.271 13.051 -1.880 . . . 1.0 . . . . . . . . . . . . A . 4 PRO CA . . . . . . . . . rr_1r02 1
. 1 . 53 . 1 1 4 PRO CB C 9.122 11.963 -1.203 . . . 1.0 . . . . . . . . . . . . A . 4 PRO CB . . . . . . . . . rr_1r02 1
. 1 . 54 . 1 1 4 PRO CD C 9.170 13.934 0.178 . . . 1.0 . . . . . . . . . . . . A . 4 PRO CD . . . . . . . . . rr_1r02 1
. 1 . 55 . 1 1 4 PRO CG C 9.396 12.451 0.188 . . . 1.0 . . . . . . . . . . . . A . 4 PRO CG . . . . . . . . . rr_1r02 1
. 1 . 56 . 1 1 4 PRO HA H 8.789 13.425 -2.752 . . . 1.0 . . . . . . . . . . . . A . 4 PRO HA . . . . . . . . . rr_1r02 1
. 1 . 57 . 1 1 4 PRO HB2 H 8.574 11.034 -1.189 . . . 1.0 . . . . . . . . . . . . A . 4 PRO HB2 . . . . . . . . . rr_1r02 1
. 1 . 58 . 1 1 4 PRO HB3 H 10.040 11.831 -1.757 . . . 1.0 . . . . . . . . . . . . A . 4 PRO HB3 . . . . . . . . . rr_1r02 1
. 1 . 59 . 1 1 4 PRO HD2 H 8.813 14.272 1.138 . . . 1.0 . . . . . . . . . . . . A . 4 PRO HD2 . . . . . . . . . rr_1r02 1
. 1 . 60 . 1 1 4 PRO HD3 H 10.075 14.454 -0.098 . . . 1.0 . . . . . . . . . . . . A . 4 PRO HD3 . . . . . . . . . rr_1r02 1
. 1 . 61 . 1 1 4 PRO HG2 H 8.717 11.976 0.881 . . . 1.0 . . . . . . . . . . . . A . 4 PRO HG2 . . . . . . . . . rr_1r02 1
. 1 . 62 . 1 1 4 PRO HG3 H 10.419 12.231 0.459 . . . 1.0 . . . . . . . . . . . . A . 4 PRO HG3 . . . . . . . . . rr_1r02 1
. 1 . 63 . 1 1 4 PRO N N 8.143 14.087 -0.855 . . . 1.0 . . . . . . . . . . . . A . 4 PRO N . . . . . . . . . rr_1r02 1
. 1 . 64 . 1 1 4 PRO O O 6.125 12.056 -1.470 . . . 1.0 . . . . . . . . . . . . A . 4 PRO O . . . . . . . . . rr_1r02 1
. 1 . 65 . 1 1 5 ASP C C 5.063 10.629 -3.623 . . . 1.0 . . . . . . . . . . . . A . 5 ASP C . . . . . . . . . rr_1r02 1
. 1 . 66 . 1 1 5 ASP CA C 5.403 12.018 -4.160 . . . 1.0 . . . . . . . . . . . . A . 5 ASP CA . . . . . . . . . rr_1r02 1
. 1 . 67 . 1 1 5 ASP CB C 5.478 11.978 -5.687 . . . 1.0 . . . . . . . . . . . . A . 5 ASP CB . . . . . . . . . rr_1r02 1
. 1 . 68 . 1 1 5 ASP CG C 4.157 12.332 -6.341 . . . 1.0 . . . . . . . . . . . . A . 5 ASP CG . . . . . . . . . rr_1r02 1
. 1 . 69 . 1 1 5 ASP H H 7.335 12.879 -4.219 . . . 1.0 . . . . . . . . . . . . A . 5 ASP H . . . . . . . . . rr_1r02 1
. 1 . 70 . 1 1 5 ASP HA H 4.622 12.703 -3.867 . . . 1.0 . . . . . . . . . . . . A . 5 ASP HA . . . . . . . . . rr_1r02 1
. 1 . 71 . 1 1 5 ASP HB2 H 6.224 12.684 -6.022 . . . 1.0 . . . . . . . . . . . . A . 5 ASP HB2 . . . . . . . . . rr_1r02 1
. 1 . 72 . 1 1 5 ASP HB3 H 5.761 10.985 -6.002 . . . 1.0 . . . . . . . . . . . . A . 5 ASP HB3 . . . . . . . . . rr_1r02 1
. 1 . 73 . 1 1 5 ASP N N 6.661 12.512 -3.609 . . . 1.0 . . . . . . . . . . . . A . 5 ASP N . . . . . . . . . rr_1r02 1
. 1 . 74 . 1 1 5 ASP O O 5.459 9.616 -4.199 . . . 1.0 . . . . . . . . . . . . A . 5 ASP O . . . . . . . . . rr_1r02 1
. 1 . 75 . 1 1 5 ASP OD1 O 3.122 11.763 -5.934 . . . 1.0 . . . . . . . . . . . . A . 5 ASP OD1 . . . . . . . . . rr_1r02 1
. 1 . 76 . 1 1 5 ASP OD2 O 4.157 13.178 -7.260 . . . 1.0 . . . . . . . . . . . . A . 5 ASP OD2 . . . . . . . . . rr_1r02 1
. 1 . 77 . 1 1 6 CYS C C 2.560 8.906 -2.404 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . rr_1r02 1
. 1 . 78 . 1 1 6 CYS CA C 3.932 9.344 -1.901 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . rr_1r02 1
. 1 . 79 . 1 1 6 CYS CB C 3.921 9.486 -0.377 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . rr_1r02 1
. 1 . 80 . 1 1 6 CYS H H 4.045 11.423 -2.104 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . rr_1r02 1
. 1 . 81 . 1 1 6 CYS HA H 4.660 8.612 -2.179 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . rr_1r02 1
. 1 . 82 . 1 1 6 CYS HB2 H 3.835 10.532 -0.122 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . rr_1r02 1
. 1 . 83 . 1 1 6 CYS HB3 H 3.071 8.955 0.019 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . rr_1r02 1
. 1 . 84 . 1 1 6 CYS N N 4.328 10.593 -2.515 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . rr_1r02 1
. 1 . 85 . 1 1 6 CYS O O 1.599 8.829 -1.638 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . rr_1r02 1
. 1 . 86 . 1 1 6 CYS SG S 5.414 8.839 0.444 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . rr_1r02 1
. 1 . 87 . 1 1 7 CYS C C 0.168 9.297 -4.203 . . . 1.0 . . . . . . . . . . . . A . 7 CYS C . . . . . . . . . rr_1r02 1
. 1 . 88 . 1 1 7 CYS CA C 1.222 8.201 -4.314 . . . 1.0 . . . . . . . . . . . . A . 7 CYS CA . . . . . . . . . rr_1r02 1
. 1 . 89 . 1 1 7 CYS CB C 0.714 6.915 -3.658 . . . 1.0 . . . . . . . . . . . . A . 7 CYS CB . . . . . . . . . rr_1r02 1
. 1 . 90 . 1 1 7 CYS H H 3.275 8.712 -4.262 . . . 1.0 . . . . . . . . . . . . A . 7 CYS H . . . . . . . . . rr_1r02 1
. 1 . 91 . 1 1 7 CYS HA H 1.413 8.009 -5.359 . . . 1.0 . . . . . . . . . . . . A . 7 CYS HA . . . . . . . . . rr_1r02 1
. 1 . 92 . 1 1 7 CYS HB2 H 0.654 7.065 -2.590 . . . 1.0 . . . . . . . . . . . . A . 7 CYS HB2 . . . . . . . . . rr_1r02 1
. 1 . 93 . 1 1 7 CYS HB3 H -0.271 6.690 -4.040 . . . 1.0 . . . . . . . . . . . . A . 7 CYS HB3 . . . . . . . . . rr_1r02 1
. 1 . 94 . 1 1 7 CYS N N 2.476 8.626 -3.702 . . . 1.0 . . . . . . . . . . . . A . 7 CYS N . . . . . . . . . rr_1r02 1
. 1 . 95 . 1 1 7 CYS O O -0.782 9.187 -3.428 . . . 1.0 . . . . . . . . . . . . A . 7 CYS O . . . . . . . . . rr_1r02 1
. 1 . 96 . 1 1 7 CYS SG S 1.771 5.464 -3.955 . . . 1.0 . . . . . . . . . . . . A . 7 CYS SG . . . . . . . . . rr_1r02 1
. 1 . 97 . 1 1 8 ARG C C -0.588 12.192 -3.639 . . . 1.0 . . . . . . . . . . . . A . 8 ARG C . . . . . . . . . rr_1r02 1
. 1 . 98 . 1 1 8 ARG CA C -0.592 11.476 -4.987 . . . 1.0 . . . . . . . . . . . . A . 8 ARG CA . . . . . . . . . rr_1r02 1
. 1 . 99 . 1 1 8 ARG CB C -2.004 10.990 -5.320 . . . 1.0 . . . . . . . . . . . . A . 8 ARG CB . . . . . . . . . rr_1r02 1
. 1 . 100 . 1 1 8 ARG CD C -3.003 12.565 -6.999 . . . 1.0 . . . . . . . . . . . . A . 8 ARG CD . . . . . . . . . rr_1r02 1
. 1 . 101 . 1 1 8 ARG CG C -2.388 11.193 -6.775 . . . 1.0 . . . . . . . . . . . . A . 8 ARG CG . . . . . . . . . rr_1r02 1
. 1 . 102 . 1 1 8 ARG CZ C -1.103 14.133 -7.042 . . . 1.0 . . . . . . . . . . . . A . 8 ARG CZ . . . . . . . . . rr_1r02 1
. 1 . 103 . 1 1 8 ARG H H 1.119 10.384 -5.586 . . . 1.0 . . . . . . . . . . . . A . 8 ARG H . . . . . . . . . rr_1r02 1
. 1 . 104 . 1 1 8 ARG HA H -0.272 12.172 -5.748 . . . 1.0 . . . . . . . . . . . . A . 8 ARG HA . . . . . . . . . rr_1r02 1
. 1 . 105 . 1 1 8 ARG HB2 H -2.070 9.935 -5.096 . . . 1.0 . . . . . . . . . . . . A . 8 ARG HB2 . . . . . . . . . rr_1r02 1
. 1 . 106 . 1 1 8 ARG HB3 H -2.713 11.525 -4.705 . . . 1.0 . . . . . . . . . . . . A . 8 ARG HB3 . . . . . . . . . rr_1r02 1
. 1 . 107 . 1 1 8 ARG HD2 H -3.115 12.726 -8.062 . . . 1.0 . . . . . . . . . . . . A . 8 ARG HD2 . . . . . . . . . rr_1r02 1
. 1 . 108 . 1 1 8 ARG HD3 H -3.977 12.588 -6.531 . . . 1.0 . . . . . . . . . . . . A . 8 ARG HD3 . . . . . . . . . rr_1r02 1
. 1 . 109 . 1 1 8 ARG HE H -2.449 14.007 -5.574 . . . 1.0 . . . . . . . . . . . . A . 8 ARG HE . . . . . . . . . rr_1r02 1
. 1 . 110 . 1 1 8 ARG HG2 H -1.503 11.103 -7.386 . . . 1.0 . . . . . . . . . . . . A . 8 ARG HG2 . . . . . . . . . rr_1r02 1
. 1 . 111 . 1 1 8 ARG HG3 H -3.102 10.436 -7.058 . . . 1.0 . . . . . . . . . . . . A . 8 ARG HG3 . . . . . . . . . rr_1r02 1
. 1 . 112 . 1 1 8 ARG HH11 H -1.213 12.909 -8.648 . . . 1.0 . . . . . . . . . . . . A . 8 ARG HH11 . . . . . . . . . rr_1r02 1
. 1 . 113 . 1 1 8 ARG HH12 H 0.107 14.030 -8.657 . . . 1.0 . . . . . . . . . . . . A . 8 ARG HH12 . . . . . . . . . rr_1r02 1
. 1 . 114 . 1 1 8 ARG HH21 H -0.714 15.484 -5.587 . . . 1.0 . . . . . . . . . . . . A . 8 ARG HH21 . . . . . . . . . rr_1r02 1
. 1 . 115 . 1 1 8 ARG HH22 H 0.390 15.491 -6.922 . . . 1.0 . . . . . . . . . . . . A . 8 ARG HH22 . . . . . . . . . rr_1r02 1
. 1 . 116 . 1 1 8 ARG N N 0.343 10.357 -4.989 . . . 1.0 . . . . . . . . . . . . A . 8 ARG N . . . . . . . . . rr_1r02 1
. 1 . 117 . 1 1 8 ARG NE N -2.182 13.636 -6.440 . . . 1.0 . . . . . . . . . . . . A . 8 ARG NE . . . . . . . . . rr_1r02 1
. 1 . 118 . 1 1 8 ARG NH1 N -0.703 13.651 -8.212 . . . 1.0 . . . . . . . . . . . . A . 8 ARG NH1 . . . . . . . . . rr_1r02 1
. 1 . 119 . 1 1 8 ARG NH2 N -0.420 15.116 -6.469 . . . 1.0 . . . . . . . . . . . . A . 8 ARG NH2 . . . . . . . . . rr_1r02 1
. 1 . 120 . 1 1 8 ARG O O -1.576 12.824 -3.260 . . . 1.0 . . . . . . . . . . . . A . 8 ARG O . . . . . . . . . rr_1r02 1
. 1 . 121 . 1 1 9 GLN C C -0.448 12.255 -0.667 . . . 1.0 . . . . . . . . . . . . A . 9 GLN C . . . . . . . . . rr_1r02 1
. 1 . 122 . 1 1 9 GLN CA C 0.649 12.732 -1.613 . . . 1.0 . . . . . . . . . . . . A . 9 GLN CA . . . . . . . . . rr_1r02 1
. 1 . 123 . 1 1 9 GLN CB C 0.583 14.254 -1.763 . . . 1.0 . . . . . . . . . . . . A . 9 GLN CB . . . . . . . . . rr_1r02 1
. 1 . 124 . 1 1 9 GLN CD C 0.166 16.215 -0.226 . . . 1.0 . . . . . . . . . . . . A . 9 GLN CD . . . . . . . . . rr_1r02 1
. 1 . 125 . 1 1 9 GLN CG C 1.035 15.008 -0.524 . . . 1.0 . . . . . . . . . . . . A . 9 GLN CG . . . . . . . . . rr_1r02 1
. 1 . 126 . 1 1 9 GLN H H 1.280 11.575 -3.270 . . . 1.0 . . . . . . . . . . . . A . 9 GLN H . . . . . . . . . rr_1r02 1
. 1 . 127 . 1 1 9 GLN HA H 1.609 12.460 -1.200 . . . 1.0 . . . . . . . . . . . . A . 9 GLN HA . . . . . . . . . rr_1r02 1
. 1 . 128 . 1 1 9 GLN HB2 H 1.213 14.550 -2.589 . . . 1.0 . . . . . . . . . . . . A . 9 GLN HB2 . . . . . . . . . rr_1r02 1
. 1 . 129 . 1 1 9 GLN HB3 H -0.437 14.538 -1.980 . . . 1.0 . . . . . . . . . . . . A . 9 GLN HB3 . . . . . . . . . rr_1r02 1
. 1 . 130 . 1 1 9 GLN HE21 H 0.403 15.934 1.728 . . . 1.0 . . . . . . . . . . . . A . 9 GLN HE21 . . . . . . . . . rr_1r02 1
. 1 . 131 . 1 1 9 GLN HE22 H -0.580 17.281 1.276 . . . 1.0 . . . . . . . . . . . . A . 9 GLN HE22 . . . . . . . . . rr_1r02 1
. 1 . 132 . 1 1 9 GLN HG2 H 0.997 14.339 0.323 . . . 1.0 . . . . . . . . . . . . A . 9 GLN HG2 . . . . . . . . . rr_1r02 1
. 1 . 133 . 1 1 9 GLN HG3 H 2.051 15.341 -0.672 . . . 1.0 . . . . . . . . . . . . A . 9 GLN HG3 . . . . . . . . . rr_1r02 1
. 1 . 134 . 1 1 9 GLN N N 0.525 12.091 -2.918 . . . 1.0 . . . . . . . . . . . . A . 9 GLN N . . . . . . . . . rr_1r02 1
. 1 . 135 . 1 1 9 GLN NE2 N -0.023 16.507 1.055 . . . 1.0 . . . . . . . . . . . . A . 9 GLN NE2 . . . . . . . . . rr_1r02 1
. 1 . 136 . 1 1 9 GLN O O -0.985 13.034 0.122 . . . 1.0 . . . . . . . . . . . . A . 9 GLN O . . . . . . . . . rr_1r02 1
. 1 . 137 . 1 1 9 GLN OE1 O -0.329 16.878 -1.138 . . . 1.0 . . . . . . . . . . . . A . 9 GLN OE1 . . . . . . . . . rr_1r02 1
. 1 . 138 . 1 1 10 LYS C C -1.236 9.834 1.379 . . . 1.0 . . . . . . . . . . . . A . 10 LYS C . . . . . . . . . rr_1r02 1
. 1 . 139 . 1 1 10 LYS CA C -1.814 10.388 0.079 . . . 1.0 . . . . . . . . . . . . A . 10 LYS CA . . . . . . . . . rr_1r02 1
. 1 . 140 . 1 1 10 LYS CB C -2.545 9.280 -0.681 . . . 1.0 . . . . . . . . . . . . A . 10 LYS CB . . . . . . . . . rr_1r02 1
. 1 . 141 . 1 1 10 LYS CD C -4.769 10.085 -1.529 . . . 1.0 . . . . . . . . . . . . A . 10 LYS CD . . . . . . . . . rr_1r02 1
. 1 . 142 . 1 1 10 LYS CE C -4.878 11.550 -1.144 . . . 1.0 . . . . . . . . . . . . A . 10 LYS CE . . . . . . . . . rr_1r02 1
. 1 . 143 . 1 1 10 LYS CG C -4.049 9.280 -0.459 . . . 1.0 . . . . . . . . . . . . A . 10 LYS CG . . . . . . . . . rr_1r02 1
. 1 . 144 . 1 1 10 LYS H H -0.331 10.407 -1.402 . . . 1.0 . . . . . . . . . . . . A . 10 LYS H . . . . . . . . . rr_1r02 1
. 1 . 145 . 1 1 10 LYS HA H -2.509 11.168 0.310 . . . 1.0 . . . . . . . . . . . . A . 10 LYS HA . . . . . . . . . rr_1r02 1
. 1 . 146 . 1 1 10 LYS HB2 H -2.359 9.402 -1.738 . . . 1.0 . . . . . . . . . . . . A . 10 LYS HB2 . . . . . . . . . rr_1r02 1
. 1 . 147 . 1 1 10 LYS HB3 H -2.156 8.324 -0.363 . . . 1.0 . . . . . . . . . . . . A . 10 LYS HB3 . . . . . . . . . rr_1r02 1
. 1 . 148 . 1 1 10 LYS HD2 H -4.219 10.006 -2.455 . . . 1.0 . . . . . . . . . . . . A . 10 LYS HD2 . . . . . . . . . rr_1r02 1
. 1 . 149 . 1 1 10 LYS HD3 H -5.761 9.680 -1.662 . . . 1.0 . . . . . . . . . . . . A . 10 LYS HD3 . . . . . . . . . rr_1r02 1
. 1 . 150 . 1 1 10 LYS HE2 H -3.883 11.957 -1.036 . . . 1.0 . . . . . . . . . . . . A . 10 LYS HE2 . . . . . . . . . rr_1r02 1
. 1 . 151 . 1 1 10 LYS HE3 H -5.398 12.078 -1.929 . . . 1.0 . . . . . . . . . . . . A . 10 LYS HE3 . . . . . . . . . rr_1r02 1
. 1 . 152 . 1 1 10 LYS HG2 H -4.407 8.262 -0.486 . . . 1.0 . . . . . . . . . . . . A . 10 LYS HG2 . . . . . . . . . rr_1r02 1
. 1 . 153 . 1 1 10 LYS HG3 H -4.260 9.712 0.508 . . . 1.0 . . . . . . . . . . . . A . 10 LYS HG3 . . . . . . . . . rr_1r02 1
. 1 . 154 . 1 1 10 LYS HZ1 H -6.044 12.683 0.169 . . . 1.0 . . . . . . . . . . . . A . 10 LYS HZ1 . . . . . . . . . rr_1r02 1
. 1 . 155 . 1 1 10 LYS HZ2 H -4.968 11.631 0.942 . . . 1.0 . . . . . . . . . . . . A . 10 LYS HZ2 . . . . . . . . . rr_1r02 1
. 1 . 156 . 1 1 10 LYS HZ3 H -6.371 11.023 0.219 . . . 1.0 . . . . . . . . . . . . A . 10 LYS HZ3 . . . . . . . . . rr_1r02 1
. 1 . 157 . 1 1 10 LYS N N -0.782 10.971 -0.756 . . . 1.0 . . . . . . . . . . . . A . 10 LYS N . . . . . . . . . rr_1r02 1
. 1 . 158 . 1 1 10 LYS NZ N -5.617 11.735 0.136 . . . 1.0 . . . . . . . . . . . . A . 10 LYS NZ . . . . . . . . . rr_1r02 1
. 1 . 159 . 1 1 10 LYS O O -1.820 8.940 1.988 . . . 1.0 . . . . . . . . . . . . A . 10 LYS O . . . . . . . . . rr_1r02 1
. 1 . 160 . 1 1 11 THR C C 1.287 8.589 2.817 . . . 1.0 . . . . . . . . . . . . A . 11 THR C . . . . . . . . . rr_1r02 1
. 1 . 161 . 1 1 11 THR CA C 0.568 9.924 3.029 . . . 1.0 . . . . . . . . . . . . A . 11 THR CA . . . . . . . . . rr_1r02 1
. 1 . 162 . 1 1 11 THR CB C -0.446 9.832 4.184 . . . 1.0 . . . . . . . . . . . . A . 11 THR CB . . . . . . . . . rr_1r02 1
. 1 . 163 . 1 1 11 THR CG2 C -0.915 8.424 4.505 . . . 1.0 . . . . . . . . . . . . A . 11 THR CG2 . . . . . . . . . rr_1r02 1
. 1 . 164 . 1 1 11 THR H H 0.329 11.076 1.269 . . . 1.0 . . . . . . . . . . . . A . 11 THR H . . . . . . . . . rr_1r02 1
. 1 . 165 . 1 1 11 THR HA H 1.309 10.669 3.280 . . . 1.0 . . . . . . . . . . . . A . 11 THR HA . . . . . . . . . rr_1r02 1
. 1 . 166 . 1 1 11 THR HB H -1.318 10.417 3.924 . . . 1.0 . . . . . . . . . . . . A . 11 THR HB . . . . . . . . . rr_1r02 1
. 1 . 167 . 1 1 11 THR HG1 H -0.001 11.330 5.367 . . . 1.0 . . . . . . . . . . . . A . 11 THR HG1 . . . . . . . . . rr_1r02 1
. 1 . 168 . 1 1 11 THR HG21 H -1.918 8.459 4.906 . . . 1.0 . . . . . . . . . . . . A . 11 THR HG21 . . . . . . . . . rr_1r02 1
. 1 . 169 . 1 1 11 THR HG22 H -0.252 7.981 5.234 . . . 1.0 . . . . . . . . . . . . A . 11 THR HG22 . . . . . . . . . rr_1r02 1
. 1 . 170 . 1 1 11 THR HG23 H -0.909 7.827 3.606 . . . 1.0 . . . . . . . . . . . . A . 11 THR HG23 . . . . . . . . . rr_1r02 1
. 1 . 171 . 1 1 11 THR N N -0.089 10.368 1.800 . . . 1.0 . . . . . . . . . . . . A . 11 THR N . . . . . . . . . rr_1r02 1
. 1 . 172 . 1 1 11 THR O O 1.626 7.896 3.776 . . . 1.0 . . . . . . . . . . . . A . 11 THR O . . . . . . . . . rr_1r02 1
. 1 . 173 . 1 1 11 THR OG1 O 0.103 10.375 5.371 . . . 1.0 . . . . . . . . . . . . A . 11 THR OG1 . . . . . . . . . rr_1r02 1
. 1 . 174 . 1 1 12 CYS C C 1.353 5.785 1.590 . . . 1.0 . . . . . . . . . . . . A . 12 CYS C . . . . . . . . . rr_1r02 1
. 1 . 175 . 1 1 12 CYS CA C 2.204 6.996 1.217 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CA . . . . . . . . . rr_1r02 1
. 1 . 176 . 1 1 12 CYS CB C 3.566 6.929 1.915 . . . 1.0 . . . . . . . . . . . . A . 12 CYS CB . . . . . . . . . rr_1r02 1
. 1 . 177 . 1 1 12 CYS H H 1.234 8.835 0.831 . . . 1.0 . . . . . . . . . . . . A . 12 CYS H . . . . . . . . . rr_1r02 1
. 1 . 178 . 1 1 12 CYS HA H 2.360 6.989 0.147 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HA . . . . . . . . . rr_1r02 1
. 1 . 179 . 1 1 12 CYS HB2 H 3.683 7.801 2.541 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB2 . . . . . . . . . rr_1r02 1
. 1 . 180 . 1 1 12 CYS HB3 H 3.608 6.042 2.528 . . . 1.0 . . . . . . . . . . . . A . 12 CYS HB3 . . . . . . . . . rr_1r02 1
. 1 . 181 . 1 1 12 CYS N N 1.521 8.240 1.555 . . . 1.0 . . . . . . . . . . . . A . 12 CYS N . . . . . . . . . rr_1r02 1
. 1 . 182 . 1 1 12 CYS O O 1.857 4.798 2.127 . . . 1.0 . . . . . . . . . . . . A . 12 CYS O . . . . . . . . . rr_1r02 1
. 1 . 183 . 1 1 12 CYS SG S 4.983 6.881 0.769 . . . 1.0 . . . . . . . . . . . . A . 12 CYS SG . . . . . . . . . rr_1r02 1
. 1 . 184 . 1 1 13 SER C C -0.442 3.499 0.874 . . . 1.0 . . . . . . . . . . . . A . 13 SER C . . . . . . . . . rr_1r02 1
. 1 . 185 . 1 1 13 SER CA C -0.861 4.777 1.595 . . . 1.0 . . . . . . . . . . . . A . 13 SER CA . . . . . . . . . rr_1r02 1
. 1 . 186 . 1 1 13 SER CB C -2.286 5.161 1.190 . . . 1.0 . . . . . . . . . . . . A . 13 SER CB . . . . . . . . . rr_1r02 1
. 1 . 187 . 1 1 13 SER H H -0.282 6.678 0.866 . . . 1.0 . . . . . . . . . . . . A . 13 SER H . . . . . . . . . rr_1r02 1
. 1 . 188 . 1 1 13 SER HA H -0.834 4.602 2.659 . . . 1.0 . . . . . . . . . . . . A . 13 SER HA . . . . . . . . . rr_1r02 1
. 1 . 189 . 1 1 13 SER HB2 H -2.924 4.293 1.263 . . . 1.0 . . . . . . . . . . . . A . 13 SER HB2 . . . . . . . . . rr_1r02 1
. 1 . 190 . 1 1 13 SER HB3 H -2.650 5.932 1.851 . . . 1.0 . . . . . . . . . . . . A . 13 SER HB3 . . . . . . . . . rr_1r02 1
. 1 . 191 . 1 1 13 SER HG H -1.896 5.013 -0.725 . . . 1.0 . . . . . . . . . . . . A . 13 SER HG . . . . . . . . . rr_1r02 1
. 1 . 192 . 1 1 13 SER N N 0.060 5.866 1.296 . . . 1.0 . . . . . . . . . . . . A . 13 SER N . . . . . . . . . rr_1r02 1
. 1 . 193 . 1 1 13 SER O O -0.772 2.393 1.306 . . . 1.0 . . . . . . . . . . . . A . 13 SER O . . . . . . . . . rr_1r02 1
. 1 . 194 . 1 1 13 SER OG O -2.326 5.644 -0.142 . . . 1.0 . . . . . . . . . . . . A . 13 SER OG . . . . . . . . . rr_1r02 1
. 1 . 195 . 1 1 14 CYS C C 1.599 1.574 -0.146 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . rr_1r02 1
. 1 . 196 . 1 1 14 CYS CA C 0.755 2.515 -1.004 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . rr_1r02 1
. 1 . 197 . 1 1 14 CYS CB C 1.567 2.992 -2.209 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . rr_1r02 1
. 1 . 198 . 1 1 14 CYS H H 0.522 4.561 -0.520 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . rr_1r02 1
. 1 . 199 . 1 1 14 CYS HA H -0.113 1.979 -1.357 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . rr_1r02 1
. 1 . 200 . 1 1 14 CYS HB2 H 2.350 3.652 -1.869 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . rr_1r02 1
. 1 . 201 . 1 1 14 CYS HB3 H 2.013 2.136 -2.695 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . rr_1r02 1
. 1 . 202 . 1 1 14 CYS N N 0.290 3.656 -0.226 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . rr_1r02 1
. 1 . 203 . 1 1 14 CYS O O 1.705 0.384 -0.439 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . rr_1r02 1
. 1 . 204 . 1 1 14 CYS SG S 0.589 3.891 -3.455 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . rr_1r02 1
. 1 . 205 . 1 1 15 ARG C C 2.266 0.093 2.309 . . . 1.0 . . . . . . . . . . . . A . 15 ARG C . . . . . . . . . rr_1r02 1
. 1 . 206 . 1 1 15 ARG CA C 3.027 1.317 1.811 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CA . . . . . . . . . rr_1r02 1
. 1 . 207 . 1 1 15 ARG CB C 3.490 2.163 2.998 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CB . . . . . . . . . rr_1r02 1
. 1 . 208 . 1 1 15 ARG CD C 5.988 2.383 3.180 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CD . . . . . . . . . rr_1r02 1
. 1 . 209 . 1 1 15 ARG CG C 4.700 3.029 2.692 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CG . . . . . . . . . rr_1r02 1
. 1 . 210 . 1 1 15 ARG CZ C 7.028 1.439 1.155 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CZ . . . . . . . . . rr_1r02 1
. 1 . 211 . 1 1 15 ARG H H 2.074 3.068 1.098 . . . 1.0 . . . . . . . . . . . . A . 15 ARG H . . . . . . . . . rr_1r02 1
. 1 . 212 . 1 1 15 ARG HA H 3.892 0.988 1.256 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HA . . . . . . . . . rr_1r02 1
. 1 . 213 . 1 1 15 ARG HB2 H 2.680 2.809 3.303 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB2 . . . . . . . . . rr_1r02 1
. 1 . 214 . 1 1 15 ARG HB3 H 3.742 1.505 3.816 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB3 . . . . . . . . . rr_1r02 1
. 1 . 215 . 1 1 15 ARG HD2 H 6.767 3.130 3.194 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD2 . . . . . . . . . rr_1r02 1
. 1 . 216 . 1 1 15 ARG HD3 H 5.830 2.009 4.181 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD3 . . . . . . . . . rr_1r02 1
. 1 . 217 . 1 1 15 ARG HE H 6.215 0.368 2.628 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HE . . . . . . . . . rr_1r02 1
. 1 . 218 . 1 1 15 ARG HG2 H 4.766 3.175 1.624 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG2 . . . . . . . . . rr_1r02 1
. 1 . 219 . 1 1 15 ARG HG3 H 4.580 3.984 3.181 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG3 . . . . . . . . . rr_1r02 1
. 1 . 220 . 1 1 15 ARG HH11 H 7.047 3.460 1.242 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH11 . . . . . . . . . rr_1r02 1
. 1 . 221 . 1 1 15 ARG HH12 H 7.773 2.771 -0.171 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH12 . . . . . . . . . rr_1r02 1
. 1 . 222 . 1 1 15 ARG HH21 H 7.170 -0.540 0.772 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH21 . . . . . . . . . rr_1r02 1
. 1 . 223 . 1 1 15 ARG HH22 H 7.843 0.500 -0.438 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH22 . . . . . . . . . rr_1r02 1
. 1 . 224 . 1 1 15 ARG N N 2.196 2.115 0.913 . . . 1.0 . . . . . . . . . . . . A . 15 ARG N . . . . . . . . . rr_1r02 1
. 1 . 225 . 1 1 15 ARG NE N 6.406 1.278 2.321 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NE . . . . . . . . . rr_1r02 1
. 1 . 226 . 1 1 15 ARG NH1 N 7.306 2.657 0.705 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH1 . . . . . . . . . rr_1r02 1
. 1 . 227 . 1 1 15 ARG NH2 N 7.375 0.380 0.438 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH2 . . . . . . . . . rr_1r02 1
. 1 . 228 . 1 1 15 ARG O O 2.786 -1.023 2.293 . . . 1.0 . . . . . . . . . . . . A . 15 ARG O . . . . . . . . . rr_1r02 1
. 1 . 229 . 1 1 16 LEU C C -0.245 -1.676 2.091 . . . 1.0 . . . . . . . . . . . . A . 16 LEU C . . . . . . . . . rr_1r02 1
. 1 . 230 . 1 1 16 LEU CA C 0.196 -0.779 3.239 . . . 1.0 . . . . . . . . . . . . A . 16 LEU CA . . . . . . . . . rr_1r02 1
. 1 . 231 . 1 1 16 LEU CB C -1.030 -0.223 3.967 . . . 1.0 . . . . . . . . . . . . A . 16 LEU CB . . . . . . . . . rr_1r02 1
. 1 . 232 . 1 1 16 LEU CD1 C -0.807 2.127 4.817 . . . 1.0 . . . . . . . . . . . . A . 16 LEU CD1 . . . . . . . . . rr_1r02 1
. 1 . 233 . 1 1 16 LEU CD2 C -1.678 0.331 6.326 . . . 1.0 . . . . . . . . . . . . A . 16 LEU CD2 . . . . . . . . . rr_1r02 1
. 1 . 234 . 1 1 16 LEU CG C -0.724 0.654 5.184 . . . 1.0 . . . . . . . . . . . . A . 16 LEU CG . . . . . . . . . rr_1r02 1
. 1 . 235 . 1 1 16 LEU H H 0.669 1.220 2.730 . . . 1.0 . . . . . . . . . . . . A . 16 LEU H . . . . . . . . . rr_1r02 1
. 1 . 236 . 1 1 16 LEU HA H 0.784 -1.361 3.934 . . . 1.0 . . . . . . . . . . . . A . 16 LEU HA . . . . . . . . . rr_1r02 1
. 1 . 237 . 1 1 16 LEU HB2 H -1.605 0.361 3.263 . . . 1.0 . . . . . . . . . . . . A . 16 LEU HB2 . . . . . . . . . rr_1r02 1
. 1 . 238 . 1 1 16 LEU HB3 H -1.635 -1.056 4.294 . . . 1.0 . . . . . . . . . . . . A . 16 LEU HB3 . . . . . . . . . rr_1r02 1
. 1 . 239 . 1 1 16 LEU HD11 H -1.739 2.536 5.178 . . . 1.0 . . . . . . . . . . . . A . 16 LEU HD11 . . . . . . . . . rr_1r02 1
. 1 . 240 . 1 1 16 LEU HD12 H -0.759 2.234 3.743 . . . 1.0 . . . . . . . . . . . . A . 16 LEU HD12 . . . . . . . . . rr_1r02 1
. 1 . 241 . 1 1 16 LEU HD13 H 0.017 2.658 5.269 . . . 1.0 . . . . . . . . . . . . A . 16 LEU HD13 . . . . . . . . . rr_1r02 1
. 1 . 242 . 1 1 16 LEU HD21 H -1.507 -0.680 6.664 . . . 1.0 . . . . . . . . . . . . A . 16 LEU HD21 . . . . . . . . . rr_1r02 1
. 1 . 243 . 1 1 16 LEU HD22 H -2.697 0.428 5.981 . . . 1.0 . . . . . . . . . . . . A . 16 LEU HD22 . . . . . . . . . rr_1r02 1
. 1 . 244 . 1 1 16 LEU HD23 H -1.507 1.018 7.142 . . . 1.0 . . . . . . . . . . . . A . 16 LEU HD23 . . . . . . . . . rr_1r02 1
. 1 . 245 . 1 1 16 LEU HG H 0.283 0.450 5.521 . . . 1.0 . . . . . . . . . . . . A . 16 LEU HG . . . . . . . . . rr_1r02 1
. 1 . 246 . 1 1 16 LEU N N 1.031 0.309 2.745 . . . 1.0 . . . . . . . . . . . . A . 16 LEU N . . . . . . . . . rr_1r02 1
. 1 . 247 . 1 1 16 LEU O O -0.281 -2.900 2.222 . . . 1.0 . . . . . . . . . . . . A . 16 LEU O . . . . . . . . . rr_1r02 1
. 1 . 248 . 1 1 17 TYR C C 0.154 -2.528 -0.876 . . . 1.0 . . . . . . . . . . . . A . 17 TYR C . . . . . . . . . rr_1r02 1
. 1 . 249 . 1 1 17 TYR CA C -1.013 -1.797 -0.217 . . . 1.0 . . . . . . . . . . . . A . 17 TYR CA . . . . . . . . . rr_1r02 1
. 1 . 250 . 1 1 17 TYR CB C -1.671 -0.850 -1.223 . . . 1.0 . . . . . . . . . . . . A . 17 TYR CB . . . . . . . . . rr_1r02 1
. 1 . 251 . 1 1 17 TYR CD1 C -4.055 -1.632 -1.506 . . . 1.0 . . . . . . . . . . . . A . 17 TYR CD1 . . . . . . . . . rr_1r02 1
. 1 . 252 . 1 1 17 TYR CD2 C -3.671 0.408 -0.335 . . . 1.0 . . . . . . . . . . . . A . 17 TYR CD2 . . . . . . . . . rr_1r02 1
. 1 . 253 . 1 1 17 TYR CE1 C -5.416 -1.487 -1.321 . . . 1.0 . . . . . . . . . . . . A . 17 TYR CE1 . . . . . . . . . rr_1r02 1
. 1 . 254 . 1 1 17 TYR CE2 C -5.033 0.560 -0.146 . . . 1.0 . . . . . . . . . . . . A . 17 TYR CE2 . . . . . . . . . rr_1r02 1
. 1 . 255 . 1 1 17 TYR CG C -3.160 -0.688 -1.017 . . . 1.0 . . . . . . . . . . . . A . 17 TYR CG . . . . . . . . . rr_1r02 1
. 1 . 256 . 1 1 17 TYR CZ C -5.900 -0.391 -0.640 . . . 1.0 . . . . . . . . . . . . A . 17 TYR CZ . . . . . . . . . rr_1r02 1
. 1 . 257 . 1 1 17 TYR H H -0.524 -0.078 0.921 . . . 1.0 . . . . . . . . . . . . A . 17 TYR H . . . . . . . . . rr_1r02 1
. 1 . 258 . 1 1 17 TYR HA H -1.735 -2.525 0.104 . . . 1.0 . . . . . . . . . . . . A . 17 TYR HA . . . . . . . . . rr_1r02 1
. 1 . 259 . 1 1 17 TYR HB2 H -1.217 0.126 -1.138 . . . 1.0 . . . . . . . . . . . . A . 17 TYR HB2 . . . . . . . . . rr_1r02 1
. 1 . 260 . 1 1 17 TYR HB3 H -1.511 -1.231 -2.221 . . . 1.0 . . . . . . . . . . . . A . 17 TYR HB3 . . . . . . . . . rr_1r02 1
. 1 . 261 . 1 1 17 TYR HD1 H -3.672 -2.491 -2.037 . . . 1.0 . . . . . . . . . . . . A . 17 TYR HD1 . . . . . . . . . rr_1r02 1
. 1 . 262 . 1 1 17 TYR HD2 H -2.990 1.152 0.052 . . . 1.0 . . . . . . . . . . . . A . 17 TYR HD2 . . . . . . . . . rr_1r02 1
. 1 . 263 . 1 1 17 TYR HE1 H -6.096 -2.233 -1.709 . . . 1.0 . . . . . . . . . . . . A . 17 TYR HE1 . . . . . . . . . rr_1r02 1
. 1 . 264 . 1 1 17 TYR HE2 H -5.411 1.420 0.387 . . . 1.0 . . . . . . . . . . . . A . 17 TYR HE2 . . . . . . . . . rr_1r02 1
. 1 . 265 . 1 1 17 TYR HH H -7.573 -0.925 0.141 . . . 1.0 . . . . . . . . . . . . A . 17 TYR HH . . . . . . . . . rr_1r02 1
. 1 . 266 . 1 1 17 TYR N N -0.576 -1.056 0.961 . . . 1.0 . . . . . . . . . . . . A . 17 TYR N . . . . . . . . . rr_1r02 1
. 1 . 267 . 1 1 17 TYR O O -0.045 -3.390 -1.732 . . . 1.0 . . . . . . . . . . . . A . 17 TYR O . . . . . . . . . rr_1r02 1
. 1 . 268 . 1 1 17 TYR OH O -7.256 -0.244 -0.455 . . . 1.0 . . . . . . . . . . . . A . 17 TYR OH . . . . . . . . . rr_1r02 1
. 1 . 269 . 1 1 18 GLU C C 2.800 -4.171 -0.389 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . rr_1r02 1
. 1 . 270 . 1 1 18 GLU CA C 2.567 -2.803 -1.018 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . rr_1r02 1
. 1 . 271 . 1 1 18 GLU CB C 3.786 -1.905 -0.789 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . rr_1r02 1
. 1 . 272 . 1 1 18 GLU CD C 5.443 -0.344 -1.883 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . rr_1r02 1
. 1 . 273 . 1 1 18 GLU CG C 4.049 -0.938 -1.932 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . rr_1r02 1
. 1 . 274 . 1 1 18 GLU H H 1.462 -1.489 0.215 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . rr_1r02 1
. 1 . 275 . 1 1 18 GLU HA H 2.420 -2.927 -2.080 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . rr_1r02 1
. 1 . 276 . 1 1 18 GLU HB2 H 3.630 -1.332 0.112 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . rr_1r02 1
. 1 . 277 . 1 1 18 GLU HB3 H 4.658 -2.528 -0.664 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . rr_1r02 1
. 1 . 278 . 1 1 18 GLU HG2 H 3.931 -1.465 -2.867 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . rr_1r02 1
. 1 . 279 . 1 1 18 GLU HG3 H 3.329 -0.135 -1.880 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . rr_1r02 1
. 1 . 280 . 1 1 18 GLU N N 1.369 -2.179 -0.471 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . rr_1r02 1
. 1 . 281 . 1 1 18 GLU O O 2.907 -5.178 -1.090 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . rr_1r02 1
. 1 . 282 . 1 1 18 GLU OE1 O 6.403 -1.102 -1.628 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . rr_1r02 1
. 1 . 283 . 1 1 18 GLU OE2 O 5.575 0.877 -2.103 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . rr_1r02 1
. 1 . 284 . 1 1 19 LEU C C 1.865 -6.363 1.540 . . . 1.0 . . . . . . . . . . . . A . 19 LEU C . . . . . . . . . rr_1r02 1
. 1 . 285 . 1 1 19 LEU CA C 3.083 -5.450 1.660 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CA . . . . . . . . . rr_1r02 1
. 1 . 286 . 1 1 19 LEU CB C 3.380 -5.166 3.133 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CB . . . . . . . . . rr_1r02 1
. 1 . 287 . 1 1 19 LEU CD1 C 4.983 -3.251 3.352 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD1 . . . . . . . . . rr_1r02 1
. 1 . 288 . 1 1 19 LEU CD2 C 5.240 -5.267 4.810 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD2 . . . . . . . . . rr_1r02 1
. 1 . 289 . 1 1 19 LEU CG C 4.823 -4.761 3.438 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CG . . . . . . . . . rr_1r02 1
. 1 . 290 . 1 1 19 LEU H H 2.774 -3.368 1.439 . . . 1.0 . . . . . . . . . . . . A . 19 LEU H . . . . . . . . . rr_1r02 1
. 1 . 291 . 1 1 19 LEU HA H 3.936 -5.948 1.221 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HA . . . . . . . . . rr_1r02 1
. 1 . 292 . 1 1 19 LEU HB2 H 2.727 -4.369 3.461 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB2 . . . . . . . . . rr_1r02 1
. 1 . 293 . 1 1 19 LEU HB3 H 3.150 -6.053 3.702 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB3 . . . . . . . . . rr_1r02 1
. 1 . 294 . 1 1 19 LEU HD11 H 4.220 -2.775 3.948 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD11 . . . . . . . . . rr_1r02 1
. 1 . 295 . 1 1 19 LEU HD12 H 4.887 -2.937 2.323 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD12 . . . . . . . . . rr_1r02 1
. 1 . 296 . 1 1 19 LEU HD13 H 5.957 -2.971 3.725 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD13 . . . . . . . . . rr_1r02 1
. 1 . 297 . 1 1 19 LEU HD21 H 4.370 -5.334 5.448 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD21 . . . . . . . . . rr_1r02 1
. 1 . 298 . 1 1 19 LEU HD22 H 5.954 -4.584 5.245 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD22 . . . . . . . . . rr_1r02 1
. 1 . 299 . 1 1 19 LEU HD23 H 5.691 -6.244 4.712 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD23 . . . . . . . . . rr_1r02 1
. 1 . 300 . 1 1 19 LEU HG H 5.476 -5.208 2.701 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HG . . . . . . . . . rr_1r02 1
. 1 . 301 . 1 1 19 LEU N N 2.871 -4.203 0.935 . . . 1.0 . . . . . . . . . . . . A . 19 LEU N . . . . . . . . . rr_1r02 1
. 1 . 302 . 1 1 19 LEU O O 1.952 -7.566 1.790 . . . 1.0 . . . . . . . . . . . . A . 19 LEU O . . . . . . . . . rr_1r02 1
. 1 . 303 . 1 1 20 LEU C C -0.530 -7.295 -0.328 . . . 1.0 . . . . . . . . . . . . A . 20 LEU C . . . . . . . . . rr_1r02 1
. 1 . 304 . 1 1 20 LEU CA C -0.504 -6.551 1.005 . . . 1.0 . . . . . . . . . . . . A . 20 LEU CA . . . . . . . . . rr_1r02 1
. 1 . 305 . 1 1 20 LEU CB C -1.719 -5.625 1.111 . . . 1.0 . . . . . . . . . . . . A . 20 LEU CB . . . . . . . . . rr_1r02 1
. 1 . 306 . 1 1 20 LEU CD1 C -2.959 -3.924 2.474 . . . 1.0 . . . . . . . . . . . . A . 20 LEU CD1 . . . . . . . . . rr_1r02 1
. 1 . 307 . 1 1 20 LEU CD2 C -2.657 -6.246 3.351 . . . 1.0 . . . . . . . . . . . . A . 20 LEU CD2 . . . . . . . . . rr_1r02 1
. 1 . 308 . 1 1 20 LEU CG C -2.034 -5.130 2.523 . . . 1.0 . . . . . . . . . . . . A . 20 LEU CG . . . . . . . . . rr_1r02 1
. 1 . 309 . 1 1 20 LEU H H 0.717 -4.824 0.971 . . . 1.0 . . . . . . . . . . . . A . 20 LEU H . . . . . . . . . rr_1r02 1
. 1 . 310 . 1 1 20 LEU HA H -0.545 -7.274 1.807 . . . 1.0 . . . . . . . . . . . . A . 20 LEU HA . . . . . . . . . rr_1r02 1
. 1 . 311 . 1 1 20 LEU HB2 H -1.545 -4.766 0.480 . . . 1.0 . . . . . . . . . . . . A . 20 LEU HB2 . . . . . . . . . rr_1r02 1
. 1 . 312 . 1 1 20 LEU HB3 H -2.582 -6.156 0.737 . . . 1.0 . . . . . . . . . . . . A . 20 LEU HB3 . . . . . . . . . rr_1r02 1
. 1 . 313 . 1 1 20 LEU HD11 H -3.947 -4.239 2.174 . . . 1.0 . . . . . . . . . . . . A . 20 LEU HD11 . . . . . . . . . rr_1r02 1
. 1 . 314 . 1 1 20 LEU HD12 H -2.578 -3.209 1.759 . . . 1.0 . . . . . . . . . . . . A . 20 LEU HD12 . . . . . . . . . rr_1r02 1
. 1 . 315 . 1 1 20 LEU HD13 H -3.006 -3.467 3.449 . . . 1.0 . . . . . . . . . . . . A . 20 LEU HD13 . . . . . . . . . rr_1r02 1
. 1 . 316 . 1 1 20 LEU HD21 H -3.346 -5.822 4.065 . . . 1.0 . . . . . . . . . . . . A . 20 LEU HD21 . . . . . . . . . rr_1r02 1
. 1 . 317 . 1 1 20 LEU HD22 H -1.879 -6.781 3.875 . . . 1.0 . . . . . . . . . . . . A . 20 LEU HD22 . . . . . . . . . rr_1r02 1
. 1 . 318 . 1 1 20 LEU HD23 H -3.186 -6.925 2.699 . . . 1.0 . . . . . . . . . . . . A . 20 LEU HD23 . . . . . . . . . rr_1r02 1
. 1 . 319 . 1 1 20 LEU HG H -1.116 -4.829 3.006 . . . 1.0 . . . . . . . . . . . . A . 20 LEU HG . . . . . . . . . rr_1r02 1
. 1 . 320 . 1 1 20 LEU N N 0.728 -5.786 1.157 . . . 1.0 . . . . . . . . . . . . A . 20 LEU N . . . . . . . . . rr_1r02 1
. 1 . 321 . 1 1 20 LEU O O -1.055 -8.403 -0.418 . . . 1.0 . . . . . . . . . . . . A . 20 LEU O . . . . . . . . . rr_1r02 1
. 1 . 322 . 1 1 21 HIS C C 1.425 -7.961 -2.942 . . . 1.0 . . . . . . . . . . . . A . 21 HIS C . . . . . . . . . rr_1r02 1
. 1 . 323 . 1 1 21 HIS CA C 0.077 -7.292 -2.684 . . . 1.0 . . . . . . . . . . . . A . 21 HIS CA . . . . . . . . . rr_1r02 1
. 1 . 324 . 1 1 21 HIS CB C -0.221 -6.246 -3.769 . . . 1.0 . . . . . . . . . . . . A . 21 HIS CB . . . . . . . . . rr_1r02 1
. 1 . 325 . 1 1 21 HIS CD2 C 2.060 -5.818 -4.935 . . . 1.0 . . . . . . . . . . . . A . 21 HIS CD2 . . . . . . . . . rr_1r02 1
. 1 . 326 . 1 1 21 HIS CE1 C 2.288 -3.698 -4.429 . . . 1.0 . . . . . . . . . . . . A . 21 HIS CE1 . . . . . . . . . rr_1r02 1
. 1 . 327 . 1 1 21 HIS CG C 0.977 -5.454 -4.207 . . . 1.0 . . . . . . . . . . . . A . 21 HIS CG . . . . . . . . . rr_1r02 1
. 1 . 328 . 1 1 21 HIS H H 0.443 -5.795 -1.229 . . . 1.0 . . . . . . . . . . . . A . 21 HIS H . . . . . . . . . rr_1r02 1
. 1 . 329 . 1 1 21 HIS HA H -0.692 -8.049 -2.713 . . . 1.0 . . . . . . . . . . . . A . 21 HIS HA . . . . . . . . . rr_1r02 1
. 1 . 330 . 1 1 21 HIS HB2 H -0.620 -6.746 -4.638 . . . 1.0 . . . . . . . . . . . . A . 21 HIS HB2 . . . . . . . . . rr_1r02 1
. 1 . 331 . 1 1 21 HIS HB3 H -0.958 -5.551 -3.392 . . . 1.0 . . . . . . . . . . . . A . 21 HIS HB3 . . . . . . . . . rr_1r02 1
. 1 . 332 . 1 1 21 HIS HD1 H 0.532 -3.566 -3.385 . . . 1.0 . . . . . . . . . . . . A . 21 HIS HD1 . . . . . . . . . rr_1r02 1
. 1 . 333 . 1 1 21 HIS HD2 H 2.258 -6.799 -5.343 . . . 1.0 . . . . . . . . . . . . A . 21 HIS HD2 . . . . . . . . . rr_1r02 1
. 1 . 334 . 1 1 21 HIS HE1 H 2.683 -2.695 -4.354 . . . 1.0 . . . . . . . . . . . . A . 21 HIS HE1 . . . . . . . . . rr_1r02 1
. 1 . 335 . 1 1 21 HIS HE2 H 3.664 -4.645 -5.612 . . . 1.0 . . . . . . . . . . . . A . 21 HIS HE2 . . . . . . . . . rr_1r02 1
. 1 . 336 . 1 1 21 HIS N N 0.040 -6.678 -1.360 . . . 1.0 . . . . . . . . . . . . A . 21 HIS N . . . . . . . . . rr_1r02 1
. 1 . 337 . 1 1 21 HIS ND1 N 1.150 -4.120 -3.906 . . . 1.0 . . . . . . . . . . . . A . 21 HIS ND1 . . . . . . . . . rr_1r02 1
. 1 . 338 . 1 1 21 HIS NE2 N 2.858 -4.708 -5.057 . . . 1.0 . . . . . . . . . . . . A . 21 HIS NE2 . . . . . . . . . rr_1r02 1
. 1 . 339 . 1 1 21 HIS O O 1.489 -9.060 -3.494 . . . 1.0 . . . . . . . . . . . . A . 21 HIS O . . . . . . . . . rr_1r02 1
. 1 . 340 . 1 1 22 GLY C C 4.170 -8.919 -1.725 . . . 1.0 . . . . . . . . . . . . A . 22 GLY C . . . . . . . . . rr_1r02 1
. 1 . 341 . 1 1 22 GLY CA C 3.831 -7.838 -2.732 . . . 1.0 . . . . . . . . . . . . A . 22 GLY CA . . . . . . . . . rr_1r02 1
. 1 . 342 . 1 1 22 GLY H H 2.389 -6.421 -2.102 . . . 1.0 . . . . . . . . . . . . A . 22 GLY H . . . . . . . . . rr_1r02 1
. 1 . 343 . 1 1 22 GLY HA2 H 3.893 -8.256 -3.727 . . . 1.0 . . . . . . . . . . . . A . 22 GLY HA2 . . . . . . . . . rr_1r02 1
. 1 . 344 . 1 1 22 GLY HA3 H 4.552 -7.038 -2.643 . . . 1.0 . . . . . . . . . . . . A . 22 GLY HA3 . . . . . . . . . rr_1r02 1
. 1 . 345 . 1 1 22 GLY N N 2.500 -7.292 -2.537 . . . 1.0 . . . . . . . . . . . . A . 22 GLY N . . . . . . . . . rr_1r02 1
. 1 . 346 . 1 1 22 GLY O O 4.397 -10.072 -2.094 . . . 1.0 . . . . . . . . . . . . A . 22 GLY O . . . . . . . . . rr_1r02 1
. 1 . 347 . 1 1 23 ALA C C 3.256 -9.927 1.350 . . . 1.0 . . . . . . . . . . . . A . 23 ALA C . . . . . . . . . rr_1r02 1
. 1 . 348 . 1 1 23 ALA CA C 4.519 -9.493 0.614 . . . 1.0 . . . . . . . . . . . . A . 23 ALA CA . . . . . . . . . rr_1r02 1
. 1 . 349 . 1 1 23 ALA CB C 5.515 -8.882 1.588 . . . 1.0 . . . . . . . . . . . . A . 23 ALA CB . . . . . . . . . rr_1r02 1
. 1 . 350 . 1 1 23 ALA H H 4.016 -7.613 -0.219 . . . 1.0 . . . . . . . . . . . . A . 23 ALA H . . . . . . . . . rr_1r02 1
. 1 . 351 . 1 1 23 ALA HA H 4.976 -10.362 0.164 . . . 1.0 . . . . . . . . . . . . A . 23 ALA HA . . . . . . . . . rr_1r02 1
. 1 . 352 . 1 1 23 ALA HB1 H 4.984 -8.311 2.335 . . . 1.0 . . . . . . . . . . . . A . 23 ALA HB1 . . . . . . . . . rr_1r02 1
. 1 . 353 . 1 1 23 ALA HB2 H 6.191 -8.233 1.050 . . . 1.0 . . . . . . . . . . . . A . 23 ALA HB2 . . . . . . . . . rr_1r02 1
. 1 . 354 . 1 1 23 ALA HB3 H 6.077 -9.668 2.069 . . . 1.0 . . . . . . . . . . . . A . 23 ALA HB3 . . . . . . . . . rr_1r02 1
. 1 . 355 . 1 1 23 ALA N N 4.205 -8.547 -0.450 . . . 1.0 . . . . . . . . . . . . A . 23 ALA N . . . . . . . . . rr_1r02 1
. 1 . 356 . 1 1 23 ALA O O 3.268 -10.122 2.565 . . . 1.0 . . . . . . . . . . . . A . 23 ALA O . . . . . . . . . rr_1r02 1
. 1 . 357 . 1 1 24 GLY C C 0.621 -11.954 1.001 . . . 1.0 . . . . . . . . . . . . A . 24 GLY C . . . . . . . . . rr_1r02 1
. 1 . 358 . 1 1 24 GLY CA C 0.908 -10.480 1.201 . . . 1.0 . . . . . . . . . . . . A . 24 GLY CA . . . . . . . . . rr_1r02 1
. 1 . 359 . 1 1 24 GLY H H 2.214 -9.903 -0.357 . . . 1.0 . . . . . . . . . . . . A . 24 GLY H . . . . . . . . . rr_1r02 1
. 1 . 360 . 1 1 24 GLY HA2 H 0.940 -10.273 2.261 . . . 1.0 . . . . . . . . . . . . A . 24 GLY HA2 . . . . . . . . . rr_1r02 1
. 1 . 361 . 1 1 24 GLY HA3 H 0.108 -9.906 0.757 . . . 1.0 . . . . . . . . . . . . A . 24 GLY HA3 . . . . . . . . . rr_1r02 1
. 1 . 362 . 1 1 24 GLY N N 2.164 -10.073 0.606 . . . 1.0 . . . . . . . . . . . . A . 24 GLY N . . . . . . . . . rr_1r02 1
. 1 . 363 . 1 1 24 GLY O O -0.527 -12.347 0.798 . . . 1.0 . . . . . . . . . . . . A . 24 GLY O . . . . . . . . . rr_1r02 1
. 1 . 364 . 1 1 25 ASN C C 0.472 -14.773 1.847 . . . 1.0 . . . . . . . . . . . . A . 25 ASN C . . . . . . . . . rr_1r02 1
. 1 . 365 . 1 1 25 ASN CA C 1.522 -14.214 0.890 . . . 1.0 . . . . . . . . . . . . A . 25 ASN CA . . . . . . . . . rr_1r02 1
. 1 . 366 . 1 1 25 ASN CB C 2.863 -14.915 1.118 . . . 1.0 . . . . . . . . . . . . A . 25 ASN CB . . . . . . . . . rr_1r02 1
. 1 . 367 . 1 1 25 ASN CG C 3.115 -16.020 0.112 . . . 1.0 . . . . . . . . . . . . A . 25 ASN CG . . . . . . . . . rr_1r02 1
. 1 . 368 . 1 1 25 ASN H H 2.558 -12.399 1.231 . . . 1.0 . . . . . . . . . . . . A . 25 ASN H . . . . . . . . . rr_1r02 1
. 1 . 369 . 1 1 25 ASN HA H 1.199 -14.395 -0.124 . . . 1.0 . . . . . . . . . . . . A . 25 ASN HA . . . . . . . . . rr_1r02 1
. 1 . 370 . 1 1 25 ASN HB2 H 3.659 -14.190 1.033 . . . 1.0 . . . . . . . . . . . . A . 25 ASN HB2 . . . . . . . . . rr_1r02 1
. 1 . 371 . 1 1 25 ASN HB3 H 2.875 -15.343 2.109 . . . 1.0 . . . . . . . . . . . . A . 25 ASN HB3 . . . . . . . . . rr_1r02 1
. 1 . 372 . 1 1 25 ASN HD21 H 1.222 -16.611 0.251 . . . 1.0 . . . . . . . . . . . . A . 25 ASN HD21 . . . . . . . . . rr_1r02 1
. 1 . 373 . 1 1 25 ASN HD22 H 2.213 -17.519 -0.836 . . . 1.0 . . . . . . . . . . . . A . 25 ASN HD22 . . . . . . . . . rr_1r02 1
. 1 . 374 . 1 1 25 ASN N N 1.668 -12.773 1.063 . . . 1.0 . . . . . . . . . . . . A . 25 ASN N . . . . . . . . . rr_1r02 1
. 1 . 375 . 1 1 25 ASN ND2 N 2.079 -16.794 -0.189 . . . 1.0 . . . . . . . . . . . . A . 25 ASN ND2 . . . . . . . . . rr_1r02 1
. 1 . 376 . 1 1 25 ASN O O -0.129 -15.815 1.587 . . . 1.0 . . . . . . . . . . . . A . 25 ASN O . . . . . . . . . rr_1r02 1
. 1 . 377 . 1 1 25 ASN OD1 O 4.228 -16.178 -0.391 . . . 1.0 . . . . . . . . . . . . A . 25 ASN OD1 . . . . . . . . . rr_1r02 1
. 1 . 378 . 1 1 26 HIS C C -2.126 -14.035 3.558 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . rr_1r02 1
. 1 . 379 . 1 1 26 HIS CA C -0.724 -14.492 3.949 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . rr_1r02 1
. 1 . 380 . 1 1 26 HIS CB C -0.356 -13.934 5.326 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . rr_1r02 1
. 1 . 381 . 1 1 26 HIS CD2 C 1.765 -15.270 5.990 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . rr_1r02 1
. 1 . 382 . 1 1 26 HIS CE1 C 3.176 -13.595 6.103 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . rr_1r02 1
. 1 . 383 . 1 1 26 HIS CG C 1.081 -14.142 5.688 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . rr_1r02 1
. 1 . 384 . 1 1 26 HIS H H 0.763 -13.244 3.105 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . rr_1r02 1
. 1 . 385 . 1 1 26 HIS HA H -0.708 -15.571 3.992 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . rr_1r02 1
. 1 . 386 . 1 1 26 HIS HB2 H -0.553 -12.873 5.341 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . rr_1r02 1
. 1 . 387 . 1 1 26 HIS HB3 H -0.963 -14.419 6.076 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . rr_1r02 1
. 1 . 388 . 1 1 26 HIS HD1 H 1.802 -12.163 5.606 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . rr_1r02 1
. 1 . 389 . 1 1 26 HIS HD2 H 1.364 -16.274 6.024 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . rr_1r02 1
. 1 . 390 . 1 1 26 HIS HE1 H 4.079 -13.021 6.241 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . rr_1r02 1
. 1 . 391 . 1 1 26 HIS HE2 H 3.814 -15.522 6.375 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . rr_1r02 1
. 1 . 392 . 1 1 26 HIS N N 0.255 -14.069 2.955 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . rr_1r02 1
. 1 . 393 . 1 1 26 HIS ND1 N 1.993 -13.110 5.769 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . rr_1r02 1
. 1 . 394 . 1 1 26 HIS NE2 N 3.064 -14.904 6.245 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . rr_1r02 1
. 1 . 395 . 1 1 26 HIS O O -3.112 -14.717 3.839 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . rr_1r02 1
. 1 . 396 . 1 1 27 ALA C C -3.978 -13.032 1.211 . . . 1.0 . . . . . . . . . . . . A . 27 ALA C . . . . . . . . . rr_1r02 1
. 1 . 397 . 1 1 27 ALA CA C -3.487 -12.335 2.475 . . . 1.0 . . . . . . . . . . . . A . 27 ALA CA . . . . . . . . . rr_1r02 1
. 1 . 398 . 1 1 27 ALA CB C -3.372 -10.836 2.243 . . . 1.0 . . . . . . . . . . . . A . 27 ALA CB . . . . . . . . . rr_1r02 1
. 1 . 399 . 1 1 27 ALA H H -1.384 -12.384 2.710 . . . 1.0 . . . . . . . . . . . . A . 27 ALA H . . . . . . . . . rr_1r02 1
. 1 . 400 . 1 1 27 ALA HA H -4.205 -12.499 3.267 . . . 1.0 . . . . . . . . . . . . A . 27 ALA HA . . . . . . . . . rr_1r02 1
. 1 . 401 . 1 1 27 ALA HB1 H -2.527 -10.450 2.794 . . . 1.0 . . . . . . . . . . . . A . 27 ALA HB1 . . . . . . . . . rr_1r02 1
. 1 . 402 . 1 1 27 ALA HB2 H -4.274 -10.348 2.581 . . . 1.0 . . . . . . . . . . . . A . 27 ALA HB2 . . . . . . . . . rr_1r02 1
. 1 . 403 . 1 1 27 ALA HB3 H -3.232 -10.644 1.189 . . . 1.0 . . . . . . . . . . . . A . 27 ALA HB3 . . . . . . . . . rr_1r02 1
. 1 . 404 . 1 1 27 ALA N N -2.206 -12.879 2.907 . . . 1.0 . . . . . . . . . . . . A . 27 ALA N . . . . . . . . . rr_1r02 1
. 1 . 405 . 1 1 27 ALA O O -5.156 -13.369 1.093 . . . 1.0 . . . . . . . . . . . . A . 27 ALA O . . . . . . . . . rr_1r02 1
. 1 . 406 . 1 1 28 ALA C C -3.904 -15.324 -0.742 . . . 1.0 . . . . . . . . . . . . A . 28 ALA C . . . . . . . . . rr_1r02 1
. 1 . 407 . 1 1 28 ALA CA C -3.402 -13.906 -0.986 . . . 1.0 . . . . . . . . . . . . A . 28 ALA CA . . . . . . . . . rr_1r02 1
. 1 . 408 . 1 1 28 ALA CB C -2.195 -13.924 -1.912 . . . 1.0 . . . . . . . . . . . . A . 28 ALA CB . . . . . . . . . rr_1r02 1
. 1 . 409 . 1 1 28 ALA H H -2.143 -12.955 0.424 . . . 1.0 . . . . . . . . . . . . A . 28 ALA H . . . . . . . . . rr_1r02 1
. 1 . 410 . 1 1 28 ALA HA H -4.184 -13.334 -1.464 . . . 1.0 . . . . . . . . . . . . A . 28 ALA HA . . . . . . . . . rr_1r02 1
. 1 . 411 . 1 1 28 ALA HB1 H -2.373 -14.616 -2.722 . . . 1.0 . . . . . . . . . . . . A . 28 ALA HB1 . . . . . . . . . rr_1r02 1
. 1 . 412 . 1 1 28 ALA HB2 H -1.320 -14.235 -1.359 . . . 1.0 . . . . . . . . . . . . A . 28 ALA HB2 . . . . . . . . . rr_1r02 1
. 1 . 413 . 1 1 28 ALA HB3 H -2.033 -12.933 -2.312 . . . 1.0 . . . . . . . . . . . . A . 28 ALA HB3 . . . . . . . . . rr_1r02 1
. 1 . 414 . 1 1 28 ALA N N -3.065 -13.246 0.270 . . . 1.0 . . . . . . . . . . . . A . 28 ALA N . . . . . . . . . rr_1r02 1
. 1 . 415 . 1 1 28 ALA O O -4.911 -15.744 -1.310 . . . 1.0 . . . . . . . . . . . . A . 28 ALA O . . . . . . . . . rr_1r02 1
. 1 . 416 . 1 1 29 GLY C C -4.999 -17.518 0.953 . . . 1.0 . . . . . . . . . . . . A . 29 GLY C . . . . . . . . . rr_1r02 1
. 1 . 417 . 1 1 29 GLY CA C -3.584 -17.424 0.416 . . . 1.0 . . . . . . . . . . . . A . 29 GLY CA . . . . . . . . . rr_1r02 1
. 1 . 418 . 1 1 29 GLY H H -2.400 -15.671 0.535 . . . 1.0 . . . . . . . . . . . . A . 29 GLY H . . . . . . . . . rr_1r02 1
. 1 . 419 . 1 1 29 GLY HA2 H -3.511 -18.017 -0.483 . . . 1.0 . . . . . . . . . . . . A . 29 GLY HA2 . . . . . . . . . rr_1r02 1
. 1 . 420 . 1 1 29 GLY HA3 H -2.904 -17.823 1.155 . . . 1.0 . . . . . . . . . . . . A . 29 GLY HA3 . . . . . . . . . rr_1r02 1
. 1 . 421 . 1 1 29 GLY N N -3.194 -16.059 0.110 . . . 1.0 . . . . . . . . . . . . A . 29 GLY N . . . . . . . . . rr_1r02 1
. 1 . 422 . 1 1 29 GLY O O -5.665 -18.541 0.787 . . . 1.0 . . . . . . . . . . . . A . 29 GLY O . . . . . . . . . rr_1r02 1
. 1 . 423 . 1 1 30 ILE C C -7.819 -15.936 1.125 . . . 1.0 . . . . . . . . . . . . A . 30 ILE C . . . . . . . . . rr_1r02 1
. 1 . 424 . 1 1 30 ILE CA C -6.804 -16.418 2.158 . . . 1.0 . . . . . . . . . . . . A . 30 ILE CA . . . . . . . . . rr_1r02 1
. 1 . 425 . 1 1 30 ILE CB C -6.878 -15.503 3.397 . . . 1.0 . . . . . . . . . . . . A . 30 ILE CB . . . . . . . . . rr_1r02 1
. 1 . 426 . 1 1 30 ILE CD1 C -5.414 -14.715 5.323 . . . 1.0 . . . . . . . . . . . . A . 30 ILE CD1 . . . . . . . . . rr_1r02 1
. 1 . 427 . 1 1 30 ILE CG1 C -5.755 -15.846 4.378 . . . 1.0 . . . . . . . . . . . . A . 30 ILE CG1 . . . . . . . . . rr_1r02 1
. 1 . 428 . 1 1 30 ILE CG2 C -8.235 -15.630 4.071 . . . 1.0 . . . . . . . . . . . . A . 30 ILE CG2 . . . . . . . . . rr_1r02 1
. 1 . 429 . 1 1 30 ILE H H -4.882 -15.666 1.696 . . . 1.0 . . . . . . . . . . . . A . 30 ILE H . . . . . . . . . rr_1r02 1
. 1 . 430 . 1 1 30 ILE HA H -7.064 -17.421 2.461 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HA . . . . . . . . . rr_1r02 1
. 1 . 431 . 1 1 30 ILE HB H -6.759 -14.481 3.068 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HB . . . . . . . . . rr_1r02 1
. 1 . 432 . 1 1 30 ILE HD11 H -5.189 -13.825 4.755 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HD11 . . . . . . . . . rr_1r02 1
. 1 . 433 . 1 1 30 ILE HD12 H -4.556 -14.989 5.917 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HD12 . . . . . . . . . rr_1r02 1
. 1 . 434 . 1 1 30 ILE HD13 H -6.256 -14.522 5.973 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HD13 . . . . . . . . . rr_1r02 1
. 1 . 435 . 1 1 30 ILE HG12 H -6.053 -16.696 4.974 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HG12 . . . . . . . . . rr_1r02 1
. 1 . 436 . 1 1 30 ILE HG13 H -4.863 -16.095 3.822 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HG13 . . . . . . . . . rr_1r02 1
. 1 . 437 . 1 1 30 ILE HG21 H -8.137 -15.399 5.121 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HG21 . . . . . . . . . rr_1r02 1
. 1 . 438 . 1 1 30 ILE HG22 H -8.601 -16.640 3.956 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HG22 . . . . . . . . . rr_1r02 1
. 1 . 439 . 1 1 30 ILE HG23 H -8.930 -14.942 3.614 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HG23 . . . . . . . . . rr_1r02 1
. 1 . 440 . 1 1 30 ILE N N -5.460 -16.451 1.596 . . . 1.0 . . . . . . . . . . . . A . 30 ILE N . . . . . . . . . rr_1r02 1
. 1 . 441 . 1 1 30 ILE O O -8.985 -16.328 1.156 . . . 1.0 . . . . . . . . . . . . A . 30 ILE O . . . . . . . . . rr_1r02 1
. 1 . 442 . 1 1 31 LEU C C -8.470 -15.582 -1.937 . . . 1.0 . . . . . . . . . . . . A . 31 LEU C . . . . . . . . . rr_1r02 1
. 1 . 443 . 1 1 31 LEU CA C -8.233 -14.553 -0.834 . . . 1.0 . . . . . . . . . . . . A . 31 LEU CA . . . . . . . . . rr_1r02 1
. 1 . 444 . 1 1 31 LEU CB C -7.625 -13.279 -1.428 . . . 1.0 . . . . . . . . . . . . A . 31 LEU CB . . . . . . . . . rr_1r02 1
. 1 . 445 . 1 1 31 LEU CD1 C -8.290 -11.141 -2.557 . . . 1.0 . . . . . . . . . . . . A . 31 LEU CD1 . . . . . . . . . rr_1r02 1
. 1 . 446 . 1 1 31 LEU CD2 C -7.954 -13.214 -3.911 . . . 1.0 . . . . . . . . . . . . A . 31 LEU CD2 . . . . . . . . . rr_1r02 1
. 1 . 447 . 1 1 31 LEU CG C -8.422 -12.655 -2.576 . . . 1.0 . . . . . . . . . . . . A . 31 LEU CG . . . . . . . . . rr_1r02 1
. 1 . 448 . 1 1 31 LEU H H -6.426 -14.810 0.236 . . . 1.0 . . . . . . . . . . . . A . 31 LEU H . . . . . . . . . rr_1r02 1
. 1 . 449 . 1 1 31 LEU HA H -9.181 -14.309 -0.380 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HA . . . . . . . . . rr_1r02 1
. 1 . 450 . 1 1 31 LEU HB2 H -7.537 -12.546 -0.638 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HB2 . . . . . . . . . rr_1r02 1
. 1 . 451 . 1 1 31 LEU HB3 H -6.636 -13.513 -1.791 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HB3 . . . . . . . . . rr_1r02 1
. 1 . 452 . 1 1 31 LEU HD11 H -8.028 -10.815 -1.561 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HD11 . . . . . . . . . rr_1r02 1
. 1 . 453 . 1 1 31 LEU HD12 H -9.230 -10.693 -2.846 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HD12 . . . . . . . . . rr_1r02 1
. 1 . 454 . 1 1 31 LEU HD13 H -7.519 -10.837 -3.249 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HD13 . . . . . . . . . rr_1r02 1
. 1 . 455 . 1 1 31 LEU HD21 H -7.241 -12.535 -4.356 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HD21 . . . . . . . . . rr_1r02 1
. 1 . 456 . 1 1 31 LEU HD22 H -8.804 -13.328 -4.571 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HD22 . . . . . . . . . rr_1r02 1
. 1 . 457 . 1 1 31 LEU HD23 H -7.490 -14.176 -3.756 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HD23 . . . . . . . . . rr_1r02 1
. 1 . 458 . 1 1 31 LEU HG H -9.467 -12.901 -2.456 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HG . . . . . . . . . rr_1r02 1
. 1 . 459 . 1 1 31 LEU N N -7.366 -15.085 0.211 . . . 1.0 . . . . . . . . . . . . A . 31 LEU N . . . . . . . . . rr_1r02 1
. 1 . 460 . 1 1 31 LEU O O -9.270 -15.359 -2.844 . . . 1.0 . . . . . . . . . . . . A . 31 LEU O . . . . . . . . . rr_1r02 1
. 1 . 461 . 1 1 32 THR C C -8.842 -18.870 -2.349 . . . 1.0 . . . . . . . . . . . . A . 32 THR C . . . . . . . . . rr_1r02 1
. 1 . 462 . 1 1 32 THR CA C -7.910 -17.770 -2.848 . . . 1.0 . . . . . . . . . . . . A . 32 THR CA . . . . . . . . . rr_1r02 1
. 1 . 463 . 1 1 32 THR CB C -6.539 -18.362 -3.186 . . . 1.0 . . . . . . . . . . . . A . 32 THR CB . . . . . . . . . rr_1r02 1
. 1 . 464 . 1 1 32 THR CG2 C -6.581 -19.356 -4.326 . . . 1.0 . . . . . . . . . . . . A . 32 THR CG2 . . . . . . . . . rr_1r02 1
. 1 . 465 . 1 1 32 THR H H -7.148 -16.836 -1.110 . . . 1.0 . . . . . . . . . . . . A . 32 THR H . . . . . . . . . rr_1r02 1
. 1 . 466 . 1 1 32 THR HA H -8.332 -17.334 -3.741 . . . 1.0 . . . . . . . . . . . . A . 32 THR HA . . . . . . . . . rr_1r02 1
. 1 . 467 . 1 1 32 THR HB H -6.156 -18.874 -2.314 . . . 1.0 . . . . . . . . . . . . A . 32 THR HB . . . . . . . . . rr_1r02 1
. 1 . 468 . 1 1 32 THR HG1 H -5.881 -16.959 -4.383 . . . 1.0 . . . . . . . . . . . . A . 32 THR HG1 . . . . . . . . . rr_1r02 1
. 1 . 469 . 1 1 32 THR HG21 H -7.324 -19.048 -5.046 . . . 1.0 . . . . . . . . . . . . A . 32 THR HG21 . . . . . . . . . rr_1r02 1
. 1 . 470 . 1 1 32 THR HG22 H -6.834 -20.334 -3.942 . . . 1.0 . . . . . . . . . . . . A . 32 THR HG22 . . . . . . . . . rr_1r02 1
. 1 . 471 . 1 1 32 THR HG23 H -5.612 -19.397 -4.804 . . . 1.0 . . . . . . . . . . . . A . 32 THR HG23 . . . . . . . . . rr_1r02 1
. 1 . 472 . 1 1 32 THR N N -7.771 -16.711 -1.856 . . . 1.0 . . . . . . . . . . . . A . 32 THR N . . . . . . . . . rr_1r02 1
. 1 . 473 . 1 1 32 THR O O -8.712 -20.030 -2.738 . . . 1.0 . . . . . . . . . . . . A . 32 THR O . . . . . . . . . rr_1r02 1
. 1 . 474 . 1 1 32 THR OG1 O -5.625 -17.340 -3.541 . . . 1.0 . . . . . . . . . . . . A . 32 THR OG1 . . . . . . . . . rr_1r02 1
. 1 . 475 . 1 1 33 LEU C C -10.018 -20.571 -0.187 . . . 1.0 . . . . . . . . . . . . A . 33 LEU C . . . . . . . . . rr_1r02 1
. 1 . 476 . 1 1 33 LEU CA C -10.736 -19.453 -0.936 . . . 1.0 . . . . . . . . . . . . A . 33 LEU CA . . . . . . . . . rr_1r02 1
. 1 . 477 . 1 1 33 LEU CB C -11.601 -20.043 -2.052 . . . 1.0 . . . . . . . . . . . . A . 33 LEU CB . . . . . . . . . rr_1r02 1
. 1 . 478 . 1 1 33 LEU CD1 C -12.991 -19.715 -4.113 . . . 1.0 . . . . . . . . . . . . A . 33 LEU CD1 . . . . . . . . . rr_1r02 1
. 1 . 479 . 1 1 33 LEU CD2 C -12.773 -17.862 -2.446 . . . 1.0 . . . . . . . . . . . . A . 33 LEU CD2 . . . . . . . . . rr_1r02 1
. 1 . 480 . 1 1 33 LEU CG C -12.071 -19.040 -3.107 . . . 1.0 . . . . . . . . . . . . A . 33 LEU CG . . . . . . . . . rr_1r02 1
. 1 . 481 . 1 1 33 LEU H H -9.837 -17.556 -1.214 . . . 1.0 . . . . . . . . . . . . A . 33 LEU H . . . . . . . . . rr_1r02 1
. 1 . 482 . 1 1 33 LEU HA H -11.373 -18.923 -0.242 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HA . . . . . . . . . rr_1r02 1
. 1 . 483 . 1 1 33 LEU HB2 H -11.031 -20.815 -2.548 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HB2 . . . . . . . . . rr_1r02 1
. 1 . 484 . 1 1 33 LEU HB3 H -12.473 -20.495 -1.604 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HB3 . . . . . . . . . rr_1r02 1
. 1 . 485 . 1 1 33 LEU HD11 H -12.516 -20.606 -4.494 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HD11 . . . . . . . . . rr_1r02 1
. 1 . 486 . 1 1 33 LEU HD12 H -13.192 -19.036 -4.928 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HD12 . . . . . . . . . rr_1r02 1
. 1 . 487 . 1 1 33 LEU HD13 H -13.920 -19.979 -3.629 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HD13 . . . . . . . . . rr_1r02 1
. 1 . 488 . 1 1 33 LEU HD21 H -12.052 -17.087 -2.232 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HD21 . . . . . . . . . rr_1r02 1
. 1 . 489 . 1 1 33 LEU HD22 H -13.234 -18.189 -1.527 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HD22 . . . . . . . . . rr_1r02 1
. 1 . 490 . 1 1 33 LEU HD23 H -13.531 -17.476 -3.112 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HD23 . . . . . . . . . rr_1r02 1
. 1 . 491 . 1 1 33 LEU HG H -11.213 -18.661 -3.642 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HG . . . . . . . . . rr_1r02 1
. 1 . 492 . 1 1 33 LEU N N -9.783 -18.497 -1.487 . . . 1.0 . . . . . . . . . . . . A . 33 LEU N . . . . . . . . . rr_1r02 1
. 1 . 493 . 1 1 33 LEU O O -10.708 -21.452 0.366 . . . 1.0 . . . . . . . . . . . . A . 33 LEU O . . . . . . . . . rr_1r02 1
. 1 . 494 . 1 1 33 LEU OXT O -8.769 -20.557 -0.163 . . . 1.0 . . . . . . . . . . . . A . 33 LEU OXT . . . . . . . . . rr_1r02 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_1r02
_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 1r02.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_1r02 1
1 1r02.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 16 rr_1r02 1
1 1r02.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 14 rr_1r02 1
1 1r02.mr . . XPLOR/CNS 4 distance NOE simple 204 rr_1r02 1
1 1r02.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_1r02 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_1r02
_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: '1r02'" . . . . distance "general distance" . 203 rr_1r02 1
2 "From CCPN project: '1r02'" . . . . distance "hydrogen bond" . 14 rr_1r02 1
3 "From CCPN project: '1r02'" . . . . "dihedral angle" "Not applicable" . 16 rr_1r02 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 1r02.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_1r02 1
1 1r02.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 16 rr_1r02 1
1 1r02.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 14 rr_1r02 1
1 1r02.mr . . XPLOR/CNS 4 distance NOE simple 204 rr_1r02 1
1 1r02.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_1r02 1
stop_
save_
save_CNS/XPLOR_distance_constraints_4
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_4
_Gen_dist_constraint_list.Entry_ID rr_1r02
_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_1r02 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 OR . 1 1 2 2 PRO HA H . . . 1 1 2 2 PRO HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 2 PRO HB2 . . A . 2 PRO HA . . . 2 . HB* . . . . . 2 . HA . . rr_1r02 1
1 2 OR . 1 1 2 2 PRO HB3 H . . . 1 1 2 2 PRO HA H . . . . . 4.0 1.8 6.0 . . . . . A . 2 PRO HB3 . . A . 2 PRO HA . . . 2 . HB* . . . . . 2 . HA . . rr_1r02 1
2 1 OR . 1 1 2 2 PRO HB2 H . . . 1 1 2 2 PRO HG2 H . . . . . 3.0 1.8 4.3 . . . . . A . 2 PRO HG2 . . A . 2 PRO HB2 . . . 2 . HG* . . . . . 2 . HB* . . rr_1r02 1
2 2 OR . 1 1 2 2 PRO HB3 H . . . 1 1 2 2 PRO HG2 H . . . . . 3.0 1.8 4.3 . . . . . A . 2 PRO HG2 . . A . 2 PRO HB3 . . . 2 . HG* . . . . . 2 . HB* . . rr_1r02 1
2 3 OR . 1 1 2 2 PRO HG3 H . . . 1 1 2 2 PRO HB2 H . . . . . 3.0 1.8 4.3 . . . . . A . 2 PRO HG3 . . A . 2 PRO HB2 . . . 2 . HG* . . . . . 2 . HB* . . rr_1r02 1
2 4 OR . 1 1 2 2 PRO HB3 H . . . 1 1 2 2 PRO HG3 H . . . . . 3.0 1.8 4.3 . . . . . A . 2 PRO HG3 . . A . 2 PRO HB3 . . . 2 . HG* . . . . . 2 . HB* . . rr_1r02 1
3 1 OR . 1 1 2 2 PRO HB2 H . . . 1 1 2 2 PRO HD2 H . . . . . 3.0 1.8 4.3 . . . . . A . 2 PRO HD2 . . A . 2 PRO HB2 . . . 2 . HD* . . . . . 2 . HB* . . rr_1r02 1
3 2 OR . 1 1 2 2 PRO HB3 H . . . 1 1 2 2 PRO HD2 H . . . . . 3.0 1.8 4.3 . . . . . A . 2 PRO HD2 . . A . 2 PRO HB3 . . . 2 . HD* . . . . . 2 . HB* . . rr_1r02 1
3 3 OR . 1 1 2 2 PRO HD3 H . . . 1 1 2 2 PRO HB2 H . . . . . 3.0 1.8 4.3 . . . . . A . 2 PRO HD3 . . A . 2 PRO HB2 . . . 2 . HD* . . . . . 2 . HB* . . rr_1r02 1
3 4 OR . 1 1 2 2 PRO HB3 H . . . 1 1 2 2 PRO HD3 H . . . . . 3.0 1.8 4.3 . . . . . A . 2 PRO HD3 . . A . 2 PRO HB3 . . . 2 . HD* . . . . . 2 . HB* . . rr_1r02 1
4 1 . . 1 1 3 3 LEU HA H . . . 1 1 3 3 LEU H H . . . . . 3.0 1.8 3.3 . . . . . A . 3 LEU HA . . A . 3 LEU H . . . 3 . HA . . . . . 3 . HN . . rr_1r02 1
5 1 OR . 1 1 3 3 LEU H H . . . 1 1 3 3 LEU HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 3 LEU HB2 . . A . 3 LEU H . . . 3 . HB* . . . . . 3 . HN . . rr_1r02 1
5 2 OR . 1 1 3 3 LEU H H . . . 1 1 3 3 LEU HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 3 LEU HB3 . . A . 3 LEU H . . . 3 . HB* . . . . . 3 . HN . . rr_1r02 1
6 1 . . 1 1 3 3 LEU H H . . . 1 1 3 3 LEU HG H . . . . . 4.0 1.8 5.0 . . . . . A . 3 LEU HG . . A . 3 LEU H . . . 3 . HG . . . . . 3 . HN . . rr_1r02 1
7 1 OR . 1 1 3 3 LEU H H . . . 1 1 3 3 LEU MD1 H . . . . . 4.0 1.8 6.0 . . . . . A . 3 LEU MD1 . . A . 3 LEU H . . . 3 . HD* . . . . . 3 . HN . . rr_1r02 1
7 2 OR . 1 1 3 3 LEU H H . . . 1 1 3 3 LEU MD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 3 LEU MD2 . . A . 3 LEU H . . . 3 . HD* . . . . . 3 . HN . . rr_1r02 1
8 1 OR . 1 1 4 4 PRO HA H . . . 1 1 4 4 PRO HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 4 PRO HB2 . . A . 4 PRO HA . . . 4 . HB* . . . . . 4 . HA . . rr_1r02 1
8 2 OR . 1 1 4 4 PRO HB3 H . . . 1 1 4 4 PRO HA H . . . . . 4.0 1.8 6.0 . . . . . A . 4 PRO HB3 . . A . 4 PRO HA . . . 4 . HB* . . . . . 4 . HA . . rr_1r02 1
9 1 OR . 1 1 4 4 PRO HB2 H . . . 1 1 4 4 PRO HG2 H . . . . . 3.0 1.8 4.3 . . . . . A . 4 PRO HG2 . . A . 4 PRO HB2 . . . 4 . HG* . . . . . 4 . HB* . . rr_1r02 1
9 2 OR . 1 1 4 4 PRO HB3 H . . . 1 1 4 4 PRO HG2 H . . . . . 3.0 1.8 4.3 . . . . . A . 4 PRO HG2 . . A . 4 PRO HB3 . . . 4 . HG* . . . . . 4 . HB* . . rr_1r02 1
9 3 OR . 1 1 4 4 PRO HG3 H . . . 1 1 4 4 PRO HB2 H . . . . . 3.0 1.8 4.3 . . . . . A . 4 PRO HG3 . . A . 4 PRO HB2 . . . 4 . HG* . . . . . 4 . HB* . . rr_1r02 1
9 4 OR . 1 1 4 4 PRO HB3 H . . . 1 1 4 4 PRO HG3 H . . . . . 3.0 1.8 4.3 . . . . . A . 4 PRO HG3 . . A . 4 PRO HB3 . . . 4 . HG* . . . . . 4 . HB* . . rr_1r02 1
10 1 OR . 1 1 4 4 PRO HB2 H . . . 1 1 4 4 PRO HD2 H . . . . . 3.0 1.8 4.3 . . . . . A . 4 PRO HD2 . . A . 4 PRO HB2 . . . 4 . HD* . . . . . 4 . HB* . . rr_1r02 1
10 2 OR . 1 1 4 4 PRO HB3 H . . . 1 1 4 4 PRO HD2 H . . . . . 3.0 1.8 4.3 . . . . . A . 4 PRO HD2 . . A . 4 PRO HB3 . . . 4 . HD* . . . . . 4 . HB* . . rr_1r02 1
10 3 OR . 1 1 4 4 PRO HD3 H . . . 1 1 4 4 PRO HB2 H . . . . . 3.0 1.8 4.3 . . . . . A . 4 PRO HD3 . . A . 4 PRO HB2 . . . 4 . HD* . . . . . 4 . HB* . . rr_1r02 1
10 4 OR . 1 1 4 4 PRO HB3 H . . . 1 1 4 4 PRO HD3 H . . . . . 3.0 1.8 4.3 . . . . . A . 4 PRO HD3 . . A . 4 PRO HB3 . . . 4 . HD* . . . . . 4 . HB* . . rr_1r02 1
11 1 . . 1 1 5 5 ASP HA H . . . 1 1 5 5 ASP H H . . . . . 3.0 1.8 3.3 . . . . . A . 5 ASP HA . . A . 5 ASP H . . . 5 . HA . . . . . 5 . HN . . rr_1r02 1
12 1 OR . 1 1 5 5 ASP H H . . . 1 1 5 5 ASP HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 5 ASP HB2 . . A . 5 ASP H . . . 5 . HB* . . . . . 5 . HN . . rr_1r02 1
12 2 OR . 1 1 5 5 ASP H H . . . 1 1 5 5 ASP HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 5 ASP HB3 . . A . 5 ASP H . . . 5 . HB* . . . . . 5 . HN . . rr_1r02 1
13 1 . . 1 1 6 6 CYS HA H . . . 1 1 6 6 CYS H H . . . . . 2.5 1.8 2.7 . . . . . A . 6 CYS HA . . A . 6 CYS H . . . 6 . HA . . . . . 6 . HN . . rr_1r02 1
14 1 OR . 1 1 6 6 CYS H H . . . 1 1 6 6 CYS HB2 H . . . . . 3.0 1.8 4.3 . . . . . A . 6 CYS HB2 . . A . 6 CYS H . . . 6 . HB* . . . . . 6 . HN . . rr_1r02 1
14 2 OR . 1 1 6 6 CYS H H . . . 1 1 6 6 CYS HB3 H . . . . . 3.0 1.8 4.3 . . . . . A . 6 CYS HB3 . . A . 6 CYS H . . . 6 . HB* . . . . . 6 . HN . . rr_1r02 1
15 1 . . 1 1 7 7 CYS HA H . . . 1 1 7 7 CYS H H . . . . . 2.5 1.8 2.7 . . . . . A . 7 CYS HA . . A . 7 CYS H . . . 7 . HA . . . . . 7 . HN . . rr_1r02 1
16 1 OR . 1 1 7 7 CYS H H . . . 1 1 7 7 CYS HB2 H . . . . . 3.0 1.8 4.3 . . . . . A . 7 CYS HB2 . . A . 7 CYS H . . . 7 . HB* . . . . . 7 . HN . . rr_1r02 1
16 2 OR . 1 1 7 7 CYS H H . . . 1 1 7 7 CYS HB3 H . . . . . 3.0 1.8 4.3 . . . . . A . 7 CYS HB3 . . A . 7 CYS H . . . 7 . HB* . . . . . 7 . HN . . rr_1r02 1
17 1 . . 1 1 8 8 ARG HA H . . . 1 1 8 8 ARG H H . . . . . 2.5 1.8 2.7 . . . . . A . 8 ARG HA . . A . 8 ARG H . . . 8 . HA . . . . . 8 . HN . . rr_1r02 1
18 1 OR . 1 1 8 8 ARG H H . . . 1 1 8 8 ARG HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 8 ARG HB2 . . A . 8 ARG H . . . 8 . HB* . . . . . 8 . HN . . rr_1r02 1
18 2 OR . 1 1 8 8 ARG H H . . . 1 1 8 8 ARG HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 8 ARG HB3 . . A . 8 ARG H . . . 8 . HB* . . . . . 8 . HN . . rr_1r02 1
19 1 OR . 1 1 8 8 ARG H H . . . 1 1 8 8 ARG HG2 H . . . . . 4.0 1.8 6.0 . . . . . A . 8 ARG HG2 . . A . 8 ARG H . . . 8 . HG* . . . . . 8 . HN . . rr_1r02 1
19 2 OR . 1 1 8 8 ARG H H . . . 1 1 8 8 ARG HG3 H . . . . . 4.0 1.8 6.0 . . . . . A . 8 ARG HG3 . . A . 8 ARG H . . . 8 . HG* . . . . . 8 . HN . . rr_1r02 1
20 1 OR . 1 1 8 8 ARG H H . . . 1 1 8 8 ARG HD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 8 ARG HD2 . . A . 8 ARG H . . . 8 . HD* . . . . . 8 . HN . . rr_1r02 1
20 2 OR . 1 1 8 8 ARG H H . . . 1 1 8 8 ARG HD3 H . . . . . 4.0 1.8 6.0 . . . . . A . 8 ARG HD3 . . A . 8 ARG H . . . 8 . HD* . . . . . 8 . HN . . rr_1r02 1
21 1 . . 1 1 9 9 GLN HA H . . . 1 1 9 9 GLN H H . . . . . 2.5 1.8 2.7 . . . . . A . 9 GLN HA . . A . 9 GLN H . . . 9 . HA . . . . . 9 . HN . . rr_1r02 1
22 1 OR . 1 1 9 9 GLN H H . . . 1 1 9 9 GLN HB2 H . . . . . 3.0 1.8 4.3 . . . . . A . 9 GLN HB2 . . A . 9 GLN H . . . 9 . HB* . . . . . 9 . HN . . rr_1r02 1
22 2 OR . 1 1 9 9 GLN H H . . . 1 1 9 9 GLN HB3 H . . . . . 3.0 1.8 4.3 . . . . . A . 9 GLN HB3 . . A . 9 GLN H . . . 9 . HB* . . . . . 9 . HN . . rr_1r02 1
23 1 OR . 1 1 9 9 GLN H H . . . 1 1 9 9 GLN HG2 H . . . . . 4.0 1.8 6.0 . . . . . A . 9 GLN HG2 . . A . 9 GLN H . . . 9 . HG* . . . . . 9 . HN . . rr_1r02 1
23 2 OR . 1 1 9 9 GLN H H . . . 1 1 9 9 GLN HG3 H . . . . . 4.0 1.8 6.0 . . . . . A . 9 GLN HG3 . . A . 9 GLN H . . . 9 . HG* . . . . . 9 . HN . . rr_1r02 1
24 1 . . 1 1 10 10 LYS HA H . . . 1 1 10 10 LYS H H . . . . . 2.5 1.8 2.7 . . . . . A . 10 LYS HA . . A . 10 LYS H . . . 10 . HA . . . . . 10 . HN . . rr_1r02 1
25 1 OR . 1 1 10 10 LYS HA H . . . 1 1 10 10 LYS HB2 H . . . . . 3.0 1.8 4.3 . . . . . A . 10 LYS HA . . A . 10 LYS HB2 . . . 10 . HA . . . . . 10 . HB* . . rr_1r02 1
25 2 OR . 1 1 10 10 LYS HA H . . . 1 1 10 10 LYS HB3 H . . . . . 3.0 1.8 4.3 . . . . . A . 10 LYS HA . . A . 10 LYS HB3 . . . 10 . HA . . . . . 10 . HB* . . rr_1r02 1
26 1 OR . 1 1 10 10 LYS H H . . . 1 1 10 10 LYS HB2 H . . . . . 3.0 1.8 4.3 . . . . . A . 10 LYS HB2 . . A . 10 LYS H . . . 10 . HB* . . . . . 10 . HN . . rr_1r02 1
26 2 OR . 1 1 10 10 LYS H H . . . 1 1 10 10 LYS HB3 H . . . . . 3.0 1.8 4.3 . . . . . A . 10 LYS HB3 . . A . 10 LYS H . . . 10 . HB* . . . . . 10 . HN . . rr_1r02 1
27 1 OR . 1 1 10 10 LYS H H . . . 1 1 10 10 LYS HG2 H . . . . . 3.0 1.8 4.3 . . . . . A . 10 LYS HG2 . . A . 10 LYS H . . . 10 . HG* . . . . . 10 . HN . . rr_1r02 1
27 2 OR . 1 1 10 10 LYS H H . . . 1 1 10 10 LYS HG3 H . . . . . 3.0 1.8 4.3 . . . . . A . 10 LYS HG3 . . A . 10 LYS H . . . 10 . HG* . . . . . 10 . HN . . rr_1r02 1
28 1 OR . 1 1 10 10 LYS H H . . . 1 1 10 10 LYS HD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 10 LYS HD2 . . A . 10 LYS H . . . 10 . HD* . . . . . 10 . HN . . rr_1r02 1
28 2 OR . 1 1 10 10 LYS H H . . . 1 1 10 10 LYS HD3 H . . . . . 4.0 1.8 6.0 . . . . . A . 10 LYS HD3 . . A . 10 LYS H . . . 10 . HD* . . . . . 10 . HN . . rr_1r02 1
29 1 . . 1 1 11 11 THR HA H . . . 1 1 11 11 THR H H . . . . . 3.0 1.8 3.3 . . . . . A . 11 THR HA . . A . 11 THR H . . . 11 . HA . . . . . 11 . HN . . rr_1r02 1
30 1 . . 1 1 11 11 THR H H . . . 1 1 11 11 THR HB H . . . . . 3.0 1.8 3.3 . . . . . A . 11 THR HB . . A . 11 THR H . . . 11 . HB . . . . . 11 . HN . . rr_1r02 1
31 1 OR . 1 1 11 11 THR H H . . . 1 1 11 11 THR MG H . . . . . 4.0 1.8 6.0 . . . . . A . 11 THR MG . . A . 11 THR H . . . 11 . HG* . . . . . 11 . HN . . rr_1r02 1
31 2 OR . 1 1 11 11 THR H H . . . 1 1 11 11 THR HG1 H . . . . . 4.0 1.8 6.0 . . . . . A . 11 THR HG1 . . A . 11 THR H . . . 11 . HG* . . . . . 11 . HN . . rr_1r02 1
32 1 . . 1 1 12 12 CYS HA H . . . 1 1 12 12 CYS H H . . . . . 3.0 1.8 3.3 . . . . . A . 12 CYS HA . . A . 12 CYS H . . . 12 . HA . . . . . 12 . HN . . rr_1r02 1
33 1 OR . 1 1 12 12 CYS H H . . . 1 1 12 12 CYS HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 12 CYS HB2 . . A . 12 CYS H . . . 12 . HB* . . . . . 12 . HN . . rr_1r02 1
33 2 OR . 1 1 12 12 CYS H H . . . 1 1 12 12 CYS HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 12 CYS HB3 . . A . 12 CYS H . . . 12 . HB* . . . . . 12 . HN . . rr_1r02 1
34 1 . . 1 1 13 13 SER HA H . . . 1 1 13 13 SER H H . . . . . 3.0 1.8 3.3 . . . . . A . 13 SER HA . . A . 13 SER H . . . 13 . HA . . . . . 13 . HN . . rr_1r02 1
35 1 OR . 1 1 13 13 SER H H . . . 1 1 13 13 SER HB2 H . . . . . 3.0 1.8 4.3 . . . . . A . 13 SER HB2 . . A . 13 SER H . . . 13 . HB* . . . . . 13 . HN . . rr_1r02 1
35 2 OR . 1 1 13 13 SER H H . . . 1 1 13 13 SER HB3 H . . . . . 3.0 1.8 4.3 . . . . . A . 13 SER HB3 . . A . 13 SER H . . . 13 . HB* . . . . . 13 . HN . . rr_1r02 1
36 1 OR . 1 1 13 13 SER HA H . . . 1 1 13 13 SER HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 13 SER HA . . A . 13 SER HB2 . . . 13 . HA . . . . . 13 . HB* . . rr_1r02 1
36 2 OR . 1 1 13 13 SER HA H . . . 1 1 13 13 SER HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 13 SER HA . . A . 13 SER HB3 . . . 13 . HA . . . . . 13 . HB* . . rr_1r02 1
37 1 . . 1 1 14 14 CYS HA H . . . 1 1 14 14 CYS H H . . . . . 3.0 1.8 3.3 . . . . . A . 14 CYS HA . . A . 14 CYS H . . . 14 . HA . . . . . 14 . HN . . rr_1r02 1
38 1 OR . 1 1 14 14 CYS H H . . . 1 1 14 14 CYS HB2 H . . . . . 3.0 1.8 4.3 . . . . . A . 14 CYS HB2 . . A . 14 CYS H . . . 14 . HB* . . . . . 14 . HN . . rr_1r02 1
38 2 OR . 1 1 14 14 CYS H H . . . 1 1 14 14 CYS HB3 H . . . . . 3.0 1.8 4.3 . . . . . A . 14 CYS HB3 . . A . 14 CYS H . . . 14 . HB* . . . . . 14 . HN . . rr_1r02 1
39 1 . . 1 1 15 15 ARG HA H . . . 1 1 15 15 ARG H H . . . . . 3.0 1.8 3.3 . . . . . A . 15 ARG HA . . A . 15 ARG H . . . 15 . HA . . . . . 15 . HN . . rr_1r02 1
40 1 OR . 1 1 15 15 ARG H H . . . 1 1 15 15 ARG HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 15 ARG HB2 . . A . 15 ARG H . . . 15 . HB* . . . . . 15 . HN . . rr_1r02 1
40 2 OR . 1 1 15 15 ARG H H . . . 1 1 15 15 ARG HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 15 ARG HB3 . . A . 15 ARG H . . . 15 . HB* . . . . . 15 . HN . . rr_1r02 1
41 1 OR . 1 1 15 15 ARG H H . . . 1 1 15 15 ARG HG2 H . . . . . 4.0 1.8 6.0 . . . . . A . 15 ARG HG2 . . A . 15 ARG H . . . 15 . HG* . . . . . 15 . HN . . rr_1r02 1
41 2 OR . 1 1 15 15 ARG H H . . . 1 1 15 15 ARG HG3 H . . . . . 4.0 1.8 6.0 . . . . . A . 15 ARG HG3 . . A . 15 ARG H . . . 15 . HG* . . . . . 15 . HN . . rr_1r02 1
42 1 OR . 1 1 15 15 ARG H H . . . 1 1 15 15 ARG HD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 15 ARG HD2 . . A . 15 ARG H . . . 15 . HD* . . . . . 15 . HN . . rr_1r02 1
42 2 OR . 1 1 15 15 ARG H H . . . 1 1 15 15 ARG HD3 H . . . . . 4.0 1.8 6.0 . . . . . A . 15 ARG HD3 . . A . 15 ARG H . . . 15 . HD* . . . . . 15 . HN . . rr_1r02 1
43 1 . . 1 1 16 16 LEU HA H . . . 1 1 16 16 LEU H H . . . . . 3.0 1.8 3.3 . . . . . A . 16 LEU HA . . A . 16 LEU H . . . 16 . HA . . . . . 16 . HN . . rr_1r02 1
44 1 OR . 1 1 16 16 LEU H H . . . 1 1 16 16 LEU HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 16 LEU HB2 . . A . 16 LEU H . . . 16 . HB* . . . . . 16 . HN . . rr_1r02 1
44 2 OR . 1 1 16 16 LEU H H . . . 1 1 16 16 LEU HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 16 LEU HB3 . . A . 16 LEU H . . . 16 . HB* . . . . . 16 . HN . . rr_1r02 1
45 1 . . 1 1 16 16 LEU H H . . . 1 1 16 16 LEU HG H . . . . . 4.0 1.8 6.0 . . . . . A . 16 LEU HG . . A . 16 LEU H . . . 16 . HG* . . . . . 16 . HN . . rr_1r02 1
46 1 OR . 1 1 16 16 LEU H H . . . 1 1 16 16 LEU MD1 H . . . . . 4.0 1.8 6.0 . . . . . A . 16 LEU MD1 . . A . 16 LEU H . . . 16 . HD* . . . . . 16 . HN . . rr_1r02 1
46 2 OR . 1 1 16 16 LEU H H . . . 1 1 16 16 LEU MD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 16 LEU MD2 . . A . 16 LEU H . . . 16 . HD* . . . . . 16 . HN . . rr_1r02 1
47 1 OR . 1 1 16 16 LEU HA H . . . 1 1 16 16 LEU HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 16 LEU HA . . A . 16 LEU HB2 . . . 16 . HA . . . . . 16 . HB* . . rr_1r02 1
47 2 OR . 1 1 16 16 LEU HA H . . . 1 1 16 16 LEU HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 16 LEU HA . . A . 16 LEU HB3 . . . 16 . HA . . . . . 16 . HB* . . rr_1r02 1
48 1 . . 1 1 17 17 TYR HA H . . . 1 1 17 17 TYR H H . . . . . 3.0 1.8 3.3 . . . . . A . 17 TYR HA . . A . 17 TYR H . . . 17 . HA . . . . . 17 . HN . . rr_1r02 1
49 1 OR . 1 1 17 17 TYR H H . . . 1 1 17 17 TYR HB2 H . . . . . 3.0 1.8 4.3 . . . . . A . 17 TYR HB2 . . A . 17 TYR H . . . 17 . HB* . . . . . 17 . HN . . rr_1r02 1
49 2 OR . 1 1 17 17 TYR H H . . . 1 1 17 17 TYR HB3 H . . . . . 3.0 1.8 4.3 . . . . . A . 17 TYR HB3 . . A . 17 TYR H . . . 17 . HB* . . . . . 17 . HN . . rr_1r02 1
50 1 OR . 1 1 17 17 TYR HA H . . . 1 1 17 17 TYR HB2 H . . . . . 3.0 1.8 4.3 . . . . . A . 17 TYR HA . . A . 17 TYR HB2 . . . 17 . HA . . . . . 17 . HB* . . rr_1r02 1
50 2 OR . 1 1 17 17 TYR HA H . . . 1 1 17 17 TYR HB3 H . . . . . 3.0 1.8 4.3 . . . . . A . 17 TYR HA . . A . 17 TYR HB3 . . . 17 . HA . . . . . 17 . HB* . . rr_1r02 1
51 1 . . 1 1 18 18 GLU HA H . . . 1 1 18 18 GLU H H . . . . . 3.0 1.8 3.3 . . . . . A . 18 GLU HA . . A . 18 GLU H . . . 18 . HA . . . . . 18 . HN . . rr_1r02 1
52 1 OR . 1 1 18 18 GLU H H . . . 1 1 18 18 GLU HB2 H . . . . . 3.0 1.8 4.3 . . . . . A . 18 GLU HB2 . . A . 18 GLU H . . . 18 . HB* . . . . . 18 . HN . . rr_1r02 1
52 2 OR . 1 1 18 18 GLU H H . . . 1 1 18 18 GLU HB3 H . . . . . 3.0 1.8 4.3 . . . . . A . 18 GLU HB3 . . A . 18 GLU H . . . 18 . HB* . . . . . 18 . HN . . rr_1r02 1
53 1 OR . 1 1 18 18 GLU H H . . . 1 1 18 18 GLU HG2 H . . . . . 4.0 1.8 6.0 . . . . . A . 18 GLU HG2 . . A . 18 GLU H . . . 18 . HG* . . . . . 18 . HN . . rr_1r02 1
53 2 OR . 1 1 18 18 GLU H H . . . 1 1 18 18 GLU HG3 H . . . . . 4.0 1.8 6.0 . . . . . A . 18 GLU HG3 . . A . 18 GLU H . . . 18 . HG* . . . . . 18 . HN . . rr_1r02 1
54 1 . . 1 1 19 19 LEU HA H . . . 1 1 19 19 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 19 LEU HA . . A . 19 LEU H . . . 19 . HA . . . . . 19 . HN . . rr_1r02 1
55 1 OR . 1 1 19 19 LEU H H . . . 1 1 19 19 LEU HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 19 LEU HB2 . . A . 19 LEU H . . . 19 . HB* . . . . . 19 . HN . . rr_1r02 1
55 2 OR . 1 1 19 19 LEU H H . . . 1 1 19 19 LEU HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 19 LEU HB3 . . A . 19 LEU H . . . 19 . HB* . . . . . 19 . HN . . rr_1r02 1
56 1 . . 1 1 19 19 LEU H H . . . 1 1 19 19 LEU HG H . . . . . 4.0 1.8 5.0 . . . . . A . 19 LEU HG . . A . 19 LEU H . . . 19 . HG . . . . . 19 . HN . . rr_1r02 1
57 1 OR . 1 1 19 19 LEU H H . . . 1 1 19 19 LEU MD1 H . . . . . 4.0 1.8 6.0 . . . . . A . 19 LEU MD1 . . A . 19 LEU H . . . 19 . HD* . . . . . 19 . HN . . rr_1r02 1
57 2 OR . 1 1 19 19 LEU H H . . . 1 1 19 19 LEU MD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 19 LEU MD2 . . A . 19 LEU H . . . 19 . HD* . . . . . 19 . HN . . rr_1r02 1
58 1 . . 1 1 20 20 LEU HA H . . . 1 1 20 20 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 20 LEU HA . . A . 20 LEU H . . . 20 . HA . . . . . 20 . HN . . rr_1r02 1
59 1 OR . 1 1 20 20 LEU H H . . . 1 1 20 20 LEU HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 20 LEU HB2 . . A . 20 LEU H . . . 20 . HB* . . . . . 20 . HN . . rr_1r02 1
59 2 OR . 1 1 20 20 LEU H H . . . 1 1 20 20 LEU HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 20 LEU HB3 . . A . 20 LEU H . . . 20 . HB* . . . . . 20 . HN . . rr_1r02 1
60 1 . . 1 1 20 20 LEU H H . . . 1 1 20 20 LEU HG H . . . . . 4.0 1.8 5.0 . . . . . A . 20 LEU HG . . A . 20 LEU H . . . 20 . HG . . . . . 20 . HN . . rr_1r02 1
61 1 OR . 1 1 20 20 LEU H H . . . 1 1 20 20 LEU MD1 H . . . . . 4.0 1.8 6.0 . . . . . A . 20 LEU MD1 . . A . 20 LEU H . . . 20 . HD* . . . . . 20 . HN . . rr_1r02 1
61 2 OR . 1 1 20 20 LEU H H . . . 1 1 20 20 LEU MD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 20 LEU MD2 . . A . 20 LEU H . . . 20 . HD* . . . . . 20 . HN . . rr_1r02 1
62 1 . . 1 1 21 21 HIS HA H . . . 1 1 21 21 HIS H H . . . . . 4.0 1.8 5.0 . . . . . A . 21 HIS HA . . A . 21 HIS H . . . 21 . HA . . . . . 21 . HN . . rr_1r02 1
63 1 OR . 1 1 21 21 HIS H H . . . 1 1 21 21 HIS HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 21 HIS HB2 . . A . 21 HIS H . . . 21 . HB* . . . . . 21 . HN . . rr_1r02 1
63 2 OR . 1 1 21 21 HIS H H . . . 1 1 21 21 HIS HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 21 HIS HB3 . . A . 21 HIS H . . . 21 . HB* . . . . . 21 . HN . . rr_1r02 1
64 1 OR . 1 1 21 21 HIS HA H . . . 1 1 21 21 HIS HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 21 HIS HA . . A . 21 HIS HB2 . . . 21 . HA . . . . . 21 . HB* . . rr_1r02 1
64 2 OR . 1 1 21 21 HIS HA H . . . 1 1 21 21 HIS HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 21 HIS HA . . A . 21 HIS HB3 . . . 21 . HA . . . . . 21 . HB* . . rr_1r02 1
65 1 OR . 1 1 22 22 GLY H H . . . 1 1 22 22 GLY HA2 H . . . . . 3.0 1.8 4.3 . . . . . A . 22 GLY HA2 . . A . 22 GLY H . . . 22 . HA* . . . . . 22 . HN . . rr_1r02 1
65 2 OR . 1 1 22 22 GLY HA3 H . . . 1 1 22 22 GLY H H . . . . . 3.0 1.8 4.3 . . . . . A . 22 GLY HA3 . . A . 22 GLY H . . . 22 . HA* . . . . . 22 . HN . . rr_1r02 1
66 1 . . 1 1 23 23 ALA HA H . . . 1 1 23 23 ALA H H . . . . . 3.0 1.8 3.3 . . . . . A . 23 ALA HA . . A . 23 ALA H . . . 23 . HA . . . . . 23 . HN . . rr_1r02 1
67 1 . . 1 1 23 23 ALA H H . . . 1 1 23 23 ALA MB H . . . . . 4.0 1.8 6.0 . . . . . A . 23 ALA MB . . A . 23 ALA H . . . 23 . HB* . . . . . 23 . HN . . rr_1r02 1
68 1 OR . 1 1 24 24 GLY H H . . . 1 1 24 24 GLY HA2 H . . . . . 3.0 1.8 4.3 . . . . . A . 24 GLY HA2 . . A . 24 GLY H . . . 24 . HA* . . . . . 24 . HN . . rr_1r02 1
68 2 OR . 1 1 24 24 GLY HA3 H . . . 1 1 24 24 GLY H H . . . . . 3.0 1.8 4.3 . . . . . A . 24 GLY HA3 . . A . 24 GLY H . . . 24 . HA* . . . . . 24 . HN . . rr_1r02 1
69 1 . . 1 1 25 25 ASN HA H . . . 1 1 25 25 ASN H H . . . . . 3.0 1.8 3.3 . . . . . A . 25 ASN HA . . A . 25 ASN H . . . 25 . HA . . . . . 25 . HN . . rr_1r02 1
70 1 OR . 1 1 25 25 ASN H H . . . 1 1 25 25 ASN HB2 H . . . . . 3.0 1.8 4.3 . . . . . A . 25 ASN HB2 . . A . 25 ASN H . . . 25 . HB* . . . . . 25 . HN . . rr_1r02 1
70 2 OR . 1 1 25 25 ASN H H . . . 1 1 25 25 ASN HB3 H . . . . . 3.0 1.8 4.3 . . . . . A . 25 ASN HB3 . . A . 25 ASN H . . . 25 . HB* . . . . . 25 . HN . . rr_1r02 1
71 1 OR . 1 1 25 25 ASN HA H . . . 1 1 25 25 ASN HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 25 ASN HA . . A . 25 ASN HB2 . . . 25 . HA . . . . . 25 . HB* . . rr_1r02 1
71 2 OR . 1 1 25 25 ASN HA H . . . 1 1 25 25 ASN HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 25 ASN HA . . A . 25 ASN HB3 . . . 25 . HA . . . . . 25 . HB* . . rr_1r02 1
72 1 . . 1 1 26 26 HIS HA H . . . 1 1 26 26 HIS H H . . . . . 3.0 1.8 3.3 . . . . . A . 26 HIS HA . . A . 26 HIS H . . . 26 . HA . . . . . 26 . HN . . rr_1r02 1
73 1 OR . 1 1 26 26 HIS H H . . . 1 1 26 26 HIS HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 26 HIS HB2 . . A . 26 HIS H . . . 26 . HB* . . . . . 26 . HN . . rr_1r02 1
73 2 OR . 1 1 26 26 HIS H H . . . 1 1 26 26 HIS HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 26 HIS HB3 . . A . 26 HIS H . . . 26 . HB* . . . . . 26 . HN . . rr_1r02 1
74 1 OR . 1 1 26 26 HIS HA H . . . 1 1 26 26 HIS HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 26 HIS HA . . A . 26 HIS HB2 . . . 26 . HA . . . . . 26 . HB* . . rr_1r02 1
74 2 OR . 1 1 26 26 HIS HA H . . . 1 1 26 26 HIS HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 26 HIS HA . . A . 26 HIS HB3 . . . 26 . HA . . . . . 26 . HB* . . rr_1r02 1
75 1 . . 1 1 27 27 ALA HA H . . . 1 1 27 27 ALA H H . . . . . 3.0 1.8 3.3 . . . . . A . 27 ALA HA . . A . 27 ALA H . . . 27 . HA . . . . . 27 . HN . . rr_1r02 1
76 1 . . 1 1 27 27 ALA H H . . . 1 1 27 27 ALA MB H . . . . . 4.0 1.8 6.0 . . . . . A . 27 ALA MB . . A . 27 ALA H . . . 27 . HB* . . . . . 27 . HN . . rr_1r02 1
77 1 . . 1 1 28 28 ALA HA H . . . 1 1 28 28 ALA H H . . . . . 3.0 1.8 3.3 . . . . . A . 28 ALA HA . . A . 28 ALA H . . . 28 . HA . . . . . 28 . HN . . rr_1r02 1
78 1 . . 1 1 28 28 ALA H H . . . 1 1 28 28 ALA MB H . . . . . 4.0 1.8 6.0 . . . . . A . 28 ALA MB . . A . 28 ALA H . . . 28 . HB* . . . . . 28 . HN . . rr_1r02 1
79 1 . . 1 1 28 28 ALA HA H . . . 1 1 28 28 ALA MB H . . . . . 4.0 1.8 6.0 . . . . . A . 28 ALA HA . . A . 28 ALA MB . . . 28 . HA . . . . . 28 . HB* . . rr_1r02 1
80 1 OR . 1 1 29 29 GLY H H . . . 1 1 29 29 GLY HA2 H . . . . . 3.0 1.8 4.3 . . . . . A . 29 GLY HA2 . . A . 29 GLY H . . . 29 . HA* . . . . . 29 . HN . . rr_1r02 1
80 2 OR . 1 1 29 29 GLY HA3 H . . . 1 1 29 29 GLY H H . . . . . 3.0 1.8 4.3 . . . . . A . 29 GLY HA3 . . A . 29 GLY H . . . 29 . HA* . . . . . 29 . HN . . rr_1r02 1
81 1 . . 1 1 30 30 ILE HA H . . . 1 1 30 30 ILE H H . . . . . 3.0 1.8 3.3 . . . . . A . 30 ILE HA . . A . 30 ILE H . . . 30 . HA . . . . . 30 . HN . . rr_1r02 1
82 1 . . 1 1 30 30 ILE H H . . . 1 1 30 30 ILE HB H . . . . . 3.0 1.8 3.3 . . . . . A . 30 ILE HB . . A . 30 ILE H . . . 30 . HB . . . . . 30 . HN . . rr_1r02 1
83 1 . . 1 1 30 30 ILE H H . . . 1 1 30 30 ILE MG H . . . . . 4.0 1.8 6.0 . . . . . A . 30 ILE MG . . A . 30 ILE H . . . 30 . HG2* . . . . . 30 . HN . . rr_1r02 1
84 1 OR . 1 1 30 30 ILE H H . . . 1 1 30 30 ILE HG12 H . . . . . 4.0 1.8 6.0 . . . . . A . 30 ILE HG12 . . A . 30 ILE H . . . 30 . HG1* . . . . . 30 . HN . . rr_1r02 1
84 2 OR . 1 1 30 30 ILE H H . . . 1 1 30 30 ILE HG13 H . . . . . 4.0 1.8 6.0 . . . . . A . 30 ILE HG13 . . A . 30 ILE H . . . 30 . HG1* . . . . . 30 . HN . . rr_1r02 1
85 1 . . 1 1 30 30 ILE H H . . . 1 1 30 30 ILE MD H . . . . . 4.0 1.8 6.0 . . . . . A . 30 ILE MD . . A . 30 ILE H . . . 30 . HD* . . . . . 30 . HN . . rr_1r02 1
86 1 . . 1 1 31 31 LEU HA H . . . 1 1 31 31 LEU H H . . . . . 3.0 1.8 3.3 . . . . . A . 31 LEU HA . . A . 31 LEU H . . . 31 . HA . . . . . 31 . HN . . rr_1r02 1
87 1 OR . 1 1 31 31 LEU H H . . . 1 1 31 31 LEU HB2 H . . . . . 3.0 1.8 4.3 . . . . . A . 31 LEU HB2 . . A . 31 LEU H . . . 31 . HB* . . . . . 31 . HN . . rr_1r02 1
87 2 OR . 1 1 31 31 LEU H H . . . 1 1 31 31 LEU HB3 H . . . . . 3.0 1.8 4.3 . . . . . A . 31 LEU HB3 . . A . 31 LEU H . . . 31 . HB* . . . . . 31 . HN . . rr_1r02 1
88 1 . . 1 1 31 31 LEU H H . . . 1 1 31 31 LEU HG H . . . . . 4.0 1.8 6.0 . . . . . A . 31 LEU HG . . A . 31 LEU H . . . 31 . HG* . . . . . 31 . HN . . rr_1r02 1
89 1 OR . 1 1 31 31 LEU H H . . . 1 1 31 31 LEU MD1 H . . . . . 4.0 1.8 6.0 . . . . . A . 31 LEU MD1 . . A . 31 LEU H . . . 31 . HD* . . . . . 31 . HN . . rr_1r02 1
89 2 OR . 1 1 31 31 LEU H H . . . 1 1 31 31 LEU MD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 31 LEU MD2 . . A . 31 LEU H . . . 31 . HD* . . . . . 31 . HN . . rr_1r02 1
90 1 . . 1 1 32 32 THR HA H . . . 1 1 32 32 THR H H . . . . . 3.0 1.8 3.3 . . . . . A . 32 THR HA . . A . 32 THR H . . . 32 . HA . . . . . 32 . HN . . rr_1r02 1
91 1 . . 1 1 32 32 THR H H . . . 1 1 32 32 THR HB H . . . . . 3.0 1.8 3.3 . . . . . A . 32 THR HB . . A . 32 THR H . . . 32 . HB . . . . . 32 . HN . . rr_1r02 1
92 1 OR . 1 1 32 32 THR H H . . . 1 1 32 32 THR MG H . . . . . 3.0 1.8 4.3 . . . . . A . 32 THR MG . . A . 32 THR H . . . 32 . HG* . . . . . 32 . HN . . rr_1r02 1
92 2 OR . 1 1 32 32 THR H H . . . 1 1 32 32 THR HG1 H . . . . . 3.0 1.8 4.3 . . . . . A . 32 THR HG1 . . A . 32 THR H . . . 32 . HG* . . . . . 32 . HN . . rr_1r02 1
93 1 . . 1 1 33 33 LEU HA H . . . 1 1 33 33 LEU H H . . . . . 3.0 1.8 3.3 . . . . . A . 33 LEU HA . . A . 33 LEU H . . . 33 . HA . . . . . 33 . HN . . rr_1r02 1
94 1 OR . 1 1 33 33 LEU H H . . . 1 1 33 33 LEU HB2 H . . . . . 3.0 1.8 4.3 . . . . . A . 33 LEU HB2 . . A . 33 LEU H . . . 33 . HB* . . . . . 33 . HN . . rr_1r02 1
94 2 OR . 1 1 33 33 LEU H H . . . 1 1 33 33 LEU HB3 H . . . . . 3.0 1.8 4.3 . . . . . A . 33 LEU HB3 . . A . 33 LEU H . . . 33 . HB* . . . . . 33 . HN . . rr_1r02 1
95 1 . . 1 1 33 33 LEU H H . . . 1 1 33 33 LEU HG H . . . . . 4.0 1.8 6.0 . . . . . A . 33 LEU HG . . A . 33 LEU H . . . 33 . HG* . . . . . 33 . HN . . rr_1r02 1
96 1 . . 1 1 5 5 ASP H H . . . 1 1 6 6 CYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 5 ASP H . . A . 6 CYS H . . . 5 . HN . . . . . 6 . HN . . rr_1r02 1
97 1 . . 1 1 6 6 CYS H H . . . 1 1 7 7 CYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 6 CYS H . . A . 7 CYS H . . . 6 . HN . . . . . 7 . HN . . rr_1r02 1
98 1 . . 1 1 8 8 ARG H H . . . 1 1 9 9 GLN H H . . . . . 4.0 1.8 5.0 . . . . . A . 8 ARG H . . A . 9 GLN H . . . 8 . HN . . . . . 9 . HN . . rr_1r02 1
99 1 . . 1 1 9 9 GLN H H . . . 1 1 10 10 LYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 9 GLN H . . A . 10 LYS H . . . 9 . HN . . . . . 10 . HN . . rr_1r02 1
100 1 . . 1 1 10 10 LYS H H . . . 1 1 11 11 THR H H . . . . . 4.0 1.8 5.0 . . . . . A . 10 LYS H . . A . 11 THR H . . . 10 . HN . . . . . 11 . HN . . rr_1r02 1
101 1 . . 1 1 11 11 THR H H . . . 1 1 12 12 CYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 11 THR H . . A . 12 CYS H . . . 11 . HN . . . . . 12 . HN . . rr_1r02 1
102 1 . . 1 1 12 12 CYS H H . . . 1 1 13 13 SER H H . . . . . 4.0 1.8 5.0 . . . . . A . 12 CYS H . . A . 13 SER H . . . 12 . HN . . . . . 13 . HN . . rr_1r02 1
103 1 . . 1 1 13 13 SER H H . . . 1 1 14 14 CYS H H . . . . . 3.0 1.8 3.3 . . . . . A . 13 SER H . . A . 14 CYS H . . . 13 . HN . . . . . 14 . HN . . rr_1r02 1
104 1 . . 1 1 14 14 CYS H H . . . 1 1 15 15 ARG H H . . . . . 4.0 1.8 5.0 . . . . . A . 14 CYS H . . A . 15 ARG H . . . 14 . HN . . . . . 15 . HN . . rr_1r02 1
105 1 . . 1 1 15 15 ARG H H . . . 1 1 16 16 LEU H H . . . . . 3.0 1.8 3.3 . . . . . A . 15 ARG H . . A . 16 LEU H . . . 15 . HN . . . . . 16 . HN . . rr_1r02 1
106 1 . . 1 1 16 16 LEU H H . . . 1 1 17 17 TYR H H . . . . . 3.0 1.8 3.3 . . . . . A . 16 LEU H . . A . 17 TYR H . . . 16 . HN . . . . . 17 . HN . . rr_1r02 1
107 1 . . 1 1 17 17 TYR H H . . . 1 1 18 18 GLU H H . . . . . 3.0 1.8 3.3 . . . . . A . 17 TYR H . . A . 18 GLU H . . . 17 . HN . . . . . 18 . HN . . rr_1r02 1
108 1 . . 1 1 18 18 GLU H H . . . 1 1 19 19 LEU H H . . . . . 3.0 1.8 3.3 . . . . . A . 18 GLU H . . A . 19 LEU H . . . 18 . HN . . . . . 19 . HN . . rr_1r02 1
109 1 . . 1 1 19 19 LEU H H . . . 1 1 20 20 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 19 LEU H . . A . 20 LEU H . . . 19 . HN . . . . . 20 . HN . . rr_1r02 1
110 1 . . 1 1 20 20 LEU H H . . . 1 1 21 21 HIS H H . . . . . 3.0 1.8 3.3 . . . . . A . 20 LEU H . . A . 21 HIS H . . . 20 . HN . . . . . 21 . HN . . rr_1r02 1
111 1 . . 1 1 21 21 HIS H H . . . 1 1 22 22 GLY H H . . . . . 3.0 1.8 3.3 . . . . . A . 21 HIS H . . A . 22 GLY H . . . 21 . HN . . . . . 22 . HN . . rr_1r02 1
112 1 . . 1 1 23 23 ALA H H . . . 1 1 24 24 GLY H H . . . . . 4.0 1.8 5.0 . . . . . A . 23 ALA H . . A . 24 GLY H . . . 23 . HN . . . . . 24 . HN . . rr_1r02 1
113 1 . . 1 1 24 24 GLY H H . . . 1 1 25 25 ASN H H . . . . . 4.0 1.8 5.0 . . . . . A . 24 GLY H . . A . 25 ASN H . . . 24 . HN . . . . . 25 . HN . . rr_1r02 1
114 1 . . 1 1 25 25 ASN H H . . . 1 1 26 26 HIS H H . . . . . 4.0 1.8 5.0 . . . . . A . 25 ASN H . . A . 26 HIS H . . . 25 . HN . . . . . 26 . HN . . rr_1r02 1
115 1 . . 1 1 26 26 HIS H H . . . 1 1 27 27 ALA H H . . . . . 4.0 1.8 5.0 . . . . . A . 26 HIS H . . A . 27 ALA H . . . 26 . HN . . . . . 27 . HN . . rr_1r02 1
116 1 . . 1 1 27 27 ALA H H . . . 1 1 28 28 ALA H H . . . . . 3.0 1.8 3.3 . . . . . A . 27 ALA H . . A . 28 ALA H . . . 27 . HN . . . . . 28 . HN . . rr_1r02 1
117 1 . . 1 1 28 28 ALA H H . . . 1 1 29 29 GLY H H . . . . . 3.0 1.8 3.3 . . . . . A . 28 ALA H . . A . 29 GLY H . . . 28 . HN . . . . . 29 . HN . . rr_1r02 1
118 1 . . 1 1 29 29 GLY H H . . . 1 1 30 30 ILE H H . . . . . 3.0 1.8 3.3 . . . . . A . 29 GLY H . . A . 30 ILE H . . . 29 . HN . . . . . 30 . HN . . rr_1r02 1
119 1 . . 1 1 31 31 LEU H H . . . 1 1 32 32 THR H H . . . . . 4.0 1.8 5.0 . . . . . A . 31 LEU H . . A . 32 THR H . . . 31 . HN . . . . . 32 . HN . . rr_1r02 1
120 1 . . 1 1 32 32 THR H H . . . 1 1 33 33 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 32 THR H . . A . 33 LEU H . . . 32 . HN . . . . . 33 . HN . . rr_1r02 1
121 1 . . 1 1 6 6 CYS H H . . . 1 1 8 8 ARG H H . . . . . 4.0 1.8 5.0 . . . . . A . 6 CYS H . . A . 8 ARG H . . . 6 . HN . . . . . 8 . HN . . rr_1r02 1
122 1 . . 1 1 6 6 CYS H H . . . 1 1 11 11 THR H H . . . . . 4.0 1.8 5.0 . . . . . A . 6 CYS H . . A . 11 THR H . . . 6 . HN . . . . . 11 . HN . . rr_1r02 1
123 1 . . 1 1 10 10 LYS H H . . . 1 1 12 12 CYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 10 LYS H . . A . 12 CYS H . . . 10 . HN . . . . . 12 . HN . . rr_1r02 1
124 1 . . 1 1 11 11 THR H H . . . 1 1 13 13 SER H H . . . . . 4.0 1.8 5.0 . . . . . A . 11 THR H . . A . 13 SER H . . . 11 . HN . . . . . 13 . HN . . rr_1r02 1
125 1 . . 1 1 14 14 CYS H H . . . 1 1 16 16 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 14 CYS H . . A . 16 LEU H . . . 14 . HN . . . . . 16 . HN . . rr_1r02 1
126 1 . . 1 1 16 16 LEU H H . . . 1 1 18 18 GLU H H . . . . . 4.0 1.8 5.0 . . . . . A . 16 LEU H . . A . 18 GLU H . . . 16 . HN . . . . . 18 . HN . . rr_1r02 1
127 1 . . 1 1 15 15 ARG H H . . . 1 1 17 17 TYR H H . . . . . 4.0 1.8 5.0 . . . . . A . 15 ARG H . . A . 17 TYR H . . . 15 . HN . . . . . 17 . HN . . rr_1r02 1
128 1 . . 1 1 17 17 TYR H H . . . 1 1 19 19 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 17 TYR H . . A . 19 LEU H . . . 17 . HN . . . . . 19 . HN . . rr_1r02 1
129 1 . . 1 1 18 18 GLU H H . . . 1 1 20 20 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 18 GLU H . . A . 20 LEU H . . . 18 . HN . . . . . 20 . HN . . rr_1r02 1
130 1 . . 1 1 19 19 LEU H H . . . 1 1 21 21 HIS H H . . . . . 4.0 1.8 5.0 . . . . . A . 19 LEU H . . A . 21 HIS H . . . 19 . HN . . . . . 21 . HN . . rr_1r02 1
131 1 . . 1 1 24 24 GLY H H . . . 1 1 26 26 HIS H H . . . . . 4.0 1.8 5.0 . . . . . A . 24 GLY H . . A . 26 HIS H . . . 24 . HN . . . . . 26 . HN . . rr_1r02 1
132 1 . . 1 1 25 25 ASN H H . . . 1 1 27 27 ALA H H . . . . . 4.0 1.8 5.0 . . . . . A . 25 ASN H . . A . 27 ALA H . . . 25 . HN . . . . . 27 . HN . . rr_1r02 1
133 1 . . 1 1 26 26 HIS H H . . . 1 1 28 28 ALA H H . . . . . 4.0 1.8 5.0 . . . . . A . 26 HIS H . . A . 28 ALA H . . . 26 . HN . . . . . 28 . HN . . rr_1r02 1
134 1 . . 1 1 27 27 ALA H H . . . 1 1 29 29 GLY H H . . . . . 4.0 1.8 5.0 . . . . . A . 27 ALA H . . A . 29 GLY H . . . 27 . HN . . . . . 29 . HN . . rr_1r02 1
135 1 . . 1 1 28 28 ALA H H . . . 1 1 30 30 ILE H H . . . . . 4.0 1.8 5.0 . . . . . A . 28 ALA H . . A . 30 ILE H . . . 28 . HN . . . . . 30 . HN . . rr_1r02 1
136 1 . . 1 1 15 15 ARG HA H . . . 1 1 18 18 GLU H H . . . . . 4.0 1.8 5.0 . . . . . A . 15 ARG HA . . A . 18 GLU H . . . 15 . HA . . . . . 18 . HN . . rr_1r02 1
137 1 . . 1 1 16 16 LEU HA H . . . 1 1 19 19 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 16 LEU HA . . A . 19 LEU H . . . 16 . HA . . . . . 19 . HN . . rr_1r02 1
138 1 . . 1 1 17 17 TYR HA H . . . 1 1 20 20 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 17 TYR HA . . A . 20 LEU H . . . 17 . HA . . . . . 20 . HN . . rr_1r02 1
139 1 . . 1 1 25 25 ASN HA H . . . 1 1 28 28 ALA H H . . . . . 4.0 1.8 5.0 . . . . . A . 25 ASN HA . . A . 28 ALA H . . . 25 . HA . . . . . 28 . HN . . rr_1r02 1
140 1 . . 1 1 26 26 HIS HA H . . . 1 1 29 29 GLY H H . . . . . 4.0 1.8 5.0 . . . . . A . 26 HIS HA . . A . 29 GLY H . . . 26 . HA . . . . . 29 . HN . . rr_1r02 1
141 1 . . 1 1 28 28 ALA HA H . . . 1 1 31 31 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 28 ALA HA . . A . 31 LEU H . . . 28 . HA . . . . . 31 . HN . . rr_1r02 1
142 1 . . 1 1 27 27 ALA HA H . . . 1 1 30 30 ILE H H . . . . . 4.0 1.8 5.0 . . . . . A . 27 ALA HA . . A . 30 ILE H . . . 27 . HA . . . . . 30 . HN . . rr_1r02 1
143 1 . . 1 1 28 28 ALA HA H . . . 1 1 32 32 THR H H . . . . . 4.0 1.8 5.0 . . . . . A . 28 ALA HA . . A . 32 THR H . . . 28 . HA . . . . . 32 . HN . . rr_1r02 1
144 1 OR . 1 1 8 8 ARG H H . . . 1 1 7 7 CYS HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 7 CYS HB2 . . A . 8 ARG H . . . 7 . HB* . . . . . 8 . HN . . rr_1r02 1
144 2 OR . 1 1 7 7 CYS HB3 H . . . 1 1 8 8 ARG H H . . . . . 4.0 1.8 6.0 . . . . . A . 7 CYS HB3 . . A . 8 ARG H . . . 7 . HB* . . . . . 8 . HN . . rr_1r02 1
145 1 OR . 1 1 10 10 LYS H H . . . 1 1 9 9 GLN HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 9 GLN HB2 . . A . 10 LYS H . . . 9 . HB* . . . . . 10 . HN . . rr_1r02 1
145 2 OR . 1 1 9 9 GLN HB3 H . . . 1 1 10 10 LYS H H . . . . . 4.0 1.8 6.0 . . . . . A . 9 GLN HB3 . . A . 10 LYS H . . . 9 . HB* . . . . . 10 . HN . . rr_1r02 1
146 1 OR . 1 1 13 13 SER H H . . . 1 1 12 12 CYS HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 12 CYS HB2 . . A . 13 SER H . . . 12 . HB* . . . . . 13 . HN . . rr_1r02 1
146 2 OR . 1 1 12 12 CYS HB3 H . . . 1 1 13 13 SER H H . . . . . 4.0 1.8 6.0 . . . . . A . 12 CYS HB3 . . A . 13 SER H . . . 12 . HB* . . . . . 13 . HN . . rr_1r02 1
147 1 OR . 1 1 17 17 TYR H H . . . 1 1 16 16 LEU HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 16 LEU HB2 . . A . 17 TYR H . . . 16 . HB* . . . . . 17 . HN . . rr_1r02 1
147 2 OR . 1 1 16 16 LEU HB3 H . . . 1 1 17 17 TYR H H . . . . . 4.0 1.8 6.0 . . . . . A . 16 LEU HB3 . . A . 17 TYR H . . . 16 . HB* . . . . . 17 . HN . . rr_1r02 1
148 1 OR . 1 1 18 18 GLU H H . . . 1 1 17 17 TYR HB2 H . . . . . 3.0 1.8 4.3 . . . . . A . 17 TYR HB2 . . A . 18 GLU H . . . 17 . HB* . . . . . 18 . HN . . rr_1r02 1
148 2 OR . 1 1 17 17 TYR HB3 H . . . 1 1 18 18 GLU H H . . . . . 3.0 1.8 4.3 . . . . . A . 17 TYR HB3 . . A . 18 GLU H . . . 17 . HB* . . . . . 18 . HN . . rr_1r02 1
149 1 OR . 1 1 19 19 LEU H H . . . 1 1 18 18 GLU HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 18 GLU HB2 . . A . 19 LEU H . . . 18 . HB* . . . . . 19 . HN . . rr_1r02 1
149 2 OR . 1 1 18 18 GLU HB3 H . . . 1 1 19 19 LEU H H . . . . . 4.0 1.8 6.0 . . . . . A . 18 GLU HB3 . . A . 19 LEU H . . . 18 . HB* . . . . . 19 . HN . . rr_1r02 1
150 1 OR . 1 1 20 20 LEU H H . . . 1 1 19 19 LEU HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 19 LEU HB2 . . A . 20 LEU H . . . 19 . HB* . . . . . 20 . HN . . rr_1r02 1
150 2 OR . 1 1 19 19 LEU HB3 H . . . 1 1 20 20 LEU H H . . . . . 4.0 1.8 6.0 . . . . . A . 19 LEU HB3 . . A . 20 LEU H . . . 19 . HB* . . . . . 20 . HN . . rr_1r02 1
151 1 OR . 1 1 21 21 HIS H H . . . 1 1 20 20 LEU HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 20 LEU HB2 . . A . 21 HIS H . . . 20 . HB* . . . . . 21 . HN . . rr_1r02 1
151 2 OR . 1 1 20 20 LEU HB3 H . . . 1 1 21 21 HIS H H . . . . . 4.0 1.8 6.0 . . . . . A . 20 LEU HB3 . . A . 21 HIS H . . . 20 . HB* . . . . . 21 . HN . . rr_1r02 1
152 1 OR . 1 1 27 27 ALA H H . . . 1 1 26 26 HIS HB2 H . . . . . 3.0 1.8 4.3 . . . . . A . 26 HIS HB2 . . A . 27 ALA H . . . 26 . HB* . . . . . 27 . HN . . rr_1r02 1
152 2 OR . 1 1 26 26 HIS HB3 H . . . 1 1 27 27 ALA H H . . . . . 3.0 1.8 4.3 . . . . . A . 26 HIS HB3 . . A . 27 ALA H . . . 26 . HB* . . . . . 27 . HN . . rr_1r02 1
153 1 . . 1 1 28 28 ALA MB H . . . 1 1 29 29 GLY H H . . . . . 3.0 1.8 4.3 . . . . . A . 28 ALA MB . . A . 29 GLY H . . . 28 . HB* . . . . . 29 . HN . . rr_1r02 1
154 1 . . 1 1 30 30 ILE HB H . . . 1 1 31 31 LEU H H . . . . . 4.0 1.8 6.0 . . . . . A . 30 ILE HB . . A . 31 LEU H . . . 30 . HB* . . . . . 31 . HN . . rr_1r02 1
155 1 . . 1 1 17 17 TYR H H . . . 1 1 16 16 LEU HG H . . . . . 4.0 1.8 5.0 . . . . . A . 16 LEU HG . . A . 17 TYR H . . . 16 . HG . . . . . 17 . HN . . rr_1r02 1
156 1 OR . 1 1 17 17 TYR H H . . . 1 1 16 16 LEU MD1 H . . . . . 4.0 1.8 6.0 . . . . . A . 16 LEU MD1 . . A . 17 TYR H . . . 16 . HD* . . . . . 17 . HN . . rr_1r02 1
156 2 OR . 1 1 16 16 LEU MD2 H . . . 1 1 17 17 TYR H H . . . . . 4.0 1.8 6.0 . . . . . A . 16 LEU MD2 . . A . 17 TYR H . . . 16 . HD* . . . . . 17 . HN . . rr_1r02 1
157 1 OR . 1 1 12 12 CYS H H . . . 1 1 11 11 THR MG H . . . . . 4.0 1.8 6.0 . . . . . A . 11 THR MG . . A . 12 CYS H . . . 11 . HG* . . . . . 12 . HN . . rr_1r02 1
157 2 OR . 1 1 11 11 THR HG1 H . . . 1 1 12 12 CYS H H . . . . . 4.0 1.8 6.0 . . . . . A . 11 THR HG1 . . A . 12 CYS H . . . 11 . HG* . . . . . 12 . HN . . rr_1r02 1
158 1 OR . 1 1 32 32 THR H H . . . 1 1 31 31 LEU MD1 H . . . . . 4.0 1.8 6.0 . . . . . A . 31 LEU MD1 . . A . 32 THR H . . . 31 . HD* . . . . . 32 . HN . . rr_1r02 1
158 2 OR . 1 1 31 31 LEU MD2 H . . . 1 1 32 32 THR H H . . . . . 4.0 1.8 6.0 . . . . . A . 31 LEU MD2 . . A . 32 THR H . . . 31 . HD* . . . . . 32 . HN . . rr_1r02 1
159 1 . . 1 1 20 20 LEU HG H . . . 1 1 21 21 HIS H H . . . . . 4.0 1.8 5.0 . . . . . A . 20 LEU HG . . A . 21 HIS H . . . 20 . HG . . . . . 21 . HN . . rr_1r02 1
160 1 OR . 1 1 14 14 CYS HA H . . . 1 1 17 17 TYR HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 14 CYS HA . . A . 17 TYR HB2 . . . 14 . HA . . . . . 17 . HB* . . rr_1r02 1
160 2 OR . 1 1 14 14 CYS HA H . . . 1 1 17 17 TYR HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 14 CYS HA . . A . 17 TYR HB3 . . . 14 . HA . . . . . 17 . HB* . . rr_1r02 1
161 1 OR . 1 1 15 15 ARG HA H . . . 1 1 18 18 GLU HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 15 ARG HA . . A . 18 GLU HB2 . . . 15 . HA . . . . . 18 . HB* . . rr_1r02 1
161 2 OR . 1 1 15 15 ARG HA H . . . 1 1 18 18 GLU HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 15 ARG HA . . A . 18 GLU HB3 . . . 15 . HA . . . . . 18 . HB* . . rr_1r02 1
162 1 OR . 1 1 16 16 LEU HA H . . . 1 1 19 19 LEU HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 16 LEU HA . . A . 19 LEU HB2 . . . 16 . HA . . . . . 19 . HB* . . rr_1r02 1
162 2 OR . 1 1 16 16 LEU HA H . . . 1 1 19 19 LEU HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 16 LEU HA . . A . 19 LEU HB3 . . . 16 . HA . . . . . 19 . HB* . . rr_1r02 1
163 1 OR . 1 1 17 17 TYR HA H . . . 1 1 20 20 LEU HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 17 TYR HA . . A . 20 LEU HB2 . . . 17 . HA . . . . . 20 . HB* . . rr_1r02 1
163 2 OR . 1 1 17 17 TYR HA H . . . 1 1 20 20 LEU HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 17 TYR HA . . A . 20 LEU HB3 . . . 17 . HA . . . . . 20 . HB* . . rr_1r02 1
164 1 OR . 1 1 18 18 GLU HA H . . . 1 1 21 21 HIS HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 18 GLU HA . . A . 21 HIS HB2 . . . 18 . HA . . . . . 21 . HB* . . rr_1r02 1
164 2 OR . 1 1 18 18 GLU HA H . . . 1 1 21 21 HIS HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 18 GLU HA . . A . 21 HIS HB3 . . . 18 . HA . . . . . 21 . HB* . . rr_1r02 1
165 1 . . 1 1 27 27 ALA HA H . . . 1 1 30 30 ILE HB H . . . . . 4.0 1.8 6.0 . . . . . A . 27 ALA HA . . A . 30 ILE HB . . . 27 . HA . . . . . 30 . HB* . . rr_1r02 1
166 1 . . 1 1 5 5 ASP HA H . . . 1 1 6 6 CYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 5 ASP HA . . A . 6 CYS H . . . 5 . HA . . . . . 6 . HN . . rr_1r02 1
167 1 . . 1 1 6 6 CYS HA H . . . 1 1 7 7 CYS H H . . . . . 3.0 1.8 3.3 . . . . . A . 6 CYS HA . . A . 7 CYS H . . . 6 . HA . . . . . 7 . HN . . rr_1r02 1
168 1 . . 1 1 7 7 CYS HA H . . . 1 1 8 8 ARG H H . . . . . 3.0 1.8 3.3 . . . . . A . 7 CYS HA . . A . 8 ARG H . . . 7 . HA . . . . . 8 . HN . . rr_1r02 1
169 1 . . 1 1 8 8 ARG HA H . . . 1 1 9 9 GLN H H . . . . . 4.0 1.8 5.0 . . . . . A . 8 ARG HA . . A . 9 GLN H . . . 8 . HA . . . . . 9 . HN . . rr_1r02 1
170 1 . . 1 1 9 9 GLN HA H . . . 1 1 10 10 LYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 9 GLN HA . . A . 10 LYS H . . . 9 . HA . . . . . 10 . HN . . rr_1r02 1
171 1 . . 1 1 10 10 LYS HA H . . . 1 1 11 11 THR H H . . . . . 4.0 1.8 5.0 . . . . . A . 10 LYS HA . . A . 11 THR H . . . 10 . HA . . . . . 11 . HN . . rr_1r02 1
172 1 . . 1 1 11 11 THR HA H . . . 1 1 12 12 CYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 11 THR HA . . A . 12 CYS H . . . 11 . HA . . . . . 12 . HN . . rr_1r02 1
173 1 . . 1 1 12 12 CYS HA H . . . 1 1 13 13 SER H H . . . . . 3.0 1.8 3.3 . . . . . A . 12 CYS HA . . A . 13 SER H . . . 12 . HA . . . . . 13 . HN . . rr_1r02 1
174 1 . . 1 1 13 13 SER HA H . . . 1 1 14 14 CYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 13 SER HA . . A . 14 CYS H . . . 13 . HA . . . . . 14 . HN . . rr_1r02 1
175 1 . . 1 1 14 14 CYS HA H . . . 1 1 15 15 ARG H H . . . . . 4.0 1.8 5.0 . . . . . A . 14 CYS HA . . A . 15 ARG H . . . 14 . HA . . . . . 15 . HN . . rr_1r02 1
176 1 . . 1 1 15 15 ARG HA H . . . 1 1 16 16 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 15 ARG HA . . A . 16 LEU H . . . 15 . HA . . . . . 16 . HN . . rr_1r02 1
177 1 . . 1 1 16 16 LEU HA H . . . 1 1 17 17 TYR H H . . . . . 4.0 1.8 5.0 . . . . . A . 16 LEU HA . . A . 17 TYR H . . . 16 . HA . . . . . 17 . HN . . rr_1r02 1
178 1 . . 1 1 17 17 TYR HA H . . . 1 1 18 18 GLU H H . . . . . 3.0 1.8 3.3 . . . . . A . 17 TYR HA . . A . 18 GLU H . . . 17 . HA . . . . . 18 . HN . . rr_1r02 1
179 1 . . 1 1 18 18 GLU HA H . . . 1 1 19 19 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 18 GLU HA . . A . 19 LEU H . . . 18 . HA . . . . . 19 . HN . . rr_1r02 1
180 1 . . 1 1 19 19 LEU HA H . . . 1 1 20 20 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 19 LEU HA . . A . 20 LEU H . . . 19 . HA . . . . . 20 . HN . . rr_1r02 1
181 1 . . 1 1 20 20 LEU HA H . . . 1 1 21 21 HIS H H . . . . . 4.0 1.8 5.0 . . . . . A . 20 LEU HA . . A . 21 HIS H . . . 20 . HA . . . . . 21 . HN . . rr_1r02 1
182 1 . . 1 1 21 21 HIS HA H . . . 1 1 22 22 GLY H H . . . . . 4.0 1.8 5.0 . . . . . A . 21 HIS HA . . A . 22 GLY H . . . 21 . HA . . . . . 22 . HN . . rr_1r02 1
183 1 OR . 1 1 23 23 ALA H H . . . 1 1 22 22 GLY HA2 H . . . . . 4.0 1.8 6.0 . . . . . A . 22 GLY HA2 . . A . 23 ALA H . . . 22 . HA* . . . . . 23 . HN . . rr_1r02 1
183 2 OR . 1 1 22 22 GLY HA3 H . . . 1 1 23 23 ALA H H . . . . . 4.0 1.8 6.0 . . . . . A . 22 GLY HA3 . . A . 23 ALA H . . . 22 . HA* . . . . . 23 . HN . . rr_1r02 1
184 1 . . 1 1 23 23 ALA HA H . . . 1 1 24 24 GLY H H . . . . . 4.0 1.8 5.0 . . . . . A . 23 ALA HA . . A . 24 GLY H . . . 23 . HA . . . . . 24 . HN . . rr_1r02 1
185 1 OR . 1 1 25 25 ASN H H . . . 1 1 24 24 GLY HA2 H . . . . . 4.0 1.8 6.0 . . . . . A . 24 GLY HA2 . . A . 25 ASN H . . . 24 . HA* . . . . . 25 . HN . . rr_1r02 1
185 2 OR . 1 1 24 24 GLY HA3 H . . . 1 1 25 25 ASN H H . . . . . 4.0 1.8 6.0 . . . . . A . 24 GLY HA3 . . A . 25 ASN H . . . 24 . HA* . . . . . 25 . HN . . rr_1r02 1
186 1 . . 1 1 25 25 ASN HA H . . . 1 1 26 26 HIS H H . . . . . 4.0 1.8 5.0 . . . . . A . 25 ASN HA . . A . 26 HIS H . . . 25 . HA . . . . . 26 . HN . . rr_1r02 1
187 1 . . 1 1 26 26 HIS HA H . . . 1 1 27 27 ALA H H . . . . . 4.0 1.8 5.0 . . . . . A . 26 HIS HA . . A . 27 ALA H . . . 26 . HA . . . . . 27 . HN . . rr_1r02 1
188 1 . . 1 1 27 27 ALA HA H . . . 1 1 28 28 ALA H H . . . . . 4.0 1.8 5.0 . . . . . A . 27 ALA HA . . A . 28 ALA H . . . 27 . HA . . . . . 28 . HN . . rr_1r02 1
189 1 . . 1 1 28 28 ALA HA H . . . 1 1 29 29 GLY H H . . . . . 3.0 1.8 4.3 . . . . . A . 28 ALA HA . . A . 29 GLY H . . . 28 . HA . . . . . 29 . HN . . rr_1r02 1
190 1 OR . 1 1 30 30 ILE H H . . . 1 1 29 29 GLY HA2 H . . . . . 4.0 1.8 5.0 . . . . . A . 29 GLY HA2 . . A . 30 ILE H . . . 29 . HA* . . . . . 30 . HN . . rr_1r02 1
190 2 OR . 1 1 29 29 GLY HA3 H . . . 1 1 30 30 ILE H H . . . . . 4.0 1.8 5.0 . . . . . A . 29 GLY HA3 . . A . 30 ILE H . . . 29 . HA* . . . . . 30 . HN . . rr_1r02 1
191 1 . . 1 1 30 30 ILE HA H . . . 1 1 31 31 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 30 ILE HA . . A . 31 LEU H . . . 30 . HA . . . . . 31 . HN . . rr_1r02 1
192 1 . . 1 1 31 31 LEU HA H . . . 1 1 32 32 THR H H . . . . . 3.0 1.8 3.3 . . . . . A . 31 LEU HA . . A . 32 THR H . . . 31 . HA . . . . . 32 . HN . . rr_1r02 1
193 1 . . 1 1 32 32 THR HA H . . . 1 1 33 33 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 32 THR HA . . A . 33 LEU H . . . 32 . HA . . . . . 33 . HN . . rr_1r02 1
194 1 . . 1 1 6 6 CYS HA H . . . 1 1 12 12 CYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 6 CYS HA . . A . 12 CYS H . . . 6 . HA . . . . . 12 . HN . . rr_1r02 1
195 1 . . 1 1 7 7 CYS HA H . . . 1 1 9 9 GLN H H . . . . . 4.0 1.8 5.0 . . . . . A . 7 CYS HA . . A . 9 GLN H . . . 7 . HA . . . . . 9 . HN . . rr_1r02 1
196 1 . . 1 1 11 11 THR HA H . . . 1 1 12 12 CYS HA H . . . . . 4.0 1.8 5.0 . . . . . A . 11 THR HA . . A . 12 CYS HA . . . 11 . HA . . . . . 12 . HA . . rr_1r02 1
197 1 OR . 1 1 25 25 ASN HA H . . . 1 1 24 24 GLY HA2 H . . . . . 4.0 1.8 6.0 . . . . . A . 24 GLY HA2 . . A . 25 ASN HA . . . 24 . HA* . . . . . 25 . HA . . rr_1r02 1
197 2 OR . 1 1 24 24 GLY HA3 H . . . 1 1 25 25 ASN HA H . . . . . 4.0 1.8 6.0 . . . . . A . 24 GLY HA3 . . A . 25 ASN HA . . . 24 . HA* . . . . . 25 . HA . . rr_1r02 1
198 1 . . 1 1 27 27 ALA HA H . . . 1 1 28 28 ALA HA H . . . . . 4.0 1.8 5.0 . . . . . A . 27 ALA HA . . A . 28 ALA HA . . . 27 . HA . . . . . 28 . HA . . rr_1r02 1
199 1 OR . 1 1 28 28 ALA HA H . . . 1 1 29 29 GLY HA2 H . . . . . 4.0 1.8 6.0 . . . . . A . 28 ALA HA . . A . 29 GLY HA2 . . . 28 . HA . . . . . 29 . HA* . . rr_1r02 1
199 2 OR . 1 1 28 28 ALA HA H . . . 1 1 29 29 GLY HA3 H . . . . . 4.0 1.8 6.0 . . . . . A . 28 ALA HA . . A . 29 GLY HA3 . . . 28 . HA . . . . . 29 . HA* . . rr_1r02 1
200 1 OR . 1 1 30 30 ILE HA H . . . 1 1 29 29 GLY HA2 H . . . . . 4.0 1.8 6.0 . . . . . A . 29 GLY HA2 . . A . 30 ILE HA . . . 29 . HA* . . . . . 30 . HA . . rr_1r02 1
200 2 OR . 1 1 29 29 GLY HA3 H . . . 1 1 30 30 ILE HA H . . . . . 4.0 1.8 6.0 . . . . . A . 29 GLY HA3 . . A . 30 ILE HA . . . 29 . HA* . . . . . 30 . HA . . rr_1r02 1
201 1 . . 1 1 30 30 ILE HA H . . . 1 1 31 31 LEU HA H . . . . . 4.0 1.8 5.0 . . . . . A . 30 ILE HA . . A . 31 LEU HA . . . 30 . HA . . . . . 31 . HA . . rr_1r02 1
202 1 OR . 1 1 23 23 ALA HA H . . . 1 1 22 22 GLY HA2 H . . . . . 4.0 1.8 6.0 . . . . . A . 22 GLY HA2 . . A . 23 ALA HA . . . 22 . HA* . . . . . 23 . HA . . rr_1r02 1
202 2 OR . 1 1 22 22 GLY HA3 H . . . 1 1 23 23 ALA HA H . . . . . 4.0 1.8 6.0 . . . . . A . 22 GLY HA3 . . A . 23 ALA HA . . . 22 . HA* . . . . . 23 . HA . . rr_1r02 1
203 1 OR . 1 1 23 23 ALA HA H . . . 1 1 24 24 GLY HA2 H . . . . . 4.0 1.8 6.0 . . . . . A . 23 ALA HA . . A . 24 GLY HA2 . . . 23 . HA . . . . . 24 . HA* . . rr_1r02 1
203 2 OR . 1 1 23 23 ALA HA H . . . 1 1 24 24 GLY HA3 H . . . . . 4.0 1.8 6.0 . . . . . A . 23 ALA HA . . A . 24 GLY HA3 . . . 23 . HA . . . . . 24 . HA* . . rr_1r02 1
stop_
loop_
_Gen_dist_constraint_parse_err.ID
_Gen_dist_constraint_parse_err.Content
_Gen_dist_constraint_parse_err.Begin_line
_Gen_dist_constraint_parse_err.Begin_column
_Gen_dist_constraint_parse_err.End_line
_Gen_dist_constraint_parse_err.End_column
_Gen_dist_constraint_parse_err.Entry_ID
_Gen_dist_constraint_parse_err.Gen_dist_constraint_list_ID
1 "assign (resid 25 and namd HA) (resid 28 and name HB*) 4.0 2.2 2.0" 173 1 173 68 rr_1r02 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 table
intra noe (Orexin A 5C H2O)
;
2 1 3 30 rr_1r02 1
2
;inter noe
NN noe
;
99 1 100 9 rr_1r02 1
3 BN(i,i+1) 149 1 149 11 rr_1r02 1
4 "sequetial (i-j=1)" 161 1 161 19 rr_1r02 1
5 AB(i,i+3) 167 1 167 11 rr_1r02 1
6 "a an assign" 175 1 175 15 rr_1r02 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 4 198 1 "Not handling restraint 198, item 1, resonance(s) ' .29.HA' (nmrStar names) not linked" rr_1r02 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_3
_Gen_dist_constraint_list.Entry_ID rr_1r02
_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_1r02 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 6 6 CYS O O . . . 1 1 10 10 LYS N N . . . . . 3.0 2.3 3.5 . . . . . A . 6 CYS O . . A . 10 LYS N . . . 6 . O . . . . . 10 . N . . rr_1r02 2
2 1 . . 1 1 13 13 SER O O . . . 1 1 17 17 TYR N N . . . . . 3.0 2.3 3.5 . . . . . A . 13 SER O . . A . 17 TYR N . . . 13 . O . . . . . 17 . N . . rr_1r02 2
3 1 . . 1 1 14 14 CYS O O . . . 1 1 18 18 GLU N N . . . . . 3.0 2.3 3.5 . . . . . A . 14 CYS O . . A . 18 GLU N . . . 14 . O . . . . . 18 . N . . rr_1r02 2
4 1 . . 1 1 15 15 ARG O O . . . 1 1 19 19 LEU N N . . . . . 3.0 2.3 3.5 . . . . . A . 15 ARG O . . A . 19 LEU N . . . 15 . O . . . . . 19 . N . . rr_1r02 2
5 1 . . 1 1 16 16 LEU O O . . . 1 1 20 20 LEU N N . . . . . 3.0 2.3 3.5 . . . . . A . 16 LEU O . . A . 20 LEU N . . . 16 . O . . . . . 20 . N . . rr_1r02 2
6 1 . . 1 1 17 17 TYR O O . . . 1 1 21 21 HIS N N . . . . . 3.0 2.3 3.5 . . . . . A . 17 TYR O . . A . 21 HIS N . . . 17 . O . . . . . 21 . N . . rr_1r02 2
7 1 . . 1 1 28 28 ALA O O . . . 1 1 32 32 THR N N . . . . . 3.0 2.3 3.5 . . . . . A . 28 ALA O . . A . 32 THR N . . . 28 . O . . . . . 32 . N . . rr_1r02 2
8 1 . . 1 1 10 10 LYS H H . . . 1 1 6 6 CYS O O . . . . . 2.0 1.3 2.5 . . . . . A . 6 CYS O . . A . 10 LYS H . . . 6 . O . . . . . 10 . HN . . rr_1r02 2
9 1 . . 1 1 17 17 TYR H H . . . 1 1 13 13 SER O O . . . . . 2.0 1.3 2.5 . . . . . A . 13 SER O . . A . 17 TYR H . . . 13 . O . . . . . 17 . HN . . rr_1r02 2
10 1 . . 1 1 18 18 GLU H H . . . 1 1 14 14 CYS O O . . . . . 2.0 1.3 2.5 . . . . . A . 14 CYS O . . A . 18 GLU H . . . 14 . O . . . . . 18 . HN . . rr_1r02 2
11 1 . . 1 1 19 19 LEU H H . . . 1 1 15 15 ARG O O . . . . . 2.0 1.3 2.5 . . . . . A . 15 ARG O . . A . 19 LEU H . . . 15 . O . . . . . 19 . HN . . rr_1r02 2
12 1 . . 1 1 20 20 LEU H H . . . 1 1 16 16 LEU O O . . . . . 2.0 1.3 2.5 . . . . . A . 16 LEU O . . A . 20 LEU H . . . 16 . O . . . . . 20 . HN . . rr_1r02 2
13 1 . . 1 1 21 21 HIS H H . . . 1 1 17 17 TYR O O . . . . . 2.0 1.3 2.5 . . . . . A . 17 TYR O . . A . 21 HIS H . . . 17 . O . . . . . 21 . HN . . rr_1r02 2
14 1 . . 1 1 32 32 THR H H . . . 1 1 28 28 ALA O O . . . . . 2.0 1.3 2.5 . . . . . A . 28 ALA O . . A . 32 THR H . . . 28 . O . . . . . 32 . HN . . rr_1r02 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 "H-bond constraint" 2 1 2 20 rr_1r02 2
stop_
save_
save_CNS/XPLOR_distance_constraints_4_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_4_1
_Distance_constraint_list.Entry_ID rr_1r02
_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_1r02 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 2 . OR rr_1r02 1
1 2 . 3 . rr_1r02 1
1 3 . . . rr_1r02 1
2 1 2 . OR rr_1r02 1
2 2 . 3 . rr_1r02 1
2 3 . 4 . rr_1r02 1
2 4 . 5 . rr_1r02 1
2 5 . . . rr_1r02 1
3 1 2 . OR rr_1r02 1
3 2 . 3 . rr_1r02 1
3 3 . 4 . rr_1r02 1
3 4 . 5 . rr_1r02 1
3 5 . . . rr_1r02 1
4 1 . . . rr_1r02 1
5 1 2 . OR rr_1r02 1
5 2 . 3 . rr_1r02 1
5 3 . . . rr_1r02 1
6 1 . . . rr_1r02 1
7 1 2 . OR rr_1r02 1
7 2 . 3 . rr_1r02 1
7 3 . . . rr_1r02 1
8 1 2 . OR rr_1r02 1
8 2 . 3 . rr_1r02 1
8 3 . . . rr_1r02 1
9 1 2 . OR rr_1r02 1
9 2 . 3 . rr_1r02 1
9 3 . 4 . rr_1r02 1
9 4 . 5 . rr_1r02 1
9 5 . . . rr_1r02 1
10 1 2 . OR rr_1r02 1
10 2 . 3 . rr_1r02 1
10 3 . 4 . rr_1r02 1
10 4 . 5 . rr_1r02 1
10 5 . . . rr_1r02 1
11 1 . . . rr_1r02 1
12 1 2 . OR rr_1r02 1
12 2 . 3 . rr_1r02 1
12 3 . . . rr_1r02 1
13 1 . . . rr_1r02 1
14 1 2 . OR rr_1r02 1
14 2 . 3 . rr_1r02 1
14 3 . . . rr_1r02 1
15 1 . . . rr_1r02 1
16 1 2 . OR rr_1r02 1
16 2 . 3 . rr_1r02 1
16 3 . . . rr_1r02 1
17 1 . . . rr_1r02 1
18 1 2 . OR rr_1r02 1
18 2 . 3 . rr_1r02 1
18 3 . . . rr_1r02 1
19 1 2 . OR rr_1r02 1
19 2 . 3 . rr_1r02 1
19 3 . . . rr_1r02 1
20 1 2 . OR rr_1r02 1
20 2 . 3 . rr_1r02 1
20 3 . . . rr_1r02 1
21 1 . . . rr_1r02 1
22 1 2 . OR rr_1r02 1
22 2 . 3 . rr_1r02 1
22 3 . . . rr_1r02 1
23 1 2 . OR rr_1r02 1
23 2 . 3 . rr_1r02 1
23 3 . . . rr_1r02 1
24 1 . . . rr_1r02 1
25 1 2 . OR rr_1r02 1
25 2 . 3 . rr_1r02 1
25 3 . . . rr_1r02 1
26 1 2 . OR rr_1r02 1
26 2 . 3 . rr_1r02 1
26 3 . . . rr_1r02 1
27 1 2 . OR rr_1r02 1
27 2 . 3 . rr_1r02 1
27 3 . . . rr_1r02 1
28 1 2 . OR rr_1r02 1
28 2 . 3 . rr_1r02 1
28 3 . . . rr_1r02 1
29 1 . . . rr_1r02 1
30 1 . . . rr_1r02 1
31 1 2 . OR rr_1r02 1
31 2 . 3 . rr_1r02 1
31 3 . . . rr_1r02 1
32 1 . . . rr_1r02 1
33 1 2 . OR rr_1r02 1
33 2 . 3 . rr_1r02 1
33 3 . . . rr_1r02 1
34 1 . . . rr_1r02 1
35 1 2 . OR rr_1r02 1
35 2 . 3 . rr_1r02 1
35 3 . . . rr_1r02 1
36 1 2 . OR rr_1r02 1
36 2 . 3 . rr_1r02 1
36 3 . . . rr_1r02 1
37 1 . . . rr_1r02 1
38 1 2 . OR rr_1r02 1
38 2 . 3 . rr_1r02 1
38 3 . . . rr_1r02 1
39 1 . . . rr_1r02 1
40 1 2 . OR rr_1r02 1
40 2 . 3 . rr_1r02 1
40 3 . . . rr_1r02 1
41 1 2 . OR rr_1r02 1
41 2 . 3 . rr_1r02 1
41 3 . . . rr_1r02 1
42 1 2 . OR rr_1r02 1
42 2 . 3 . rr_1r02 1
42 3 . . . rr_1r02 1
43 1 . . . rr_1r02 1
44 1 2 . OR rr_1r02 1
44 2 . 3 . rr_1r02 1
44 3 . . . rr_1r02 1
45 1 . . . rr_1r02 1
46 1 2 . OR rr_1r02 1
46 2 . 3 . rr_1r02 1
46 3 . . . rr_1r02 1
47 1 2 . OR rr_1r02 1
47 2 . 3 . rr_1r02 1
47 3 . . . rr_1r02 1
48 1 . . . rr_1r02 1
49 1 2 . OR rr_1r02 1
49 2 . 3 . rr_1r02 1
49 3 . . . rr_1r02 1
50 1 2 . OR rr_1r02 1
50 2 . 3 . rr_1r02 1
50 3 . . . rr_1r02 1
51 1 . . . rr_1r02 1
52 1 2 . OR rr_1r02 1
52 2 . 3 . rr_1r02 1
52 3 . . . rr_1r02 1
53 1 2 . OR rr_1r02 1
53 2 . 3 . rr_1r02 1
53 3 . . . rr_1r02 1
54 1 . . . rr_1r02 1
55 1 2 . OR rr_1r02 1
55 2 . 3 . rr_1r02 1
55 3 . . . rr_1r02 1
56 1 . . . rr_1r02 1
57 1 2 . OR rr_1r02 1
57 2 . 3 . rr_1r02 1
57 3 . . . rr_1r02 1
58 1 . . . rr_1r02 1
59 1 2 . OR rr_1r02 1
59 2 . 3 . rr_1r02 1
59 3 . . . rr_1r02 1
60 1 . . . rr_1r02 1
61 1 2 . OR rr_1r02 1
61 2 . 3 . rr_1r02 1
61 3 . . . rr_1r02 1
62 1 . . . rr_1r02 1
63 1 2 . OR rr_1r02 1
63 2 . 3 . rr_1r02 1
63 3 . . . rr_1r02 1
64 1 2 . OR rr_1r02 1
64 2 . 3 . rr_1r02 1
64 3 . . . rr_1r02 1
65 1 2 . OR rr_1r02 1
65 2 . 3 . rr_1r02 1
65 3 . . . rr_1r02 1
66 1 . . . rr_1r02 1
67 1 . . . rr_1r02 1
68 1 2 . OR rr_1r02 1
68 2 . 3 . rr_1r02 1
68 3 . . . rr_1r02 1
69 1 . . . rr_1r02 1
70 1 2 . OR rr_1r02 1
70 2 . 3 . rr_1r02 1
70 3 . . . rr_1r02 1
71 1 2 . OR rr_1r02 1
71 2 . 3 . rr_1r02 1
71 3 . . . rr_1r02 1
72 1 . . . rr_1r02 1
73 1 2 . OR rr_1r02 1
73 2 . 3 . rr_1r02 1
73 3 . . . rr_1r02 1
74 1 2 . OR rr_1r02 1
74 2 . 3 . rr_1r02 1
74 3 . . . rr_1r02 1
75 1 . . . rr_1r02 1
76 1 . . . rr_1r02 1
77 1 . . . rr_1r02 1
78 1 . . . rr_1r02 1
79 1 . . . rr_1r02 1
80 1 2 . OR rr_1r02 1
80 2 . 3 . rr_1r02 1
80 3 . . . rr_1r02 1
81 1 . . . rr_1r02 1
82 1 . . . rr_1r02 1
83 1 . . . rr_1r02 1
84 1 2 . OR rr_1r02 1
84 2 . 3 . rr_1r02 1
84 3 . . . rr_1r02 1
85 1 . . . rr_1r02 1
86 1 . . . rr_1r02 1
87 1 2 . OR rr_1r02 1
87 2 . 3 . rr_1r02 1
87 3 . . . rr_1r02 1
88 1 . . . rr_1r02 1
89 1 2 . OR rr_1r02 1
89 2 . 3 . rr_1r02 1
89 3 . . . rr_1r02 1
90 1 . . . rr_1r02 1
91 1 . . . rr_1r02 1
92 1 2 . OR rr_1r02 1
92 2 . 3 . rr_1r02 1
92 3 . . . rr_1r02 1
93 1 . . . rr_1r02 1
94 1 2 . OR rr_1r02 1
94 2 . 3 . rr_1r02 1
94 3 . . . rr_1r02 1
95 1 . . . rr_1r02 1
96 1 . . . rr_1r02 1
97 1 . . . rr_1r02 1
98 1 . . . rr_1r02 1
99 1 . . . rr_1r02 1
100 1 . . . rr_1r02 1
101 1 . . . rr_1r02 1
102 1 . . . rr_1r02 1
103 1 . . . rr_1r02 1
104 1 . . . rr_1r02 1
105 1 . . . rr_1r02 1
106 1 . . . rr_1r02 1
107 1 . . . rr_1r02 1
108 1 . . . rr_1r02 1
109 1 . . . rr_1r02 1
110 1 . . . rr_1r02 1
111 1 . . . rr_1r02 1
112 1 . . . rr_1r02 1
113 1 . . . rr_1r02 1
114 1 . . . rr_1r02 1
115 1 . . . rr_1r02 1
116 1 . . . rr_1r02 1
117 1 . . . rr_1r02 1
118 1 . . . rr_1r02 1
119 1 . . . rr_1r02 1
120 1 . . . rr_1r02 1
121 1 . . . rr_1r02 1
122 1 . . . rr_1r02 1
123 1 . . . rr_1r02 1
124 1 . . . rr_1r02 1
125 1 . . . rr_1r02 1
126 1 . . . rr_1r02 1
127 1 . . . rr_1r02 1
128 1 . . . rr_1r02 1
129 1 . . . rr_1r02 1
130 1 . . . rr_1r02 1
131 1 . . . rr_1r02 1
132 1 . . . rr_1r02 1
133 1 . . . rr_1r02 1
134 1 . . . rr_1r02 1
135 1 . . . rr_1r02 1
136 1 . . . rr_1r02 1
137 1 . . . rr_1r02 1
138 1 . . . rr_1r02 1
139 1 . . . rr_1r02 1
140 1 . . . rr_1r02 1
141 1 . . . rr_1r02 1
142 1 . . . rr_1r02 1
143 1 . . . rr_1r02 1
144 1 2 . OR rr_1r02 1
144 2 . 3 . rr_1r02 1
144 3 . . . rr_1r02 1
145 1 2 . OR rr_1r02 1
145 2 . 3 . rr_1r02 1
145 3 . . . rr_1r02 1
146 1 2 . OR rr_1r02 1
146 2 . 3 . rr_1r02 1
146 3 . . . rr_1r02 1
147 1 2 . OR rr_1r02 1
147 2 . 3 . rr_1r02 1
147 3 . . . rr_1r02 1
148 1 2 . OR rr_1r02 1
148 2 . 3 . rr_1r02 1
148 3 . . . rr_1r02 1
149 1 2 . OR rr_1r02 1
149 2 . 3 . rr_1r02 1
149 3 . . . rr_1r02 1
150 1 2 . OR rr_1r02 1
150 2 . 3 . rr_1r02 1
150 3 . . . rr_1r02 1
151 1 2 . OR rr_1r02 1
151 2 . 3 . rr_1r02 1
151 3 . . . rr_1r02 1
152 1 2 . OR rr_1r02 1
152 2 . 3 . rr_1r02 1
152 3 . . . rr_1r02 1
153 1 . . . rr_1r02 1
154 1 . . . rr_1r02 1
155 1 . . . rr_1r02 1
156 1 2 . OR rr_1r02 1
156 2 . 3 . rr_1r02 1
156 3 . . . rr_1r02 1
157 1 2 . OR rr_1r02 1
157 2 . 3 . rr_1r02 1
157 3 . . . rr_1r02 1
158 1 2 . OR rr_1r02 1
158 2 . 3 . rr_1r02 1
158 3 . . . rr_1r02 1
159 1 . . . rr_1r02 1
160 1 2 . OR rr_1r02 1
160 2 . 3 . rr_1r02 1
160 3 . . . rr_1r02 1
161 1 2 . OR rr_1r02 1
161 2 . 3 . rr_1r02 1
161 3 . . . rr_1r02 1
162 1 2 . OR rr_1r02 1
162 2 . 3 . rr_1r02 1
162 3 . . . rr_1r02 1
163 1 2 . OR rr_1r02 1
163 2 . 3 . rr_1r02 1
163 3 . . . rr_1r02 1
164 1 2 . OR rr_1r02 1
164 2 . 3 . rr_1r02 1
164 3 . . . rr_1r02 1
165 1 . . . rr_1r02 1
166 1 . . . rr_1r02 1
167 1 . . . rr_1r02 1
168 1 . . . rr_1r02 1
169 1 . . . rr_1r02 1
170 1 . . . rr_1r02 1
171 1 . . . rr_1r02 1
172 1 . . . rr_1r02 1
173 1 . . . rr_1r02 1
174 1 . . . rr_1r02 1
175 1 . . . rr_1r02 1
176 1 . . . rr_1r02 1
177 1 . . . rr_1r02 1
178 1 . . . rr_1r02 1
179 1 . . . rr_1r02 1
180 1 . . . rr_1r02 1
181 1 . . . rr_1r02 1
182 1 . . . rr_1r02 1
183 1 2 . OR rr_1r02 1
183 2 . 3 . rr_1r02 1
183 3 . . . rr_1r02 1
184 1 . . . rr_1r02 1
185 1 2 . OR rr_1r02 1
185 2 . 3 . rr_1r02 1
185 3 . . . rr_1r02 1
186 1 . . . rr_1r02 1
187 1 . . . rr_1r02 1
188 1 . . . rr_1r02 1
189 1 . . . rr_1r02 1
190 1 2 . OR rr_1r02 1
190 2 . 3 . rr_1r02 1
190 3 . . . rr_1r02 1
191 1 . . . rr_1r02 1
192 1 . . . rr_1r02 1
193 1 . . . rr_1r02 1
194 1 . . . rr_1r02 1
195 1 . . . rr_1r02 1
196 1 . . . rr_1r02 1
197 1 2 . OR rr_1r02 1
197 2 . 3 . rr_1r02 1
197 3 . . . rr_1r02 1
198 1 . . . rr_1r02 1
199 1 2 . OR rr_1r02 1
199 2 . 3 . rr_1r02 1
199 3 . . . rr_1r02 1
200 1 2 . OR rr_1r02 1
200 2 . 3 . rr_1r02 1
200 3 . . . rr_1r02 1
201 1 . . . rr_1r02 1
202 1 2 . OR rr_1r02 1
202 2 . 3 . rr_1r02 1
202 3 . . . rr_1r02 1
203 1 2 . OR rr_1r02 1
203 2 . 3 . rr_1r02 1
203 3 . . . rr_1r02 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 2 . 1 . 1 1 2 2 PRO HB2 H . . . . 2 . HB* rr_1r02 1
1 2 . 2 . 1 1 2 2 PRO HA H . . . . 2 . HA rr_1r02 1
1 3 . 1 . 1 1 2 2 PRO HB3 H . . . . 2 . HB* rr_1r02 1
1 3 . 2 . 1 1 2 2 PRO HA H . . . . 2 . HA rr_1r02 1
2 2 . 1 . 1 1 2 2 PRO HG2 H . . . . 2 . HG* rr_1r02 1
2 2 . 2 . 1 1 2 2 PRO HB2 H . . . . 2 . HB* rr_1r02 1
2 3 . 1 . 1 1 2 2 PRO HG2 H . . . . 2 . HG* rr_1r02 1
2 3 . 2 . 1 1 2 2 PRO HB3 H . . . . 2 . HB* rr_1r02 1
2 4 . 1 . 1 1 2 2 PRO HG3 H . . . . 2 . HG* rr_1r02 1
2 4 . 2 . 1 1 2 2 PRO HB2 H . . . . 2 . HB* rr_1r02 1
2 5 . 1 . 1 1 2 2 PRO HG3 H . . . . 2 . HG* rr_1r02 1
2 5 . 2 . 1 1 2 2 PRO HB3 H . . . . 2 . HB* rr_1r02 1
3 2 . 1 . 1 1 2 2 PRO HD2 H . . . . 2 . HD* rr_1r02 1
3 2 . 2 . 1 1 2 2 PRO HB2 H . . . . 2 . HB* rr_1r02 1
3 3 . 1 . 1 1 2 2 PRO HD2 H . . . . 2 . HD* rr_1r02 1
3 3 . 2 . 1 1 2 2 PRO HB3 H . . . . 2 . HB* rr_1r02 1
3 4 . 1 . 1 1 2 2 PRO HD3 H . . . . 2 . HD* rr_1r02 1
3 4 . 2 . 1 1 2 2 PRO HB2 H . . . . 2 . HB* rr_1r02 1
3 5 . 1 . 1 1 2 2 PRO HD3 H . . . . 2 . HD* rr_1r02 1
3 5 . 2 . 1 1 2 2 PRO HB3 H . . . . 2 . HB* rr_1r02 1
4 1 . 1 . 1 1 3 3 LEU HA H . . . . 3 . HA rr_1r02 1
4 1 . 2 . 1 1 3 3 LEU H H . . . . 3 . HN rr_1r02 1
5 2 . 1 . 1 1 3 3 LEU HB2 H . . . . 3 . HB* rr_1r02 1
5 2 . 2 . 1 1 3 3 LEU H H . . . . 3 . HN rr_1r02 1
5 3 . 1 . 1 1 3 3 LEU HB3 H . . . . 3 . HB* rr_1r02 1
5 3 . 2 . 1 1 3 3 LEU H H . . . . 3 . HN rr_1r02 1
6 1 . 1 . 1 1 3 3 LEU HG H . . . . 3 . HG rr_1r02 1
6 1 . 2 . 1 1 3 3 LEU H H . . . . 3 . HN rr_1r02 1
7 2 . 1 . 1 1 3 3 LEU MD1 H . . . . 3 . HD* rr_1r02 1
7 2 . 2 . 1 1 3 3 LEU H H . . . . 3 . HN rr_1r02 1
7 3 . 1 . 1 1 3 3 LEU MD2 H . . . . 3 . HD* rr_1r02 1
7 3 . 2 . 1 1 3 3 LEU H H . . . . 3 . HN rr_1r02 1
8 2 . 1 . 1 1 4 4 PRO HB2 H . . . . 4 . HB* rr_1r02 1
8 2 . 2 . 1 1 4 4 PRO HA H . . . . 4 . HA rr_1r02 1
8 3 . 1 . 1 1 4 4 PRO HB3 H . . . . 4 . HB* rr_1r02 1
8 3 . 2 . 1 1 4 4 PRO HA H . . . . 4 . HA rr_1r02 1
9 2 . 1 . 1 1 4 4 PRO HG2 H . . . . 4 . HG* rr_1r02 1
9 2 . 2 . 1 1 4 4 PRO HB2 H . . . . 4 . HB* rr_1r02 1
9 3 . 1 . 1 1 4 4 PRO HG2 H . . . . 4 . HG* rr_1r02 1
9 3 . 2 . 1 1 4 4 PRO HB3 H . . . . 4 . HB* rr_1r02 1
9 4 . 1 . 1 1 4 4 PRO HG3 H . . . . 4 . HG* rr_1r02 1
9 4 . 2 . 1 1 4 4 PRO HB2 H . . . . 4 . HB* rr_1r02 1
9 5 . 1 . 1 1 4 4 PRO HG3 H . . . . 4 . HG* rr_1r02 1
9 5 . 2 . 1 1 4 4 PRO HB3 H . . . . 4 . HB* rr_1r02 1
10 2 . 1 . 1 1 4 4 PRO HD2 H . . . . 4 . HD* rr_1r02 1
10 2 . 2 . 1 1 4 4 PRO HB2 H . . . . 4 . HB* rr_1r02 1
10 3 . 1 . 1 1 4 4 PRO HD2 H . . . . 4 . HD* rr_1r02 1
10 3 . 2 . 1 1 4 4 PRO HB3 H . . . . 4 . HB* rr_1r02 1
10 4 . 1 . 1 1 4 4 PRO HD3 H . . . . 4 . HD* rr_1r02 1
10 4 . 2 . 1 1 4 4 PRO HB2 H . . . . 4 . HB* rr_1r02 1
10 5 . 1 . 1 1 4 4 PRO HD3 H . . . . 4 . HD* rr_1r02 1
10 5 . 2 . 1 1 4 4 PRO HB3 H . . . . 4 . HB* rr_1r02 1
11 1 . 1 . 1 1 5 5 ASP HA H . . . . 5 . HA rr_1r02 1
11 1 . 2 . 1 1 5 5 ASP H H . . . . 5 . HN rr_1r02 1
12 2 . 1 . 1 1 5 5 ASP HB2 H . . . . 5 . HB* rr_1r02 1
12 2 . 2 . 1 1 5 5 ASP H H . . . . 5 . HN rr_1r02 1
12 3 . 1 . 1 1 5 5 ASP HB3 H . . . . 5 . HB* rr_1r02 1
12 3 . 2 . 1 1 5 5 ASP H H . . . . 5 . HN rr_1r02 1
13 1 . 1 . 1 1 6 6 CYS HA H . . . . 6 . HA rr_1r02 1
13 1 . 2 . 1 1 6 6 CYS H H . . . . 6 . HN rr_1r02 1
14 2 . 1 . 1 1 6 6 CYS HB2 H . . . . 6 . HB* rr_1r02 1
14 2 . 2 . 1 1 6 6 CYS H H . . . . 6 . HN rr_1r02 1
14 3 . 1 . 1 1 6 6 CYS HB3 H . . . . 6 . HB* rr_1r02 1
14 3 . 2 . 1 1 6 6 CYS H H . . . . 6 . HN rr_1r02 1
15 1 . 1 . 1 1 7 7 CYS HA H . . . . 7 . HA rr_1r02 1
15 1 . 2 . 1 1 7 7 CYS H H . . . . 7 . HN rr_1r02 1
16 2 . 1 . 1 1 7 7 CYS HB2 H . . . . 7 . HB* rr_1r02 1
16 2 . 2 . 1 1 7 7 CYS H H . . . . 7 . HN rr_1r02 1
16 3 . 1 . 1 1 7 7 CYS HB3 H . . . . 7 . HB* rr_1r02 1
16 3 . 2 . 1 1 7 7 CYS H H . . . . 7 . HN rr_1r02 1
17 1 . 1 . 1 1 8 8 ARG HA H . . . . 8 . HA rr_1r02 1
17 1 . 2 . 1 1 8 8 ARG H H . . . . 8 . HN rr_1r02 1
18 2 . 1 . 1 1 8 8 ARG HB2 H . . . . 8 . HB* rr_1r02 1
18 2 . 2 . 1 1 8 8 ARG H H . . . . 8 . HN rr_1r02 1
18 3 . 1 . 1 1 8 8 ARG HB3 H . . . . 8 . HB* rr_1r02 1
18 3 . 2 . 1 1 8 8 ARG H H . . . . 8 . HN rr_1r02 1
19 2 . 1 . 1 1 8 8 ARG HG2 H . . . . 8 . HG* rr_1r02 1
19 2 . 2 . 1 1 8 8 ARG H H . . . . 8 . HN rr_1r02 1
19 3 . 1 . 1 1 8 8 ARG HG3 H . . . . 8 . HG* rr_1r02 1
19 3 . 2 . 1 1 8 8 ARG H H . . . . 8 . HN rr_1r02 1
20 2 . 1 . 1 1 8 8 ARG HD2 H . . . . 8 . HD* rr_1r02 1
20 2 . 2 . 1 1 8 8 ARG H H . . . . 8 . HN rr_1r02 1
20 3 . 1 . 1 1 8 8 ARG HD3 H . . . . 8 . HD* rr_1r02 1
20 3 . 2 . 1 1 8 8 ARG H H . . . . 8 . HN rr_1r02 1
21 1 . 1 . 1 1 9 9 GLN HA H . . . . 9 . HA rr_1r02 1
21 1 . 2 . 1 1 9 9 GLN H H . . . . 9 . HN rr_1r02 1
22 2 . 1 . 1 1 9 9 GLN HB2 H . . . . 9 . HB* rr_1r02 1
22 2 . 2 . 1 1 9 9 GLN H H . . . . 9 . HN rr_1r02 1
22 3 . 1 . 1 1 9 9 GLN HB3 H . . . . 9 . HB* rr_1r02 1
22 3 . 2 . 1 1 9 9 GLN H H . . . . 9 . HN rr_1r02 1
23 2 . 1 . 1 1 9 9 GLN HG2 H . . . . 9 . HG* rr_1r02 1
23 2 . 2 . 1 1 9 9 GLN H H . . . . 9 . HN rr_1r02 1
23 3 . 1 . 1 1 9 9 GLN HG3 H . . . . 9 . HG* rr_1r02 1
23 3 . 2 . 1 1 9 9 GLN H H . . . . 9 . HN rr_1r02 1
24 1 . 1 . 1 1 10 10 LYS HA H . . . . 10 . HA rr_1r02 1
24 1 . 2 . 1 1 10 10 LYS H H . . . . 10 . HN rr_1r02 1
25 2 . 1 . 1 1 10 10 LYS HA H . . . . 10 . HA rr_1r02 1
25 2 . 2 . 1 1 10 10 LYS HB2 H . . . . 10 . HB* rr_1r02 1
25 3 . 1 . 1 1 10 10 LYS HA H . . . . 10 . HA rr_1r02 1
25 3 . 2 . 1 1 10 10 LYS HB3 H . . . . 10 . HB* rr_1r02 1
26 2 . 1 . 1 1 10 10 LYS HB2 H . . . . 10 . HB* rr_1r02 1
26 2 . 2 . 1 1 10 10 LYS H H . . . . 10 . HN rr_1r02 1
26 3 . 1 . 1 1 10 10 LYS HB3 H . . . . 10 . HB* rr_1r02 1
26 3 . 2 . 1 1 10 10 LYS H H . . . . 10 . HN rr_1r02 1
27 2 . 1 . 1 1 10 10 LYS HG2 H . . . . 10 . HG* rr_1r02 1
27 2 . 2 . 1 1 10 10 LYS H H . . . . 10 . HN rr_1r02 1
27 3 . 1 . 1 1 10 10 LYS HG3 H . . . . 10 . HG* rr_1r02 1
27 3 . 2 . 1 1 10 10 LYS H H . . . . 10 . HN rr_1r02 1
28 2 . 1 . 1 1 10 10 LYS HD2 H . . . . 10 . HD* rr_1r02 1
28 2 . 2 . 1 1 10 10 LYS H H . . . . 10 . HN rr_1r02 1
28 3 . 1 . 1 1 10 10 LYS HD3 H . . . . 10 . HD* rr_1r02 1
28 3 . 2 . 1 1 10 10 LYS H H . . . . 10 . HN rr_1r02 1
29 1 . 1 . 1 1 11 11 THR HA H . . . . 11 . HA rr_1r02 1
29 1 . 2 . 1 1 11 11 THR H H . . . . 11 . HN rr_1r02 1
30 1 . 1 . 1 1 11 11 THR HB H . . . . 11 . HB rr_1r02 1
30 1 . 2 . 1 1 11 11 THR H H . . . . 11 . HN rr_1r02 1
31 2 . 1 . 1 1 11 11 THR MG H . . . . 11 . HG* rr_1r02 1
31 2 . 2 . 1 1 11 11 THR H H . . . . 11 . HN rr_1r02 1
31 3 . 1 . 1 1 11 11 THR HG1 H . . . . 11 . HG* rr_1r02 1
31 3 . 2 . 1 1 11 11 THR H H . . . . 11 . HN rr_1r02 1
32 1 . 1 . 1 1 12 12 CYS HA H . . . . 12 . HA rr_1r02 1
32 1 . 2 . 1 1 12 12 CYS H H . . . . 12 . HN rr_1r02 1
33 2 . 1 . 1 1 12 12 CYS HB2 H . . . . 12 . HB* rr_1r02 1
33 2 . 2 . 1 1 12 12 CYS H H . . . . 12 . HN rr_1r02 1
33 3 . 1 . 1 1 12 12 CYS HB3 H . . . . 12 . HB* rr_1r02 1
33 3 . 2 . 1 1 12 12 CYS H H . . . . 12 . HN rr_1r02 1
34 1 . 1 . 1 1 13 13 SER HA H . . . . 13 . HA rr_1r02 1
34 1 . 2 . 1 1 13 13 SER H H . . . . 13 . HN rr_1r02 1
35 2 . 1 . 1 1 13 13 SER HB2 H . . . . 13 . HB* rr_1r02 1
35 2 . 2 . 1 1 13 13 SER H H . . . . 13 . HN rr_1r02 1
35 3 . 1 . 1 1 13 13 SER HB3 H . . . . 13 . HB* rr_1r02 1
35 3 . 2 . 1 1 13 13 SER H H . . . . 13 . HN rr_1r02 1
36 2 . 1 . 1 1 13 13 SER HA H . . . . 13 . HA rr_1r02 1
36 2 . 2 . 1 1 13 13 SER HB2 H . . . . 13 . HB* rr_1r02 1
36 3 . 1 . 1 1 13 13 SER HA H . . . . 13 . HA rr_1r02 1
36 3 . 2 . 1 1 13 13 SER HB3 H . . . . 13 . HB* rr_1r02 1
37 1 . 1 . 1 1 14 14 CYS HA H . . . . 14 . HA rr_1r02 1
37 1 . 2 . 1 1 14 14 CYS H H . . . . 14 . HN rr_1r02 1
38 2 . 1 . 1 1 14 14 CYS HB2 H . . . . 14 . HB* rr_1r02 1
38 2 . 2 . 1 1 14 14 CYS H H . . . . 14 . HN rr_1r02 1
38 3 . 1 . 1 1 14 14 CYS HB3 H . . . . 14 . HB* rr_1r02 1
38 3 . 2 . 1 1 14 14 CYS H H . . . . 14 . HN rr_1r02 1
39 1 . 1 . 1 1 15 15 ARG HA H . . . . 15 . HA rr_1r02 1
39 1 . 2 . 1 1 15 15 ARG H H . . . . 15 . HN rr_1r02 1
40 2 . 1 . 1 1 15 15 ARG HB2 H . . . . 15 . HB* rr_1r02 1
40 2 . 2 . 1 1 15 15 ARG H H . . . . 15 . HN rr_1r02 1
40 3 . 1 . 1 1 15 15 ARG HB3 H . . . . 15 . HB* rr_1r02 1
40 3 . 2 . 1 1 15 15 ARG H H . . . . 15 . HN rr_1r02 1
41 2 . 1 . 1 1 15 15 ARG HG2 H . . . . 15 . HG* rr_1r02 1
41 2 . 2 . 1 1 15 15 ARG H H . . . . 15 . HN rr_1r02 1
41 3 . 1 . 1 1 15 15 ARG HG3 H . . . . 15 . HG* rr_1r02 1
41 3 . 2 . 1 1 15 15 ARG H H . . . . 15 . HN rr_1r02 1
42 2 . 1 . 1 1 15 15 ARG HD2 H . . . . 15 . HD* rr_1r02 1
42 2 . 2 . 1 1 15 15 ARG H H . . . . 15 . HN rr_1r02 1
42 3 . 1 . 1 1 15 15 ARG HD3 H . . . . 15 . HD* rr_1r02 1
42 3 . 2 . 1 1 15 15 ARG H H . . . . 15 . HN rr_1r02 1
43 1 . 1 . 1 1 16 16 LEU HA H . . . . 16 . HA rr_1r02 1
43 1 . 2 . 1 1 16 16 LEU H H . . . . 16 . HN rr_1r02 1
44 2 . 1 . 1 1 16 16 LEU HB2 H . . . . 16 . HB* rr_1r02 1
44 2 . 2 . 1 1 16 16 LEU H H . . . . 16 . HN rr_1r02 1
44 3 . 1 . 1 1 16 16 LEU HB3 H . . . . 16 . HB* rr_1r02 1
44 3 . 2 . 1 1 16 16 LEU H H . . . . 16 . HN rr_1r02 1
45 1 . 1 . 1 1 16 16 LEU HG H . . . . 16 . HG* rr_1r02 1
45 1 . 2 . 1 1 16 16 LEU H H . . . . 16 . HN rr_1r02 1
46 2 . 1 . 1 1 16 16 LEU MD1 H . . . . 16 . HD* rr_1r02 1
46 2 . 2 . 1 1 16 16 LEU H H . . . . 16 . HN rr_1r02 1
46 3 . 1 . 1 1 16 16 LEU MD2 H . . . . 16 . HD* rr_1r02 1
46 3 . 2 . 1 1 16 16 LEU H H . . . . 16 . HN rr_1r02 1
47 2 . 1 . 1 1 16 16 LEU HA H . . . . 16 . HA rr_1r02 1
47 2 . 2 . 1 1 16 16 LEU HB2 H . . . . 16 . HB* rr_1r02 1
47 3 . 1 . 1 1 16 16 LEU HA H . . . . 16 . HA rr_1r02 1
47 3 . 2 . 1 1 16 16 LEU HB3 H . . . . 16 . HB* rr_1r02 1
48 1 . 1 . 1 1 17 17 TYR HA H . . . . 17 . HA rr_1r02 1
48 1 . 2 . 1 1 17 17 TYR H H . . . . 17 . HN rr_1r02 1
49 2 . 1 . 1 1 17 17 TYR HB2 H . . . . 17 . HB* rr_1r02 1
49 2 . 2 . 1 1 17 17 TYR H H . . . . 17 . HN rr_1r02 1
49 3 . 1 . 1 1 17 17 TYR HB3 H . . . . 17 . HB* rr_1r02 1
49 3 . 2 . 1 1 17 17 TYR H H . . . . 17 . HN rr_1r02 1
50 2 . 1 . 1 1 17 17 TYR HA H . . . . 17 . HA rr_1r02 1
50 2 . 2 . 1 1 17 17 TYR HB2 H . . . . 17 . HB* rr_1r02 1
50 3 . 1 . 1 1 17 17 TYR HA H . . . . 17 . HA rr_1r02 1
50 3 . 2 . 1 1 17 17 TYR HB3 H . . . . 17 . HB* rr_1r02 1
51 1 . 1 . 1 1 18 18 GLU HA H . . . . 18 . HA rr_1r02 1
51 1 . 2 . 1 1 18 18 GLU H H . . . . 18 . HN rr_1r02 1
52 2 . 1 . 1 1 18 18 GLU HB2 H . . . . 18 . HB* rr_1r02 1
52 2 . 2 . 1 1 18 18 GLU H H . . . . 18 . HN rr_1r02 1
52 3 . 1 . 1 1 18 18 GLU HB3 H . . . . 18 . HB* rr_1r02 1
52 3 . 2 . 1 1 18 18 GLU H H . . . . 18 . HN rr_1r02 1
53 2 . 1 . 1 1 18 18 GLU HG2 H . . . . 18 . HG* rr_1r02 1
53 2 . 2 . 1 1 18 18 GLU H H . . . . 18 . HN rr_1r02 1
53 3 . 1 . 1 1 18 18 GLU HG3 H . . . . 18 . HG* rr_1r02 1
53 3 . 2 . 1 1 18 18 GLU H H . . . . 18 . HN rr_1r02 1
54 1 . 1 . 1 1 19 19 LEU HA H . . . . 19 . HA rr_1r02 1
54 1 . 2 . 1 1 19 19 LEU H H . . . . 19 . HN rr_1r02 1
55 2 . 1 . 1 1 19 19 LEU HB2 H . . . . 19 . HB* rr_1r02 1
55 2 . 2 . 1 1 19 19 LEU H H . . . . 19 . HN rr_1r02 1
55 3 . 1 . 1 1 19 19 LEU HB3 H . . . . 19 . HB* rr_1r02 1
55 3 . 2 . 1 1 19 19 LEU H H . . . . 19 . HN rr_1r02 1
56 1 . 1 . 1 1 19 19 LEU HG H . . . . 19 . HG rr_1r02 1
56 1 . 2 . 1 1 19 19 LEU H H . . . . 19 . HN rr_1r02 1
57 2 . 1 . 1 1 19 19 LEU MD1 H . . . . 19 . HD* rr_1r02 1
57 2 . 2 . 1 1 19 19 LEU H H . . . . 19 . HN rr_1r02 1
57 3 . 1 . 1 1 19 19 LEU MD2 H . . . . 19 . HD* rr_1r02 1
57 3 . 2 . 1 1 19 19 LEU H H . . . . 19 . HN rr_1r02 1
58 1 . 1 . 1 1 20 20 LEU HA H . . . . 20 . HA rr_1r02 1
58 1 . 2 . 1 1 20 20 LEU H H . . . . 20 . HN rr_1r02 1
59 2 . 1 . 1 1 20 20 LEU HB2 H . . . . 20 . HB* rr_1r02 1
59 2 . 2 . 1 1 20 20 LEU H H . . . . 20 . HN rr_1r02 1
59 3 . 1 . 1 1 20 20 LEU HB3 H . . . . 20 . HB* rr_1r02 1
59 3 . 2 . 1 1 20 20 LEU H H . . . . 20 . HN rr_1r02 1
60 1 . 1 . 1 1 20 20 LEU HG H . . . . 20 . HG rr_1r02 1
60 1 . 2 . 1 1 20 20 LEU H H . . . . 20 . HN rr_1r02 1
61 2 . 1 . 1 1 20 20 LEU MD1 H . . . . 20 . HD* rr_1r02 1
61 2 . 2 . 1 1 20 20 LEU H H . . . . 20 . HN rr_1r02 1
61 3 . 1 . 1 1 20 20 LEU MD2 H . . . . 20 . HD* rr_1r02 1
61 3 . 2 . 1 1 20 20 LEU H H . . . . 20 . HN rr_1r02 1
62 1 . 1 . 1 1 21 21 HIS HA H . . . . 21 . HA rr_1r02 1
62 1 . 2 . 1 1 21 21 HIS H H . . . . 21 . HN rr_1r02 1
63 2 . 1 . 1 1 21 21 HIS HB2 H . . . . 21 . HB* rr_1r02 1
63 2 . 2 . 1 1 21 21 HIS H H . . . . 21 . HN rr_1r02 1
63 3 . 1 . 1 1 21 21 HIS HB3 H . . . . 21 . HB* rr_1r02 1
63 3 . 2 . 1 1 21 21 HIS H H . . . . 21 . HN rr_1r02 1
64 2 . 1 . 1 1 21 21 HIS HA H . . . . 21 . HA rr_1r02 1
64 2 . 2 . 1 1 21 21 HIS HB2 H . . . . 21 . HB* rr_1r02 1
64 3 . 1 . 1 1 21 21 HIS HA H . . . . 21 . HA rr_1r02 1
64 3 . 2 . 1 1 21 21 HIS HB3 H . . . . 21 . HB* rr_1r02 1
65 2 . 1 . 1 1 22 22 GLY HA2 H . . . . 22 . HA* rr_1r02 1
65 2 . 2 . 1 1 22 22 GLY H H . . . . 22 . HN rr_1r02 1
65 3 . 1 . 1 1 22 22 GLY HA3 H . . . . 22 . HA* rr_1r02 1
65 3 . 2 . 1 1 22 22 GLY H H . . . . 22 . HN rr_1r02 1
66 1 . 1 . 1 1 23 23 ALA HA H . . . . 23 . HA rr_1r02 1
66 1 . 2 . 1 1 23 23 ALA H H . . . . 23 . HN rr_1r02 1
67 1 . 1 . 1 1 23 23 ALA MB H . . . . 23 . HB* rr_1r02 1
67 1 . 2 . 1 1 23 23 ALA H H . . . . 23 . HN rr_1r02 1
68 2 . 1 . 1 1 24 24 GLY HA2 H . . . . 24 . HA* rr_1r02 1
68 2 . 2 . 1 1 24 24 GLY H H . . . . 24 . HN rr_1r02 1
68 3 . 1 . 1 1 24 24 GLY HA3 H . . . . 24 . HA* rr_1r02 1
68 3 . 2 . 1 1 24 24 GLY H H . . . . 24 . HN rr_1r02 1
69 1 . 1 . 1 1 25 25 ASN HA H . . . . 25 . HA rr_1r02 1
69 1 . 2 . 1 1 25 25 ASN H H . . . . 25 . HN rr_1r02 1
70 2 . 1 . 1 1 25 25 ASN HB2 H . . . . 25 . HB* rr_1r02 1
70 2 . 2 . 1 1 25 25 ASN H H . . . . 25 . HN rr_1r02 1
70 3 . 1 . 1 1 25 25 ASN HB3 H . . . . 25 . HB* rr_1r02 1
70 3 . 2 . 1 1 25 25 ASN H H . . . . 25 . HN rr_1r02 1
71 2 . 1 . 1 1 25 25 ASN HA H . . . . 25 . HA rr_1r02 1
71 2 . 2 . 1 1 25 25 ASN HB2 H . . . . 25 . HB* rr_1r02 1
71 3 . 1 . 1 1 25 25 ASN HA H . . . . 25 . HA rr_1r02 1
71 3 . 2 . 1 1 25 25 ASN HB3 H . . . . 25 . HB* rr_1r02 1
72 1 . 1 . 1 1 26 26 HIS HA H . . . . 26 . HA rr_1r02 1
72 1 . 2 . 1 1 26 26 HIS H H . . . . 26 . HN rr_1r02 1
73 2 . 1 . 1 1 26 26 HIS HB2 H . . . . 26 . HB* rr_1r02 1
73 2 . 2 . 1 1 26 26 HIS H H . . . . 26 . HN rr_1r02 1
73 3 . 1 . 1 1 26 26 HIS HB3 H . . . . 26 . HB* rr_1r02 1
73 3 . 2 . 1 1 26 26 HIS H H . . . . 26 . HN rr_1r02 1
74 2 . 1 . 1 1 26 26 HIS HA H . . . . 26 . HA rr_1r02 1
74 2 . 2 . 1 1 26 26 HIS HB2 H . . . . 26 . HB* rr_1r02 1
74 3 . 1 . 1 1 26 26 HIS HA H . . . . 26 . HA rr_1r02 1
74 3 . 2 . 1 1 26 26 HIS HB3 H . . . . 26 . HB* rr_1r02 1
75 1 . 1 . 1 1 27 27 ALA HA H . . . . 27 . HA rr_1r02 1
75 1 . 2 . 1 1 27 27 ALA H H . . . . 27 . HN rr_1r02 1
76 1 . 1 . 1 1 27 27 ALA MB H . . . . 27 . HB* rr_1r02 1
76 1 . 2 . 1 1 27 27 ALA H H . . . . 27 . HN rr_1r02 1
77 1 . 1 . 1 1 28 28 ALA HA H . . . . 28 . HA rr_1r02 1
77 1 . 2 . 1 1 28 28 ALA H H . . . . 28 . HN rr_1r02 1
78 1 . 1 . 1 1 28 28 ALA MB H . . . . 28 . HB* rr_1r02 1
78 1 . 2 . 1 1 28 28 ALA H H . . . . 28 . HN rr_1r02 1
79 1 . 1 . 1 1 28 28 ALA HA H . . . . 28 . HA rr_1r02 1
79 1 . 2 . 1 1 28 28 ALA MB H . . . . 28 . HB* rr_1r02 1
80 2 . 1 . 1 1 29 29 GLY HA2 H . . . . 29 . HA* rr_1r02 1
80 2 . 2 . 1 1 29 29 GLY H H . . . . 29 . HN rr_1r02 1
80 3 . 1 . 1 1 29 29 GLY HA3 H . . . . 29 . HA* rr_1r02 1
80 3 . 2 . 1 1 29 29 GLY H H . . . . 29 . HN rr_1r02 1
81 1 . 1 . 1 1 30 30 ILE HA H . . . . 30 . HA rr_1r02 1
81 1 . 2 . 1 1 30 30 ILE H H . . . . 30 . HN rr_1r02 1
82 1 . 1 . 1 1 30 30 ILE HB H . . . . 30 . HB rr_1r02 1
82 1 . 2 . 1 1 30 30 ILE H H . . . . 30 . HN rr_1r02 1
83 1 . 1 . 1 1 30 30 ILE MG H . . . . 30 . HG2* rr_1r02 1
83 1 . 2 . 1 1 30 30 ILE H H . . . . 30 . HN rr_1r02 1
84 2 . 1 . 1 1 30 30 ILE HG12 H . . . . 30 . HG1* rr_1r02 1
84 2 . 2 . 1 1 30 30 ILE H H . . . . 30 . HN rr_1r02 1
84 3 . 1 . 1 1 30 30 ILE HG13 H . . . . 30 . HG1* rr_1r02 1
84 3 . 2 . 1 1 30 30 ILE H H . . . . 30 . HN rr_1r02 1
85 1 . 1 . 1 1 30 30 ILE MD H . . . . 30 . HD* rr_1r02 1
85 1 . 2 . 1 1 30 30 ILE H H . . . . 30 . HN rr_1r02 1
86 1 . 1 . 1 1 31 31 LEU HA H . . . . 31 . HA rr_1r02 1
86 1 . 2 . 1 1 31 31 LEU H H . . . . 31 . HN rr_1r02 1
87 2 . 1 . 1 1 31 31 LEU HB2 H . . . . 31 . HB* rr_1r02 1
87 2 . 2 . 1 1 31 31 LEU H H . . . . 31 . HN rr_1r02 1
87 3 . 1 . 1 1 31 31 LEU HB3 H . . . . 31 . HB* rr_1r02 1
87 3 . 2 . 1 1 31 31 LEU H H . . . . 31 . HN rr_1r02 1
88 1 . 1 . 1 1 31 31 LEU HG H . . . . 31 . HG* rr_1r02 1
88 1 . 2 . 1 1 31 31 LEU H H . . . . 31 . HN rr_1r02 1
89 2 . 1 . 1 1 31 31 LEU MD1 H . . . . 31 . HD* rr_1r02 1
89 2 . 2 . 1 1 31 31 LEU H H . . . . 31 . HN rr_1r02 1
89 3 . 1 . 1 1 31 31 LEU MD2 H . . . . 31 . HD* rr_1r02 1
89 3 . 2 . 1 1 31 31 LEU H H . . . . 31 . HN rr_1r02 1
90 1 . 1 . 1 1 32 32 THR HA H . . . . 32 . HA rr_1r02 1
90 1 . 2 . 1 1 32 32 THR H H . . . . 32 . HN rr_1r02 1
91 1 . 1 . 1 1 32 32 THR HB H . . . . 32 . HB rr_1r02 1
91 1 . 2 . 1 1 32 32 THR H H . . . . 32 . HN rr_1r02 1
92 2 . 1 . 1 1 32 32 THR MG H . . . . 32 . HG* rr_1r02 1
92 2 . 2 . 1 1 32 32 THR H H . . . . 32 . HN rr_1r02 1
92 3 . 1 . 1 1 32 32 THR HG1 H . . . . 32 . HG* rr_1r02 1
92 3 . 2 . 1 1 32 32 THR H H . . . . 32 . HN rr_1r02 1
93 1 . 1 . 1 1 33 33 LEU HA H . . . . 33 . HA rr_1r02 1
93 1 . 2 . 1 1 33 33 LEU H H . . . . 33 . HN rr_1r02 1
94 2 . 1 . 1 1 33 33 LEU HB2 H . . . . 33 . HB* rr_1r02 1
94 2 . 2 . 1 1 33 33 LEU H H . . . . 33 . HN rr_1r02 1
94 3 . 1 . 1 1 33 33 LEU HB3 H . . . . 33 . HB* rr_1r02 1
94 3 . 2 . 1 1 33 33 LEU H H . . . . 33 . HN rr_1r02 1
95 1 . 1 . 1 1 33 33 LEU HG H . . . . 33 . HG* rr_1r02 1
95 1 . 2 . 1 1 33 33 LEU H H . . . . 33 . HN rr_1r02 1
96 1 . 1 . 1 1 5 5 ASP H H . . . . 5 . HN rr_1r02 1
96 1 . 2 . 1 1 6 6 CYS H H . . . . 6 . HN rr_1r02 1
97 1 . 1 . 1 1 6 6 CYS H H . . . . 6 . HN rr_1r02 1
97 1 . 2 . 1 1 7 7 CYS H H . . . . 7 . HN rr_1r02 1
98 1 . 1 . 1 1 8 8 ARG H H . . . . 8 . HN rr_1r02 1
98 1 . 2 . 1 1 9 9 GLN H H . . . . 9 . HN rr_1r02 1
99 1 . 1 . 1 1 9 9 GLN H H . . . . 9 . HN rr_1r02 1
99 1 . 2 . 1 1 10 10 LYS H H . . . . 10 . HN rr_1r02 1
100 1 . 1 . 1 1 10 10 LYS H H . . . . 10 . HN rr_1r02 1
100 1 . 2 . 1 1 11 11 THR H H . . . . 11 . HN rr_1r02 1
101 1 . 1 . 1 1 11 11 THR H H . . . . 11 . HN rr_1r02 1
101 1 . 2 . 1 1 12 12 CYS H H . . . . 12 . HN rr_1r02 1
102 1 . 1 . 1 1 12 12 CYS H H . . . . 12 . HN rr_1r02 1
102 1 . 2 . 1 1 13 13 SER H H . . . . 13 . HN rr_1r02 1
103 1 . 1 . 1 1 13 13 SER H H . . . . 13 . HN rr_1r02 1
103 1 . 2 . 1 1 14 14 CYS H H . . . . 14 . HN rr_1r02 1
104 1 . 1 . 1 1 14 14 CYS H H . . . . 14 . HN rr_1r02 1
104 1 . 2 . 1 1 15 15 ARG H H . . . . 15 . HN rr_1r02 1
105 1 . 1 . 1 1 15 15 ARG H H . . . . 15 . HN rr_1r02 1
105 1 . 2 . 1 1 16 16 LEU H H . . . . 16 . HN rr_1r02 1
106 1 . 1 . 1 1 16 16 LEU H H . . . . 16 . HN rr_1r02 1
106 1 . 2 . 1 1 17 17 TYR H H . . . . 17 . HN rr_1r02 1
107 1 . 1 . 1 1 17 17 TYR H H . . . . 17 . HN rr_1r02 1
107 1 . 2 . 1 1 18 18 GLU H H . . . . 18 . HN rr_1r02 1
108 1 . 1 . 1 1 18 18 GLU H H . . . . 18 . HN rr_1r02 1
108 1 . 2 . 1 1 19 19 LEU H H . . . . 19 . HN rr_1r02 1
109 1 . 1 . 1 1 19 19 LEU H H . . . . 19 . HN rr_1r02 1
109 1 . 2 . 1 1 20 20 LEU H H . . . . 20 . HN rr_1r02 1
110 1 . 1 . 1 1 20 20 LEU H H . . . . 20 . HN rr_1r02 1
110 1 . 2 . 1 1 21 21 HIS H H . . . . 21 . HN rr_1r02 1
111 1 . 1 . 1 1 21 21 HIS H H . . . . 21 . HN rr_1r02 1
111 1 . 2 . 1 1 22 22 GLY H H . . . . 22 . HN rr_1r02 1
112 1 . 1 . 1 1 23 23 ALA H H . . . . 23 . HN rr_1r02 1
112 1 . 2 . 1 1 24 24 GLY H H . . . . 24 . HN rr_1r02 1
113 1 . 1 . 1 1 24 24 GLY H H . . . . 24 . HN rr_1r02 1
113 1 . 2 . 1 1 25 25 ASN H H . . . . 25 . HN rr_1r02 1
114 1 . 1 . 1 1 25 25 ASN H H . . . . 25 . HN rr_1r02 1
114 1 . 2 . 1 1 26 26 HIS H H . . . . 26 . HN rr_1r02 1
115 1 . 1 . 1 1 26 26 HIS H H . . . . 26 . HN rr_1r02 1
115 1 . 2 . 1 1 27 27 ALA H H . . . . 27 . HN rr_1r02 1
116 1 . 1 . 1 1 27 27 ALA H H . . . . 27 . HN rr_1r02 1
116 1 . 2 . 1 1 28 28 ALA H H . . . . 28 . HN rr_1r02 1
117 1 . 1 . 1 1 28 28 ALA H H . . . . 28 . HN rr_1r02 1
117 1 . 2 . 1 1 29 29 GLY H H . . . . 29 . HN rr_1r02 1
118 1 . 1 . 1 1 29 29 GLY H H . . . . 29 . HN rr_1r02 1
118 1 . 2 . 1 1 30 30 ILE H H . . . . 30 . HN rr_1r02 1
119 1 . 1 . 1 1 31 31 LEU H H . . . . 31 . HN rr_1r02 1
119 1 . 2 . 1 1 32 32 THR H H . . . . 32 . HN rr_1r02 1
120 1 . 1 . 1 1 32 32 THR H H . . . . 32 . HN rr_1r02 1
120 1 . 2 . 1 1 33 33 LEU H H . . . . 33 . HN rr_1r02 1
121 1 . 1 . 1 1 6 6 CYS H H . . . . 6 . HN rr_1r02 1
121 1 . 2 . 1 1 8 8 ARG H H . . . . 8 . HN rr_1r02 1
122 1 . 1 . 1 1 6 6 CYS H H . . . . 6 . HN rr_1r02 1
122 1 . 2 . 1 1 11 11 THR H H . . . . 11 . HN rr_1r02 1
123 1 . 1 . 1 1 10 10 LYS H H . . . . 10 . HN rr_1r02 1
123 1 . 2 . 1 1 12 12 CYS H H . . . . 12 . HN rr_1r02 1
124 1 . 1 . 1 1 11 11 THR H H . . . . 11 . HN rr_1r02 1
124 1 . 2 . 1 1 13 13 SER H H . . . . 13 . HN rr_1r02 1
125 1 . 1 . 1 1 14 14 CYS H H . . . . 14 . HN rr_1r02 1
125 1 . 2 . 1 1 16 16 LEU H H . . . . 16 . HN rr_1r02 1
126 1 . 1 . 1 1 16 16 LEU H H . . . . 16 . HN rr_1r02 1
126 1 . 2 . 1 1 18 18 GLU H H . . . . 18 . HN rr_1r02 1
127 1 . 1 . 1 1 15 15 ARG H H . . . . 15 . HN rr_1r02 1
127 1 . 2 . 1 1 17 17 TYR H H . . . . 17 . HN rr_1r02 1
128 1 . 1 . 1 1 17 17 TYR H H . . . . 17 . HN rr_1r02 1
128 1 . 2 . 1 1 19 19 LEU H H . . . . 19 . HN rr_1r02 1
129 1 . 1 . 1 1 18 18 GLU H H . . . . 18 . HN rr_1r02 1
129 1 . 2 . 1 1 20 20 LEU H H . . . . 20 . HN rr_1r02 1
130 1 . 1 . 1 1 19 19 LEU H H . . . . 19 . HN rr_1r02 1
130 1 . 2 . 1 1 21 21 HIS H H . . . . 21 . HN rr_1r02 1
131 1 . 1 . 1 1 24 24 GLY H H . . . . 24 . HN rr_1r02 1
131 1 . 2 . 1 1 26 26 HIS H H . . . . 26 . HN rr_1r02 1
132 1 . 1 . 1 1 25 25 ASN H H . . . . 25 . HN rr_1r02 1
132 1 . 2 . 1 1 27 27 ALA H H . . . . 27 . HN rr_1r02 1
133 1 . 1 . 1 1 26 26 HIS H H . . . . 26 . HN rr_1r02 1
133 1 . 2 . 1 1 28 28 ALA H H . . . . 28 . HN rr_1r02 1
134 1 . 1 . 1 1 27 27 ALA H H . . . . 27 . HN rr_1r02 1
134 1 . 2 . 1 1 29 29 GLY H H . . . . 29 . HN rr_1r02 1
135 1 . 1 . 1 1 28 28 ALA H H . . . . 28 . HN rr_1r02 1
135 1 . 2 . 1 1 30 30 ILE H H . . . . 30 . HN rr_1r02 1
136 1 . 1 . 1 1 15 15 ARG HA H . . . . 15 . HA rr_1r02 1
136 1 . 2 . 1 1 18 18 GLU H H . . . . 18 . HN rr_1r02 1
137 1 . 1 . 1 1 16 16 LEU HA H . . . . 16 . HA rr_1r02 1
137 1 . 2 . 1 1 19 19 LEU H H . . . . 19 . HN rr_1r02 1
138 1 . 1 . 1 1 17 17 TYR HA H . . . . 17 . HA rr_1r02 1
138 1 . 2 . 1 1 20 20 LEU H H . . . . 20 . HN rr_1r02 1
139 1 . 1 . 1 1 25 25 ASN HA H . . . . 25 . HA rr_1r02 1
139 1 . 2 . 1 1 28 28 ALA H H . . . . 28 . HN rr_1r02 1
140 1 . 1 . 1 1 26 26 HIS HA H . . . . 26 . HA rr_1r02 1
140 1 . 2 . 1 1 29 29 GLY H H . . . . 29 . HN rr_1r02 1
141 1 . 1 . 1 1 28 28 ALA HA H . . . . 28 . HA rr_1r02 1
141 1 . 2 . 1 1 31 31 LEU H H . . . . 31 . HN rr_1r02 1
142 1 . 1 . 1 1 27 27 ALA HA H . . . . 27 . HA rr_1r02 1
142 1 . 2 . 1 1 30 30 ILE H H . . . . 30 . HN rr_1r02 1
143 1 . 1 . 1 1 28 28 ALA HA H . . . . 28 . HA rr_1r02 1
143 1 . 2 . 1 1 32 32 THR H H . . . . 32 . HN rr_1r02 1
144 2 . 1 . 1 1 7 7 CYS HB2 H . . . . 7 . HB* rr_1r02 1
144 2 . 2 . 1 1 8 8 ARG H H . . . . 8 . HN rr_1r02 1
144 3 . 1 . 1 1 7 7 CYS HB3 H . . . . 7 . HB* rr_1r02 1
144 3 . 2 . 1 1 8 8 ARG H H . . . . 8 . HN rr_1r02 1
145 2 . 1 . 1 1 9 9 GLN HB2 H . . . . 9 . HB* rr_1r02 1
145 2 . 2 . 1 1 10 10 LYS H H . . . . 10 . HN rr_1r02 1
145 3 . 1 . 1 1 9 9 GLN HB3 H . . . . 9 . HB* rr_1r02 1
145 3 . 2 . 1 1 10 10 LYS H H . . . . 10 . HN rr_1r02 1
146 2 . 1 . 1 1 12 12 CYS HB2 H . . . . 12 . HB* rr_1r02 1
146 2 . 2 . 1 1 13 13 SER H H . . . . 13 . HN rr_1r02 1
146 3 . 1 . 1 1 12 12 CYS HB3 H . . . . 12 . HB* rr_1r02 1
146 3 . 2 . 1 1 13 13 SER H H . . . . 13 . HN rr_1r02 1
147 2 . 1 . 1 1 16 16 LEU HB2 H . . . . 16 . HB* rr_1r02 1
147 2 . 2 . 1 1 17 17 TYR H H . . . . 17 . HN rr_1r02 1
147 3 . 1 . 1 1 16 16 LEU HB3 H . . . . 16 . HB* rr_1r02 1
147 3 . 2 . 1 1 17 17 TYR H H . . . . 17 . HN rr_1r02 1
148 2 . 1 . 1 1 17 17 TYR HB2 H . . . . 17 . HB* rr_1r02 1
148 2 . 2 . 1 1 18 18 GLU H H . . . . 18 . HN rr_1r02 1
148 3 . 1 . 1 1 17 17 TYR HB3 H . . . . 17 . HB* rr_1r02 1
148 3 . 2 . 1 1 18 18 GLU H H . . . . 18 . HN rr_1r02 1
149 2 . 1 . 1 1 18 18 GLU HB2 H . . . . 18 . HB* rr_1r02 1
149 2 . 2 . 1 1 19 19 LEU H H . . . . 19 . HN rr_1r02 1
149 3 . 1 . 1 1 18 18 GLU HB3 H . . . . 18 . HB* rr_1r02 1
149 3 . 2 . 1 1 19 19 LEU H H . . . . 19 . HN rr_1r02 1
150 2 . 1 . 1 1 19 19 LEU HB2 H . . . . 19 . HB* rr_1r02 1
150 2 . 2 . 1 1 20 20 LEU H H . . . . 20 . HN rr_1r02 1
150 3 . 1 . 1 1 19 19 LEU HB3 H . . . . 19 . HB* rr_1r02 1
150 3 . 2 . 1 1 20 20 LEU H H . . . . 20 . HN rr_1r02 1
151 2 . 1 . 1 1 20 20 LEU HB2 H . . . . 20 . HB* rr_1r02 1
151 2 . 2 . 1 1 21 21 HIS H H . . . . 21 . HN rr_1r02 1
151 3 . 1 . 1 1 20 20 LEU HB3 H . . . . 20 . HB* rr_1r02 1
151 3 . 2 . 1 1 21 21 HIS H H . . . . 21 . HN rr_1r02 1
152 2 . 1 . 1 1 26 26 HIS HB2 H . . . . 26 . HB* rr_1r02 1
152 2 . 2 . 1 1 27 27 ALA H H . . . . 27 . HN rr_1r02 1
152 3 . 1 . 1 1 26 26 HIS HB3 H . . . . 26 . HB* rr_1r02 1
152 3 . 2 . 1 1 27 27 ALA H H . . . . 27 . HN rr_1r02 1
153 1 . 1 . 1 1 28 28 ALA MB H . . . . 28 . HB* rr_1r02 1
153 1 . 2 . 1 1 29 29 GLY H H . . . . 29 . HN rr_1r02 1
154 1 . 1 . 1 1 30 30 ILE HB H . . . . 30 . HB* rr_1r02 1
154 1 . 2 . 1 1 31 31 LEU H H . . . . 31 . HN rr_1r02 1
155 1 . 1 . 1 1 16 16 LEU HG H . . . . 16 . HG rr_1r02 1
155 1 . 2 . 1 1 17 17 TYR H H . . . . 17 . HN rr_1r02 1
156 2 . 1 . 1 1 16 16 LEU MD1 H . . . . 16 . HD* rr_1r02 1
156 2 . 2 . 1 1 17 17 TYR H H . . . . 17 . HN rr_1r02 1
156 3 . 1 . 1 1 16 16 LEU MD2 H . . . . 16 . HD* rr_1r02 1
156 3 . 2 . 1 1 17 17 TYR H H . . . . 17 . HN rr_1r02 1
157 2 . 1 . 1 1 11 11 THR MG H . . . . 11 . HG* rr_1r02 1
157 2 . 2 . 1 1 12 12 CYS H H . . . . 12 . HN rr_1r02 1
157 3 . 1 . 1 1 11 11 THR HG1 H . . . . 11 . HG* rr_1r02 1
157 3 . 2 . 1 1 12 12 CYS H H . . . . 12 . HN rr_1r02 1
158 2 . 1 . 1 1 31 31 LEU MD1 H . . . . 31 . HD* rr_1r02 1
158 2 . 2 . 1 1 32 32 THR H H . . . . 32 . HN rr_1r02 1
158 3 . 1 . 1 1 31 31 LEU MD2 H . . . . 31 . HD* rr_1r02 1
158 3 . 2 . 1 1 32 32 THR H H . . . . 32 . HN rr_1r02 1
159 1 . 1 . 1 1 20 20 LEU HG H . . . . 20 . HG rr_1r02 1
159 1 . 2 . 1 1 21 21 HIS H H . . . . 21 . HN rr_1r02 1
160 2 . 1 . 1 1 14 14 CYS HA H . . . . 14 . HA rr_1r02 1
160 2 . 2 . 1 1 17 17 TYR HB2 H . . . . 17 . HB* rr_1r02 1
160 3 . 1 . 1 1 14 14 CYS HA H . . . . 14 . HA rr_1r02 1
160 3 . 2 . 1 1 17 17 TYR HB3 H . . . . 17 . HB* rr_1r02 1
161 2 . 1 . 1 1 15 15 ARG HA H . . . . 15 . HA rr_1r02 1
161 2 . 2 . 1 1 18 18 GLU HB2 H . . . . 18 . HB* rr_1r02 1
161 3 . 1 . 1 1 15 15 ARG HA H . . . . 15 . HA rr_1r02 1
161 3 . 2 . 1 1 18 18 GLU HB3 H . . . . 18 . HB* rr_1r02 1
162 2 . 1 . 1 1 16 16 LEU HA H . . . . 16 . HA rr_1r02 1
162 2 . 2 . 1 1 19 19 LEU HB2 H . . . . 19 . HB* rr_1r02 1
162 3 . 1 . 1 1 16 16 LEU HA H . . . . 16 . HA rr_1r02 1
162 3 . 2 . 1 1 19 19 LEU HB3 H . . . . 19 . HB* rr_1r02 1
163 2 . 1 . 1 1 17 17 TYR HA H . . . . 17 . HA rr_1r02 1
163 2 . 2 . 1 1 20 20 LEU HB2 H . . . . 20 . HB* rr_1r02 1
163 3 . 1 . 1 1 17 17 TYR HA H . . . . 17 . HA rr_1r02 1
163 3 . 2 . 1 1 20 20 LEU HB3 H . . . . 20 . HB* rr_1r02 1
164 2 . 1 . 1 1 18 18 GLU HA H . . . . 18 . HA rr_1r02 1
164 2 . 2 . 1 1 21 21 HIS HB2 H . . . . 21 . HB* rr_1r02 1
164 3 . 1 . 1 1 18 18 GLU HA H . . . . 18 . HA rr_1r02 1
164 3 . 2 . 1 1 21 21 HIS HB3 H . . . . 21 . HB* rr_1r02 1
165 1 . 1 . 1 1 27 27 ALA HA H . . . . 27 . HA rr_1r02 1
165 1 . 2 . 1 1 30 30 ILE HB H . . . . 30 . HB* rr_1r02 1
166 1 . 1 . 1 1 5 5 ASP HA H . . . . 5 . HA rr_1r02 1
166 1 . 2 . 1 1 6 6 CYS H H . . . . 6 . HN rr_1r02 1
167 1 . 1 . 1 1 6 6 CYS HA H . . . . 6 . HA rr_1r02 1
167 1 . 2 . 1 1 7 7 CYS H H . . . . 7 . HN rr_1r02 1
168 1 . 1 . 1 1 7 7 CYS HA H . . . . 7 . HA rr_1r02 1
168 1 . 2 . 1 1 8 8 ARG H H . . . . 8 . HN rr_1r02 1
169 1 . 1 . 1 1 8 8 ARG HA H . . . . 8 . HA rr_1r02 1
169 1 . 2 . 1 1 9 9 GLN H H . . . . 9 . HN rr_1r02 1
170 1 . 1 . 1 1 9 9 GLN HA H . . . . 9 . HA rr_1r02 1
170 1 . 2 . 1 1 10 10 LYS H H . . . . 10 . HN rr_1r02 1
171 1 . 1 . 1 1 10 10 LYS HA H . . . . 10 . HA rr_1r02 1
171 1 . 2 . 1 1 11 11 THR H H . . . . 11 . HN rr_1r02 1
172 1 . 1 . 1 1 11 11 THR HA H . . . . 11 . HA rr_1r02 1
172 1 . 2 . 1 1 12 12 CYS H H . . . . 12 . HN rr_1r02 1
173 1 . 1 . 1 1 12 12 CYS HA H . . . . 12 . HA rr_1r02 1
173 1 . 2 . 1 1 13 13 SER H H . . . . 13 . HN rr_1r02 1
174 1 . 1 . 1 1 13 13 SER HA H . . . . 13 . HA rr_1r02 1
174 1 . 2 . 1 1 14 14 CYS H H . . . . 14 . HN rr_1r02 1
175 1 . 1 . 1 1 14 14 CYS HA H . . . . 14 . HA rr_1r02 1
175 1 . 2 . 1 1 15 15 ARG H H . . . . 15 . HN rr_1r02 1
176 1 . 1 . 1 1 15 15 ARG HA H . . . . 15 . HA rr_1r02 1
176 1 . 2 . 1 1 16 16 LEU H H . . . . 16 . HN rr_1r02 1
177 1 . 1 . 1 1 16 16 LEU HA H . . . . 16 . HA rr_1r02 1
177 1 . 2 . 1 1 17 17 TYR H H . . . . 17 . HN rr_1r02 1
178 1 . 1 . 1 1 17 17 TYR HA H . . . . 17 . HA rr_1r02 1
178 1 . 2 . 1 1 18 18 GLU H H . . . . 18 . HN rr_1r02 1
179 1 . 1 . 1 1 18 18 GLU HA H . . . . 18 . HA rr_1r02 1
179 1 . 2 . 1 1 19 19 LEU H H . . . . 19 . HN rr_1r02 1
180 1 . 1 . 1 1 19 19 LEU HA H . . . . 19 . HA rr_1r02 1
180 1 . 2 . 1 1 20 20 LEU H H . . . . 20 . HN rr_1r02 1
181 1 . 1 . 1 1 20 20 LEU HA H . . . . 20 . HA rr_1r02 1
181 1 . 2 . 1 1 21 21 HIS H H . . . . 21 . HN rr_1r02 1
182 1 . 1 . 1 1 21 21 HIS HA H . . . . 21 . HA rr_1r02 1
182 1 . 2 . 1 1 22 22 GLY H H . . . . 22 . HN rr_1r02 1
183 2 . 1 . 1 1 22 22 GLY HA2 H . . . . 22 . HA* rr_1r02 1
183 2 . 2 . 1 1 23 23 ALA H H . . . . 23 . HN rr_1r02 1
183 3 . 1 . 1 1 22 22 GLY HA3 H . . . . 22 . HA* rr_1r02 1
183 3 . 2 . 1 1 23 23 ALA H H . . . . 23 . HN rr_1r02 1
184 1 . 1 . 1 1 23 23 ALA HA H . . . . 23 . HA rr_1r02 1
184 1 . 2 . 1 1 24 24 GLY H H . . . . 24 . HN rr_1r02 1
185 2 . 1 . 1 1 24 24 GLY HA2 H . . . . 24 . HA* rr_1r02 1
185 2 . 2 . 1 1 25 25 ASN H H . . . . 25 . HN rr_1r02 1
185 3 . 1 . 1 1 24 24 GLY HA3 H . . . . 24 . HA* rr_1r02 1
185 3 . 2 . 1 1 25 25 ASN H H . . . . 25 . HN rr_1r02 1
186 1 . 1 . 1 1 25 25 ASN HA H . . . . 25 . HA rr_1r02 1
186 1 . 2 . 1 1 26 26 HIS H H . . . . 26 . HN rr_1r02 1
187 1 . 1 . 1 1 26 26 HIS HA H . . . . 26 . HA rr_1r02 1
187 1 . 2 . 1 1 27 27 ALA H H . . . . 27 . HN rr_1r02 1
188 1 . 1 . 1 1 27 27 ALA HA H . . . . 27 . HA rr_1r02 1
188 1 . 2 . 1 1 28 28 ALA H H . . . . 28 . HN rr_1r02 1
189 1 . 1 . 1 1 28 28 ALA HA H . . . . 28 . HA rr_1r02 1
189 1 . 2 . 1 1 29 29 GLY H H . . . . 29 . HN rr_1r02 1
190 2 . 1 . 1 1 29 29 GLY HA2 H . . . . 29 . HA* rr_1r02 1
190 2 . 2 . 1 1 30 30 ILE H H . . . . 30 . HN rr_1r02 1
190 3 . 1 . 1 1 29 29 GLY HA3 H . . . . 29 . HA* rr_1r02 1
190 3 . 2 . 1 1 30 30 ILE H H . . . . 30 . HN rr_1r02 1
191 1 . 1 . 1 1 30 30 ILE HA H . . . . 30 . HA rr_1r02 1
191 1 . 2 . 1 1 31 31 LEU H H . . . . 31 . HN rr_1r02 1
192 1 . 1 . 1 1 31 31 LEU HA H . . . . 31 . HA rr_1r02 1
192 1 . 2 . 1 1 32 32 THR H H . . . . 32 . HN rr_1r02 1
193 1 . 1 . 1 1 32 32 THR HA H . . . . 32 . HA rr_1r02 1
193 1 . 2 . 1 1 33 33 LEU H H . . . . 33 . HN rr_1r02 1
194 1 . 1 . 1 1 6 6 CYS HA H . . . . 6 . HA rr_1r02 1
194 1 . 2 . 1 1 12 12 CYS H H . . . . 12 . HN rr_1r02 1
195 1 . 1 . 1 1 7 7 CYS HA H . . . . 7 . HA rr_1r02 1
195 1 . 2 . 1 1 9 9 GLN H H . . . . 9 . HN rr_1r02 1
196 1 . 1 . 1 1 11 11 THR HA H . . . . 11 . HA rr_1r02 1
196 1 . 2 . 1 1 12 12 CYS HA H . . . . 12 . HA rr_1r02 1
197 2 . 1 . 1 1 24 24 GLY HA2 H . . . . 24 . HA* rr_1r02 1
197 2 . 2 . 1 1 25 25 ASN HA H . . . . 25 . HA rr_1r02 1
197 3 . 1 . 1 1 24 24 GLY HA3 H . . . . 24 . HA* rr_1r02 1
197 3 . 2 . 1 1 25 25 ASN HA H . . . . 25 . HA rr_1r02 1
198 1 . 1 . 1 1 27 27 ALA HA H . . . . 27 . HA rr_1r02 1
198 1 . 2 . 1 1 28 28 ALA HA H . . . . 28 . HA rr_1r02 1
199 2 . 1 . 1 1 28 28 ALA HA H . . . . 28 . HA rr_1r02 1
199 2 . 2 . 1 1 29 29 GLY HA2 H . . . . 29 . HA* rr_1r02 1
199 3 . 1 . 1 1 28 28 ALA HA H . . . . 28 . HA rr_1r02 1
199 3 . 2 . 1 1 29 29 GLY HA3 H . . . . 29 . HA* rr_1r02 1
200 2 . 1 . 1 1 29 29 GLY HA2 H . . . . 29 . HA* rr_1r02 1
200 2 . 2 . 1 1 30 30 ILE HA H . . . . 30 . HA rr_1r02 1
200 3 . 1 . 1 1 29 29 GLY HA3 H . . . . 29 . HA* rr_1r02 1
200 3 . 2 . 1 1 30 30 ILE HA H . . . . 30 . HA rr_1r02 1
201 1 . 1 . 1 1 30 30 ILE HA H . . . . 30 . HA rr_1r02 1
201 1 . 2 . 1 1 31 31 LEU HA H . . . . 31 . HA rr_1r02 1
202 2 . 1 . 1 1 22 22 GLY HA2 H . . . . 22 . HA* rr_1r02 1
202 2 . 2 . 1 1 23 23 ALA HA H . . . . 23 . HA rr_1r02 1
202 3 . 1 . 1 1 22 22 GLY HA3 H . . . . 22 . HA* rr_1r02 1
202 3 . 2 . 1 1 23 23 ALA HA H . . . . 23 . HA rr_1r02 1
203 2 . 1 . 1 1 23 23 ALA HA H . . . . 23 . HA rr_1r02 1
203 2 . 2 . 1 1 24 24 GLY HA2 H . . . . 24 . HA* rr_1r02 1
203 3 . 1 . 1 1 23 23 ALA HA H . . . . 23 . HA rr_1r02 1
203 3 . 2 . 1 1 24 24 GLY HA3 H . . . . 24 . HA* rr_1r02 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 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
1 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
2 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
2 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
2 4 . . . . . . 3.0 1.8 4.3 rr_1r02 1
2 5 . . . . . . 3.0 1.8 4.3 rr_1r02 1
3 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
3 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
3 4 . . . . . . 3.0 1.8 4.3 rr_1r02 1
3 5 . . . . . . 3.0 1.8 4.3 rr_1r02 1
4 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
5 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
5 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
6 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
7 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
7 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
8 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
8 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
9 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
9 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
9 4 . . . . . . 3.0 1.8 4.3 rr_1r02 1
9 5 . . . . . . 3.0 1.8 4.3 rr_1r02 1
10 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
10 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
10 4 . . . . . . 3.0 1.8 4.3 rr_1r02 1
10 5 . . . . . . 3.0 1.8 4.3 rr_1r02 1
11 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
12 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
12 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
13 1 . . . . . . 2.5 1.8 2.7 rr_1r02 1
14 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
14 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
15 1 . . . . . . 2.5 1.8 2.7 rr_1r02 1
16 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
16 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
17 1 . . . . . . 2.5 1.8 2.7 rr_1r02 1
18 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
18 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
19 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
19 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
20 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
20 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
21 1 . . . . . . 2.5 1.8 2.7 rr_1r02 1
22 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
22 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
23 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
23 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
24 1 . . . . . . 2.5 1.8 2.7 rr_1r02 1
25 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
25 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
26 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
26 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
27 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
27 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
28 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
28 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
29 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
30 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
31 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
31 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
32 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
33 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
33 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
34 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
35 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
35 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
36 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
36 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
37 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
38 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
38 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
39 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
40 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
40 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
41 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
41 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
42 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
42 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
43 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
44 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
44 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
45 1 . . . . . . 4.0 1.8 6.0 rr_1r02 1
46 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
46 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
47 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
47 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
48 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
49 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
49 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
50 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
50 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
51 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
52 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
52 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
53 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
53 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
54 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
55 2 . . . . . . 4.0 1.8 5.0 rr_1r02 1
55 3 . . . . . . 4.0 1.8 5.0 rr_1r02 1
56 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
57 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
57 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
58 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
59 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
59 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
60 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
61 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
61 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
62 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
63 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
63 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
64 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
64 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
65 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
65 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
66 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
67 1 . . . . . . 4.0 1.8 6.0 rr_1r02 1
68 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
68 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
69 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
70 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
70 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
71 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
71 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
72 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
73 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
73 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
74 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
74 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
75 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
76 1 . . . . . . 4.0 1.8 6.0 rr_1r02 1
77 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
78 1 . . . . . . 4.0 1.8 6.0 rr_1r02 1
79 1 . . . . . . 4.0 1.8 6.0 rr_1r02 1
80 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
80 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
81 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
82 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
83 1 . . . . . . 4.0 1.8 6.0 rr_1r02 1
84 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
84 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
85 1 . . . . . . 4.0 1.8 6.0 rr_1r02 1
86 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
87 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
87 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
88 1 . . . . . . 4.0 1.8 6.0 rr_1r02 1
89 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
89 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
90 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
91 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
92 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
92 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
93 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
94 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
94 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
95 1 . . . . . . 4.0 1.8 6.0 rr_1r02 1
96 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
97 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
98 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
99 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
100 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
101 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
102 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
103 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
104 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
105 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
106 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
107 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
108 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
109 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
110 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
111 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
112 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
113 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
114 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
115 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
116 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
117 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
118 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
119 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
120 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
121 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
122 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
123 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
124 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
125 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
126 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
127 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
128 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
129 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
130 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
131 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
132 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
133 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
134 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
135 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
136 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
137 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
138 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
139 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
140 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
141 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
142 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
143 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
144 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
144 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
145 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
145 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
146 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
146 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
147 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
147 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
148 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
148 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
149 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
149 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
150 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
150 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
151 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
151 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
152 2 . . . . . . 3.0 1.8 4.3 rr_1r02 1
152 3 . . . . . . 3.0 1.8 4.3 rr_1r02 1
153 1 . . . . . . 3.0 1.8 4.3 rr_1r02 1
154 1 . . . . . . 4.0 1.8 6.0 rr_1r02 1
155 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
156 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
156 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
157 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
157 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
158 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
158 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
159 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
160 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
160 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
161 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
161 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
162 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
162 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
163 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
163 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
164 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
164 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
165 1 . . . . . . 4.0 1.8 6.0 rr_1r02 1
166 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
167 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
168 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
169 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
170 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
171 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
172 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
173 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
174 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
175 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
176 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
177 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
178 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
179 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
180 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
181 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
182 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
183 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
183 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
184 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
185 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
185 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
186 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
187 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
188 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
189 1 . . . . . . 3.0 1.8 4.3 rr_1r02 1
190 2 . . . . . . 4.0 1.8 5.0 rr_1r02 1
190 3 . . . . . . 4.0 1.8 5.0 rr_1r02 1
191 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
192 1 . . . . . . 3.0 1.8 3.3 rr_1r02 1
193 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
194 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
195 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
196 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
197 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
197 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
198 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
199 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
199 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
200 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
200 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
201 1 . . . . . . 4.0 1.8 5.0 rr_1r02 1
202 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
202 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
203 2 . . . . . . 4.0 1.8 6.0 rr_1r02 1
203 3 . . . . . . 4.0 1.8 6.0 rr_1r02 1
stop_
loop_
_Dist_constraint_parse_err.ID
_Dist_constraint_parse_err.Content
_Dist_constraint_parse_err.Begin_line
_Dist_constraint_parse_err.Begin_column
_Dist_constraint_parse_err.End_line
_Dist_constraint_parse_err.End_column
_Dist_constraint_parse_err.Entry_ID
_Dist_constraint_parse_err.Distance_constraint_list_ID
1 "assign (resid 25 and namd HA) (resid 28 and name HB*) 4.0 2.2 2.0" 173 1 173 68 rr_1r02 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 table
intra noe (Orexin A 5C H2O)
;
2 1 3 30 rr_1r02 1
2
;inter noe
NN noe
;
99 1 100 9 rr_1r02 1
3 BN(i,i+1) 149 1 149 11 rr_1r02 1
4 "sequetial (i-j=1)" 161 1 161 19 rr_1r02 1
5 AB(i,i+3) 167 1 167 11 rr_1r02 1
6 "a an assign" 175 1 175 15 rr_1r02 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 4 198 1 "Not handling restraint 198, item 1, resonance(s) ' .29.HA' (nmrStar names) not linked" rr_1r02 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_3_1
_Distance_constraint_list.Entry_ID rr_1r02
_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_1r02 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_1r02 2
2 1 . . . rr_1r02 2
3 1 . . . rr_1r02 2
4 1 . . . rr_1r02 2
5 1 . . . rr_1r02 2
6 1 . . . rr_1r02 2
7 1 . . . rr_1r02 2
8 1 . . . rr_1r02 2
9 1 . . . rr_1r02 2
10 1 . . . rr_1r02 2
11 1 . . . rr_1r02 2
12 1 . . . rr_1r02 2
13 1 . . . rr_1r02 2
14 1 . . . rr_1r02 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 6 6 CYS O O . . . . 6 . O rr_1r02 2
1 1 . 2 . 1 1 10 10 LYS N N . . . . 10 . N rr_1r02 2
2 1 . 1 . 1 1 13 13 SER O O . . . . 13 . O rr_1r02 2
2 1 . 2 . 1 1 17 17 TYR N N . . . . 17 . N rr_1r02 2
3 1 . 1 . 1 1 14 14 CYS O O . . . . 14 . O rr_1r02 2
3 1 . 2 . 1 1 18 18 GLU N N . . . . 18 . N rr_1r02 2
4 1 . 1 . 1 1 15 15 ARG O O . . . . 15 . O rr_1r02 2
4 1 . 2 . 1 1 19 19 LEU N N . . . . 19 . N rr_1r02 2
5 1 . 1 . 1 1 16 16 LEU O O . . . . 16 . O rr_1r02 2
5 1 . 2 . 1 1 20 20 LEU N N . . . . 20 . N rr_1r02 2
6 1 . 1 . 1 1 17 17 TYR O O . . . . 17 . O rr_1r02 2
6 1 . 2 . 1 1 21 21 HIS N N . . . . 21 . N rr_1r02 2
7 1 . 1 . 1 1 28 28 ALA O O . . . . 28 . O rr_1r02 2
7 1 . 2 . 1 1 32 32 THR N N . . . . 32 . N rr_1r02 2
8 1 . 1 . 1 1 6 6 CYS O O . . . . 6 . O rr_1r02 2
8 1 . 2 . 1 1 10 10 LYS H H . . . . 10 . HN rr_1r02 2
9 1 . 1 . 1 1 13 13 SER O O . . . . 13 . O rr_1r02 2
9 1 . 2 . 1 1 17 17 TYR H H . . . . 17 . HN rr_1r02 2
10 1 . 1 . 1 1 14 14 CYS O O . . . . 14 . O rr_1r02 2
10 1 . 2 . 1 1 18 18 GLU H H . . . . 18 . HN rr_1r02 2
11 1 . 1 . 1 1 15 15 ARG O O . . . . 15 . O rr_1r02 2
11 1 . 2 . 1 1 19 19 LEU H H . . . . 19 . HN rr_1r02 2
12 1 . 1 . 1 1 16 16 LEU O O . . . . 16 . O rr_1r02 2
12 1 . 2 . 1 1 20 20 LEU H H . . . . 20 . HN rr_1r02 2
13 1 . 1 . 1 1 17 17 TYR O O . . . . 17 . O rr_1r02 2
13 1 . 2 . 1 1 21 21 HIS H H . . . . 21 . HN rr_1r02 2
14 1 . 1 . 1 1 28 28 ALA O O . . . . 28 . O rr_1r02 2
14 1 . 2 . 1 1 32 32 THR H H . . . . 32 . HN rr_1r02 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 . . . . . . 3.0 2.3 3.5 rr_1r02 2
2 1 . . . . . . 3.0 2.3 3.5 rr_1r02 2
3 1 . . . . . . 3.0 2.3 3.5 rr_1r02 2
4 1 . . . . . . 3.0 2.3 3.5 rr_1r02 2
5 1 . . . . . . 3.0 2.3 3.5 rr_1r02 2
6 1 . . . . . . 3.0 2.3 3.5 rr_1r02 2
7 1 . . . . . . 3.0 2.3 3.5 rr_1r02 2
8 1 . . . . . . 2.0 1.3 2.5 rr_1r02 2
9 1 . . . . . . 2.0 1.3 2.5 rr_1r02 2
10 1 . . . . . . 2.0 1.3 2.5 rr_1r02 2
11 1 . . . . . . 2.0 1.3 2.5 rr_1r02 2
12 1 . . . . . . 2.0 1.3 2.5 rr_1r02 2
13 1 . . . . . . 2.0 1.3 2.5 rr_1r02 2
14 1 . . . . . . 2.0 1.3 2.5 rr_1r02 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 "H-bond constraint" 2 1 2 20 rr_1r02 2
stop_
save_
save_CNS/XPLOR_dihedral_2
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_2
_Torsion_angle_constraint_list.Entry_ID rr_1r02
_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 2
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_1r02 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 4 4 PRO C C . . 1 1 5 5 ASP N N . . 1 1 5 5 ASP CA C . . 1 1 5 5 ASP C C . -100.0 -10.0 . . . A . 4 PRO C . . A . 5 ASP N . . A . 5 ASP CA . . A . 5 ASP C . . . 4 . C . . . . . 5 . N . . . . . 5 . CA . . . . . 5 . C . . rr_1r02 1
2 . . 1 1 5 5 ASP C C . . 1 1 6 6 CYS N N . . 1 1 6 6 CYS CA C . . 1 1 6 6 CYS C C . -100.0 -10.0 . . . A . 5 ASP C . . A . 6 CYS N . . A . 6 CYS CA . . A . 6 CYS C . . . 5 . C . . . . . 6 . N . . . . . 6 . CA . . . . . 6 . C . . rr_1r02 1
3 . . 1 1 9 9 GLN C C . . 1 1 10 10 LYS N N . . 1 1 10 10 LYS CA C . . 1 1 10 10 LYS C C . -100.0 -10.0 . . . A . 9 GLN C . . A . 10 LYS N . . A . 10 LYS CA . . A . 10 LYS C . . . 9 . C . . . . . 10 . N . . . . . 10 . CA . . . . . 10 . C . . rr_1r02 1
4 . . 1 1 13 13 SER C C . . 1 1 14 14 CYS N N . . 1 1 14 14 CYS CA C . . 1 1 14 14 CYS C C . -100.0 -10.0 . . . A . 13 SER C . . A . 14 CYS N . . A . 14 CYS CA . . A . 14 CYS C . . . 13 . C . . . . . 14 . N . . . . . 14 . CA . . . . . 14 . C . . rr_1r02 1
5 . . 1 1 14 14 CYS C C . . 1 1 15 15 ARG N N . . 1 1 15 15 ARG CA C . . 1 1 15 15 ARG C C . -100.0 -10.0 . . . A . 14 CYS C . . A . 15 ARG N . . A . 15 ARG CA . . A . 15 ARG C . . . 14 . C . . . . . 15 . N . . . . . 15 . CA . . . . . 15 . C . . rr_1r02 1
6 . . 1 1 15 15 ARG C C . . 1 1 16 16 LEU N N . . 1 1 16 16 LEU CA C . . 1 1 16 16 LEU C C . -100.0 -10.0 . . . A . 15 ARG C . . A . 16 LEU N . . A . 16 LEU CA . . A . 16 LEU C . . . 15 . C . . . . . 16 . N . . . . . 16 . CA . . . . . 16 . C . . rr_1r02 1
7 . . 1 1 16 16 LEU C C . . 1 1 17 17 TYR N N . . 1 1 17 17 TYR CA C . . 1 1 17 17 TYR C C . -100.0 -10.0 . . . A . 16 LEU C . . A . 17 TYR N . . A . 17 TYR CA . . A . 17 TYR C . . . 16 . C . . . . . 17 . N . . . . . 17 . CA . . . . . 17 . C . . rr_1r02 1
8 . . 1 1 17 17 TYR C C . . 1 1 18 18 GLU N N . . 1 1 18 18 GLU CA C . . 1 1 18 18 GLU C C . -100.0 -10.0 . . . A . 17 TYR C . . A . 18 GLU N . . A . 18 GLU CA . . A . 18 GLU C . . . 17 . C . . . . . 18 . N . . . . . 18 . CA . . . . . 18 . C . . rr_1r02 1
9 . . 1 1 18 18 GLU C C . . 1 1 19 19 LEU N N . . 1 1 19 19 LEU CA C . . 1 1 19 19 LEU C C . -100.0 -10.0 . . . A . 18 GLU C . . A . 19 LEU N . . A . 19 LEU CA . . A . 19 LEU C . . . 18 . C . . . . . 19 . N . . . . . 19 . CA . . . . . 19 . C . . rr_1r02 1
10 . . 1 1 19 19 LEU C C . . 1 1 20 20 LEU N N . . 1 1 20 20 LEU CA C . . 1 1 20 20 LEU C C . -100.0 -10.0 . . . A . 19 LEU C . . A . 20 LEU N . . A . 20 LEU CA . . A . 20 LEU C . . . 19 . C . . . . . 20 . N . . . . . 20 . CA . . . . . 20 . C . . rr_1r02 1
11 . . 1 1 20 20 LEU C C . . 1 1 21 21 HIS N N . . 1 1 21 21 HIS CA C . . 1 1 21 21 HIS C C . -100.0 -10.0 . . . A . 20 LEU C . . A . 21 HIS N . . A . 21 HIS CA . . A . 21 HIS C . . . 20 . C . . . . . 21 . N . . . . . 21 . CA . . . . . 21 . C . . rr_1r02 1
12 . . 1 1 23 23 ALA C C . . 1 1 24 24 GLY N N . . 1 1 24 24 GLY CA C . . 1 1 24 24 GLY C C . -100.0 -10.0 . . . A . 23 ALA C . . A . 24 GLY N . . A . 24 GLY CA . . A . 24 GLY C . . . 23 . C . . . . . 24 . N . . . . . 24 . CA . . . . . 24 . C . . rr_1r02 1
13 . . 1 1 24 24 GLY C C . . 1 1 25 25 ASN N N . . 1 1 25 25 ASN CA C . . 1 1 25 25 ASN C C . -100.0 -10.0 . . . A . 24 GLY C . . A . 25 ASN N . . A . 25 ASN CA . . A . 25 ASN C . . . 24 . C . . . . . 25 . N . . . . . 25 . CA . . . . . 25 . C . . rr_1r02 1
14 . . 1 1 25 25 ASN C C . . 1 1 26 26 HIS N N . . 1 1 26 26 HIS CA C . . 1 1 26 26 HIS C C . -100.0 -10.0 . . . A . 25 ASN C . . A . 26 HIS N . . A . 26 HIS CA . . A . 26 HIS C . . . 25 . C . . . . . 26 . N . . . . . 26 . CA . . . . . 26 . C . . rr_1r02 1
15 . . 1 1 26 26 HIS C C . . 1 1 27 27 ALA N N . . 1 1 27 27 ALA CA C . . 1 1 27 27 ALA C C . -100.0 -10.0 . . . A . 26 HIS C . . A . 27 ALA N . . A . 27 ALA CA . . A . 27 ALA C . . . 26 . C . . . . . 27 . N . . . . . 27 . CA . . . . . 27 . C . . rr_1r02 1
16 . . 1 1 27 27 ALA C C . . 1 1 28 28 ALA N N . . 1 1 28 28 ALA CA C . . 1 1 28 28 ALA C C . -100.0 -10.0 . . . A . 27 ALA C . . A . 28 ALA N . . A . 28 ALA CA . . A . 28 ALA C . . . 27 . C . . . . . 28 . N . . . . . 28 . CA . . . . . 28 . C . . rr_1r02 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 "orexin A dihed table" 2 1 2 23 rr_1r02 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_1r02
_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 NEUROPEPTIDE 19-SEP-03 1R02 *TITLE SOLUTION STRUCTURE OF HUMAN OREXIN-A:REGULATOR OF APPETITE *TITLE 2 AND WAKEFULNESS *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: OREXIN-A; *COMPND 3 CHAIN: A; *COMPND 4 SYNONYM: HYPOCRETIN-1; *COMPND 5 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 OTHER_DETAILS: SYNTHETIC PEPTIDE IS NATURALLY FOUND IN *SOURCE 4 HOMO SAPIENS *KEYWDS TURN, HELIX-LOOP-HELIX *EXPDTA NMR *AUTHOR H.-Y.KIM, E.HONG, J.-I.KIM, W.LEE *REVDAT 1 19-SEP-04 1R02 0"
save_
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